Browse entries in the PDBbind-CN Database
HEADER 4LVT_COMPLEX COMPND 4LVT_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 24 TYR ASP ASN ARG GLU ILE VAL MET LYS TYR ILE HIS TYR SEQRES 2 A 24 LYS LEU SER GLN ARG GLY TYR GLU TRP ASP ALA SEQRES 1 A 115 SER GLU VAL VAL HIS LEU THR LEU ARG GLN ALA GLY ASP SEQRES 2 A 115 ASP PHE SER ARG ARG TYR ARG ARG ASP PHE ALA GLU MET SEQRES 3 A 115 SER SER GLN LEU HIS LEU THR PRO PHE THR ALA ARG GLY SEQRES 4 A 115 ARG PHE ALA THR VAL VAL GLU GLU LEU PHE ARG ASP GLY SEQRES 5 A 115 VAL ASN TRP GLY ARG ILE VAL ALA PHE PHE GLU PHE GLY SEQRES 6 A 115 GLY VAL MET CYS VAL GLU SER VAL ASN ARG GLU MET SER SEQRES 7 A 115 PRO LEU VAL ASP ASN ILE ALA LEU TRP MET THR GLU TYR SEQRES 8 A 115 LEU ASN ARG HIS LEU HIS THR TRP ILE GLN ASP ASN GLY SEQRES 9 A 115 GLY TRP ASP ALA PHE VAL GLU LEU TYR GLY PRO HET UNN A 231 122 ATOM 1 N TYR A 7 -7.874 -11.318 3.066 1.00 42.64 N ATOM 2 CA TYR A 7 -6.787 -11.241 4.042 1.00 40.98 C ATOM 3 C TYR A 7 -6.842 -9.888 4.741 1.00 42.01 C ATOM 4 O TYR A 7 -7.153 -8.871 4.111 1.00 41.44 O ATOM 5 CB TYR A 7 -5.437 -11.425 3.355 1.00 41.43 C ATOM 6 CG TYR A 7 -5.206 -12.822 2.810 1.00 42.30 C ATOM 7 CD1 TYR A 7 -5.274 -13.086 1.444 1.00 42.79 C ATOM 8 CD2 TYR A 7 -4.930 -13.880 3.666 1.00 44.57 C ATOM 9 CE1 TYR A 7 -5.061 -14.365 0.942 1.00 41.95 C ATOM 10 CE2 TYR A 7 -4.703 -15.170 3.174 1.00 45.79 C ATOM 11 CZ TYR A 7 -4.774 -15.400 1.813 1.00 53.19 C ATOM 12 OH TYR A 7 -4.570 -16.672 1.332 1.00 56.89 O ATOM 13 HA TYR A 7 -6.905 -12.038 4.776 1.00 0.00 H ATOM 14 HB3 TYR A 7 -4.652 -11.205 4.078 1.00 0.00 H ATOM 15 HB2 TYR A 7 -5.375 -10.719 2.527 1.00 0.00 H ATOM 16 HD2 TYR A 7 -4.889 -13.702 4.741 1.00 0.00 H ATOM 17 HE2 TYR A 7 -4.472 -15.987 3.858 1.00 0.00 H ATOM 18 HE1 TYR A 7 -5.120 -14.551 -0.130 1.00 0.00 H ATOM 19 HD1 TYR A 7 -5.499 -12.273 0.754 1.00 0.00 H ATOM 20 HH TYR A 7 -4.654 -16.668 0.346 1.00 0.00 H ATOM 21 HN3 TYR A 7 -7.764 -10.557 2.366 1.00 0.00 H ATOM 22 HN2 TYR A 7 -8.786 -11.212 3.555 1.00 0.00 H ATOM 23 HN1 TYR A 7 -7.842 -12.240 2.585 1.00 0.00 H ATOM 24 N ASP A 8 -6.538 -9.879 6.040 1.00 35.06 N ATOM 25 CA ASP A 8 -6.577 -8.651 6.831 1.00 32.55 C ATOM 26 C ASP A 8 -5.414 -7.704 6.516 1.00 31.75 C ATOM 27 O ASP A 8 -4.274 -7.989 6.845 1.00 29.23 O ATOM 28 CB ASP A 8 -6.585 -8.996 8.319 1.00 35.03 C ATOM 29 CG ASP A 8 -6.694 -7.763 9.206 1.00 50.60 C ATOM 30 OD1 ASP A 8 -7.522 -6.881 8.911 1.00 55.39 O ATOM 31 OD2 ASP A 8 -5.938 -7.665 10.189 1.00 56.78 O ATOM 32 HA ASP A 8 -7.493 -8.125 6.564 1.00 0.00 H ATOM 33 HB2 ASP A 8 -7.434 -9.648 8.522 1.00 0.00 H ATOM 34 HB3 ASP A 8 -5.660 -9.520 8.561 1.00 0.00 H ATOM 35 H ASP A 8 -6.266 -10.770 6.502 1.00 0.00 H ATOM 36 N ASN A 9 -5.705 -6.577 5.878 1.00 28.03 N ATOM 37 CA ASN A 9 -4.660 -5.616 5.517 1.00 26.57 C ATOM 38 C ASN A 9 -3.921 -5.060 6.718 1.00 29.90 C ATOM 39 O ASN A 9 -2.721 -4.821 6.659 1.00 30.51 O ATOM 40 CB ASN A 9 -5.235 -4.483 4.686 1.00 25.37 C ATOM 41 CG ASN A 9 -5.656 -4.944 3.315 1.00 41.33 C ATOM 42 OD1 ASN A 9 -5.016 -5.814 2.720 1.00 33.50 O ATOM 43 ND2 ASN A 9 -6.761 -4.408 2.823 1.00 36.70 N ATOM 44 HA ASN A 9 -3.930 -6.168 4.924 1.00 0.00 H ATOM 45 HB2 ASN A 9 -6.104 -4.074 5.202 1.00 0.00 H ATOM 46 HB3 ASN A 9 -4.478 -3.706 4.579 1.00 0.00 H ATOM 47 HD22 ASN A 9 -7.268 -3.676 3.361 1.00 0.00 H ATOM 48 HD21 ASN A 9 -7.122 -4.718 1.898 1.00 0.00 H ATOM 49 H ASN A 9 -6.694 -6.372 5.630 1.00 0.00 H ATOM 50 N ARG A 10 -4.627 -4.869 7.825 1.00 24.83 N ATOM 51 CA ARG A 10 -3.975 -4.358 9.024 1.00 23.71 C ATOM 52 C ARG A 10 -2.854 -5.271 9.508 1.00 23.66 C ATOM 53 O ARG A 10 -1.762 -4.800 9.832 1.00 22.47 O ATOM 54 CB ARG A 10 -4.983 -4.064 10.133 1.00 25.26 C ATOM 55 CG ARG A 10 -4.315 -3.790 11.466 1.00 38.63 C ATOM 56 CD ARG A 10 -5.311 -3.817 12.619 1.00 55.03 C ATOM 57 NE ARG A 10 -5.009 -2.779 13.594 1.00 70.11 N ATOM 58 CZ ARG A 10 -4.345 -2.986 14.723 1.00 90.52 C ATOM 59 NH1 ARG A 10 -3.922 -4.206 15.031 1.00 78.02 N ATOM 60 NH2 ARG A 10 -4.112 -1.973 15.546 1.00 83.93 N ATOM 61 HA ARG A 10 -3.510 -3.412 8.748 1.00 0.00 H ATOM 62 HB2 ARG A 10 -5.570 -3.190 9.850 1.00 0.00 H ATOM 63 HB3 ARG A 10 -5.643 -4.924 10.243 1.00 0.00 H ATOM 64 HG2 ARG A 10 -3.553 -4.549 11.641 1.00 0.00 H ATOM 65 HG3 ARG A 10 -3.845 -2.807 11.429 1.00 0.00 H ATOM 66 HD2 ARG A 10 -5.264 -4.790 13.108 1.00 0.00 H ATOM 67 HD3 ARG A 10 -6.315 -3.657 12.227 1.00 0.00 H ATOM 68 HE ARG A 10 -5.335 -1.812 13.392 1.00 0.00 H ATOM 69 HH12 ARG A 10 -3.401 -4.368 15.917 1.00 0.00 H ATOM 70 HH11 ARG A 10 -4.111 -5.000 14.387 1.00 0.00 H ATOM 71 HH22 ARG A 10 -3.592 -2.132 16.432 1.00 0.00 H ATOM 72 HH21 ARG A 10 -4.450 -1.019 15.305 1.00 0.00 H ATOM 73 H ARG A 10 -5.645 -5.084 7.837 1.00 0.00 H ATOM 74 N GLU A 11 -3.097 -6.583 9.512 1.00 18.35 N ATOM 75 CA GLU A 11 -2.063 -7.545 9.892 1.00 17.87 C ATOM 76 C GLU A 11 -0.920 -7.564 8.870 1.00 17.59 C ATOM 77 O GLU A 11 0.239 -7.772 9.222 1.00 16.92 O ATOM 78 CB GLU A 11 -2.657 -8.958 10.010 1.00 20.34 C ATOM 79 CG GLU A 11 -1.745 -9.957 10.673 1.00 37.33 C ATOM 80 CD GLU A 11 -1.750 -9.841 12.194 1.00 64.77 C ATOM 81 OE1 GLU A 11 -2.386 -8.908 12.732 1.00 51.17 O ATOM 82 OE2 GLU A 11 -1.079 -10.663 12.850 1.00 69.38 O ATOM 83 HA GLU A 11 -1.667 -7.234 10.859 1.00 0.00 H ATOM 84 HB2 GLU A 11 -3.577 -8.895 10.592 1.00 0.00 H ATOM 85 HB3 GLU A 11 -2.887 -9.317 9.007 1.00 0.00 H ATOM 86 HG2 GLU A 11 -2.069 -10.961 10.399 1.00 0.00 H ATOM 87 HG3 GLU A 11 -0.729 -9.794 10.314 1.00 0.00 H ATOM 88 H GLU A 11 -4.040 -6.928 9.240 1.00 0.00 H ATOM 89 N ILE A 12 -1.241 -7.359 7.600 1.00 12.85 N ATOM 90 CA ILE A 12 -0.202 -7.380 6.571 1.00 13.41 C ATOM 91 C ILE A 12 0.736 -6.179 6.799 1.00 17.63 C ATOM 92 O ILE A 12 1.956 -6.305 6.743 1.00 18.98 O ATOM 93 CB ILE A 12 -0.813 -7.397 5.131 1.00 16.85 C ATOM 94 CG1 ILE A 12 -1.346 -8.797 4.788 1.00 16.85 C ATOM 95 CG2 ILE A 12 0.262 -7.047 4.070 1.00 16.04 C ATOM 96 CD1 ILE A 12 -2.321 -8.801 3.636 1.00 23.60 C ATOM 97 HA ILE A 12 0.377 -8.300 6.652 1.00 0.00 H ATOM 98 HB ILE A 12 -1.617 -6.661 5.117 1.00 0.00 H ATOM 99 HG12 ILE A 12 -0.501 -9.435 4.528 1.00 0.00 H ATOM 100 HG13 ILE A 12 -1.848 -9.201 5.667 1.00 0.00 H ATOM 101 HD11 ILE A 12 -3.178 -8.175 3.885 1.00 0.00 H ATOM 102 HD12 ILE A 12 -1.830 -8.409 2.745 1.00 0.00 H ATOM 103 HD13 ILE A 12 -2.656 -9.821 3.449 1.00 0.00 H ATOM 104 HG21 ILE A 12 0.659 -6.052 4.271 1.00 0.00 H ATOM 105 HG22 ILE A 12 1.069 -7.778 4.118 1.00 0.00 H ATOM 106 HG23 ILE A 12 -0.189 -7.066 3.078 1.00 0.00 H ATOM 107 H ILE A 12 -2.231 -7.183 7.336 1.00 0.00 H ATOM 108 N VAL A 13 0.162 -5.019 7.078 1.00 15.30 N ATOM 109 CA VAL A 13 0.956 -3.817 7.376 1.00 13.71 C ATOM 110 C VAL A 13 1.828 -4.027 8.626 1.00 19.67 C ATOM 111 O VAL A 13 3.056 -3.788 8.608 1.00 17.45 O ATOM 112 CB VAL A 13 0.033 -2.559 7.519 1.00 16.33 C ATOM 113 CG1 VAL A 13 0.822 -1.363 8.080 1.00 16.14 C ATOM 114 CG2 VAL A 13 -0.578 -2.189 6.158 1.00 15.59 C ATOM 115 HA VAL A 13 1.628 -3.637 6.537 1.00 0.00 H ATOM 116 HB VAL A 13 -0.769 -2.804 8.216 1.00 0.00 H ATOM 117 HG11 VAL A 13 1.221 -1.620 9.061 1.00 0.00 H ATOM 118 HG12 VAL A 13 1.643 -1.122 7.405 1.00 0.00 H ATOM 119 HG13 VAL A 13 0.159 -0.502 8.170 1.00 0.00 H ATOM 120 HG21 VAL A 13 0.221 -1.967 5.451 1.00 0.00 H ATOM 121 HG22 VAL A 13 -1.170 -3.026 5.788 1.00 0.00 H ATOM 122 HG23 VAL A 13 -1.217 -1.313 6.274 1.00 0.00 H ATOM 123 H VAL A 13 -0.876 -4.956 7.087 1.00 0.00 H ATOM 124 N MET A 14 1.201 -4.517 9.691 1.00 17.77 N ATOM 125 CA MET A 14 1.886 -4.706 10.969 1.00 21.09 C ATOM 126 C MET A 14 3.040 -5.685 10.865 1.00 21.74 C ATOM 127 O MET A 14 4.124 -5.415 11.369 1.00 19.85 O ATOM 128 CB MET A 14 0.897 -5.207 12.042 1.00 26.49 C ATOM 129 CG MET A 14 -0.128 -4.171 12.519 1.00 34.73 C ATOM 130 SD MET A 14 -1.286 -4.810 13.819 1.00 44.63 S ATOM 131 CE MET A 14 -0.366 -6.283 14.482 1.00 42.02 C ATOM 132 HA MET A 14 2.289 -3.734 11.255 1.00 0.00 H ATOM 133 HB2 MET A 14 0.352 -6.056 11.629 1.00 0.00 H ATOM 134 HB3 MET A 14 1.474 -5.534 12.907 1.00 0.00 H ATOM 135 HG2 MET A 14 -0.718 -3.850 11.660 1.00 0.00 H ATOM 136 HG3 MET A 14 0.411 -3.317 12.928 1.00 0.00 H ATOM 137 HE1 MET A 14 -0.197 -6.997 13.676 1.00 0.00 H ATOM 138 HE2 MET A 14 0.592 -5.959 14.889 1.00 0.00 H ATOM 139 HE3 MET A 14 -0.955 -6.754 15.269 1.00 0.00 H ATOM 140 H MET A 14 0.196 -4.773 9.613 1.00 0.00 H ATOM 141 N LYS A 15 2.815 -6.830 10.223 1.00 16.94 N ATOM 142 CA LYS A 15 3.885 -7.825 10.113 1.00 17.60 C ATOM 143 C LYS A 15 5.009 -7.290 9.271 1.00 18.69 C ATOM 144 O LYS A 15 6.173 -7.517 9.565 1.00 18.01 O ATOM 145 CB LYS A 15 3.378 -9.150 9.522 1.00 21.88 C ATOM 146 CG LYS A 15 2.494 -9.935 10.490 1.00 41.29 C ATOM 147 CD LYS A 15 2.594 -11.434 10.243 1.00 58.29 C ATOM 148 CE LYS A 15 3.708 -12.060 11.067 1.00 74.89 C ATOM 149 NZ LYS A 15 3.426 -13.489 11.393 1.00 84.40 N ATOM 150 HA LYS A 15 4.247 -8.025 11.121 1.00 0.00 H ATOM 151 HB2 LYS A 15 2.801 -8.932 8.623 1.00 0.00 H ATOM 152 HB3 LYS A 15 4.238 -9.766 9.260 1.00 0.00 H ATOM 153 HG2 LYS A 15 2.810 -9.722 11.511 1.00 0.00 H ATOM 154 HG3 LYS A 15 1.458 -9.622 10.358 1.00 0.00 H ATOM 155 HD2 LYS A 15 1.647 -11.902 10.513 1.00 0.00 H ATOM 156 HD3 LYS A 15 2.795 -11.607 9.186 1.00 0.00 H ATOM 157 HE2 LYS A 15 3.815 -11.501 11.997 1.00 0.00 H ATOM 158 HE3 LYS A 15 4.638 -12.005 10.502 1.00 0.00 H ATOM 159 HZ1 LYS A 15 2.543 -13.551 11.939 1.00 0.00 H ATOM 160 HZ2 LYS A 15 3.329 -14.032 10.511 1.00 0.00 H ATOM 161 HZ3 LYS A 15 4.210 -13.876 11.955 1.00 0.00 H ATOM 162 H LYS A 15 1.883 -7.017 9.801 1.00 0.00 H ATOM 163 N TYR A 16 4.658 -6.564 8.215 1.00 15.38 N ATOM 164 CA TYR A 16 5.667 -6.025 7.318 1.00 14.30 C ATOM 165 C TYR A 16 6.563 -4.990 8.017 1.00 18.33 C ATOM 166 O TYR A 16 7.785 -5.012 7.893 1.00 17.94 O ATOM 167 CB TYR A 16 4.991 -5.402 6.095 1.00 14.30 C ATOM 168 CG TYR A 16 5.946 -4.665 5.201 1.00 17.30 C ATOM 169 CD1 TYR A 16 6.614 -5.317 4.172 1.00 20.29 C ATOM 170 CD2 TYR A 16 6.178 -3.306 5.388 1.00 18.97 C ATOM 171 CE1 TYR A 16 7.470 -4.636 3.356 1.00 19.45 C ATOM 172 CE2 TYR A 16 7.047 -2.629 4.605 1.00 19.82 C ATOM 173 CZ TYR A 16 7.703 -3.293 3.604 1.00 24.91 C ATOM 174 OH TYR A 16 8.581 -2.571 2.850 1.00 28.20 O ATOM 175 HA TYR A 16 6.308 -6.848 7.002 1.00 0.00 H ATOM 176 HB3 TYR A 16 4.229 -4.703 6.439 1.00 0.00 H ATOM 177 HB2 TYR A 16 4.519 -6.197 5.517 1.00 0.00 H ATOM 178 HD2 TYR A 16 5.649 -2.777 6.181 1.00 0.00 H ATOM 179 HE2 TYR A 16 7.223 -1.566 4.769 1.00 0.00 H ATOM 180 HE1 TYR A 16 7.962 -5.140 2.524 1.00 0.00 H ATOM 181 HD1 TYR A 16 6.453 -6.383 4.015 1.00 0.00 H ATOM 182 HH TYR A 16 8.988 -3.159 2.165 1.00 0.00 H ATOM 183 H TYR A 16 3.652 -6.380 8.028 1.00 0.00 H ATOM 184 N ILE A 17 5.942 -4.061 8.719 1.00 15.79 N ATOM 185 CA ILE A 17 6.690 -2.983 9.397 1.00 16.35 C ATOM 186 C ILE A 17 7.481 -3.588 10.530 1.00 22.07 C ATOM 187 O ILE A 17 8.664 -3.285 10.717 1.00 20.59 O ATOM 188 CB ILE A 17 5.739 -1.906 9.930 1.00 19.44 C ATOM 189 CG1 ILE A 17 5.090 -1.148 8.766 1.00 20.27 C ATOM 190 CG2 ILE A 17 6.498 -0.944 10.900 1.00 19.78 C ATOM 191 CD1 ILE A 17 4.054 -0.143 9.247 1.00 29.79 C ATOM 192 HA ILE A 17 7.362 -2.506 8.684 1.00 0.00 H ATOM 193 HB ILE A 17 4.940 -2.382 10.499 1.00 0.00 H ATOM 194 HG12 ILE A 17 5.866 -0.617 8.215 1.00 0.00 H ATOM 195 HG13 ILE A 17 4.604 -1.866 8.106 1.00 0.00 H ATOM 196 HD11 ILE A 17 3.269 -0.666 9.793 1.00 0.00 H ATOM 197 HD12 ILE A 17 4.532 0.584 9.903 1.00 0.00 H ATOM 198 HD13 ILE A 17 3.621 0.370 8.388 1.00 0.00 H ATOM 199 HG21 ILE A 17 6.896 -1.515 11.739 1.00 0.00 H ATOM 200 HG22 ILE A 17 7.317 -0.463 10.365 1.00 0.00 H ATOM 201 HG23 ILE A 17 5.809 -0.185 11.270 1.00 0.00 H ATOM 202 H ILE A 17 4.905 -4.089 8.796 1.00 0.00 H ATOM 203 N HIS A 18 6.825 -4.460 11.284 1.00 20.92 N ATOM 204 CA HIS A 18 7.500 -5.086 12.407 1.00 22.69 C ATOM 205 C HIS A 18 8.794 -5.782 12.003 1.00 27.63 C ATOM 206 O HIS A 18 9.800 -5.671 12.695 1.00 25.22 O ATOM 207 CB HIS A 18 6.585 -6.042 13.172 1.00 24.58 C ATOM 208 CG HIS A 18 7.246 -6.655 14.361 1.00 29.33 C ATOM 209 ND1 HIS A 18 7.085 -6.151 15.633 1.00 31.60 N ATOM 210 CD2 HIS A 18 8.144 -7.665 14.461 1.00 32.03 C ATOM 211 CE1 HIS A 18 7.820 -6.857 16.475 1.00 32.01 C ATOM 212 NE2 HIS A 18 8.462 -7.790 15.791 1.00 32.66 N ATOM 213 HA HIS A 18 7.768 -4.272 13.080 1.00 0.00 H ATOM 214 HB2 HIS A 18 5.708 -5.489 13.508 1.00 0.00 H ATOM 215 HB3 HIS A 18 6.274 -6.840 12.498 1.00 0.00 H ATOM 216 HD2 HIS A 18 8.539 -8.265 13.641 1.00 0.00 H ATOM 217 HE1 HIS A 18 7.886 -6.697 17.551 1.00 0.00 H ATOM 218 H HIS A 18 5.834 -4.694 11.072 1.00 0.00 H ATOM 219 N TYR A 19 8.771 -6.494 10.879 1.00 26.79 N ATOM 220 CA TYR A 19 9.955 -7.208 10.417 1.00 27.52 C ATOM 221 C TYR A 19 11.079 -6.257 10.016 1.00 28.94 C ATOM 222 O TYR A 19 12.243 -6.486 10.338 1.00 30.36 O ATOM 223 CB TYR A 19 9.615 -8.156 9.253 1.00 30.41 C ATOM 224 CG TYR A 19 10.806 -8.970 8.792 1.00 35.36 C ATOM 225 CD1 TYR A 19 11.610 -8.526 7.760 1.00 37.38 C ATOM 226 CD2 TYR A 19 11.146 -10.165 9.422 1.00 38.14 C ATOM 227 CE1 TYR A 19 12.716 -9.254 7.347 1.00 38.66 C ATOM 228 CE2 TYR A 19 12.257 -10.900 9.021 1.00 39.66 C ATOM 229 CZ TYR A 19 13.040 -10.432 7.986 1.00 49.18 C ATOM 230 OH TYR A 19 14.155 -11.142 7.589 1.00 52.91 O ATOM 231 HA TYR A 19 10.310 -7.803 11.258 1.00 0.00 H ATOM 232 HB3 TYR A 19 9.253 -7.562 8.414 1.00 0.00 H ATOM 233 HB2 TYR A 19 8.830 -8.839 9.578 1.00 0.00 H ATOM 234 HD2 TYR A 19 10.531 -10.531 10.244 1.00 0.00 H ATOM 235 HE2 TYR A 19 12.506 -11.837 9.520 1.00 0.00 H ATOM 236 HE1 TYR A 19 13.328 -8.896 6.519 1.00 0.00 H ATOM 237 HD1 TYR A 19 11.371 -7.587 7.261 1.00 0.00 H ATOM 238 HH TYR A 19 14.597 -10.668 6.841 1.00 0.00 H ATOM 239 H TYR A 19 7.894 -6.542 10.321 1.00 0.00 H ATOM 240 N LYS A 20 10.729 -5.226 9.259 1.00 23.40 N ATOM 241 CA LYS A 20 11.694 -4.221 8.816 1.00 23.53 C ATOM 242 C LYS A 20 12.404 -3.551 10.011 1.00 25.42 C ATOM 243 O LYS A 20 13.609 -3.347 10.002 1.00 26.00 O ATOM 244 CB LYS A 20 10.963 -3.158 8.007 1.00 25.78 C ATOM 245 CG LYS A 20 11.651 -2.758 6.726 1.00 39.40 C ATOM 246 CD LYS A 20 10.745 -2.947 5.530 1.00 41.26 C ATOM 247 CE LYS A 20 11.543 -3.368 4.308 1.00 44.72 C ATOM 248 NZ LYS A 20 13.011 -3.232 4.520 1.00 49.08 N ATOM 249 HA LYS A 20 12.451 -4.716 8.208 1.00 0.00 H ATOM 250 HB2 LYS A 20 9.974 -3.542 7.756 1.00 0.00 H ATOM 251 HB3 LYS A 20 10.859 -2.269 8.629 1.00 0.00 H ATOM 252 HG2 LYS A 20 11.939 -1.709 6.791 1.00 0.00 H ATOM 253 HG3 LYS A 20 12.543 -3.371 6.596 1.00 0.00 H ATOM 254 HD2 LYS A 20 10.008 -3.717 5.758 1.00 0.00 H ATOM 255 HD3 LYS A 20 10.234 -2.008 5.317 1.00 0.00 H ATOM 256 HE2 LYS A 20 11.250 -2.742 3.465 1.00 0.00 H ATOM 257 HE3 LYS A 20 11.316 -4.410 4.082 1.00 0.00 H ATOM 258 HZ1 LYS A 20 13.239 -2.239 4.729 1.00 0.00 H ATOM 259 HZ2 LYS A 20 13.302 -3.832 5.319 1.00 0.00 H ATOM 260 HZ3 LYS A 20 13.513 -3.531 3.660 1.00 0.00 H ATOM 261 H LYS A 20 9.734 -5.129 8.971 1.00 0.00 H ATOM 262 N LEU A 21 11.637 -3.161 11.019 1.00 21.94 N ATOM 263 CA LEU A 21 12.201 -2.494 12.186 1.00 21.91 C ATOM 264 C LEU A 21 13.021 -3.476 13.048 1.00 29.49 C ATOM 265 O LEU A 21 14.121 -3.153 13.508 1.00 28.51 O ATOM 266 CB LEU A 21 11.074 -1.857 13.004 1.00 21.34 C ATOM 267 CG LEU A 21 10.374 -0.704 12.265 1.00 23.80 C ATOM 268 CD1 LEU A 21 9.300 -0.026 13.119 1.00 22.25 C ATOM 269 CD2 LEU A 21 11.397 0.298 11.737 1.00 22.45 C ATOM 270 HA LEU A 21 12.882 -1.713 11.849 1.00 0.00 H ATOM 271 HB2 LEU A 21 10.334 -2.624 13.233 1.00 0.00 H ATOM 272 HB3 LEU A 21 11.494 -1.471 13.933 1.00 0.00 H ATOM 273 HG LEU A 21 9.852 -1.135 11.411 1.00 0.00 H ATOM 274 HD21 LEU A 21 11.967 0.708 12.571 1.00 0.00 H ATOM 275 HD22 LEU A 21 12.073 -0.205 11.046 1.00 0.00 H ATOM 276 HD23 LEU A 21 10.879 1.105 11.218 1.00 0.00 H ATOM 277 HD11 LEU A 21 8.541 -0.758 13.395 1.00 0.00 H ATOM 278 HD12 LEU A 21 9.758 0.382 14.020 1.00 0.00 H ATOM 279 HD13 LEU A 21 8.839 0.780 12.548 1.00 0.00 H ATOM 280 H LEU A 21 10.612 -3.334 10.977 1.00 0.00 H ATOM 281 N SER A 22 12.475 -4.668 13.285 1.00 28.54 N ATOM 282 CA SER A 22 13.179 -5.658 14.099 1.00 29.84 C ATOM 283 C SER A 22 14.595 -5.883 13.552 1.00 34.56 C ATOM 284 O SER A 22 15.549 -6.081 14.307 1.00 33.76 O ATOM 285 CB SER A 22 12.406 -6.984 14.118 1.00 34.70 C ATOM 286 OG SER A 22 12.947 -7.863 15.081 1.00 44.80 O ATOM 287 HA SER A 22 13.250 -5.280 15.119 1.00 0.00 H ATOM 288 HB2 SER A 22 12.468 -7.449 13.134 1.00 0.00 H ATOM 289 HB3 SER A 22 11.362 -6.786 14.360 1.00 0.00 H ATOM 290 HG SER A 22 12.889 -7.445 15.977 1.00 0.00 H ATOM 291 H SER A 22 11.541 -4.896 12.888 1.00 0.00 H ATOM 292 N GLN A 23 14.737 -5.793 12.235 1.00 31.88 N ATOM 293 CA GLN A 23 16.041 -5.986 11.604 1.00 32.58 C ATOM 294 C GLN A 23 16.997 -4.823 11.876 1.00 39.33 C ATOM 295 O GLN A 23 18.181 -4.895 11.547 1.00 40.87 O ATOM 296 CB GLN A 23 15.885 -6.278 10.102 1.00 33.89 C ATOM 297 CG GLN A 23 16.362 -5.159 9.181 1.00 55.19 C ATOM 298 CD GLN A 23 15.493 -5.000 7.934 1.00 80.95 C ATOM 299 OE1 GLN A 23 15.165 -3.878 7.530 1.00 76.62 O ATOM 300 NE2 GLN A 23 15.126 -6.122 7.314 1.00 70.47 N ATOM 301 HA GLN A 23 16.501 -6.862 12.062 1.00 0.00 H ATOM 302 HB2 GLN A 23 16.457 -7.176 9.869 1.00 0.00 H ATOM 303 HB3 GLN A 23 14.829 -6.458 9.899 1.00 0.00 H ATOM 304 HG2 GLN A 23 16.347 -4.221 9.737 1.00 0.00 H ATOM 305 HG3 GLN A 23 17.383 -5.378 8.868 1.00 0.00 H ATOM 306 HE22 GLN A 23 15.425 -7.045 7.689 1.00 0.00 H ATOM 307 HE21 GLN A 23 14.541 -6.074 6.455 1.00 0.00 H ATOM 308 H GLN A 23 13.908 -5.582 11.644 1.00 0.00 H ATOM 309 N ARG A 24 16.487 -3.764 12.509 1.00 34.16 N ATOM 310 CA ARG A 24 17.312 -2.615 12.890 1.00 33.02 C ATOM 311 C ARG A 24 17.495 -2.619 14.406 1.00 36.17 C ATOM 312 O ARG A 24 17.943 -1.631 14.979 1.00 38.32 O ATOM 313 CB ARG A 24 16.650 -1.293 12.476 1.00 30.57 C ATOM 314 CG ARG A 24 16.505 -1.077 10.978 1.00 41.25 C ATOM 315 CD ARG A 24 17.837 -0.691 10.349 1.00 58.68 C ATOM 316 NE ARG A 24 17.757 -0.492 8.902 1.00 65.69 N ATOM 317 CZ ARG A 24 17.187 -1.345 8.055 1.00 84.29 C ATOM 318 NH1 ARG A 24 17.175 -1.083 6.753 1.00 74.20 N ATOM 319 NH2 ARG A 24 16.627 -2.458 8.507 1.00 70.26 N ATOM 320 HA ARG A 24 18.273 -2.696 12.381 1.00 0.00 H ATOM 321 HB2 ARG A 24 15.654 -1.262 12.918 1.00 0.00 H ATOM 322 HB3 ARG A 24 17.250 -0.476 12.877 1.00 0.00 H ATOM 323 HG2 ARG A 24 16.147 -1.998 10.518 1.00 0.00 H ATOM 324 HG3 ARG A 24 15.783 -0.280 10.801 1.00 0.00 H ATOM 325 HD2 ARG A 24 18.558 -1.484 10.550 1.00 0.00 H ATOM 326 HD3 ARG A 24 18.181 0.236 10.808 1.00 0.00 H ATOM 327 HE ARG A 24 18.174 0.376 8.508 1.00 0.00 H ATOM 328 HH12 ARG A 24 16.729 -1.751 6.092 1.00 0.00 H ATOM 329 HH11 ARG A 24 17.612 -0.210 6.394 1.00 0.00 H ATOM 330 HH22 ARG A 24 16.182 -3.123 7.843 1.00 0.00 H ATOM 331 HH21 ARG A 24 16.632 -2.666 9.526 1.00 0.00 H ATOM 332 H ARG A 24 15.473 -3.754 12.739 1.00 0.00 H ATOM 333 N GLY A 25 17.097 -3.711 15.053 1.00 29.72 N ATOM 334 CA GLY A 25 17.199 -3.877 16.496 1.00 28.49 C ATOM 335 C GLY A 25 16.093 -3.158 17.247 1.00 31.54 C ATOM 336 O GLY A 25 16.148 -2.988 18.480 1.00 29.83 O ATOM 337 HA3 GLY A 25 18.160 -3.481 16.826 1.00 0.00 H ATOM 338 HA2 GLY A 25 17.146 -4.940 16.730 1.00 0.00 H ATOM 339 H GLY A 25 16.690 -4.490 14.497 1.00 0.00 H ATOM 340 N TYR A 26 15.079 -2.720 16.499 1.00 25.71 N ATOM 341 CA TYR A 26 13.976 -1.975 17.103 1.00 23.14 C ATOM 342 C TYR A 26 12.760 -2.882 17.253 1.00 25.95 C ATOM 343 O TYR A 26 12.126 -3.261 16.265 1.00 22.26 O ATOM 344 CB TYR A 26 13.655 -0.726 16.260 1.00 22.21 C ATOM 345 CG TYR A 26 12.669 0.226 16.913 1.00 19.93 C ATOM 346 CD1 TYR A 26 13.109 1.304 17.666 1.00 19.11 C ATOM 347 CD2 TYR A 26 11.298 0.028 16.787 1.00 20.22 C ATOM 348 CE1 TYR A 26 12.218 2.159 18.265 1.00 16.65 C ATOM 349 CE2 TYR A 26 10.408 0.909 17.343 1.00 20.18 C ATOM 350 CZ TYR A 26 10.874 1.947 18.110 1.00 19.19 C ATOM 351 OH TYR A 26 9.984 2.797 18.708 1.00 17.09 O ATOM 352 HA TYR A 26 14.266 -1.636 18.097 1.00 0.00 H ATOM 353 HB3 TYR A 26 13.236 -1.053 15.308 1.00 0.00 H ATOM 354 HB2 TYR A 26 14.585 -0.186 16.080 1.00 0.00 H ATOM 355 HD2 TYR A 26 10.927 -0.838 16.239 1.00 0.00 H ATOM 356 HE2 TYR A 26 9.338 0.786 17.177 1.00 0.00 H ATOM 357 HE1 TYR A 26 12.577 2.999 18.859 1.00 0.00 H ATOM 358 HD1 TYR A 26 14.179 1.475 17.784 1.00 0.00 H ATOM 359 HH TYR A 26 9.431 3.236 18.014 1.00 0.00 H ATOM 360 H TYR A 26 15.073 -2.910 15.477 1.00 0.00 H ATOM 361 N GLU A 27 12.443 -3.244 18.497 1.00 22.58 N ATOM 362 CA GLU A 27 11.307 -4.132 18.755 1.00 22.05 C ATOM 363 C GLU A 27 10.063 -3.298 18.965 1.00 25.24 C ATOM 364 O GLU A 27 9.746 -2.861 20.064 1.00 24.41 O ATOM 365 CB GLU A 27 11.575 -5.067 19.951 1.00 23.56 C ATOM 366 CG GLU A 27 12.768 -5.998 19.724 1.00 29.24 C ATOM 367 CD GLU A 27 12.623 -6.802 18.442 1.00 47.57 C ATOM 368 OE1 GLU A 27 11.503 -7.285 18.189 1.00 39.69 O ATOM 369 OE2 GLU A 27 13.611 -6.942 17.686 1.00 46.82 O ATOM 370 HA GLU A 27 11.158 -4.778 17.890 1.00 0.00 H ATOM 371 HB2 GLU A 27 11.773 -4.457 20.832 1.00 0.00 H ATOM 372 HB3 GLU A 27 10.687 -5.675 20.123 1.00 0.00 H ATOM 373 HG2 GLU A 27 13.677 -5.399 19.664 1.00 0.00 H ATOM 374 HG3 GLU A 27 12.843 -6.687 20.566 1.00 0.00 H ATOM 375 H GLU A 27 13.010 -2.891 19.294 1.00 0.00 H ATOM 376 N TRP A 28 9.349 -3.097 17.874 1.00 21.58 N ATOM 377 CA TRP A 28 8.174 -2.259 17.876 1.00 20.65 C ATOM 378 C TRP A 28 6.994 -2.926 18.557 1.00 26.39 C ATOM 379 O TRP A 28 6.702 -4.098 18.330 1.00 26.93 O ATOM 380 CB TRP A 28 7.838 -1.902 16.412 1.00 19.06 C ATOM 381 CG TRP A 28 6.570 -1.140 16.204 1.00 20.64 C ATOM 382 CD1 TRP A 28 6.195 0.032 16.790 1.00 23.67 C ATOM 383 CD2 TRP A 28 5.580 -1.428 15.218 1.00 20.78 C ATOM 384 NE1 TRP A 28 4.998 0.470 16.257 1.00 23.16 N ATOM 385 CE2 TRP A 28 4.607 -0.408 15.283 1.00 24.45 C ATOM 386 CE3 TRP A 28 5.413 -2.469 14.300 1.00 21.72 C ATOM 387 CZ2 TRP A 28 3.454 -0.430 14.510 1.00 24.12 C ATOM 388 CZ3 TRP A 28 4.275 -2.469 13.505 1.00 22.86 C ATOM 389 CH2 TRP A 28 3.336 -1.438 13.587 1.00 23.18 C ATOM 390 HA TRP A 28 8.382 -1.355 18.449 1.00 0.00 H ATOM 391 HB2 TRP A 28 8.658 -1.302 16.017 1.00 0.00 H ATOM 392 HB3 TRP A 28 7.766 -2.832 15.849 1.00 0.00 H ATOM 393 HE1 TRP A 28 4.481 1.324 16.547 1.00 0.00 H ATOM 394 HD1 TRP A 28 6.758 0.549 17.567 1.00 0.00 H ATOM 395 HZ2 TRP A 28 2.675 0.322 14.631 1.00 0.00 H ATOM 396 HH2 TRP A 28 2.489 -1.434 12.901 1.00 0.00 H ATOM 397 HZ3 TRP A 28 4.111 -3.288 12.804 1.00 0.00 H ATOM 398 HE3 TRP A 28 6.157 -3.260 14.211 1.00 0.00 H ATOM 399 H TRP A 28 9.641 -3.555 16.987 1.00 0.00 H ATOM 400 N ASP A 29 6.289 -2.156 19.369 1.00 23.95 N ATOM 401 CA ASP A 29 5.069 -2.623 20.004 1.00 25.78 C ATOM 402 C ASP A 29 3.949 -2.345 18.981 1.00 34.08 C ATOM 403 O ASP A 29 3.401 -1.236 18.908 1.00 36.32 O ATOM 404 CB ASP A 29 4.805 -1.814 21.287 1.00 27.50 C ATOM 405 CG ASP A 29 3.392 -1.999 21.811 1.00 38.90 C ATOM 406 OD1 ASP A 29 2.855 -1.082 22.485 1.00 40.94 O ATOM 407 OD2 ASP A 29 2.827 -3.083 21.558 1.00 41.45 O ATOM 408 HA ASP A 29 5.128 -3.676 20.278 1.00 0.00 H ATOM 409 HB2 ASP A 29 5.508 -2.137 22.055 1.00 0.00 H ATOM 410 HB3 ASP A 29 4.963 -0.757 21.073 1.00 0.00 H ATOM 411 H ASP A 29 6.618 -1.188 19.558 1.00 0.00 H ATOM 412 N ALA A 30 3.679 -3.315 18.129 1.00 30.94 N ATOM 413 CA ALA A 30 2.660 -3.150 17.098 1.00 46.10 C ATOM 414 C ALA A 30 1.354 -2.615 17.669 1.00 77.76 C ATOM 415 O ALA A 30 0.296 -3.194 17.454 1.00 50.73 O ATOM 416 CB ALA A 30 2.431 -4.467 16.373 1.00 46.53 C ATOM 417 HA ALA A 30 3.025 -2.411 16.385 1.00 0.00 H ATOM 418 HB1 ALA A 30 3.362 -4.791 15.908 1.00 0.00 H ATOM 419 HB2 ALA A 30 2.099 -5.221 17.087 1.00 0.00 H ATOM 420 HB3 ALA A 30 1.668 -4.330 15.606 1.00 0.00 H ATOM 421 H ALA A 30 4.201 -4.212 18.193 1.00 0.00 H TER 422 ALA A 30 ATOM 423 N SER A 87 -2.104 -16.642 7.061 1.00 49.00 N ATOM 424 CA SER A 87 -1.701 -15.849 5.902 1.00 47.08 C ATOM 425 C SER A 87 -0.187 -15.680 5.822 1.00 44.93 C ATOM 426 O SER A 87 0.300 -14.692 5.263 1.00 44.22 O ATOM 427 CB SER A 87 -2.360 -14.471 5.947 1.00 52.33 C ATOM 428 OG SER A 87 -3.275 -14.367 7.025 1.00 66.67 O ATOM 429 HA SER A 87 -2.030 -16.390 5.015 1.00 0.00 H ATOM 430 HB2 SER A 87 -2.894 -14.303 5.012 1.00 0.00 H ATOM 431 HB3 SER A 87 -1.587 -13.712 6.064 1.00 0.00 H ATOM 432 HG SER A 87 -3.682 -13.465 7.025 1.00 0.00 H ATOM 433 HN3 SER A 87 -1.783 -16.170 7.931 1.00 0.00 H ATOM 434 HN2 SER A 87 -1.674 -17.587 6.999 1.00 0.00 H ATOM 435 HN1 SER A 87 -3.140 -16.731 7.075 1.00 0.00 H ATOM 436 N GLU A 88 0.553 -16.641 6.371 1.00 35.39 N ATOM 437 CA GLU A 88 2.010 -16.564 6.391 1.00 33.09 C ATOM 438 C GLU A 88 2.675 -16.433 5.022 1.00 32.40 C ATOM 439 O GLU A 88 3.710 -15.766 4.883 1.00 32.29 O ATOM 440 CB GLU A 88 2.609 -17.752 7.128 1.00 34.19 C ATOM 441 CG GLU A 88 4.059 -17.543 7.545 1.00 45.78 C ATOM 442 CD GLU A 88 4.276 -16.229 8.284 1.00 70.70 C ATOM 443 OE1 GLU A 88 3.467 -15.902 9.181 1.00 73.75 O ATOM 444 OE2 GLU A 88 5.270 -15.533 7.985 1.00 63.24 O ATOM 445 HA GLU A 88 2.220 -15.634 6.920 1.00 0.00 H ATOM 446 HB2 GLU A 88 2.016 -17.937 8.024 1.00 0.00 H ATOM 447 HB3 GLU A 88 2.560 -18.623 6.475 1.00 0.00 H ATOM 448 HG2 GLU A 88 4.356 -18.364 8.198 1.00 0.00 H ATOM 449 HG3 GLU A 88 4.683 -17.548 6.651 1.00 0.00 H ATOM 450 H GLU A 88 0.082 -17.465 6.795 1.00 0.00 H ATOM 451 N VAL A 89 2.134 -17.130 4.031 1.00 23.54 N ATOM 452 CA VAL A 89 2.726 -17.079 2.699 1.00 21.30 C ATOM 453 C VAL A 89 2.686 -15.650 2.177 1.00 20.45 C ATOM 454 O VAL A 89 3.665 -15.176 1.564 1.00 17.07 O ATOM 455 CB VAL A 89 2.064 -18.082 1.711 1.00 24.52 C ATOM 456 CG1 VAL A 89 2.540 -17.805 0.273 1.00 23.74 C ATOM 457 CG2 VAL A 89 2.409 -19.542 2.130 1.00 24.31 C ATOM 458 HA VAL A 89 3.767 -17.394 2.778 1.00 0.00 H ATOM 459 HB VAL A 89 0.982 -17.954 1.745 1.00 0.00 H ATOM 460 HG11 VAL A 89 2.264 -16.789 -0.010 1.00 0.00 H ATOM 461 HG12 VAL A 89 3.623 -17.916 0.222 1.00 0.00 H ATOM 462 HG13 VAL A 89 2.069 -18.514 -0.407 1.00 0.00 H ATOM 463 HG21 VAL A 89 3.490 -19.678 2.112 1.00 0.00 H ATOM 464 HG22 VAL A 89 2.035 -19.728 3.137 1.00 0.00 H ATOM 465 HG23 VAL A 89 1.942 -20.238 1.434 1.00 0.00 H ATOM 466 H VAL A 89 1.289 -17.712 4.204 1.00 0.00 H ATOM 467 N VAL A 90 1.554 -14.974 2.406 1.00 17.36 N ATOM 468 CA VAL A 90 1.399 -13.587 1.951 1.00 18.20 C ATOM 469 C VAL A 90 2.478 -12.695 2.550 1.00 19.72 C ATOM 470 O VAL A 90 3.138 -11.956 1.826 1.00 17.00 O ATOM 471 CB VAL A 90 -0.030 -13.013 2.130 1.00 22.56 C ATOM 472 CG1 VAL A 90 -0.080 -11.535 1.730 1.00 21.24 C ATOM 473 CG2 VAL A 90 -1.030 -13.788 1.246 1.00 23.20 C ATOM 474 HA VAL A 90 1.541 -13.602 0.870 1.00 0.00 H ATOM 475 HB VAL A 90 -0.297 -13.115 3.182 1.00 0.00 H ATOM 476 HG11 VAL A 90 0.607 -10.967 2.357 1.00 0.00 H ATOM 477 HG12 VAL A 90 0.211 -11.433 0.684 1.00 0.00 H ATOM 478 HG13 VAL A 90 -1.094 -11.157 1.865 1.00 0.00 H ATOM 479 HG21 VAL A 90 -0.736 -13.696 0.200 1.00 0.00 H ATOM 480 HG22 VAL A 90 -1.028 -14.839 1.534 1.00 0.00 H ATOM 481 HG23 VAL A 90 -2.029 -13.374 1.382 1.00 0.00 H ATOM 482 H VAL A 90 0.773 -15.438 2.913 1.00 0.00 H ATOM 483 N HIS A 91 2.679 -12.776 3.864 1.00 16.88 N ATOM 484 CA HIS A 91 3.696 -11.941 4.505 1.00 17.96 C ATOM 485 C HIS A 91 5.102 -12.171 3.965 1.00 21.54 C ATOM 486 O HIS A 91 5.838 -11.222 3.717 1.00 19.33 O ATOM 487 CB HIS A 91 3.693 -12.147 6.031 1.00 19.94 C ATOM 488 CG HIS A 91 2.366 -11.860 6.665 1.00 24.10 C ATOM 489 ND1 HIS A 91 1.708 -12.771 7.471 1.00 26.83 N ATOM 490 CD2 HIS A 91 1.551 -10.784 6.569 1.00 24.61 C ATOM 491 CE1 HIS A 91 0.555 -12.256 7.861 1.00 25.62 C ATOM 492 NE2 HIS A 91 0.443 -11.047 7.337 1.00 25.68 N ATOM 493 HA HIS A 91 3.424 -10.913 4.266 1.00 0.00 H ATOM 494 HB2 HIS A 91 3.960 -13.183 6.241 1.00 0.00 H ATOM 495 HB3 HIS A 91 4.438 -11.484 6.471 1.00 0.00 H ATOM 496 HD2 HIS A 91 1.738 -9.879 5.991 1.00 0.00 H ATOM 497 HE1 HIS A 91 -0.178 -12.744 8.504 1.00 0.00 H ATOM 498 H HIS A 91 2.112 -13.434 4.436 1.00 0.00 H ATOM 499 N LEU A 92 5.496 -13.435 3.830 1.00 20.19 N ATOM 500 CA LEU A 92 6.836 -13.761 3.349 1.00 20.86 C ATOM 501 C LEU A 92 7.027 -13.296 1.913 1.00 19.90 C ATOM 502 O LEU A 92 8.074 -12.756 1.545 1.00 19.13 O ATOM 503 CB LEU A 92 7.102 -15.267 3.453 1.00 22.74 C ATOM 504 CG LEU A 92 8.390 -15.661 2.726 1.00 31.97 C ATOM 505 CD1 LEU A 92 9.634 -14.872 3.226 1.00 33.97 C ATOM 506 CD2 LEU A 92 8.650 -17.186 2.764 1.00 38.18 C ATOM 507 HA LEU A 92 7.552 -13.236 3.982 1.00 0.00 H ATOM 508 HB2 LEU A 92 7.191 -15.539 4.505 1.00 0.00 H ATOM 509 HB3 LEU A 92 6.265 -15.806 3.009 1.00 0.00 H ATOM 510 HG LEU A 92 8.230 -15.381 1.685 1.00 0.00 H ATOM 511 HD21 LEU A 92 8.736 -17.513 3.800 1.00 0.00 H ATOM 512 HD22 LEU A 92 7.821 -17.707 2.285 1.00 0.00 H ATOM 513 HD23 LEU A 92 9.576 -17.409 2.234 1.00 0.00 H ATOM 514 HD11 LEU A 92 9.475 -13.806 3.066 1.00 0.00 H ATOM 515 HD12 LEU A 92 9.781 -15.063 4.289 1.00 0.00 H ATOM 516 HD13 LEU A 92 10.515 -15.196 2.672 1.00 0.00 H ATOM 517 H LEU A 92 4.838 -14.204 4.071 1.00 0.00 H ATOM 518 N THR A 93 6.009 -13.513 1.091 1.00 15.52 N ATOM 519 CA THR A 93 6.043 -13.115 -0.323 1.00 14.00 C ATOM 520 C THR A 93 6.190 -11.597 -0.470 1.00 18.96 C ATOM 521 O THR A 93 6.977 -11.122 -1.296 1.00 17.84 O ATOM 522 CB THR A 93 4.782 -13.629 -1.067 1.00 22.31 C ATOM 523 OG1 THR A 93 4.703 -15.055 -0.946 1.00 21.96 O ATOM 524 CG2 THR A 93 4.839 -13.278 -2.552 1.00 21.83 C ATOM 525 HA THR A 93 6.919 -13.575 -0.781 1.00 0.00 H ATOM 526 HB THR A 93 3.910 -13.153 -0.619 1.00 0.00 H ATOM 527 HG1 THR A 93 4.645 -15.301 0.011 1.00 0.00 H ATOM 528 HG23 THR A 93 4.900 -12.196 -2.666 1.00 0.00 H ATOM 529 HG21 THR A 93 5.718 -13.742 -3.000 1.00 0.00 H ATOM 530 HG22 THR A 93 3.940 -13.647 -3.046 1.00 0.00 H ATOM 531 H THR A 93 5.157 -13.981 1.460 1.00 0.00 H ATOM 532 N LEU A 94 5.454 -10.837 0.347 1.00 15.67 N ATOM 533 CA LEU A 94 5.514 -9.372 0.286 1.00 16.38 C ATOM 534 C LEU A 94 6.885 -8.873 0.705 1.00 18.98 C ATOM 535 O LEU A 94 7.440 -7.951 0.104 1.00 18.86 O ATOM 536 CB LEU A 94 4.430 -8.758 1.166 1.00 17.03 C ATOM 537 CG LEU A 94 4.291 -7.229 1.204 1.00 21.45 C ATOM 538 CD1 LEU A 94 4.069 -6.684 -0.208 1.00 21.93 C ATOM 539 CD2 LEU A 94 3.107 -6.876 2.097 1.00 24.69 C ATOM 540 HA LEU A 94 5.339 -9.064 -0.745 1.00 0.00 H ATOM 541 HB2 LEU A 94 3.475 -9.159 0.827 1.00 0.00 H ATOM 542 HB3 LEU A 94 4.619 -9.089 2.187 1.00 0.00 H ATOM 543 HG LEU A 94 5.202 -6.782 1.601 1.00 0.00 H ATOM 544 HD21 LEU A 94 2.200 -7.324 1.690 1.00 0.00 H ATOM 545 HD22 LEU A 94 3.284 -7.260 3.102 1.00 0.00 H ATOM 546 HD23 LEU A 94 2.993 -5.793 2.136 1.00 0.00 H ATOM 547 HD11 LEU A 94 4.919 -6.950 -0.837 1.00 0.00 H ATOM 548 HD12 LEU A 94 3.158 -7.116 -0.624 1.00 0.00 H ATOM 549 HD13 LEU A 94 3.972 -5.599 -0.166 1.00 0.00 H ATOM 550 H LEU A 94 4.826 -11.293 1.040 1.00 0.00 H ATOM 551 N ARG A 95 7.447 -9.507 1.726 1.00 15.29 N ATOM 552 CA ARG A 95 8.793 -9.157 2.197 1.00 15.57 C ATOM 553 C ARG A 95 9.819 -9.372 1.103 1.00 17.27 C ATOM 554 O ARG A 95 10.693 -8.528 0.870 1.00 18.82 O ATOM 555 CB ARG A 95 9.160 -10.016 3.426 1.00 17.58 C ATOM 556 CG ARG A 95 10.630 -9.978 3.813 1.00 27.71 C ATOM 557 CD ARG A 95 10.879 -10.900 5.012 1.00 41.68 C ATOM 558 NE ARG A 95 9.683 -11.034 5.842 1.00 44.23 N ATOM 559 CZ ARG A 95 9.555 -11.889 6.849 1.00 65.77 C ATOM 560 NH1 ARG A 95 10.547 -12.715 7.154 1.00 54.13 N ATOM 561 NH2 ARG A 95 8.432 -11.914 7.555 1.00 59.54 N ATOM 562 HA ARG A 95 8.795 -8.103 2.475 1.00 0.00 H ATOM 563 HB2 ARG A 95 8.576 -9.661 4.275 1.00 0.00 H ATOM 564 HB3 ARG A 95 8.892 -11.050 3.210 1.00 0.00 H ATOM 565 HG2 ARG A 95 11.235 -10.311 2.969 1.00 0.00 H ATOM 566 HG3 ARG A 95 10.908 -8.958 4.078 1.00 0.00 H ATOM 567 HD2 ARG A 95 11.686 -10.485 5.617 1.00 0.00 H ATOM 568 HD3 ARG A 95 11.170 -11.885 4.647 1.00 0.00 H ATOM 569 HE ARG A 95 8.875 -10.415 5.628 1.00 0.00 H ATOM 570 HH12 ARG A 95 10.443 -13.384 7.944 1.00 0.00 H ATOM 571 HH11 ARG A 95 11.429 -12.694 6.603 1.00 0.00 H ATOM 572 HH22 ARG A 95 8.329 -12.583 8.345 1.00 0.00 H ATOM 573 HH21 ARG A 95 7.655 -11.265 7.319 1.00 0.00 H ATOM 574 H ARG A 95 6.923 -10.268 2.203 1.00 0.00 H ATOM 575 N GLN A 96 9.725 -10.510 0.421 1.00 14.69 N ATOM 576 CA GLN A 96 10.649 -10.811 -0.668 1.00 15.13 C ATOM 577 C GLN A 96 10.450 -9.869 -1.840 1.00 16.44 C ATOM 578 O GLN A 96 11.416 -9.353 -2.394 1.00 15.22 O ATOM 579 CB GLN A 96 10.490 -12.264 -1.141 1.00 17.38 C ATOM 580 CG GLN A 96 11.000 -13.276 -0.115 1.00 24.73 C ATOM 581 CD GLN A 96 10.669 -14.719 -0.478 1.00 44.03 C ATOM 582 OE1 GLN A 96 9.714 -14.997 -1.204 1.00 31.37 O ATOM 583 NE2 GLN A 96 11.456 -15.646 0.049 1.00 48.91 N ATOM 584 HA GLN A 96 11.658 -10.673 -0.279 1.00 0.00 H ATOM 585 HB2 GLN A 96 9.433 -12.457 -1.327 1.00 0.00 H ATOM 586 HB3 GLN A 96 11.050 -12.393 -2.067 1.00 0.00 H ATOM 587 HG2 GLN A 96 12.083 -13.177 -0.039 1.00 0.00 H ATOM 588 HG3 GLN A 96 10.548 -13.049 0.850 1.00 0.00 H ATOM 589 HE22 GLN A 96 12.252 -15.368 0.657 1.00 0.00 H ATOM 590 HE21 GLN A 96 11.277 -16.652 -0.146 1.00 0.00 H ATOM 591 H GLN A 96 8.982 -11.195 0.667 1.00 0.00 H ATOM 592 N ALA A 97 9.199 -9.652 -2.240 1.00 12.67 N ATOM 593 CA ALA A 97 8.932 -8.738 -3.364 1.00 13.07 C ATOM 594 C ALA A 97 9.434 -7.318 -3.043 1.00 14.38 C ATOM 595 O ALA A 97 9.916 -6.592 -3.925 1.00 13.08 O ATOM 596 CB ALA A 97 7.416 -8.709 -3.710 1.00 14.42 C ATOM 597 HA ALA A 97 9.475 -9.110 -4.233 1.00 0.00 H ATOM 598 HB1 ALA A 97 7.089 -9.711 -3.988 1.00 0.00 H ATOM 599 HB2 ALA A 97 6.853 -8.369 -2.841 1.00 0.00 H ATOM 600 HB3 ALA A 97 7.248 -8.026 -4.543 1.00 0.00 H ATOM 601 H ALA A 97 8.410 -10.128 -1.759 1.00 0.00 H ATOM 602 N GLY A 98 9.292 -6.899 -1.795 1.00 12.03 N ATOM 603 CA GLY A 98 9.750 -5.561 -1.405 1.00 12.79 C ATOM 604 C GLY A 98 11.270 -5.447 -1.445 1.00 18.06 C ATOM 605 O GLY A 98 11.824 -4.427 -1.869 1.00 17.29 O ATOM 606 HA3 GLY A 98 9.407 -5.352 -0.392 1.00 0.00 H ATOM 607 HA2 GLY A 98 9.323 -4.828 -2.090 1.00 0.00 H ATOM 608 H GLY A 98 8.853 -7.522 -1.087 1.00 0.00 H ATOM 609 N ASP A 99 11.954 -6.503 -1.012 1.00 16.49 N ATOM 610 CA ASP A 99 13.420 -6.540 -1.060 1.00 17.00 C ATOM 611 C ASP A 99 13.847 -6.474 -2.525 1.00 21.12 C ATOM 612 O ASP A 99 14.802 -5.767 -2.876 1.00 20.32 O ATOM 613 CB ASP A 99 13.966 -7.815 -0.400 1.00 19.46 C ATOM 614 CG ASP A 99 13.920 -7.743 1.117 1.00 29.67 C ATOM 615 OD1 ASP A 99 13.679 -6.640 1.646 1.00 28.18 O ATOM 616 OD2 ASP A 99 14.056 -8.796 1.777 1.00 39.27 O ATOM 617 HA ASP A 99 13.825 -5.692 -0.507 1.00 0.00 H ATOM 618 HB2 ASP A 99 13.368 -8.665 -0.729 1.00 0.00 H ATOM 619 HB3 ASP A 99 15.000 -7.957 -0.713 1.00 0.00 H ATOM 620 H ASP A 99 11.437 -7.321 -0.631 1.00 0.00 H ATOM 621 N ASP A 100 13.115 -7.176 -3.389 1.00 18.02 N ATOM 622 CA ASP A 100 13.423 -7.170 -4.823 1.00 17.06 C ATOM 623 C ASP A 100 13.220 -5.780 -5.388 1.00 20.05 C ATOM 624 O ASP A 100 14.013 -5.311 -6.198 1.00 18.33 O ATOM 625 CB ASP A 100 12.494 -8.109 -5.594 1.00 19.22 C ATOM 626 CG ASP A 100 12.938 -9.562 -5.533 1.00 32.29 C ATOM 627 OD1 ASP A 100 12.180 -10.422 -6.045 1.00 28.29 O ATOM 628 OD2 ASP A 100 13.972 -9.858 -4.884 1.00 40.41 O ATOM 629 HA ASP A 100 14.457 -7.496 -4.932 1.00 0.00 H ATOM 630 HB2 ASP A 100 11.493 -8.033 -5.170 1.00 0.00 H ATOM 631 HB3 ASP A 100 12.470 -7.796 -6.638 1.00 0.00 H ATOM 632 H ASP A 100 12.312 -7.738 -3.041 1.00 0.00 H ATOM 633 N PHE A 101 12.089 -5.164 -5.031 1.00 15.31 N ATOM 634 CA PHE A 101 11.800 -3.822 -5.500 1.00 13.56 C ATOM 635 C PHE A 101 12.904 -2.855 -5.139 1.00 18.20 C ATOM 636 O PHE A 101 13.336 -2.075 -5.973 1.00 19.63 O ATOM 637 CB PHE A 101 10.474 -3.296 -4.926 1.00 13.20 C ATOM 638 CG PHE A 101 10.245 -1.835 -5.205 1.00 14.30 C ATOM 639 CD1 PHE A 101 9.694 -1.421 -6.421 1.00 14.88 C ATOM 640 CD2 PHE A 101 10.674 -0.877 -4.293 1.00 15.02 C ATOM 641 CE1 PHE A 101 9.539 -0.063 -6.714 1.00 16.60 C ATOM 642 CE2 PHE A 101 10.482 0.473 -4.551 1.00 19.14 C ATOM 643 CZ PHE A 101 9.901 0.884 -5.763 1.00 17.45 C ATOM 644 HA PHE A 101 11.722 -3.888 -6.585 1.00 0.00 H ATOM 645 HB2 PHE A 101 9.655 -3.865 -5.366 1.00 0.00 H ATOM 646 HB3 PHE A 101 10.480 -3.446 -3.846 1.00 0.00 H ATOM 647 HD2 PHE A 101 11.164 -1.188 -3.370 1.00 0.00 H ATOM 648 HE2 PHE A 101 10.782 1.216 -3.812 1.00 0.00 H ATOM 649 HZ PHE A 101 9.735 1.944 -5.957 1.00 0.00 H ATOM 650 HE1 PHE A 101 9.138 0.250 -7.678 1.00 0.00 H ATOM 651 HD1 PHE A 101 9.381 -2.167 -7.151 1.00 0.00 H ATOM 652 H PHE A 101 11.410 -5.651 -4.412 1.00 0.00 H ATOM 653 N SER A 102 13.305 -2.848 -3.878 1.00 16.47 N ATOM 654 CA SER A 102 14.308 -1.883 -3.422 1.00 18.37 C ATOM 655 C SER A 102 15.707 -2.073 -4.013 1.00 20.57 C ATOM 656 O SER A 102 16.485 -1.139 -4.048 1.00 17.82 O ATOM 657 CB SER A 102 14.386 -1.857 -1.900 1.00 22.37 C ATOM 658 OG SER A 102 14.979 -3.060 -1.416 1.00 37.28 O ATOM 659 HA SER A 102 13.956 -0.923 -3.799 1.00 0.00 H ATOM 660 HB2 SER A 102 13.381 -1.760 -1.489 1.00 0.00 H ATOM 661 HB3 SER A 102 14.989 -1.006 -1.585 1.00 0.00 H ATOM 662 HG SER A 102 15.893 -3.148 -1.786 1.00 0.00 H ATOM 663 H SER A 102 12.905 -3.533 -3.206 1.00 0.00 H ATOM 664 N ARG A 103 16.014 -3.278 -4.471 1.00 16.78 N ATOM 665 CA ARG A 103 17.297 -3.529 -5.128 1.00 16.60 C ATOM 666 C ARG A 103 17.202 -3.167 -6.604 1.00 18.83 C ATOM 667 O ARG A 103 18.060 -2.465 -7.137 1.00 15.98 O ATOM 668 CB ARG A 103 17.714 -5.006 -4.969 1.00 18.42 C ATOM 669 CG ARG A 103 19.042 -5.338 -5.685 1.00 23.30 C ATOM 670 CD ARG A 103 19.408 -6.799 -5.443 1.00 20.55 C ATOM 671 NE ARG A 103 18.414 -7.699 -6.023 1.00 19.95 N ATOM 672 CZ ARG A 103 18.376 -8.057 -7.305 1.00 33.44 C ATOM 673 NH1 ARG A 103 19.275 -7.586 -8.160 1.00 18.20 N ATOM 674 NH2 ARG A 103 17.429 -8.879 -7.734 1.00 24.34 N ATOM 675 HA ARG A 103 18.056 -2.907 -4.654 1.00 0.00 H ATOM 676 HB2 ARG A 103 17.828 -5.223 -3.907 1.00 0.00 H ATOM 677 HB3 ARG A 103 16.928 -5.636 -5.385 1.00 0.00 H ATOM 678 HG2 ARG A 103 18.929 -5.165 -6.755 1.00 0.00 H ATOM 679 HG3 ARG A 103 19.833 -4.697 -5.296 1.00 0.00 H ATOM 680 HD2 ARG A 103 19.465 -6.978 -4.369 1.00 0.00 H ATOM 681 HD3 ARG A 103 20.378 -7.002 -5.896 1.00 0.00 H ATOM 682 HE ARG A 103 17.685 -8.087 -5.391 1.00 0.00 H ATOM 683 HH12 ARG A 103 19.240 -7.869 -9.160 1.00 0.00 H ATOM 684 HH11 ARG A 103 20.015 -6.933 -7.830 1.00 0.00 H ATOM 685 HH22 ARG A 103 17.398 -9.159 -8.735 1.00 0.00 H ATOM 686 HH21 ARG A 103 16.717 -9.244 -7.070 1.00 0.00 H ATOM 687 H ARG A 103 15.333 -4.057 -4.362 1.00 0.00 H ATOM 688 N ARG A 104 16.123 -3.607 -7.255 1.00 16.50 N ATOM 689 CA ARG A 104 15.904 -3.334 -8.669 1.00 15.47 C ATOM 690 C ARG A 104 15.677 -1.858 -8.966 1.00 18.39 C ATOM 691 O ARG A 104 16.045 -1.365 -10.035 1.00 17.46 O ATOM 692 CB ARG A 104 14.735 -4.187 -9.184 1.00 17.30 C ATOM 693 CG ARG A 104 14.959 -5.709 -9.008 1.00 21.12 C ATOM 694 CD ARG A 104 13.706 -6.502 -9.418 1.00 23.49 C ATOM 695 NE ARG A 104 13.952 -7.943 -9.422 1.00 21.02 N ATOM 696 CZ ARG A 104 13.658 -8.762 -10.426 1.00 32.01 C ATOM 697 NH1 ARG A 104 13.097 -8.311 -11.550 1.00 24.98 N ATOM 698 NH2 ARG A 104 13.936 -10.043 -10.302 1.00 27.46 N ATOM 699 HA ARG A 104 16.817 -3.606 -9.198 1.00 0.00 H ATOM 700 HB2 ARG A 104 13.835 -3.905 -8.638 1.00 0.00 H ATOM 701 HB3 ARG A 104 14.596 -3.978 -10.245 1.00 0.00 H ATOM 702 HG2 ARG A 104 15.798 -6.020 -9.631 1.00 0.00 H ATOM 703 HG3 ARG A 104 15.187 -5.917 -7.963 1.00 0.00 H ATOM 704 HD2 ARG A 104 13.404 -6.193 -10.419 1.00 0.00 H ATOM 705 HD3 ARG A 104 12.903 -6.283 -8.714 1.00 0.00 H ATOM 706 HE ARG A 104 14.390 -8.358 -8.575 1.00 0.00 H ATOM 707 HH12 ARG A 104 12.876 -8.972 -12.322 1.00 0.00 H ATOM 708 HH11 ARG A 104 12.881 -7.299 -11.654 1.00 0.00 H ATOM 709 HH22 ARG A 104 13.714 -10.701 -11.076 1.00 0.00 H ATOM 710 HH21 ARG A 104 14.378 -10.397 -9.430 1.00 0.00 H ATOM 711 H ARG A 104 15.415 -4.164 -6.735 1.00 0.00 H ATOM 712 N TYR A 105 15.075 -1.139 -8.018 1.00 14.40 N ATOM 713 CA TYR A 105 14.833 0.293 -8.183 1.00 14.76 C ATOM 714 C TYR A 105 15.561 1.053 -7.079 1.00 19.08 C ATOM 715 O TYR A 105 14.991 1.850 -6.347 1.00 17.58 O ATOM 716 CB TYR A 105 13.333 0.606 -8.196 1.00 16.87 C ATOM 717 CG TYR A 105 12.664 0.018 -9.409 1.00 19.80 C ATOM 718 CD1 TYR A 105 12.123 -1.271 -9.375 1.00 22.02 C ATOM 719 CD2 TYR A 105 12.704 0.689 -10.627 1.00 20.82 C ATOM 720 CE1 TYR A 105 11.568 -1.846 -10.528 1.00 23.11 C ATOM 721 CE2 TYR A 105 12.150 0.136 -11.772 1.00 22.70 C ATOM 722 CZ TYR A 105 11.583 -1.127 -11.717 1.00 28.70 C ATOM 723 OH TYR A 105 11.035 -1.636 -12.871 1.00 26.20 O ATOM 724 HA TYR A 105 15.224 0.616 -9.148 1.00 0.00 H ATOM 725 HB3 TYR A 105 13.195 1.687 -8.203 1.00 0.00 H ATOM 726 HB2 TYR A 105 12.875 0.188 -7.300 1.00 0.00 H ATOM 727 HD2 TYR A 105 13.180 1.668 -10.683 1.00 0.00 H ATOM 728 HE2 TYR A 105 12.161 0.692 -12.710 1.00 0.00 H ATOM 729 HE1 TYR A 105 11.131 -2.844 -10.492 1.00 0.00 H ATOM 730 HD1 TYR A 105 12.133 -1.835 -8.442 1.00 0.00 H ATOM 731 HH TYR A 105 10.668 -2.538 -12.691 1.00 0.00 H ATOM 732 H TYR A 105 14.771 -1.608 -7.141 1.00 0.00 H ATOM 733 N ARG A 106 16.850 0.769 -6.980 1.00 17.10 N ATOM 734 CA ARG A 106 17.684 1.326 -5.949 1.00 17.39 C ATOM 735 C ARG A 106 17.807 2.845 -6.004 1.00 19.82 C ATOM 736 O ARG A 106 17.869 3.492 -4.966 1.00 18.91 O ATOM 737 CB ARG A 106 19.071 0.672 -5.992 1.00 20.52 C ATOM 738 CG ARG A 106 20.031 1.251 -4.988 1.00 25.55 C ATOM 739 CD ARG A 106 19.432 1.149 -3.614 1.00 25.88 C ATOM 740 NE ARG A 106 20.278 1.809 -2.623 1.00 43.48 N ATOM 741 CZ ARG A 106 20.174 1.631 -1.312 1.00 59.06 C ATOM 742 NH1 ARG A 106 19.281 0.782 -0.820 1.00 41.32 N ATOM 743 NH2 ARG A 106 20.993 2.286 -0.498 1.00 52.29 N ATOM 744 HA ARG A 106 17.193 1.105 -5.002 1.00 0.00 H ATOM 745 HB2 ARG A 106 18.958 -0.393 -5.790 1.00 0.00 H ATOM 746 HB3 ARG A 106 19.488 0.809 -6.990 1.00 0.00 H ATOM 747 HG2 ARG A 106 20.969 0.697 -5.019 1.00 0.00 H ATOM 748 HG3 ARG A 106 20.221 2.298 -5.226 1.00 0.00 H ATOM 749 HD2 ARG A 106 19.326 0.097 -3.348 1.00 0.00 H ATOM 750 HD3 ARG A 106 18.450 1.623 -3.617 1.00 0.00 H ATOM 751 HE ARG A 106 21.011 2.462 -2.968 1.00 0.00 H ATOM 752 HH12 ARG A 106 19.204 0.646 0.208 1.00 0.00 H ATOM 753 HH11 ARG A 106 18.658 0.252 -1.463 1.00 0.00 H ATOM 754 HH22 ARG A 106 20.919 2.153 0.531 1.00 0.00 H ATOM 755 HH21 ARG A 106 21.708 2.932 -0.889 1.00 0.00 H ATOM 756 H ARG A 106 17.275 0.120 -7.673 1.00 0.00 H ATOM 757 N ARG A 107 17.861 3.429 -7.193 1.00 16.99 N ATOM 758 CA ARG A 107 17.981 4.884 -7.244 1.00 17.36 C ATOM 759 C ARG A 107 16.725 5.555 -6.635 1.00 20.22 C ATOM 760 O ARG A 107 16.826 6.496 -5.859 1.00 19.99 O ATOM 761 CB ARG A 107 18.220 5.397 -8.664 1.00 17.24 C ATOM 762 CG ARG A 107 18.336 6.935 -8.696 1.00 26.78 C ATOM 763 CD ARG A 107 18.533 7.494 -10.088 1.00 30.26 C ATOM 764 NE ARG A 107 19.937 7.450 -10.470 1.00 55.47 N ATOM 765 CZ ARG A 107 20.869 8.276 -10.004 1.00 71.81 C ATOM 766 NH1 ARG A 107 20.546 9.217 -9.126 1.00 62.82 N ATOM 767 NH2 ARG A 107 22.128 8.157 -10.414 1.00 47.99 N ATOM 768 HA ARG A 107 18.855 5.153 -6.650 1.00 0.00 H ATOM 769 HB2 ARG A 107 19.144 4.964 -9.047 1.00 0.00 H ATOM 770 HB3 ARG A 107 17.387 5.091 -9.297 1.00 0.00 H ATOM 771 HG2 ARG A 107 17.423 7.359 -8.279 1.00 0.00 H ATOM 772 HG3 ARG A 107 19.186 7.231 -8.081 1.00 0.00 H ATOM 773 HD2 ARG A 107 18.189 8.528 -10.110 1.00 0.00 H ATOM 774 HD3 ARG A 107 17.951 6.904 -10.796 1.00 0.00 H ATOM 775 HE ARG A 107 20.231 6.723 -11.154 1.00 0.00 H ATOM 776 HH12 ARG A 107 21.276 9.862 -8.763 1.00 0.00 H ATOM 777 HH11 ARG A 107 19.562 9.309 -8.801 1.00 0.00 H ATOM 778 HH22 ARG A 107 22.857 8.803 -10.049 1.00 0.00 H ATOM 779 HH21 ARG A 107 22.384 7.418 -11.099 1.00 0.00 H ATOM 780 H ARG A 107 17.819 2.866 -8.066 1.00 0.00 H ATOM 781 N ASP A 108 15.547 5.061 -6.992 1.00 15.56 N ATOM 782 CA ASP A 108 14.299 5.604 -6.433 1.00 15.50 C ATOM 783 C ASP A 108 14.302 5.436 -4.907 1.00 20.30 C ATOM 784 O ASP A 108 13.999 6.370 -4.163 1.00 18.82 O ATOM 785 CB ASP A 108 13.101 4.868 -7.034 1.00 15.72 C ATOM 786 CG ASP A 108 12.911 5.175 -8.504 1.00 22.66 C ATOM 787 OD1 ASP A 108 13.043 4.263 -9.337 1.00 24.15 O ATOM 788 OD2 ASP A 108 12.671 6.345 -8.838 1.00 27.41 O ATOM 789 HA ASP A 108 14.225 6.664 -6.677 1.00 0.00 H ATOM 790 HB2 ASP A 108 13.255 3.795 -6.918 1.00 0.00 H ATOM 791 HB3 ASP A 108 12.201 5.165 -6.495 1.00 0.00 H ATOM 792 H ASP A 108 15.505 4.279 -7.676 1.00 0.00 H ATOM 793 N PHE A 109 14.648 4.228 -4.458 1.00 19.50 N ATOM 794 CA PHE A 109 14.692 3.897 -3.036 1.00 19.71 C ATOM 795 C PHE A 109 15.657 4.816 -2.289 1.00 24.74 C ATOM 796 O PHE A 109 15.331 5.363 -1.247 1.00 23.54 O ATOM 797 CB PHE A 109 15.148 2.442 -2.860 1.00 21.86 C ATOM 798 CG PHE A 109 15.164 1.977 -1.430 1.00 23.39 C ATOM 799 CD1 PHE A 109 16.314 2.083 -0.661 1.00 26.88 C ATOM 800 CD2 PHE A 109 14.022 1.443 -0.847 1.00 24.29 C ATOM 801 CE1 PHE A 109 16.334 1.631 0.658 1.00 27.77 C ATOM 802 CE2 PHE A 109 14.033 0.982 0.447 1.00 26.69 C ATOM 803 CZ PHE A 109 15.180 1.091 1.215 1.00 25.68 C ATOM 804 HA PHE A 109 13.692 4.030 -2.624 1.00 0.00 H ATOM 805 HB2 PHE A 109 14.471 1.799 -3.423 1.00 0.00 H ATOM 806 HB3 PHE A 109 16.156 2.347 -3.263 1.00 0.00 H ATOM 807 HD2 PHE A 109 13.101 1.389 -1.427 1.00 0.00 H ATOM 808 HE2 PHE A 109 13.136 0.529 0.870 1.00 0.00 H ATOM 809 HZ PHE A 109 15.178 0.755 2.252 1.00 0.00 H ATOM 810 HE1 PHE A 109 17.248 1.700 1.248 1.00 0.00 H ATOM 811 HD1 PHE A 109 17.212 2.525 -1.093 1.00 0.00 H ATOM 812 H PHE A 109 14.897 3.492 -5.149 1.00 0.00 H ATOM 813 N ALA A 110 16.863 4.941 -2.824 1.00 22.49 N ATOM 814 CA ALA A 110 17.914 5.751 -2.228 1.00 22.50 C ATOM 815 C ALA A 110 17.554 7.226 -2.206 1.00 24.08 C ATOM 816 O ALA A 110 17.841 7.911 -1.230 1.00 24.14 O ATOM 817 CB ALA A 110 19.236 5.537 -2.984 1.00 23.57 C ATOM 818 HA ALA A 110 18.031 5.430 -1.193 1.00 0.00 H ATOM 819 HB1 ALA A 110 19.518 4.486 -2.929 1.00 0.00 H ATOM 820 HB2 ALA A 110 19.108 5.826 -4.027 1.00 0.00 H ATOM 821 HB3 ALA A 110 20.016 6.148 -2.530 1.00 0.00 H ATOM 822 H ALA A 110 17.067 4.437 -3.710 1.00 0.00 H ATOM 823 N GLU A 111 16.916 7.708 -3.271 1.00 19.52 N ATOM 824 CA GLU A 111 16.535 9.109 -3.352 1.00 20.84 C ATOM 825 C GLU A 111 15.434 9.444 -2.370 1.00 27.13 C ATOM 826 O GLU A 111 15.474 10.482 -1.693 1.00 27.01 O ATOM 827 CB GLU A 111 16.117 9.488 -4.785 1.00 22.39 C ATOM 828 CG GLU A 111 17.317 9.886 -5.649 1.00 36.33 C ATOM 829 CD GLU A 111 16.954 10.153 -7.096 1.00 60.53 C ATOM 830 OE1 GLU A 111 15.750 10.296 -7.392 1.00 65.57 O ATOM 831 OE2 GLU A 111 17.878 10.225 -7.936 1.00 52.46 O ATOM 832 HA GLU A 111 17.412 9.699 -3.084 1.00 0.00 H ATOM 833 HB2 GLU A 111 15.621 8.633 -5.244 1.00 0.00 H ATOM 834 HB3 GLU A 111 15.423 10.327 -4.739 1.00 0.00 H ATOM 835 HG2 GLU A 111 17.760 10.790 -5.231 1.00 0.00 H ATOM 836 HG3 GLU A 111 18.048 9.078 -5.619 1.00 0.00 H ATOM 837 H GLU A 111 16.686 7.070 -4.060 1.00 0.00 H ATOM 838 N MET A 112 14.441 8.566 -2.296 1.00 23.02 N ATOM 839 CA MET A 112 13.338 8.790 -1.376 1.00 22.82 C ATOM 840 C MET A 112 13.920 8.796 0.034 1.00 28.46 C ATOM 841 O MET A 112 13.624 9.676 0.823 1.00 29.06 O ATOM 842 CB MET A 112 12.278 7.681 -1.524 1.00 24.75 C ATOM 843 CG MET A 112 11.104 7.834 -0.581 1.00 27.71 C ATOM 844 SD MET A 112 10.148 9.309 -0.949 1.00 31.00 S ATOM 845 CE MET A 112 9.242 8.807 -2.390 1.00 28.00 C ATOM 846 HA MET A 112 12.845 9.738 -1.589 1.00 0.00 H ATOM 847 HB2 MET A 112 11.903 7.697 -2.547 1.00 0.00 H ATOM 848 HB3 MET A 112 12.754 6.720 -1.328 1.00 0.00 H ATOM 849 HG2 MET A 112 11.477 7.900 0.441 1.00 0.00 H ATOM 850 HG3 MET A 112 10.458 6.961 -0.675 1.00 0.00 H ATOM 851 HE1 MET A 112 9.941 8.541 -3.183 1.00 0.00 H ATOM 852 HE2 MET A 112 8.622 7.944 -2.146 1.00 0.00 H ATOM 853 HE3 MET A 112 8.608 9.629 -2.724 1.00 0.00 H ATOM 854 H MET A 112 14.452 7.717 -2.897 1.00 0.00 H ATOM 855 N SER A 113 14.752 7.806 0.344 1.00 26.62 N ATOM 856 CA SER A 113 15.355 7.704 1.670 1.00 28.33 C ATOM 857 C SER A 113 16.129 8.948 2.107 1.00 37.15 C ATOM 858 O SER A 113 16.100 9.319 3.271 1.00 38.25 O ATOM 859 CB SER A 113 16.298 6.505 1.749 1.00 31.55 C ATOM 860 OG SER A 113 15.596 5.291 1.584 1.00 39.44 O ATOM 861 HA SER A 113 14.510 7.587 2.348 1.00 0.00 H ATOM 862 HB2 SER A 113 16.789 6.502 2.722 1.00 0.00 H ATOM 863 HB3 SER A 113 17.049 6.591 0.964 1.00 0.00 H ATOM 864 HG SER A 113 15.151 5.286 0.699 1.00 0.00 H ATOM 865 H SER A 113 14.978 7.088 -0.374 1.00 0.00 H ATOM 866 N SER A 114 16.881 9.551 1.197 1.00 36.00 N ATOM 867 CA SER A 114 17.683 10.706 1.574 1.00 37.03 C ATOM 868 C SER A 114 16.984 12.054 1.449 1.00 40.87 C ATOM 869 O SER A 114 17.436 13.025 2.037 1.00 41.01 O ATOM 870 CB SER A 114 19.051 10.699 0.877 1.00 40.69 C ATOM 871 OG SER A 114 18.912 10.481 -0.510 1.00 48.68 O ATOM 872 HA SER A 114 17.843 10.589 2.646 1.00 0.00 H ATOM 873 HB2 SER A 114 19.664 9.905 1.303 1.00 0.00 H ATOM 874 HB3 SER A 114 19.539 11.660 1.040 1.00 0.00 H ATOM 875 HG SER A 114 18.473 9.607 -0.663 1.00 0.00 H ATOM 876 H SER A 114 16.898 9.200 0.218 1.00 0.00 H ATOM 877 N GLN A 115 15.853 12.100 0.749 1.00 36.98 N ATOM 878 CA GLN A 115 15.111 13.349 0.565 1.00 36.49 C ATOM 879 C GLN A 115 13.786 13.482 1.315 1.00 39.41 C ATOM 880 O GLN A 115 12.974 14.349 0.980 1.00 38.47 O ATOM 881 CB GLN A 115 14.858 13.611 -0.925 1.00 37.84 C ATOM 882 CG GLN A 115 16.127 13.786 -1.764 1.00 48.11 C ATOM 883 CD GLN A 115 15.870 13.580 -3.237 1.00 63.70 C ATOM 884 OE1 GLN A 115 14.761 13.796 -3.723 1.00 61.11 O ATOM 885 NE2 GLN A 115 16.893 13.146 -3.958 1.00 59.23 N ATOM 886 HA GLN A 115 15.769 14.095 1.010 1.00 0.00 H ATOM 887 HB2 GLN A 115 14.296 12.768 -1.328 1.00 0.00 H ATOM 888 HB3 GLN A 115 14.262 14.519 -1.015 1.00 0.00 H ATOM 889 HG2 GLN A 115 16.512 14.794 -1.612 1.00 0.00 H ATOM 890 HG3 GLN A 115 16.870 13.061 -1.432 1.00 0.00 H ATOM 891 HE22 GLN A 115 17.814 12.977 -3.505 1.00 0.00 H ATOM 892 HE21 GLN A 115 16.775 12.975 -4.977 1.00 0.00 H ATOM 893 H GLN A 115 15.486 11.226 0.321 1.00 0.00 H ATOM 894 N LEU A 116 13.559 12.652 2.329 1.00 34.22 N ATOM 895 CA LEU A 116 12.312 12.731 3.097 1.00 33.52 C ATOM 896 C LEU A 116 12.107 14.029 3.902 1.00 37.38 C ATOM 897 O LEU A 116 10.984 14.538 3.982 1.00 36.34 O ATOM 898 CB LEU A 116 12.164 11.527 4.041 1.00 33.47 C ATOM 899 CG LEU A 116 11.476 10.254 3.546 1.00 37.15 C ATOM 900 CD1 LEU A 116 11.218 9.341 4.752 1.00 36.65 C ATOM 901 CD2 LEU A 116 10.178 10.552 2.814 1.00 38.28 C ATOM 902 HA LEU A 116 11.536 12.725 2.331 1.00 0.00 H ATOM 903 HB2 LEU A 116 13.170 11.243 4.351 1.00 0.00 H ATOM 904 HB3 LEU A 116 11.602 11.873 4.909 1.00 0.00 H ATOM 905 HG LEU A 116 12.130 9.759 2.828 1.00 0.00 H ATOM 906 HD21 LEU A 116 9.493 11.069 3.487 1.00 0.00 H ATOM 907 HD22 LEU A 116 10.386 11.183 1.950 1.00 0.00 H ATOM 908 HD23 LEU A 116 9.727 9.617 2.482 1.00 0.00 H ATOM 909 HD11 LEU A 116 12.167 9.092 5.227 1.00 0.00 H ATOM 910 HD12 LEU A 116 10.577 9.858 5.467 1.00 0.00 H ATOM 911 HD13 LEU A 116 10.727 8.428 4.416 1.00 0.00 H ATOM 912 H LEU A 116 14.273 11.939 2.580 1.00 0.00 H ATOM 913 N HIS A 117 13.163 14.526 4.539 1.00 36.40 N ATOM 914 CA HIS A 117 13.061 15.722 5.403 1.00 37.72 C ATOM 915 C HIS A 117 11.925 15.491 6.392 1.00 35.32 C ATOM 916 O HIS A 117 11.053 16.338 6.594 1.00 35.19 O ATOM 917 CB HIS A 117 12.760 16.983 4.584 1.00 40.80 C ATOM 918 CG HIS A 117 13.873 17.400 3.672 1.00 46.07 C ATOM 919 ND1 HIS A 117 14.956 16.591 3.398 1.00 49.05 N ATOM 920 CD2 HIS A 117 14.069 18.543 2.974 1.00 49.27 C ATOM 921 CE1 HIS A 117 15.766 17.216 2.560 1.00 49.10 C ATOM 922 NE2 HIS A 117 15.251 18.402 2.287 1.00 49.42 N ATOM 923 HA HIS A 117 14.012 15.872 5.914 1.00 0.00 H ATOM 924 HB2 HIS A 117 11.873 16.795 3.979 1.00 0.00 H ATOM 925 HB3 HIS A 117 12.559 17.801 5.276 1.00 0.00 H ATOM 926 HD2 HIS A 117 13.412 19.413 2.959 1.00 0.00 H ATOM 927 HE1 HIS A 117 16.700 16.820 2.162 1.00 0.00 H ATOM 928 H HIS A 117 14.086 14.061 4.427 1.00 0.00 H ATOM 929 N LEU A 118 11.939 14.307 6.983 1.00 26.93 N ATOM 930 CA LEU A 118 10.904 13.864 7.906 1.00 25.06 C ATOM 931 C LEU A 118 10.893 14.521 9.289 1.00 22.24 C ATOM 932 O LEU A 118 11.897 14.520 9.992 1.00 19.72 O ATOM 933 CB LEU A 118 11.093 12.356 8.102 1.00 26.08 C ATOM 934 CG LEU A 118 10.034 11.544 8.830 1.00 32.84 C ATOM 935 CD1 LEU A 118 8.782 11.449 7.968 1.00 33.45 C ATOM 936 CD2 LEU A 118 10.605 10.161 9.128 1.00 35.10 C ATOM 937 HA LEU A 118 9.956 14.151 7.451 1.00 0.00 H ATOM 938 HB2 LEU A 118 11.196 11.920 7.108 1.00 0.00 H ATOM 939 HB3 LEU A 118 12.024 12.225 8.653 1.00 0.00 H ATOM 940 HG LEU A 118 9.759 12.024 9.769 1.00 0.00 H ATOM 941 HD21 LEU A 118 10.873 9.671 8.192 1.00 0.00 H ATOM 942 HD22 LEU A 118 11.492 10.263 9.753 1.00 0.00 H ATOM 943 HD23 LEU A 118 9.857 9.565 9.651 1.00 0.00 H ATOM 944 HD11 LEU A 118 8.400 12.451 7.772 1.00 0.00 H ATOM 945 HD12 LEU A 118 9.028 10.962 7.024 1.00 0.00 H ATOM 946 HD13 LEU A 118 8.025 10.866 8.492 1.00 0.00 H ATOM 947 H LEU A 118 12.728 13.661 6.778 1.00 0.00 H ATOM 948 N THR A 119 9.741 15.050 9.690 1.00 16.21 N ATOM 949 CA THR A 119 9.553 15.525 11.063 1.00 15.15 C ATOM 950 C THR A 119 8.121 15.160 11.381 1.00 16.76 C ATOM 951 O THR A 119 7.363 14.792 10.486 1.00 16.27 O ATOM 952 CB THR A 119 9.796 17.041 11.294 1.00 20.70 C ATOM 953 OG1 THR A 119 8.672 17.784 10.837 1.00 21.91 O ATOM 954 CG2 THR A 119 11.049 17.528 10.635 1.00 22.64 C ATOM 955 HA THR A 119 10.297 15.064 11.712 1.00 0.00 H ATOM 956 HB THR A 119 9.925 17.193 12.366 1.00 0.00 H ATOM 957 HG1 THR A 119 8.833 18.749 10.987 1.00 0.00 H ATOM 958 HG23 THR A 119 11.898 16.948 10.997 1.00 0.00 H ATOM 959 HG21 THR A 119 10.960 17.409 9.555 1.00 0.00 H ATOM 960 HG22 THR A 119 11.198 18.581 10.875 1.00 0.00 H ATOM 961 H THR A 119 8.955 15.128 9.013 1.00 0.00 H ATOM 962 N PRO A 120 7.737 15.234 12.658 1.00 13.59 N ATOM 963 CA PRO A 120 6.349 14.920 12.976 1.00 14.63 C ATOM 964 C PRO A 120 5.384 15.942 12.376 1.00 19.01 C ATOM 965 O PRO A 120 4.181 15.678 12.276 1.00 18.15 O ATOM 966 CB PRO A 120 6.320 14.992 14.519 1.00 16.44 C ATOM 967 CG PRO A 120 7.698 14.686 14.928 1.00 19.44 C ATOM 968 CD PRO A 120 8.591 15.260 13.862 1.00 14.64 C ATOM 969 HA PRO A 120 6.037 13.956 12.574 1.00 0.00 H ATOM 970 HD3 PRO A 120 8.889 16.279 14.108 1.00 0.00 H ATOM 971 HD2 PRO A 120 9.481 14.646 13.724 1.00 0.00 H ATOM 972 HG3 PRO A 120 7.840 13.608 15.000 1.00 0.00 H ATOM 973 HG2 PRO A 120 7.917 15.145 15.892 1.00 0.00 H ATOM 974 HB2 PRO A 120 6.031 15.988 14.853 1.00 0.00 H ATOM 975 HB3 PRO A 120 5.625 14.258 14.926 1.00 0.00 H ATOM 976 N PHE A 121 5.896 17.112 11.993 1.00 16.13 N ATOM 977 CA PHE A 121 5.027 18.136 11.397 1.00 14.85 C ATOM 978 C PHE A 121 4.735 17.889 9.925 1.00 16.10 C ATOM 979 O PHE A 121 3.777 18.446 9.393 1.00 13.75 O ATOM 980 CB PHE A 121 5.617 19.547 11.531 1.00 15.37 C ATOM 981 CG PHE A 121 5.886 19.956 12.952 1.00 16.32 C ATOM 982 CD1 PHE A 121 7.190 20.120 13.399 1.00 18.54 C ATOM 983 CD2 PHE A 121 4.857 20.084 13.853 1.00 16.80 C ATOM 984 CE1 PHE A 121 7.446 20.487 14.694 1.00 18.89 C ATOM 985 CE2 PHE A 121 5.114 20.420 15.166 1.00 20.28 C ATOM 986 CZ PHE A 121 6.426 20.629 15.580 1.00 17.07 C ATOM 987 HA PHE A 121 4.097 18.065 11.961 1.00 0.00 H ATOM 988 HB2 PHE A 121 6.556 19.582 10.979 1.00 0.00 H ATOM 989 HB3 PHE A 121 4.914 20.257 11.095 1.00 0.00 H ATOM 990 HD2 PHE A 121 3.830 19.919 13.528 1.00 0.00 H ATOM 991 HE2 PHE A 121 4.293 20.521 15.876 1.00 0.00 H ATOM 992 HZ PHE A 121 6.635 20.906 16.613 1.00 0.00 H ATOM 993 HE1 PHE A 121 8.472 20.666 15.015 1.00 0.00 H ATOM 994 HD1 PHE A 121 8.020 19.955 12.712 1.00 0.00 H ATOM 995 H PHE A 121 6.911 17.300 12.116 1.00 0.00 H ATOM 996 N THR A 122 5.588 17.114 9.260 1.00 12.03 N ATOM 997 CA THR A 122 5.425 16.874 7.822 1.00 12.23 C ATOM 998 C THR A 122 5.054 15.447 7.403 1.00 17.41 C ATOM 999 O THR A 122 4.684 15.220 6.240 1.00 17.03 O ATOM 1000 CB THR A 122 6.699 17.263 7.061 1.00 19.66 C ATOM 1001 OG1 THR A 122 7.778 16.448 7.524 1.00 20.99 O ATOM 1002 CG2 THR A 122 7.043 18.765 7.253 1.00 19.79 C ATOM 1003 HA THR A 122 4.571 17.501 7.565 1.00 0.00 H ATOM 1004 HB THR A 122 6.534 17.101 5.996 1.00 0.00 H ATOM 1005 HG1 THR A 122 8.606 16.691 7.039 1.00 0.00 H ATOM 1006 HG23 THR A 122 6.213 19.375 6.896 1.00 0.00 H ATOM 1007 HG21 THR A 122 7.214 18.965 8.311 1.00 0.00 H ATOM 1008 HG22 THR A 122 7.942 19.006 6.686 1.00 0.00 H ATOM 1009 H THR A 122 6.381 16.672 9.767 1.00 0.00 H ATOM 1010 N ALA A 123 5.283 14.475 8.283 1.00 14.79 N ATOM 1011 CA ALA A 123 5.087 13.056 7.925 1.00 14.98 C ATOM 1012 C ALA A 123 3.785 12.737 7.199 1.00 18.19 C ATOM 1013 O ALA A 123 3.776 12.094 6.157 1.00 17.53 O ATOM 1014 CB ALA A 123 5.244 12.167 9.153 1.00 15.34 C ATOM 1015 HA ALA A 123 5.872 12.842 7.199 1.00 0.00 H ATOM 1016 HB1 ALA A 123 6.245 12.293 9.566 1.00 0.00 H ATOM 1017 HB2 ALA A 123 4.503 12.449 9.901 1.00 0.00 H ATOM 1018 HB3 ALA A 123 5.096 11.126 8.867 1.00 0.00 H ATOM 1019 H ALA A 123 5.606 14.720 9.241 1.00 0.00 H ATOM 1020 N ARG A 124 2.672 13.162 7.761 1.00 15.57 N ATOM 1021 CA ARG A 124 1.379 12.893 7.141 1.00 14.92 C ATOM 1022 C ARG A 124 1.227 13.533 5.763 1.00 17.36 C ATOM 1023 O ARG A 124 0.633 12.948 4.860 1.00 16.05 O ATOM 1024 CB ARG A 124 0.223 13.344 8.059 1.00 15.73 C ATOM 1025 CG ARG A 124 -1.132 12.934 7.481 1.00 26.39 C ATOM 1026 CD ARG A 124 -2.168 12.572 8.512 1.00 47.41 C ATOM 1027 NE ARG A 124 -2.953 11.416 8.070 1.00 69.64 N ATOM 1028 CZ ARG A 124 -3.660 11.364 6.940 1.00 88.67 C ATOM 1029 NH1 ARG A 124 -3.737 12.425 6.149 1.00 82.49 N ATOM 1030 NH2 ARG A 124 -4.352 10.272 6.629 1.00 73.56 N ATOM 1031 HA ARG A 124 1.333 11.813 7.000 1.00 0.00 H ATOM 1032 HB2 ARG A 124 0.346 12.883 9.039 1.00 0.00 H ATOM 1033 HB3 ARG A 124 0.253 14.429 8.162 1.00 0.00 H ATOM 1034 HG2 ARG A 124 -1.516 13.766 6.890 1.00 0.00 H ATOM 1035 HG3 ARG A 124 -0.979 12.070 6.834 1.00 0.00 H ATOM 1036 HD2 ARG A 124 -2.834 13.421 8.664 1.00 0.00 H ATOM 1037 HD3 ARG A 124 -1.670 12.330 9.451 1.00 0.00 H ATOM 1038 HE ARG A 124 -2.959 10.575 8.682 1.00 0.00 H ATOM 1039 HH12 ARG A 124 -4.290 12.379 5.269 1.00 0.00 H ATOM 1040 HH11 ARG A 124 -3.245 13.304 6.408 1.00 0.00 H ATOM 1041 HH22 ARG A 124 -4.901 10.238 5.746 1.00 0.00 H ATOM 1042 HH21 ARG A 124 -4.344 9.452 7.268 1.00 0.00 H ATOM 1043 H ARG A 124 2.715 13.694 8.654 1.00 0.00 H ATOM 1044 N GLY A 125 1.764 14.735 5.585 1.00 14.97 N ATOM 1045 CA GLY A 125 1.656 15.412 4.297 1.00 13.23 C ATOM 1046 C GLY A 125 2.571 14.754 3.289 1.00 16.33 C ATOM 1047 O GLY A 125 2.221 14.601 2.126 1.00 17.78 O ATOM 1048 HA3 GLY A 125 1.940 16.458 4.414 1.00 0.00 H ATOM 1049 HA2 GLY A 125 0.627 15.353 3.943 1.00 0.00 H ATOM 1050 H GLY A 125 2.265 15.197 6.370 1.00 0.00 H ATOM 1051 N ARG A 126 3.764 14.366 3.719 1.00 13.20 N ATOM 1052 CA ARG A 126 4.681 13.679 2.798 1.00 14.28 C ATOM 1053 C ARG A 126 4.043 12.346 2.365 1.00 17.34 C ATOM 1054 O ARG A 126 4.046 12.003 1.198 1.00 16.19 O ATOM 1055 CB ARG A 126 6.027 13.403 3.484 1.00 13.41 C ATOM 1056 CG ARG A 126 6.996 12.588 2.606 1.00 26.25 C ATOM 1057 CD ARG A 126 7.968 13.513 1.864 1.00 27.37 C ATOM 1058 NE ARG A 126 7.288 14.661 1.268 1.00 32.36 N ATOM 1059 CZ ARG A 126 7.156 14.854 -0.038 1.00 44.41 C ATOM 1060 NH1 ARG A 126 7.704 13.997 -0.898 1.00 29.56 N ATOM 1061 NH2 ARG A 126 6.519 15.929 -0.485 1.00 34.72 N ATOM 1062 HA ARG A 126 4.858 14.313 1.929 1.00 0.00 H ATOM 1063 HB2 ARG A 126 6.496 14.357 3.726 1.00 0.00 H ATOM 1064 HB3 ARG A 126 5.841 12.848 4.403 1.00 0.00 H ATOM 1065 HG2 ARG A 126 7.564 11.906 3.239 1.00 0.00 H ATOM 1066 HG3 ARG A 126 6.422 12.014 1.878 1.00 0.00 H ATOM 1067 HD2 ARG A 126 8.459 12.946 1.073 1.00 0.00 H ATOM 1068 HD3 ARG A 126 8.717 13.875 2.569 1.00 0.00 H ATOM 1069 HE ARG A 126 6.881 15.372 1.909 1.00 0.00 H ATOM 1070 HH12 ARG A 126 7.600 14.149 -1.922 1.00 0.00 H ATOM 1071 HH11 ARG A 126 8.236 13.176 -0.546 1.00 0.00 H ATOM 1072 HH22 ARG A 126 6.414 16.083 -1.508 1.00 0.00 H ATOM 1073 HH21 ARG A 126 6.125 16.617 0.188 1.00 0.00 H ATOM 1074 H ARG A 126 4.049 14.547 4.703 1.00 0.00 H ATOM 1075 N PHE A 127 3.476 11.614 3.319 1.00 13.41 N ATOM 1076 CA PHE A 127 2.837 10.329 2.992 1.00 14.32 C ATOM 1077 C PHE A 127 1.683 10.502 1.983 1.00 19.00 C ATOM 1078 O PHE A 127 1.606 9.792 0.988 1.00 16.34 O ATOM 1079 CB PHE A 127 2.314 9.663 4.280 1.00 15.31 C ATOM 1080 CG PHE A 127 1.633 8.337 4.048 1.00 16.53 C ATOM 1081 CD1 PHE A 127 0.279 8.277 3.754 1.00 17.94 C ATOM 1082 CD2 PHE A 127 2.348 7.161 4.154 1.00 17.46 C ATOM 1083 CE1 PHE A 127 -0.334 7.054 3.503 1.00 19.57 C ATOM 1084 CE2 PHE A 127 1.740 5.932 3.927 1.00 20.27 C ATOM 1085 CZ PHE A 127 0.402 5.881 3.591 1.00 18.10 C ATOM 1086 HA PHE A 127 3.589 9.692 2.527 1.00 0.00 H ATOM 1087 HB2 PHE A 127 3.158 9.503 4.951 1.00 0.00 H ATOM 1088 HB3 PHE A 127 1.600 10.339 4.751 1.00 0.00 H ATOM 1089 HD2 PHE A 127 3.405 7.197 4.420 1.00 0.00 H ATOM 1090 HE2 PHE A 127 2.318 5.012 4.014 1.00 0.00 H ATOM 1091 HZ PHE A 127 -0.075 4.921 3.395 1.00 0.00 H ATOM 1092 HE1 PHE A 127 -1.391 7.017 3.238 1.00 0.00 H ATOM 1093 HD1 PHE A 127 -0.309 9.194 3.719 1.00 0.00 H ATOM 1094 H PHE A 127 3.484 11.951 4.303 1.00 0.00 H ATOM 1095 N ALA A 128 0.779 11.445 2.253 1.00 16.53 N ATOM 1096 CA ALA A 128 -0.365 11.669 1.375 1.00 15.65 C ATOM 1097 C ALA A 128 0.081 12.054 -0.036 1.00 18.15 C ATOM 1098 O ALA A 128 -0.445 11.561 -1.026 1.00 18.03 O ATOM 1099 CB ALA A 128 -1.283 12.767 1.962 1.00 15.87 C ATOM 1100 HA ALA A 128 -0.922 10.735 1.308 1.00 0.00 H ATOM 1101 HB1 ALA A 128 -1.641 12.453 2.942 1.00 0.00 H ATOM 1102 HB2 ALA A 128 -0.720 13.695 2.059 1.00 0.00 H ATOM 1103 HB3 ALA A 128 -2.132 12.923 1.296 1.00 0.00 H ATOM 1104 H ALA A 128 0.891 12.031 3.105 1.00 0.00 H ATOM 1105 N THR A 129 1.047 12.956 -0.112 1.00 15.39 N ATOM 1106 CA THR A 129 1.546 13.440 -1.389 1.00 16.11 C ATOM 1107 C THR A 129 2.174 12.350 -2.232 1.00 17.28 C ATOM 1108 O THR A 129 1.907 12.246 -3.416 1.00 15.51 O ATOM 1109 CB THR A 129 2.542 14.613 -1.217 1.00 26.61 C ATOM 1110 OG1 THR A 129 1.823 15.768 -0.773 1.00 31.31 O ATOM 1111 CG2 THR A 129 3.187 14.937 -2.570 1.00 26.86 C ATOM 1112 HA THR A 129 0.667 13.803 -1.921 1.00 0.00 H ATOM 1113 HB THR A 129 3.309 14.337 -0.494 1.00 0.00 H ATOM 1114 HG1 THR A 129 1.385 15.570 0.092 1.00 0.00 H ATOM 1115 HG23 THR A 129 3.740 14.067 -2.925 1.00 0.00 H ATOM 1116 HG21 THR A 129 2.409 15.193 -3.290 1.00 0.00 H ATOM 1117 HG22 THR A 129 3.868 15.780 -2.454 1.00 0.00 H ATOM 1118 H THR A 129 1.461 13.329 0.766 1.00 0.00 H ATOM 1119 N VAL A 130 3.055 11.574 -1.615 1.00 12.78 N ATOM 1120 CA VAL A 130 3.762 10.517 -2.336 1.00 13.43 C ATOM 1121 C VAL A 130 2.782 9.428 -2.777 1.00 17.77 C ATOM 1122 O VAL A 130 2.792 9.001 -3.928 1.00 17.43 O ATOM 1123 CB VAL A 130 4.895 9.949 -1.461 1.00 17.36 C ATOM 1124 CG1 VAL A 130 5.405 8.624 -2.018 1.00 17.86 C ATOM 1125 CG2 VAL A 130 5.997 10.995 -1.324 1.00 16.46 C ATOM 1126 HA VAL A 130 4.214 10.933 -3.236 1.00 0.00 H ATOM 1127 HB VAL A 130 4.515 9.729 -0.463 1.00 0.00 H ATOM 1128 HG11 VAL A 130 4.588 7.903 -2.043 1.00 0.00 H ATOM 1129 HG12 VAL A 130 5.786 8.778 -3.027 1.00 0.00 H ATOM 1130 HG13 VAL A 130 6.204 8.247 -1.380 1.00 0.00 H ATOM 1131 HG21 VAL A 130 6.386 11.242 -2.312 1.00 0.00 H ATOM 1132 HG22 VAL A 130 5.589 11.892 -0.858 1.00 0.00 H ATOM 1133 HG23 VAL A 130 6.800 10.596 -0.705 1.00 0.00 H ATOM 1134 H VAL A 130 3.246 11.720 -0.603 1.00 0.00 H ATOM 1135 N VAL A 131 1.884 9.029 -1.878 1.00 15.43 N ATOM 1136 CA VAL A 131 0.909 7.987 -2.210 1.00 14.01 C ATOM 1137 C VAL A 131 -0.004 8.392 -3.373 1.00 17.97 C ATOM 1138 O VAL A 131 -0.259 7.608 -4.273 1.00 17.33 O ATOM 1139 CB VAL A 131 0.160 7.526 -0.968 1.00 18.52 C ATOM 1140 CG1 VAL A 131 -0.910 6.548 -1.339 1.00 18.93 C ATOM 1141 CG2 VAL A 131 1.152 6.864 0.029 1.00 17.83 C ATOM 1142 HA VAL A 131 1.455 7.118 -2.577 1.00 0.00 H ATOM 1143 HB VAL A 131 -0.303 8.393 -0.496 1.00 0.00 H ATOM 1144 HG11 VAL A 131 -1.613 7.023 -2.023 1.00 0.00 H ATOM 1145 HG12 VAL A 131 -0.458 5.683 -1.824 1.00 0.00 H ATOM 1146 HG13 VAL A 131 -1.436 6.228 -0.439 1.00 0.00 H ATOM 1147 HG21 VAL A 131 1.625 6.005 -0.447 1.00 0.00 H ATOM 1148 HG22 VAL A 131 1.915 7.588 0.315 1.00 0.00 H ATOM 1149 HG23 VAL A 131 0.609 6.536 0.916 1.00 0.00 H ATOM 1150 H VAL A 131 1.875 9.461 -0.932 1.00 0.00 H ATOM 1151 N GLU A 132 -0.428 9.651 -3.395 1.00 15.19 N ATOM 1152 CA GLU A 132 -1.268 10.128 -4.483 1.00 14.05 C ATOM 1153 C GLU A 132 -0.476 10.113 -5.788 1.00 16.30 C ATOM 1154 O GLU A 132 -1.005 9.770 -6.837 1.00 15.49 O ATOM 1155 CB GLU A 132 -1.815 11.526 -4.191 1.00 15.93 C ATOM 1156 CG GLU A 132 -2.847 12.010 -5.220 1.00 24.84 C ATOM 1157 CD GLU A 132 -2.201 12.537 -6.488 1.00 39.80 C ATOM 1158 OE1 GLU A 132 -2.860 12.542 -7.553 1.00 45.35 O ATOM 1159 OE2 GLU A 132 -1.026 12.932 -6.429 1.00 36.80 O ATOM 1160 HA GLU A 132 -2.124 9.460 -4.580 1.00 0.00 H ATOM 1161 HB2 GLU A 132 -2.287 11.513 -3.209 1.00 0.00 H ATOM 1162 HB3 GLU A 132 -0.981 12.228 -4.183 1.00 0.00 H ATOM 1163 HG2 GLU A 132 -3.499 11.176 -5.480 1.00 0.00 H ATOM 1164 HG3 GLU A 132 -3.440 12.807 -4.772 1.00 0.00 H ATOM 1165 H GLU A 132 -0.157 10.300 -2.629 1.00 0.00 H ATOM 1166 N GLU A 133 0.811 10.436 -5.723 1.00 14.14 N ATOM 1167 CA GLU A 133 1.628 10.429 -6.923 1.00 14.44 C ATOM 1168 C GLU A 133 1.869 9.003 -7.417 1.00 18.45 C ATOM 1169 O GLU A 133 1.853 8.720 -8.623 1.00 17.65 O ATOM 1170 CB GLU A 133 2.977 11.104 -6.672 1.00 15.95 C ATOM 1171 CG GLU A 133 2.891 12.609 -6.506 1.00 24.57 C ATOM 1172 CD GLU A 133 4.198 13.226 -6.036 1.00 42.62 C ATOM 1173 OE1 GLU A 133 5.165 12.480 -5.759 1.00 35.68 O ATOM 1174 OE2 GLU A 133 4.245 14.467 -5.897 1.00 42.94 O ATOM 1175 HA GLU A 133 1.083 10.985 -7.686 1.00 0.00 H ATOM 1176 HB2 GLU A 133 3.408 10.683 -5.764 1.00 0.00 H ATOM 1177 HB3 GLU A 133 3.631 10.889 -7.517 1.00 0.00 H ATOM 1178 HG2 GLU A 133 2.622 13.051 -7.466 1.00 0.00 H ATOM 1179 HG3 GLU A 133 2.116 12.835 -5.774 1.00 0.00 H ATOM 1180 H GLU A 133 1.235 10.695 -4.809 1.00 0.00 H ATOM 1181 N LEU A 134 2.109 8.109 -6.469 1.00 12.93 N ATOM 1182 CA LEU A 134 2.405 6.726 -6.793 1.00 12.39 C ATOM 1183 C LEU A 134 1.284 6.084 -7.584 1.00 15.09 C ATOM 1184 O LEU A 134 1.535 5.339 -8.522 1.00 15.00 O ATOM 1185 CB LEU A 134 2.668 5.927 -5.496 1.00 12.69 C ATOM 1186 CG LEU A 134 2.905 4.414 -5.628 1.00 16.60 C ATOM 1187 CD1 LEU A 134 4.037 4.132 -6.625 1.00 15.87 C ATOM 1188 CD2 LEU A 134 3.268 3.839 -4.247 1.00 13.57 C ATOM 1189 HA LEU A 134 3.299 6.712 -7.417 1.00 0.00 H ATOM 1190 HB2 LEU A 134 3.551 6.356 -5.022 1.00 0.00 H ATOM 1191 HB3 LEU A 134 1.804 6.067 -4.846 1.00 0.00 H ATOM 1192 HG LEU A 134 1.996 3.940 -5.998 1.00 0.00 H ATOM 1193 HD21 LEU A 134 4.174 4.322 -3.880 1.00 0.00 H ATOM 1194 HD22 LEU A 134 2.449 4.023 -3.551 1.00 0.00 H ATOM 1195 HD23 LEU A 134 3.437 2.766 -4.335 1.00 0.00 H ATOM 1196 HD11 LEU A 134 3.768 4.535 -7.601 1.00 0.00 H ATOM 1197 HD12 LEU A 134 4.954 4.605 -6.275 1.00 0.00 H ATOM 1198 HD13 LEU A 134 4.190 3.056 -6.705 1.00 0.00 H ATOM 1199 H LEU A 134 2.085 8.405 -5.472 1.00 0.00 H ATOM 1200 N PHE A 135 0.045 6.319 -7.159 1.00 12.25 N ATOM 1201 CA PHE A 135 -1.113 5.696 -7.794 1.00 12.80 C ATOM 1202 C PHE A 135 -1.880 6.547 -8.808 1.00 21.67 C ATOM 1203 O PHE A 135 -2.943 6.146 -9.293 1.00 19.21 O ATOM 1204 CB PHE A 135 -2.072 5.151 -6.743 1.00 12.43 C ATOM 1205 CG PHE A 135 -1.468 4.035 -5.919 1.00 12.69 C ATOM 1206 CD1 PHE A 135 -1.064 4.253 -4.600 1.00 14.07 C ATOM 1207 CD2 PHE A 135 -1.173 2.817 -6.513 1.00 14.62 C ATOM 1208 CE1 PHE A 135 -0.492 3.231 -3.853 1.00 13.91 C ATOM 1209 CE2 PHE A 135 -0.595 1.774 -5.778 1.00 15.76 C ATOM 1210 CZ PHE A 135 -0.264 1.979 -4.444 1.00 13.06 C ATOM 1211 HA PHE A 135 -0.679 4.892 -8.388 1.00 0.00 H ATOM 1212 HB2 PHE A 135 -2.355 5.964 -6.074 1.00 0.00 H ATOM 1213 HB3 PHE A 135 -2.961 4.771 -7.246 1.00 0.00 H ATOM 1214 HD2 PHE A 135 -1.395 2.669 -7.570 1.00 0.00 H ATOM 1215 HE2 PHE A 135 -0.406 0.809 -6.249 1.00 0.00 H ATOM 1216 HZ PHE A 135 0.172 1.169 -3.858 1.00 0.00 H ATOM 1217 HE1 PHE A 135 -0.221 3.401 -2.811 1.00 0.00 H ATOM 1218 HD1 PHE A 135 -1.199 5.237 -4.151 1.00 0.00 H ATOM 1219 H PHE A 135 -0.102 6.962 -6.355 1.00 0.00 H ATOM 1220 N ARG A 136 -1.300 7.682 -9.160 1.00 22.74 N ATOM 1221 CA ARG A 136 -1.942 8.615 -10.078 1.00 23.85 C ATOM 1222 C ARG A 136 -2.392 7.979 -11.387 1.00 27.13 C ATOM 1223 O ARG A 136 -3.533 8.156 -11.795 1.00 27.74 O ATOM 1224 CB ARG A 136 -1.056 9.835 -10.330 1.00 24.88 C ATOM 1225 CG ARG A 136 -1.804 11.026 -10.949 1.00 44.52 C ATOM 1226 CD ARG A 136 -0.908 12.259 -11.035 1.00 53.21 C ATOM 1227 NE ARG A 136 -0.857 12.971 -9.760 1.00 61.98 N ATOM 1228 CZ ARG A 136 0.126 13.788 -9.400 1.00 72.18 C ATOM 1229 NH1 ARG A 136 0.091 14.393 -8.220 1.00 52.85 N ATOM 1230 NH2 ARG A 136 1.138 14.011 -10.227 1.00 61.99 N ATOM 1231 HA ARG A 136 -2.855 8.942 -9.581 1.00 0.00 H ATOM 1232 HB2 ARG A 136 -0.630 10.153 -9.379 1.00 0.00 H ATOM 1233 HB3 ARG A 136 -0.253 9.543 -11.007 1.00 0.00 H ATOM 1234 HG2 ARG A 136 -2.134 10.756 -11.952 1.00 0.00 H ATOM 1235 HG3 ARG A 136 -2.672 11.260 -10.333 1.00 0.00 H ATOM 1236 HD2 ARG A 136 -1.299 12.929 -11.800 1.00 0.00 H ATOM 1237 HD3 ARG A 136 0.100 11.947 -11.308 1.00 0.00 H ATOM 1238 HE ARG A 136 -1.641 12.829 -9.092 1.00 0.00 H ATOM 1239 HH12 ARG A 136 0.862 15.032 -7.940 1.00 0.00 H ATOM 1240 HH11 ARG A 136 -0.708 14.228 -7.574 1.00 0.00 H ATOM 1241 HH22 ARG A 136 1.908 14.651 -9.946 1.00 0.00 H ATOM 1242 HH21 ARG A 136 1.162 13.546 -11.157 1.00 0.00 H ATOM 1243 H ARG A 136 -0.363 7.915 -8.773 1.00 0.00 H ATOM 1244 N ASP A 137 -1.508 7.213 -12.012 1.00 22.77 N ATOM 1245 CA ASP A 137 -1.808 6.549 -13.277 1.00 22.87 C ATOM 1246 C ASP A 137 -2.393 5.161 -13.111 1.00 25.38 C ATOM 1247 O ASP A 137 -2.181 4.306 -13.961 1.00 24.88 O ATOM 1248 CB ASP A 137 -0.538 6.465 -14.114 1.00 24.86 C ATOM 1249 CG ASP A 137 -0.017 7.841 -14.487 1.00 37.38 C ATOM 1250 OD1 ASP A 137 -0.852 8.768 -14.549 1.00 36.92 O ATOM 1251 OD2 ASP A 137 1.206 7.999 -14.683 1.00 43.30 O ATOM 1252 HA ASP A 137 -2.569 7.151 -13.774 1.00 0.00 H ATOM 1253 HB2 ASP A 137 0.228 5.940 -13.542 1.00 0.00 H ATOM 1254 HB3 ASP A 137 -0.753 5.909 -15.027 1.00 0.00 H ATOM 1255 H ASP A 137 -0.568 7.081 -11.586 1.00 0.00 H ATOM 1256 N GLY A 138 -3.084 4.920 -11.997 1.00 19.61 N ATOM 1257 CA GLY A 138 -3.654 3.610 -11.763 1.00 17.58 C ATOM 1258 C GLY A 138 -2.841 2.708 -10.848 1.00 19.05 C ATOM 1259 O GLY A 138 -1.732 3.016 -10.429 1.00 19.16 O ATOM 1260 HA3 GLY A 138 -3.758 3.110 -12.726 1.00 0.00 H ATOM 1261 HA2 GLY A 138 -4.639 3.745 -11.317 1.00 0.00 H ATOM 1262 H GLY A 138 -3.214 5.675 -11.294 1.00 0.00 H ATOM 1263 N VAL A 139 -3.411 1.556 -10.543 1.00 13.92 N ATOM 1264 CA VAL A 139 -2.789 0.595 -9.650 1.00 12.63 C ATOM 1265 C VAL A 139 -2.268 -0.626 -10.405 1.00 16.31 C ATOM 1266 O VAL A 139 -2.885 -1.078 -11.373 1.00 17.37 O ATOM 1267 CB VAL A 139 -3.857 0.134 -8.577 1.00 15.38 C ATOM 1268 CG1 VAL A 139 -3.231 -0.784 -7.542 1.00 15.34 C ATOM 1269 CG2 VAL A 139 -4.511 1.358 -7.896 1.00 14.03 C ATOM 1270 HA VAL A 139 -1.937 1.074 -9.168 1.00 0.00 H ATOM 1271 HB VAL A 139 -4.634 -0.426 -9.097 1.00 0.00 H ATOM 1272 HG11 VAL A 139 -2.830 -1.668 -8.038 1.00 0.00 H ATOM 1273 HG12 VAL A 139 -2.426 -0.257 -7.030 1.00 0.00 H ATOM 1274 HG13 VAL A 139 -3.989 -1.084 -6.818 1.00 0.00 H ATOM 1275 HG21 VAL A 139 -3.742 1.949 -7.398 1.00 0.00 H ATOM 1276 HG22 VAL A 139 -5.009 1.969 -8.649 1.00 0.00 H ATOM 1277 HG23 VAL A 139 -5.242 1.017 -7.162 1.00 0.00 H ATOM 1278 H VAL A 139 -4.338 1.330 -10.957 1.00 0.00 H ATOM 1279 N ASN A 140 -1.175 -1.199 -9.912 1.00 11.19 N ATOM 1280 CA ASN A 140 -0.683 -2.509 -10.340 1.00 10.35 C ATOM 1281 C ASN A 140 0.058 -3.084 -9.132 1.00 13.63 C ATOM 1282 O ASN A 140 0.244 -2.379 -8.143 1.00 11.02 O ATOM 1283 CB ASN A 140 0.143 -2.480 -11.640 1.00 12.60 C ATOM 1284 CG ASN A 140 1.418 -1.672 -11.508 1.00 24.15 C ATOM 1285 OD1 ASN A 140 2.072 -1.710 -10.481 1.00 15.30 O ATOM 1286 ND2 ASN A 140 1.820 -1.007 -12.583 1.00 19.07 N ATOM 1287 HA ASN A 140 -1.509 -3.159 -10.628 1.00 0.00 H ATOM 1288 HB2 ASN A 140 0.405 -3.503 -11.909 1.00 0.00 H ATOM 1289 HB3 ASN A 140 -0.467 -2.042 -12.431 1.00 0.00 H ATOM 1290 HD22 ASN A 140 1.231 -1.000 -13.440 1.00 0.00 H ATOM 1291 HD21 ASN A 140 2.724 -0.493 -12.569 1.00 0.00 H ATOM 1292 H ASN A 140 -0.640 -0.688 -9.181 1.00 0.00 H ATOM 1293 N TRP A 141 0.357 -4.375 -9.142 1.00 11.04 N ATOM 1294 CA TRP A 141 0.984 -4.998 -7.971 1.00 11.05 C ATOM 1295 C TRP A 141 2.352 -4.408 -7.654 1.00 12.31 C ATOM 1296 O TRP A 141 2.744 -4.335 -6.500 1.00 10.68 O ATOM 1297 CB TRP A 141 1.092 -6.516 -8.158 1.00 10.53 C ATOM 1298 CG TRP A 141 -0.235 -7.259 -7.985 1.00 12.07 C ATOM 1299 CD1 TRP A 141 -0.939 -7.948 -8.957 1.00 14.83 C ATOM 1300 CD2 TRP A 141 -1.003 -7.384 -6.772 1.00 12.21 C ATOM 1301 NE1 TRP A 141 -2.063 -8.545 -8.394 1.00 14.40 N ATOM 1302 CE2 TRP A 141 -2.135 -8.200 -7.069 1.00 15.90 C ATOM 1303 CE3 TRP A 141 -0.841 -6.903 -5.467 1.00 13.24 C ATOM 1304 CZ2 TRP A 141 -3.085 -8.535 -6.107 1.00 14.90 C ATOM 1305 CZ3 TRP A 141 -1.790 -7.249 -4.508 1.00 15.09 C ATOM 1306 CH2 TRP A 141 -2.872 -8.085 -4.827 1.00 15.95 C ATOM 1307 HA TRP A 141 0.337 -4.785 -7.120 1.00 0.00 H ATOM 1308 HB2 TRP A 141 1.467 -6.712 -9.162 1.00 0.00 H ATOM 1309 HB3 TRP A 141 1.800 -6.903 -7.425 1.00 0.00 H ATOM 1310 HE1 TRP A 141 -2.739 -9.154 -8.897 1.00 0.00 H ATOM 1311 HD1 TRP A 141 -0.655 -8.013 -10.007 1.00 0.00 H ATOM 1312 HZ2 TRP A 141 -3.962 -9.130 -6.360 1.00 0.00 H ATOM 1313 HH2 TRP A 141 -3.561 -8.385 -4.038 1.00 0.00 H ATOM 1314 HZ3 TRP A 141 -1.691 -6.864 -3.493 1.00 0.00 H ATOM 1315 HE3 TRP A 141 0.009 -6.272 -5.207 1.00 0.00 H ATOM 1316 H TRP A 141 0.146 -4.949 -9.983 1.00 0.00 H ATOM 1317 N GLY A 142 3.095 -4.001 -8.672 1.00 10.92 N ATOM 1318 CA GLY A 142 4.407 -3.427 -8.408 1.00 11.19 C ATOM 1319 C GLY A 142 4.311 -2.113 -7.644 1.00 13.01 C ATOM 1320 O GLY A 142 5.111 -1.842 -6.771 1.00 13.39 O ATOM 1321 HA3 GLY A 142 4.910 -3.246 -9.358 1.00 0.00 H ATOM 1322 HA2 GLY A 142 4.989 -4.135 -7.819 1.00 0.00 H ATOM 1323 H GLY A 142 2.746 -4.090 -9.648 1.00 0.00 H ATOM 1324 N ARG A 143 3.293 -1.319 -7.934 1.00 10.03 N ATOM 1325 CA ARG A 143 3.077 -0.057 -7.226 1.00 9.56 C ATOM 1326 C ARG A 143 2.592 -0.331 -5.827 1.00 14.18 C ATOM 1327 O ARG A 143 2.891 0.425 -4.919 1.00 13.65 O ATOM 1328 CB ARG A 143 2.067 0.820 -7.964 1.00 11.10 C ATOM 1329 CG ARG A 143 2.639 1.399 -9.242 1.00 15.97 C ATOM 1330 CD ARG A 143 1.597 2.076 -10.087 1.00 15.66 C ATOM 1331 NE ARG A 143 2.220 2.648 -11.290 1.00 18.31 N ATOM 1332 CZ ARG A 143 1.556 2.912 -12.413 1.00 40.86 C ATOM 1333 NH1 ARG A 143 2.192 3.401 -13.463 1.00 36.18 N ATOM 1334 NH2 ARG A 143 0.251 2.694 -12.483 1.00 33.47 N ATOM 1335 HA ARG A 143 4.026 0.477 -7.183 1.00 0.00 H ATOM 1336 HB2 ARG A 143 1.193 0.217 -8.211 1.00 0.00 H ATOM 1337 HB3 ARG A 143 1.769 1.639 -7.310 1.00 0.00 H ATOM 1338 HG2 ARG A 143 3.406 2.128 -8.982 1.00 0.00 H ATOM 1339 HG3 ARG A 143 3.088 0.592 -9.821 1.00 0.00 H ATOM 1340 HD2 ARG A 143 1.126 2.872 -9.511 1.00 0.00 H ATOM 1341 HD3 ARG A 143 0.842 1.347 -10.383 1.00 0.00 H ATOM 1342 HE ARG A 143 3.238 2.858 -11.262 1.00 0.00 H ATOM 1343 HH12 ARG A 143 1.669 3.606 -14.339 1.00 0.00 H ATOM 1344 HH11 ARG A 143 3.215 3.581 -13.414 1.00 0.00 H ATOM 1345 HH22 ARG A 143 -0.264 2.901 -13.362 1.00 0.00 H ATOM 1346 HH21 ARG A 143 -0.258 2.315 -11.659 1.00 0.00 H ATOM 1347 H ARG A 143 2.630 -1.599 -8.684 1.00 0.00 H ATOM 1348 N ILE A 144 1.861 -1.429 -5.647 1.00 11.17 N ATOM 1349 CA ILE A 144 1.426 -1.804 -4.298 1.00 9.71 C ATOM 1350 C ILE A 144 2.675 -2.185 -3.479 1.00 13.88 C ATOM 1351 O ILE A 144 2.858 -1.763 -2.340 1.00 10.58 O ATOM 1352 CB ILE A 144 0.355 -2.906 -4.345 1.00 12.47 C ATOM 1353 CG1 ILE A 144 -0.988 -2.268 -4.736 1.00 11.92 C ATOM 1354 CG2 ILE A 144 0.223 -3.585 -2.930 1.00 12.95 C ATOM 1355 CD1 ILE A 144 -2.103 -3.262 -5.023 1.00 14.60 C ATOM 1356 HA ILE A 144 0.940 -0.965 -3.801 1.00 0.00 H ATOM 1357 HB ILE A 144 0.637 -3.664 -5.075 1.00 0.00 H ATOM 1358 HG12 ILE A 144 -1.309 -1.624 -3.918 1.00 0.00 H ATOM 1359 HG13 ILE A 144 -0.831 -1.666 -5.631 1.00 0.00 H ATOM 1360 HD11 ILE A 144 -1.808 -3.909 -5.849 1.00 0.00 H ATOM 1361 HD12 ILE A 144 -2.287 -3.866 -4.135 1.00 0.00 H ATOM 1362 HD13 ILE A 144 -3.011 -2.721 -5.290 1.00 0.00 H ATOM 1363 HG21 ILE A 144 1.180 -4.024 -2.649 1.00 0.00 H ATOM 1364 HG22 ILE A 144 -0.064 -2.834 -2.194 1.00 0.00 H ATOM 1365 HG23 ILE A 144 -0.538 -4.364 -2.972 1.00 0.00 H ATOM 1366 H ILE A 144 1.599 -2.020 -6.462 1.00 0.00 H ATOM 1367 N VAL A 145 3.586 -2.940 -4.081 1.00 10.60 N ATOM 1368 CA VAL A 145 4.822 -3.264 -3.370 1.00 9.21 C ATOM 1369 C VAL A 145 5.600 -1.973 -3.060 1.00 11.29 C ATOM 1370 O VAL A 145 6.142 -1.800 -1.970 1.00 12.98 O ATOM 1371 CB VAL A 145 5.688 -4.235 -4.200 1.00 10.38 C ATOM 1372 CG1 VAL A 145 7.056 -4.434 -3.513 1.00 10.33 C ATOM 1373 CG2 VAL A 145 4.953 -5.563 -4.369 1.00 8.48 C ATOM 1374 HA VAL A 145 4.569 -3.756 -2.431 1.00 0.00 H ATOM 1375 HB VAL A 145 5.865 -3.816 -5.190 1.00 0.00 H ATOM 1376 HG11 VAL A 145 7.565 -3.473 -3.435 1.00 0.00 H ATOM 1377 HG12 VAL A 145 6.904 -4.848 -2.516 1.00 0.00 H ATOM 1378 HG13 VAL A 145 7.662 -5.121 -4.105 1.00 0.00 H ATOM 1379 HG21 VAL A 145 4.760 -5.998 -3.388 1.00 0.00 H ATOM 1380 HG22 VAL A 145 4.008 -5.391 -4.883 1.00 0.00 H ATOM 1381 HG23 VAL A 145 5.568 -6.245 -4.956 1.00 0.00 H ATOM 1382 H VAL A 145 3.423 -3.296 -5.044 1.00 0.00 H ATOM 1383 N ALA A 146 5.637 -1.067 -4.025 1.00 8.44 N ATOM 1384 CA ALA A 146 6.345 0.217 -3.860 1.00 8.85 C ATOM 1385 C ALA A 146 5.741 0.992 -2.712 1.00 13.74 C ATOM 1386 O ALA A 146 6.451 1.661 -1.972 1.00 11.90 O ATOM 1387 CB ALA A 146 6.279 1.041 -5.134 1.00 8.51 C ATOM 1388 HA ALA A 146 7.392 0.007 -3.643 1.00 0.00 H ATOM 1389 HB1 ALA A 146 6.744 0.486 -5.949 1.00 0.00 H ATOM 1390 HB2 ALA A 146 5.237 1.244 -5.380 1.00 0.00 H ATOM 1391 HB3 ALA A 146 6.809 1.982 -4.984 1.00 0.00 H ATOM 1392 H ALA A 146 5.154 -1.266 -4.924 1.00 0.00 H ATOM 1393 N PHE A 147 4.416 0.896 -2.571 1.00 11.29 N ATOM 1394 CA PHE A 147 3.692 1.581 -1.500 1.00 9.43 C ATOM 1395 C PHE A 147 4.170 1.011 -0.145 1.00 12.56 C ATOM 1396 O PHE A 147 4.419 1.753 0.812 1.00 12.53 O ATOM 1397 CB PHE A 147 2.175 1.331 -1.711 1.00 10.77 C ATOM 1398 CG PHE A 147 1.327 1.560 -0.476 1.00 11.05 C ATOM 1399 CD1 PHE A 147 0.922 0.485 0.304 1.00 12.48 C ATOM 1400 CD2 PHE A 147 0.873 2.842 -0.143 1.00 14.15 C ATOM 1401 CE1 PHE A 147 0.118 0.662 1.390 1.00 12.44 C ATOM 1402 CE2 PHE A 147 0.053 3.035 0.963 1.00 15.50 C ATOM 1403 CZ PHE A 147 -0.354 1.932 1.706 1.00 13.70 C ATOM 1404 HA PHE A 147 3.879 2.655 -1.509 1.00 0.00 H ATOM 1405 HB2 PHE A 147 1.824 2.002 -2.495 1.00 0.00 H ATOM 1406 HB3 PHE A 147 2.040 0.298 -2.031 1.00 0.00 H ATOM 1407 HD2 PHE A 147 1.165 3.695 -0.756 1.00 0.00 H ATOM 1408 HE2 PHE A 147 -0.267 4.038 1.244 1.00 0.00 H ATOM 1409 HZ PHE A 147 -1.045 2.063 2.539 1.00 0.00 H ATOM 1410 HE1 PHE A 147 -0.155 -0.191 2.011 1.00 0.00 H ATOM 1411 HD1 PHE A 147 1.254 -0.520 0.043 1.00 0.00 H ATOM 1412 H PHE A 147 3.880 0.314 -3.246 1.00 0.00 H ATOM 1413 N PHE A 148 4.304 -0.307 -0.047 1.00 9.67 N ATOM 1414 CA PHE A 148 4.794 -0.898 1.211 1.00 10.31 C ATOM 1415 C PHE A 148 6.246 -0.495 1.503 1.00 13.25 C ATOM 1416 O PHE A 148 6.589 -0.204 2.652 1.00 12.56 O ATOM 1417 CB PHE A 148 4.657 -2.438 1.217 1.00 11.48 C ATOM 1418 CG PHE A 148 3.293 -2.919 1.638 1.00 12.70 C ATOM 1419 CD1 PHE A 148 2.272 -3.086 0.696 1.00 14.43 C ATOM 1420 CD2 PHE A 148 3.025 -3.189 2.987 1.00 14.54 C ATOM 1421 CE1 PHE A 148 1.022 -3.552 1.073 1.00 14.47 C ATOM 1422 CE2 PHE A 148 1.779 -3.651 3.364 1.00 15.91 C ATOM 1423 CZ PHE A 148 0.777 -3.814 2.424 1.00 14.24 C ATOM 1424 HA PHE A 148 4.163 -0.498 2.004 1.00 0.00 H ATOM 1425 HB2 PHE A 148 4.858 -2.806 0.211 1.00 0.00 H ATOM 1426 HB3 PHE A 148 5.395 -2.848 1.906 1.00 0.00 H ATOM 1427 HD2 PHE A 148 3.799 -3.034 3.738 1.00 0.00 H ATOM 1428 HE2 PHE A 148 1.584 -3.889 4.410 1.00 0.00 H ATOM 1429 HZ PHE A 148 -0.211 -4.149 2.739 1.00 0.00 H ATOM 1430 HE1 PHE A 148 0.243 -3.712 0.328 1.00 0.00 H ATOM 1431 HD1 PHE A 148 2.462 -2.846 -0.350 1.00 0.00 H ATOM 1432 H PHE A 148 4.064 -0.918 -0.854 1.00 0.00 H ATOM 1433 N GLU A 149 7.092 -0.503 0.471 1.00 10.55 N ATOM 1434 CA GLU A 149 8.501 -0.139 0.632 1.00 9.50 C ATOM 1435 C GLU A 149 8.632 1.341 1.006 1.00 13.90 C ATOM 1436 O GLU A 149 9.527 1.728 1.752 1.00 13.15 O ATOM 1437 CB GLU A 149 9.347 -0.476 -0.622 1.00 8.89 C ATOM 1438 CG GLU A 149 9.605 -1.986 -0.791 1.00 14.70 C ATOM 1439 CD GLU A 149 10.486 -2.535 0.324 1.00 20.87 C ATOM 1440 OE1 GLU A 149 11.520 -1.905 0.614 1.00 22.46 O ATOM 1441 OE2 GLU A 149 10.107 -3.543 0.951 1.00 23.65 O ATOM 1442 HA GLU A 149 8.901 -0.743 1.447 1.00 0.00 H ATOM 1443 HB2 GLU A 149 8.819 -0.113 -1.504 1.00 0.00 H ATOM 1444 HB3 GLU A 149 10.307 0.033 -0.540 1.00 0.00 H ATOM 1445 HG2 GLU A 149 8.650 -2.511 -0.778 1.00 0.00 H ATOM 1446 HG3 GLU A 149 10.099 -2.155 -1.748 1.00 0.00 H ATOM 1447 H GLU A 149 6.742 -0.774 -0.470 1.00 0.00 H ATOM 1448 N PHE A 150 7.738 2.167 0.491 1.00 12.00 N ATOM 1449 CA PHE A 150 7.747 3.594 0.857 1.00 11.25 C ATOM 1450 C PHE A 150 7.363 3.756 2.347 1.00 15.59 C ATOM 1451 O PHE A 150 7.964 4.541 3.070 1.00 14.57 O ATOM 1452 CB PHE A 150 6.780 4.387 -0.022 1.00 11.98 C ATOM 1453 CG PHE A 150 6.503 5.754 0.492 1.00 13.06 C ATOM 1454 CD1 PHE A 150 7.516 6.700 0.531 1.00 15.36 C ATOM 1455 CD2 PHE A 150 5.242 6.089 0.982 1.00 14.52 C ATOM 1456 CE1 PHE A 150 7.280 7.963 1.029 1.00 16.84 C ATOM 1457 CE2 PHE A 150 5.018 7.339 1.492 1.00 17.16 C ATOM 1458 CZ PHE A 150 6.050 8.272 1.536 1.00 15.07 C ATOM 1459 HA PHE A 150 8.752 3.985 0.699 1.00 0.00 H ATOM 1460 HB2 PHE A 150 7.210 4.473 -1.020 1.00 0.00 H ATOM 1461 HB3 PHE A 150 5.838 3.842 -0.080 1.00 0.00 H ATOM 1462 HD2 PHE A 150 4.435 5.356 0.959 1.00 0.00 H ATOM 1463 HE2 PHE A 150 4.029 7.605 1.865 1.00 0.00 H ATOM 1464 HZ PHE A 150 5.876 9.253 1.977 1.00 0.00 H ATOM 1465 HE1 PHE A 150 8.072 8.712 1.018 1.00 0.00 H ATOM 1466 HD1 PHE A 150 8.509 6.442 0.164 1.00 0.00 H ATOM 1467 H PHE A 150 7.025 1.808 -0.176 1.00 0.00 H ATOM 1468 N GLY A 151 6.362 3.014 2.807 1.00 13.36 N ATOM 1469 CA GLY A 151 5.979 3.070 4.212 1.00 12.92 C ATOM 1470 C GLY A 151 7.129 2.569 5.065 1.00 17.05 C ATOM 1471 O GLY A 151 7.404 3.131 6.125 1.00 16.88 O ATOM 1472 HA3 GLY A 151 5.103 2.443 4.376 1.00 0.00 H ATOM 1473 HA2 GLY A 151 5.744 4.099 4.485 1.00 0.00 H ATOM 1474 H GLY A 151 5.846 2.386 2.158 1.00 0.00 H ATOM 1475 N GLY A 152 7.818 1.523 4.596 1.00 14.21 N ATOM 1476 CA GLY A 152 8.981 0.977 5.280 1.00 14.70 C ATOM 1477 C GLY A 152 10.125 2.005 5.347 1.00 18.45 C ATOM 1478 O GLY A 152 10.804 2.115 6.356 1.00 17.95 O ATOM 1479 HA3 GLY A 152 9.327 0.094 4.742 1.00 0.00 H ATOM 1480 HA2 GLY A 152 8.697 0.695 6.294 1.00 0.00 H ATOM 1481 H GLY A 152 7.510 1.082 3.706 1.00 0.00 H ATOM 1482 N VAL A 153 10.346 2.744 4.265 1.00 14.42 N ATOM 1483 CA VAL A 153 11.393 3.792 4.236 1.00 13.67 C ATOM 1484 C VAL A 153 11.005 4.858 5.269 1.00 16.49 C ATOM 1485 O VAL A 153 11.844 5.319 6.040 1.00 15.52 O ATOM 1486 CB VAL A 153 11.514 4.443 2.825 1.00 17.94 C ATOM 1487 CG1 VAL A 153 12.296 5.773 2.896 1.00 18.06 C ATOM 1488 CG2 VAL A 153 12.210 3.502 1.841 1.00 17.43 C ATOM 1489 HA VAL A 153 12.361 3.347 4.469 1.00 0.00 H ATOM 1490 HB VAL A 153 10.502 4.640 2.472 1.00 0.00 H ATOM 1491 HG11 VAL A 153 11.775 6.465 3.558 1.00 0.00 H ATOM 1492 HG12 VAL A 153 13.298 5.584 3.282 1.00 0.00 H ATOM 1493 HG13 VAL A 153 12.366 6.206 1.898 1.00 0.00 H ATOM 1494 HG21 VAL A 153 13.211 3.272 2.206 1.00 0.00 H ATOM 1495 HG22 VAL A 153 11.634 2.581 1.752 1.00 0.00 H ATOM 1496 HG23 VAL A 153 12.279 3.984 0.866 1.00 0.00 H ATOM 1497 H VAL A 153 9.768 2.582 3.415 1.00 0.00 H ATOM 1498 N MET A 154 9.727 5.235 5.297 1.00 13.72 N ATOM 1499 CA MET A 154 9.250 6.223 6.271 1.00 13.80 C ATOM 1500 C MET A 154 9.449 5.729 7.722 1.00 15.63 C ATOM 1501 O MET A 154 9.883 6.480 8.573 1.00 14.45 O ATOM 1502 CB MET A 154 7.781 6.611 6.016 1.00 16.41 C ATOM 1503 CG MET A 154 7.591 7.563 4.830 1.00 21.69 C ATOM 1504 SD MET A 154 6.015 8.434 4.922 1.00 27.91 S ATOM 1505 CE MET A 154 6.390 9.711 6.159 1.00 23.58 C ATOM 1506 HA MET A 154 9.855 7.120 6.139 1.00 0.00 H ATOM 1507 HB2 MET A 154 7.213 5.701 5.821 1.00 0.00 H ATOM 1508 HB3 MET A 154 7.392 7.095 6.912 1.00 0.00 H ATOM 1509 HG2 MET A 154 7.623 6.987 3.905 1.00 0.00 H ATOM 1510 HG3 MET A 154 8.400 8.294 4.830 1.00 0.00 H ATOM 1511 HE1 MET A 154 6.678 9.234 7.096 1.00 0.00 H ATOM 1512 HE2 MET A 154 7.210 10.333 5.800 1.00 0.00 H ATOM 1513 HE3 MET A 154 5.507 10.329 6.321 1.00 0.00 H ATOM 1514 H MET A 154 9.057 4.822 4.617 1.00 0.00 H ATOM 1515 N CYS A 155 9.145 4.469 7.992 1.00 10.55 N ATOM 1516 CA CYS A 155 9.325 3.931 9.338 1.00 12.65 C ATOM 1517 C CYS A 155 10.818 3.854 9.699 1.00 19.31 C ATOM 1518 O CYS A 155 11.218 4.219 10.809 1.00 19.04 O ATOM 1519 CB CYS A 155 8.680 2.557 9.477 1.00 12.80 C ATOM 1520 SG CYS A 155 6.882 2.615 9.409 1.00 16.80 S ATOM 1521 HA CYS A 155 8.830 4.611 10.032 1.00 0.00 H ATOM 1522 HB2 CYS A 155 8.978 2.128 10.434 1.00 0.00 H ATOM 1523 HB3 CYS A 155 9.038 1.921 8.668 1.00 0.00 H ATOM 1524 HG CYS A 155 6.486 3.145 8.198 1.00 0.00 H ATOM 1525 H CYS A 155 8.774 3.856 7.238 1.00 0.00 H ATOM 1526 N VAL A 156 11.626 3.380 8.757 1.00 14.73 N ATOM 1527 CA VAL A 156 13.068 3.252 8.962 1.00 15.04 C ATOM 1528 C VAL A 156 13.736 4.600 9.205 1.00 18.19 C ATOM 1529 O VAL A 156 14.605 4.743 10.084 1.00 17.58 O ATOM 1530 CB VAL A 156 13.746 2.480 7.807 1.00 19.15 C ATOM 1531 CG1 VAL A 156 15.270 2.651 7.888 1.00 19.34 C ATOM 1532 CG2 VAL A 156 13.382 0.994 7.870 1.00 19.28 C ATOM 1533 HA VAL A 156 13.204 2.663 9.869 1.00 0.00 H ATOM 1534 HB VAL A 156 13.390 2.885 6.860 1.00 0.00 H ATOM 1535 HG11 VAL A 156 15.520 3.709 7.810 1.00 0.00 H ATOM 1536 HG12 VAL A 156 15.628 2.261 8.841 1.00 0.00 H ATOM 1537 HG13 VAL A 156 15.740 2.104 7.071 1.00 0.00 H ATOM 1538 HG21 VAL A 156 13.718 0.579 8.820 1.00 0.00 H ATOM 1539 HG22 VAL A 156 12.301 0.882 7.785 1.00 0.00 H ATOM 1540 HG23 VAL A 156 13.868 0.467 7.049 1.00 0.00 H ATOM 1541 H VAL A 156 11.220 3.091 7.844 1.00 0.00 H ATOM 1542 N GLU A 157 13.364 5.590 8.399 1.00 14.54 N ATOM 1543 CA GLU A 157 13.907 6.925 8.591 1.00 15.58 C ATOM 1544 C GLU A 157 13.448 7.525 9.916 1.00 19.71 C ATOM 1545 O GLU A 157 14.199 8.212 10.596 1.00 17.91 O ATOM 1546 CB GLU A 157 13.546 7.842 7.422 1.00 17.15 C ATOM 1547 CG GLU A 157 14.219 7.388 6.121 1.00 25.66 C ATOM 1548 CD GLU A 157 15.700 7.072 6.315 1.00 62.63 C ATOM 1549 OE1 GLU A 157 16.406 7.901 6.938 1.00 54.04 O ATOM 1550 OE2 GLU A 157 16.150 5.989 5.867 1.00 61.01 O ATOM 1551 HA GLU A 157 14.993 6.836 8.624 1.00 0.00 H ATOM 1552 HB2 GLU A 157 12.465 7.831 7.284 1.00 0.00 H ATOM 1553 HB3 GLU A 157 13.871 8.856 7.654 1.00 0.00 H ATOM 1554 HG2 GLU A 157 13.714 6.493 5.758 1.00 0.00 H ATOM 1555 HG3 GLU A 157 14.124 8.182 5.381 1.00 0.00 H ATOM 1556 H GLU A 157 12.685 5.410 7.632 1.00 0.00 H ATOM 1557 N SER A 158 12.225 7.217 10.313 1.00 16.69 N ATOM 1558 CA SER A 158 11.720 7.747 11.570 1.00 16.46 C ATOM 1559 C SER A 158 12.563 7.215 12.726 1.00 20.45 C ATOM 1560 O SER A 158 12.944 7.969 13.626 1.00 19.04 O ATOM 1561 CB SER A 158 10.203 7.517 11.711 1.00 17.08 C ATOM 1562 OG SER A 158 9.967 6.307 12.387 1.00 33.47 O ATOM 1563 HA SER A 158 11.827 8.832 11.589 1.00 0.00 H ATOM 1564 HB2 SER A 158 9.749 7.473 10.721 1.00 0.00 H ATOM 1565 HB3 SER A 158 9.763 8.339 12.275 1.00 0.00 H ATOM 1566 HG SER A 158 10.366 5.560 11.874 1.00 0.00 H ATOM 1567 H SER A 158 11.627 6.598 9.729 1.00 0.00 H ATOM 1568 N VAL A 159 12.923 5.933 12.667 1.00 17.34 N ATOM 1569 CA VAL A 159 13.769 5.337 13.696 1.00 16.59 C ATOM 1570 C VAL A 159 15.192 5.936 13.651 1.00 21.34 C ATOM 1571 O VAL A 159 15.773 6.278 14.683 1.00 21.23 O ATOM 1572 CB VAL A 159 13.780 3.769 13.572 1.00 22.07 C ATOM 1573 CG1 VAL A 159 14.939 3.179 14.348 1.00 22.27 C ATOM 1574 CG2 VAL A 159 12.448 3.184 14.080 1.00 21.96 C ATOM 1575 HA VAL A 159 13.350 5.578 14.673 1.00 0.00 H ATOM 1576 HB VAL A 159 13.901 3.509 12.520 1.00 0.00 H ATOM 1577 HG11 VAL A 159 15.876 3.571 13.953 1.00 0.00 H ATOM 1578 HG12 VAL A 159 14.845 3.449 15.400 1.00 0.00 H ATOM 1579 HG13 VAL A 159 14.927 2.094 14.248 1.00 0.00 H ATOM 1580 HG21 VAL A 159 12.307 3.458 15.126 1.00 0.00 H ATOM 1581 HG22 VAL A 159 11.627 3.583 13.485 1.00 0.00 H ATOM 1582 HG23 VAL A 159 12.471 2.098 13.988 1.00 0.00 H ATOM 1583 H VAL A 159 12.595 5.347 11.873 1.00 0.00 H ATOM 1584 N ASN A 160 15.758 6.056 12.454 1.00 17.59 N ATOM 1585 CA ASN A 160 17.085 6.631 12.289 1.00 18.44 C ATOM 1586 C ASN A 160 17.133 8.071 12.814 1.00 24.05 C ATOM 1587 O ASN A 160 18.155 8.536 13.306 1.00 25.09 O ATOM 1588 CB ASN A 160 17.498 6.613 10.810 1.00 19.81 C ATOM 1589 CG ASN A 160 17.752 5.204 10.287 1.00 34.90 C ATOM 1590 OD1 ASN A 160 17.812 4.977 9.082 1.00 35.12 O ATOM 1591 ND2 ASN A 160 17.917 4.260 11.194 1.00 24.49 N ATOM 1592 HA ASN A 160 17.782 6.024 12.867 1.00 0.00 H ATOM 1593 HB2 ASN A 160 16.701 7.066 10.220 1.00 0.00 H ATOM 1594 HB3 ASN A 160 18.411 7.198 10.695 1.00 0.00 H ATOM 1595 HD22 ASN A 160 17.858 4.495 12.205 1.00 0.00 H ATOM 1596 HD21 ASN A 160 18.106 3.281 10.897 1.00 0.00 H ATOM 1597 H ASN A 160 15.239 5.731 11.614 1.00 0.00 H ATOM 1598 N ARG A 161 16.033 8.795 12.689 1.00 19.59 N ATOM 1599 CA ARG A 161 16.030 10.186 13.108 1.00 18.76 C ATOM 1600 C ARG A 161 15.566 10.383 14.540 1.00 19.72 C ATOM 1601 O ARG A 161 15.289 11.505 14.964 1.00 17.78 O ATOM 1602 CB ARG A 161 15.189 11.017 12.138 1.00 20.23 C ATOM 1603 CG ARG A 161 15.807 11.065 10.740 1.00 30.27 C ATOM 1604 CD ARG A 161 14.896 11.773 9.765 1.00 44.49 C ATOM 1605 NE ARG A 161 14.832 13.204 10.023 1.00 55.23 N ATOM 1606 CZ ARG A 161 14.642 14.125 9.086 1.00 71.56 C ATOM 1607 NH1 ARG A 161 14.512 13.772 7.806 1.00 70.49 N ATOM 1608 NH2 ARG A 161 14.567 15.402 9.435 1.00 50.63 N ATOM 1609 HA ARG A 161 17.064 10.530 13.083 1.00 0.00 H ATOM 1610 HB2 ARG A 161 14.194 10.577 12.068 1.00 0.00 H ATOM 1611 HB3 ARG A 161 15.109 12.034 12.523 1.00 0.00 H ATOM 1612 HG2 ARG A 161 16.758 11.596 10.789 1.00 0.00 H ATOM 1613 HG3 ARG A 161 15.979 10.047 10.392 1.00 0.00 H ATOM 1614 HD2 ARG A 161 13.893 11.354 9.851 1.00 0.00 H ATOM 1615 HD3 ARG A 161 15.270 11.613 8.754 1.00 0.00 H ATOM 1616 HE ARG A 161 14.942 13.526 11.006 1.00 0.00 H ATOM 1617 HH12 ARG A 161 14.363 14.500 7.078 1.00 0.00 H ATOM 1618 HH11 ARG A 161 14.559 12.769 7.536 1.00 0.00 H ATOM 1619 HH22 ARG A 161 14.418 16.132 8.709 1.00 0.00 H ATOM 1620 HH21 ARG A 161 14.657 15.674 10.435 1.00 0.00 H ATOM 1621 H ARG A 161 15.172 8.369 12.291 1.00 0.00 H ATOM 1622 N GLU A 162 15.448 9.281 15.274 1.00 16.82 N ATOM 1623 CA GLU A 162 15.012 9.322 16.665 1.00 16.32 C ATOM 1624 C GLU A 162 13.620 9.884 16.780 1.00 18.70 C ATOM 1625 O GLU A 162 13.292 10.576 17.745 1.00 17.99 O ATOM 1626 CB GLU A 162 15.996 10.134 17.517 1.00 18.08 C ATOM 1627 CG GLU A 162 17.390 9.537 17.440 1.00 24.87 C ATOM 1628 CD GLU A 162 18.348 10.067 18.497 1.00 50.13 C ATOM 1629 OE1 GLU A 162 18.045 11.089 19.158 1.00 36.51 O ATOM 1630 OE2 GLU A 162 19.430 9.464 18.642 1.00 50.19 O ATOM 1631 HA GLU A 162 14.993 8.299 17.042 1.00 0.00 H ATOM 1632 HB2 GLU A 162 16.025 11.160 17.151 1.00 0.00 H ATOM 1633 HB3 GLU A 162 15.661 10.129 18.554 1.00 0.00 H ATOM 1634 HG2 GLU A 162 17.308 8.457 17.562 1.00 0.00 H ATOM 1635 HG3 GLU A 162 17.805 9.760 16.457 1.00 0.00 H ATOM 1636 H GLU A 162 15.673 8.362 14.843 1.00 0.00 H ATOM 1637 N MET A 163 12.768 9.514 15.831 1.00 13.47 N ATOM 1638 CA MET A 163 11.370 9.964 15.867 1.00 13.70 C ATOM 1639 C MET A 163 10.504 8.747 15.738 1.00 17.59 C ATOM 1640 O MET A 163 9.465 8.784 15.103 1.00 19.68 O ATOM 1641 CB MET A 163 11.074 10.875 14.665 1.00 15.65 C ATOM 1642 CG MET A 163 11.681 12.273 14.756 1.00 18.69 C ATOM 1643 SD MET A 163 11.615 13.002 13.094 1.00 22.62 S ATOM 1644 CE MET A 163 12.709 14.420 13.322 1.00 18.72 C ATOM 1645 HA MET A 163 11.182 10.509 16.792 1.00 0.00 H ATOM 1646 HB2 MET A 163 11.465 10.393 13.769 1.00 0.00 H ATOM 1647 HB3 MET A 163 9.993 10.980 14.577 1.00 0.00 H ATOM 1648 HG2 MET A 163 12.715 12.209 15.095 1.00 0.00 H ATOM 1649 HG3 MET A 163 11.108 12.884 15.454 1.00 0.00 H ATOM 1650 HE1 MET A 163 12.307 15.065 14.103 1.00 0.00 H ATOM 1651 HE2 MET A 163 13.700 14.070 13.612 1.00 0.00 H ATOM 1652 HE3 MET A 163 12.778 14.978 12.388 1.00 0.00 H ATOM 1653 H MET A 163 13.093 8.901 15.056 1.00 0.00 H ATOM 1654 N SER A 164 10.924 7.674 16.389 1.00 14.54 N ATOM 1655 CA SER A 164 10.263 6.386 16.284 1.00 13.35 C ATOM 1656 C SER A 164 8.761 6.323 16.615 1.00 16.47 C ATOM 1657 O SER A 164 8.045 5.485 16.084 1.00 15.67 O ATOM 1658 CB SER A 164 11.097 5.311 16.995 1.00 15.23 C ATOM 1659 OG SER A 164 10.715 5.241 18.357 1.00 27.66 O ATOM 1660 HA SER A 164 10.230 6.178 15.215 1.00 0.00 H ATOM 1661 HB2 SER A 164 12.154 5.567 16.927 1.00 0.00 H ATOM 1662 HB3 SER A 164 10.927 4.345 16.519 1.00 0.00 H ATOM 1663 HG SER A 164 11.253 4.547 18.814 1.00 0.00 H ATOM 1664 H SER A 164 11.761 7.757 17.000 1.00 0.00 H ATOM 1665 N PRO A 165 8.248 7.244 17.453 1.00 14.68 N ATOM 1666 CA PRO A 165 6.790 7.183 17.642 1.00 12.33 C ATOM 1667 C PRO A 165 6.006 7.376 16.334 1.00 17.75 C ATOM 1668 O PRO A 165 4.848 6.972 16.248 1.00 17.95 O ATOM 1669 CB PRO A 165 6.525 8.375 18.568 1.00 13.94 C ATOM 1670 CG PRO A 165 7.734 8.435 19.419 1.00 17.72 C ATOM 1671 CD PRO A 165 8.873 8.157 18.440 1.00 14.55 C ATOM 1672 HA PRO A 165 6.474 6.213 18.027 1.00 0.00 H ATOM 1673 HD3 PRO A 165 9.214 9.076 17.963 1.00 0.00 H ATOM 1674 HD2 PRO A 165 9.713 7.677 18.942 1.00 0.00 H ATOM 1675 HG3 PRO A 165 7.698 7.677 20.201 1.00 0.00 H ATOM 1676 HG2 PRO A 165 7.842 9.420 19.874 1.00 0.00 H ATOM 1677 HB2 PRO A 165 6.407 9.294 17.994 1.00 0.00 H ATOM 1678 HB3 PRO A 165 5.633 8.208 19.171 1.00 0.00 H ATOM 1679 N LEU A 166 6.612 8.014 15.327 1.00 12.93 N ATOM 1680 CA LEU A 166 5.919 8.212 14.047 1.00 12.26 C ATOM 1681 C LEU A 166 5.529 6.876 13.415 1.00 16.13 C ATOM 1682 O LEU A 166 4.621 6.801 12.571 1.00 15.97 O ATOM 1683 CB LEU A 166 6.807 8.977 13.065 1.00 11.89 C ATOM 1684 CG LEU A 166 6.981 10.465 13.383 1.00 15.56 C ATOM 1685 CD1 LEU A 166 7.788 11.128 12.292 1.00 14.36 C ATOM 1686 CD2 LEU A 166 5.603 11.133 13.557 1.00 19.22 C ATOM 1687 HA LEU A 166 5.017 8.787 14.256 1.00 0.00 H ATOM 1688 HB2 LEU A 166 7.793 8.512 13.066 1.00 0.00 H ATOM 1689 HB3 LEU A 166 6.367 8.891 12.071 1.00 0.00 H ATOM 1690 HG LEU A 166 7.524 10.579 14.321 1.00 0.00 H ATOM 1691 HD21 LEU A 166 5.031 11.028 12.635 1.00 0.00 H ATOM 1692 HD22 LEU A 166 5.068 10.651 14.376 1.00 0.00 H ATOM 1693 HD23 LEU A 166 5.739 12.191 13.783 1.00 0.00 H ATOM 1694 HD11 LEU A 166 8.768 10.655 12.228 1.00 0.00 H ATOM 1695 HD12 LEU A 166 7.268 11.020 11.340 1.00 0.00 H ATOM 1696 HD13 LEU A 166 7.909 12.186 12.523 1.00 0.00 H ATOM 1697 H LEU A 166 7.580 8.372 15.451 1.00 0.00 H ATOM 1698 N VAL A 167 6.257 5.832 13.766 1.00 13.93 N ATOM 1699 CA VAL A 167 5.970 4.506 13.208 1.00 14.35 C ATOM 1700 C VAL A 167 4.496 4.137 13.385 1.00 18.44 C ATOM 1701 O VAL A 167 3.855 3.620 12.470 1.00 15.45 O ATOM 1702 CB VAL A 167 6.909 3.418 13.794 1.00 16.69 C ATOM 1703 CG1 VAL A 167 6.416 1.980 13.363 1.00 16.65 C ATOM 1704 CG2 VAL A 167 8.361 3.677 13.353 1.00 15.21 C ATOM 1705 HA VAL A 167 6.170 4.553 12.137 1.00 0.00 H ATOM 1706 HB VAL A 167 6.879 3.465 14.883 1.00 0.00 H ATOM 1707 HG11 VAL A 167 5.405 1.817 13.736 1.00 0.00 H ATOM 1708 HG12 VAL A 167 6.420 1.907 12.275 1.00 0.00 H ATOM 1709 HG13 VAL A 167 7.084 1.228 13.782 1.00 0.00 H ATOM 1710 HG21 VAL A 167 8.419 3.651 12.265 1.00 0.00 H ATOM 1711 HG22 VAL A 167 8.679 4.656 13.712 1.00 0.00 H ATOM 1712 HG23 VAL A 167 9.009 2.907 13.771 1.00 0.00 H ATOM 1713 H VAL A 167 7.038 5.950 14.442 1.00 0.00 H ATOM 1714 N ASP A 168 3.943 4.404 14.558 1.00 16.73 N ATOM 1715 CA ASP A 168 2.532 4.065 14.800 1.00 15.63 C ATOM 1716 C ASP A 168 1.599 4.812 13.846 1.00 18.52 C ATOM 1717 O ASP A 168 0.591 4.271 13.404 1.00 18.84 O ATOM 1718 CB ASP A 168 2.151 4.412 16.248 1.00 17.44 C ATOM 1719 CG ASP A 168 2.899 3.562 17.256 1.00 29.16 C ATOM 1720 OD1 ASP A 168 3.022 2.344 17.020 1.00 29.55 O ATOM 1721 OD2 ASP A 168 3.414 4.120 18.248 1.00 35.29 O ATOM 1722 HA ASP A 168 2.418 2.995 14.626 1.00 0.00 H ATOM 1723 HB2 ASP A 168 2.384 5.461 16.431 1.00 0.00 H ATOM 1724 HB3 ASP A 168 1.081 4.251 16.378 1.00 0.00 H ATOM 1725 H ASP A 168 4.506 4.853 15.308 1.00 0.00 H ATOM 1726 N ASN A 169 1.901 6.081 13.571 1.00 14.93 N ATOM 1727 CA ASN A 169 1.032 6.872 12.707 1.00 15.48 C ATOM 1728 C ASN A 169 1.152 6.335 11.287 1.00 15.99 C ATOM 1729 O ASN A 169 0.151 6.183 10.588 1.00 13.38 O ATOM 1730 CB ASN A 169 1.424 8.358 12.726 1.00 18.66 C ATOM 1731 CG ASN A 169 1.429 8.934 14.121 1.00 31.30 C ATOM 1732 OD1 ASN A 169 2.385 8.774 14.841 1.00 23.32 O ATOM 1733 ND2 ASN A 169 0.340 9.570 14.514 1.00 23.36 N ATOM 1734 HA ASN A 169 0.007 6.793 13.068 1.00 0.00 H ATOM 1735 HB2 ASN A 169 2.422 8.463 12.300 1.00 0.00 H ATOM 1736 HB3 ASN A 169 0.711 8.916 12.119 1.00 0.00 H ATOM 1737 HD22 ASN A 169 -0.460 9.684 13.860 1.00 0.00 H ATOM 1738 HD21 ASN A 169 0.283 9.956 15.478 1.00 0.00 H ATOM 1739 H ASN A 169 2.759 6.508 13.974 1.00 0.00 H ATOM 1740 N ILE A 170 2.388 6.068 10.877 1.00 10.83 N ATOM 1741 CA ILE A 170 2.641 5.534 9.546 1.00 11.13 C ATOM 1742 C ILE A 170 1.869 4.227 9.319 1.00 15.67 C ATOM 1743 O ILE A 170 1.204 4.069 8.313 1.00 15.10 O ATOM 1744 CB ILE A 170 4.143 5.343 9.244 1.00 12.76 C ATOM 1745 CG1 ILE A 170 4.863 6.722 9.213 1.00 13.68 C ATOM 1746 CG2 ILE A 170 4.283 4.679 7.881 1.00 12.47 C ATOM 1747 CD1 ILE A 170 6.376 6.648 9.551 1.00 11.99 C ATOM 1748 HA ILE A 170 2.276 6.283 8.844 1.00 0.00 H ATOM 1749 HB ILE A 170 4.594 4.724 10.020 1.00 0.00 H ATOM 1750 HG12 ILE A 170 4.754 7.144 8.214 1.00 0.00 H ATOM 1751 HG13 ILE A 170 4.381 7.378 9.938 1.00 0.00 H ATOM 1752 HD11 ILE A 170 6.504 6.239 10.553 1.00 0.00 H ATOM 1753 HD12 ILE A 170 6.877 6.005 8.828 1.00 0.00 H ATOM 1754 HD13 ILE A 170 6.806 7.649 9.508 1.00 0.00 H ATOM 1755 HG21 ILE A 170 3.781 3.712 7.896 1.00 0.00 H ATOM 1756 HG22 ILE A 170 3.828 5.314 7.121 1.00 0.00 H ATOM 1757 HG23 ILE A 170 5.340 4.538 7.654 1.00 0.00 H ATOM 1758 H ILE A 170 3.188 6.243 11.518 1.00 0.00 H ATOM 1759 N ALA A 171 1.940 3.312 10.269 1.00 13.25 N ATOM 1760 CA ALA A 171 1.235 2.029 10.123 1.00 13.64 C ATOM 1761 C ALA A 171 -0.269 2.245 9.952 1.00 17.05 C ATOM 1762 O ALA A 171 -0.917 1.586 9.147 1.00 18.50 O ATOM 1763 CB ALA A 171 1.511 1.126 11.317 1.00 14.63 C ATOM 1764 HA ALA A 171 1.611 1.540 9.224 1.00 0.00 H ATOM 1765 HB1 ALA A 171 2.582 0.935 11.387 1.00 0.00 H ATOM 1766 HB2 ALA A 171 1.168 1.616 12.228 1.00 0.00 H ATOM 1767 HB3 ALA A 171 0.980 0.183 11.188 1.00 0.00 H ATOM 1768 H ALA A 171 2.498 3.500 11.126 1.00 0.00 H ATOM 1769 N LEU A 172 -0.828 3.182 10.699 1.00 14.24 N ATOM 1770 CA LEU A 172 -2.256 3.496 10.595 1.00 15.02 C ATOM 1771 C LEU A 172 -2.583 4.078 9.212 1.00 17.23 C ATOM 1772 O LEU A 172 -3.545 3.673 8.597 1.00 16.12 O ATOM 1773 CB LEU A 172 -2.672 4.501 11.685 1.00 16.40 C ATOM 1774 CG LEU A 172 -4.087 5.061 11.506 1.00 24.55 C ATOM 1775 CD1 LEU A 172 -5.130 3.969 11.833 1.00 25.93 C ATOM 1776 CD2 LEU A 172 -4.325 6.315 12.344 1.00 30.28 C ATOM 1777 HA LEU A 172 -2.813 2.569 10.733 1.00 0.00 H ATOM 1778 HB2 LEU A 172 -2.621 4.000 12.652 1.00 0.00 H ATOM 1779 HB3 LEU A 172 -1.969 5.334 11.671 1.00 0.00 H ATOM 1780 HG LEU A 172 -4.197 5.359 10.463 1.00 0.00 H ATOM 1781 HD21 LEU A 172 -4.187 6.077 13.399 1.00 0.00 H ATOM 1782 HD22 LEU A 172 -3.616 7.088 12.048 1.00 0.00 H ATOM 1783 HD23 LEU A 172 -5.342 6.672 12.181 1.00 0.00 H ATOM 1784 HD11 LEU A 172 -4.990 3.122 11.161 1.00 0.00 H ATOM 1785 HD12 LEU A 172 -5.000 3.642 12.865 1.00 0.00 H ATOM 1786 HD13 LEU A 172 -6.133 4.376 11.703 1.00 0.00 H ATOM 1787 H LEU A 172 -0.240 3.709 11.376 1.00 0.00 H ATOM 1788 N TRP A 173 -1.785 5.033 8.732 1.00 14.44 N ATOM 1789 CA TRP A 173 -2.027 5.634 7.416 1.00 14.53 C ATOM 1790 C TRP A 173 -1.953 4.582 6.316 1.00 17.23 C ATOM 1791 O TRP A 173 -2.669 4.666 5.324 1.00 15.74 O ATOM 1792 CB TRP A 173 -1.010 6.752 7.095 1.00 14.03 C ATOM 1793 CG TRP A 173 -0.965 7.868 8.079 1.00 15.38 C ATOM 1794 CD1 TRP A 173 -1.990 8.301 8.899 1.00 18.87 C ATOM 1795 CD2 TRP A 173 0.163 8.702 8.373 1.00 15.04 C ATOM 1796 NE1 TRP A 173 -1.529 9.285 9.742 1.00 18.29 N ATOM 1797 CE2 TRP A 173 -0.220 9.561 9.436 1.00 18.94 C ATOM 1798 CE3 TRP A 173 1.489 8.740 7.910 1.00 15.79 C ATOM 1799 CZ2 TRP A 173 0.667 10.456 10.024 1.00 18.47 C ATOM 1800 CZ3 TRP A 173 2.364 9.633 8.481 1.00 16.98 C ATOM 1801 CH2 TRP A 173 1.951 10.487 9.532 1.00 18.03 C ATOM 1802 HA TRP A 173 -3.027 6.066 7.453 1.00 0.00 H ATOM 1803 HB2 TRP A 173 -0.018 6.303 7.048 1.00 0.00 H ATOM 1804 HB3 TRP A 173 -1.264 7.170 6.121 1.00 0.00 H ATOM 1805 HE1 TRP A 173 -2.084 9.746 10.491 1.00 0.00 H ATOM 1806 HD1 TRP A 173 -3.011 7.920 8.880 1.00 0.00 H ATOM 1807 HZ2 TRP A 173 0.357 11.107 10.842 1.00 0.00 H ATOM 1808 HH2 TRP A 173 2.668 11.186 9.962 1.00 0.00 H ATOM 1809 HZ3 TRP A 173 3.391 9.684 8.119 1.00 0.00 H ATOM 1810 HE3 TRP A 173 1.818 8.074 7.113 1.00 0.00 H ATOM 1811 H TRP A 173 -0.977 5.357 9.301 1.00 0.00 H ATOM 1812 N MET A 174 -1.028 3.638 6.451 1.00 13.48 N ATOM 1813 CA MET A 174 -0.883 2.594 5.433 1.00 12.19 C ATOM 1814 C MET A 174 -2.120 1.707 5.443 1.00 16.74 C ATOM 1815 O MET A 174 -2.681 1.399 4.399 1.00 15.88 O ATOM 1816 CB MET A 174 0.350 1.738 5.719 1.00 12.77 C ATOM 1817 CG MET A 174 1.678 2.457 5.364 1.00 13.90 C ATOM 1818 SD MET A 174 3.084 1.457 5.888 1.00 15.33 S ATOM 1819 CE MET A 174 3.025 0.173 4.589 1.00 13.06 C ATOM 1820 HA MET A 174 -0.768 3.067 4.458 1.00 0.00 H ATOM 1821 HB2 MET A 174 0.362 1.488 6.780 1.00 0.00 H ATOM 1822 HB3 MET A 174 0.282 0.822 5.132 1.00 0.00 H ATOM 1823 HG2 MET A 174 1.713 3.422 5.871 1.00 0.00 H ATOM 1824 HG3 MET A 174 1.727 2.612 4.286 1.00 0.00 H ATOM 1825 HE1 MET A 174 2.065 -0.342 4.632 1.00 0.00 H ATOM 1826 HE2 MET A 174 3.144 0.641 3.612 1.00 0.00 H ATOM 1827 HE3 MET A 174 3.830 -0.543 4.751 1.00 0.00 H ATOM 1828 H MET A 174 -0.404 3.640 7.283 1.00 0.00 H ATOM 1829 N THR A 175 -2.549 1.312 6.636 1.00 14.75 N ATOM 1830 CA THR A 175 -3.728 0.435 6.793 1.00 14.79 C ATOM 1831 C THR A 175 -4.964 1.109 6.223 1.00 18.29 C ATOM 1832 O THR A 175 -5.730 0.497 5.474 1.00 17.73 O ATOM 1833 CB THR A 175 -3.939 0.107 8.272 1.00 20.17 C ATOM 1834 OG1 THR A 175 -2.765 -0.527 8.772 1.00 17.90 O ATOM 1835 CG2 THR A 175 -5.163 -0.797 8.472 1.00 17.76 C ATOM 1836 HA THR A 175 -3.555 -0.492 6.246 1.00 0.00 H ATOM 1837 HB THR A 175 -4.124 1.031 8.820 1.00 0.00 H ATOM 1838 HG1 THR A 175 -1.992 0.084 8.670 1.00 0.00 H ATOM 1839 HG23 THR A 175 -6.050 -0.296 8.084 1.00 0.00 H ATOM 1840 HG21 THR A 175 -5.011 -1.735 7.938 1.00 0.00 H ATOM 1841 HG22 THR A 175 -5.294 -0.999 9.535 1.00 0.00 H ATOM 1842 H THR A 175 -2.040 1.629 7.486 1.00 0.00 H ATOM 1843 N GLU A 176 -5.141 2.382 6.565 1.00 16.35 N ATOM 1844 CA GLU A 176 -6.267 3.148 6.068 1.00 16.93 C ATOM 1845 C GLU A 176 -6.266 3.269 4.552 1.00 19.60 C ATOM 1846 O GLU A 176 -7.327 3.205 3.918 1.00 17.74 O ATOM 1847 CB GLU A 176 -6.284 4.560 6.672 1.00 18.91 C ATOM 1848 CG GLU A 176 -6.731 4.588 8.119 1.00 29.48 C ATOM 1849 CD GLU A 176 -6.486 5.936 8.778 1.00 47.25 C ATOM 1850 OE1 GLU A 176 -6.982 6.132 9.910 1.00 47.45 O ATOM 1851 OE2 GLU A 176 -5.816 6.801 8.164 1.00 32.67 O ATOM 1852 HA GLU A 176 -7.159 2.600 6.372 1.00 0.00 H ATOM 1853 HB2 GLU A 176 -5.277 4.974 6.613 1.00 0.00 H ATOM 1854 HB3 GLU A 176 -6.965 5.178 6.087 1.00 0.00 H ATOM 1855 HG2 GLU A 176 -7.798 4.367 8.160 1.00 0.00 H ATOM 1856 HG3 GLU A 176 -6.182 3.824 8.670 1.00 0.00 H ATOM 1857 H GLU A 176 -4.457 2.838 7.202 1.00 0.00 H ATOM 1858 N TYR A 177 -5.100 3.554 3.972 1.00 13.83 N ATOM 1859 CA TYR A 177 -5.036 3.701 2.528 1.00 12.52 C ATOM 1860 C TYR A 177 -5.341 2.376 1.839 1.00 17.63 C ATOM 1861 O TYR A 177 -6.067 2.325 0.847 1.00 19.12 O ATOM 1862 CB TYR A 177 -3.687 4.279 2.068 1.00 13.67 C ATOM 1863 CG TYR A 177 -3.720 4.670 0.612 1.00 15.77 C ATOM 1864 CD1 TYR A 177 -4.265 5.882 0.217 1.00 18.49 C ATOM 1865 CD2 TYR A 177 -3.321 3.772 -0.371 1.00 16.52 C ATOM 1866 CE1 TYR A 177 -4.345 6.227 -1.125 1.00 21.26 C ATOM 1867 CE2 TYR A 177 -3.384 4.108 -1.721 1.00 17.39 C ATOM 1868 CZ TYR A 177 -3.920 5.322 -2.090 1.00 22.79 C ATOM 1869 OH TYR A 177 -3.962 5.667 -3.421 1.00 20.56 O ATOM 1870 HA TYR A 177 -5.801 4.420 2.235 1.00 0.00 H ATOM 1871 HB3 TYR A 177 -2.911 3.528 2.216 1.00 0.00 H ATOM 1872 HB2 TYR A 177 -3.457 5.160 2.666 1.00 0.00 H ATOM 1873 HD2 TYR A 177 -2.953 2.788 -0.080 1.00 0.00 H ATOM 1874 HE2 TYR A 177 -3.013 3.417 -2.478 1.00 0.00 H ATOM 1875 HE1 TYR A 177 -4.738 7.200 -1.420 1.00 0.00 H ATOM 1876 HD1 TYR A 177 -4.636 6.575 0.972 1.00 0.00 H ATOM 1877 HH TYR A 177 -4.373 6.562 -3.516 1.00 0.00 H ATOM 1878 H TYR A 177 -4.243 3.670 4.549 1.00 0.00 H ATOM 1879 N LEU A 178 -4.797 1.293 2.365 1.00 17.47 N ATOM 1880 CA LEU A 178 -5.103 -0.030 1.808 1.00 18.82 C ATOM 1881 C LEU A 178 -6.609 -0.331 1.915 1.00 23.64 C ATOM 1882 O LEU A 178 -7.235 -0.765 0.956 1.00 21.46 O ATOM 1883 CB LEU A 178 -4.347 -1.119 2.558 1.00 19.33 C ATOM 1884 CG LEU A 178 -2.897 -1.339 2.142 1.00 26.20 C ATOM 1885 CD1 LEU A 178 -2.132 -1.968 3.304 1.00 27.76 C ATOM 1886 CD2 LEU A 178 -2.837 -2.254 0.892 1.00 26.88 C ATOM 1887 HA LEU A 178 -4.799 -0.020 0.761 1.00 0.00 H ATOM 1888 HB2 LEU A 178 -4.354 -0.860 3.617 1.00 0.00 H ATOM 1889 HB3 LEU A 178 -4.882 -2.057 2.411 1.00 0.00 H ATOM 1890 HG LEU A 178 -2.439 -0.383 1.888 1.00 0.00 H ATOM 1891 HD21 LEU A 178 -3.294 -3.216 1.125 1.00 0.00 H ATOM 1892 HD22 LEU A 178 -3.378 -1.783 0.072 1.00 0.00 H ATOM 1893 HD23 LEU A 178 -1.797 -2.405 0.603 1.00 0.00 H ATOM 1894 HD11 LEU A 178 -2.169 -1.301 4.165 1.00 0.00 H ATOM 1895 HD12 LEU A 178 -2.588 -2.923 3.563 1.00 0.00 H ATOM 1896 HD13 LEU A 178 -1.094 -2.127 3.011 1.00 0.00 H ATOM 1897 H LEU A 178 -4.151 1.378 3.175 1.00 0.00 H ATOM 1898 N ASN A 179 -7.175 -0.141 3.104 1.00 20.84 N ATOM 1899 CA ASN A 179 -8.584 -0.451 3.319 1.00 21.12 C ATOM 1900 C ASN A 179 -9.524 0.443 2.546 1.00 26.78 C ATOM 1901 O ASN A 179 -10.549 -0.012 2.053 1.00 27.43 O ATOM 1902 CB ASN A 179 -8.929 -0.425 4.815 1.00 21.71 C ATOM 1903 CG ASN A 179 -8.514 -1.688 5.519 1.00 38.63 C ATOM 1904 OD1 ASN A 179 -8.268 -2.715 4.888 1.00 37.11 O ATOM 1905 ND2 ASN A 179 -8.384 -1.611 6.827 1.00 38.67 N ATOM 1906 HA ASN A 179 -8.730 -1.460 2.932 1.00 0.00 H ATOM 1907 HB2 ASN A 179 -8.418 0.419 5.278 1.00 0.00 H ATOM 1908 HB3 ASN A 179 -10.006 -0.300 4.924 1.00 0.00 H ATOM 1909 HD22 ASN A 179 -8.603 -0.722 7.320 1.00 0.00 H ATOM 1910 HD21 ASN A 179 -8.062 -2.439 7.367 1.00 0.00 H ATOM 1911 H ASN A 179 -6.606 0.233 3.890 1.00 0.00 H ATOM 1912 N ARG A 180 -9.148 1.701 2.376 1.00 24.15 N ATOM 1913 CA ARG A 180 -9.996 2.651 1.682 1.00 25.00 C ATOM 1914 C ARG A 180 -9.750 2.903 0.200 1.00 29.15 C ATOM 1915 O ARG A 180 -10.661 3.347 -0.511 1.00 29.87 O ATOM 1916 CB ARG A 180 -10.022 3.979 2.453 1.00 27.20 C ATOM 1917 CG ARG A 180 -10.425 3.810 3.912 1.00 39.88 C ATOM 1918 CD ARG A 180 -10.156 5.082 4.718 1.00 48.09 C ATOM 1919 NE ARG A 180 -10.326 4.860 6.153 1.00 50.75 N ATOM 1920 CZ ARG A 180 -10.107 5.784 7.087 1.00 64.32 C ATOM 1921 NH1 ARG A 180 -9.689 6.996 6.744 1.00 45.42 N ATOM 1922 NH2 ARG A 180 -10.299 5.493 8.367 1.00 53.43 N ATOM 1923 HA ARG A 180 -10.965 2.153 1.672 1.00 0.00 H ATOM 1924 HB2 ARG A 180 -9.027 4.422 2.416 1.00 0.00 H ATOM 1925 HB3 ARG A 180 -10.735 4.648 1.970 1.00 0.00 H ATOM 1926 HG2 ARG A 180 -11.489 3.577 3.961 1.00 0.00 H ATOM 1927 HG3 ARG A 180 -9.854 2.989 4.345 1.00 0.00 H ATOM 1928 HD2 ARG A 180 -10.850 5.858 4.396 1.00 0.00 H ATOM 1929 HD3 ARG A 180 -9.134 5.410 4.530 1.00 0.00 H ATOM 1930 HE ARG A 180 -10.639 3.918 6.465 1.00 0.00 H ATOM 1931 HH12 ARG A 180 -9.519 7.714 7.477 1.00 0.00 H ATOM 1932 HH11 ARG A 180 -9.531 7.228 5.742 1.00 0.00 H ATOM 1933 HH22 ARG A 180 -10.128 6.215 9.096 1.00 0.00 H ATOM 1934 HH21 ARG A 180 -10.621 4.543 8.642 1.00 0.00 H ATOM 1935 H ARG A 180 -8.228 2.014 2.747 1.00 0.00 H ATOM 1936 N HIS A 181 -8.525 2.685 -0.269 1.00 23.87 N ATOM 1937 CA HIS A 181 -8.209 2.988 -1.666 1.00 24.87 C ATOM 1938 C HIS A 181 -7.658 1.856 -2.525 1.00 25.07 C ATOM 1939 O HIS A 181 -7.698 1.920 -3.735 1.00 27.47 O ATOM 1940 CB HIS A 181 -7.300 4.209 -1.791 1.00 27.55 C ATOM 1941 CG HIS A 181 -7.885 5.466 -1.216 1.00 33.30 C ATOM 1942 ND1 HIS A 181 -8.508 6.421 -1.993 1.00 36.13 N ATOM 1943 CD2 HIS A 181 -7.908 5.943 0.055 1.00 36.33 C ATOM 1944 CE1 HIS A 181 -8.901 7.423 -1.223 1.00 35.96 C ATOM 1945 NE2 HIS A 181 -8.549 7.158 0.024 1.00 36.11 N ATOM 1946 HA HIS A 181 -9.198 3.189 -2.078 1.00 0.00 H ATOM 1947 HB2 HIS A 181 -6.366 3.996 -1.271 1.00 0.00 H ATOM 1948 HB3 HIS A 181 -7.096 4.378 -2.848 1.00 0.00 H ATOM 1949 HD2 HIS A 181 -7.495 5.453 0.937 1.00 0.00 H ATOM 1950 HE1 HIS A 181 -9.426 8.317 -1.560 1.00 0.00 H ATOM 1951 H HIS A 181 -7.790 2.299 0.358 1.00 0.00 H ATOM 1952 N LEU A 182 -7.071 0.856 -1.910 1.00 17.38 N ATOM 1953 CA LEU A 182 -6.496 -0.252 -2.682 1.00 14.53 C ATOM 1954 C LEU A 182 -7.323 -1.506 -2.594 1.00 18.01 C ATOM 1955 O LEU A 182 -7.199 -2.391 -3.430 1.00 17.43 O ATOM 1956 CB LEU A 182 -5.093 -0.561 -2.175 1.00 12.26 C ATOM 1957 CG LEU A 182 -4.162 0.624 -2.436 1.00 13.49 C ATOM 1958 CD1 LEU A 182 -2.806 0.322 -1.843 1.00 13.65 C ATOM 1959 CD2 LEU A 182 -4.079 0.935 -3.950 1.00 12.52 C ATOM 1960 HA LEU A 182 -6.473 0.068 -3.724 1.00 0.00 H ATOM 1961 HB2 LEU A 182 -5.133 -0.759 -1.104 1.00 0.00 H ATOM 1962 HB3 LEU A 182 -4.709 -1.441 -2.691 1.00 0.00 H ATOM 1963 HG LEU A 182 -4.558 1.519 -1.956 1.00 0.00 H ATOM 1964 HD21 LEU A 182 -3.695 0.062 -4.478 1.00 0.00 H ATOM 1965 HD22 LEU A 182 -5.073 1.179 -4.324 1.00 0.00 H ATOM 1966 HD23 LEU A 182 -3.411 1.781 -4.110 1.00 0.00 H ATOM 1967 HD11 LEU A 182 -2.908 0.162 -0.770 1.00 0.00 H ATOM 1968 HD12 LEU A 182 -2.399 -0.576 -2.308 1.00 0.00 H ATOM 1969 HD13 LEU A 182 -2.136 1.162 -2.025 1.00 0.00 H ATOM 1970 H LEU A 182 -7.013 0.849 -0.872 1.00 0.00 H ATOM 1971 N HIS A 183 -8.115 -1.616 -1.533 1.00 17.87 N ATOM 1972 CA HIS A 183 -8.903 -2.832 -1.293 1.00 18.58 C ATOM 1973 C HIS A 183 -9.704 -3.313 -2.522 1.00 19.21 C ATOM 1974 O HIS A 183 -9.649 -4.488 -2.910 1.00 19.82 O ATOM 1975 CB HIS A 183 -9.802 -2.644 -0.053 1.00 20.98 C ATOM 1976 CG HIS A 183 -10.735 -3.791 0.205 1.00 26.33 C ATOM 1977 ND1 HIS A 183 -10.293 -5.061 0.504 1.00 29.89 N ATOM 1978 CD2 HIS A 183 -12.088 -3.864 0.173 1.00 30.01 C ATOM 1979 CE1 HIS A 183 -11.330 -5.866 0.654 1.00 29.83 C ATOM 1980 NE2 HIS A 183 -12.432 -5.158 0.481 1.00 30.21 N ATOM 1981 HA HIS A 183 -8.192 -3.635 -1.097 1.00 0.00 H ATOM 1982 HB2 HIS A 183 -9.161 -2.520 0.820 1.00 0.00 H ATOM 1983 HB3 HIS A 183 -10.398 -1.742 -0.195 1.00 0.00 H ATOM 1984 HD2 HIS A 183 -12.775 -3.049 -0.055 1.00 0.00 H ATOM 1985 HE1 HIS A 183 -11.284 -6.931 0.881 1.00 0.00 H ATOM 1986 H HIS A 183 -8.178 -0.826 -0.860 1.00 0.00 H ATOM 1987 N THR A 184 -10.475 -2.426 -3.119 1.00 15.62 N ATOM 1988 CA THR A 184 -11.312 -2.808 -4.283 1.00 15.42 C ATOM 1989 C THR A 184 -10.476 -3.332 -5.458 1.00 18.51 C ATOM 1990 O THR A 184 -10.812 -4.354 -6.060 1.00 19.07 O ATOM 1991 CB THR A 184 -12.220 -1.657 -4.712 1.00 25.15 C ATOM 1992 OG1 THR A 184 -13.017 -1.253 -3.588 1.00 27.28 O ATOM 1993 CG2 THR A 184 -13.117 -2.070 -5.885 1.00 22.36 C ATOM 1994 HA THR A 184 -11.946 -3.633 -3.960 1.00 0.00 H ATOM 1995 HB THR A 184 -11.606 -0.822 -5.048 1.00 0.00 H ATOM 1996 HG1 THR A 184 -12.423 -0.957 -2.853 1.00 0.00 H ATOM 1997 HG23 THR A 184 -12.495 -2.373 -6.727 1.00 0.00 H ATOM 1998 HG21 THR A 184 -13.750 -2.904 -5.581 1.00 0.00 H ATOM 1999 HG22 THR A 184 -13.742 -1.226 -6.178 1.00 0.00 H ATOM 2000 H THR A 184 -10.497 -1.447 -2.770 1.00 0.00 H ATOM 2001 N TRP A 185 -9.387 -2.636 -5.769 1.00 12.74 N ATOM 2002 CA TRP A 185 -8.504 -3.063 -6.846 1.00 11.88 C ATOM 2003 C TRP A 185 -7.973 -4.432 -6.535 1.00 14.53 C ATOM 2004 O TRP A 185 -7.968 -5.302 -7.389 1.00 11.07 O ATOM 2005 CB TRP A 185 -7.338 -2.090 -7.027 1.00 10.27 C ATOM 2006 CG TRP A 185 -6.515 -2.391 -8.239 1.00 11.16 C ATOM 2007 CD1 TRP A 185 -6.704 -1.902 -9.515 1.00 13.85 C ATOM 2008 CD2 TRP A 185 -5.419 -3.316 -8.326 1.00 11.38 C ATOM 2009 NE1 TRP A 185 -5.743 -2.424 -10.361 1.00 12.07 N ATOM 2010 CE2 TRP A 185 -4.949 -3.288 -9.659 1.00 14.09 C ATOM 2011 CE3 TRP A 185 -4.749 -4.116 -7.387 1.00 12.96 C ATOM 2012 CZ2 TRP A 185 -3.865 -4.057 -10.089 1.00 13.46 C ATOM 2013 CZ3 TRP A 185 -3.669 -4.880 -7.818 1.00 14.35 C ATOM 2014 CH2 TRP A 185 -3.272 -4.877 -9.169 1.00 15.06 C ATOM 2015 HA TRP A 185 -9.075 -3.082 -7.774 1.00 0.00 H ATOM 2016 HB2 TRP A 185 -7.738 -1.080 -7.119 1.00 0.00 H ATOM 2017 HB3 TRP A 185 -6.697 -2.147 -6.147 1.00 0.00 H ATOM 2018 HE1 TRP A 185 -5.640 -2.196 -11.370 1.00 0.00 H ATOM 2019 HD1 TRP A 185 -7.492 -1.209 -9.811 1.00 0.00 H ATOM 2020 HZ2 TRP A 185 -3.506 -4.006 -11.117 1.00 0.00 H ATOM 2021 HH2 TRP A 185 -2.472 -5.545 -9.489 1.00 0.00 H ATOM 2022 HZ3 TRP A 185 -3.122 -5.490 -7.099 1.00 0.00 H ATOM 2023 HE3 TRP A 185 -5.067 -4.138 -6.345 1.00 0.00 H ATOM 2024 H TRP A 185 -9.162 -1.773 -5.235 1.00 0.00 H ATOM 2025 N ILE A 186 -7.536 -4.630 -5.289 1.00 14.32 N ATOM 2026 CA ILE A 186 -6.971 -5.919 -4.884 1.00 12.90 C ATOM 2027 C ILE A 186 -7.974 -7.065 -5.036 1.00 16.24 C ATOM 2028 O ILE A 186 -7.682 -8.120 -5.594 1.00 15.89 O ATOM 2029 CB ILE A 186 -6.421 -5.839 -3.449 1.00 14.76 C ATOM 2030 CG1 ILE A 186 -5.134 -4.985 -3.429 1.00 14.74 C ATOM 2031 CG2 ILE A 186 -6.248 -7.253 -2.896 1.00 15.41 C ATOM 2032 CD1 ILE A 186 -4.641 -4.545 -2.031 1.00 13.34 C ATOM 2033 HA ILE A 186 -6.143 -6.141 -5.558 1.00 0.00 H ATOM 2034 HB ILE A 186 -7.122 -5.334 -2.785 1.00 0.00 H ATOM 2035 HG12 ILE A 186 -4.339 -5.566 -3.897 1.00 0.00 H ATOM 2036 HG13 ILE A 186 -5.319 -4.086 -4.017 1.00 0.00 H ATOM 2037 HD11 ILE A 186 -5.413 -3.946 -1.547 1.00 0.00 H ATOM 2038 HD12 ILE A 186 -4.432 -5.428 -1.427 1.00 0.00 H ATOM 2039 HD13 ILE A 186 -3.733 -3.952 -2.137 1.00 0.00 H ATOM 2040 HG21 ILE A 186 -7.213 -7.760 -2.890 1.00 0.00 H ATOM 2041 HG22 ILE A 186 -5.550 -7.805 -3.525 1.00 0.00 H ATOM 2042 HG23 ILE A 186 -5.858 -7.199 -1.879 1.00 0.00 H ATOM 2043 H ILE A 186 -7.598 -3.857 -4.596 1.00 0.00 H ATOM 2044 N GLN A 187 -9.176 -6.844 -4.550 1.00 13.07 N ATOM 2045 CA GLN A 187 -10.222 -7.859 -4.634 1.00 13.50 C ATOM 2046 C GLN A 187 -10.615 -8.131 -6.110 1.00 16.16 C ATOM 2047 O GLN A 187 -10.806 -9.280 -6.513 1.00 17.38 O ATOM 2048 CB GLN A 187 -11.447 -7.345 -3.865 1.00 16.38 C ATOM 2049 CG GLN A 187 -12.721 -8.095 -4.152 1.00 45.52 C ATOM 2050 CD GLN A 187 -13.809 -7.815 -3.118 1.00 63.76 C ATOM 2051 OE1 GLN A 187 -13.799 -6.781 -2.434 1.00 49.77 O ATOM 2052 NE2 GLN A 187 -14.765 -8.733 -3.015 1.00 59.72 N ATOM 2053 HA GLN A 187 -9.856 -8.792 -4.205 1.00 0.00 H ATOM 2054 HB2 GLN A 187 -11.238 -7.423 -2.798 1.00 0.00 H ATOM 2055 HB3 GLN A 187 -11.601 -6.298 -4.128 1.00 0.00 H ATOM 2056 HG2 GLN A 187 -13.088 -7.799 -5.135 1.00 0.00 H ATOM 2057 HG3 GLN A 187 -12.506 -9.163 -4.153 1.00 0.00 H ATOM 2058 HE22 GLN A 187 -14.733 -9.586 -3.609 1.00 0.00 H ATOM 2059 HE21 GLN A 187 -15.545 -8.598 -2.340 1.00 0.00 H ATOM 2060 H GLN A 187 -9.385 -5.931 -4.098 1.00 0.00 H ATOM 2061 N ASP A 188 -10.696 -7.070 -6.918 1.00 10.31 N ATOM 2062 CA ASP A 188 -11.049 -7.206 -8.344 1.00 10.76 C ATOM 2063 C ASP A 188 -9.980 -7.999 -9.084 1.00 17.19 C ATOM 2064 O ASP A 188 -10.221 -8.546 -10.159 1.00 18.09 O ATOM 2065 CB ASP A 188 -11.189 -5.830 -9.008 1.00 8.89 C ATOM 2066 CG ASP A 188 -12.440 -5.095 -8.559 1.00 15.99 C ATOM 2067 OD1 ASP A 188 -12.597 -3.892 -8.913 1.00 17.30 O ATOM 2068 OD2 ASP A 188 -13.304 -5.751 -7.937 1.00 17.71 O ATOM 2069 HA ASP A 188 -12.003 -7.731 -8.398 1.00 0.00 H ATOM 2070 HB2 ASP A 188 -10.318 -5.227 -8.752 1.00 0.00 H ATOM 2071 HB3 ASP A 188 -11.231 -5.965 -10.089 1.00 0.00 H ATOM 2072 H ASP A 188 -10.505 -6.123 -6.532 1.00 0.00 H ATOM 2073 N ASN A 189 -8.796 -8.058 -8.500 1.00 15.20 N ATOM 2074 CA ASN A 189 -7.711 -8.815 -9.108 1.00 15.42 C ATOM 2075 C ASN A 189 -7.590 -10.189 -8.479 1.00 23.53 C ATOM 2076 O ASN A 189 -6.595 -10.861 -8.690 1.00 26.15 O ATOM 2077 CB ASN A 189 -6.390 -8.098 -8.890 1.00 11.72 C ATOM 2078 CG ASN A 189 -6.078 -7.156 -9.996 1.00 18.90 C ATOM 2079 OD1 ASN A 189 -5.496 -7.559 -10.980 1.00 16.64 O ATOM 2080 ND2 ASN A 189 -6.628 -5.952 -9.930 1.00 14.82 N ATOM 2081 HA ASN A 189 -7.934 -8.908 -10.171 1.00 0.00 H ATOM 2082 HB2 ASN A 189 -6.443 -7.539 -7.956 1.00 0.00 H ATOM 2083 HB3 ASN A 189 -5.594 -8.839 -8.824 1.00 0.00 H ATOM 2084 HD22 ASN A 189 -7.117 -5.651 -9.063 1.00 0.00 H ATOM 2085 HD21 ASN A 189 -6.570 -5.309 -10.745 1.00 0.00 H ATOM 2086 H ASN A 189 -8.638 -7.561 -7.600 1.00 0.00 H ATOM 2087 N GLY A 190 -8.552 -10.572 -7.651 1.00 20.56 N ATOM 2088 CA GLY A 190 -8.534 -11.878 -7.006 1.00 20.90 C ATOM 2089 C GLY A 190 -7.997 -11.936 -5.581 1.00 25.39 C ATOM 2090 O GLY A 190 -7.881 -13.023 -4.995 1.00 25.12 O ATOM 2091 HA3 GLY A 190 -7.919 -12.539 -7.617 1.00 0.00 H ATOM 2092 HA2 GLY A 190 -9.558 -12.251 -6.988 1.00 0.00 H ATOM 2093 H GLY A 190 -9.341 -9.923 -7.457 1.00 0.00 H ATOM 2094 N GLY A 191 -7.613 -10.782 -5.034 1.00 21.17 N ATOM 2095 CA GLY A 191 -7.075 -10.712 -3.685 1.00 19.62 C ATOM 2096 C GLY A 191 -5.586 -10.996 -3.644 1.00 20.02 C ATOM 2097 O GLY A 191 -4.967 -11.146 -4.678 1.00 22.07 O ATOM 2098 HA3 GLY A 191 -7.589 -11.445 -3.064 1.00 0.00 H ATOM 2099 HA2 GLY A 191 -7.253 -9.713 -3.288 1.00 0.00 H ATOM 2100 H GLY A 191 -7.701 -9.907 -5.588 1.00 0.00 H ATOM 2101 N TRP A 192 -5.030 -11.120 -2.440 1.00 16.16 N ATOM 2102 CA TRP A 192 -3.607 -11.380 -2.226 1.00 15.98 C ATOM 2103 C TRP A 192 -3.125 -12.738 -2.753 1.00 20.01 C ATOM 2104 O TRP A 192 -1.945 -12.926 -2.986 1.00 19.38 O ATOM 2105 CB TRP A 192 -3.259 -11.224 -0.742 1.00 15.75 C ATOM 2106 CG TRP A 192 -3.199 -9.755 -0.304 1.00 16.74 C ATOM 2107 CD1 TRP A 192 -4.168 -9.052 0.340 1.00 19.30 C ATOM 2108 CD2 TRP A 192 -2.127 -8.827 -0.555 1.00 16.61 C ATOM 2109 NE1 TRP A 192 -3.745 -7.759 0.561 1.00 17.96 N ATOM 2110 CE2 TRP A 192 -2.512 -7.583 -0.012 1.00 19.48 C ATOM 2111 CE3 TRP A 192 -0.851 -8.949 -1.119 1.00 17.73 C ATOM 2112 CZ2 TRP A 192 -1.666 -6.469 -0.013 1.00 18.33 C ATOM 2113 CZ3 TRP A 192 -0.028 -7.830 -1.152 1.00 18.59 C ATOM 2114 CH2 TRP A 192 -0.441 -6.605 -0.592 1.00 18.90 C ATOM 2115 HA TRP A 192 -3.075 -10.634 -2.816 1.00 0.00 H ATOM 2116 HB2 TRP A 192 -4.018 -11.735 -0.149 1.00 0.00 H ATOM 2117 HB3 TRP A 192 -2.287 -11.683 -0.560 1.00 0.00 H ATOM 2118 HE1 TRP A 192 -4.277 -7.032 1.080 1.00 0.00 H ATOM 2119 HD1 TRP A 192 -5.137 -9.452 0.638 1.00 0.00 H ATOM 2120 HZ2 TRP A 192 -1.977 -5.525 0.434 1.00 0.00 H ATOM 2121 HH2 TRP A 192 0.233 -5.749 -0.623 1.00 0.00 H ATOM 2122 HZ3 TRP A 192 0.954 -7.901 -1.619 1.00 0.00 H ATOM 2123 HE3 TRP A 192 -0.511 -9.902 -1.524 1.00 0.00 H ATOM 2124 H TRP A 192 -5.643 -11.027 -1.605 1.00 0.00 H ATOM 2125 N ASP A 193 -4.048 -13.670 -2.985 1.00 15.92 N ATOM 2126 CA ASP A 193 -3.665 -14.963 -3.536 1.00 15.77 C ATOM 2127 C ASP A 193 -3.076 -14.721 -4.918 1.00 17.67 C ATOM 2128 O ASP A 193 -2.167 -15.430 -5.339 1.00 18.81 O ATOM 2129 CB ASP A 193 -4.880 -15.894 -3.670 1.00 18.17 C ATOM 2130 CG ASP A 193 -5.238 -16.615 -2.350 1.00 28.58 C ATOM 2131 OD1 ASP A 193 -4.435 -16.589 -1.395 1.00 25.64 O ATOM 2132 OD2 ASP A 193 -6.343 -17.212 -2.295 1.00 34.55 O ATOM 2133 HA ASP A 193 -2.945 -15.439 -2.870 1.00 0.00 H ATOM 2134 HB2 ASP A 193 -5.739 -15.302 -3.986 1.00 0.00 H ATOM 2135 HB3 ASP A 193 -4.660 -16.646 -4.428 1.00 0.00 H ATOM 2136 H ASP A 193 -5.047 -13.474 -2.772 1.00 0.00 H ATOM 2137 N ALA A 194 -3.616 -13.737 -5.632 1.00 14.98 N ATOM 2138 CA ALA A 194 -3.140 -13.400 -6.979 1.00 15.36 C ATOM 2139 C ALA A 194 -1.718 -12.850 -6.953 1.00 19.64 C ATOM 2140 O ALA A 194 -0.894 -13.149 -7.832 1.00 19.89 O ATOM 2141 CB ALA A 194 -4.064 -12.430 -7.668 1.00 16.23 C ATOM 2142 HA ALA A 194 -3.134 -14.328 -7.551 1.00 0.00 H ATOM 2143 HB1 ALA A 194 -5.056 -12.874 -7.754 1.00 0.00 H ATOM 2144 HB2 ALA A 194 -4.125 -11.511 -7.084 1.00 0.00 H ATOM 2145 HB3 ALA A 194 -3.677 -12.205 -8.662 1.00 0.00 H ATOM 2146 H ALA A 194 -4.400 -13.189 -5.223 1.00 0.00 H ATOM 2147 N PHE A 195 -1.435 -12.045 -5.941 1.00 15.17 N ATOM 2148 CA PHE A 195 -0.095 -11.481 -5.759 1.00 14.24 C ATOM 2149 C PHE A 195 0.867 -12.629 -5.473 1.00 15.97 C ATOM 2150 O PHE A 195 1.944 -12.722 -6.047 1.00 15.15 O ATOM 2151 CB PHE A 195 -0.099 -10.531 -4.555 1.00 15.45 C ATOM 2152 CG PHE A 195 1.268 -10.060 -4.170 1.00 14.92 C ATOM 2153 CD1 PHE A 195 1.965 -9.210 -5.000 1.00 16.71 C ATOM 2154 CD2 PHE A 195 1.869 -10.502 -2.997 1.00 18.40 C ATOM 2155 CE1 PHE A 195 3.226 -8.773 -4.671 1.00 18.07 C ATOM 2156 CE2 PHE A 195 3.170 -10.084 -2.666 1.00 20.77 C ATOM 2157 CZ PHE A 195 3.838 -9.209 -3.509 1.00 16.87 C ATOM 2158 HA PHE A 195 0.207 -10.935 -6.653 1.00 0.00 H ATOM 2159 HB2 PHE A 195 -0.708 -9.662 -4.802 1.00 0.00 H ATOM 2160 HB3 PHE A 195 -0.539 -11.052 -3.704 1.00 0.00 H ATOM 2161 HD2 PHE A 195 1.329 -11.175 -2.331 1.00 0.00 H ATOM 2162 HE2 PHE A 195 3.649 -10.444 -1.756 1.00 0.00 H ATOM 2163 HZ PHE A 195 4.841 -8.866 -3.257 1.00 0.00 H ATOM 2164 HE1 PHE A 195 3.747 -8.078 -5.330 1.00 0.00 H ATOM 2165 HD1 PHE A 195 1.509 -8.878 -5.933 1.00 0.00 H ATOM 2166 H PHE A 195 -2.182 -11.807 -5.258 1.00 0.00 H ATOM 2167 N VAL A 196 0.474 -13.516 -4.575 1.00 14.72 N ATOM 2168 CA VAL A 196 1.327 -14.676 -4.279 1.00 16.49 C ATOM 2169 C VAL A 196 1.659 -15.497 -5.538 1.00 20.32 C ATOM 2170 O VAL A 196 2.817 -15.823 -5.806 1.00 19.13 O ATOM 2171 CB VAL A 196 0.744 -15.542 -3.172 1.00 21.40 C ATOM 2172 CG1 VAL A 196 1.558 -16.856 -3.034 1.00 22.03 C ATOM 2173 CG2 VAL A 196 0.734 -14.765 -1.849 1.00 20.80 C ATOM 2174 HA VAL A 196 2.273 -14.280 -3.910 1.00 0.00 H ATOM 2175 HB VAL A 196 -0.283 -15.803 -3.427 1.00 0.00 H ATOM 2176 HG11 VAL A 196 1.521 -17.406 -3.975 1.00 0.00 H ATOM 2177 HG12 VAL A 196 2.594 -16.617 -2.792 1.00 0.00 H ATOM 2178 HG13 VAL A 196 1.129 -17.465 -2.238 1.00 0.00 H ATOM 2179 HG21 VAL A 196 1.754 -14.484 -1.586 1.00 0.00 H ATOM 2180 HG22 VAL A 196 0.126 -13.867 -1.961 1.00 0.00 H ATOM 2181 HG23 VAL A 196 0.315 -15.393 -1.063 1.00 0.00 H ATOM 2182 H VAL A 196 -0.433 -13.394 -4.081 1.00 0.00 H ATOM 2183 N GLU A 197 0.648 -15.755 -6.352 1.00 16.09 N ATOM 2184 CA GLU A 197 0.866 -16.526 -7.570 1.00 15.42 C ATOM 2185 C GLU A 197 1.819 -15.810 -8.502 1.00 22.35 C ATOM 2186 O GLU A 197 2.694 -16.429 -9.103 1.00 22.36 O ATOM 2187 CB GLU A 197 -0.452 -16.724 -8.298 1.00 15.65 C ATOM 2188 CG GLU A 197 -0.287 -17.251 -9.699 1.00 21.10 C ATOM 2189 CD GLU A 197 -1.575 -17.809 -10.225 1.00 35.56 C ATOM 2190 OE1 GLU A 197 -2.243 -18.535 -9.459 1.00 17.49 O ATOM 2191 OE2 GLU A 197 -1.947 -17.485 -11.377 1.00 22.92 O ATOM 2192 HA GLU A 197 1.293 -17.487 -7.283 1.00 0.00 H ATOM 2193 HB2 GLU A 197 -1.057 -17.431 -7.731 1.00 0.00 H ATOM 2194 HB3 GLU A 197 -0.967 -15.765 -8.348 1.00 0.00 H ATOM 2195 HG2 GLU A 197 0.040 -16.439 -10.348 1.00 0.00 H ATOM 2196 HG3 GLU A 197 0.467 -18.038 -9.696 1.00 0.00 H ATOM 2197 H GLU A 197 -0.305 -15.407 -6.122 1.00 0.00 H ATOM 2198 N LEU A 198 1.582 -14.511 -8.685 1.00 19.39 N ATOM 2199 CA LEU A 198 2.357 -13.699 -9.615 1.00 19.94 C ATOM 2200 C LEU A 198 3.821 -13.638 -9.221 1.00 23.97 C ATOM 2201 O LEU A 198 4.716 -13.666 -10.078 1.00 22.41 O ATOM 2202 CB LEU A 198 1.790 -12.286 -9.636 1.00 21.06 C ATOM 2203 CG LEU A 198 1.657 -11.530 -10.940 1.00 27.97 C ATOM 2204 CD1 LEU A 198 1.205 -12.436 -12.067 1.00 28.45 C ATOM 2205 CD2 LEU A 198 0.673 -10.387 -10.720 1.00 31.93 C ATOM 2206 HA LEU A 198 2.289 -14.158 -10.601 1.00 0.00 H ATOM 2207 HB2 LEU A 198 0.790 -12.344 -9.205 1.00 0.00 H ATOM 2208 HB3 LEU A 198 2.428 -11.684 -8.990 1.00 0.00 H ATOM 2209 HG LEU A 198 2.629 -11.135 -11.238 1.00 0.00 H ATOM 2210 HD21 LEU A 198 -0.292 -10.793 -10.418 1.00 0.00 H ATOM 2211 HD22 LEU A 198 1.052 -9.729 -9.938 1.00 0.00 H ATOM 2212 HD23 LEU A 198 0.558 -9.824 -11.647 1.00 0.00 H ATOM 2213 HD11 LEU A 198 1.934 -13.234 -12.204 1.00 0.00 H ATOM 2214 HD12 LEU A 198 0.235 -12.867 -11.818 1.00 0.00 H ATOM 2215 HD13 LEU A 198 1.121 -11.856 -12.986 1.00 0.00 H ATOM 2216 H LEU A 198 0.816 -14.060 -8.145 1.00 0.00 H ATOM 2217 N TYR A 199 4.081 -13.495 -7.928 1.00 20.99 N ATOM 2218 CA TYR A 199 5.468 -13.414 -7.485 1.00 22.35 C ATOM 2219 C TYR A 199 6.151 -14.777 -7.557 1.00 31.10 C ATOM 2220 O TYR A 199 7.290 -14.879 -8.008 1.00 30.33 O ATOM 2221 CB TYR A 199 5.597 -12.833 -6.069 1.00 21.73 C ATOM 2222 CG TYR A 199 7.034 -12.644 -5.664 1.00 21.93 C ATOM 2223 CD1 TYR A 199 7.740 -11.530 -6.068 1.00 22.59 C ATOM 2224 CD2 TYR A 199 7.722 -13.647 -4.980 1.00 23.69 C ATOM 2225 CE1 TYR A 199 9.071 -11.361 -5.725 1.00 22.13 C ATOM 2226 CE2 TYR A 199 9.069 -13.496 -4.652 1.00 24.14 C ATOM 2227 CZ TYR A 199 9.734 -12.360 -5.053 1.00 25.80 C ATOM 2228 OH TYR A 199 11.063 -12.197 -4.717 1.00 25.76 O ATOM 2229 HA TYR A 199 5.971 -12.731 -8.169 1.00 0.00 H ATOM 2230 HB3 TYR A 199 5.119 -13.514 -5.364 1.00 0.00 H ATOM 2231 HB2 TYR A 199 5.093 -11.867 -6.038 1.00 0.00 H ATOM 2232 HD2 TYR A 199 7.199 -14.561 -4.698 1.00 0.00 H ATOM 2233 HE2 TYR A 199 9.589 -14.268 -4.085 1.00 0.00 H ATOM 2234 HE1 TYR A 199 9.591 -10.439 -5.987 1.00 0.00 H ATOM 2235 HD1 TYR A 199 7.241 -10.769 -6.668 1.00 0.00 H ATOM 2236 HH TYR A 199 11.390 -11.335 -5.078 1.00 0.00 H ATOM 2237 H TYR A 199 3.305 -13.441 -7.238 1.00 0.00 H ATOM 2238 N GLY A 200 5.446 -15.810 -7.111 1.00 32.37 N ATOM 2239 CA GLY A 200 5.960 -17.171 -7.070 1.00 35.58 C ATOM 2240 C GLY A 200 6.510 -17.474 -5.680 1.00 46.36 C ATOM 2241 O GLY A 200 7.540 -16.930 -5.280 1.00 47.33 O ATOM 2242 HA3 GLY A 200 6.756 -17.280 -7.806 1.00 0.00 H ATOM 2243 HA2 GLY A 200 5.155 -17.869 -7.301 1.00 0.00 H ATOM 2244 H GLY A 200 4.477 -15.638 -6.774 1.00 0.00 H ATOM 2245 N PRO A 201 5.806 -18.310 -4.891 1.00 46.65 N ATOM 2246 CA PRO A 201 4.620 -19.160 -5.024 1.00 52.20 C ATOM 2247 C PRO A 201 3.507 -18.494 -5.816 1.00107.94 C ATOM 2248 O PRO A 201 3.061 -19.021 -6.833 1.00 81.05 O ATOM 2249 CB PRO A 201 4.186 -19.383 -3.565 1.00 53.12 C ATOM 2250 CG PRO A 201 4.940 -18.306 -2.735 1.00 56.19 C ATOM 2251 CD PRO A 201 5.704 -17.443 -3.706 1.00 50.47 C ATOM 2252 HA PRO A 201 4.836 -20.079 -5.569 1.00 0.00 H ATOM 2253 HD3 PRO A 201 5.158 -16.527 -3.933 1.00 0.00 H ATOM 2254 HD2 PRO A 201 6.690 -17.190 -3.317 1.00 0.00 H ATOM 2255 HG3 PRO A 201 5.629 -18.786 -2.040 1.00 0.00 H ATOM 2256 HG2 PRO A 201 4.227 -17.699 -2.177 1.00 0.00 H ATOM 2257 HB2 PRO A 201 3.108 -19.255 -3.465 1.00 0.00 H ATOM 2258 HB3 PRO A 201 4.465 -20.383 -3.233 1.00 0.00 H TER 2259 PRO A 201 HETATM 2260 O HOH 1 11.400 -0.115 2.736 1.00 12.43 O HETATM 2261 O HOH 2 -4.566 -1.959 -13.280 1.00 13.18 O HETATM 2262 O HOH 3 15.355 3.197 -9.456 1.00 25.44 O HETATM 2263 O HOH 4 -14.694 -2.482 -9.038 1.00 19.54 O HETATM 2264 O HOH 5 -7.043 -13.836 -2.473 1.00 17.42 O HETATM 2265 O HOH 6 1.997 20.101 10.430 1.00 20.51 O HETATM 2266 O HOH 7 -7.295 -10.746 -0.376 1.00 18.11 O HETATM 2267 O HOH 8 9.926 -4.449 15.376 1.00 23.77 O HETATM 2268 O HOH 9 7.443 3.116 17.624 1.00 23.46 O HETATM 2269 O HOH 10 13.414 12.515 19.394 1.00 22.20 O HETATM 2270 O HOH 11 -11.236 0.256 -2.087 1.00 27.71 O HETATM 2271 O HOH 12 -4.026 7.150 4.458 1.00 31.51 O HETATM 2272 O HOH 13 10.734 -6.169 2.282 1.00 20.68 O HETATM 2273 O HOH 14 -7.844 -6.463 0.223 1.00 40.75 O HETATM 2274 O HOH 15 -0.553 -5.678 -11.609 1.00 21.35 O HETATM 2275 O HOH 16 3.119 6.749 18.651 1.00 34.95 O HETATM 2276 O HOH 17 -2.057 10.347 12.854 1.00 37.34 O HETATM 2277 O HOH 18 -9.110 0.171 -5.136 1.00 22.27 O HETATM 2278 O HOH 19 3.189 -8.612 5.758 1.00 16.66 O HETATM 2279 O HOH 20 3.930 -9.256 -13.468 1.00 44.98 O HETATM 2280 O HOH 21 9.244 -6.713 6.346 1.00 27.52 O HETATM 2281 O HOH 22 5.728 -8.874 5.106 1.00 19.15 O HETATM 2282 O HOH 23 14.202 -3.002 20.461 1.00 25.61 O HETATM 2283 O HOH 24 2.850 22.267 11.724 1.00 25.91 O HETATM 2284 O HOH 25 -3.590 8.605 -6.764 1.00 24.84 O HETATM 2285 O HOH 26 16.792 -4.792 -1.114 1.00 40.18 O HETATM 2286 O HOH 27 -9.072 0.874 7.927 1.00 42.26 O HETATM 2287 O HOH 28 -3.731 -9.854 -10.542 1.00 25.73 O HETATM 2288 O HOH 29 4.269 0.665 -13.413 1.00 34.28 O HETATM 2289 O HOH 30 11.228 19.205 7.235 1.00 38.84 O HETATM 2290 O HOH 31 7.698 5.555 -10.931 1.00 47.34 O HETATM 2291 O HOH 32 4.344 5.191 -10.101 1.00 44.82 O HETATM 2292 O HOH 33 11.000 -6.301 4.580 1.00 37.64 O HETATM 2293 O HOH 34 9.554 -4.324 -13.042 1.00 33.90 O HETATM 2294 O HOH 35 8.055 -6.753 19.212 1.00 41.97 O HETATM 2295 O HOH 36 -3.706 -10.891 6.841 1.00 43.60 O HETATM 2296 O HOH 37 -0.217 -19.443 4.562 1.00 30.19 O HETATM 2297 O HOH 38 16.596 -9.309 -4.032 1.00 33.17 O HETATM 2298 O HOH 39 -1.027 -12.634 10.269 1.00 49.22 O HETATM 2299 O HOH 40 3.523 10.506 16.714 1.00 37.63 O HETATM 2300 O HOH 41 5.881 3.723 19.425 1.00 42.22 O HETATM 2301 O HOH 42 -3.383 10.794 -0.560 1.00 32.58 O HETATM 2302 O HOH 43 4.930 3.256 -11.938 1.00 39.27 O HETATM 2303 O HOH 44 -3.948 0.198 11.949 1.00 43.88 O HETATM 2304 O HOH 45 -0.583 10.993 17.094 1.00 59.63 O HETATM 2305 O HOH 46 18.981 2.777 7.381 1.00 49.18 O HETATM 2306 O HOH 47 12.355 8.712 -5.416 1.00 42.10 O HETATM 2307 O HOH 48 21.474 5.449 -6.698 1.00 47.96 O HETATM 2308 O HOH 49 17.819 16.990 7.128 1.00 58.19 O HETATM 2309 O HOH 50 1.584 3.684 -16.271 1.00 49.33 O HETATM 2310 O HOH 51 -0.297 -16.980 3.362 1.00 43.96 O HETATM 2311 O HOH 52 -15.129 -3.250 -2.331 1.00 42.98 O HETATM 2312 O HOH 53 0.738 5.665 -11.053 1.00 35.01 O HETATM 2313 O HOH 54 9.241 19.798 9.408 1.00 30.66 O HETATM 2314 O HOH 55 13.852 -3.216 1.278 1.00 37.15 O HETATM 2315 O HOH 56 -12.634 0.168 0.308 1.00 42.03 O HETATM 2316 O HOH 57 11.874 -5.876 -12.349 1.00 35.21 O HETATM 2317 O HOH 58 -2.772 9.859 4.754 1.00 55.03 O HETATM 2318 O HOH 59 15.400 3.603 4.197 1.00 39.09 O HETATM 2319 O HOH 60 -4.626 8.007 -4.393 1.00 37.25 O HETATM 2320 O HOH 61 8.857 16.920 3.754 1.00 46.10 O HETATM 2321 O HOH 62 8.988 -9.643 12.696 1.00 44.47 O HETATM 2322 O HOH 63 20.200 2.585 2.471 1.00 56.78 O HETATM 2323 O HOH 64 -0.825 1.866 14.266 1.00 37.98 O HETATM 2324 O HOH 65 19.748 4.581 1.208 1.00 54.25 O HETATM 2325 O HOH 66 -8.004 -9.545 13.301 1.00 59.50 O HETATM 2326 O HOH 67 14.335 -5.010 22.504 1.00 39.09 O HETATM 2327 O HOH 68 0.004 -20.421 -11.894 1.00 37.26 O HETATM 2328 O HOH 69 16.090 -8.618 4.944 1.00 60.04 O HETATM 2329 O HOH 70 17.810 -6.912 -1.219 1.00 41.05 O HETATM 2330 O HOH 71 -10.008 -9.645 -1.736 1.00 47.44 O HETATM 2331 O HOH 72 -4.868 9.924 -2.723 1.00 42.40 O HETATM 2332 O HOH 73 4.303 17.221 16.834 1.00 42.50 O HETATM 2333 O HOH 74 -6.535 6.936 3.238 1.00 28.55 O HETATM 2334 O HOH 75 -6.217 9.185 1.489 1.00 50.86 O HETATM 2335 O HOH 76 14.652 -8.128 23.565 1.00 52.32 O HETATM 2336 O HOH 77 13.470 18.236 8.087 1.00 57.40 O HETATM 2337 O HOH 78 6.830 5.121 21.558 1.00 62.80 O HETATM 2338 O HOH 79 16.488 13.825 14.874 1.00 39.94 O HETATM 2339 O HOH 80 2.141 17.305 15.310 1.00 47.76 O HETATM 2340 O HOH 81 -5.898 8.404 -14.335 1.00 49.87 O HETATM 2341 O HOH 82 -2.914 -20.996 -11.506 1.00 43.35 O HETATM 2342 O HOH 83 2.558 1.708 22.269 1.00 48.99 O HETATM 2343 O HOH 84 13.108 -8.817 4.617 1.00 69.41 O HETATM 2344 O HOH 85 3.944 1.667 19.688 1.00 47.38 O HETATM 2345 O HOH 86 14.750 -1.270 4.625 1.00 60.27 O HETATM 2346 O HOH 87 -11.511 5.549 -3.476 1.00 51.48 O HETATM 2347 O HOH 88 17.038 1.597 4.905 1.00 54.75 O HETATM 2348 O HOH 89 10.054 5.375 -13.297 1.00 62.58 O HETATM 2349 O HOH 90 12.678 4.758 -11.689 1.00 52.39 O HETATM 2350 O HOH 91 11.457 2.857 -11.907 1.00 80.08 O HETATM 2351 C4 UNN A 92 9.991 5.759 -4.529 1.00 -0.07 C HETATM 2352 C17 UNN A 92 8.670 5.468 -4.808 1.00 -0.05 C HETATM 2353 C5 UNN A 92 8.025 4.456 -4.125 1.00 -0.07 C HETATM 2354 C15 UNN A 92 8.701 3.719 -3.177 1.00 -0.06 C HETATM 2355 C24 UNN A 92 10.025 4.009 -2.918 1.00 0.03 C HETATM 2356 C14 UNN A 92 10.684 5.017 -3.591 1.00 -0.06 C HETATM 2357 H17 UNN A 92 11.729 5.224 -3.388 1.00 0.06 H HETATM 2358 CL6 UNN A 92 10.863 3.074 -1.739 1.00 -0.08 CL HETATM 2359 H8 UNN A 92 8.199 2.921 -2.641 1.00 0.06 H HETATM 2360 H2 UNN A 92 6.984 4.241 -4.335 1.00 0.05 H HETATM 2361 C25 UNN A 92 7.939 6.275 -5.786 1.00 -0.05 C HETATM 2362 C26 UNN A 92 8.216 6.257 -7.102 1.00 -0.01 C HETATM 2363 C29 UNN A 92 7.475 7.120 -8.062 1.00 -0.01 C HETATM 2364 C39 UNN A 92 6.789 8.278 -7.374 1.00 -0.02 C HETATM 2365 C30 UNN A 92 5.967 7.693 -6.261 1.00 -0.04 C HETATM 2366 C28 UNN A 92 6.874 7.122 -5.188 1.00 -0.04 C HETATM 2367 H9 UNN A 92 7.341 7.950 -4.634 1.00 0.03 H HETATM 2368 H10 UNN A 92 6.274 6.511 -4.497 1.00 0.03 H HETATM 2369 H21 UNN A 92 5.335 8.480 -5.823 1.00 0.03 H HETATM 2370 H22 UNN A 92 5.329 6.892 -6.662 1.00 0.03 H HETATM 2371 C40 UNN A 92 5.904 9.009 -8.359 1.00 -0.06 C HETATM 2372 H39 UNN A 92 6.522 9.430 -9.165 1.00 0.02 H HETATM 2373 H40 UNN A 92 5.373 9.822 -7.842 1.00 0.02 H HETATM 2374 H41 UNN A 92 5.173 8.307 -8.786 1.00 0.02 H HETATM 2375 C41 UNN A 92 7.777 9.264 -6.804 1.00 -0.06 C HETATM 2376 H42 UNN A 92 8.432 8.752 -6.084 1.00 0.02 H HETATM 2377 H43 UNN A 92 7.234 10.074 -6.295 1.00 0.02 H HETATM 2378 H44 UNN A 92 8.386 9.685 -7.618 1.00 0.02 H HETATM 2379 H19 UNN A 92 6.715 6.511 -8.573 1.00 0.05 H HETATM 2380 H20 UNN A 92 8.185 7.518 -8.802 1.00 0.05 H HETATM 2381 C42 UNN A 92 9.238 5.369 -7.739 1.00 0.00 C HETATM 2382 N49 UNN A 92 8.641 4.376 -8.695 1.00 0.25 N HETATM 2383 C33 UNN A 92 7.517 3.650 -8.032 1.00 -0.01 C HETATM 2384 C31 UNN A 92 6.948 2.603 -8.967 1.00 0.07 C HETATM 2385 N48 UNN A 92 8.022 1.701 -9.340 1.00 -0.30 N HETATM 2386 C19 UNN A 92 7.544 0.547 -10.008 1.00 0.05 C HETATM 2387 C8 UNN A 92 8.451 -0.248 -10.676 1.00 -0.04 C HETATM 2388 C6 UNN A 92 8.057 -1.392 -11.328 1.00 -0.05 C HETATM 2389 C18 UNN A 92 6.722 -1.732 -11.307 1.00 0.04 C HETATM 2390 C7 UNN A 92 5.785 -0.966 -10.638 1.00 -0.05 C HETATM 2391 C9 UNN A 92 6.204 0.181 -9.988 1.00 -0.04 C HETATM 2392 H14 UNN A 92 5.484 0.797 -9.461 1.00 0.05 H HETATM 2393 H4 UNN A 92 4.741 -1.259 -10.623 1.00 0.06 H HETATM 2394 C27 UNN A 92 6.325 -2.982 -11.958 1.00 0.22 C HETATM 2395 N52 UNN A 92 5.006 -3.343 -11.654 1.00 -0.16 N HETATM 2396 S64 UNN A 92 4.372 -4.786 -12.242 1.00 0.08 S HETATM 2397 C22 UNN A 92 5.395 -6.057 -11.535 1.00 0.10 C HETATM 2398 C13 UNN A 92 6.466 -6.622 -12.206 1.00 -0.05 C HETATM 2399 C10 UNN A 92 7.230 -7.608 -11.598 1.00 -0.04 C HETATM 2400 C20 UNN A 92 6.906 -8.014 -10.321 1.00 0.06 C HETATM 2401 C23 UNN A 92 5.849 -7.397 -9.687 1.00 0.12 C HETATM 2402 C16 UNN A 92 5.059 -6.440 -10.259 1.00 -0.02 C HETATM 2403 H18 UNN A 92 4.214 -6.007 -9.735 1.00 0.06 H HETATM 2404 S63 UNN A 92 5.403 -7.935 -8.085 1.00 0.09 S HETATM 2405 C47 UNN A 92 4.354 -9.315 -8.512 1.00 0.52 C HETATM 2406 F59 UNN A 92 3.802 -9.859 -7.419 1.00 -0.15 F HETATM 2407 F60 UNN A 92 3.299 -8.964 -9.298 1.00 -0.15 F HETATM 2408 F61 UNN A 92 5.030 -10.305 -9.156 1.00 -0.15 F HETATM 2409 O54 UNN A 92 6.515 -8.500 -7.344 1.00 -0.16 O HETATM 2410 O55 UNN A 92 4.546 -6.929 -7.477 1.00 -0.16 O HETATM 2411 N51 UNN A 92 7.615 -8.986 -9.603 1.00 -0.32 N HETATM 2412 C46 UNN A 92 8.683 -9.644 -10.340 1.00 0.05 C HETATM 2413 C43 UNN A 92 8.879 -10.958 -9.615 1.00 0.01 C HETATM 2414 C44 UNN A 92 9.205 -12.072 -10.568 1.00 -0.03 C HETATM 2415 N50 UNN A 92 9.568 -13.264 -9.760 1.00 0.24 N HETATM 2416 C35 UNN A 92 10.466 -12.952 -8.636 1.00 -0.01 C HETATM 2417 C37 UNN A 92 10.590 -14.232 -7.845 1.00 0.09 C HETATM 2418 O58 UNN A 92 11.248 -15.176 -8.674 1.00 -0.37 O HETATM 2419 C38 UNN A 92 10.339 -15.548 -9.697 1.00 0.09 C HETATM 2420 C36 UNN A 92 10.107 -14.361 -10.597 1.00 -0.01 C HETATM 2421 H33 UNN A 92 9.384 -14.622 -11.384 1.00 0.08 H HETATM 2422 H34 UNN A 92 11.055 -14.049 -11.059 1.00 0.08 H HETATM 2423 H37 UNN A 92 10.761 -16.378 -10.282 1.00 0.06 H HETATM 2424 H38 UNN A 92 9.386 -15.863 -9.248 1.00 0.06 H HETATM 2425 H35 UNN A 92 9.592 -14.603 -7.570 1.00 0.06 H HETATM 2426 H36 UNN A 92 11.180 -14.056 -6.933 1.00 0.06 H HETATM 2427 H31 UNN A 92 11.451 -12.634 -9.009 1.00 0.08 H HETATM 2428 H32 UNN A 92 10.036 -12.155 -8.011 1.00 0.08 H HETATM 2429 H57 UNN A 92 8.710 -13.604 -9.354 1.00 0.20 H HETATM 2430 H49 UNN A 92 10.051 -11.782 -11.209 1.00 0.08 H HETATM 2431 H50 UNN A 92 8.330 -12.297 -11.195 1.00 0.08 H HETATM 2432 H47 UNN A 92 9.705 -10.850 -8.897 1.00 0.03 H HETATM 2433 H48 UNN A 92 7.954 -11.209 -9.075 1.00 0.03 H HETATM 2434 C45 UNN A 92 9.965 -8.822 -10.295 1.00 0.03 C HETATM 2435 S62 UNN A 92 10.441 -8.324 -8.602 1.00 -0.10 S HETATM 2436 C21 UNN A 92 9.550 -6.790 -8.461 1.00 0.02 C HETATM 2437 C11 UNN A 92 9.597 -5.860 -9.470 1.00 -0.05 C HETATM 2438 C2 UNN A 92 8.873 -4.688 -9.378 1.00 -0.07 C HETATM 2439 C1 UNN A 92 8.101 -4.424 -8.270 1.00 -0.07 C HETATM 2440 C3 UNN A 92 8.042 -5.346 -7.251 1.00 -0.07 C HETATM 2441 C12 UNN A 92 8.766 -6.520 -7.355 1.00 -0.05 C HETATM 2442 H16 UNN A 92 8.717 -7.245 -6.551 1.00 0.06 H HETATM 2443 H13 UNN A 92 7.434 -5.154 -6.375 1.00 0.06 H HETATM 2444 H11 UNN A 92 7.544 -3.497 -8.201 1.00 0.06 H HETATM 2445 H12 UNN A 92 8.913 -3.968 -10.187 1.00 0.06 H HETATM 2446 H15 UNN A 92 10.207 -6.048 -10.346 1.00 0.06 H HETATM 2447 H51 UNN A 92 9.820 -7.914 -10.899 1.00 0.04 H HETATM 2448 H52 UNN A 92 10.780 -9.422 -10.725 1.00 0.04 H HETATM 2449 H53 UNN A 92 8.389 -9.812 -11.387 1.00 0.06 H HETATM 2450 H54 UNN A 92 7.396 -9.218 -8.624 1.00 0.18 H HETATM 2451 H6 UNN A 92 8.070 -8.053 -12.120 1.00 0.05 H HETATM 2452 H7 UNN A 92 6.709 -6.293 -13.210 1.00 0.06 H HETATM 2453 O56 UNN A 92 3.060 -4.964 -11.660 1.00 -0.15 O HETATM 2454 O57 UNN A 92 4.491 -4.760 -13.685 1.00 -0.15 O HETATM 2455 H55 UNN A 92 4.441 -2.743 -11.087 1.00 0.21 H HETATM 2456 O53 UNN A 92 7.079 -3.702 -12.592 1.00 -0.39 O HETATM 2457 H3 UNN A 92 8.779 -2.012 -11.846 1.00 0.06 H HETATM 2458 H5 UNN A 92 9.497 0.035 -10.687 1.00 0.05 H HETATM 2459 C32 UNN A 92 9.088 2.347 -10.070 1.00 0.07 C HETATM 2460 C34 UNN A 92 9.692 3.454 -9.220 1.00 -0.01 C HETATM 2461 H29 UNN A 92 10.399 4.031 -9.834 1.00 0.08 H HETATM 2462 H30 UNN A 92 10.227 3.002 -8.372 1.00 0.08 H HETATM 2463 H25 UNN A 92 9.865 1.607 -10.314 1.00 0.06 H HETATM 2464 H26 UNN A 92 8.687 2.777 -10.999 1.00 0.06 H HETATM 2465 H23 UNN A 92 6.539 3.088 -9.866 1.00 0.06 H HETATM 2466 H24 UNN A 92 6.150 2.042 -8.458 1.00 0.06 H HETATM 2467 H27 UNN A 92 7.889 3.160 -7.120 1.00 0.08 H HETATM 2468 H28 UNN A 92 6.727 4.368 -7.766 1.00 0.08 H HETATM 2469 H56 UNN A 92 8.261 4.883 -9.479 1.00 0.21 H HETATM 2470 H45 UNN A 92 9.766 4.818 -6.947 1.00 0.10 H HETATM 2471 H46 UNN A 92 9.954 5.997 -8.289 1.00 0.10 H HETATM 2472 H1 UNN A 92 10.486 6.572 -5.047 1.00 0.05 H CONECT 1 2 21 22 23 CONECT 21 1 CONECT 22 1 CONECT 23 1 CONECT 423 424 433 434 435 CONECT 433 423 CONECT 434 423 CONECT 435 423 CONECT 2351 2352 2356 2472 CONECT 2352 2351 2353 2361 CONECT 2353 2352 2354 2360 CONECT 2354 2353 2355 2359 CONECT 2355 2354 2356 2358 CONECT 2356 2351 2355 2357 CONECT 2357 2356 CONECT 2358 2355 CONECT 2359 2354 CONECT 2360 2353 CONECT 2361 2352 2362 2366 CONECT 2362 2361 2363 2381 CONECT 2363 2362 2364 2379 2380 CONECT 2364 2363 2365 2371 2375 CONECT 2365 2364 2366 2369 2370 CONECT 2366 2361 2365 2367 2368 CONECT 2367 2366 CONECT 2368 2366 CONECT 2369 2365 CONECT 2370 2365 CONECT 2371 2364 2372 2373 2374 CONECT 2372 2371 CONECT 2373 2371 CONECT 2374 2371 CONECT 2375 2364 2376 2377 2378 CONECT 2376 2375 CONECT 2377 2375 CONECT 2378 2375 CONECT 2379 2363 CONECT 2380 2363 CONECT 2381 2362 2382 2470 2471 CONECT 2382 2381 2383 2460 2469 CONECT 2383 2382 2384 2467 2468 CONECT 2384 2383 2385 2465 2466 CONECT 2385 2384 2386 2459 CONECT 2386 2385 2387 2391 CONECT 2387 2386 2388 2458 CONECT 2388 2387 2389 2457 CONECT 2389 2388 2390 2394 CONECT 2390 2389 2391 2393 CONECT 2391 2386 2390 2392 CONECT 2392 2391 CONECT 2393 2390 CONECT 2394 2389 2395 2456 CONECT 2395 2394 2396 2455 CONECT 2396 2395 2397 2453 2454 CONECT 2397 2396 2398 2402 CONECT 2398 2397 2399 2452 CONECT 2399 2398 2400 2451 CONECT 2400 2399 2401 2411 CONECT 2401 2400 2402 2404 CONECT 2402 2397 2401 2403 CONECT 2403 2402 CONECT 2404 2401 2405 2409 2410 CONECT 2405 2404 2406 2407 2408 CONECT 2406 2405 CONECT 2407 2405 CONECT 2408 2405 CONECT 2409 2404 CONECT 2410 2404 CONECT 2411 2400 2412 2450 CONECT 2412 2411 2413 2434 2449 CONECT 2413 2412 2414 2432 2433 CONECT 2414 2413 2415 2430 2431 CONECT 2415 2414 2416 2420 2429 CONECT 2416 2415 2417 2427 2428 CONECT 2417 2416 2418 2425 2426 CONECT 2418 2417 2419 CONECT 2419 2418 2420 2423 2424 CONECT 2420 2415 2419 2421 2422 CONECT 2421 2420 CONECT 2422 2420 CONECT 2423 2419 CONECT 2424 2419 CONECT 2425 2417 CONECT 2426 2417 CONECT 2427 2416 CONECT 2428 2416 CONECT 2429 2415 CONECT 2430 2414 CONECT 2431 2414 CONECT 2432 2413 CONECT 2433 2413 CONECT 2434 2412 2435 2447 2448 CONECT 2435 2434 2436 CONECT 2436 2435 2437 2441 CONECT 2437 2436 2438 2446 CONECT 2438 2437 2439 2445 CONECT 2439 2438 2440 2444 CONECT 2440 2439 2441 2443 CONECT 2441 2436 2440 2442 CONECT 2442 2441 CONECT 2443 2440 CONECT 2444 2439 CONECT 2445 2438 CONECT 2446 2437 CONECT 2447 2434 CONECT 2448 2434 CONECT 2449 2412 CONECT 2450 2411 CONECT 2451 2399 CONECT 2452 2398 CONECT 2453 2396 CONECT 2454 2396 CONECT 2455 2395 CONECT 2456 2394 CONECT 2457 2388 CONECT 2458 2387 CONECT 2459 2385 2460 2463 2464 CONECT 2460 2382 2459 2461 2462 CONECT 2461 2460 CONECT 2462 2460 CONECT 2463 2459 CONECT 2464 2459 CONECT 2465 2384 CONECT 2466 2384 CONECT 2467 2383 CONECT 2468 2383 CONECT 2469 2382 CONECT 2470 2381 CONECT 2471 2381 CONECT 2472 2351 MASTER 0 0 0 0 0 0 0 0 2470 2 130 11 END
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Related entries of code: 4lvt
Entries with 90% protein sequence similarity cutoff in PDBbind
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Protein Sequence Similarity
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RCSB PDB
PDBbind
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172aa, >6GL8_1|Chain... *
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RCSB PDB
PDBbind
166aa, >6O0P_1|Chain... at 92%
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RCSB PDB
PDBbind
166aa, >6O0O_1|Chains... at 92%
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RCSB PDB
PDBbind
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PDBbind
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Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
6qgh
RCSB PDB
PDBbind
1XJ
Entry Information
PDB ID
4lvt
Complex Type
Protein-Ligand
PDBbind Subset
refined set
Protein Name
Apoptosis regulator Bcl-2
Ligand Name
1XJ
EC.Number
E.C.-.-.-.-
Resolution
2.05(Å)
Affinity (Kd/Ki/IC50)
Ki=44pM
Release Year
2013
Protein/NA Sequence
Check fasta file
Primary Reference
(2013) NAT.MED. (N.Y.) Vol. 19: pp. 202-208
Ligand Properties
Formula
C
4
7
H
5
7
ClF
3
N
5
O
6
S
3
Molecular Weight
976.629
Exact Mass
975.311
No. of atoms
122
No. of bonds
128
Polar Surface Area
172.82
LOGP Value
9.58 (
Computed with XLOGP3
)
11.83 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 4
No. of Hydrogen Bond Acceptors: 5
No. of Rotatable Bonds: 17
No. of Nitrogen and Oxygen Atoms: 11
No. of Rings: 7
Canonical SMILES
Clc1ccc(cc1)C1=C(C[N@@H+]2CCN(CC2)c2ccc(cc2)C(=O)NS(=O)(=O)c2ccc(c(c2)S(=O)(=O)C(F)(F)F)N[C@H](CC[NH+]2CCOCC2)CSc2ccccc2)CC(CC1)(C)C
InChI String
InChI=1S/C47H55ClF3N5O6S3/c1-46(2)20-18-42(34-8-12-37(48)13-9-34)36(31-46)32-55-22-24-56(25-23-55)39-14-10-35(11-15-39)45(57)53-65(60,61)41-16-17-43(44(30-41)64(58,59)47(49,50)51)52-38(19-21-54-26-28-62-29-27-54)33-63-40-6-4-3-5-7-40/h3-17,30,38,52H,18-29,31-33H2,1-2H3,(H,53,57)/p+2/t38-/m1/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):
P10415
Entrez Gene ID
NCBI Entrez Gene ID:
596
ASD
Information of known allosteric effects of PDB entries
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