Browse entries in the PDBbind-CN Database
HEADER 1XA5_COMPLEX COMPND 1XA5_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 72 GLN LEU THR GLU GLU GLN ILE ALA GLU PHE LYS GLU ALA SEQRES 2 A 72 PHE SER LEU PHE ASP LYS ASP GLY ASP GLY THR ILE THR SEQRES 3 A 72 THR LYS GLU LEU GLY THR VAL MET ARG SER LEU GLY GLN SEQRES 4 A 72 ASN PRO THR GLU ALA GLU LEU GLN ASP MET ILE ASN GLU SEQRES 5 A 72 VAL ASP ALA ASP GLY ASN GLY THR ILE ASP PHE PRO GLU SEQRES 6 A 72 PHE LEU THR MET MET ALA ARG SEQRES 1 A 72 LYS ASP THR ASP SER GLU GLU GLU ILE ARG GLU ALA PHE SEQRES 2 A 72 ARG VAL PHE ASP LYS ASP GLY ASN GLY TYR ILE SER ALA SEQRES 3 A 72 ALA GLU LEU ARG HIS VAL MET THR ASN LEU GLY GLU LYS SEQRES 4 A 72 LEU THR ASP GLU GLU VAL ASP GLU MET ILE ARG GLU ALA SEQRES 5 A 72 ASP ILE ASP GLY ASP GLY GLN VAL ASN TYR GLU GLU PHE SEQRES 6 A 72 VAL GLN MET MET THR ALA LYS HET CA A 1 1 HET CA A 2 1 HET CA A 3 1 HET CA A 4 1 HET KAR A 202 117 ATOM 1 N GLN A 3 22.555 34.986 113.756 1.00 16.17 N ATOM 2 CA GLN A 3 23.487 34.302 114.705 1.00 17.91 C ATOM 3 C GLN A 3 23.030 34.467 116.159 1.00 17.08 C ATOM 4 O GLN A 3 22.261 35.374 116.479 1.00 17.64 O ATOM 5 CB GLN A 3 24.906 34.860 114.540 1.00 18.52 C ATOM 6 CG GLN A 3 24.999 36.374 114.685 1.00 19.83 C ATOM 7 CD GLN A 3 26.325 36.937 114.196 1.00 21.07 C ATOM 8 OE1 GLN A 3 26.695 36.754 113.033 1.00 21.98 O ATOM 9 NE2 GLN A 3 27.043 37.627 115.081 1.00 22.20 N ATOM 10 HA GLN A 3 23.482 33.238 114.469 1.00 0.00 H ATOM 11 HB2 GLN A 3 25.544 34.403 115.297 1.00 0.00 H ATOM 12 HB3 GLN A 3 25.268 34.588 113.549 1.00 0.00 H ATOM 13 HG2 GLN A 3 24.194 36.829 114.108 1.00 0.00 H ATOM 14 HG3 GLN A 3 24.879 36.631 115.738 1.00 0.00 H ATOM 15 HE22 GLN A 3 26.690 37.755 116.051 1.00 0.00 H ATOM 16 HE21 GLN A 3 27.957 38.038 114.802 1.00 0.00 H ATOM 17 HN3 GLN A 3 22.521 36.002 113.977 1.00 0.00 H ATOM 18 HN2 GLN A 3 21.604 34.577 113.851 1.00 0.00 H ATOM 19 HN1 GLN A 3 22.895 34.854 112.782 1.00 0.00 H ATOM 20 N LEU A 4 23.504 33.589 117.037 1.00 15.49 N ATOM 21 CA LEU A 4 23.310 33.778 118.468 1.00 14.94 C ATOM 22 C LEU A 4 24.314 34.794 119.004 1.00 13.58 C ATOM 23 O LEU A 4 25.330 35.085 118.361 1.00 12.87 O ATOM 24 CB LEU A 4 23.470 32.457 119.226 1.00 15.80 C ATOM 25 CG LEU A 4 22.709 31.247 118.691 1.00 16.48 C ATOM 26 CD1 LEU A 4 23.481 30.608 117.547 1.00 18.42 C ATOM 27 CD2 LEU A 4 22.463 30.233 119.790 1.00 16.78 C ATOM 28 HA LEU A 4 22.296 34.147 118.622 1.00 0.00 H ATOM 29 HB2 LEU A 4 24.530 32.204 119.224 1.00 0.00 H ATOM 30 HB3 LEU A 4 23.140 32.625 120.251 1.00 0.00 H ATOM 31 HG LEU A 4 21.742 31.587 118.320 1.00 0.00 H ATOM 32 HD21 LEU A 4 23.418 29.897 120.193 1.00 0.00 H ATOM 33 HD22 LEU A 4 21.875 30.694 120.583 1.00 0.00 H ATOM 34 HD23 LEU A 4 21.919 29.381 119.382 1.00 0.00 H ATOM 35 HD11 LEU A 4 23.607 31.335 116.745 1.00 0.00 H ATOM 36 HD12 LEU A 4 24.459 30.287 117.905 1.00 0.00 H ATOM 37 HD13 LEU A 4 22.928 29.746 117.174 1.00 0.00 H ATOM 38 H LEU A 4 24.022 32.754 116.697 1.00 0.00 H ATOM 39 N THR A 5 24.015 35.345 120.177 1.00 11.15 N ATOM 40 CA THR A 5 25.043 35.939 121.017 1.00 8.85 C ATOM 41 C THR A 5 25.769 34.806 121.722 1.00 7.94 C ATOM 42 O THR A 5 25.241 33.698 121.841 1.00 7.61 O ATOM 43 CB THR A 5 24.429 36.900 122.056 1.00 8.62 C ATOM 44 OG1 THR A 5 23.542 36.183 122.923 1.00 7.49 O ATOM 45 CG2 THR A 5 23.546 37.949 121.386 1.00 8.25 C ATOM 46 HA THR A 5 25.730 36.521 120.403 1.00 0.00 H ATOM 47 HB THR A 5 25.265 37.356 122.586 1.00 0.00 H ATOM 48 HG1 THR A 5 23.153 36.808 123.585 1.00 0.00 H ATOM 49 HG23 THR A 5 24.149 38.546 120.701 1.00 0.00 H ATOM 50 HG21 THR A 5 22.750 37.452 120.832 1.00 0.00 H ATOM 51 HG22 THR A 5 23.111 38.596 122.148 1.00 0.00 H ATOM 52 H THR A 5 23.026 35.351 120.500 1.00 0.00 H ATOM 53 N GLU A 6 26.978 35.070 122.196 1.00 7.15 N ATOM 54 CA GLU A 6 27.721 34.043 122.914 1.00 7.93 C ATOM 55 C GLU A 6 27.051 33.727 124.256 1.00 7.47 C ATOM 56 O GLU A 6 27.100 32.594 124.728 1.00 4.77 O ATOM 57 CB GLU A 6 29.186 34.461 123.079 1.00 7.88 C ATOM 58 CG GLU A 6 29.851 34.755 121.740 1.00 7.84 C ATOM 59 CD GLU A 6 31.351 34.525 121.729 1.00 7.93 C ATOM 60 OE1 GLU A 6 31.842 33.693 122.520 1.00 8.25 O ATOM 61 OE2 GLU A 6 32.038 35.180 120.911 1.00 7.99 O ATOM 62 HA GLU A 6 27.710 33.123 122.329 1.00 0.00 H ATOM 63 HB2 GLU A 6 29.229 35.357 123.698 1.00 0.00 H ATOM 64 HB3 GLU A 6 29.729 33.655 123.572 1.00 0.00 H ATOM 65 HG2 GLU A 6 29.400 34.111 120.985 1.00 0.00 H ATOM 66 HG3 GLU A 6 29.663 35.798 121.486 1.00 0.00 H ATOM 67 H GLU A 6 27.397 36.011 122.055 1.00 0.00 H ATOM 68 N GLU A 7 26.392 34.719 124.849 1.00 7.88 N ATOM 69 CA GLU A 7 25.655 34.492 126.089 1.00 9.97 C ATOM 70 C GLU A 7 24.503 33.511 125.859 1.00 9.17 C ATOM 71 O GLU A 7 24.246 32.643 126.685 1.00 9.06 O ATOM 72 CB GLU A 7 25.138 35.814 126.661 1.00 11.77 C ATOM 73 CG GLU A 7 24.189 35.665 127.841 1.00 13.14 C ATOM 74 CD GLU A 7 24.788 34.879 128.998 1.00 15.02 C ATOM 75 OE1 GLU A 7 26.024 34.683 129.034 1.00 14.75 O ATOM 76 OE2 GLU A 7 24.014 34.459 129.885 1.00 17.42 O ATOM 77 HA GLU A 7 26.337 34.052 126.817 1.00 0.00 H ATOM 78 HB2 GLU A 7 25.996 36.403 126.986 1.00 0.00 H ATOM 79 HB3 GLU A 7 24.613 36.346 125.867 1.00 0.00 H ATOM 80 HG2 GLU A 7 23.922 36.659 128.199 1.00 0.00 H ATOM 81 HG3 GLU A 7 23.291 35.150 127.500 1.00 0.00 H ATOM 82 H GLU A 7 26.402 35.668 124.424 1.00 0.00 H ATOM 83 N GLN A 8 23.821 33.644 124.728 1.00 9.51 N ATOM 84 CA GLN A 8 22.817 32.669 124.326 1.00 9.35 C ATOM 85 C GLN A 8 23.427 31.277 124.225 1.00 8.17 C ATOM 86 O GLN A 8 22.909 30.314 124.790 1.00 5.69 O ATOM 87 CB GLN A 8 22.224 33.048 122.970 1.00 11.84 C ATOM 88 CG GLN A 8 21.157 34.128 123.023 1.00 12.73 C ATOM 89 CD GLN A 8 20.478 34.324 121.678 1.00 13.45 C ATOM 90 OE1 GLN A 8 21.001 35.027 120.806 1.00 12.29 O ATOM 91 NE2 GLN A 8 19.317 33.693 121.503 1.00 12.61 N ATOM 92 HA GLN A 8 22.033 32.665 125.083 1.00 0.00 H ATOM 93 HB2 GLN A 8 23.034 33.402 122.332 1.00 0.00 H ATOM 94 HB3 GLN A 8 21.781 32.154 122.531 1.00 0.00 H ATOM 95 HG2 GLN A 8 20.405 33.844 123.759 1.00 0.00 H ATOM 96 HG3 GLN A 8 21.621 35.067 123.323 1.00 0.00 H ATOM 97 HE22 GLN A 8 18.920 33.113 122.269 1.00 0.00 H ATOM 98 HE21 GLN A 8 18.809 33.781 120.600 1.00 0.00 H ATOM 99 H GLN A 8 24.008 34.463 124.115 1.00 0.00 H ATOM 100 N ILE A 9 24.523 31.172 123.483 1.00 6.99 N ATOM 101 CA ILE A 9 25.172 29.888 123.290 1.00 7.66 C ATOM 102 C ILE A 9 25.549 29.327 124.654 1.00 7.86 C ATOM 103 O ILE A 9 25.346 28.146 124.925 1.00 8.64 O ATOM 104 CB ILE A 9 26.416 30.027 122.386 1.00 6.35 C ATOM 105 CG1 ILE A 9 26.017 30.541 121.003 1.00 4.13 C ATOM 106 CG2 ILE A 9 27.128 28.682 122.257 1.00 6.06 C ATOM 107 CD1 ILE A 9 27.193 30.993 120.158 1.00 5.01 C ATOM 108 HA ILE A 9 24.487 29.204 122.789 1.00 0.00 H ATOM 109 HB ILE A 9 27.096 30.746 122.843 1.00 0.00 H ATOM 110 HG12 ILE A 9 25.500 29.740 120.474 1.00 0.00 H ATOM 111 HG13 ILE A 9 25.340 31.386 121.132 1.00 0.00 H ATOM 112 HD11 ILE A 9 27.715 31.803 120.668 1.00 0.00 H ATOM 113 HD12 ILE A 9 27.875 30.156 120.010 1.00 0.00 H ATOM 114 HD13 ILE A 9 26.831 31.344 119.192 1.00 0.00 H ATOM 115 HG21 ILE A 9 27.440 28.341 123.244 1.00 0.00 H ATOM 116 HG22 ILE A 9 26.447 27.953 121.818 1.00 0.00 H ATOM 117 HG23 ILE A 9 28.003 28.795 121.617 1.00 0.00 H ATOM 118 H ILE A 9 24.922 32.021 123.034 1.00 0.00 H ATOM 119 N ALA A 10 26.072 30.188 125.519 1.00 8.32 N ATOM 120 CA ALA A 10 26.513 29.768 126.844 1.00 9.12 C ATOM 121 C ALA A 10 25.357 29.186 127.649 1.00 9.50 C ATOM 122 O ALA A 10 25.511 28.167 128.320 1.00 5.30 O ATOM 123 CB ALA A 10 27.136 30.926 127.586 1.00 8.99 C ATOM 124 HA ALA A 10 27.264 28.988 126.715 1.00 0.00 H ATOM 125 HB1 ALA A 10 27.996 31.294 127.026 1.00 0.00 H ATOM 126 HB2 ALA A 10 26.402 31.724 127.693 1.00 0.00 H ATOM 127 HB3 ALA A 10 27.459 30.593 128.572 1.00 0.00 H ATOM 128 H ALA A 10 26.170 31.186 125.245 1.00 0.00 H ATOM 129 N GLU A 11 24.203 29.843 127.583 1.00 10.94 N ATOM 130 CA GLU A 11 23.029 29.380 128.307 1.00 12.47 C ATOM 131 C GLU A 11 22.573 28.033 127.753 1.00 12.48 C ATOM 132 O GLU A 11 22.139 27.162 128.508 1.00 12.68 O ATOM 133 CB GLU A 11 21.902 30.416 128.233 1.00 14.27 C ATOM 134 CG GLU A 11 22.226 31.723 128.951 1.00 15.14 C ATOM 135 CD GLU A 11 21.305 32.866 128.554 1.00 17.62 C ATOM 136 OE1 GLU A 11 20.492 32.686 127.621 1.00 19.59 O ATOM 137 OE2 GLU A 11 21.393 33.952 129.174 1.00 17.72 O ATOM 138 HA GLU A 11 23.291 29.251 129.357 1.00 0.00 H ATOM 139 HB2 GLU A 11 21.706 30.638 127.184 1.00 0.00 H ATOM 140 HB3 GLU A 11 21.008 29.986 128.685 1.00 0.00 H ATOM 141 HG2 GLU A 11 22.135 31.561 130.025 1.00 0.00 H ATOM 142 HG3 GLU A 11 23.252 32.005 128.713 1.00 0.00 H ATOM 143 H GLU A 11 24.138 30.704 127.003 1.00 0.00 H ATOM 144 N PHE A 12 22.686 27.855 126.440 1.00 10.32 N ATOM 145 CA PHE A 12 22.336 26.580 125.820 1.00 11.71 C ATOM 146 C PHE A 12 23.311 25.484 126.242 1.00 11.05 C ATOM 147 O PHE A 12 22.908 24.361 126.513 1.00 9.95 O ATOM 148 CB PHE A 12 22.311 26.702 124.293 1.00 12.69 C ATOM 149 CG PHE A 12 21.195 27.571 123.768 1.00 14.03 C ATOM 150 CD1 PHE A 12 20.036 27.760 124.503 1.00 13.94 C ATOM 151 CD2 PHE A 12 21.310 28.201 122.538 1.00 14.32 C ATOM 152 CE1 PHE A 12 19.013 28.559 124.019 1.00 15.06 C ATOM 153 CE2 PHE A 12 20.293 29.004 122.054 1.00 14.87 C ATOM 154 CZ PHE A 12 19.143 29.182 122.794 1.00 15.10 C ATOM 155 HA PHE A 12 21.338 26.308 126.162 1.00 0.00 H ATOM 156 HB2 PHE A 12 23.260 27.127 123.967 1.00 0.00 H ATOM 157 HB3 PHE A 12 22.197 25.704 123.870 1.00 0.00 H ATOM 158 HD2 PHE A 12 22.214 28.062 121.945 1.00 0.00 H ATOM 159 HE2 PHE A 12 20.401 29.496 121.087 1.00 0.00 H ATOM 160 HZ PHE A 12 18.340 29.812 122.413 1.00 0.00 H ATOM 161 HE1 PHE A 12 18.105 28.696 124.606 1.00 0.00 H ATOM 162 HD1 PHE A 12 19.928 27.275 125.473 1.00 0.00 H ATOM 163 H PHE A 12 23.029 28.636 125.845 1.00 0.00 H ATOM 164 N LYS A 13 24.593 25.824 126.298 1.00 12.55 N ATOM 165 CA LYS A 13 25.632 24.877 126.690 1.00 14.15 C ATOM 166 C LYS A 13 25.485 24.454 128.152 1.00 14.45 C ATOM 167 O LYS A 13 25.650 23.278 128.489 1.00 12.00 O ATOM 168 CB LYS A 13 27.019 25.491 126.465 1.00 14.84 C ATOM 169 CG LYS A 13 27.567 25.274 125.062 1.00 16.10 C ATOM 170 CD LYS A 13 28.755 26.185 124.758 1.00 17.22 C ATOM 171 CE LYS A 13 29.951 25.891 125.658 1.00 18.05 C ATOM 172 NZ LYS A 13 31.034 26.929 125.527 1.00 18.04 N ATOM 173 HA LYS A 13 25.521 23.989 126.068 1.00 0.00 H ATOM 174 HB2 LYS A 13 26.954 26.564 126.647 1.00 0.00 H ATOM 175 HB3 LYS A 13 27.712 25.045 127.178 1.00 0.00 H ATOM 176 HG2 LYS A 13 27.887 24.236 124.967 1.00 0.00 H ATOM 177 HG3 LYS A 13 26.775 25.477 124.341 1.00 0.00 H ATOM 178 HD2 LYS A 13 29.053 26.040 123.720 1.00 0.00 H ATOM 179 HD3 LYS A 13 28.450 27.221 124.906 1.00 0.00 H ATOM 180 HE2 LYS A 13 30.363 24.919 125.388 1.00 0.00 H ATOM 181 HE3 LYS A 13 29.613 25.866 126.694 1.00 0.00 H ATOM 182 HZ1 LYS A 13 31.370 26.956 124.543 1.00 0.00 H ATOM 183 HZ2 LYS A 13 30.653 27.860 125.790 1.00 0.00 H ATOM 184 HZ3 LYS A 13 31.824 26.685 126.158 1.00 0.00 H ATOM 185 H LYS A 13 24.866 26.798 126.054 1.00 0.00 H ATOM 186 N GLU A 14 25.184 25.423 129.011 1.00 14.43 N ATOM 187 CA GLU A 14 24.954 25.159 130.425 1.00 15.27 C ATOM 188 C GLU A 14 23.802 24.174 130.581 1.00 14.25 C ATOM 189 O GLU A 14 23.920 23.164 131.279 1.00 12.51 O ATOM 190 CB GLU A 14 24.640 26.465 131.161 1.00 17.81 C ATOM 191 CG GLU A 14 24.095 26.277 132.570 1.00 21.61 C ATOM 192 CD GLU A 14 25.168 26.367 133.640 1.00 23.96 C ATOM 193 OE1 GLU A 14 25.903 27.380 133.662 1.00 26.90 O ATOM 194 OE2 GLU A 14 25.273 25.428 134.462 1.00 25.45 O ATOM 195 HA GLU A 14 25.854 24.725 130.860 1.00 0.00 H ATOM 196 HB2 GLU A 14 25.558 27.050 131.225 1.00 0.00 H ATOM 197 HB3 GLU A 14 23.900 27.015 130.579 1.00 0.00 H ATOM 198 HG2 GLU A 14 23.350 27.049 132.760 1.00 0.00 H ATOM 199 HG3 GLU A 14 23.624 25.296 132.632 1.00 0.00 H ATOM 200 H GLU A 14 25.110 26.400 128.663 1.00 0.00 H ATOM 201 N ALA A 15 22.691 24.469 129.910 1.00 13.76 N ATOM 202 CA ALA A 15 21.512 23.612 129.968 1.00 12.93 C ATOM 203 C ALA A 15 21.848 22.198 129.513 1.00 12.47 C ATOM 204 O ALA A 15 21.488 21.226 130.173 1.00 13.09 O ATOM 205 CB ALA A 15 20.398 24.190 129.119 1.00 12.83 C ATOM 206 HA ALA A 15 21.174 23.565 131.003 1.00 0.00 H ATOM 207 HB1 ALA A 15 20.137 25.181 129.490 1.00 0.00 H ATOM 208 HB2 ALA A 15 20.733 24.265 128.084 1.00 0.00 H ATOM 209 HB3 ALA A 15 19.526 23.538 129.173 1.00 0.00 H ATOM 210 H ALA A 15 22.663 25.332 129.330 1.00 0.00 H ATOM 211 N PHE A 16 22.539 22.094 128.382 1.00 12.35 N ATOM 212 CA PHE A 16 22.944 20.806 127.835 1.00 13.46 C ATOM 213 C PHE A 16 23.804 20.066 128.853 1.00 15.22 C ATOM 214 O PHE A 16 23.586 18.886 129.123 1.00 14.67 O ATOM 215 CB PHE A 16 23.710 21.014 126.524 1.00 13.55 C ATOM 216 CG PHE A 16 24.024 19.743 125.785 1.00 13.24 C ATOM 217 CD1 PHE A 16 23.043 19.078 125.070 1.00 13.06 C ATOM 218 CD2 PHE A 16 25.310 19.219 125.794 1.00 13.37 C ATOM 219 CE1 PHE A 16 23.334 17.912 124.382 1.00 12.78 C ATOM 220 CE2 PHE A 16 25.601 18.050 125.113 1.00 14.10 C ATOM 221 CZ PHE A 16 24.609 17.396 124.407 1.00 13.43 C ATOM 222 HA PHE A 16 22.060 20.205 127.624 1.00 0.00 H ATOM 223 HB2 PHE A 16 23.108 21.648 125.873 1.00 0.00 H ATOM 224 HB3 PHE A 16 24.649 21.518 126.753 1.00 0.00 H ATOM 225 HD2 PHE A 16 26.098 19.734 126.343 1.00 0.00 H ATOM 226 HE2 PHE A 16 26.613 17.645 125.133 1.00 0.00 H ATOM 227 HZ PHE A 16 24.836 16.474 123.872 1.00 0.00 H ATOM 228 HE1 PHE A 16 22.552 17.402 123.820 1.00 0.00 H ATOM 229 HD1 PHE A 16 22.029 19.477 125.048 1.00 0.00 H ATOM 230 H PHE A 16 22.799 22.961 127.871 1.00 0.00 H ATOM 231 N SER A 17 24.757 20.785 129.438 1.00 17.47 N ATOM 232 CA SER A 17 25.703 20.213 130.392 1.00 18.82 C ATOM 233 C SER A 17 25.004 19.542 131.570 1.00 19.19 C ATOM 234 O SER A 17 25.516 18.569 132.123 1.00 20.00 O ATOM 235 CB SER A 17 26.654 21.298 130.910 1.00 19.58 C ATOM 236 OG SER A 17 26.027 22.101 131.900 1.00 20.05 O ATOM 237 HA SER A 17 26.267 19.446 129.861 1.00 0.00 H ATOM 238 HB2 SER A 17 26.958 21.932 130.077 1.00 0.00 H ATOM 239 HB3 SER A 17 27.534 20.823 131.343 1.00 0.00 H ATOM 240 HG SER A 17 25.229 22.539 131.511 1.00 0.00 H ATOM 241 H SER A 17 24.832 21.796 129.207 1.00 0.00 H ATOM 242 N LEU A 18 23.840 20.060 131.955 1.00 19.23 N ATOM 243 CA LEU A 18 23.078 19.480 133.058 1.00 19.09 C ATOM 244 C LEU A 18 22.636 18.060 132.727 1.00 17.93 C ATOM 245 O LEU A 18 22.561 17.205 133.612 1.00 17.33 O ATOM 246 CB LEU A 18 21.855 20.338 133.383 1.00 20.37 C ATOM 247 CG LEU A 18 22.158 21.722 133.965 1.00 22.08 C ATOM 248 CD1 LEU A 18 20.951 22.264 134.715 1.00 22.84 C ATOM 249 CD2 LEU A 18 23.379 21.677 134.872 1.00 22.31 C ATOM 250 HA LEU A 18 23.731 19.450 133.930 1.00 0.00 H ATOM 251 HB2 LEU A 18 21.287 20.477 132.463 1.00 0.00 H ATOM 252 HB3 LEU A 18 21.246 19.795 134.106 1.00 0.00 H ATOM 253 HG LEU A 18 22.379 22.396 133.137 1.00 0.00 H ATOM 254 HD21 LEU A 18 23.195 20.985 135.693 1.00 0.00 H ATOM 255 HD22 LEU A 18 24.243 21.341 134.299 1.00 0.00 H ATOM 256 HD23 LEU A 18 23.571 22.673 135.271 1.00 0.00 H ATOM 257 HD11 LEU A 18 20.106 22.345 134.031 1.00 0.00 H ATOM 258 HD12 LEU A 18 20.696 21.586 135.530 1.00 0.00 H ATOM 259 HD13 LEU A 18 21.188 23.248 135.120 1.00 0.00 H ATOM 260 H LEU A 18 23.465 20.895 131.460 1.00 0.00 H ATOM 261 N PHE A 19 22.350 17.815 131.451 1.00 15.24 N ATOM 262 CA PHE A 19 21.919 16.500 130.992 1.00 14.01 C ATOM 263 C PHE A 19 23.113 15.620 130.635 1.00 14.77 C ATOM 264 O PHE A 19 23.181 14.459 131.037 1.00 13.74 O ATOM 265 CB PHE A 19 21.010 16.641 129.767 1.00 13.90 C ATOM 266 CG PHE A 19 19.651 17.201 130.078 1.00 12.96 C ATOM 267 CD1 PHE A 19 19.479 18.557 130.296 1.00 11.72 C ATOM 268 CD2 PHE A 19 18.545 16.374 130.138 1.00 12.59 C ATOM 269 CE1 PHE A 19 18.227 19.076 130.569 1.00 11.32 C ATOM 270 CE2 PHE A 19 17.285 16.894 130.412 1.00 12.20 C ATOM 271 CZ PHE A 19 17.133 18.244 130.627 1.00 11.13 C ATOM 272 HA PHE A 19 21.370 16.027 131.806 1.00 0.00 H ATOM 273 HB2 PHE A 19 21.498 17.302 129.051 1.00 0.00 H ATOM 274 HB3 PHE A 19 20.881 15.655 129.320 1.00 0.00 H ATOM 275 HD2 PHE A 19 18.662 15.304 129.969 1.00 0.00 H ATOM 276 HE2 PHE A 19 16.419 16.233 130.456 1.00 0.00 H ATOM 277 HZ PHE A 19 16.147 18.654 130.843 1.00 0.00 H ATOM 278 HE1 PHE A 19 18.107 20.146 130.739 1.00 0.00 H ATOM 279 HD1 PHE A 19 20.341 19.223 130.252 1.00 0.00 H ATOM 280 H PHE A 19 22.437 18.586 130.759 1.00 0.00 H ATOM 281 N ASP A 20 24.039 16.180 129.864 1.00 15.02 N ATOM 282 CA ASP A 20 25.251 15.480 129.468 1.00 16.89 C ATOM 283 C ASP A 20 26.255 15.511 130.614 1.00 18.84 C ATOM 284 O ASP A 20 27.181 16.322 130.619 1.00 20.25 O ATOM 285 CB ASP A 20 25.847 16.140 128.220 1.00 16.30 C ATOM 286 CG ASP A 20 27.055 15.400 127.679 1.00 16.14 C ATOM 287 OD1 ASP A 20 27.165 14.171 127.883 1.00 16.14 O ATOM 288 OD2 ASP A 20 27.945 15.970 127.020 1.00 15.10 O ATOM 289 HA ASP A 20 25.012 14.442 129.234 1.00 0.00 H ATOM 290 HB2 ASP A 20 25.082 16.171 127.444 1.00 0.00 H ATOM 291 HB3 ASP A 20 26.147 17.157 128.474 1.00 0.00 H ATOM 292 H ASP A 20 23.892 17.154 129.532 1.00 0.00 H ATOM 293 N LYS A 21 26.063 14.625 131.584 1.00 20.81 N ATOM 294 CA LYS A 21 26.850 14.649 132.812 1.00 22.80 C ATOM 295 C LYS A 21 28.319 14.303 132.562 1.00 22.47 C ATOM 296 O LYS A 21 29.214 14.924 133.135 1.00 20.64 O ATOM 297 CB LYS A 21 26.258 13.680 133.838 1.00 24.67 C ATOM 298 CG LYS A 21 25.787 14.346 135.123 1.00 26.24 C ATOM 299 CD LYS A 21 24.591 15.258 134.876 1.00 27.61 C ATOM 300 CE LYS A 21 23.600 15.224 136.038 1.00 28.55 C ATOM 301 NZ LYS A 21 23.757 16.402 136.947 1.00 28.85 N ATOM 302 HA LYS A 21 26.811 15.666 133.201 1.00 0.00 H ATOM 303 HB2 LYS A 21 25.406 13.176 133.381 1.00 0.00 H ATOM 304 HB3 LYS A 21 27.020 12.944 134.093 1.00 0.00 H ATOM 305 HG2 LYS A 21 25.502 13.574 135.838 1.00 0.00 H ATOM 306 HG3 LYS A 21 26.604 14.938 135.535 1.00 0.00 H ATOM 307 HD2 LYS A 21 24.947 16.280 134.746 1.00 0.00 H ATOM 308 HD3 LYS A 21 24.082 14.934 133.968 1.00 0.00 H ATOM 309 HE2 LYS A 21 23.763 14.312 136.613 1.00 0.00 H ATOM 310 HE3 LYS A 21 22.587 15.222 135.636 1.00 0.00 H ATOM 311 HZ1 LYS A 21 24.719 16.408 137.342 1.00 0.00 H ATOM 312 HZ2 LYS A 21 23.596 17.277 136.409 1.00 0.00 H ATOM 313 HZ3 LYS A 21 23.064 16.336 137.720 1.00 0.00 H ATOM 314 H LYS A 21 25.332 13.895 131.465 1.00 0.00 H ATOM 315 N ASP A 22 28.560 13.312 131.708 1.00 21.97 N ATOM 316 CA ASP A 22 29.915 12.828 131.473 1.00 22.34 C ATOM 317 C ASP A 22 30.637 13.640 130.396 1.00 22.27 C ATOM 318 O ASP A 22 31.815 13.419 130.132 1.00 22.05 O ATOM 319 CB ASP A 22 29.897 11.336 131.111 1.00 21.82 C ATOM 320 CG ASP A 22 29.399 11.077 129.704 1.00 21.11 C ATOM 321 OD1 ASP A 22 29.063 12.050 129.000 1.00 20.37 O ATOM 322 OD2 ASP A 22 29.308 9.928 129.222 1.00 19.63 O ATOM 323 HA ASP A 22 30.474 12.958 132.400 1.00 0.00 H ATOM 324 HB2 ASP A 22 30.910 10.944 131.199 1.00 0.00 H ATOM 325 HB3 ASP A 22 29.245 10.815 131.812 1.00 0.00 H ATOM 326 H ASP A 22 27.766 12.874 131.198 1.00 0.00 H ATOM 327 N GLY A 23 29.921 14.572 129.776 1.00 22.82 N ATOM 328 CA GLY A 23 30.527 15.545 128.885 1.00 22.61 C ATOM 329 C GLY A 23 31.059 14.979 127.580 1.00 22.55 C ATOM 330 O GLY A 23 31.977 15.553 126.991 1.00 23.12 O ATOM 331 HA3 GLY A 23 31.357 16.016 129.412 1.00 0.00 H ATOM 332 HA2 GLY A 23 29.776 16.298 128.646 1.00 0.00 H ATOM 333 H GLY A 23 28.894 14.606 129.934 1.00 0.00 H ATOM 334 N ASP A 24 30.487 13.870 127.113 1.00 21.31 N ATOM 335 CA ASP A 24 30.927 13.263 125.856 1.00 20.22 C ATOM 336 C ASP A 24 30.130 13.779 124.652 1.00 20.45 C ATOM 337 O ASP A 24 30.320 13.318 123.529 1.00 20.82 O ATOM 338 CB ASP A 24 30.866 11.730 125.939 1.00 19.05 C ATOM 339 CG ASP A 24 29.469 11.176 125.706 1.00 17.91 C ATOM 340 OD1 ASP A 24 28.478 11.869 126.009 1.00 16.35 O ATOM 341 OD2 ASP A 24 29.269 10.040 125.230 1.00 17.38 O ATOM 342 HA ASP A 24 31.964 13.560 125.702 1.00 0.00 H ATOM 343 HB2 ASP A 24 31.535 11.314 125.185 1.00 0.00 H ATOM 344 HB3 ASP A 24 31.201 11.422 126.929 1.00 0.00 H ATOM 345 H ASP A 24 29.714 13.428 127.651 1.00 0.00 H ATOM 346 N GLY A 25 29.239 14.736 124.892 1.00 20.45 N ATOM 347 CA GLY A 25 28.569 15.439 123.811 1.00 20.16 C ATOM 348 C GLY A 25 27.281 14.780 123.350 1.00 19.97 C ATOM 349 O GLY A 25 26.662 15.211 122.378 1.00 20.64 O ATOM 350 HA3 GLY A 25 29.250 15.492 122.962 1.00 0.00 H ATOM 351 HA2 GLY A 25 28.335 16.448 124.151 1.00 0.00 H ATOM 352 H GLY A 25 29.016 14.987 125.876 1.00 0.00 H ATOM 353 N THR A 26 26.871 13.730 124.043 1.00 19.72 N ATOM 354 CA THR A 26 25.577 13.123 123.774 1.00 19.79 C ATOM 355 C THR A 26 24.858 12.842 125.082 1.00 19.15 C ATOM 356 O THR A 26 25.488 12.643 126.123 1.00 20.19 O ATOM 357 CB THR A 26 25.730 11.823 122.965 1.00 20.58 C ATOM 358 OG1 THR A 26 26.542 10.888 123.687 1.00 21.67 O ATOM 359 CG2 THR A 26 26.501 12.066 121.671 1.00 21.25 C ATOM 360 HA THR A 26 24.988 13.822 123.180 1.00 0.00 H ATOM 361 HB THR A 26 24.720 11.458 122.777 1.00 0.00 H ATOM 362 HG1 THR A 26 27.437 11.282 123.844 1.00 0.00 H ATOM 363 HG23 THR A 26 25.952 12.774 121.050 1.00 0.00 H ATOM 364 HG21 THR A 26 27.484 12.473 121.906 1.00 0.00 H ATOM 365 HG22 THR A 26 26.616 11.124 121.135 1.00 0.00 H ATOM 366 H THR A 26 27.480 13.335 124.788 1.00 0.00 H ATOM 367 N ILE A 27 23.533 12.844 125.021 1.00 16.74 N ATOM 368 CA ILE A 27 22.717 12.523 126.175 1.00 15.24 C ATOM 369 C ILE A 27 22.127 11.132 125.993 1.00 14.55 C ATOM 370 O ILE A 27 21.423 10.867 125.019 1.00 14.54 O ATOM 371 CB ILE A 27 21.603 13.561 126.338 1.00 14.27 C ATOM 372 CG1 ILE A 27 22.206 14.959 126.475 1.00 13.02 C ATOM 373 CG2 ILE A 27 20.739 13.230 127.548 1.00 14.28 C ATOM 374 CD1 ILE A 27 21.213 16.070 126.230 1.00 13.83 C ATOM 375 HA ILE A 27 23.331 12.539 127.075 1.00 0.00 H ATOM 376 HB ILE A 27 20.970 13.539 125.451 1.00 0.00 H ATOM 377 HG12 ILE A 27 22.602 15.067 127.485 1.00 0.00 H ATOM 378 HG13 ILE A 27 23.018 15.057 125.755 1.00 0.00 H ATOM 379 HD11 ILE A 27 20.815 15.983 125.219 1.00 0.00 H ATOM 380 HD12 ILE A 27 20.399 15.993 126.950 1.00 0.00 H ATOM 381 HD13 ILE A 27 21.711 17.033 126.344 1.00 0.00 H ATOM 382 HG21 ILE A 27 20.290 12.246 127.414 1.00 0.00 H ATOM 383 HG22 ILE A 27 21.358 13.230 128.445 1.00 0.00 H ATOM 384 HG23 ILE A 27 19.953 13.979 127.647 1.00 0.00 H ATOM 385 H ILE A 27 23.068 13.082 124.122 1.00 0.00 H ATOM 386 N THR A 28 22.434 10.242 126.925 1.00 13.94 N ATOM 387 CA THR A 28 21.917 8.880 126.883 1.00 13.57 C ATOM 388 C THR A 28 20.598 8.797 127.628 1.00 13.68 C ATOM 389 O THR A 28 20.186 9.749 128.297 1.00 14.39 O ATOM 390 CB THR A 28 22.927 7.903 127.516 1.00 13.33 C ATOM 391 OG1 THR A 28 23.155 8.256 128.887 1.00 11.57 O ATOM 392 CG2 THR A 28 24.306 8.035 126.862 1.00 13.49 C ATOM 393 HA THR A 28 21.759 8.604 125.840 1.00 0.00 H ATOM 394 HB THR A 28 22.509 6.904 127.393 1.00 0.00 H ATOM 395 HG1 THR A 28 23.517 9.176 128.934 1.00 0.00 H ATOM 396 HG23 THR A 28 24.231 7.783 125.804 1.00 0.00 H ATOM 397 HG21 THR A 28 24.660 9.060 126.968 1.00 0.00 H ATOM 398 HG22 THR A 28 25.005 7.355 127.350 1.00 0.00 H ATOM 399 H THR A 28 23.060 10.522 127.707 1.00 0.00 H ATOM 400 N THR A 29 19.937 7.652 127.515 1.00 14.20 N ATOM 401 CA THR A 29 18.746 7.387 128.305 1.00 13.53 C ATOM 402 C THR A 29 19.130 7.362 129.779 1.00 13.68 C ATOM 403 O THR A 29 18.410 7.878 130.637 1.00 12.79 O ATOM 404 CB THR A 29 18.117 6.051 127.886 1.00 14.14 C ATOM 405 OG1 THR A 29 19.075 4.990 128.018 1.00 13.90 O ATOM 406 CG2 THR A 29 17.773 6.057 126.402 1.00 14.44 C ATOM 407 HA THR A 29 18.009 8.172 128.137 1.00 0.00 H ATOM 408 HB THR A 29 17.238 5.911 128.515 1.00 0.00 H ATOM 409 HG1 THR A 29 18.658 4.135 127.745 1.00 0.00 H ATOM 410 HG23 THR A 29 17.042 6.841 126.203 1.00 0.00 H ATOM 411 HG21 THR A 29 18.676 6.245 125.822 1.00 0.00 H ATOM 412 HG22 THR A 29 17.355 5.090 126.123 1.00 0.00 H ATOM 413 H THR A 29 20.278 6.930 126.848 1.00 0.00 H ATOM 414 N LYS A 30 20.281 6.761 130.057 1.00 13.71 N ATOM 415 CA LYS A 30 20.850 6.755 131.396 1.00 14.73 C ATOM 416 C LYS A 30 20.933 8.173 131.959 1.00 14.53 C ATOM 417 O LYS A 30 20.481 8.432 133.076 1.00 14.45 O ATOM 418 CB LYS A 30 22.240 6.127 131.358 1.00 15.36 C ATOM 419 CG LYS A 30 22.929 6.041 132.705 1.00 16.41 C ATOM 420 CD LYS A 30 23.876 4.855 132.744 1.00 16.74 C ATOM 421 CE LYS A 30 24.961 5.027 133.798 1.00 17.47 C ATOM 422 NZ LYS A 30 26.042 4.015 133.621 1.00 16.92 N ATOM 423 HA LYS A 30 20.202 6.168 132.047 1.00 0.00 H ATOM 424 HB2 LYS A 30 22.147 5.117 130.958 1.00 0.00 H ATOM 425 HB3 LYS A 30 22.865 6.723 130.693 1.00 0.00 H ATOM 426 HG2 LYS A 30 23.494 6.957 132.878 1.00 0.00 H ATOM 427 HG3 LYS A 30 22.177 5.926 133.486 1.00 0.00 H ATOM 428 HD2 LYS A 30 23.304 3.955 132.970 1.00 0.00 H ATOM 429 HD3 LYS A 30 24.348 4.748 131.767 1.00 0.00 H ATOM 430 HE2 LYS A 30 24.519 4.908 134.787 1.00 0.00 H ATOM 431 HE3 LYS A 30 25.389 6.026 133.710 1.00 0.00 H ATOM 432 HZ1 LYS A 30 25.639 3.060 133.709 1.00 0.00 H ATOM 433 HZ2 LYS A 30 26.469 4.127 132.680 1.00 0.00 H ATOM 434 HZ3 LYS A 30 26.769 4.154 134.352 1.00 0.00 H ATOM 435 H LYS A 30 20.793 6.278 129.291 1.00 0.00 H ATOM 436 N GLU A 31 21.502 9.086 131.178 1.00 13.31 N ATOM 437 CA GLU A 31 21.677 10.470 131.615 1.00 13.18 C ATOM 438 C GLU A 31 20.338 11.197 131.710 1.00 13.17 C ATOM 439 O GLU A 31 20.092 11.938 132.661 1.00 13.08 O ATOM 440 CB GLU A 31 22.606 11.222 130.658 1.00 12.49 C ATOM 441 CG GLU A 31 24.085 10.906 130.851 1.00 12.67 C ATOM 442 CD GLU A 31 24.934 11.457 129.724 1.00 13.55 C ATOM 443 OE1 GLU A 31 24.412 11.573 128.594 1.00 13.04 O ATOM 444 OE2 GLU A 31 26.116 11.784 129.965 1.00 14.55 O ATOM 445 HA GLU A 31 22.126 10.446 132.608 1.00 0.00 H ATOM 446 HB2 GLU A 31 22.330 10.961 129.636 1.00 0.00 H ATOM 447 HB3 GLU A 31 22.461 12.292 130.810 1.00 0.00 H ATOM 448 HG2 GLU A 31 24.419 11.345 131.791 1.00 0.00 H ATOM 449 HG3 GLU A 31 24.212 9.824 130.891 1.00 0.00 H ATOM 450 H GLU A 31 21.831 8.808 130.231 1.00 0.00 H ATOM 451 N LEU A 32 19.482 10.990 130.718 1.00 12.97 N ATOM 452 CA LEU A 32 18.141 11.568 130.735 1.00 13.52 C ATOM 453 C LEU A 32 17.384 11.081 131.965 1.00 13.25 C ATOM 454 O LEU A 32 16.672 11.838 132.615 1.00 13.35 O ATOM 455 CB LEU A 32 17.383 11.189 129.458 1.00 13.70 C ATOM 456 CG LEU A 32 16.063 11.918 129.187 1.00 15.18 C ATOM 457 CD1 LEU A 32 16.243 13.438 129.186 1.00 14.98 C ATOM 458 CD2 LEU A 32 15.475 11.444 127.867 1.00 15.33 C ATOM 459 HA LEU A 32 18.223 12.654 130.778 1.00 0.00 H ATOM 460 HB2 LEU A 32 18.045 11.382 128.614 1.00 0.00 H ATOM 461 HB3 LEU A 32 17.165 10.122 129.510 1.00 0.00 H ATOM 462 HG LEU A 32 15.371 11.678 129.995 1.00 0.00 H ATOM 463 HD21 LEU A 32 16.177 11.656 127.061 1.00 0.00 H ATOM 464 HD22 LEU A 32 15.291 10.371 127.917 1.00 0.00 H ATOM 465 HD23 LEU A 32 14.537 11.966 127.680 1.00 0.00 H ATOM 466 HD11 LEU A 32 16.619 13.759 130.158 1.00 0.00 H ATOM 467 HD12 LEU A 32 16.955 13.718 128.409 1.00 0.00 H ATOM 468 HD13 LEU A 32 15.283 13.916 128.990 1.00 0.00 H ATOM 469 H LEU A 32 19.772 10.403 129.910 1.00 0.00 H ATOM 470 N GLY A 33 17.556 9.806 132.289 1.00 14.06 N ATOM 471 CA GLY A 33 16.860 9.209 133.412 1.00 14.01 C ATOM 472 C GLY A 33 17.261 9.810 134.745 1.00 13.44 C ATOM 473 O GLY A 33 16.413 10.020 135.612 1.00 13.40 O ATOM 474 HA3 GLY A 33 17.082 8.142 133.431 1.00 0.00 H ATOM 475 HA2 GLY A 33 15.789 9.354 133.274 1.00 0.00 H ATOM 476 H GLY A 33 18.205 9.221 131.724 1.00 0.00 H ATOM 477 N THR A 34 18.547 10.089 134.923 1.00 14.02 N ATOM 478 CA THR A 34 19.001 10.633 136.198 1.00 14.48 C ATOM 479 C THR A 34 18.530 12.076 136.374 1.00 13.23 C ATOM 480 O THR A 34 18.239 12.500 137.488 1.00 13.90 O ATOM 481 CB THR A 34 20.542 10.487 136.399 1.00 15.65 C ATOM 482 OG1 THR A 34 21.210 11.720 136.122 1.00 19.58 O ATOM 483 CG2 THR A 34 21.154 9.500 135.418 1.00 16.52 C ATOM 484 HA THR A 34 18.541 10.036 136.986 1.00 0.00 H ATOM 485 HB THR A 34 20.667 10.160 137.431 1.00 0.00 H ATOM 486 HG1 THR A 34 21.034 11.986 135.185 1.00 0.00 H ATOM 487 HG23 THR A 34 20.699 8.520 135.559 1.00 0.00 H ATOM 488 HG21 THR A 34 20.973 9.843 134.399 1.00 0.00 H ATOM 489 HG22 THR A 34 22.227 9.432 135.595 1.00 0.00 H ATOM 490 H THR A 34 19.228 9.920 134.156 1.00 0.00 H ATOM 491 N VAL A 35 18.423 12.821 135.278 1.00 12.65 N ATOM 492 CA VAL A 35 17.862 14.166 135.333 1.00 12.72 C ATOM 493 C VAL A 35 16.364 14.135 135.646 1.00 12.09 C ATOM 494 O VAL A 35 15.883 14.902 136.478 1.00 12.88 O ATOM 495 CB VAL A 35 18.070 14.935 134.011 1.00 13.48 C ATOM 496 CG1 VAL A 35 17.198 16.180 133.984 1.00 13.90 C ATOM 497 CG2 VAL A 35 19.534 15.316 133.834 1.00 13.61 C ATOM 498 HA VAL A 35 18.394 14.681 136.133 1.00 0.00 H ATOM 499 HB VAL A 35 17.781 14.283 133.186 1.00 0.00 H ATOM 500 HG11 VAL A 35 16.151 15.890 134.068 1.00 0.00 H ATOM 501 HG12 VAL A 35 17.465 16.827 134.819 1.00 0.00 H ATOM 502 HG13 VAL A 35 17.355 16.712 133.046 1.00 0.00 H ATOM 503 HG21 VAL A 35 19.846 15.950 134.664 1.00 0.00 H ATOM 504 HG22 VAL A 35 20.144 14.413 133.816 1.00 0.00 H ATOM 505 HG23 VAL A 35 19.656 15.857 132.896 1.00 0.00 H ATOM 506 H VAL A 35 18.745 12.438 134.366 1.00 0.00 H ATOM 507 N MET A 36 15.626 13.255 134.980 1.00 11.33 N ATOM 508 CA MET A 36 14.186 13.159 135.210 1.00 11.88 C ATOM 509 C MET A 36 13.903 12.750 136.653 1.00 11.53 C ATOM 510 O MET A 36 13.033 13.326 137.307 1.00 10.30 O ATOM 511 CB MET A 36 13.543 12.172 134.234 1.00 13.11 C ATOM 512 CG MET A 36 13.547 12.658 132.779 1.00 14.38 C ATOM 513 SD MET A 36 12.797 14.298 132.608 1.00 17.37 S ATOM 514 CE MET A 36 14.167 15.251 132.105 1.00 18.25 C ATOM 515 HA MET A 36 13.746 14.141 135.036 1.00 0.00 H ATOM 516 HB2 MET A 36 14.090 11.231 134.285 1.00 0.00 H ATOM 517 HB3 MET A 36 12.510 12.008 134.540 1.00 0.00 H ATOM 518 HG2 MET A 36 12.986 11.949 132.170 1.00 0.00 H ATOM 519 HG3 MET A 36 14.577 12.703 132.426 1.00 0.00 H ATOM 520 HE1 MET A 36 14.940 15.207 132.872 1.00 0.00 H ATOM 521 HE2 MET A 36 14.559 14.855 131.168 1.00 0.00 H ATOM 522 HE3 MET A 36 13.855 16.285 131.961 1.00 0.00 H ATOM 523 H MET A 36 16.078 12.626 134.286 1.00 0.00 H ATOM 524 N ARG A 37 14.654 11.772 137.153 1.00 10.21 N ATOM 525 CA ARG A 37 14.515 11.347 138.539 1.00 10.28 C ATOM 526 C ARG A 37 14.840 12.481 139.506 1.00 9.81 C ATOM 527 O ARG A 37 14.181 12.630 140.531 1.00 8.33 O ATOM 528 CB ARG A 37 15.404 10.135 138.825 1.00 10.35 C ATOM 529 CG ARG A 37 14.766 8.804 138.414 1.00 10.08 C ATOM 530 CD ARG A 37 15.560 7.575 138.833 1.00 10.99 C ATOM 531 NE ARG A 37 16.896 7.577 138.248 1.00 11.62 N ATOM 532 CZ ARG A 37 17.185 7.127 137.035 1.00 13.46 C ATOM 533 NH1 ARG A 37 16.231 6.619 136.266 1.00 13.51 N ATOM 534 NH2 ARG A 37 18.435 7.183 136.587 1.00 13.97 N ATOM 535 HA ARG A 37 13.474 11.062 138.692 1.00 0.00 H ATOM 536 HB2 ARG A 37 16.339 10.254 138.277 1.00 0.00 H ATOM 537 HB3 ARG A 37 15.612 10.103 139.894 1.00 0.00 H ATOM 538 HG2 ARG A 37 13.777 8.744 138.869 1.00 0.00 H ATOM 539 HG3 ARG A 37 14.666 8.793 137.329 1.00 0.00 H ATOM 540 HD2 ARG A 37 15.030 6.681 138.504 1.00 0.00 H ATOM 541 HD3 ARG A 37 15.649 7.564 139.919 1.00 0.00 H ATOM 542 HE ARG A 37 17.675 7.958 138.822 1.00 0.00 H ATOM 543 HH12 ARG A 37 16.462 6.267 135.315 1.00 0.00 H ATOM 544 HH11 ARG A 37 15.252 6.573 136.614 1.00 0.00 H ATOM 545 HH22 ARG A 37 18.663 6.830 135.636 1.00 0.00 H ATOM 546 HH21 ARG A 37 19.185 7.580 137.188 1.00 0.00 H ATOM 547 H ARG A 37 15.353 11.302 136.543 1.00 0.00 H ATOM 548 N SER A 38 15.852 13.281 139.178 1.00 10.06 N ATOM 549 CA SER A 38 16.211 14.420 140.017 1.00 10.40 C ATOM 550 C SER A 38 15.058 15.422 140.076 1.00 9.47 C ATOM 551 O SER A 38 14.964 16.204 141.015 1.00 8.57 O ATOM 552 CB SER A 38 17.492 15.097 139.513 1.00 10.77 C ATOM 553 OG SER A 38 17.224 16.019 138.470 1.00 11.77 O ATOM 554 HA SER A 38 16.403 14.051 141.025 1.00 0.00 H ATOM 555 HB2 SER A 38 18.173 14.332 139.141 1.00 0.00 H ATOM 556 HB3 SER A 38 17.961 15.628 140.342 1.00 0.00 H ATOM 557 HG SER A 38 16.803 15.543 137.710 1.00 0.00 H ATOM 558 H SER A 38 16.395 13.092 138.311 1.00 0.00 H ATOM 559 N LEU A 39 14.176 15.378 139.080 1.00 8.33 N ATOM 560 CA LEU A 39 13.024 16.276 139.031 1.00 9.06 C ATOM 561 C LEU A 39 11.757 15.657 139.625 1.00 9.17 C ATOM 562 O LEU A 39 10.679 16.250 139.554 1.00 9.19 O ATOM 563 CB LEU A 39 12.754 16.710 137.588 1.00 9.81 C ATOM 564 CG LEU A 39 13.749 17.705 136.987 1.00 9.80 C ATOM 565 CD1 LEU A 39 13.564 17.784 135.484 1.00 9.92 C ATOM 566 CD2 LEU A 39 13.597 19.084 137.617 1.00 10.79 C ATOM 567 HA LEU A 39 13.278 17.141 139.644 1.00 0.00 H ATOM 568 HB2 LEU A 39 12.759 15.816 136.965 1.00 0.00 H ATOM 569 HB3 LEU A 39 11.765 17.168 137.557 1.00 0.00 H ATOM 570 HG LEU A 39 14.757 17.350 137.201 1.00 0.00 H ATOM 571 HD21 LEU A 39 12.586 19.453 137.442 1.00 0.00 H ATOM 572 HD22 LEU A 39 13.779 19.014 138.689 1.00 0.00 H ATOM 573 HD23 LEU A 39 14.318 19.768 137.169 1.00 0.00 H ATOM 574 HD11 LEU A 39 13.733 16.800 135.046 1.00 0.00 H ATOM 575 HD12 LEU A 39 12.549 18.113 135.261 1.00 0.00 H ATOM 576 HD13 LEU A 39 14.278 18.495 135.068 1.00 0.00 H ATOM 577 H LEU A 39 14.310 14.686 138.316 1.00 0.00 H ATOM 578 N GLY A 40 11.889 14.468 140.208 1.00 9.83 N ATOM 579 CA GLY A 40 10.798 13.839 140.930 1.00 9.71 C ATOM 580 C GLY A 40 10.034 12.806 140.119 1.00 10.79 C ATOM 581 O GLY A 40 9.080 12.203 140.612 1.00 9.57 O ATOM 582 HA3 GLY A 40 10.100 14.616 141.241 1.00 0.00 H ATOM 583 HA2 GLY A 40 11.209 13.347 141.812 1.00 0.00 H ATOM 584 H GLY A 40 12.802 13.974 140.144 1.00 0.00 H ATOM 585 N GLN A 41 10.449 12.598 138.875 1.00 12.24 N ATOM 586 CA GLN A 41 9.812 11.613 138.009 1.00 12.81 C ATOM 587 C GLN A 41 10.454 10.237 138.175 1.00 14.64 C ATOM 588 O GLN A 41 11.519 10.109 138.773 1.00 14.79 O ATOM 589 CB GLN A 41 9.913 12.053 136.547 1.00 12.99 C ATOM 590 CG GLN A 41 9.279 13.407 136.261 1.00 13.47 C ATOM 591 CD GLN A 41 9.594 13.918 134.865 1.00 14.20 C ATOM 592 OE1 GLN A 41 9.564 13.154 133.902 1.00 14.22 O ATOM 593 NE2 GLN A 41 9.894 15.212 134.753 1.00 13.34 N ATOM 594 HA GLN A 41 8.763 11.542 138.296 1.00 0.00 H ATOM 595 HB2 GLN A 41 10.968 12.104 136.277 1.00 0.00 H ATOM 596 HB3 GLN A 41 9.417 11.305 135.929 1.00 0.00 H ATOM 597 HG2 GLN A 41 8.198 13.315 136.363 1.00 0.00 H ATOM 598 HG3 GLN A 41 9.651 14.128 136.989 1.00 0.00 H ATOM 599 HE22 GLN A 41 9.906 15.818 135.598 1.00 0.00 H ATOM 600 HE21 GLN A 41 10.116 15.616 133.821 1.00 0.00 H ATOM 601 H GLN A 41 11.249 13.152 138.509 1.00 0.00 H ATOM 602 N ASN A 42 9.799 9.212 137.634 1.00 15.90 N ATOM 603 CA ASN A 42 10.351 7.861 137.615 1.00 17.83 C ATOM 604 C ASN A 42 10.086 7.162 136.282 1.00 17.80 C ATOM 605 O ASN A 42 9.336 6.187 136.217 1.00 15.94 O ATOM 606 CB ASN A 42 9.767 7.026 138.761 1.00 19.18 C ATOM 607 CG ASN A 42 10.575 5.773 139.034 1.00 20.97 C ATOM 608 OD1 ASN A 42 11.791 5.753 138.839 1.00 22.21 O ATOM 609 ND2 ASN A 42 9.902 4.713 139.484 1.00 21.72 N ATOM 610 HA ASN A 42 11.430 7.949 137.744 1.00 0.00 H ATOM 611 HB2 ASN A 42 9.750 7.635 139.665 1.00 0.00 H ATOM 612 HB3 ASN A 42 8.749 6.736 138.500 1.00 0.00 H ATOM 613 HD22 ASN A 42 8.875 4.775 139.634 1.00 0.00 H ATOM 614 HD21 ASN A 42 10.404 3.825 139.684 1.00 0.00 H ATOM 615 H ASN A 42 8.864 9.379 137.211 1.00 0.00 H ATOM 616 N PRO A 43 10.698 7.668 135.217 1.00 17.50 N ATOM 617 CA PRO A 43 10.497 7.118 133.871 1.00 17.54 C ATOM 618 C PRO A 43 11.120 5.735 133.683 1.00 15.98 C ATOM 619 O PRO A 43 12.141 5.424 134.301 1.00 13.56 O ATOM 620 CB PRO A 43 11.210 8.132 132.977 1.00 17.90 C ATOM 621 CG PRO A 43 12.243 8.737 133.852 1.00 18.42 C ATOM 622 CD PRO A 43 11.633 8.804 135.220 1.00 18.35 C ATOM 623 HA PRO A 43 9.438 6.978 133.652 1.00 0.00 H ATOM 624 HD3 PRO A 43 12.391 8.687 135.994 1.00 0.00 H ATOM 625 HD2 PRO A 43 11.106 9.746 135.369 1.00 0.00 H ATOM 626 HG3 PRO A 43 12.500 9.737 133.501 1.00 0.00 H ATOM 627 HG2 PRO A 43 13.139 8.117 133.866 1.00 0.00 H ATOM 628 HB2 PRO A 43 11.671 7.636 132.123 1.00 0.00 H ATOM 629 HB3 PRO A 43 10.513 8.891 132.622 1.00 0.00 H ATOM 630 N THR A 44 10.508 4.918 132.830 1.00 15.37 N ATOM 631 CA THR A 44 11.094 3.640 132.452 1.00 15.05 C ATOM 632 C THR A 44 12.163 3.855 131.389 1.00 16.07 C ATOM 633 O THR A 44 12.220 4.912 130.746 1.00 15.43 O ATOM 634 CB THR A 44 10.015 2.670 131.917 1.00 15.23 C ATOM 635 OG1 THR A 44 9.340 3.254 130.795 1.00 15.00 O ATOM 636 CG2 THR A 44 8.911 2.439 132.949 1.00 13.62 C ATOM 637 HA THR A 44 11.545 3.197 133.340 1.00 0.00 H ATOM 638 HB THR A 44 10.534 1.744 131.667 1.00 0.00 H ATOM 639 HG1 THR A 44 8.908 4.099 131.075 1.00 0.00 H ATOM 640 HG23 THR A 44 9.341 1.992 133.845 1.00 0.00 H ATOM 641 HG21 THR A 44 8.448 3.392 133.203 1.00 0.00 H ATOM 642 HG22 THR A 44 8.160 1.769 132.532 1.00 0.00 H ATOM 643 H THR A 44 9.592 5.198 132.425 1.00 0.00 H ATOM 644 N GLU A 45 13.013 2.850 131.213 1.00 14.99 N ATOM 645 CA GLU A 45 13.997 2.862 130.144 1.00 14.87 C ATOM 646 C GLU A 45 13.297 3.148 128.819 1.00 14.26 C ATOM 647 O GLU A 45 13.740 3.994 128.038 1.00 14.00 O ATOM 648 CB GLU A 45 14.738 1.518 130.096 1.00 16.00 C ATOM 649 CG GLU A 45 15.721 1.364 128.939 1.00 16.92 C ATOM 650 CD GLU A 45 16.796 2.436 128.927 1.00 18.38 C ATOM 651 OE1 GLU A 45 17.110 2.983 130.008 1.00 18.32 O ATOM 652 OE2 GLU A 45 17.326 2.732 127.835 1.00 19.06 O ATOM 653 HA GLU A 45 14.732 3.645 130.329 1.00 0.00 H ATOM 654 HB2 GLU A 45 15.292 1.403 131.028 1.00 0.00 H ATOM 655 HB3 GLU A 45 13.995 0.725 130.016 1.00 0.00 H ATOM 656 HG2 GLU A 45 16.203 0.390 129.020 1.00 0.00 H ATOM 657 HG3 GLU A 45 15.166 1.417 128.002 1.00 0.00 H ATOM 658 H GLU A 45 12.973 2.034 131.856 1.00 0.00 H ATOM 659 N ALA A 46 12.186 2.456 128.585 1.00 13.35 N ATOM 660 CA ALA A 46 11.462 2.558 127.324 1.00 13.44 C ATOM 661 C ALA A 46 10.888 3.955 127.136 1.00 13.46 C ATOM 662 O ALA A 46 10.905 4.499 126.033 1.00 13.25 O ATOM 663 CB ALA A 46 10.348 1.516 127.267 1.00 13.06 C ATOM 664 HA ALA A 46 12.165 2.368 126.513 1.00 0.00 H ATOM 665 HB1 ALA A 46 10.780 0.519 127.350 1.00 0.00 H ATOM 666 HB2 ALA A 46 9.654 1.682 128.091 1.00 0.00 H ATOM 667 HB3 ALA A 46 9.817 1.605 126.319 1.00 0.00 H ATOM 668 H ALA A 46 11.822 1.822 129.325 1.00 0.00 H ATOM 669 N GLU A 47 10.383 4.533 128.220 1.00 13.53 N ATOM 670 CA GLU A 47 9.856 5.893 128.187 1.00 15.58 C ATOM 671 C GLU A 47 10.953 6.894 127.807 1.00 13.85 C ATOM 672 O GLU A 47 10.752 7.755 126.950 1.00 12.48 O ATOM 673 CB GLU A 47 9.212 6.249 129.534 1.00 16.08 C ATOM 674 CG GLU A 47 7.807 5.674 129.675 1.00 17.85 C ATOM 675 CD GLU A 47 7.238 5.774 131.080 1.00 18.02 C ATOM 676 OE1 GLU A 47 8.012 5.796 132.057 1.00 17.69 O ATOM 677 OE2 GLU A 47 5.999 5.826 131.207 1.00 19.99 O ATOM 678 HA GLU A 47 9.083 5.949 127.420 1.00 0.00 H ATOM 679 HB2 GLU A 47 9.835 5.853 130.336 1.00 0.00 H ATOM 680 HB3 GLU A 47 9.157 7.334 129.620 1.00 0.00 H ATOM 681 HG2 GLU A 47 7.146 6.214 128.997 1.00 0.00 H ATOM 682 HG3 GLU A 47 7.836 4.622 129.391 1.00 0.00 H ATOM 683 H GLU A 47 10.363 4.003 129.115 1.00 0.00 H ATOM 684 N LEU A 48 12.123 6.747 128.416 1.00 13.72 N ATOM 685 CA LEU A 48 13.256 7.620 128.121 1.00 13.06 C ATOM 686 C LEU A 48 13.690 7.482 126.668 1.00 13.56 C ATOM 687 O LEU A 48 14.032 8.470 126.015 1.00 13.94 O ATOM 688 CB LEU A 48 14.425 7.308 129.057 1.00 12.64 C ATOM 689 CG LEU A 48 14.115 7.528 130.543 1.00 12.61 C ATOM 690 CD1 LEU A 48 15.112 6.800 131.443 1.00 12.28 C ATOM 691 CD2 LEU A 48 14.087 9.022 130.861 1.00 12.69 C ATOM 692 HA LEU A 48 12.940 8.651 128.283 1.00 0.00 H ATOM 693 HB2 LEU A 48 14.707 6.264 128.917 1.00 0.00 H ATOM 694 HB3 LEU A 48 15.263 7.949 128.784 1.00 0.00 H ATOM 695 HG LEU A 48 13.130 7.107 130.745 1.00 0.00 H ATOM 696 HD21 LEU A 48 15.058 9.460 130.630 1.00 0.00 H ATOM 697 HD22 LEU A 48 13.317 9.506 130.260 1.00 0.00 H ATOM 698 HD23 LEU A 48 13.866 9.163 131.919 1.00 0.00 H ATOM 699 HD11 LEU A 48 15.070 5.730 131.238 1.00 0.00 H ATOM 700 HD12 LEU A 48 16.117 7.171 131.243 1.00 0.00 H ATOM 701 HD13 LEU A 48 14.857 6.982 132.487 1.00 0.00 H ATOM 702 H LEU A 48 12.236 5.991 129.121 1.00 0.00 H ATOM 703 N GLN A 49 13.662 6.256 126.156 1.00 14.34 N ATOM 704 CA GLN A 49 14.034 6.008 124.771 1.00 14.08 C ATOM 705 C GLN A 49 13.040 6.660 123.815 1.00 13.85 C ATOM 706 O GLN A 49 13.428 7.169 122.768 1.00 13.17 O ATOM 707 CB GLN A 49 14.116 4.507 124.494 1.00 14.59 C ATOM 708 CG GLN A 49 14.699 4.174 123.131 1.00 15.60 C ATOM 709 CD GLN A 49 16.063 4.799 122.919 1.00 17.16 C ATOM 710 OE1 GLN A 49 17.054 4.329 123.474 1.00 17.92 O ATOM 711 NE2 GLN A 49 16.117 5.866 122.126 1.00 18.38 N ATOM 712 HA GLN A 49 15.016 6.450 124.606 1.00 0.00 H ATOM 713 HB2 GLN A 49 14.742 4.048 125.259 1.00 0.00 H ATOM 714 HB3 GLN A 49 13.111 4.090 124.551 1.00 0.00 H ATOM 715 HG2 GLN A 49 14.792 3.091 123.045 1.00 0.00 H ATOM 716 HG3 GLN A 49 14.021 4.542 122.361 1.00 0.00 H ATOM 717 HE22 GLN A 49 15.250 6.226 121.679 1.00 0.00 H ATOM 718 HE21 GLN A 49 17.026 6.340 121.953 1.00 0.00 H ATOM 719 H GLN A 49 13.369 5.459 126.756 1.00 0.00 H ATOM 720 N ASP A 50 11.759 6.629 124.177 1.00 13.80 N ATOM 721 CA ASP A 50 10.719 7.304 123.405 1.00 13.02 C ATOM 722 C ASP A 50 10.951 8.809 123.383 1.00 14.72 C ATOM 723 O ASP A 50 10.827 9.446 122.341 1.00 13.51 O ATOM 724 CB ASP A 50 9.340 7.031 124.005 1.00 12.10 C ATOM 725 CG ASP A 50 8.768 5.680 123.595 1.00 10.64 C ATOM 726 OD1 ASP A 50 9.142 5.146 122.528 1.00 8.47 O ATOM 727 OD2 ASP A 50 7.916 5.085 124.285 1.00 10.56 O ATOM 728 HA ASP A 50 10.761 6.914 122.388 1.00 0.00 H ATOM 729 HB2 ASP A 50 9.422 7.058 125.092 1.00 0.00 H ATOM 730 HB3 ASP A 50 8.656 7.813 123.674 1.00 0.00 H ATOM 731 H ASP A 50 11.491 6.108 125.036 1.00 0.00 H ATOM 732 N MET A 51 11.276 9.372 124.544 1.00 17.08 N ATOM 733 CA MET A 51 11.572 10.797 124.659 1.00 19.20 C ATOM 734 C MET A 51 12.691 11.187 123.703 1.00 19.62 C ATOM 735 O MET A 51 12.608 12.205 123.015 1.00 19.36 O ATOM 736 CB MET A 51 11.994 11.140 126.088 1.00 21.20 C ATOM 737 CG MET A 51 10.842 11.343 127.062 1.00 22.59 C ATOM 738 SD MET A 51 11.441 11.445 128.772 1.00 25.22 S ATOM 739 CE MET A 51 10.071 10.704 129.673 1.00 26.08 C ATOM 740 HA MET A 51 10.669 11.351 124.404 1.00 0.00 H ATOM 741 HB2 MET A 51 12.616 10.327 126.463 1.00 0.00 H ATOM 742 HB3 MET A 51 12.579 12.059 126.058 1.00 0.00 H ATOM 743 HG2 MET A 51 10.151 10.504 126.976 1.00 0.00 H ATOM 744 HG3 MET A 51 10.322 12.268 126.811 1.00 0.00 H ATOM 745 HE1 MET A 51 9.165 11.285 129.497 1.00 0.00 H ATOM 746 HE2 MET A 51 9.921 9.681 129.327 1.00 0.00 H ATOM 747 HE3 MET A 51 10.299 10.699 130.739 1.00 0.00 H ATOM 748 H MET A 51 11.321 8.778 125.397 1.00 0.00 H ATOM 749 N ILE A 52 13.740 10.369 123.677 1.00 19.55 N ATOM 750 CA ILE A 52 14.877 10.589 122.791 1.00 17.99 C ATOM 751 C ILE A 52 14.480 10.400 121.331 1.00 18.23 C ATOM 752 O ILE A 52 14.891 11.170 120.467 1.00 18.44 O ATOM 753 CB ILE A 52 16.017 9.617 123.134 1.00 17.69 C ATOM 754 CG1 ILE A 52 16.712 10.044 124.429 1.00 18.93 C ATOM 755 CG2 ILE A 52 17.014 9.553 121.994 1.00 16.58 C ATOM 756 CD1 ILE A 52 17.863 9.141 124.836 1.00 18.89 C ATOM 757 HA ILE A 52 15.215 11.615 122.934 1.00 0.00 H ATOM 758 HB ILE A 52 15.594 8.623 123.282 1.00 0.00 H ATOM 759 HG12 ILE A 52 17.099 11.054 124.294 1.00 0.00 H ATOM 760 HG13 ILE A 52 15.974 10.043 125.231 1.00 0.00 H ATOM 761 HD11 ILE A 52 17.492 8.127 124.987 1.00 0.00 H ATOM 762 HD12 ILE A 52 18.618 9.139 124.049 1.00 0.00 H ATOM 763 HD13 ILE A 52 18.303 9.510 125.762 1.00 0.00 H ATOM 764 HG21 ILE A 52 16.510 9.207 121.091 1.00 0.00 H ATOM 765 HG22 ILE A 52 17.431 10.545 121.822 1.00 0.00 H ATOM 766 HG23 ILE A 52 17.815 8.861 122.252 1.00 0.00 H ATOM 767 H ILE A 52 13.749 9.544 124.310 1.00 0.00 H ATOM 768 N ASN A 53 13.685 9.371 121.056 1.00 17.38 N ATOM 769 CA ASN A 53 13.265 9.094 119.689 1.00 18.06 C ATOM 770 C ASN A 53 12.579 10.302 119.058 1.00 18.77 C ATOM 771 O ASN A 53 12.807 10.618 117.891 1.00 20.05 O ATOM 772 CB ASN A 53 12.335 7.877 119.647 1.00 16.90 C ATOM 773 CG ASN A 53 13.084 6.564 119.791 1.00 16.35 C ATOM 774 OD1 ASN A 53 14.315 6.544 119.870 1.00 15.07 O ATOM 775 ND2 ASN A 53 12.344 5.456 119.830 1.00 15.63 N ATOM 776 HA ASN A 53 14.161 8.875 119.109 1.00 0.00 H ATOM 777 HB2 ASN A 53 11.615 7.959 120.461 1.00 0.00 H ATOM 778 HB3 ASN A 53 11.806 7.875 118.694 1.00 0.00 H ATOM 779 HD22 ASN A 53 11.308 5.520 119.760 1.00 0.00 H ATOM 780 HD21 ASN A 53 12.802 4.528 119.931 1.00 0.00 H ATOM 781 H ASN A 53 13.358 8.755 121.828 1.00 0.00 H ATOM 782 N GLU A 54 11.744 10.979 119.838 1.00 19.71 N ATOM 783 CA GLU A 54 10.963 12.107 119.343 1.00 21.75 C ATOM 784 C GLU A 54 11.825 13.198 118.702 1.00 20.67 C ATOM 785 O GLU A 54 11.359 13.922 117.826 1.00 19.17 O ATOM 786 CB GLU A 54 10.153 12.721 120.484 1.00 24.07 C ATOM 787 CG GLU A 54 8.867 11.985 120.805 1.00 26.72 C ATOM 788 CD GLU A 54 7.946 12.806 121.686 1.00 29.17 C ATOM 789 OE1 GLU A 54 7.062 13.503 121.137 1.00 31.58 O ATOM 790 OE2 GLU A 54 8.115 12.765 122.924 1.00 30.28 O ATOM 791 HA GLU A 54 10.304 11.712 118.570 1.00 0.00 H ATOM 792 HB2 GLU A 54 10.775 12.728 121.379 1.00 0.00 H ATOM 793 HB3 GLU A 54 9.901 13.746 120.211 1.00 0.00 H ATOM 794 HG2 GLU A 54 8.351 11.756 119.873 1.00 0.00 H ATOM 795 HG3 GLU A 54 9.112 11.057 121.321 1.00 0.00 H ATOM 796 H GLU A 54 11.644 10.696 120.834 1.00 0.00 H ATOM 797 N VAL A 55 13.074 13.320 119.147 1.00 20.43 N ATOM 798 CA VAL A 55 13.954 14.393 118.683 1.00 20.51 C ATOM 799 C VAL A 55 15.243 13.859 118.060 1.00 19.85 C ATOM 800 O VAL A 55 16.129 14.628 117.689 1.00 19.96 O ATOM 801 CB VAL A 55 14.330 15.345 119.835 1.00 21.54 C ATOM 802 CG1 VAL A 55 13.116 16.135 120.293 1.00 21.50 C ATOM 803 CG2 VAL A 55 14.941 14.569 120.993 1.00 22.01 C ATOM 804 HA VAL A 55 13.390 14.932 117.921 1.00 0.00 H ATOM 805 HB VAL A 55 15.076 16.051 119.469 1.00 0.00 H ATOM 806 HG11 VAL A 55 12.731 16.723 119.460 1.00 0.00 H ATOM 807 HG12 VAL A 55 12.346 15.446 120.640 1.00 0.00 H ATOM 808 HG13 VAL A 55 13.403 16.801 121.107 1.00 0.00 H ATOM 809 HG21 VAL A 55 14.220 13.838 121.359 1.00 0.00 H ATOM 810 HG22 VAL A 55 15.839 14.056 120.651 1.00 0.00 H ATOM 811 HG23 VAL A 55 15.199 15.260 121.796 1.00 0.00 H ATOM 812 H VAL A 55 13.433 12.635 119.842 1.00 0.00 H ATOM 813 N ASP A 56 15.340 12.539 117.941 1.00 19.67 N ATOM 814 CA ASP A 56 16.513 11.906 117.354 1.00 18.67 C ATOM 815 C ASP A 56 16.473 12.001 115.837 1.00 19.09 C ATOM 816 O ASP A 56 15.918 11.132 115.166 1.00 19.77 O ATOM 817 CB ASP A 56 16.592 10.439 117.776 1.00 17.35 C ATOM 818 CG ASP A 56 17.966 9.857 117.573 1.00 15.68 C ATOM 819 OD1 ASP A 56 18.924 10.645 117.449 1.00 13.44 O ATOM 820 OD2 ASP A 56 18.184 8.633 117.520 1.00 15.00 O ATOM 821 HA ASP A 56 17.398 12.431 117.715 1.00 0.00 H ATOM 822 HB2 ASP A 56 16.332 10.364 118.832 1.00 0.00 H ATOM 823 HB3 ASP A 56 15.878 9.865 117.185 1.00 0.00 H ATOM 824 H ASP A 56 14.557 11.942 118.276 1.00 0.00 H ATOM 825 N ALA A 57 17.067 13.062 115.302 1.00 19.95 N ATOM 826 CA ALA A 57 16.988 13.353 113.874 1.00 20.57 C ATOM 827 C ALA A 57 17.989 12.530 113.070 1.00 21.32 C ATOM 828 O ALA A 57 17.717 12.160 111.930 1.00 22.73 O ATOM 829 CB ALA A 57 17.212 14.842 113.629 1.00 20.45 C ATOM 830 HA ALA A 57 15.989 13.077 113.535 1.00 0.00 H ATOM 831 HB1 ALA A 57 16.447 15.414 114.154 1.00 0.00 H ATOM 832 HB2 ALA A 57 18.198 15.125 113.998 1.00 0.00 H ATOM 833 HB3 ALA A 57 17.151 15.046 112.560 1.00 0.00 H ATOM 834 H ALA A 57 17.604 13.704 115.919 1.00 0.00 H ATOM 835 N ASP A 58 19.149 12.250 113.658 1.00 22.28 N ATOM 836 CA ASP A 58 20.172 11.465 112.970 1.00 22.57 C ATOM 837 C ASP A 58 20.076 9.984 113.318 1.00 22.77 C ATOM 838 O ASP A 58 20.802 9.163 112.760 1.00 24.65 O ATOM 839 CB ASP A 58 21.570 11.989 113.294 1.00 23.00 C ATOM 840 CG ASP A 58 21.967 11.743 114.732 1.00 23.23 C ATOM 841 OD1 ASP A 58 21.139 11.213 115.499 1.00 22.99 O ATOM 842 OD2 ASP A 58 23.087 12.056 115.186 1.00 24.13 O ATOM 843 HA ASP A 58 19.993 11.572 111.900 1.00 0.00 H ATOM 844 HB2 ASP A 58 22.289 11.491 112.643 1.00 0.00 H ATOM 845 HB3 ASP A 58 21.593 13.062 113.104 1.00 0.00 H ATOM 846 H ASP A 58 19.331 12.595 114.622 1.00 0.00 H ATOM 847 N GLY A 59 19.186 9.649 114.246 1.00 22.41 N ATOM 848 CA GLY A 59 18.824 8.264 114.496 1.00 22.18 C ATOM 849 C GLY A 59 19.918 7.424 115.131 1.00 21.83 C ATOM 850 O GLY A 59 19.977 6.218 114.904 1.00 22.47 O ATOM 851 HA3 GLY A 59 18.554 7.807 113.544 1.00 0.00 H ATOM 852 HA2 GLY A 59 17.960 8.254 115.160 1.00 0.00 H ATOM 853 H GLY A 59 18.736 10.399 114.809 1.00 0.00 H ATOM 854 N ASN A 60 20.775 8.048 115.936 1.00 20.93 N ATOM 855 CA ASN A 60 21.848 7.321 116.614 1.00 19.18 C ATOM 856 C ASN A 60 21.477 6.882 118.032 1.00 18.09 C ATOM 857 O ASN A 60 22.315 6.352 118.761 1.00 17.66 O ATOM 858 CB ASN A 60 23.125 8.163 116.650 1.00 18.71 C ATOM 859 CG ASN A 60 23.007 9.363 117.568 1.00 18.37 C ATOM 860 OD1 ASN A 60 21.950 9.622 118.136 1.00 17.84 O ATOM 861 ND2 ASN A 60 24.097 10.105 117.714 1.00 19.42 N ATOM 862 HA ASN A 60 22.017 6.414 116.033 1.00 0.00 H ATOM 863 HB2 ASN A 60 23.947 7.537 116.998 1.00 0.00 H ATOM 864 HB3 ASN A 60 23.340 8.515 115.641 1.00 0.00 H ATOM 865 HD22 ASN A 60 24.972 9.848 117.213 1.00 0.00 H ATOM 866 HD21 ASN A 60 24.077 10.943 118.329 1.00 0.00 H ATOM 867 H ASN A 60 20.680 9.073 116.086 1.00 0.00 H ATOM 868 N GLY A 61 20.227 7.110 118.422 1.00 17.80 N ATOM 869 CA GLY A 61 19.718 6.617 119.692 1.00 17.42 C ATOM 870 C GLY A 61 19.915 7.558 120.870 1.00 17.57 C ATOM 871 O GLY A 61 19.415 7.299 121.968 1.00 16.11 O ATOM 872 HA3 GLY A 61 20.225 5.679 119.919 1.00 0.00 H ATOM 873 HA2 GLY A 61 18.649 6.433 119.580 1.00 0.00 H ATOM 874 H GLY A 61 19.595 7.656 117.802 1.00 0.00 H ATOM 875 N THR A 62 20.645 8.649 120.651 1.00 17.54 N ATOM 876 CA THR A 62 20.922 9.610 121.712 1.00 17.12 C ATOM 877 C THR A 62 20.671 11.038 121.240 1.00 16.91 C ATOM 878 O THR A 62 20.459 11.280 120.049 1.00 15.53 O ATOM 879 CB THR A 62 22.377 9.476 122.191 1.00 17.89 C ATOM 880 OG1 THR A 62 23.271 9.720 121.100 1.00 19.76 O ATOM 881 CG2 THR A 62 22.691 8.047 122.610 1.00 18.13 C ATOM 882 HA THR A 62 20.247 9.393 122.540 1.00 0.00 H ATOM 883 HB THR A 62 22.496 10.179 123.015 1.00 0.00 H ATOM 884 HG1 THR A 62 23.123 10.635 120.752 1.00 0.00 H ATOM 885 HG23 THR A 62 22.051 7.766 123.447 1.00 0.00 H ATOM 886 HG21 THR A 62 22.509 7.375 121.771 1.00 0.00 H ATOM 887 HG22 THR A 62 23.736 7.979 122.911 1.00 0.00 H ATOM 888 H THR A 62 21.027 8.820 119.699 1.00 0.00 H ATOM 889 N ILE A 63 20.710 11.979 122.181 1.00 15.15 N ATOM 890 CA ILE A 63 20.464 13.384 121.884 1.00 14.69 C ATOM 891 C ILE A 63 21.769 14.163 121.767 1.00 15.52 C ATOM 892 O ILE A 63 22.542 14.244 122.722 1.00 16.28 O ATOM 893 CB ILE A 63 19.598 14.020 122.988 1.00 13.67 C ATOM 894 CG1 ILE A 63 18.322 13.208 123.208 1.00 14.13 C ATOM 895 CG2 ILE A 63 19.251 15.452 122.632 1.00 13.00 C ATOM 896 CD1 ILE A 63 17.566 13.607 124.452 1.00 14.19 C ATOM 897 HA ILE A 63 19.940 13.430 120.929 1.00 0.00 H ATOM 898 HB ILE A 63 20.173 14.019 123.914 1.00 0.00 H ATOM 899 HG12 ILE A 63 17.669 13.349 122.346 1.00 0.00 H ATOM 900 HG13 ILE A 63 18.592 12.155 123.290 1.00 0.00 H ATOM 901 HD11 ILE A 63 18.203 13.461 125.325 1.00 0.00 H ATOM 902 HD12 ILE A 63 17.279 14.656 124.381 1.00 0.00 H ATOM 903 HD13 ILE A 63 16.672 12.990 124.546 1.00 0.00 H ATOM 904 HG21 ILE A 63 20.168 16.031 122.523 1.00 0.00 H ATOM 905 HG22 ILE A 63 18.697 15.468 121.693 1.00 0.00 H ATOM 906 HG23 ILE A 63 18.639 15.884 123.424 1.00 0.00 H ATOM 907 H ILE A 63 20.923 11.702 123.161 1.00 0.00 H ATOM 908 N ASP A 64 22.003 14.750 120.597 1.00 15.43 N ATOM 909 CA ASP A 64 23.123 15.668 120.416 1.00 15.49 C ATOM 910 C ASP A 64 22.659 17.113 120.599 1.00 13.82 C ATOM 911 O ASP A 64 21.479 17.366 120.846 1.00 14.09 O ATOM 912 CB ASP A 64 23.761 15.472 119.037 1.00 17.04 C ATOM 913 CG ASP A 64 22.852 15.912 117.907 1.00 19.29 C ATOM 914 OD1 ASP A 64 21.852 16.610 118.183 1.00 21.50 O ATOM 915 OD2 ASP A 64 23.051 15.610 116.710 1.00 21.68 O ATOM 916 HA ASP A 64 23.877 15.451 121.172 1.00 0.00 H ATOM 917 HB2 ASP A 64 24.682 16.054 118.992 1.00 0.00 H ATOM 918 HB3 ASP A 64 23.994 14.415 118.907 1.00 0.00 H ATOM 919 H ASP A 64 21.374 14.551 119.793 1.00 0.00 H ATOM 920 N PHE A 65 23.585 18.059 120.482 1.00 11.76 N ATOM 921 CA PHE A 65 23.290 19.448 120.827 1.00 11.58 C ATOM 922 C PHE A 65 22.102 20.027 120.054 1.00 11.20 C ATOM 923 O PHE A 65 21.179 20.570 120.659 1.00 10.04 O ATOM 924 CB PHE A 65 24.525 20.337 120.633 1.00 11.16 C ATOM 925 CG PHE A 65 24.449 21.645 121.369 1.00 10.52 C ATOM 926 CD1 PHE A 65 24.853 21.738 122.694 1.00 12.11 C ATOM 927 CD2 PHE A 65 23.971 22.781 120.741 1.00 11.66 C ATOM 928 CE1 PHE A 65 24.788 22.945 123.378 1.00 10.40 C ATOM 929 CE2 PHE A 65 23.898 23.993 121.422 1.00 11.09 C ATOM 930 CZ PHE A 65 24.308 24.070 122.742 1.00 11.10 C ATOM 931 HA PHE A 65 23.009 19.439 121.880 1.00 0.00 H ATOM 932 HB2 PHE A 65 25.400 19.793 120.987 1.00 0.00 H ATOM 933 HB3 PHE A 65 24.635 20.546 119.569 1.00 0.00 H ATOM 934 HD2 PHE A 65 23.648 22.727 119.701 1.00 0.00 H ATOM 935 HE2 PHE A 65 23.518 24.881 120.916 1.00 0.00 H ATOM 936 HZ PHE A 65 24.251 25.018 123.277 1.00 0.00 H ATOM 937 HE1 PHE A 65 25.116 23.003 124.416 1.00 0.00 H ATOM 938 HD1 PHE A 65 25.227 20.851 123.205 1.00 0.00 H ATOM 939 H PHE A 65 24.534 17.807 120.140 1.00 0.00 H ATOM 940 N PRO A 66 22.129 19.931 118.725 1.00 10.93 N ATOM 941 CA PRO A 66 21.048 20.480 117.896 1.00 10.82 C ATOM 942 C PRO A 66 19.692 19.816 118.162 1.00 10.80 C ATOM 943 O PRO A 66 18.669 20.494 118.152 1.00 12.02 O ATOM 944 CB PRO A 66 21.525 20.220 116.456 1.00 11.26 C ATOM 945 CG PRO A 66 22.604 19.188 116.557 1.00 11.38 C ATOM 946 CD PRO A 66 23.199 19.317 117.919 1.00 11.34 C ATOM 947 HA PRO A 66 20.874 21.535 118.110 1.00 0.00 H ATOM 948 HD3 PRO A 66 23.470 18.339 118.317 1.00 0.00 H ATOM 949 HD2 PRO A 66 24.082 19.956 117.897 1.00 0.00 H ATOM 950 HG3 PRO A 66 23.365 19.365 115.797 1.00 0.00 H ATOM 951 HG2 PRO A 66 22.184 18.191 116.424 1.00 0.00 H ATOM 952 HB2 PRO A 66 20.702 19.849 115.846 1.00 0.00 H ATOM 953 HB3 PRO A 66 21.918 21.137 116.016 1.00 0.00 H ATOM 954 N GLU A 67 19.687 18.514 118.404 1.00 10.54 N ATOM 955 CA GLU A 67 18.458 17.820 118.769 1.00 11.90 C ATOM 956 C GLU A 67 17.976 18.280 120.143 1.00 12.33 C ATOM 957 O GLU A 67 16.776 18.367 120.396 1.00 13.32 O ATOM 958 CB GLU A 67 18.684 16.308 118.772 1.00 13.00 C ATOM 959 CG GLU A 67 18.975 15.719 117.397 1.00 13.51 C ATOM 960 CD GLU A 67 19.629 14.353 117.471 1.00 14.22 C ATOM 961 OE1 GLU A 67 19.883 13.872 118.597 1.00 16.45 O ATOM 962 OE2 GLU A 67 19.897 13.759 116.405 1.00 13.19 O ATOM 963 HA GLU A 67 17.693 18.060 118.031 1.00 0.00 H ATOM 964 HB2 GLU A 67 19.530 16.089 119.424 1.00 0.00 H ATOM 965 HB3 GLU A 67 17.788 15.829 119.167 1.00 0.00 H ATOM 966 HG2 GLU A 67 18.036 15.627 116.851 1.00 0.00 H ATOM 967 HG3 GLU A 67 19.641 16.396 116.861 1.00 0.00 H ATOM 968 H GLU A 67 20.575 17.977 118.332 1.00 0.00 H ATOM 969 N PHE A 68 18.920 18.584 121.025 1.00 12.24 N ATOM 970 CA PHE A 68 18.594 19.098 122.346 1.00 13.32 C ATOM 971 C PHE A 68 17.937 20.476 122.217 1.00 12.67 C ATOM 972 O PHE A 68 17.009 20.808 122.962 1.00 11.67 O ATOM 973 CB PHE A 68 19.868 19.167 123.194 1.00 13.95 C ATOM 974 CG PHE A 68 19.668 19.752 124.565 1.00 14.63 C ATOM 975 CD1 PHE A 68 19.193 18.969 125.606 1.00 14.84 C ATOM 976 CD2 PHE A 68 19.992 21.075 124.820 1.00 14.46 C ATOM 977 CE1 PHE A 68 19.023 19.498 126.873 1.00 15.75 C ATOM 978 CE2 PHE A 68 19.826 21.616 126.088 1.00 16.25 C ATOM 979 CZ PHE A 68 19.340 20.828 127.117 1.00 16.90 C ATOM 980 HA PHE A 68 17.887 18.432 122.841 1.00 0.00 H ATOM 981 HB2 PHE A 68 20.258 18.156 123.308 1.00 0.00 H ATOM 982 HB3 PHE A 68 20.598 19.779 122.665 1.00 0.00 H ATOM 983 HD2 PHE A 68 20.382 21.699 124.015 1.00 0.00 H ATOM 984 HE2 PHE A 68 20.078 22.660 126.273 1.00 0.00 H ATOM 985 HZ PHE A 68 19.207 21.249 128.114 1.00 0.00 H ATOM 986 HE1 PHE A 68 18.641 18.872 127.679 1.00 0.00 H ATOM 987 HD1 PHE A 68 18.950 17.922 125.424 1.00 0.00 H ATOM 988 H PHE A 68 19.918 18.451 120.765 1.00 0.00 H ATOM 989 N LEU A 69 18.407 21.267 121.256 1.00 11.11 N ATOM 990 CA LEU A 69 17.845 22.594 121.026 1.00 10.76 C ATOM 991 C LEU A 69 16.408 22.503 120.520 1.00 11.48 C ATOM 992 O LEU A 69 15.567 23.332 120.872 1.00 8.48 O ATOM 993 CB LEU A 69 18.696 23.375 120.025 1.00 10.88 C ATOM 994 CG LEU A 69 20.100 23.773 120.491 1.00 9.82 C ATOM 995 CD1 LEU A 69 20.857 24.429 119.355 1.00 9.12 C ATOM 996 CD2 LEU A 69 20.035 24.696 121.704 1.00 10.05 C ATOM 997 HA LEU A 69 17.845 23.121 121.980 1.00 0.00 H ATOM 998 HB2 LEU A 69 18.804 22.761 119.131 1.00 0.00 H ATOM 999 HB3 LEU A 69 18.158 24.289 119.774 1.00 0.00 H ATOM 1000 HG LEU A 69 20.632 22.871 120.791 1.00 0.00 H ATOM 1001 HD21 LEU A 69 19.485 25.600 121.442 1.00 0.00 H ATOM 1002 HD22 LEU A 69 19.528 24.184 122.522 1.00 0.00 H ATOM 1003 HD23 LEU A 69 21.046 24.961 122.012 1.00 0.00 H ATOM 1004 HD11 LEU A 69 20.940 23.729 118.523 1.00 0.00 H ATOM 1005 HD12 LEU A 69 20.321 25.320 119.030 1.00 0.00 H ATOM 1006 HD13 LEU A 69 21.854 24.708 119.697 1.00 0.00 H ATOM 1007 H LEU A 69 19.189 20.933 120.658 1.00 0.00 H ATOM 1008 N THR A 70 16.126 21.494 119.699 1.00 13.26 N ATOM 1009 CA THR A 70 14.771 21.291 119.185 1.00 15.02 C ATOM 1010 C THR A 70 13.853 20.760 120.286 1.00 14.57 C ATOM 1011 O THR A 70 12.707 21.185 120.403 1.00 14.50 O ATOM 1012 CB THR A 70 14.767 20.340 117.959 1.00 15.67 C ATOM 1013 OG1 THR A 70 15.321 19.070 118.316 1.00 19.73 O ATOM 1014 CG2 THR A 70 15.698 20.833 116.880 1.00 15.39 C ATOM 1015 HA THR A 70 14.391 22.258 118.854 1.00 0.00 H ATOM 1016 HB THR A 70 13.731 20.286 117.625 1.00 0.00 H ATOM 1017 HG1 THR A 70 16.253 19.193 118.628 1.00 0.00 H ATOM 1018 HG23 THR A 70 15.363 21.810 116.531 1.00 0.00 H ATOM 1019 HG21 THR A 70 16.707 20.917 117.283 1.00 0.00 H ATOM 1020 HG22 THR A 70 15.695 20.128 116.049 1.00 0.00 H ATOM 1021 H THR A 70 16.882 20.838 119.418 1.00 0.00 H ATOM 1022 N MET A 71 14.367 19.842 121.097 1.00 15.66 N ATOM 1023 CA MET A 71 13.650 19.374 122.281 1.00 17.01 C ATOM 1024 C MET A 71 13.300 20.549 123.186 1.00 17.72 C ATOM 1025 O MET A 71 12.204 20.605 123.749 1.00 17.84 O ATOM 1026 CB MET A 71 14.492 18.363 123.052 1.00 17.85 C ATOM 1027 CG MET A 71 13.922 17.982 124.408 1.00 19.64 C ATOM 1028 SD MET A 71 14.571 16.405 125.005 1.00 20.87 S ATOM 1029 CE MET A 71 15.494 16.904 126.427 1.00 21.47 C ATOM 1030 HA MET A 71 12.730 18.889 121.954 1.00 0.00 H ATOM 1031 HB2 MET A 71 14.576 17.458 122.450 1.00 0.00 H ATOM 1032 HB3 MET A 71 15.483 18.790 123.205 1.00 0.00 H ATOM 1033 HG2 MET A 71 12.838 17.906 124.324 1.00 0.00 H ATOM 1034 HG3 MET A 71 14.176 18.761 125.127 1.00 0.00 H ATOM 1035 HE1 MET A 71 16.275 17.602 126.125 1.00 0.00 H ATOM 1036 HE2 MET A 71 14.827 17.390 127.139 1.00 0.00 H ATOM 1037 HE3 MET A 71 15.947 16.028 126.891 1.00 0.00 H ATOM 1038 H MET A 71 15.305 19.446 120.884 1.00 0.00 H ATOM 1039 N MET A 72 14.236 21.485 123.316 1.00 16.61 N ATOM 1040 CA MET A 72 14.038 22.672 124.137 1.00 18.07 C ATOM 1041 C MET A 72 12.913 23.548 123.592 1.00 20.37 C ATOM 1042 O MET A 72 12.145 24.125 124.360 1.00 21.43 O ATOM 1043 CB MET A 72 15.335 23.492 124.213 1.00 16.69 C ATOM 1044 CG MET A 72 15.201 24.793 124.993 1.00 15.69 C ATOM 1045 SD MET A 72 16.685 25.823 124.960 1.00 15.75 S ATOM 1046 CE MET A 72 17.929 24.661 125.479 1.00 13.62 C ATOM 1047 HA MET A 72 13.759 22.336 125.136 1.00 0.00 H ATOM 1048 HB2 MET A 72 16.099 22.881 124.694 1.00 0.00 H ATOM 1049 HB3 MET A 72 15.649 23.732 123.197 1.00 0.00 H ATOM 1050 HG2 MET A 72 14.975 24.549 126.031 1.00 0.00 H ATOM 1051 HG3 MET A 72 14.376 25.365 124.568 1.00 0.00 H ATOM 1052 HE1 MET A 72 17.683 24.288 126.473 1.00 0.00 H ATOM 1053 HE2 MET A 72 17.964 23.829 124.775 1.00 0.00 H ATOM 1054 HE3 MET A 72 18.899 25.157 125.505 1.00 0.00 H ATOM 1055 H MET A 72 15.139 21.365 122.815 1.00 0.00 H ATOM 1056 N ALA A 73 12.817 23.645 122.268 1.00 21.78 N ATOM 1057 CA ALA A 73 11.863 24.552 121.636 1.00 22.93 C ATOM 1058 C ALA A 73 10.457 23.976 121.667 1.00 24.08 C ATOM 1059 O ALA A 73 9.480 24.716 121.653 1.00 23.50 O ATOM 1060 CB ALA A 73 12.279 24.850 120.202 1.00 22.75 C ATOM 1061 HA ALA A 73 11.861 25.484 122.202 1.00 0.00 H ATOM 1062 HB1 ALA A 73 13.265 25.315 120.200 1.00 0.00 H ATOM 1063 HB2 ALA A 73 12.313 23.920 119.634 1.00 0.00 H ATOM 1064 HB3 ALA A 73 11.555 25.527 119.748 1.00 0.00 H ATOM 1065 H ALA A 73 13.436 23.061 121.670 1.00 0.00 H ATOM 1066 N ARG A 74 10.363 22.651 121.707 1.00 25.85 N ATOM 1067 CA ARG A 74 9.076 21.975 121.787 1.00 27.96 C ATOM 1068 C ARG A 74 8.671 21.765 123.243 1.00 29.40 C ATOM 1069 O ARG A 74 7.706 22.365 123.722 1.00 30.65 O ATOM 1070 CB ARG A 74 9.135 20.627 121.064 1.00 28.79 C ATOM 1071 CG ARG A 74 9.162 20.741 119.546 1.00 29.13 C ATOM 1072 CD ARG A 74 9.220 19.401 118.830 1.00 29.40 C ATOM 1073 NE ARG A 74 9.457 19.546 117.396 1.00 29.01 N ATOM 1074 CZ ARG A 74 9.984 18.599 116.631 1.00 29.14 C ATOM 1075 NH1 ARG A 74 10.329 17.433 117.156 1.00 29.58 N ATOM 1076 NH2 ARG A 74 10.166 18.813 115.336 1.00 29.33 N ATOM 1077 HA ARG A 74 8.330 22.604 121.302 1.00 0.00 H ATOM 1078 HB2 ARG A 74 10.036 20.104 121.385 1.00 0.00 H ATOM 1079 HB3 ARG A 74 8.258 20.046 121.349 1.00 0.00 H ATOM 1080 HG2 ARG A 74 8.261 21.264 119.224 1.00 0.00 H ATOM 1081 HG3 ARG A 74 10.039 21.322 119.260 1.00 0.00 H ATOM 1082 HD2 ARG A 74 8.272 18.883 118.978 1.00 0.00 H ATOM 1083 HD3 ARG A 74 10.027 18.808 119.260 1.00 0.00 H ATOM 1084 HE ARG A 74 9.197 20.447 116.947 1.00 0.00 H ATOM 1085 HH12 ARG A 74 10.742 16.693 116.553 1.00 0.00 H ATOM 1086 HH11 ARG A 74 10.187 17.257 118.171 1.00 0.00 H ATOM 1087 HH22 ARG A 74 10.579 18.069 114.739 1.00 0.00 H ATOM 1088 HH21 ARG A 74 9.895 19.725 114.917 1.00 0.00 H ATOM 1089 H ARG A 74 11.233 22.081 121.680 1.00 0.00 H TER 1090 ARG A 74 ATOM 1091 N LYS A 77 4.231 19.717 126.274 1.00 54.77 N ATOM 1092 CA LYS A 77 3.393 19.640 127.465 1.00 54.86 C ATOM 1093 C LYS A 77 2.748 18.260 127.603 1.00 54.66 C ATOM 1094 O LYS A 77 1.853 18.064 128.428 1.00 54.84 O ATOM 1095 CB LYS A 77 2.315 20.727 127.436 1.00 54.91 C ATOM 1096 HA LYS A 77 4.034 19.802 128.332 1.00 0.00 H ATOM 1097 HB2 LYS A 77 2.790 21.707 127.400 1.00 0.00 H ATOM 1098 HB3 LYS A 77 1.689 20.593 126.554 1.00 0.00 H ATOM 1099 HN3 LYS A 77 3.650 19.537 125.430 1.00 0.00 H ATOM 1100 HN2 LYS A 77 4.985 19.003 126.336 1.00 0.00 H ATOM 1101 HN1 LYS A 77 4.654 20.665 126.210 1.00 0.00 H ATOM 1102 N ASP A 78 3.197 17.310 126.786 1.00 54.06 N ATOM 1103 CA ASP A 78 2.969 15.898 127.068 1.00 53.40 C ATOM 1104 C ASP A 78 3.859 15.519 128.244 1.00 52.70 C ATOM 1105 O ASP A 78 3.383 15.023 129.267 1.00 52.88 O ATOM 1106 CB ASP A 78 3.297 15.038 125.846 1.00 53.45 C ATOM 1107 HA ASP A 78 1.920 15.725 127.309 1.00 0.00 H ATOM 1108 HB2 ASP A 78 2.662 15.337 125.012 1.00 0.00 H ATOM 1109 HB3 ASP A 78 4.344 15.178 125.575 1.00 0.00 H ATOM 1110 H ASP A 78 3.721 17.580 125.929 1.00 0.00 H ATOM 1111 N THR A 79 5.156 15.765 128.088 1.00 51.66 N ATOM 1112 CA THR A 79 6.060 15.879 129.226 1.00 50.71 C ATOM 1113 C THR A 79 6.086 17.339 129.680 1.00 49.54 C ATOM 1114 O THR A 79 6.261 18.249 128.867 1.00 50.20 O ATOM 1115 CB THR A 79 7.475 15.392 128.848 1.00 50.98 C ATOM 1116 OG1 THR A 79 7.782 14.187 129.563 1.00 51.05 O ATOM 1117 CG2 THR A 79 8.546 16.383 129.306 1.00 50.90 C ATOM 1118 HA THR A 79 5.708 15.250 130.043 1.00 0.00 H ATOM 1119 HB THR A 79 7.478 15.264 127.766 1.00 0.00 H ATOM 1120 HG1 THR A 79 7.745 14.364 130.536 1.00 0.00 H ATOM 1121 HG23 THR A 79 8.390 17.340 128.808 1.00 0.00 H ATOM 1122 HG21 THR A 79 8.476 16.518 130.385 1.00 0.00 H ATOM 1123 HG22 THR A 79 9.532 15.995 129.050 1.00 0.00 H ATOM 1124 H THR A 79 5.537 15.879 127.127 1.00 0.00 H ATOM 1125 N ASP A 80 5.915 17.550 130.981 1.00 47.46 N ATOM 1126 CA ASP A 80 5.429 18.823 131.504 1.00 45.22 C ATOM 1127 C ASP A 80 3.911 18.740 131.670 1.00 42.99 C ATOM 1128 O ASP A 80 3.205 19.748 131.598 1.00 43.28 O ATOM 1129 CB ASP A 80 5.806 19.984 130.580 1.00 45.14 C ATOM 1130 HA ASP A 80 5.897 19.013 132.470 1.00 0.00 H ATOM 1131 HB2 ASP A 80 6.891 20.037 130.489 1.00 0.00 H ATOM 1132 HB3 ASP A 80 5.365 19.822 129.596 1.00 0.00 H ATOM 1133 H ASP A 80 6.135 16.783 131.648 1.00 0.00 H ATOM 1134 N SER A 81 3.418 17.522 131.874 1.00 39.97 N ATOM 1135 CA SER A 81 2.037 17.304 132.278 1.00 37.10 C ATOM 1136 C SER A 81 1.882 17.690 133.745 1.00 34.39 C ATOM 1137 O SER A 81 2.857 18.064 134.400 1.00 33.12 O ATOM 1138 CB SER A 81 1.653 15.839 132.074 1.00 37.58 C ATOM 1139 OG SER A 81 2.632 14.978 132.631 1.00 37.73 O ATOM 1140 HA SER A 81 1.377 17.920 131.667 1.00 0.00 H ATOM 1141 HB2 SER A 81 1.566 15.638 131.006 1.00 0.00 H ATOM 1142 HB3 SER A 81 0.694 15.650 132.557 1.00 0.00 H ATOM 1143 HG SER A 81 2.362 14.036 132.487 1.00 0.00 H ATOM 1144 H SER A 81 4.039 16.699 131.741 1.00 0.00 H ATOM 1145 N GLU A 82 0.659 17.602 134.260 1.00 31.16 N ATOM 1146 CA GLU A 82 0.389 18.001 135.636 1.00 28.80 C ATOM 1147 C GLU A 82 1.174 17.141 136.619 1.00 25.56 C ATOM 1148 O GLU A 82 1.769 17.659 137.560 1.00 24.72 O ATOM 1149 CB GLU A 82 -1.107 17.918 135.947 1.00 29.71 C ATOM 1150 CG GLU A 82 -1.599 19.040 136.847 1.00 30.55 C ATOM 1151 CD GLU A 82 -2.767 18.631 137.721 1.00 31.28 C ATOM 1152 OE1 GLU A 82 -2.539 18.303 138.905 1.00 31.44 O ATOM 1153 OE2 GLU A 82 -3.916 18.644 137.224 1.00 31.95 O ATOM 1154 HA GLU A 82 0.711 19.037 135.747 1.00 0.00 H ATOM 1155 HB2 GLU A 82 -1.658 17.961 135.008 1.00 0.00 H ATOM 1156 HB3 GLU A 82 -1.306 16.967 136.440 1.00 0.00 H ATOM 1157 HG2 GLU A 82 -0.777 19.355 137.490 1.00 0.00 H ATOM 1158 HG3 GLU A 82 -1.910 19.876 136.221 1.00 0.00 H ATOM 1159 H GLU A 82 -0.119 17.242 133.671 1.00 0.00 H ATOM 1160 N GLU A 83 1.174 15.830 136.398 1.00 22.43 N ATOM 1161 CA GLU A 83 1.936 14.918 137.244 1.00 21.31 C ATOM 1162 C GLU A 83 3.395 15.363 137.339 1.00 18.22 C ATOM 1163 O GLU A 83 3.968 15.420 138.424 1.00 17.08 O ATOM 1164 CB GLU A 83 1.866 13.483 136.707 1.00 22.48 C ATOM 1165 CG GLU A 83 2.930 12.560 137.295 1.00 24.24 C ATOM 1166 CD GLU A 83 2.887 11.148 136.729 1.00 25.88 C ATOM 1167 OE1 GLU A 83 2.696 10.993 135.502 1.00 26.49 O ATOM 1168 OE2 GLU A 83 3.051 10.188 137.517 1.00 26.30 O ATOM 1169 HA GLU A 83 1.493 14.940 138.239 1.00 0.00 H ATOM 1170 HB2 GLU A 83 0.884 13.073 136.944 1.00 0.00 H ATOM 1171 HB3 GLU A 83 1.994 13.513 135.625 1.00 0.00 H ATOM 1172 HG2 GLU A 83 3.911 12.986 137.086 1.00 0.00 H ATOM 1173 HG3 GLU A 83 2.782 12.505 138.373 1.00 0.00 H ATOM 1174 H GLU A 83 0.620 15.447 135.606 1.00 0.00 H ATOM 1175 N GLU A 84 3.992 15.677 136.196 1.00 16.06 N ATOM 1176 CA GLU A 84 5.414 15.995 136.143 1.00 16.08 C ATOM 1177 C GLU A 84 5.723 17.318 136.844 1.00 13.94 C ATOM 1178 O GLU A 84 6.762 17.451 137.498 1.00 12.55 O ATOM 1179 CB GLU A 84 5.904 16.029 134.694 1.00 16.84 C ATOM 1180 CG GLU A 84 5.365 14.891 133.837 1.00 18.77 C ATOM 1181 CD GLU A 84 6.260 14.566 132.652 1.00 19.58 C ATOM 1182 OE1 GLU A 84 7.082 15.426 132.264 1.00 20.35 O ATOM 1183 OE2 GLU A 84 6.142 13.448 132.111 1.00 20.32 O ATOM 1184 HA GLU A 84 5.947 15.207 136.675 1.00 0.00 H ATOM 1185 HB2 GLU A 84 5.593 16.973 134.247 1.00 0.00 H ATOM 1186 HB3 GLU A 84 6.992 15.972 134.697 1.00 0.00 H ATOM 1187 HG2 GLU A 84 5.274 14.000 134.459 1.00 0.00 H ATOM 1188 HG3 GLU A 84 4.381 15.173 133.463 1.00 0.00 H ATOM 1189 H GLU A 84 3.433 15.697 135.319 1.00 0.00 H ATOM 1190 N ILE A 85 4.819 18.287 136.725 1.00 12.57 N ATOM 1191 CA ILE A 85 5.054 19.604 137.306 1.00 13.65 C ATOM 1192 C ILE A 85 4.802 19.604 138.810 1.00 13.26 C ATOM 1193 O ILE A 85 5.482 20.309 139.551 1.00 11.34 O ATOM 1194 CB ILE A 85 4.198 20.690 136.629 1.00 14.04 C ATOM 1195 CG1 ILE A 85 4.545 20.807 135.144 1.00 14.85 C ATOM 1196 CG2 ILE A 85 4.439 22.032 137.295 1.00 14.02 C ATOM 1197 CD1 ILE A 85 3.411 21.344 134.300 1.00 15.25 C ATOM 1198 HA ILE A 85 6.104 19.839 137.130 1.00 0.00 H ATOM 1199 HB ILE A 85 3.151 20.406 136.732 1.00 0.00 H ATOM 1200 HG12 ILE A 85 5.399 21.476 135.041 1.00 0.00 H ATOM 1201 HG13 ILE A 85 4.813 19.818 134.773 1.00 0.00 H ATOM 1202 HD11 ILE A 85 2.551 20.679 134.383 1.00 0.00 H ATOM 1203 HD12 ILE A 85 3.138 22.339 134.651 1.00 0.00 H ATOM 1204 HD13 ILE A 85 3.729 21.400 133.259 1.00 0.00 H ATOM 1205 HG21 ILE A 85 4.169 21.967 138.349 1.00 0.00 H ATOM 1206 HG22 ILE A 85 5.492 22.297 137.205 1.00 0.00 H ATOM 1207 HG23 ILE A 85 3.829 22.793 136.808 1.00 0.00 H ATOM 1208 H ILE A 85 3.934 18.103 136.211 1.00 0.00 H ATOM 1209 N ARG A 86 3.829 18.814 139.254 1.00 12.45 N ATOM 1210 CA ARG A 86 3.586 18.640 140.681 1.00 13.79 C ATOM 1211 C ARG A 86 4.800 18.004 141.343 1.00 13.06 C ATOM 1212 O ARG A 86 5.216 18.409 142.429 1.00 12.87 O ATOM 1213 CB ARG A 86 2.365 17.751 140.914 1.00 15.66 C ATOM 1214 CG ARG A 86 1.048 18.404 140.545 1.00 17.29 C ATOM 1215 CD ARG A 86 0.382 19.140 141.687 1.00 18.55 C ATOM 1216 NE ARG A 86 -0.921 19.674 141.299 1.00 20.18 N ATOM 1217 CZ ARG A 86 -1.463 20.771 141.813 1.00 21.03 C ATOM 1218 NH1 ARG A 86 -0.820 21.458 142.748 1.00 21.75 N ATOM 1219 NH2 ARG A 86 -2.654 21.181 141.396 1.00 21.68 N ATOM 1220 HA ARG A 86 3.402 19.622 141.117 1.00 0.00 H ATOM 1221 HB2 ARG A 86 2.479 16.847 140.316 1.00 0.00 H ATOM 1222 HB3 ARG A 86 2.332 17.484 141.970 1.00 0.00 H ATOM 1223 HG2 ARG A 86 1.232 19.115 139.740 1.00 0.00 H ATOM 1224 HG3 ARG A 86 0.367 17.628 140.194 1.00 0.00 H ATOM 1225 HD2 ARG A 86 1.024 19.964 141.998 1.00 0.00 H ATOM 1226 HD3 ARG A 86 0.248 18.451 142.521 1.00 0.00 H ATOM 1227 HE ARG A 86 -1.459 19.161 140.572 1.00 0.00 H ATOM 1228 HH12 ARG A 86 -1.248 22.317 143.149 1.00 0.00 H ATOM 1229 HH11 ARG A 86 0.112 21.137 143.080 1.00 0.00 H ATOM 1230 HH22 ARG A 86 -3.078 22.041 141.799 1.00 0.00 H ATOM 1231 HH21 ARG A 86 -3.163 20.643 140.666 1.00 0.00 H ATOM 1232 H ARG A 86 3.229 18.310 138.570 1.00 0.00 H ATOM 1233 N GLU A 87 5.351 16.994 140.679 1.00 10.81 N ATOM 1234 CA GLU A 87 6.549 16.321 141.147 1.00 10.53 C ATOM 1235 C GLU A 87 7.733 17.287 141.207 1.00 9.54 C ATOM 1236 O GLU A 87 8.513 17.260 142.160 1.00 7.81 O ATOM 1237 CB GLU A 87 6.878 15.132 140.236 1.00 10.70 C ATOM 1238 CG GLU A 87 6.075 13.885 140.560 1.00 11.44 C ATOM 1239 CD GLU A 87 6.103 12.844 139.456 1.00 12.13 C ATOM 1240 OE1 GLU A 87 6.581 13.145 138.338 1.00 12.68 O ATOM 1241 OE2 GLU A 87 5.638 11.716 139.712 1.00 12.10 O ATOM 1242 HA GLU A 87 6.361 15.953 142.156 1.00 0.00 H ATOM 1243 HB2 GLU A 87 6.671 15.419 139.205 1.00 0.00 H ATOM 1244 HB3 GLU A 87 7.937 14.898 140.341 1.00 0.00 H ATOM 1245 HG2 GLU A 87 6.482 13.438 141.467 1.00 0.00 H ATOM 1246 HG3 GLU A 87 5.039 14.177 140.734 1.00 0.00 H ATOM 1247 H GLU A 87 4.909 16.674 139.794 1.00 0.00 H ATOM 1248 N ALA A 88 7.858 18.138 140.192 1.00 9.93 N ATOM 1249 CA ALA A 88 8.945 19.115 140.134 1.00 8.71 C ATOM 1250 C ALA A 88 8.774 20.197 141.195 1.00 9.40 C ATOM 1251 O ALA A 88 9.744 20.631 141.822 1.00 8.19 O ATOM 1252 CB ALA A 88 9.011 19.751 138.753 1.00 9.04 C ATOM 1253 HA ALA A 88 9.878 18.587 140.332 1.00 0.00 H ATOM 1254 HB1 ALA A 88 9.187 18.977 138.006 1.00 0.00 H ATOM 1255 HB2 ALA A 88 8.068 20.254 138.541 1.00 0.00 H ATOM 1256 HB3 ALA A 88 9.825 20.475 138.727 1.00 0.00 H ATOM 1257 H ALA A 88 7.164 18.108 139.418 1.00 0.00 H ATOM 1258 N PHE A 89 7.537 20.646 141.382 1.00 9.84 N ATOM 1259 CA PHE A 89 7.242 21.617 142.425 1.00 10.41 C ATOM 1260 C PHE A 89 7.633 21.073 143.792 1.00 9.73 C ATOM 1261 O PHE A 89 8.133 21.806 144.636 1.00 11.00 O ATOM 1262 CB PHE A 89 5.761 21.987 142.425 1.00 11.79 C ATOM 1263 CG PHE A 89 5.423 23.089 143.386 1.00 12.26 C ATOM 1264 CD1 PHE A 89 5.607 24.416 143.031 1.00 13.65 C ATOM 1265 CD2 PHE A 89 4.934 22.800 144.649 1.00 13.63 C ATOM 1266 CE1 PHE A 89 5.302 25.436 143.916 1.00 13.72 C ATOM 1267 CE2 PHE A 89 4.629 23.816 145.538 1.00 13.23 C ATOM 1268 CZ PHE A 89 4.811 25.134 145.168 1.00 13.61 C ATOM 1269 HA PHE A 89 7.827 22.513 142.217 1.00 0.00 H ATOM 1270 HB2 PHE A 89 5.484 22.307 141.420 1.00 0.00 H ATOM 1271 HB3 PHE A 89 5.184 21.103 142.695 1.00 0.00 H ATOM 1272 HD2 PHE A 89 4.788 21.762 144.946 1.00 0.00 H ATOM 1273 HE2 PHE A 89 4.245 23.576 146.530 1.00 0.00 H ATOM 1274 HZ PHE A 89 4.567 25.935 145.866 1.00 0.00 H ATOM 1275 HE1 PHE A 89 5.450 26.476 143.623 1.00 0.00 H ATOM 1276 HD1 PHE A 89 5.997 24.660 142.043 1.00 0.00 H ATOM 1277 H PHE A 89 6.768 20.298 140.774 1.00 0.00 H ATOM 1278 N ARG A 90 7.398 19.786 144.014 1.00 9.19 N ATOM 1279 CA ARG A 90 7.760 19.165 145.282 1.00 8.93 C ATOM 1280 C ARG A 90 9.268 19.240 145.495 1.00 7.10 C ATOM 1281 O ARG A 90 9.733 19.557 146.585 1.00 6.68 O ATOM 1282 CB ARG A 90 7.297 17.708 145.313 1.00 9.60 C ATOM 1283 CG ARG A 90 7.532 16.995 146.637 1.00 9.69 C ATOM 1284 CD ARG A 90 6.890 15.600 146.709 1.00 11.31 C ATOM 1285 NE ARG A 90 7.396 14.830 147.845 1.00 11.81 N ATOM 1286 CZ ARG A 90 8.584 14.244 147.877 1.00 11.64 C ATOM 1287 NH1 ARG A 90 9.384 14.317 146.831 1.00 12.71 N ATOM 1288 NH2 ARG A 90 8.973 13.579 148.952 1.00 12.61 N ATOM 1289 HA ARG A 90 7.263 19.707 146.087 1.00 0.00 H ATOM 1290 HB2 ARG A 90 6.228 17.686 145.100 1.00 0.00 H ATOM 1291 HB3 ARG A 90 7.832 17.164 144.534 1.00 0.00 H ATOM 1292 HG2 ARG A 90 8.607 16.888 146.785 1.00 0.00 H ATOM 1293 HG3 ARG A 90 7.116 17.608 147.437 1.00 0.00 H ATOM 1294 HD2 ARG A 90 7.113 15.060 145.789 1.00 0.00 H ATOM 1295 HD3 ARG A 90 5.811 15.712 146.811 1.00 0.00 H ATOM 1296 HE ARG A 90 6.784 14.736 148.681 1.00 0.00 H ATOM 1297 HH12 ARG A 90 10.316 13.857 146.856 1.00 0.00 H ATOM 1298 HH11 ARG A 90 9.082 14.835 145.981 1.00 0.00 H ATOM 1299 HH22 ARG A 90 9.907 13.121 148.971 1.00 0.00 H ATOM 1300 HH21 ARG A 90 8.345 13.514 149.779 1.00 0.00 H ATOM 1301 H ARG A 90 6.949 19.212 143.272 1.00 0.00 H ATOM 1302 N VAL A 91 10.032 18.940 144.451 1.00 6.72 N ATOM 1303 CA VAL A 91 11.477 18.960 144.560 1.00 7.53 C ATOM 1304 C VAL A 91 11.913 20.349 145.017 1.00 7.63 C ATOM 1305 O VAL A 91 12.734 20.484 145.919 1.00 8.33 O ATOM 1306 CB VAL A 91 12.166 18.603 143.228 1.00 8.99 C ATOM 1307 CG1 VAL A 91 13.683 18.774 143.347 1.00 10.49 C ATOM 1308 CG2 VAL A 91 11.838 17.182 142.822 1.00 10.03 C ATOM 1309 HA VAL A 91 11.777 18.205 145.287 1.00 0.00 H ATOM 1310 HB VAL A 91 11.793 19.281 142.461 1.00 0.00 H ATOM 1311 HG11 VAL A 91 13.912 19.810 143.599 1.00 0.00 H ATOM 1312 HG12 VAL A 91 14.061 18.116 144.130 1.00 0.00 H ATOM 1313 HG13 VAL A 91 14.152 18.517 142.397 1.00 0.00 H ATOM 1314 HG21 VAL A 91 12.185 16.496 143.594 1.00 0.00 H ATOM 1315 HG22 VAL A 91 10.760 17.080 142.701 1.00 0.00 H ATOM 1316 HG23 VAL A 91 12.334 16.951 141.879 1.00 0.00 H ATOM 1317 H VAL A 91 9.588 18.688 143.545 1.00 0.00 H ATOM 1318 N PHE A 92 11.338 21.379 144.406 1.00 8.92 N ATOM 1319 CA PHE A 92 11.728 22.754 144.692 1.00 10.02 C ATOM 1320 C PHE A 92 11.218 23.250 146.051 1.00 11.54 C ATOM 1321 O PHE A 92 11.909 24.011 146.729 1.00 13.13 O ATOM 1322 CB PHE A 92 11.252 23.681 143.578 1.00 11.23 C ATOM 1323 CG PHE A 92 12.185 23.737 142.398 1.00 11.88 C ATOM 1324 CD1 PHE A 92 13.250 24.626 142.382 1.00 12.26 C ATOM 1325 CD2 PHE A 92 11.995 22.902 141.308 1.00 12.05 C ATOM 1326 CE1 PHE A 92 14.109 24.685 141.305 1.00 12.68 C ATOM 1327 CE2 PHE A 92 12.848 22.950 140.223 1.00 13.41 C ATOM 1328 CZ PHE A 92 13.911 23.846 140.218 1.00 13.57 C ATOM 1329 HA PHE A 92 12.817 22.769 144.740 1.00 0.00 H ATOM 1330 HB2 PHE A 92 10.279 23.332 143.232 1.00 0.00 H ATOM 1331 HB3 PHE A 92 11.152 24.687 143.986 1.00 0.00 H ATOM 1332 HD2 PHE A 92 11.162 22.199 141.307 1.00 0.00 H ATOM 1333 HE2 PHE A 92 12.688 22.287 139.373 1.00 0.00 H ATOM 1334 HZ PHE A 92 14.586 23.889 139.363 1.00 0.00 H ATOM 1335 HE1 PHE A 92 14.941 25.389 141.308 1.00 0.00 H ATOM 1336 HD1 PHE A 92 13.410 25.288 143.233 1.00 0.00 H ATOM 1337 H PHE A 92 10.590 21.200 143.706 1.00 0.00 H ATOM 1338 N ASP A 93 10.030 22.808 146.455 1.00 12.40 N ATOM 1339 CA ASP A 93 9.410 23.294 147.691 1.00 12.98 C ATOM 1340 C ASP A 93 9.853 22.440 148.878 1.00 13.17 C ATOM 1341 O ASP A 93 9.083 21.631 149.399 1.00 10.96 O ATOM 1342 CB ASP A 93 7.881 23.278 147.570 1.00 12.61 C ATOM 1343 CG ASP A 93 7.187 23.585 148.884 1.00 13.41 C ATOM 1344 OD1 ASP A 93 7.818 24.224 149.751 1.00 13.67 O ATOM 1345 OD2 ASP A 93 6.014 23.228 149.143 1.00 12.23 O ATOM 1346 HA ASP A 93 9.734 24.322 147.857 1.00 0.00 H ATOM 1347 HB2 ASP A 93 7.581 24.024 146.834 1.00 0.00 H ATOM 1348 HB3 ASP A 93 7.568 22.290 147.232 1.00 0.00 H ATOM 1349 H ASP A 93 9.529 22.101 145.880 1.00 0.00 H ATOM 1350 N LYS A 94 11.093 22.654 149.309 1.00 12.44 N ATOM 1351 CA LYS A 94 11.817 21.688 150.127 1.00 12.19 C ATOM 1352 C LYS A 94 11.233 21.513 151.525 1.00 12.29 C ATOM 1353 O LYS A 94 11.361 20.442 152.122 1.00 11.81 O ATOM 1354 CB LYS A 94 13.287 22.105 150.240 1.00 14.18 C ATOM 1355 CG LYS A 94 14.132 21.696 149.047 1.00 14.89 C ATOM 1356 CD LYS A 94 15.434 22.477 148.983 1.00 16.76 C ATOM 1357 HA LYS A 94 11.723 20.726 149.623 1.00 0.00 H ATOM 1358 HB2 LYS A 94 13.331 23.190 150.337 1.00 0.00 H ATOM 1359 HB3 LYS A 94 13.708 21.644 151.134 1.00 0.00 H ATOM 1360 HG2 LYS A 94 14.361 20.633 149.124 1.00 0.00 H ATOM 1361 HG3 LYS A 94 13.565 21.879 148.134 1.00 0.00 H ATOM 1362 HD2 LYS A 94 15.214 23.541 148.898 1.00 0.00 H ATOM 1363 HD3 LYS A 94 16.010 22.295 149.890 1.00 0.00 H ATOM 1364 H LYS A 94 11.564 23.545 149.053 1.00 0.00 H ATOM 1365 N ASP A 95 10.606 22.558 152.054 1.00 10.95 N ATOM 1366 CA ASP A 95 10.006 22.477 153.380 1.00 10.67 C ATOM 1367 C ASP A 95 8.507 22.185 153.308 1.00 9.91 C ATOM 1368 O ASP A 95 7.837 22.074 154.337 1.00 8.08 O ATOM 1369 CB ASP A 95 10.265 23.756 154.170 1.00 10.63 C ATOM 1370 CG ASP A 95 9.441 24.930 153.675 1.00 11.54 C ATOM 1371 OD1 ASP A 95 8.921 24.882 152.540 1.00 11.95 O ATOM 1372 OD2 ASP A 95 9.262 25.949 154.362 1.00 11.82 O ATOM 1373 HA ASP A 95 10.479 21.644 153.900 1.00 0.00 H ATOM 1374 HB2 ASP A 95 10.020 23.575 155.217 1.00 0.00 H ATOM 1375 HB3 ASP A 95 11.321 24.011 154.084 1.00 0.00 H ATOM 1376 H ASP A 95 10.542 23.445 151.515 1.00 0.00 H ATOM 1377 N GLY A 96 7.996 22.053 152.089 1.00 9.06 N ATOM 1378 CA GLY A 96 6.622 21.644 151.869 1.00 9.49 C ATOM 1379 C GLY A 96 5.586 22.647 152.346 1.00 10.68 C ATOM 1380 O GLY A 96 4.447 22.278 152.622 1.00 10.75 O ATOM 1381 HA3 GLY A 96 6.457 20.705 152.397 1.00 0.00 H ATOM 1382 HA2 GLY A 96 6.479 21.488 150.800 1.00 0.00 H ATOM 1383 H GLY A 96 8.601 22.249 151.266 1.00 0.00 H ATOM 1384 N ASN A 97 5.966 23.918 152.434 1.00 12.76 N ATOM 1385 CA ASN A 97 5.025 24.951 152.861 1.00 13.51 C ATOM 1386 C ASN A 97 4.167 25.517 151.722 1.00 12.88 C ATOM 1387 O ASN A 97 3.366 26.419 151.944 1.00 15.70 O ATOM 1388 CB ASN A 97 5.758 26.080 153.596 1.00 12.76 C ATOM 1389 CG ASN A 97 6.517 27.001 152.659 1.00 14.11 C ATOM 1390 OD1 ASN A 97 6.921 26.608 151.558 1.00 12.99 O ATOM 1391 ND2 ASN A 97 6.722 28.240 153.098 1.00 11.73 N ATOM 1392 HA ASN A 97 4.332 24.461 153.545 1.00 0.00 H ATOM 1393 HB2 ASN A 97 5.025 26.670 154.146 1.00 0.00 H ATOM 1394 HB3 ASN A 97 6.465 25.637 154.297 1.00 0.00 H ATOM 1395 HD22 ASN A 97 6.364 28.527 154.031 1.00 0.00 H ATOM 1396 HD21 ASN A 97 7.240 28.922 152.508 1.00 0.00 H ATOM 1397 H ASN A 97 6.944 24.180 152.196 1.00 0.00 H ATOM 1398 N GLY A 98 4.333 24.985 150.513 1.00 12.65 N ATOM 1399 CA GLY A 98 3.510 25.372 149.377 1.00 12.01 C ATOM 1400 C GLY A 98 4.036 26.571 148.604 1.00 13.62 C ATOM 1401 O GLY A 98 3.375 27.087 147.698 1.00 12.54 O ATOM 1402 HA3 GLY A 98 2.512 25.613 149.744 1.00 0.00 H ATOM 1403 HA2 GLY A 98 3.450 24.525 148.694 1.00 0.00 H ATOM 1404 H GLY A 98 5.075 24.269 150.376 1.00 0.00 H ATOM 1405 N TYR A 99 5.234 27.017 148.963 1.00 14.13 N ATOM 1406 CA TYR A 99 5.855 28.159 148.308 1.00 15.89 C ATOM 1407 C TYR A 99 7.320 27.871 148.040 1.00 16.01 C ATOM 1408 O TYR A 99 8.034 27.407 148.926 1.00 18.76 O ATOM 1409 CB TYR A 99 5.748 29.398 149.194 1.00 17.64 C ATOM 1410 CG TYR A 99 4.336 29.884 149.400 1.00 19.80 C ATOM 1411 CD1 TYR A 99 3.695 29.724 150.623 1.00 21.45 C ATOM 1412 CD2 TYR A 99 3.647 30.511 148.374 1.00 20.95 C ATOM 1413 CE1 TYR A 99 2.400 30.172 150.815 1.00 23.09 C ATOM 1414 CE2 TYR A 99 2.358 30.961 148.554 1.00 23.01 C ATOM 1415 CZ TYR A 99 1.736 30.789 149.773 1.00 23.73 C ATOM 1416 OH TYR A 99 0.448 31.242 149.942 1.00 26.69 O ATOM 1417 HA TYR A 99 5.337 28.339 147.366 1.00 0.00 H ATOM 1418 HB3 TYR A 99 6.323 30.201 148.732 1.00 0.00 H ATOM 1419 HB2 TYR A 99 6.175 29.161 150.169 1.00 0.00 H ATOM 1420 HD2 TYR A 99 4.133 30.650 147.409 1.00 0.00 H ATOM 1421 HE2 TYR A 99 1.831 31.452 147.736 1.00 0.00 H ATOM 1422 HE1 TYR A 99 1.909 30.039 151.779 1.00 0.00 H ATOM 1423 HD1 TYR A 99 4.221 29.238 151.444 1.00 0.00 H ATOM 1424 HH TYR A 99 0.148 31.044 150.865 1.00 0.00 H ATOM 1425 H TYR A 99 5.742 26.537 149.733 1.00 0.00 H ATOM 1426 N ILE A 100 7.778 28.141 146.823 1.00 15.62 N ATOM 1427 CA ILE A 100 9.204 28.072 146.552 1.00 16.03 C ATOM 1428 C ILE A 100 9.849 29.405 146.892 1.00 16.25 C ATOM 1429 O ILE A 100 9.544 30.426 146.283 1.00 16.03 O ATOM 1430 CB ILE A 100 9.484 27.704 145.095 1.00 16.33 C ATOM 1431 CG1 ILE A 100 8.806 26.384 144.736 1.00 16.69 C ATOM 1432 CG2 ILE A 100 10.987 27.586 144.873 1.00 17.15 C ATOM 1433 CD1 ILE A 100 8.745 26.124 143.241 1.00 17.71 C ATOM 1434 HA ILE A 100 9.633 27.287 147.175 1.00 0.00 H ATOM 1435 HB ILE A 100 9.082 28.489 144.454 1.00 0.00 H ATOM 1436 HG12 ILE A 100 9.360 25.572 145.206 1.00 0.00 H ATOM 1437 HG13 ILE A 100 7.788 26.401 145.126 1.00 0.00 H ATOM 1438 HD11 ILE A 100 8.184 26.923 142.757 1.00 0.00 H ATOM 1439 HD12 ILE A 100 9.757 26.093 142.837 1.00 0.00 H ATOM 1440 HD13 ILE A 100 8.251 25.170 143.059 1.00 0.00 H ATOM 1441 HG21 ILE A 100 11.463 28.539 145.103 1.00 0.00 H ATOM 1442 HG22 ILE A 100 11.390 26.811 145.525 1.00 0.00 H ATOM 1443 HG23 ILE A 100 11.180 27.324 143.833 1.00 0.00 H ATOM 1444 H ILE A 100 7.116 28.402 146.064 1.00 0.00 H ATOM 1445 N SER A 101 10.731 29.382 147.887 1.00 16.68 N ATOM 1446 CA SER A 101 11.467 30.570 148.299 1.00 16.14 C ATOM 1447 C SER A 101 12.708 30.744 147.441 1.00 17.00 C ATOM 1448 O SER A 101 13.103 29.834 146.704 1.00 17.65 O ATOM 1449 CB SER A 101 11.876 30.449 149.770 1.00 15.46 C ATOM 1450 OG SER A 101 12.912 29.490 149.930 1.00 13.89 O ATOM 1451 HA SER A 101 10.822 31.439 148.173 1.00 0.00 H ATOM 1452 HB2 SER A 101 11.011 30.142 150.357 1.00 0.00 H ATOM 1453 HB3 SER A 101 12.228 31.418 150.124 1.00 0.00 H ATOM 1454 HG SER A 101 13.159 29.429 150.887 1.00 0.00 H ATOM 1455 H SER A 101 10.901 28.486 148.388 1.00 0.00 H ATOM 1456 N ALA A 102 13.330 31.914 147.545 1.00 18.65 N ATOM 1457 CA ALA A 102 14.573 32.188 146.838 1.00 18.35 C ATOM 1458 C ALA A 102 15.653 31.223 147.301 1.00 18.83 C ATOM 1459 O ALA A 102 16.433 30.705 146.500 1.00 19.27 O ATOM 1460 CB ALA A 102 15.005 33.631 147.075 1.00 19.45 C ATOM 1461 HA ALA A 102 14.415 32.048 145.769 1.00 0.00 H ATOM 1462 HB1 ALA A 102 14.230 34.305 146.711 1.00 0.00 H ATOM 1463 HB2 ALA A 102 15.157 33.793 148.142 1.00 0.00 H ATOM 1464 HB3 ALA A 102 15.936 33.823 146.541 1.00 0.00 H ATOM 1465 H ALA A 102 12.917 32.654 148.148 1.00 0.00 H ATOM 1466 N ALA A 103 15.680 30.971 148.604 1.00 19.86 N ATOM 1467 CA ALA A 103 16.641 30.049 149.184 1.00 19.25 C ATOM 1468 C ALA A 103 16.464 28.654 148.595 1.00 19.89 C ATOM 1469 O ALA A 103 17.438 27.987 148.242 1.00 20.96 O ATOM 1470 CB ALA A 103 16.478 30.020 150.698 1.00 20.09 C ATOM 1471 HA ALA A 103 17.649 30.390 148.947 1.00 0.00 H ATOM 1472 HB1 ALA A 103 16.648 31.019 151.100 1.00 0.00 H ATOM 1473 HB2 ALA A 103 15.468 29.694 150.947 1.00 0.00 H ATOM 1474 HB3 ALA A 103 17.202 29.327 151.127 1.00 0.00 H ATOM 1475 H ALA A 103 14.995 31.446 149.226 1.00 0.00 H ATOM 1476 N GLU A 104 15.216 28.216 148.480 1.00 17.77 N ATOM 1477 CA GLU A 104 14.925 26.898 147.935 1.00 17.78 C ATOM 1478 C GLU A 104 15.268 26.811 146.448 1.00 17.89 C ATOM 1479 O GLU A 104 15.830 25.814 145.987 1.00 18.30 O ATOM 1480 CB GLU A 104 13.451 26.543 148.159 1.00 16.97 C ATOM 1481 CG GLU A 104 13.103 26.239 149.609 1.00 15.67 C ATOM 1482 CD GLU A 104 11.612 26.084 149.837 1.00 14.93 C ATOM 1483 OE1 GLU A 104 10.836 26.472 148.945 1.00 15.67 O ATOM 1484 OE2 GLU A 104 11.211 25.572 150.907 1.00 14.07 O ATOM 1485 HA GLU A 104 15.552 26.179 148.462 1.00 0.00 H ATOM 1486 HB2 GLU A 104 12.841 27.384 147.828 1.00 0.00 H ATOM 1487 HB3 GLU A 104 13.214 25.665 147.558 1.00 0.00 H ATOM 1488 HG2 GLU A 104 13.598 25.312 149.899 1.00 0.00 H ATOM 1489 HG3 GLU A 104 13.468 27.055 150.233 1.00 0.00 H ATOM 1490 H GLU A 104 14.431 28.826 148.785 1.00 0.00 H ATOM 1491 N LEU A 105 14.923 27.852 145.697 1.00 18.66 N ATOM 1492 CA LEU A 105 15.217 27.882 144.268 1.00 18.67 C ATOM 1493 C LEU A 105 16.720 27.751 144.022 1.00 18.25 C ATOM 1494 O LEU A 105 17.159 26.874 143.278 1.00 17.52 O ATOM 1495 CB LEU A 105 14.678 29.170 143.644 1.00 19.90 C ATOM 1496 CG LEU A 105 15.033 29.405 142.174 1.00 21.18 C ATOM 1497 CD1 LEU A 105 13.863 30.042 141.437 1.00 22.00 C ATOM 1498 HA LEU A 105 14.722 27.034 143.795 1.00 0.00 H ATOM 1499 HB2 LEU A 105 13.591 29.151 143.726 1.00 0.00 H ATOM 1500 HB3 LEU A 105 15.069 30.009 144.220 1.00 0.00 H ATOM 1501 HG LEU A 105 15.897 30.067 142.115 1.00 0.00 H ATOM 1502 HD11 LEU A 105 12.998 29.381 141.491 1.00 0.00 H ATOM 1503 HD12 LEU A 105 13.621 30.998 141.900 1.00 0.00 H ATOM 1504 HD13 LEU A 105 14.136 30.201 140.394 1.00 0.00 H ATOM 1505 H LEU A 105 14.435 28.659 146.135 1.00 0.00 H ATOM 1506 N ARG A 106 17.502 28.616 144.663 1.00 18.63 N ATOM 1507 CA ARG A 106 18.963 28.582 144.547 1.00 18.77 C ATOM 1508 C ARG A 106 19.537 27.223 144.925 1.00 19.20 C ATOM 1509 O ARG A 106 20.316 26.633 144.177 1.00 20.05 O ATOM 1510 CB ARG A 106 19.590 29.649 145.446 1.00 19.26 C ATOM 1511 HA ARG A 106 19.203 28.778 143.502 1.00 0.00 H ATOM 1512 HB2 ARG A 106 19.231 30.633 145.145 1.00 0.00 H ATOM 1513 HB3 ARG A 106 19.310 29.460 146.482 1.00 0.00 H ATOM 1514 H ARG A 106 17.062 29.340 145.266 1.00 0.00 H ATOM 1515 N HIS A 107 19.164 26.737 146.102 1.00 18.83 N ATOM 1516 CA HIS A 107 19.639 25.448 146.582 1.00 18.76 C ATOM 1517 C HIS A 107 19.437 24.371 145.523 1.00 17.78 C ATOM 1518 O HIS A 107 20.377 23.689 145.122 1.00 15.84 O ATOM 1519 CB HIS A 107 18.884 25.062 147.853 1.00 19.90 C ATOM 1520 CG HIS A 107 19.493 23.917 148.597 1.00 20.57 C ATOM 1521 ND1 HIS A 107 20.324 24.093 149.681 1.00 21.16 N ATOM 1522 CD2 HIS A 107 19.381 22.579 148.421 1.00 21.92 C ATOM 1523 CE1 HIS A 107 20.704 22.912 150.137 1.00 21.27 C ATOM 1524 NE2 HIS A 107 20.144 21.977 149.391 1.00 21.43 N ATOM 1525 HA HIS A 107 20.704 25.530 146.798 1.00 0.00 H ATOM 1526 HB2 HIS A 107 18.861 25.928 148.515 1.00 0.00 H ATOM 1527 HB3 HIS A 107 17.865 24.789 147.578 1.00 0.00 H ATOM 1528 HD2 HIS A 107 18.795 22.074 147.653 1.00 0.00 H ATOM 1529 HE1 HIS A 107 21.367 22.739 150.985 1.00 0.00 H ATOM 1530 H HIS A 107 18.516 27.292 146.697 1.00 0.00 H ATOM 1531 N VAL A 108 18.198 24.223 145.074 1.00 17.72 N ATOM 1532 CA VAL A 108 17.835 23.125 144.192 1.00 18.55 C ATOM 1533 C VAL A 108 18.546 23.239 142.842 1.00 19.19 C ATOM 1534 O VAL A 108 19.118 22.266 142.350 1.00 18.38 O ATOM 1535 CB VAL A 108 16.306 23.057 143.994 1.00 18.35 C ATOM 1536 CG1 VAL A 108 15.949 22.080 142.886 1.00 18.07 C ATOM 1537 CG2 VAL A 108 15.626 22.660 145.300 1.00 18.38 C ATOM 1538 HA VAL A 108 18.161 22.200 144.668 1.00 0.00 H ATOM 1539 HB VAL A 108 15.950 24.044 143.700 1.00 0.00 H ATOM 1540 HG11 VAL A 108 16.411 22.405 141.954 1.00 0.00 H ATOM 1541 HG12 VAL A 108 16.315 21.087 143.147 1.00 0.00 H ATOM 1542 HG13 VAL A 108 14.866 22.049 142.765 1.00 0.00 H ATOM 1543 HG21 VAL A 108 15.990 21.682 145.615 1.00 0.00 H ATOM 1544 HG22 VAL A 108 15.856 23.400 146.067 1.00 0.00 H ATOM 1545 HG23 VAL A 108 14.548 22.615 145.148 1.00 0.00 H ATOM 1546 H VAL A 108 17.469 24.908 145.359 1.00 0.00 H ATOM 1547 N MET A 109 18.524 24.427 142.250 1.00 20.39 N ATOM 1548 CA MET A 109 19.264 24.658 141.011 1.00 21.93 C ATOM 1549 C MET A 109 20.719 24.220 141.148 1.00 21.85 C ATOM 1550 O MET A 109 21.266 23.568 140.258 1.00 23.08 O ATOM 1551 CB MET A 109 19.204 26.132 140.624 1.00 22.42 C ATOM 1552 CG MET A 109 17.828 26.574 140.171 1.00 23.79 C ATOM 1553 SD MET A 109 17.245 25.645 138.738 1.00 24.71 S ATOM 1554 CE MET A 109 15.665 26.476 138.451 1.00 24.09 C ATOM 1555 HA MET A 109 18.797 24.061 140.228 1.00 0.00 H ATOM 1556 HB2 MET A 109 19.493 26.730 141.489 1.00 0.00 H ATOM 1557 HB3 MET A 109 19.909 26.306 139.811 1.00 0.00 H ATOM 1558 HG2 MET A 109 17.868 27.632 139.911 1.00 0.00 H ATOM 1559 HG3 MET A 109 17.126 26.429 140.992 1.00 0.00 H ATOM 1560 HE1 MET A 109 15.035 26.371 139.334 1.00 0.00 H ATOM 1561 HE2 MET A 109 15.843 27.533 138.253 1.00 0.00 H ATOM 1562 HE3 MET A 109 15.168 26.023 137.593 1.00 0.00 H ATOM 1563 H MET A 109 17.974 25.202 142.673 1.00 0.00 H ATOM 1564 N THR A 110 21.342 24.577 142.267 1.00 21.39 N ATOM 1565 CA THR A 110 22.714 24.164 142.543 1.00 21.27 C ATOM 1566 C THR A 110 22.805 22.646 142.611 1.00 20.95 C ATOM 1567 O THR A 110 23.728 22.041 142.069 1.00 20.75 O ATOM 1568 CB THR A 110 23.211 24.783 143.867 1.00 21.12 C ATOM 1569 OG1 THR A 110 23.149 26.213 143.790 1.00 21.32 O ATOM 1570 CG2 THR A 110 24.691 24.485 144.095 1.00 20.78 C ATOM 1571 HA THR A 110 23.349 24.520 141.732 1.00 0.00 H ATOM 1572 HB THR A 110 22.585 24.367 144.657 1.00 0.00 H ATOM 1573 HG1 THR A 110 22.213 26.493 143.629 1.00 0.00 H ATOM 1574 HG23 THR A 110 24.836 23.407 144.167 1.00 0.00 H ATOM 1575 HG21 THR A 110 25.272 24.876 143.260 1.00 0.00 H ATOM 1576 HG22 THR A 110 25.018 24.960 145.020 1.00 0.00 H ATOM 1577 H THR A 110 20.839 25.165 142.962 1.00 0.00 H ATOM 1578 N ASN A 111 21.842 22.033 143.284 1.00 21.41 N ATOM 1579 CA ASN A 111 21.798 20.584 143.378 1.00 22.37 C ATOM 1580 C ASN A 111 21.715 19.938 142.001 1.00 22.58 C ATOM 1581 O ASN A 111 22.312 18.889 141.768 1.00 21.80 O ATOM 1582 CB ASN A 111 20.614 20.147 144.234 1.00 23.48 C ATOM 1583 CG ASN A 111 20.893 20.270 145.721 1.00 24.05 C ATOM 1584 OD1 ASN A 111 21.865 20.908 146.140 1.00 23.30 O ATOM 1585 ND2 ASN A 111 20.036 19.658 146.528 1.00 24.64 N ATOM 1586 HA ASN A 111 22.723 20.252 143.849 1.00 0.00 H ATOM 1587 HB2 ASN A 111 19.755 20.771 143.987 1.00 0.00 H ATOM 1588 HB3 ASN A 111 20.383 19.106 144.007 1.00 0.00 H ATOM 1589 HD22 ASN A 111 19.232 19.132 146.130 1.00 0.00 H ATOM 1590 HD21 ASN A 111 20.168 19.704 147.559 1.00 0.00 H ATOM 1591 H ASN A 111 21.106 22.599 143.753 1.00 0.00 H ATOM 1592 N LEU A 112 20.980 20.571 141.090 1.00 23.42 N ATOM 1593 CA LEU A 112 20.774 20.015 139.755 1.00 24.58 C ATOM 1594 C LEU A 112 22.001 20.218 138.872 1.00 25.38 C ATOM 1595 O LEU A 112 22.192 19.500 137.889 1.00 25.82 O ATOM 1596 CB LEU A 112 19.540 20.638 139.097 1.00 24.71 C ATOM 1597 CG LEU A 112 18.230 20.479 139.874 1.00 25.29 C ATOM 1598 CD1 LEU A 112 17.101 21.253 139.201 1.00 25.59 C ATOM 1599 CD2 LEU A 112 17.859 19.008 140.033 1.00 24.77 C ATOM 1600 HA LEU A 112 20.612 18.943 139.865 1.00 0.00 H ATOM 1601 HB2 LEU A 112 19.729 21.704 138.970 1.00 0.00 H ATOM 1602 HB3 LEU A 112 19.410 20.174 138.119 1.00 0.00 H ATOM 1603 HG LEU A 112 18.381 20.895 140.870 1.00 0.00 H ATOM 1604 HD21 LEU A 112 17.737 18.557 139.048 1.00 0.00 H ATOM 1605 HD22 LEU A 112 18.651 18.491 140.575 1.00 0.00 H ATOM 1606 HD23 LEU A 112 16.925 18.928 140.589 1.00 0.00 H ATOM 1607 HD11 LEU A 112 17.360 22.311 139.162 1.00 0.00 H ATOM 1608 HD12 LEU A 112 16.957 20.876 138.189 1.00 0.00 H ATOM 1609 HD13 LEU A 112 16.182 21.123 139.773 1.00 0.00 H ATOM 1610 H LEU A 112 20.542 21.482 141.334 1.00 0.00 H ATOM 1611 N GLY A 113 22.831 21.194 139.231 1.00 25.89 N ATOM 1612 CA GLY A 113 24.087 21.430 138.539 1.00 26.19 C ATOM 1613 C GLY A 113 24.214 22.851 138.022 1.00 26.86 C ATOM 1614 O GLY A 113 25.261 23.246 137.519 1.00 27.39 O ATOM 1615 HA3 GLY A 113 24.154 20.744 137.694 1.00 0.00 H ATOM 1616 HA2 GLY A 113 24.908 21.235 139.230 1.00 0.00 H ATOM 1617 H GLY A 113 22.573 21.806 140.031 1.00 0.00 H ATOM 1618 N GLU A 114 23.138 23.620 138.143 1.00 28.06 N ATOM 1619 CA GLU A 114 23.138 25.016 137.730 1.00 29.12 C ATOM 1620 C GLU A 114 23.662 25.910 138.850 1.00 28.96 C ATOM 1621 O GLU A 114 23.239 25.787 139.995 1.00 30.35 O ATOM 1622 CB GLU A 114 21.717 25.442 137.361 1.00 30.16 C ATOM 1623 CG GLU A 114 21.625 26.829 136.746 1.00 30.68 C ATOM 1624 CD GLU A 114 21.587 26.792 135.231 1.00 30.57 C ATOM 1625 OE1 GLU A 114 21.853 27.844 134.605 1.00 31.36 O ATOM 1626 OE2 GLU A 114 21.296 25.712 134.672 1.00 28.80 O ATOM 1627 HA GLU A 114 23.792 25.121 136.864 1.00 0.00 H ATOM 1628 HB2 GLU A 114 21.319 24.723 136.645 1.00 0.00 H ATOM 1629 HB3 GLU A 114 21.109 25.427 138.266 1.00 0.00 H ATOM 1630 HG2 GLU A 114 20.717 27.312 137.107 1.00 0.00 H ATOM 1631 HG3 GLU A 114 22.493 27.409 137.060 1.00 0.00 H ATOM 1632 H GLU A 114 22.269 23.213 138.545 1.00 0.00 H ATOM 1633 N LYS A 115 24.575 26.815 138.517 1.00 28.80 N ATOM 1634 CA LYS A 115 25.101 27.760 139.499 1.00 28.65 C ATOM 1635 C LYS A 115 24.607 29.170 139.191 1.00 27.67 C ATOM 1636 O LYS A 115 24.981 29.760 138.178 1.00 27.48 O ATOM 1637 CB LYS A 115 26.632 27.730 139.508 1.00 29.07 C ATOM 1638 HA LYS A 115 24.742 27.467 140.486 1.00 0.00 H ATOM 1639 HB2 LYS A 115 26.973 26.727 139.764 1.00 0.00 H ATOM 1640 HB3 LYS A 115 27.005 28.001 138.520 1.00 0.00 H ATOM 1641 H LYS A 115 24.923 26.852 137.537 1.00 0.00 H ATOM 1642 N LEU A 116 23.758 29.703 140.064 1.00 26.39 N ATOM 1643 CA LEU A 116 23.128 30.995 139.816 1.00 24.86 C ATOM 1644 C LEU A 116 23.718 32.073 140.715 1.00 22.94 C ATOM 1645 O LEU A 116 23.951 31.838 141.902 1.00 23.18 O ATOM 1646 CB LEU A 116 21.617 30.902 140.045 1.00 24.52 C ATOM 1647 CG LEU A 116 20.851 29.964 139.110 1.00 24.66 C ATOM 1648 CD1 LEU A 116 19.487 29.638 139.694 1.00 24.75 C ATOM 1649 CD2 LEU A 116 20.709 30.570 137.723 1.00 24.48 C ATOM 1650 HA LEU A 116 23.319 31.267 138.778 1.00 0.00 H ATOM 1651 HB2 LEU A 116 21.455 30.559 141.067 1.00 0.00 H ATOM 1652 HB3 LEU A 116 21.200 31.902 139.928 1.00 0.00 H ATOM 1653 HG LEU A 116 21.420 29.039 139.013 1.00 0.00 H ATOM 1654 HD21 LEU A 116 20.166 31.513 137.794 1.00 0.00 H ATOM 1655 HD22 LEU A 116 21.699 30.750 137.303 1.00 0.00 H ATOM 1656 HD23 LEU A 116 20.161 29.881 137.081 1.00 0.00 H ATOM 1657 HD11 LEU A 116 19.614 29.152 140.661 1.00 0.00 H ATOM 1658 HD12 LEU A 116 18.918 30.559 139.820 1.00 0.00 H ATOM 1659 HD13 LEU A 116 18.954 28.970 139.018 1.00 0.00 H ATOM 1660 H LEU A 116 23.539 29.189 140.941 1.00 0.00 H ATOM 1661 N THR A 117 23.957 33.250 140.141 1.00 20.24 N ATOM 1662 CA THR A 117 24.273 34.437 140.927 1.00 18.23 C ATOM 1663 C THR A 117 23.036 34.904 141.675 1.00 16.97 C ATOM 1664 O THR A 117 21.915 34.530 141.328 1.00 15.94 O ATOM 1665 CB THR A 117 24.778 35.582 140.023 1.00 18.26 C ATOM 1666 OG1 THR A 117 23.721 36.033 139.163 1.00 17.54 O ATOM 1667 CG2 THR A 117 25.868 35.105 139.065 1.00 18.20 C ATOM 1668 HA THR A 117 25.060 34.174 141.634 1.00 0.00 H ATOM 1669 HB THR A 117 25.145 36.358 140.695 1.00 0.00 H ATOM 1670 HG1 THR A 117 24.055 36.766 138.588 1.00 0.00 H ATOM 1671 HG23 THR A 117 26.720 34.741 139.639 1.00 0.00 H ATOM 1672 HG21 THR A 117 25.476 34.300 138.443 1.00 0.00 H ATOM 1673 HG22 THR A 117 26.182 35.935 138.432 1.00 0.00 H ATOM 1674 H THR A 117 23.917 33.325 139.104 1.00 0.00 H ATOM 1675 N ASP A 118 23.240 35.731 142.695 1.00 16.27 N ATOM 1676 CA ASP A 118 22.128 36.314 143.442 1.00 15.97 C ATOM 1677 C ASP A 118 21.191 37.080 142.515 1.00 16.03 C ATOM 1678 O ASP A 118 19.971 37.004 142.658 1.00 16.92 O ATOM 1679 CB ASP A 118 22.632 37.259 144.531 1.00 14.92 C ATOM 1680 CG ASP A 118 23.611 36.598 145.479 1.00 14.28 C ATOM 1681 OD1 ASP A 118 23.553 35.359 145.637 1.00 11.23 O ATOM 1682 OD2 ASP A 118 24.472 37.253 146.109 1.00 12.04 O ATOM 1683 HA ASP A 118 21.585 35.491 143.905 1.00 0.00 H ATOM 1684 HB2 ASP A 118 23.126 38.106 144.055 1.00 0.00 H ATOM 1685 HB3 ASP A 118 21.777 37.615 145.106 1.00 0.00 H ATOM 1686 H ASP A 118 24.215 35.969 142.968 1.00 0.00 H ATOM 1687 N GLU A 119 21.765 37.820 141.571 1.00 16.69 N ATOM 1688 CA GLU A 119 20.976 38.606 140.629 1.00 16.96 C ATOM 1689 C GLU A 119 20.061 37.705 139.804 1.00 16.99 C ATOM 1690 O GLU A 119 18.894 38.032 139.583 1.00 17.53 O ATOM 1691 CB GLU A 119 21.887 39.421 139.708 1.00 16.75 C ATOM 1692 HA GLU A 119 20.356 39.295 141.202 1.00 0.00 H ATOM 1693 HB2 GLU A 119 22.497 40.097 140.308 1.00 0.00 H ATOM 1694 HB3 GLU A 119 22.534 38.745 139.149 1.00 0.00 H ATOM 1695 H GLU A 119 22.803 37.839 141.503 1.00 0.00 H ATOM 1696 N GLU A 120 20.593 36.567 139.366 1.00 17.30 N ATOM 1697 CA GLU A 120 19.838 35.621 138.545 1.00 17.55 C ATOM 1698 C GLU A 120 18.690 34.989 139.328 1.00 16.96 C ATOM 1699 O GLU A 120 17.574 34.864 138.824 1.00 15.11 O ATOM 1700 CB GLU A 120 20.765 34.528 138.001 1.00 18.19 C ATOM 1701 CG GLU A 120 21.445 34.894 136.688 1.00 19.25 C ATOM 1702 CD GLU A 120 22.714 34.097 136.426 1.00 19.84 C ATOM 1703 OE1 GLU A 120 22.951 33.086 137.121 1.00 20.37 O ATOM 1704 OE2 GLU A 120 23.481 34.485 135.521 1.00 20.49 O ATOM 1705 HA GLU A 120 19.410 36.178 137.711 1.00 0.00 H ATOM 1706 HB2 GLU A 120 21.537 34.331 138.745 1.00 0.00 H ATOM 1707 HB3 GLU A 120 20.176 33.625 137.843 1.00 0.00 H ATOM 1708 HG2 GLU A 120 20.746 34.710 135.873 1.00 0.00 H ATOM 1709 HG3 GLU A 120 21.700 35.953 136.714 1.00 0.00 H ATOM 1710 H GLU A 120 21.577 36.343 139.615 1.00 0.00 H ATOM 1711 N VAL A 121 18.966 34.583 140.562 1.00 17.15 N ATOM 1712 CA VAL A 121 17.921 34.061 141.427 1.00 18.06 C ATOM 1713 C VAL A 121 16.876 35.150 141.657 1.00 18.19 C ATOM 1714 O VAL A 121 15.682 34.917 141.498 1.00 18.47 O ATOM 1715 CB VAL A 121 18.487 33.588 142.781 1.00 18.19 C ATOM 1716 CG1 VAL A 121 17.368 33.090 143.677 1.00 18.64 C ATOM 1717 CG2 VAL A 121 19.524 32.498 142.572 1.00 18.45 C ATOM 1718 HA VAL A 121 17.468 33.198 140.938 1.00 0.00 H ATOM 1719 HB VAL A 121 18.970 34.435 143.268 1.00 0.00 H ATOM 1720 HG11 VAL A 121 16.657 33.898 143.851 1.00 0.00 H ATOM 1721 HG12 VAL A 121 16.860 32.256 143.193 1.00 0.00 H ATOM 1722 HG13 VAL A 121 17.786 32.760 144.628 1.00 0.00 H ATOM 1723 HG21 VAL A 121 19.062 31.651 142.065 1.00 0.00 H ATOM 1724 HG22 VAL A 121 20.340 32.887 141.963 1.00 0.00 H ATOM 1725 HG23 VAL A 121 19.912 32.177 143.539 1.00 0.00 H ATOM 1726 H VAL A 121 19.943 34.639 140.914 1.00 0.00 H ATOM 1727 N ASP A 122 17.335 36.341 142.025 1.00 17.53 N ATOM 1728 CA ASP A 122 16.441 37.479 142.193 1.00 18.55 C ATOM 1729 C ASP A 122 15.534 37.615 140.969 1.00 17.85 C ATOM 1730 O ASP A 122 14.314 37.591 141.091 1.00 18.67 O ATOM 1731 CB ASP A 122 17.236 38.777 142.393 1.00 18.83 C ATOM 1732 CG ASP A 122 17.986 38.818 143.719 1.00 19.67 C ATOM 1733 OD1 ASP A 122 17.741 37.946 144.575 1.00 19.54 O ATOM 1734 OD2 ASP A 122 18.842 39.695 143.991 1.00 21.51 O ATOM 1735 HA ASP A 122 15.832 37.306 143.081 1.00 0.00 H ATOM 1736 HB2 ASP A 122 17.958 38.871 141.582 1.00 0.00 H ATOM 1737 HB3 ASP A 122 16.543 39.618 142.359 1.00 0.00 H ATOM 1738 H ASP A 122 18.353 36.464 142.197 1.00 0.00 H ATOM 1739 N GLU A 123 16.139 37.749 139.791 1.00 18.10 N ATOM 1740 CA GLU A 123 15.391 38.008 138.562 1.00 18.15 C ATOM 1741 C GLU A 123 14.420 36.880 138.260 1.00 18.27 C ATOM 1742 O GLU A 123 13.259 37.123 137.929 1.00 17.43 O ATOM 1743 CB GLU A 123 16.341 38.196 137.378 1.00 18.84 C ATOM 1744 HA GLU A 123 14.823 38.926 138.714 1.00 0.00 H ATOM 1745 HB2 GLU A 123 17.001 39.041 137.574 1.00 0.00 H ATOM 1746 HB3 GLU A 123 16.936 37.293 137.244 1.00 0.00 H ATOM 1747 H GLU A 123 17.175 37.667 139.743 1.00 0.00 H ATOM 1748 N MET A 124 14.905 35.648 138.372 1.00 18.15 N ATOM 1749 CA MET A 124 14.073 34.469 138.174 1.00 20.11 C ATOM 1750 C MET A 124 12.801 34.568 139.014 1.00 19.11 C ATOM 1751 O MET A 124 11.692 34.416 138.502 1.00 16.88 O ATOM 1752 CB MET A 124 14.854 33.210 138.555 1.00 21.94 C ATOM 1753 CG MET A 124 14.614 32.021 137.646 1.00 24.54 C ATOM 1754 SD MET A 124 15.965 30.811 137.700 1.00 26.92 S ATOM 1755 CE MET A 124 17.378 31.865 137.569 1.00 27.33 C ATOM 1756 HA MET A 124 13.793 34.411 137.122 1.00 0.00 H ATOM 1757 HB2 MET A 124 15.917 33.448 138.530 1.00 0.00 H ATOM 1758 HB3 MET A 124 14.570 32.927 139.568 1.00 0.00 H ATOM 1759 HG2 MET A 124 14.509 32.380 136.622 1.00 0.00 H ATOM 1760 HG3 MET A 124 13.692 31.528 137.953 1.00 0.00 H ATOM 1761 HE1 MET A 124 17.330 32.420 136.632 1.00 0.00 H ATOM 1762 HE2 MET A 124 17.388 32.563 138.406 1.00 0.00 H ATOM 1763 HE3 MET A 124 18.284 31.260 137.589 1.00 0.00 H ATOM 1764 H MET A 124 15.910 35.522 138.608 1.00 0.00 H ATOM 1765 N ILE A 125 12.976 34.829 140.308 1.00 18.92 N ATOM 1766 CA ILE A 125 11.851 35.003 141.219 1.00 20.52 C ATOM 1767 C ILE A 125 10.931 36.132 140.761 1.00 20.84 C ATOM 1768 O ILE A 125 9.720 35.949 140.667 1.00 20.81 O ATOM 1769 CB ILE A 125 12.354 35.300 142.644 1.00 21.87 C ATOM 1770 CG1 ILE A 125 13.119 34.102 143.209 1.00 21.86 C ATOM 1771 CG2 ILE A 125 11.185 35.662 143.551 1.00 22.93 C ATOM 1772 CD1 ILE A 125 12.232 33.048 143.829 1.00 22.95 C ATOM 1773 HA ILE A 125 11.284 34.072 141.218 1.00 0.00 H ATOM 1774 HB ILE A 125 13.037 36.149 142.599 1.00 0.00 H ATOM 1775 HG12 ILE A 125 13.685 33.642 142.399 1.00 0.00 H ATOM 1776 HG13 ILE A 125 13.808 34.463 143.972 1.00 0.00 H ATOM 1777 HD11 ILE A 125 11.667 33.488 144.651 1.00 0.00 H ATOM 1778 HD12 ILE A 125 11.543 32.666 143.076 1.00 0.00 H ATOM 1779 HD13 ILE A 125 12.849 32.232 144.206 1.00 0.00 H ATOM 1780 HG21 ILE A 125 10.682 36.546 143.158 1.00 0.00 H ATOM 1781 HG22 ILE A 125 10.483 34.829 143.587 1.00 0.00 H ATOM 1782 HG23 ILE A 125 11.556 35.869 144.555 1.00 0.00 H ATOM 1783 H ILE A 125 13.944 34.911 140.680 1.00 0.00 H ATOM 1784 N ARG A 126 11.509 37.299 140.487 1.00 19.99 N ATOM 1785 CA ARG A 126 10.724 38.480 140.134 1.00 21.48 C ATOM 1786 C ARG A 126 9.887 38.259 138.871 1.00 21.53 C ATOM 1787 O ARG A 126 8.736 38.684 138.798 1.00 21.34 O ATOM 1788 CB ARG A 126 11.640 39.695 139.941 1.00 21.54 C ATOM 1789 HA ARG A 126 10.039 38.667 140.961 1.00 0.00 H ATOM 1790 HB2 ARG A 126 12.180 39.892 140.867 1.00 0.00 H ATOM 1791 HB3 ARG A 126 12.351 39.489 139.141 1.00 0.00 H ATOM 1792 H ARG A 126 12.546 37.372 140.525 1.00 0.00 H ATOM 1793 N GLU A 127 10.472 37.596 137.878 1.00 21.86 N ATOM 1794 CA GLU A 127 9.773 37.329 136.629 1.00 21.59 C ATOM 1795 C GLU A 127 8.672 36.286 136.818 1.00 20.84 C ATOM 1796 O GLU A 127 7.721 36.234 136.044 1.00 19.88 O ATOM 1797 CB GLU A 127 10.762 36.876 135.549 1.00 22.97 C ATOM 1798 CG GLU A 127 11.536 38.020 134.903 1.00 24.43 C ATOM 1799 CD GLU A 127 12.579 37.542 133.905 1.00 25.59 C ATOM 1800 OE1 GLU A 127 12.415 36.432 133.353 1.00 26.29 O ATOM 1801 OE2 GLU A 127 13.568 38.276 133.674 1.00 26.29 O ATOM 1802 HA GLU A 127 9.300 38.256 136.306 1.00 0.00 H ATOM 1803 HB2 GLU A 127 11.477 36.191 136.004 1.00 0.00 H ATOM 1804 HB3 GLU A 127 10.206 36.355 134.770 1.00 0.00 H ATOM 1805 HG2 GLU A 127 10.830 38.668 134.384 1.00 0.00 H ATOM 1806 HG3 GLU A 127 12.039 38.586 135.687 1.00 0.00 H ATOM 1807 H GLU A 127 11.450 37.261 137.996 1.00 0.00 H ATOM 1808 N ALA A 128 8.793 35.459 137.853 1.00 21.41 N ATOM 1809 CA ALA A 128 7.791 34.424 138.114 1.00 20.94 C ATOM 1810 C ALA A 128 6.703 34.919 139.058 1.00 19.98 C ATOM 1811 O ALA A 128 5.581 34.423 139.039 1.00 20.59 O ATOM 1812 CB ALA A 128 8.451 33.183 138.683 1.00 21.17 C ATOM 1813 HA ALA A 128 7.319 34.175 137.163 1.00 0.00 H ATOM 1814 HB1 ALA A 128 9.180 32.801 137.969 1.00 0.00 H ATOM 1815 HB2 ALA A 128 8.953 33.436 139.617 1.00 0.00 H ATOM 1816 HB3 ALA A 128 7.692 32.423 138.871 1.00 0.00 H ATOM 1817 H ALA A 128 9.613 35.549 138.487 1.00 0.00 H ATOM 1818 N ASP A 129 7.041 35.908 139.877 1.00 20.28 N ATOM 1819 CA ASP A 129 6.213 36.284 141.017 1.00 19.71 C ATOM 1820 C ASP A 129 5.067 37.204 140.618 1.00 19.90 C ATOM 1821 O ASP A 129 5.221 38.419 140.589 1.00 22.00 O ATOM 1822 CB ASP A 129 7.079 36.966 142.076 1.00 19.62 C ATOM 1823 CG ASP A 129 6.353 37.163 143.390 1.00 19.55 C ATOM 1824 OD1 ASP A 129 5.262 36.563 143.587 1.00 19.38 O ATOM 1825 OD2 ASP A 129 6.807 37.905 144.284 1.00 16.99 O ATOM 1826 HA ASP A 129 5.774 35.372 141.421 1.00 0.00 H ATOM 1827 HB2 ASP A 129 7.961 36.351 142.254 1.00 0.00 H ATOM 1828 HB3 ASP A 129 7.388 37.941 141.699 1.00 0.00 H ATOM 1829 H ASP A 129 7.923 36.430 139.700 1.00 0.00 H ATOM 1830 N ILE A 130 3.913 36.613 140.330 1.00 20.42 N ATOM 1831 CA ILE A 130 2.739 37.365 139.900 1.00 19.99 C ATOM 1832 C ILE A 130 2.151 38.232 141.014 1.00 18.91 C ATOM 1833 O ILE A 130 1.852 39.403 140.792 1.00 19.21 O ATOM 1834 CB ILE A 130 1.662 36.404 139.355 1.00 20.71 C ATOM 1835 CG1 ILE A 130 2.106 35.816 138.014 1.00 21.25 C ATOM 1836 CG2 ILE A 130 0.331 37.122 139.200 1.00 20.98 C ATOM 1837 HA ILE A 130 3.067 38.039 139.109 1.00 0.00 H ATOM 1838 HB ILE A 130 1.533 35.591 140.070 1.00 0.00 H ATOM 1839 HG12 ILE A 130 2.259 36.623 137.298 1.00 0.00 H ATOM 1840 HG13 ILE A 130 3.038 35.267 138.150 1.00 0.00 H ATOM 1841 HG21 ILE A 130 0.009 37.500 140.170 1.00 0.00 H ATOM 1842 HG22 ILE A 130 0.447 37.953 138.505 1.00 0.00 H ATOM 1843 HG23 ILE A 130 -0.413 36.425 138.814 1.00 0.00 H ATOM 1844 H ILE A 130 3.844 35.579 140.414 1.00 0.00 H ATOM 1845 N ASP A 131 1.981 37.668 142.207 1.00 17.98 N ATOM 1846 CA ASP A 131 1.260 38.368 143.270 1.00 17.69 C ATOM 1847 C ASP A 131 2.180 39.124 144.238 1.00 17.15 C ATOM 1848 O ASP A 131 1.707 39.808 145.146 1.00 16.69 O ATOM 1849 CB ASP A 131 0.357 37.400 144.041 1.00 18.17 C ATOM 1850 CG ASP A 131 1.138 36.333 144.772 1.00 18.19 C ATOM 1851 OD1 ASP A 131 2.384 36.433 144.817 1.00 19.31 O ATOM 1852 OD2 ASP A 131 0.590 35.362 145.332 1.00 17.49 O ATOM 1853 HA ASP A 131 0.647 39.121 142.774 1.00 0.00 H ATOM 1854 HB2 ASP A 131 -0.223 37.968 144.768 1.00 0.00 H ATOM 1855 HB3 ASP A 131 -0.319 36.917 143.336 1.00 0.00 H ATOM 1856 H ASP A 131 2.365 36.718 142.386 1.00 0.00 H ATOM 1857 N GLY A 132 3.489 39.000 144.043 1.00 17.22 N ATOM 1858 CA GLY A 132 4.441 39.909 144.661 1.00 16.67 C ATOM 1859 C GLY A 132 4.784 39.616 146.113 1.00 15.54 C ATOM 1860 O GLY A 132 5.095 40.533 146.870 1.00 15.26 O ATOM 1861 HA3 GLY A 132 4.025 40.915 144.611 1.00 0.00 H ATOM 1862 HA2 GLY A 132 5.365 39.870 144.084 1.00 0.00 H ATOM 1863 H GLY A 132 3.841 38.234 143.434 1.00 0.00 H ATOM 1864 N ASP A 133 4.739 38.350 146.514 1.00 14.21 N ATOM 1865 CA ASP A 133 5.144 37.991 147.873 1.00 14.21 C ATOM 1866 C ASP A 133 6.603 37.522 147.925 1.00 13.27 C ATOM 1867 O ASP A 133 7.086 37.104 148.971 1.00 12.93 O ATOM 1868 CB ASP A 133 4.212 36.925 148.466 1.00 14.20 C ATOM 1869 CG ASP A 133 4.264 35.613 147.711 1.00 14.12 C ATOM 1870 OD1 ASP A 133 4.925 35.557 146.652 1.00 14.70 O ATOM 1871 OD2 ASP A 133 3.673 34.587 148.101 1.00 13.45 O ATOM 1872 HA ASP A 133 5.063 38.892 148.481 1.00 0.00 H ATOM 1873 HB2 ASP A 133 4.504 36.744 149.500 1.00 0.00 H ATOM 1874 HB3 ASP A 133 3.190 37.302 148.439 1.00 0.00 H ATOM 1875 H ASP A 133 4.414 37.611 145.858 1.00 0.00 H ATOM 1876 N GLY A 134 7.296 37.608 146.793 1.00 12.42 N ATOM 1877 CA GLY A 134 8.699 37.235 146.723 1.00 13.09 C ATOM 1878 C GLY A 134 8.903 35.733 146.680 1.00 13.57 C ATOM 1879 O GLY A 134 10.032 35.247 146.751 1.00 13.27 O ATOM 1880 HA3 GLY A 134 9.210 37.632 147.600 1.00 0.00 H ATOM 1881 HA2 GLY A 134 9.132 37.672 145.823 1.00 0.00 H ATOM 1882 H GLY A 134 6.821 37.952 145.934 1.00 0.00 H ATOM 1883 N GLN A 135 7.802 34.999 146.554 1.00 15.21 N ATOM 1884 CA GLN A 135 7.832 33.544 146.561 1.00 16.77 C ATOM 1885 C GLN A 135 7.107 32.998 145.338 1.00 15.54 C ATOM 1886 O GLN A 135 6.308 33.697 144.724 1.00 16.65 O ATOM 1887 CB GLN A 135 7.148 33.015 147.819 1.00 19.43 C ATOM 1888 CG GLN A 135 7.910 33.268 149.097 1.00 22.25 C ATOM 1889 CD GLN A 135 7.110 32.881 150.332 1.00 24.51 C ATOM 1890 OE1 GLN A 135 5.918 32.562 150.240 1.00 24.41 O ATOM 1891 NE2 GLN A 135 7.759 32.919 151.492 1.00 26.92 N ATOM 1892 HA GLN A 135 8.872 33.219 146.543 1.00 0.00 H ATOM 1893 HB2 GLN A 135 6.172 33.493 147.903 1.00 0.00 H ATOM 1894 HB3 GLN A 135 7.015 31.939 147.708 1.00 0.00 H ATOM 1895 HG2 GLN A 135 8.830 32.685 149.078 1.00 0.00 H ATOM 1896 HG3 GLN A 135 8.155 34.329 149.156 1.00 0.00 H ATOM 1897 HE22 GLN A 135 8.762 33.194 151.518 1.00 0.00 H ATOM 1898 HE21 GLN A 135 7.264 32.674 152.373 1.00 0.00 H ATOM 1899 H GLN A 135 6.887 35.481 146.447 1.00 0.00 H ATOM 1900 N VAL A 136 7.372 31.740 145.001 1.00 15.64 N ATOM 1901 CA VAL A 136 6.741 31.114 143.845 1.00 14.89 C ATOM 1902 C VAL A 136 5.770 30.016 144.265 1.00 14.12 C ATOM 1903 O VAL A 136 6.182 28.948 144.707 1.00 13.85 O ATOM 1904 CB VAL A 136 7.794 30.532 142.888 1.00 15.12 C ATOM 1905 CG1 VAL A 136 7.128 29.843 141.697 1.00 14.46 C ATOM 1906 CG2 VAL A 136 8.732 31.637 142.414 1.00 15.44 C ATOM 1907 HA VAL A 136 6.182 31.893 143.327 1.00 0.00 H ATOM 1908 HB VAL A 136 8.375 29.782 143.425 1.00 0.00 H ATOM 1909 HG11 VAL A 136 6.494 29.032 142.056 1.00 0.00 H ATOM 1910 HG12 VAL A 136 6.521 30.567 141.153 1.00 0.00 H ATOM 1911 HG13 VAL A 136 7.896 29.440 141.036 1.00 0.00 H ATOM 1912 HG21 VAL A 136 8.156 32.402 141.893 1.00 0.00 H ATOM 1913 HG22 VAL A 136 9.233 32.080 143.274 1.00 0.00 H ATOM 1914 HG23 VAL A 136 9.475 31.216 141.737 1.00 0.00 H ATOM 1915 H VAL A 136 8.044 31.190 145.574 1.00 0.00 H ATOM 1916 N ASN A 137 4.477 30.286 144.127 1.00 13.98 N ATOM 1917 CA ASN A 137 3.462 29.269 144.394 1.00 13.18 C ATOM 1918 C ASN A 137 3.319 28.333 143.197 1.00 13.48 C ATOM 1919 O ASN A 137 3.992 28.513 142.177 1.00 12.00 O ATOM 1920 CB ASN A 137 2.121 29.917 144.743 1.00 13.23 C ATOM 1921 CG ASN A 137 1.485 30.626 143.562 1.00 13.84 C ATOM 1922 OD1 ASN A 137 1.728 30.278 142.409 1.00 14.42 O ATOM 1923 ND2 ASN A 137 0.666 31.631 143.848 1.00 13.93 N ATOM 1924 HA ASN A 137 3.783 28.680 145.253 1.00 0.00 H ATOM 1925 HB2 ASN A 137 1.439 29.141 145.092 1.00 0.00 H ATOM 1926 HB3 ASN A 137 2.282 30.643 145.540 1.00 0.00 H ATOM 1927 HD22 ASN A 137 0.489 31.892 144.839 1.00 0.00 H ATOM 1928 HD21 ASN A 137 0.201 32.158 143.081 1.00 0.00 H ATOM 1929 H ASN A 137 4.182 31.236 143.824 1.00 0.00 H ATOM 1930 N TYR A 138 2.447 27.335 143.314 1.00 12.99 N ATOM 1931 CA TYR A 138 2.365 26.301 142.287 1.00 13.41 C ATOM 1932 C TYR A 138 2.018 26.877 140.917 1.00 13.54 C ATOM 1933 O TYR A 138 2.687 26.579 139.930 1.00 12.96 O ATOM 1934 CB TYR A 138 1.351 25.220 142.660 1.00 13.42 C ATOM 1935 CG TYR A 138 1.211 24.175 141.578 1.00 13.50 C ATOM 1936 CD1 TYR A 138 2.194 23.211 141.389 1.00 13.11 C ATOM 1937 CD2 TYR A 138 0.115 24.170 140.725 1.00 12.15 C ATOM 1938 CE1 TYR A 138 2.081 22.261 140.395 1.00 12.76 C ATOM 1939 CE2 TYR A 138 -0.002 23.224 139.723 1.00 12.78 C ATOM 1940 CZ TYR A 138 0.983 22.273 139.565 1.00 12.42 C ATOM 1941 OH TYR A 138 0.875 21.331 138.573 1.00 12.37 O ATOM 1942 HA TYR A 138 3.356 25.851 142.228 1.00 0.00 H ATOM 1943 HB3 TYR A 138 0.381 25.689 142.824 1.00 0.00 H ATOM 1944 HB2 TYR A 138 1.678 24.733 143.579 1.00 0.00 H ATOM 1945 HD2 TYR A 138 -0.664 24.922 140.847 1.00 0.00 H ATOM 1946 HE2 TYR A 138 -0.869 23.230 139.062 1.00 0.00 H ATOM 1947 HE1 TYR A 138 2.856 21.506 140.268 1.00 0.00 H ATOM 1948 HD1 TYR A 138 3.070 23.205 142.038 1.00 0.00 H ATOM 1949 HH TYR A 138 0.835 21.783 137.693 1.00 0.00 H ATOM 1950 H TYR A 138 1.820 27.291 144.142 1.00 0.00 H ATOM 1951 N GLU A 139 0.979 27.707 140.859 1.00 13.78 N ATOM 1952 CA GLU A 139 0.506 28.251 139.589 1.00 14.12 C ATOM 1953 C GLU A 139 1.579 29.110 138.930 1.00 14.37 C ATOM 1954 O GLU A 139 1.728 29.108 137.709 1.00 14.78 O ATOM 1955 CB GLU A 139 -0.771 29.071 139.793 1.00 14.19 C ATOM 1956 HA GLU A 139 0.282 27.412 138.930 1.00 0.00 H ATOM 1957 HB2 GLU A 139 -1.548 28.433 140.214 1.00 0.00 H ATOM 1958 HB3 GLU A 139 -0.567 29.896 140.476 1.00 0.00 H ATOM 1959 H GLU A 139 0.493 27.974 141.739 1.00 0.00 H ATOM 1960 N GLU A 140 2.329 29.841 139.744 1.00 13.84 N ATOM 1961 CA GLU A 140 3.458 30.615 139.244 1.00 12.76 C ATOM 1962 C GLU A 140 4.543 29.686 138.717 1.00 12.28 C ATOM 1963 O GLU A 140 5.168 29.964 137.697 1.00 12.29 O ATOM 1964 CB GLU A 140 4.017 31.505 140.353 1.00 12.12 C ATOM 1965 CG GLU A 140 3.104 32.665 140.714 1.00 12.75 C ATOM 1966 CD GLU A 140 3.530 33.379 141.977 1.00 12.97 C ATOM 1967 OE1 GLU A 140 4.395 32.847 142.697 1.00 14.07 O ATOM 1968 OE2 GLU A 140 3.006 34.478 142.249 1.00 14.35 O ATOM 1969 HA GLU A 140 3.114 31.248 138.426 1.00 0.00 H ATOM 1970 HB2 GLU A 140 4.169 30.894 141.243 1.00 0.00 H ATOM 1971 HB3 GLU A 140 4.974 31.908 140.023 1.00 0.00 H ATOM 1972 HG2 GLU A 140 3.108 33.380 139.892 1.00 0.00 H ATOM 1973 HG3 GLU A 140 2.093 32.282 140.855 1.00 0.00 H ATOM 1974 H GLU A 140 2.107 29.862 140.760 1.00 0.00 H ATOM 1975 N PHE A 141 4.761 28.578 139.418 1.00 12.04 N ATOM 1976 CA PHE A 141 5.770 27.608 139.014 1.00 12.13 C ATOM 1977 C PHE A 141 5.432 27.019 137.653 1.00 12.43 C ATOM 1978 O PHE A 141 6.303 26.876 136.794 1.00 11.78 O ATOM 1979 CB PHE A 141 5.877 26.491 140.051 1.00 12.37 C ATOM 1980 CG PHE A 141 6.997 25.527 139.791 1.00 11.89 C ATOM 1981 CD1 PHE A 141 8.320 25.931 139.907 1.00 11.96 C ATOM 1982 CD2 PHE A 141 6.729 24.218 139.429 1.00 11.09 C ATOM 1983 CE1 PHE A 141 9.353 25.041 139.672 1.00 11.38 C ATOM 1984 CE2 PHE A 141 7.760 23.325 139.197 1.00 11.26 C ATOM 1985 CZ PHE A 141 9.069 23.736 139.316 1.00 10.49 C ATOM 1986 HA PHE A 141 6.729 28.122 138.945 1.00 0.00 H ATOM 1987 HB2 PHE A 141 6.034 26.944 141.030 1.00 0.00 H ATOM 1988 HB3 PHE A 141 4.939 25.935 140.056 1.00 0.00 H ATOM 1989 HD2 PHE A 141 5.695 23.888 139.326 1.00 0.00 H ATOM 1990 HE2 PHE A 141 7.536 22.295 138.920 1.00 0.00 H ATOM 1991 HZ PHE A 141 9.881 23.033 139.130 1.00 0.00 H ATOM 1992 HE1 PHE A 141 10.388 25.368 139.767 1.00 0.00 H ATOM 1993 HD1 PHE A 141 8.547 26.960 140.186 1.00 0.00 H ATOM 1994 H PHE A 141 4.198 28.399 140.274 1.00 0.00 H ATOM 1995 N VAL A 142 4.160 26.680 137.467 1.00 13.19 N ATOM 1996 CA VAL A 142 3.674 26.170 136.195 1.00 14.06 C ATOM 1997 C VAL A 142 4.041 27.105 135.053 1.00 14.94 C ATOM 1998 O VAL A 142 4.581 26.670 134.038 1.00 15.40 O ATOM 1999 CB VAL A 142 2.146 25.998 136.200 1.00 13.84 C ATOM 2000 CG1 VAL A 142 1.633 25.770 134.787 1.00 14.06 C ATOM 2001 CG2 VAL A 142 1.747 24.848 137.100 1.00 15.09 C ATOM 2002 HA VAL A 142 4.149 25.200 136.050 1.00 0.00 H ATOM 2003 HB VAL A 142 1.696 26.912 136.587 1.00 0.00 H ATOM 2004 HG11 VAL A 142 1.892 26.627 134.165 1.00 0.00 H ATOM 2005 HG12 VAL A 142 2.091 24.870 134.377 1.00 0.00 H ATOM 2006 HG13 VAL A 142 0.550 25.650 134.810 1.00 0.00 H ATOM 2007 HG21 VAL A 142 2.207 23.929 136.738 1.00 0.00 H ATOM 2008 HG22 VAL A 142 2.085 25.049 138.116 1.00 0.00 H ATOM 2009 HG23 VAL A 142 0.662 24.741 137.091 1.00 0.00 H ATOM 2010 H VAL A 142 3.491 26.783 138.257 1.00 0.00 H ATOM 2011 N GLN A 143 3.731 28.387 135.212 1.00 16.05 N ATOM 2012 CA GLN A 143 4.000 29.362 134.163 1.00 17.95 C ATOM 2013 C GLN A 143 5.498 29.472 133.916 1.00 17.17 C ATOM 2014 O GLN A 143 5.939 29.611 132.783 1.00 14.21 O ATOM 2015 CB GLN A 143 3.426 30.730 134.540 1.00 20.35 C ATOM 2016 CG GLN A 143 1.904 30.759 134.628 1.00 22.39 C ATOM 2017 CD GLN A 143 1.232 30.332 133.334 1.00 23.37 C ATOM 2018 OE1 GLN A 143 1.205 31.093 132.366 1.00 25.81 O ATOM 2019 NE2 GLN A 143 0.689 29.118 133.314 1.00 23.73 N ATOM 2020 HA GLN A 143 3.516 29.024 133.247 1.00 0.00 H ATOM 2021 HB2 GLN A 143 3.832 31.017 135.510 1.00 0.00 H ATOM 2022 HB3 GLN A 143 3.740 31.453 133.788 1.00 0.00 H ATOM 2023 HG2 GLN A 143 1.588 30.085 135.424 1.00 0.00 H ATOM 2024 HG3 GLN A 143 1.588 31.774 134.867 1.00 0.00 H ATOM 2025 HE22 GLN A 143 0.738 28.512 134.158 1.00 0.00 H ATOM 2026 HE21 GLN A 143 0.215 28.774 132.454 1.00 0.00 H ATOM 2027 H GLN A 143 3.289 28.700 136.100 1.00 0.00 H ATOM 2028 N MET A 144 6.272 29.396 134.993 1.00 19.12 N ATOM 2029 CA MET A 144 7.724 29.523 134.926 1.00 20.23 C ATOM 2030 C MET A 144 8.356 28.352 134.172 1.00 20.44 C ATOM 2031 O MET A 144 9.355 28.519 133.472 1.00 19.38 O ATOM 2032 CB MET A 144 8.294 29.595 136.346 1.00 21.60 C ATOM 2033 CG MET A 144 9.812 29.569 136.424 1.00 23.44 C ATOM 2034 SD MET A 144 10.418 29.512 138.130 1.00 24.91 S ATOM 2035 CE MET A 144 11.428 28.051 138.071 1.00 26.08 C ATOM 2036 HA MET A 144 7.962 30.437 134.382 1.00 0.00 H ATOM 2037 HB2 MET A 144 7.946 30.520 136.805 1.00 0.00 H ATOM 2038 HB3 MET A 144 7.910 28.745 136.910 1.00 0.00 H ATOM 2039 HG2 MET A 144 10.202 30.466 135.944 1.00 0.00 H ATOM 2040 HG3 MET A 144 10.175 28.688 135.894 1.00 0.00 H ATOM 2041 HE1 MET A 144 10.811 27.195 137.796 1.00 0.00 H ATOM 2042 HE2 MET A 144 12.216 28.185 137.330 1.00 0.00 H ATOM 2043 HE3 MET A 144 11.874 27.879 139.051 1.00 0.00 H ATOM 2044 H MET A 144 5.826 29.240 135.919 1.00 0.00 H ATOM 2045 N MET A 145 7.768 27.169 134.317 1.00 20.82 N ATOM 2046 CA MET A 145 8.336 25.961 133.732 1.00 21.28 C ATOM 2047 C MET A 145 7.843 25.755 132.301 1.00 21.74 C ATOM 2048 O MET A 145 8.492 25.076 131.510 1.00 20.43 O ATOM 2049 CB MET A 145 7.992 24.737 134.590 1.00 22.38 C ATOM 2050 CG MET A 145 8.834 24.597 135.857 1.00 23.08 C ATOM 2051 SD MET A 145 10.604 24.720 135.546 1.00 25.16 S ATOM 2052 CE MET A 145 11.290 24.129 137.075 1.00 26.36 C ATOM 2053 HA MET A 145 9.419 26.081 133.704 1.00 0.00 H ATOM 2054 HB2 MET A 145 6.945 24.809 134.883 1.00 0.00 H ATOM 2055 HB3 MET A 145 8.138 23.843 133.983 1.00 0.00 H ATOM 2056 HG2 MET A 145 8.627 23.626 136.306 1.00 0.00 H ATOM 2057 HG3 MET A 145 8.548 25.386 136.553 1.00 0.00 H ATOM 2058 HE1 MET A 145 10.954 24.767 137.893 1.00 0.00 H ATOM 2059 HE2 MET A 145 10.957 23.106 137.250 1.00 0.00 H ATOM 2060 HE3 MET A 145 12.378 24.153 137.017 1.00 0.00 H ATOM 2061 H MET A 145 6.883 27.104 134.860 1.00 0.00 H ATOM 2062 N THR A 146 6.699 26.344 131.969 1.00 22.78 N ATOM 2063 CA THR A 146 6.131 26.200 130.635 1.00 24.19 C ATOM 2064 C THR A 146 6.249 27.500 129.846 1.00 25.18 C ATOM 2065 O THR A 146 5.658 27.640 128.775 1.00 25.13 O ATOM 2066 CB THR A 146 4.650 25.770 130.719 1.00 24.43 C ATOM 2067 OG1 THR A 146 3.874 26.794 131.355 1.00 24.13 O ATOM 2068 CG2 THR A 146 4.482 24.558 131.630 1.00 25.06 C ATOM 2069 HA THR A 146 6.696 25.427 130.115 1.00 0.00 H ATOM 2070 HB THR A 146 4.331 25.565 129.697 1.00 0.00 H ATOM 2071 HG1 THR A 146 4.220 26.949 132.270 1.00 0.00 H ATOM 2072 HG23 THR A 146 5.044 23.718 131.222 1.00 0.00 H ATOM 2073 HG21 THR A 146 4.856 24.798 132.625 1.00 0.00 H ATOM 2074 HG22 THR A 146 3.426 24.295 131.691 1.00 0.00 H ATOM 2075 H THR A 146 6.199 26.920 132.676 1.00 0.00 H ATOM 2076 N ALA A 147 7.015 28.445 130.381 1.00 26.17 N ATOM 2077 CA ALA A 147 7.200 29.744 129.741 1.00 27.26 C ATOM 2078 C ALA A 147 7.833 29.590 128.363 1.00 28.82 C ATOM 2079 O ALA A 147 8.476 28.579 128.074 1.00 28.70 O ATOM 2080 CB ALA A 147 8.064 30.648 130.617 1.00 26.93 C ATOM 2081 HA ALA A 147 6.219 30.202 129.617 1.00 0.00 H ATOM 2082 HB1 ALA A 147 7.576 30.792 131.581 1.00 0.00 H ATOM 2083 HB2 ALA A 147 9.038 30.183 130.767 1.00 0.00 H ATOM 2084 HB3 ALA A 147 8.193 31.613 130.126 1.00 0.00 H ATOM 2085 H ALA A 147 7.497 28.253 131.282 1.00 0.00 H ATOM 2086 N LYS A 148 7.648 30.607 127.525 1.00 30.88 N ATOM 2087 CA LYS A 148 8.191 30.622 126.168 1.00 32.03 C ATOM 2088 C LYS A 148 7.296 29.841 125.210 1.00 31.86 C ATOM 2089 O LYS A 148 7.372 30.018 123.993 1.00 31.54 O ATOM 2090 CB LYS A 148 9.606 30.041 126.145 1.00 32.99 C ATOM 2091 CG LYS A 148 10.628 30.843 126.939 1.00 33.56 C ATOM 2092 CD LYS A 148 11.959 30.901 126.201 1.00 34.29 C ATOM 2093 CE LYS A 148 13.046 31.568 127.031 1.00 34.37 C ATOM 2094 NZ LYS A 148 13.956 32.380 126.174 1.00 34.90 N ATOM 2095 HA LYS A 148 8.229 31.661 125.839 1.00 0.00 H ATOM 2096 HB2 LYS A 148 9.568 29.033 126.558 1.00 0.00 H ATOM 2097 HB3 LYS A 148 9.939 29.995 125.108 1.00 0.00 H ATOM 2098 HG2 LYS A 148 10.254 31.857 127.083 1.00 0.00 H ATOM 2099 HG3 LYS A 148 10.777 30.371 127.910 1.00 0.00 H ATOM 2100 HD2 LYS A 148 12.273 29.885 125.962 1.00 0.00 H ATOM 2101 HD3 LYS A 148 11.825 31.465 125.278 1.00 0.00 H ATOM 2102 HE2 LYS A 148 13.628 30.799 127.539 1.00 0.00 H ATOM 2103 HE3 LYS A 148 12.580 32.218 127.771 1.00 0.00 H ATOM 2104 HZ1 LYS A 148 14.407 31.764 125.468 1.00 0.00 H ATOM 2105 HZ2 LYS A 148 13.407 33.119 125.690 1.00 0.00 H ATOM 2106 HZ3 LYS A 148 14.686 32.822 126.768 1.00 0.00 H ATOM 2107 H LYS A 148 7.094 31.425 127.849 1.00 0.00 H TER 2108 LYS A 148 HETATM 2109 CA CA A 1 26.936 11.954 127.691 1.00 36.65 CA HETATM 2110 CA CA A 2 8.901 26.195 150.618 1.00 28.77 CA HETATM 2111 CA CA A 3 4.297 34.744 144.424 1.00 31.60 CA HETATM 2112 CA CA A 4 20.847 11.765 117.810 1.00 36.11 CA HETATM 2113 O HOH 5 3.574 19.477 144.250 1.00 24.61 O HETATM 2114 O HOH 6 12.220 30.097 130.063 1.00 35.61 O HETATM 2115 O HOH 7 13.418 6.395 136.543 1.00 28.71 O HETATM 2116 O HOH 8 9.165 16.551 137.093 1.00 28.68 O HETATM 2117 O HOH 9 11.106 -0.008 129.989 1.00 29.01 O HETATM 2118 O HOH 10 22.771 13.120 117.540 1.00 35.64 O HETATM 2119 O HOH 11 14.714 19.020 146.744 1.00 32.89 O HETATM 2120 O HOH 12 1.688 21.224 144.387 1.00 33.90 O HETATM 2121 O HOH 13 22.545 13.335 133.660 1.00 42.20 O HETATM 2122 O HOH 14 6.397 6.556 125.860 1.00 33.41 O HETATM 2123 O HOH 15 9.747 5.763 120.135 1.00 26.15 O HETATM 2124 O HOH 16 22.954 33.543 112.013 1.00 29.71 O HETATM 2125 O HOH 17 1.389 26.662 145.980 1.00 23.93 O HETATM 2126 O HOH 18 4.233 18.953 150.403 1.00 25.23 O HETATM 2127 O HOH 19 2.864 33.302 145.942 1.00 29.67 O HETATM 2128 O HOH 20 26.780 37.137 118.115 1.00 39.34 O HETATM 2129 O HOH 21 17.594 34.171 119.560 1.00 22.29 O HETATM 2130 O HOH 22 7.182 23.532 156.477 1.00 40.04 O HETATM 2131 O HOH 23 20.462 25.404 132.361 1.00 32.69 O HETATM 2132 O HOH 24 20.401 36.159 118.425 1.00 39.03 O HETATM 2133 O HOH 25 7.692 26.563 126.285 1.00 49.21 O HETATM 2134 O HOH 26 10.989 33.353 136.216 1.00 36.27 O HETATM 2135 O HOH 27 26.406 36.121 143.384 1.00 32.94 O HETATM 2136 O HOH 28 20.719 15.421 114.654 1.00 38.10 O HETATM 2137 O HOH 29 9.158 38.493 133.089 1.00 51.91 O HETATM 2138 O HOH 30 16.262 36.505 145.930 1.00 40.91 O HETATM 2139 O HOH 31 17.876 24.181 131.973 1.00 30.26 O HETATM 2140 O HOH 32 26.528 17.285 121.071 1.00 40.58 O HETATM 2141 O HOH 33 25.480 39.377 145.312 1.00 50.11 O HETATM 2142 O HOH 34 24.113 12.308 119.218 1.00 52.23 O HETATM 2143 O HOH 35 11.944 13.941 144.546 1.00 39.59 O HETATM 2144 O HOH 36 -0.667 28.087 146.178 1.00 45.89 O HETATM 2145 O HOH 37 9.312 15.051 144.077 1.00 26.13 O HETATM 2146 O HOH 38 27.484 32.398 130.740 1.00 41.77 O HETATM 2147 O HOH 39 27.067 9.321 127.717 1.00 34.96 O HETATM 2148 O HOH 40 12.899 26.035 153.130 1.00 33.29 O HETATM 2149 O HOH 41 21.734 37.301 124.426 1.00 31.51 O HETATM 2150 O HOH 42 32.347 33.568 125.182 1.00 41.99 O HETATM 2151 O HOH 43 29.362 31.278 124.779 1.00 35.09 O HETATM 2152 O HOH 44 8.291 8.682 127.001 1.00 36.59 O HETATM 2153 O HOH 45 4.525 21.510 148.564 1.00 35.44 O HETATM 2154 O HOH 46 17.944 5.760 133.599 1.00 39.96 O HETATM 2155 O HOH 47 9.908 28.338 151.747 1.00 31.17 O HETATM 2156 O HOH 48 30.979 31.348 122.813 1.00 28.36 O HETATM 2157 O HOH 49 21.798 19.703 149.153 1.00 38.59 O HETATM 2158 O HOH 50 5.230 32.552 136.935 1.00 48.50 O HETATM 2159 O HOH 51 23.301 8.310 138.173 1.00 48.78 O HETATM 2160 O HOH 52 18.321 29.709 130.090 1.00 39.28 O HETATM 2161 O HOH 53 21.883 4.651 128.490 1.00 36.34 O HETATM 2162 O HOH 54 11.149 14.493 123.664 1.00 48.91 O HETATM 2163 O HOH 55 22.925 33.233 144.787 1.00 34.30 O HETATM 2164 O HOH 56 6.095 21.080 124.701 1.00 43.69 O HETATM 2165 O HOH 57 -1.023 21.939 136.685 1.00 53.30 O HETATM 2166 O1 KAR A 58 15.833 20.165 134.216 1.00 -0.36 O HETATM 2167 C11 KAR A 58 15.848 21.210 133.576 1.00 0.18 C HETATM 2168 O2 KAR A 58 16.970 21.909 133.428 1.00 -0.30 O HETATM 2169 C9 KAR A 58 18.102 21.033 133.494 1.00 0.06 C HETATM 2170 H1 KAR A 58 19.026 21.618 133.371 1.00 0.06 H HETATM 2171 H2 KAR A 58 18.033 20.283 132.692 1.00 0.06 H HETATM 2172 H3 KAR A 58 18.117 20.526 134.470 1.00 0.06 H HETATM 2173 C10 KAR A 58 14.562 21.771 132.894 1.00 0.05 C HETATM 2174 C12 KAR A 58 14.386 23.293 133.224 1.00 -0.03 C HETATM 2175 C14 KAR A 58 14.032 24.162 132.187 1.00 -0.05 C HETATM 2176 C15 KAR A 58 13.837 25.517 132.448 1.00 -0.02 C HETATM 2177 C16 KAR A 58 14.018 26.071 133.690 1.00 0.08 C HETATM 2178 C17 KAR A 58 14.365 25.239 134.753 1.00 0.03 C HETATM 2179 C18 KAR A 58 14.546 23.859 134.514 1.00 0.12 C HETATM 2180 O19 KAR A 58 14.895 23.043 135.593 1.00 -0.29 O HETATM 2181 C20 KAR A 58 16.250 23.100 136.070 1.00 0.07 C HETATM 2182 H5 KAR A 58 16.370 22.407 136.916 1.00 0.06 H HETATM 2183 H6 KAR A 58 16.480 24.124 136.399 1.00 0.06 H HETATM 2184 H7 KAR A 58 16.936 22.812 135.260 1.00 0.06 H HETATM 2185 H8 KAR A 58 14.494 25.646 135.750 1.00 0.06 H HETATM 2186 N24 KAR A 58 13.795 27.410 133.641 1.00 -0.29 N HETATM 2187 C25 KAR A 58 13.913 28.293 134.800 1.00 0.03 C HETATM 2188 H9 KAR A 58 13.929 27.690 135.720 1.00 0.05 H HETATM 2189 H10 KAR A 58 13.054 28.980 134.827 1.00 0.05 H HETATM 2190 H11 KAR A 58 14.844 28.874 134.725 1.00 0.05 H HETATM 2191 C22 KAR A 58 13.745 27.895 132.252 1.00 0.07 C HETATM 2192 C21 KAR A 58 13.520 26.580 131.484 1.00 0.01 C HETATM 2193 C23 KAR A 58 12.004 26.371 131.741 1.00 -0.04 C HETATM 2194 C31 KAR A 58 11.276 27.239 130.721 1.00 -0.04 C HETATM 2195 N30 KAR A 58 12.254 27.202 129.625 1.00 0.25 N HETATM 2196 C27 KAR A 58 13.520 26.496 129.955 1.00 -0.08 C HETATM 2197 C29 KAR A 58 14.654 27.272 129.257 1.00 -0.03 C HETATM 2198 C32 KAR A 58 14.104 27.655 127.877 1.00 -0.08 C HETATM 2199 C33 KAR A 58 12.816 27.545 127.450 1.00 0.03 C HETATM 2200 C34 KAR A 58 11.699 27.022 128.289 1.00 0.04 C HETATM 2201 H17 KAR A 58 10.779 27.609 128.150 1.00 0.13 H HETATM 2202 H18 KAR A 58 11.494 25.963 128.075 1.00 0.13 H HETATM 2203 H22 KAR A 58 12.587 27.858 126.433 1.00 0.16 H HETATM 2204 H21 KAR A 58 14.820 28.058 127.163 1.00 0.05 H HETATM 2205 C35 KAR A 58 15.785 26.212 128.943 1.00 -0.09 C HETATM 2206 C36 KAR A 58 17.278 26.571 129.209 1.00 -0.08 C HETATM 2207 H25 KAR A 58 17.915 25.718 128.933 1.00 0.02 H HETATM 2208 H26 KAR A 58 17.415 26.801 130.276 1.00 0.02 H HETATM 2209 H27 KAR A 58 17.558 27.447 128.606 1.00 0.02 H HETATM 2210 H23 KAR A 58 15.702 25.965 127.874 1.00 0.01 H HETATM 2211 H24 KAR A 58 15.560 25.319 129.544 1.00 0.01 H HETATM 2212 C28 KAR A 58 15.107 28.531 130.122 1.00 -0.04 C HETATM 2213 C26 KAR A 58 15.067 28.536 131.710 1.00 0.19 C HETATM 2214 C83 KAR A 58 16.293 27.874 132.149 1.00 0.27 C HETATM 2215 O4 KAR A 58 16.661 26.717 132.011 1.00 -0.33 O HETATM 2216 N85 KAR A 58 17.033 28.917 132.842 1.00 -0.16 N HETATM 2217 C24 KAR A 58 16.340 30.076 132.821 1.00 0.35 C HETATM 2218 O61 KAR A 58 15.162 29.900 132.163 1.00 -0.25 O HETATM 2219 O3 KAR A 58 16.702 31.123 133.315 1.00 -0.37 O HETATM 2220 C19 KAR A 58 18.331 28.754 133.466 1.00 0.07 C HETATM 2221 C30 KAR A 58 18.196 28.963 134.987 1.00 0.05 C HETATM 2222 CL1 KAR A 58 17.666 27.445 135.716 1.00 -0.12 CL HETATM 2223 H32 KAR A 58 17.455 29.750 135.189 1.00 0.05 H HETATM 2224 H33 KAR A 58 19.168 29.258 135.409 1.00 0.05 H HETATM 2225 H30 KAR A 58 19.032 29.495 133.054 1.00 0.06 H HETATM 2226 H31 KAR A 58 18.710 27.741 133.267 1.00 0.06 H HETATM 2227 H28 KAR A 58 14.472 29.369 129.798 1.00 0.01 H HETATM 2228 H29 KAR A 58 16.151 28.734 129.842 1.00 0.01 H HETATM 2229 H15 KAR A 58 13.522 25.448 129.619 1.00 0.06 H HETATM 2230 H16 KAR A 58 12.561 28.161 129.585 1.00 0.21 H HETATM 2231 H19 KAR A 58 11.116 28.262 131.093 1.00 0.08 H HETATM 2232 H20 KAR A 58 10.311 26.801 130.424 1.00 0.08 H HETATM 2233 H13 KAR A 58 11.744 26.684 132.763 1.00 0.02 H HETATM 2234 H14 KAR A 58 11.736 25.313 131.602 1.00 0.02 H HETATM 2235 H12 KAR A 58 12.914 28.604 132.119 1.00 0.05 H HETATM 2236 H4 KAR A 58 13.909 23.781 131.179 1.00 0.10 H HETATM 2237 C13 KAR A 58 13.344 21.163 133.663 1.00 -0.08 C HETATM 2238 C41 KAR A 58 11.941 21.848 133.568 1.00 -0.01 C HETATM 2239 C91 KAR A 58 11.445 22.108 132.112 1.00 -0.03 C HETATM 2240 N48 KAR A 58 10.653 21.001 131.509 1.00 0.24 N HETATM 2241 C95 KAR A 58 9.586 20.414 132.350 1.00 -0.00 C HETATM 2242 C46 KAR A 58 10.156 19.910 133.699 1.00 0.11 C HETATM 2243 C92 KAR A 58 10.829 21.122 134.403 1.00 -0.01 C HETATM 2244 H39 KAR A 58 10.045 21.857 134.637 1.00 0.03 H HETATM 2245 H40 KAR A 58 11.285 20.762 135.337 1.00 0.03 H HETATM 2246 O10 KAR A 58 11.088 18.823 133.522 1.00 -0.38 O HETATM 2247 H41 KAR A 58 10.650 18.099 133.091 1.00 0.21 H HETATM 2248 C94 KAR A 58 9.072 19.219 134.598 1.00 -0.02 C HETATM 2249 C45 KAR A 58 7.727 19.978 134.796 1.00 -0.06 C HETATM 2250 H44 KAR A 58 7.063 19.385 135.443 1.00 0.02 H HETATM 2251 H45 KAR A 58 7.245 20.132 133.819 1.00 0.02 H HETATM 2252 H46 KAR A 58 7.922 20.953 135.266 1.00 0.02 H HETATM 2253 H42 KAR A 58 9.515 19.065 135.593 1.00 0.03 H HETATM 2254 H43 KAR A 58 8.839 18.244 134.146 1.00 0.03 H HETATM 2255 H47 KAR A 58 8.821 21.180 132.546 1.00 0.08 H HETATM 2256 H48 KAR A 58 9.130 19.569 131.814 1.00 0.08 H HETATM 2257 C90 KAR A 58 11.229 20.099 130.489 1.00 -0.02 C HETATM 2258 C89 KAR A 58 12.724 19.728 130.681 1.00 0.04 C HETATM 2259 C7 KAR A 58 13.924 20.673 130.591 1.00 0.01 C HETATM 2260 C3 KAR A 58 14.507 20.813 129.210 1.00 0.03 C HETATM 2261 C4 KAR A 58 15.550 21.699 129.381 1.00 0.08 C HETATM 2262 C5 KAR A 58 16.364 22.093 128.313 1.00 -0.03 C HETATM 2263 C6 KAR A 58 16.080 21.540 127.055 1.00 -0.06 C HETATM 2264 C1 KAR A 58 15.021 20.637 126.878 1.00 -0.06 C HETATM 2265 C2 KAR A 58 14.215 20.258 127.960 1.00 -0.05 C HETATM 2266 H56 KAR A 58 13.395 19.560 127.833 1.00 0.07 H HETATM 2267 H57 KAR A 58 14.824 20.228 125.894 1.00 0.06 H HETATM 2268 H58 KAR A 58 16.691 21.816 126.203 1.00 0.07 H HETATM 2269 H54 KAR A 58 17.178 22.795 128.452 1.00 0.06 H HETATM 2270 N9 KAR A 58 15.601 22.065 130.674 1.00 -0.28 N HETATM 2271 C8 KAR A 58 14.653 21.486 131.393 1.00 0.02 C HETATM 2272 H55 KAR A 58 16.297 22.720 131.060 1.00 0.22 H HETATM 2273 H52 KAR A 58 12.921 18.947 129.932 1.00 0.06 H HETATM 2274 H53 KAR A 58 12.781 19.292 131.689 1.00 0.06 H HETATM 2275 H50 KAR A 58 11.126 20.588 129.509 1.00 0.09 H HETATM 2276 H51 KAR A 58 10.646 19.166 130.496 1.00 0.09 H HETATM 2277 H49 KAR A 58 10.081 21.560 130.895 1.00 0.20 H HETATM 2278 H37 KAR A 58 12.326 22.282 131.477 1.00 0.08 H HETATM 2279 H38 KAR A 58 10.817 23.011 132.122 1.00 0.08 H HETATM 2280 H36 KAR A 58 12.069 22.840 134.026 1.00 0.03 H HETATM 2281 H34 KAR A 58 13.617 21.145 134.728 1.00 0.01 H HETATM 2282 H35 KAR A 58 13.220 20.133 133.299 1.00 0.01 H CONECT 1 2 17 18 19 CONECT 17 1 CONECT 18 1 CONECT 19 1 CONECT 287 286 2109 CONECT 321 320 2109 CONECT 340 339 2109 CONECT 356 355 2109 CONECT 819 818 2112 CONECT 841 840 2112 CONECT 860 859 2112 CONECT 878 877 2112 CONECT 1091 1092 1099 1100 1101 CONECT 1099 1091 CONECT 1100 1091 CONECT 1101 1091 CONECT 1344 1343 2110 CONECT 1371 1370 2110 CONECT 1390 1389 2110 CONECT 1408 1407 2110 CONECT 1824 1823 2111 CONECT 1851 1850 2111 CONECT 1870 1869 2111 CONECT 1886 1885 2111 CONECT 2109 287 321 340 356 CONECT 2110 1344 1371 1390 1408 CONECT 2111 1824 1851 1870 1886 CONECT 2112 819 841 860 878 CONECT 2166 2167 CONECT 2167 2166 2168 2173 CONECT 2168 2167 2169 CONECT 2169 2168 2170 2171 2172 CONECT 2170 2169 CONECT 2171 2169 CONECT 2172 2169 CONECT 2173 2167 2174 2237 2271 CONECT 2174 2173 2175 2179 CONECT 2175 2174 2176 2236 CONECT 2176 2175 2177 2192 CONECT 2177 2176 2178 2186 CONECT 2178 2177 2179 2185 CONECT 2179 2174 2178 2180 CONECT 2180 2179 2181 CONECT 2181 2180 2182 2183 2184 CONECT 2182 2181 CONECT 2183 2181 CONECT 2184 2181 CONECT 2185 2178 CONECT 2186 2177 2187 2191 CONECT 2187 2186 2188 2189 2190 CONECT 2188 2187 CONECT 2189 2187 CONECT 2190 2187 CONECT 2191 2186 2192 2213 2235 CONECT 2192 2176 2191 2193 2196 CONECT 2193 2192 2194 2233 2234 CONECT 2194 2193 2195 2231 2232 CONECT 2195 2194 2196 2200 2230 CONECT 2196 2192 2195 2197 2229 CONECT 2197 2196 2198 2205 2212 CONECT 2198 2197 2199 2204 CONECT 2199 2198 2200 2203 CONECT 2200 2195 2199 2201 2202 CONECT 2201 2200 CONECT 2202 2200 CONECT 2203 2199 CONECT 2204 2198 CONECT 2205 2197 2206 2210 2211 CONECT 2206 2205 2207 2208 2209 CONECT 2207 2206 CONECT 2208 2206 CONECT 2209 2206 CONECT 2210 2205 CONECT 2211 2205 CONECT 2212 2197 2213 2227 2228 CONECT 2213 2191 2212 2214 2218 CONECT 2214 2213 2215 2216 CONECT 2215 2214 CONECT 2216 2214 2217 2220 CONECT 2217 2216 2218 2219 CONECT 2218 2213 2217 CONECT 2219 2217 CONECT 2220 2216 2221 2225 2226 CONECT 2221 2220 2222 2223 2224 CONECT 2222 2221 CONECT 2223 2221 CONECT 2224 2221 CONECT 2225 2220 CONECT 2226 2220 CONECT 2227 2212 CONECT 2228 2212 CONECT 2229 2196 CONECT 2230 2195 CONECT 2231 2194 CONECT 2232 2194 CONECT 2233 2193 CONECT 2234 2193 CONECT 2235 2191 CONECT 2236 2175 CONECT 2237 2173 2238 2281 2282 CONECT 2238 2237 2239 2243 2280 CONECT 2239 2238 2240 2278 2279 CONECT 2240 2239 2241 2257 2277 CONECT 2241 2240 2242 2255 2256 CONECT 2242 2241 2243 2246 2248 CONECT 2243 2238 2242 2244 2245 CONECT 2244 2243 CONECT 2245 2243 CONECT 2246 2242 2247 CONECT 2247 2246 CONECT 2248 2242 2249 2253 2254 CONECT 2249 2248 2250 2251 2252 CONECT 2250 2249 CONECT 2251 2249 CONECT 2252 2249 CONECT 2253 2248 CONECT 2254 2248 CONECT 2255 2241 CONECT 2256 2241 CONECT 2257 2240 2258 2275 2276 CONECT 2258 2257 2259 2273 2274 CONECT 2259 2258 2260 2271 CONECT 2260 2259 2261 2265 CONECT 2261 2260 2262 2270 CONECT 2262 2261 2263 2269 CONECT 2263 2262 2264 2268 CONECT 2264 2263 2265 2267 CONECT 2265 2260 2264 2266 CONECT 2266 2265 CONECT 2267 2264 CONECT 2268 2263 CONECT 2269 2262 CONECT 2270 2261 2271 2272 CONECT 2271 2173 2259 2270 CONECT 2272 2270 CONECT 2273 2258 CONECT 2274 2258 CONECT 2275 2257 CONECT 2276 2257 CONECT 2277 2240 CONECT 2278 2239 CONECT 2279 2239 CONECT 2280 2238 CONECT 2281 2237 CONECT 2282 2237 MASTER 0 0 0 0 0 0 0 0 2280 2 145 12 END
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Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
1xa5
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
calmodulin
Ligand Name
KAR
EC.Number
E.C.-.-.-.-
Resolution
2.12(Å)
Affinity (Kd/Ki/IC50)
Kd=316nM
Release Year
2004
Protein/NA Sequence
Check fasta file
Primary Reference
J.Biol.Chem. v280 pp. 8266-74, 2005
Ligand Properties
Formula
C
4
6
H
5
8
ClN
5
O
7
Molecular Weight
828.435
Exact Mass
827.402
No. of atoms
117
No. of bonds
126
Polar Surface Area
130.28
LOGP Value
5.99 (
Computed with XLOGP3
)
5.81 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 4
No. of Hydrogen Bond Acceptors: 4
No. of Rotatable Bonds: 9
No. of Nitrogen and Oxygen Atoms: 12
No. of Rings: 10
Canonical SMILES
ClCCN1C(=O)O[C@]2(C1=O)C[C@]1(CC)C=CC[N@@H+]3[C@@H]1[C@@]1([C@H]2N(C)c2c1cc(c(c2)OC)[C@]1(C[C@H]2C[N@@H+](CCc4c1[nH]c1c4cccc1)C[C@](C2)(O)CC)C(=O)OC)CC3
InChI String
InChI=1S/C46H56ClN5O7/c1-6-42-14-10-17-51-19-15-44(37(42)51)31-21-32(35(57-4)22-34(31)49(3)38(44)46(26-42)39(53)52(20-16-47)41(55)59-46)45(40(54)58-5)24-28-23-43(56,7-2)27-50(25-28)18-13-30-29-11-8-9-12-33(29)48-36(30)45/h8-12,14,21-22,28,37-38,48,56H,6-7,13,15-20,23-27H2,1-5H3/p+2/t28-,37-,38+,42-,43-,44+,45-,46+/m0/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
P62157
Entrez Gene ID
NCBI Entrez Gene ID:
100297344
520277
617095
ASD
Information of known allosteric effects of PDB entries
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