Browse entries in the PDBbind-CN Database
HEADER 5GGO_COMPLEX COMPND 5GGO_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 153 ARG VAL LEU ASP VAL GLU VAL TYR SER SER ARG SER LYS SEQRES 2 A 153 VAL TYR VAL ALA VAL ASP GLY THR THR VAL LEU GLU ASP SEQRES 3 A 153 GLU ALA ARG GLU GLN GLY ARG GLY ILE HIS VAL ILE VAL SEQRES 4 A 153 LEU ASN GLN ALA THR GLY HIS VAL MET ALA LYS ARG VAL SEQRES 5 A 153 PHE ASP THR TYR SER PRO HIS GLU ASP GLU ALA MET VAL SEQRES 6 A 153 LEU PHE LEU ASN MET VAL ALA PRO GLY ARG VAL LEU ILE SEQRES 7 A 153 CYS THR VAL LYS ASP GLU GLY SER PHE HIS LEU LYS ASP SEQRES 8 A 153 THR ALA LYS ALA LEU LEU ARG SER LEU GLY SER GLN ALA SEQRES 9 A 153 GLY PRO ALA LEU GLY TRP ARG ASP THR TRP ALA PHE VAL SEQRES 10 A 153 GLY ARG LYS GLY GLY PRO VAL PHE GLY GLU LYS HIS SER SEQRES 11 A 153 LYS SER PRO ALA LEU SER SER TRP GLY ASP PRO VAL LEU SEQRES 12 A 153 LEU LYS THR ASP VAL PRO LEU SER SER ALA HET LEC A 340 69 ATOM 1 N ARG A 97 95.922 116.152 114.160 1.00 39.46 N ATOM 2 CA ARG A 97 95.095 115.461 113.169 1.00 19.91 C ATOM 3 C ARG A 97 95.215 113.937 113.332 1.00 16.06 C ATOM 4 O ARG A 97 94.855 113.139 112.432 1.00 17.43 O ATOM 5 CB ARG A 97 95.482 115.898 111.769 1.00 37.52 C ATOM 6 HN3 ARG A 97 96.917 115.876 114.033 1.00 0.00 H ATOM 7 HN2 ARG A 97 95.608 115.889 115.116 1.00 0.00 H ATOM 8 HN1 ARG A 97 95.827 117.180 114.033 1.00 0.00 H ATOM 9 N VAL A 98 95.708 113.534 114.513 1.00 16.91 N ATOM 10 CA VAL A 98 95.809 112.120 114.839 1.00 14.91 C ATOM 11 C VAL A 98 95.484 111.896 116.288 1.00 16.50 C ATOM 12 O VAL A 98 95.569 112.818 117.086 1.00 16.45 O ATOM 13 CB VAL A 98 97.218 111.535 114.580 1.00 25.10 C ATOM 14 CG1 VAL A 98 97.378 111.123 113.148 1.00 34.39 C ATOM 15 CG2 VAL A 98 98.260 112.524 114.972 1.00 28.23 C ATOM 16 H VAL A 98 96.023 114.243 115.206 1.00 0.00 H ATOM 17 N LEU A 99 95.085 110.675 116.600 1.00 14.62 N ATOM 18 CA LEU A 99 94.932 110.164 117.980 1.00 14.76 C ATOM 19 C LEU A 99 96.005 109.151 118.242 1.00 17.11 C ATOM 20 O LEU A 99 96.227 108.235 117.433 1.00 16.49 O ATOM 21 CB LEU A 99 93.594 109.462 118.205 1.00 16.44 C ATOM 22 CG LEU A 99 92.318 110.226 118.040 1.00 21.63 C ATOM 23 CD1 LEU A 99 91.150 109.208 118.114 1.00 20.27 C ATOM 24 CD2 LEU A 99 92.135 111.315 119.108 1.00 20.56 C ATOM 25 H LEU A 99 94.862 110.026 115.818 1.00 0.00 H ATOM 26 N ASP A 100 96.642 109.240 119.401 1.00 15.53 N ATOM 27 CA ASP A 100 97.590 108.239 119.824 1.00 17.62 C ATOM 28 C ASP A 100 96.851 107.210 120.645 1.00 17.17 C ATOM 29 O ASP A 100 96.473 107.474 121.776 1.00 18.38 O ATOM 30 CB ASP A 100 98.713 108.947 120.625 1.00 18.65 C ATOM 31 CG ASP A 100 99.674 107.995 121.308 1.00 29.01 C ATOM 32 OD1 ASP A 100 99.794 106.813 120.932 1.00 28.00 O ATOM 33 OD2 ASP A 100 100.331 108.462 122.263 1.00 39.92 O ATOM 34 H ASP A 100 96.453 110.053 120.022 1.00 0.00 H ATOM 35 N VAL A 101 96.596 106.038 120.083 1.00 16.01 N ATOM 36 CA VAL A 101 95.756 105.040 120.744 1.00 16.12 C ATOM 37 C VAL A 101 96.603 103.865 121.198 1.00 16.11 C ATOM 38 O VAL A 101 97.397 103.329 120.411 1.00 17.15 O ATOM 39 CB VAL A 101 94.640 104.546 119.790 1.00 15.58 C ATOM 40 CG1 VAL A 101 93.779 103.460 120.459 1.00 16.74 C ATOM 41 CG2 VAL A 101 93.770 105.690 119.392 1.00 17.27 C ATOM 42 H VAL A 101 97.002 105.823 119.150 1.00 0.00 H ATOM 43 N GLU A 102 96.469 103.458 122.471 1.00 14.55 N ATOM 44 CA GLU A 102 97.162 102.311 123.012 1.00 17.54 C ATOM 45 C GLU A 102 96.119 101.323 123.461 1.00 14.61 C ATOM 46 O GLU A 102 95.207 101.701 124.172 1.00 15.55 O ATOM 47 CB GLU A 102 98.028 102.744 124.209 1.00 21.83 C ATOM 48 CG GLU A 102 99.071 101.824 124.683 1.00 30.68 C ATOM 49 CD GLU A 102 100.018 102.550 125.645 1.00 31.57 C ATOM 50 OE1 GLU A 102 100.172 102.107 126.813 1.00 41.64 O ATOM 51 OE2 GLU A 102 100.610 103.555 125.216 1.00 34.76 O ATOM 52 H GLU A 102 95.836 103.994 123.098 1.00 0.00 H ATOM 53 N VAL A 103 96.274 100.058 123.078 1.00 14.61 N ATOM 54 CA VAL A 103 95.298 99.023 123.427 1.00 15.60 C ATOM 55 C VAL A 103 96.041 97.808 123.990 1.00 17.01 C ATOM 56 O VAL A 103 96.911 97.257 123.336 1.00 19.07 O ATOM 57 CB VAL A 103 94.479 98.624 122.180 1.00 16.81 C ATOM 58 CG1 VAL A 103 93.350 97.610 122.534 1.00 15.25 C ATOM 59 CG2 VAL A 103 93.846 99.829 121.539 1.00 15.03 C ATOM 60 H VAL A 103 97.110 99.798 122.516 1.00 0.00 H ATOM 61 N TYR A 104 95.660 97.363 125.184 1.00 13.99 N ATOM 62 CA TYR A 104 96.333 96.244 125.845 1.00 14.91 C ATOM 63 C TYR A 104 95.357 95.102 126.133 1.00 14.96 C ATOM 64 O TYR A 104 94.269 95.340 126.694 1.00 15.05 O ATOM 65 CB TYR A 104 96.928 96.748 127.166 1.00 16.88 C ATOM 66 CG TYR A 104 97.761 95.755 127.948 1.00 19.52 C ATOM 67 CD1 TYR A 104 99.100 95.526 127.641 1.00 21.68 C ATOM 68 CD2 TYR A 104 97.203 95.070 129.021 1.00 15.56 C ATOM 69 CE1 TYR A 104 99.881 94.624 128.404 1.00 22.87 C ATOM 70 CE2 TYR A 104 97.959 94.188 129.789 1.00 18.45 C ATOM 71 CZ TYR A 104 99.281 93.960 129.469 1.00 20.03 C ATOM 72 OH TYR A 104 100.024 93.095 130.257 1.00 23.95 O ATOM 73 HH TYR A 104 100.946 93.037 129.902 1.00 0.00 H ATOM 74 H TYR A 104 94.860 97.824 125.662 1.00 0.00 H ATOM 75 N SER A 105 95.761 93.890 125.775 1.00 14.33 N ATOM 76 CA SER A 105 94.942 92.683 125.912 1.00 12.39 C ATOM 77 C SER A 105 95.806 91.663 126.647 1.00 16.97 C ATOM 78 O SER A 105 96.924 91.425 126.218 1.00 17.48 O ATOM 79 CB SER A 105 94.511 92.146 124.534 1.00 16.46 C ATOM 80 OG SER A 105 93.846 90.885 124.687 1.00 17.02 O ATOM 81 HG SER A 105 93.045 91.003 125.257 1.00 0.00 H ATOM 82 H SER A 105 96.715 93.791 125.373 1.00 0.00 H ATOM 83 N SER A 106 95.265 91.040 127.700 1.00 15.87 N ATOM 84 CA SER A 106 96.001 89.990 128.419 1.00 17.64 C ATOM 85 C SER A 106 95.080 89.095 129.214 1.00 19.20 C ATOM 86 O SER A 106 93.874 89.353 129.313 1.00 15.84 O ATOM 87 CB SER A 106 97.025 90.666 129.351 1.00 18.49 C ATOM 88 OG SER A 106 96.388 91.201 130.478 1.00 17.50 O ATOM 89 HG SER A 106 95.722 91.874 130.190 1.00 0.00 H ATOM 90 H SER A 106 94.309 91.302 128.015 1.00 0.00 H ATOM 91 N ARG A 107 95.659 88.045 129.840 1.00 18.21 N ATOM 92 CA ARG A 107 94.905 87.206 130.712 1.00 18.73 C ATOM 93 C ARG A 107 94.152 87.949 131.810 1.00 16.01 C ATOM 94 O ARG A 107 92.979 87.665 132.101 1.00 17.09 O ATOM 95 CB ARG A 107 95.869 86.184 131.360 1.00 18.11 C ATOM 96 CG ARG A 107 95.287 85.460 132.554 1.00 24.07 C ATOM 97 CD ARG A 107 96.352 84.558 133.176 1.00 27.77 C ATOM 98 NE ARG A 107 95.793 83.792 134.272 1.00 28.80 N ATOM 99 CZ ARG A 107 96.444 82.823 134.921 1.00 33.12 C ATOM 100 NH1 ARG A 107 97.672 82.498 134.551 1.00 33.58 N ATOM 101 NH2 ARG A 107 95.862 82.182 135.926 1.00 30.85 N ATOM 102 HE ARG A 107 94.822 84.011 134.573 1.00 0.00 H ATOM 103 HH12 ARG A 107 98.184 81.744 135.053 1.00 0.00 H ATOM 104 HH11 ARG A 107 98.125 82.996 133.759 1.00 0.00 H ATOM 105 HH22 ARG A 107 96.374 81.428 136.428 1.00 0.00 H ATOM 106 HH21 ARG A 107 94.894 82.433 136.212 1.00 0.00 H ATOM 107 H ARG A 107 96.668 87.847 129.683 1.00 0.00 H ATOM 108 N SER A 108 94.842 88.882 132.488 1.00 16.48 N ATOM 109 CA SER A 108 94.314 89.440 133.721 1.00 16.39 C ATOM 110 C SER A 108 94.038 90.945 133.655 1.00 16.69 C ATOM 111 O SER A 108 93.558 91.499 134.635 1.00 19.07 O ATOM 112 CB SER A 108 95.287 89.171 134.854 1.00 21.12 C ATOM 113 OG SER A 108 96.555 89.678 134.487 1.00 32.84 O ATOM 114 HG SER A 108 96.863 89.226 133.662 1.00 0.00 H ATOM 115 H SER A 108 95.762 89.207 132.127 1.00 0.00 H ATOM 116 N LYS A 109 94.283 91.561 132.500 1.00 16.78 N ATOM 117 CA LYS A 109 94.213 93.041 132.412 1.00 18.21 C ATOM 118 C LYS A 109 93.938 93.549 131.011 1.00 13.89 C ATOM 119 O LYS A 109 94.580 93.113 130.096 1.00 15.00 O ATOM 120 CB LYS A 109 95.539 93.658 132.901 1.00 17.01 C ATOM 121 CG LYS A 109 95.599 95.228 132.815 1.00 16.65 C ATOM 122 CD LYS A 109 96.999 95.688 133.343 1.00 20.45 C ATOM 123 CE LYS A 109 97.070 97.207 133.451 1.00 22.63 C ATOM 124 NZ LYS A 109 98.444 97.643 133.877 1.00 26.35 N ATOM 125 HZ1 LYS A 109 98.666 97.228 134.804 1.00 0.00 H ATOM 126 HZ2 LYS A 109 99.141 97.321 133.176 1.00 0.00 H ATOM 127 HZ3 LYS A 109 98.472 98.680 133.945 1.00 0.00 H ATOM 128 H LYS A 109 94.524 91.003 131.656 1.00 0.00 H ATOM 129 N VAL A 110 92.996 94.487 130.905 1.00 14.53 N ATOM 130 CA VAL A 110 92.896 95.273 129.698 1.00 16.16 C ATOM 131 C VAL A 110 93.002 96.752 130.049 1.00 13.64 C ATOM 132 O VAL A 110 92.592 97.199 131.121 1.00 15.88 O ATOM 133 CB VAL A 110 91.565 95.033 128.944 1.00 13.33 C ATOM 134 CG1 VAL A 110 91.571 93.620 128.277 1.00 15.92 C ATOM 135 CG2 VAL A 110 90.343 95.262 129.829 1.00 15.32 C ATOM 136 H VAL A 110 92.335 94.652 131.690 1.00 0.00 H ATOM 137 N TYR A 111 93.470 97.504 129.052 1.00 14.85 N ATOM 138 CA TYR A 111 93.265 98.949 129.061 1.00 12.29 C ATOM 139 C TYR A 111 93.349 99.557 127.677 1.00 14.60 C ATOM 140 O TYR A 111 93.874 98.954 126.744 1.00 15.43 O ATOM 141 CB TYR A 111 94.286 99.681 130.011 1.00 16.84 C ATOM 142 CG TYR A 111 95.691 99.836 129.497 1.00 17.42 C ATOM 143 CD1 TYR A 111 96.075 100.911 128.687 1.00 21.30 C ATOM 144 CD2 TYR A 111 96.653 98.868 129.813 1.00 20.34 C ATOM 145 CE1 TYR A 111 97.411 101.005 128.196 1.00 23.78 C ATOM 146 CE2 TYR A 111 97.962 98.978 129.372 1.00 22.00 C ATOM 147 CZ TYR A 111 98.318 100.014 128.557 1.00 24.62 C ATOM 148 OH TYR A 111 99.628 100.053 128.143 1.00 33.87 O ATOM 149 HH TYR A 111 99.766 100.842 127.562 1.00 0.00 H ATOM 150 H TYR A 111 93.983 97.059 128.265 1.00 0.00 H ATOM 151 N VAL A 112 92.787 100.768 127.549 1.00 12.55 N ATOM 152 CA VAL A 112 92.828 101.548 126.307 1.00 13.69 C ATOM 153 C VAL A 112 93.193 102.944 126.757 1.00 13.51 C ATOM 154 O VAL A 112 92.559 103.477 127.680 1.00 14.47 O ATOM 155 CB VAL A 112 91.484 101.573 125.542 1.00 13.86 C ATOM 156 CG1 VAL A 112 91.550 102.537 124.339 1.00 13.56 C ATOM 157 CG2 VAL A 112 91.078 100.093 125.111 1.00 13.99 C ATOM 158 H VAL A 112 92.297 101.175 128.372 1.00 0.00 H ATOM 159 N ALA A 113 94.208 103.505 126.104 1.00 14.14 N ATOM 160 CA ALA A 113 94.545 104.934 126.306 1.00 14.80 C ATOM 161 C ALA A 113 94.421 105.697 124.993 1.00 14.86 C ATOM 162 O ALA A 113 94.722 105.164 123.908 1.00 16.50 O ATOM 163 CB ALA A 113 95.961 105.074 126.879 1.00 19.16 C ATOM 164 H ALA A 113 94.772 102.933 125.443 1.00 0.00 H ATOM 165 N VAL A 114 93.975 106.943 125.123 1.00 12.28 N ATOM 166 CA VAL A 114 93.773 107.805 123.963 1.00 11.74 C ATOM 167 C VAL A 114 94.518 109.100 124.292 1.00 15.65 C ATOM 168 O VAL A 114 94.203 109.748 125.293 1.00 16.89 O ATOM 169 CB VAL A 114 92.302 108.069 123.671 1.00 14.75 C ATOM 170 CG1 VAL A 114 92.183 109.065 122.476 1.00 16.42 C ATOM 171 CG2 VAL A 114 91.549 106.765 123.362 1.00 15.89 C ATOM 172 H VAL A 114 93.765 107.311 126.073 1.00 0.00 H ATOM 173 N ASP A 115 95.508 109.433 123.466 1.00 14.54 N ATOM 174 CA ASP A 115 96.347 110.662 123.664 1.00 15.07 C ATOM 175 C ASP A 115 96.944 110.710 125.078 1.00 18.54 C ATOM 176 O ASP A 115 97.043 111.787 125.713 1.00 19.10 O ATOM 177 CB ASP A 115 95.544 111.914 123.369 1.00 18.89 C ATOM 178 CG ASP A 115 95.319 112.116 121.833 1.00 17.78 C ATOM 179 OD1 ASP A 115 96.107 111.502 121.073 1.00 18.28 O ATOM 180 OD2 ASP A 115 94.377 112.868 121.507 1.00 22.44 O ATOM 181 H ASP A 115 95.708 108.818 122.652 1.00 0.00 H ATOM 182 N GLY A 116 97.340 109.546 125.548 1.00 15.96 N ATOM 183 CA GLY A 116 98.044 109.440 126.823 1.00 17.49 C ATOM 184 C GLY A 116 97.160 109.380 128.034 1.00 19.97 C ATOM 185 O GLY A 116 97.685 109.400 129.134 1.00 21.26 O ATOM 186 H GLY A 116 97.147 108.684 125.000 1.00 0.00 H ATOM 187 N THR A 117 95.858 109.262 127.853 1.00 16.03 N ATOM 188 CA THR A 117 94.885 109.239 128.954 1.00 15.85 C ATOM 189 C THR A 117 94.201 107.875 128.939 1.00 16.37 C ATOM 190 O THR A 117 93.713 107.443 127.895 1.00 15.31 O ATOM 191 CB THR A 117 93.778 110.341 128.767 1.00 14.82 C ATOM 192 OG1 THR A 117 94.372 111.626 128.781 1.00 22.66 O ATOM 193 CG2 THR A 117 92.797 110.280 129.797 1.00 22.66 C ATOM 194 HG1 THR A 117 93.670 112.314 128.663 1.00 0.00 H ATOM 195 H THR A 117 95.502 109.181 126.879 1.00 0.00 H ATOM 196 N THR A 118 94.128 107.188 130.076 1.00 12.09 N ATOM 197 CA THR A 118 93.468 105.881 130.102 1.00 12.45 C ATOM 198 C THR A 118 91.961 106.056 130.167 1.00 13.94 C ATOM 199 O THR A 118 91.451 106.644 131.107 1.00 15.63 O ATOM 200 CB THR A 118 93.970 105.080 131.317 1.00 14.65 C ATOM 201 OG1 THR A 118 95.385 104.911 131.180 1.00 16.37 O ATOM 202 CG2 THR A 118 93.273 103.706 131.385 1.00 16.69 C ATOM 203 HG1 THR A 118 95.731 104.397 131.952 1.00 0.00 H ATOM 204 H THR A 118 94.540 107.579 130.947 1.00 0.00 H ATOM 205 N VAL A 119 91.245 105.532 129.151 1.00 13.75 N ATOM 206 CA VAL A 119 89.806 105.666 129.077 1.00 13.38 C ATOM 207 C VAL A 119 89.089 104.371 129.400 1.00 14.82 C ATOM 208 O VAL A 119 87.880 104.368 129.581 1.00 18.54 O ATOM 209 CB VAL A 119 89.345 106.150 127.688 1.00 13.67 C ATOM 210 CG1 VAL A 119 89.965 107.512 127.388 1.00 15.75 C ATOM 211 CG2 VAL A 119 89.730 105.170 126.585 1.00 18.91 C ATOM 212 H VAL A 119 91.742 105.016 128.398 1.00 0.00 H ATOM 213 N LEU A 120 89.855 103.298 129.509 1.00 14.08 N ATOM 214 CA LEU A 120 89.285 102.028 129.919 1.00 15.11 C ATOM 215 C LEU A 120 90.381 101.285 130.654 1.00 14.08 C ATOM 216 O LEU A 120 91.499 101.204 130.164 1.00 14.31 O ATOM 217 CB LEU A 120 88.825 101.220 128.697 1.00 16.42 C ATOM 218 CG LEU A 120 88.171 99.866 128.907 1.00 17.92 C ATOM 219 CD1 LEU A 120 87.281 99.623 127.692 1.00 28.26 C ATOM 220 CD2 LEU A 120 89.186 98.736 129.010 1.00 19.15 C ATOM 221 H LEU A 120 90.872 103.365 129.300 1.00 0.00 H ATOM 222 N GLU A 121 90.058 100.719 131.816 1.00 14.56 N ATOM 223 CA GLU A 121 91.027 99.887 132.515 1.00 18.05 C ATOM 224 C GLU A 121 90.273 98.847 133.342 1.00 15.77 C ATOM 225 O GLU A 121 89.338 99.168 134.089 1.00 16.78 O ATOM 226 CB GLU A 121 91.989 100.752 133.407 1.00 14.73 C ATOM 227 CG GLU A 121 93.018 99.831 134.138 1.00 25.53 C ATOM 228 CD GLU A 121 94.352 100.458 134.632 1.00 31.50 C ATOM 229 OE1 GLU A 121 94.489 101.700 134.531 1.00 20.43 O ATOM 230 OE2 GLU A 121 95.255 99.672 135.132 1.00 24.93 O ATOM 231 H GLU A 121 89.114 100.871 132.224 1.00 0.00 H ATOM 232 N ASP A 122 90.671 97.588 133.182 1.00 15.17 N ATOM 233 CA ASP A 122 90.076 96.543 134.009 1.00 16.59 C ATOM 234 C ASP A 122 91.129 95.527 134.359 1.00 15.99 C ATOM 235 O ASP A 122 91.575 94.760 133.509 1.00 17.04 O ATOM 236 CB ASP A 122 88.874 95.882 133.284 1.00 17.32 C ATOM 237 CG ASP A 122 88.102 94.923 134.179 1.00 21.01 C ATOM 238 OD1 ASP A 122 88.704 94.323 135.077 1.00 23.61 O ATOM 239 OD2 ASP A 122 86.887 94.810 133.958 1.00 22.49 O ATOM 240 H ASP A 122 91.397 97.351 132.476 1.00 0.00 H ATOM 241 N GLU A 123 91.504 95.532 135.650 1.00 17.38 N ATOM 242 CA GLU A 123 92.369 94.481 136.195 1.00 25.38 C ATOM 243 C GLU A 123 91.692 93.822 137.392 1.00 23.33 C ATOM 244 O GLU A 123 92.351 93.309 138.301 1.00 30.61 O ATOM 245 CB GLU A 123 93.739 95.047 136.599 1.00 26.63 C ATOM 246 CG GLU A 123 94.785 93.939 136.882 1.00 26.54 C ATOM 247 CD GLU A 123 96.194 94.460 136.987 1.00 38.29 C ATOM 248 OE1 GLU A 123 97.117 93.614 137.096 1.00 38.94 O ATOM 249 OE2 GLU A 123 96.379 95.701 136.940 1.00 29.55 O ATOM 250 H GLU A 123 91.174 96.296 136.274 1.00 0.00 H ATOM 251 N ALA A 124 90.376 93.859 137.435 1.00 23.81 N ATOM 252 CA ALA A 124 89.671 93.220 138.545 1.00 30.84 C ATOM 253 C ALA A 124 89.818 91.695 138.453 1.00 43.52 C ATOM 254 O ALA A 124 89.801 91.124 137.360 1.00 40.84 O ATOM 255 CB ALA A 124 88.206 93.623 138.562 1.00 34.22 C ATOM 256 H ALA A 124 89.842 94.340 136.684 1.00 0.00 H ATOM 257 N ARG A 125 89.967 91.038 139.604 1.00 42.80 N ATOM 258 CA ARG A 125 90.319 89.620 139.633 1.00 40.89 C ATOM 259 C ARG A 125 89.210 88.704 139.156 1.00 36.50 C ATOM 260 O ARG A 125 89.484 87.674 138.543 1.00 43.53 O ATOM 261 CB ARG A 125 90.735 89.211 141.050 1.00 38.99 C ATOM 262 H ARG A 125 89.830 91.546 140.501 1.00 0.00 H ATOM 263 N GLU A 126 87.960 89.067 139.420 1.00 38.95 N ATOM 264 CA GLU A 126 86.849 88.156 139.157 1.00 46.57 C ATOM 265 C GLU A 126 85.723 88.760 138.313 1.00 48.11 C ATOM 266 O GLU A 126 84.581 88.299 138.375 1.00 42.43 O ATOM 267 CB GLU A 126 86.274 87.634 140.487 1.00 55.18 C ATOM 268 H GLU A 126 87.770 90.009 139.818 1.00 0.00 H ATOM 269 N GLN A 127 86.040 89.766 137.499 1.00 36.98 N ATOM 270 CA GLN A 127 85.050 90.317 136.590 1.00 34.00 C ATOM 271 C GLN A 127 85.740 90.768 135.291 1.00 24.88 C ATOM 272 O GLN A 127 86.960 90.670 135.162 1.00 27.24 O ATOM 273 CB GLN A 127 84.301 91.488 137.239 1.00 38.21 C ATOM 274 H GLN A 127 87.003 90.159 137.515 1.00 0.00 H ATOM 275 N GLY A 128 84.949 91.222 134.325 1.00 22.44 N ATOM 276 CA GLY A 128 85.510 91.848 133.148 1.00 19.58 C ATOM 277 C GLY A 128 85.990 90.906 132.075 1.00 19.06 C ATOM 278 O GLY A 128 86.664 91.315 131.146 1.00 17.55 O ATOM 279 H GLY A 128 83.917 91.126 134.416 1.00 0.00 H ATOM 280 N ARG A 129 85.623 89.633 132.152 1.00 16.95 N ATOM 281 CA ARG A 129 86.085 88.708 131.116 1.00 15.36 C ATOM 282 C ARG A 129 85.441 89.021 129.782 1.00 13.78 C ATOM 283 O ARG A 129 84.258 89.356 129.755 1.00 15.42 O ATOM 284 CB ARG A 129 85.712 87.242 131.500 1.00 16.15 C ATOM 285 CG ARG A 129 86.084 86.165 130.451 1.00 14.74 C ATOM 286 CD ARG A 129 85.770 84.762 131.045 1.00 15.40 C ATOM 287 NE ARG A 129 84.358 84.679 131.380 1.00 15.03 N ATOM 288 CZ ARG A 129 83.822 83.961 132.365 1.00 16.31 C ATOM 289 NH1 ARG A 129 84.584 83.181 133.147 1.00 18.57 N ATOM 290 NH2 ARG A 129 82.521 83.986 132.543 1.00 16.41 N ATOM 291 HE ARG A 129 83.703 85.234 130.793 1.00 0.00 H ATOM 292 HH12 ARG A 129 84.148 82.627 133.912 1.00 0.00 H ATOM 293 HH11 ARG A 129 85.611 83.130 132.988 1.00 0.00 H ATOM 294 HH22 ARG A 129 82.090 83.430 133.309 1.00 0.00 H ATOM 295 HH21 ARG A 129 81.922 84.562 131.918 1.00 0.00 H ATOM 296 H ARG A 129 85.020 89.300 132.931 1.00 0.00 H ATOM 297 N GLY A 130 86.174 88.857 128.685 1.00 13.15 N ATOM 298 CA GLY A 130 85.531 88.918 127.368 1.00 13.61 C ATOM 299 C GLY A 130 86.131 89.983 126.486 1.00 13.60 C ATOM 300 O GLY A 130 87.313 90.325 126.611 1.00 14.76 O ATOM 301 H GLY A 130 87.197 88.686 128.760 1.00 0.00 H ATOM 302 N ILE A 131 85.311 90.485 125.562 1.00 11.89 N ATOM 303 CA ILE A 131 85.756 91.491 124.572 1.00 11.92 C ATOM 304 C ILE A 131 85.251 92.845 125.066 1.00 12.07 C ATOM 305 O ILE A 131 84.047 93.081 125.191 1.00 12.90 O ATOM 306 CB ILE A 131 85.203 91.161 123.190 1.00 12.49 C ATOM 307 CG1 ILE A 131 85.707 89.779 122.701 1.00 14.78 C ATOM 308 CG2 ILE A 131 85.666 92.240 122.198 1.00 14.73 C ATOM 309 CD1 ILE A 131 85.069 89.371 121.348 1.00 14.54 C ATOM 310 H ILE A 131 84.324 90.158 125.536 1.00 0.00 H ATOM 311 N HIS A 132 86.200 93.743 125.348 1.00 11.09 N ATOM 312 CA HIS A 132 85.931 95.123 125.722 1.00 11.46 C ATOM 313 C HIS A 132 85.859 95.937 124.458 1.00 15.78 C ATOM 314 O HIS A 132 86.712 95.774 123.610 1.00 15.12 O ATOM 315 CB HIS A 132 87.031 95.646 126.624 1.00 12.72 C ATOM 316 CG HIS A 132 87.018 94.987 127.956 1.00 11.80 C ATOM 317 ND1 HIS A 132 86.614 95.627 129.111 1.00 15.07 N ATOM 318 CD2 HIS A 132 87.255 93.692 128.301 1.00 15.13 C ATOM 319 CE1 HIS A 132 86.665 94.767 130.117 1.00 14.86 C ATOM 320 NE2 HIS A 132 87.067 93.595 129.655 1.00 14.40 N ATOM 321 H HIS A 132 87.192 93.436 125.297 1.00 0.00 H ATOM 322 N VAL A 133 84.834 96.779 124.318 1.00 12.47 N ATOM 323 CA VAL A 133 84.640 97.538 123.085 1.00 13.16 C ATOM 324 C VAL A 133 84.530 98.987 123.457 1.00 14.28 C ATOM 325 O VAL A 133 83.781 99.357 124.344 1.00 14.67 O ATOM 326 CB VAL A 133 83.366 97.111 122.334 1.00 14.72 C ATOM 327 CG1 VAL A 133 83.192 97.966 121.017 1.00 13.57 C ATOM 328 CG2 VAL A 133 83.384 95.591 122.017 1.00 14.56 C ATOM 329 H VAL A 133 84.160 96.897 125.101 1.00 0.00 H ATOM 330 N ILE A 134 85.342 99.825 122.824 1.00 11.87 N ATOM 331 CA ILE A 134 85.169 101.267 123.025 1.00 12.05 C ATOM 332 C ILE A 134 84.987 101.942 121.656 1.00 11.26 C ATOM 333 O ILE A 134 85.621 101.543 120.695 1.00 12.88 O ATOM 334 CB ILE A 134 86.340 101.845 123.803 1.00 17.78 C ATOM 335 CG1 ILE A 134 86.297 103.365 123.795 1.00 22.38 C ATOM 336 CG2 ILE A 134 87.599 101.476 123.247 1.00 26.78 C ATOM 337 CD1 ILE A 134 86.811 103.890 125.140 1.00 36.87 C ATOM 338 H ILE A 134 86.088 99.465 122.196 1.00 0.00 H ATOM 339 N VAL A 135 84.071 102.925 121.609 1.00 10.71 N ATOM 340 CA VAL A 135 83.717 103.628 120.362 1.00 11.79 C ATOM 341 C VAL A 135 84.103 105.084 120.545 1.00 11.81 C ATOM 342 O VAL A 135 83.703 105.686 121.532 1.00 11.69 O ATOM 343 CB VAL A 135 82.227 103.544 120.077 1.00 13.31 C ATOM 344 CG1 VAL A 135 81.899 104.277 118.792 1.00 13.26 C ATOM 345 CG2 VAL A 135 81.816 102.082 119.961 1.00 12.93 C ATOM 346 H VAL A 135 83.592 103.201 122.490 1.00 0.00 H ATOM 347 N LEU A 136 84.914 105.640 119.645 1.00 10.43 N ATOM 348 CA LEU A 136 85.317 107.030 119.739 1.00 11.56 C ATOM 349 C LEU A 136 84.719 107.881 118.624 1.00 12.08 C ATOM 350 O LEU A 136 84.587 107.382 117.506 1.00 12.83 O ATOM 351 CB LEU A 136 86.841 107.190 119.641 1.00 14.70 C ATOM 352 CG LEU A 136 87.689 106.334 120.559 1.00 12.76 C ATOM 353 CD1 LEU A 136 89.157 106.762 120.270 1.00 13.51 C ATOM 354 CD2 LEU A 136 87.301 106.547 122.002 1.00 15.12 C ATOM 355 H LEU A 136 85.267 105.062 118.855 1.00 0.00 H ATOM 356 N ASN A 137 84.442 109.138 118.935 1.00 11.67 N ATOM 357 CA ASN A 137 84.125 110.118 117.893 1.00 11.63 C ATOM 358 C ASN A 137 85.363 110.344 116.989 1.00 13.40 C ATOM 359 O ASN A 137 86.478 110.485 117.451 1.00 12.97 O ATOM 360 CB ASN A 137 83.677 111.427 118.542 1.00 12.57 C ATOM 361 CG ASN A 137 83.363 112.484 117.507 1.00 13.24 C ATOM 362 OD1 ASN A 137 84.274 113.044 116.929 1.00 14.62 O ATOM 363 ND2 ASN A 137 82.072 112.746 117.270 1.00 13.66 N ATOM 364 HD22 ASN A 137 81.333 112.236 117.795 1.00 0.00 H ATOM 365 HD21 ASN A 137 81.808 113.460 116.561 1.00 0.00 H ATOM 366 H ASN A 137 84.450 109.434 119.932 1.00 0.00 H ATOM 367 N GLN A 138 85.135 110.332 115.696 1.00 12.84 N ATOM 368 CA GLN A 138 86.252 110.238 114.747 1.00 11.79 C ATOM 369 C GLN A 138 86.894 111.591 114.502 1.00 15.31 C ATOM 370 O GLN A 138 87.933 111.645 113.815 1.00 17.51 O ATOM 371 CB GLN A 138 85.773 109.614 113.421 1.00 17.64 C ATOM 372 CG GLN A 138 84.627 110.334 112.718 1.00 15.78 C ATOM 373 CD GLN A 138 83.219 109.869 113.123 1.00 17.04 C ATOM 374 OE1 GLN A 138 82.942 109.647 114.310 1.00 15.28 O ATOM 375 NE2 GLN A 138 82.318 109.742 112.142 1.00 19.63 N ATOM 376 HE22 GLN A 138 82.590 109.938 111.158 1.00 0.00 H ATOM 377 HE21 GLN A 138 81.346 109.448 112.364 1.00 0.00 H ATOM 378 H GLN A 138 84.159 110.389 115.342 1.00 0.00 H ATOM 379 N ALA A 139 86.312 112.658 115.040 1.00 13.80 N ATOM 380 CA ALA A 139 86.912 114.007 114.941 1.00 14.92 C ATOM 381 C ALA A 139 87.571 114.451 116.218 1.00 17.77 C ATOM 382 O ALA A 139 88.577 115.186 116.171 1.00 20.81 O ATOM 383 CB ALA A 139 85.853 115.054 114.508 1.00 14.67 C ATOM 384 H ALA A 139 85.410 112.542 115.544 1.00 0.00 H ATOM 385 N THR A 140 87.030 114.063 117.381 1.00 13.24 N ATOM 386 CA THR A 140 87.547 114.568 118.623 1.00 13.72 C ATOM 387 C THR A 140 88.237 113.512 119.465 1.00 14.83 C ATOM 388 O THR A 140 88.987 113.828 120.385 1.00 17.45 O ATOM 389 CB THR A 140 86.439 115.161 119.470 1.00 15.67 C ATOM 390 OG1 THR A 140 85.484 114.109 119.716 1.00 15.15 O ATOM 391 CG2 THR A 140 85.743 116.260 118.734 1.00 18.79 C ATOM 392 HG1 THR A 140 85.127 113.781 118.853 1.00 0.00 H ATOM 393 H THR A 140 86.233 113.394 117.385 1.00 0.00 H ATOM 394 N GLY A 141 87.926 112.258 119.198 1.00 14.14 N ATOM 395 CA GLY A 141 88.419 111.198 120.063 1.00 13.40 C ATOM 396 C GLY A 141 87.638 110.990 121.360 1.00 14.12 C ATOM 397 O GLY A 141 87.973 110.091 122.147 1.00 15.83 O ATOM 398 H GLY A 141 87.333 112.029 118.375 1.00 0.00 H ATOM 399 N HIS A 142 86.560 111.723 121.551 1.00 15.14 N ATOM 400 CA HIS A 142 85.699 111.541 122.749 1.00 13.69 C ATOM 401 C HIS A 142 85.061 110.134 122.738 1.00 12.96 C ATOM 402 O HIS A 142 84.699 109.592 121.672 1.00 12.88 O ATOM 403 CB HIS A 142 84.612 112.598 122.821 1.00 13.47 C ATOM 404 CG HIS A 142 85.159 113.969 123.090 1.00 17.27 C ATOM 405 ND1 HIS A 142 84.372 115.088 123.228 1.00 26.43 N ATOM 406 CD2 HIS A 142 86.440 114.387 123.241 1.00 23.97 C ATOM 407 CE1 HIS A 142 85.138 116.137 123.481 1.00 18.45 C ATOM 408 NE2 HIS A 142 86.397 115.744 123.471 1.00 21.70 N ATOM 409 H HIS A 142 86.306 112.445 120.847 1.00 0.00 H ATOM 410 N VAL A 143 84.973 109.531 123.928 1.00 12.33 N ATOM 411 CA VAL A 143 84.363 108.206 124.058 1.00 12.01 C ATOM 412 C VAL A 143 82.848 108.290 123.940 1.00 13.18 C ATOM 413 O VAL A 143 82.185 109.006 124.730 1.00 14.47 O ATOM 414 CB VAL A 143 84.738 107.583 125.385 1.00 12.16 C ATOM 415 CG1 VAL A 143 83.988 106.240 125.513 1.00 12.33 C ATOM 416 CG2 VAL A 143 86.285 107.391 125.435 1.00 15.10 C ATOM 417 H VAL A 143 85.343 110.010 124.774 1.00 0.00 H ATOM 418 N MET A 144 82.328 107.566 122.935 1.00 11.28 N ATOM 419 CA MET A 144 80.880 107.578 122.684 1.00 12.70 C ATOM 420 C MET A 144 80.207 106.418 123.349 1.00 13.34 C ATOM 421 O MET A 144 79.049 106.519 123.691 1.00 14.32 O ATOM 422 CB MET A 144 80.586 107.539 121.185 1.00 12.85 C ATOM 423 CG MET A 144 81.173 108.715 120.399 1.00 13.64 C ATOM 424 SD MET A 144 80.315 110.243 120.775 1.00 16.78 S ATOM 425 CE MET A 144 81.387 111.059 121.972 1.00 19.45 C ATOM 426 H MET A 144 82.953 106.994 122.332 1.00 0.00 H ATOM 427 N ALA A 145 80.938 105.339 123.568 1.00 12.92 N ATOM 428 CA ALA A 145 80.382 104.160 124.222 1.00 10.57 C ATOM 429 C ALA A 145 81.483 103.262 124.711 1.00 13.05 C ATOM 430 O ALA A 145 82.565 103.209 124.096 1.00 11.84 O ATOM 431 CB ALA A 145 79.503 103.364 123.256 1.00 14.32 C ATOM 432 H ALA A 145 81.933 105.330 123.267 1.00 0.00 H ATOM 433 N LYS A 146 81.179 102.496 125.785 1.00 14.40 N ATOM 434 CA LYS A 146 82.083 101.534 126.387 1.00 13.28 C ATOM 435 C LYS A 146 81.237 100.322 126.714 1.00 15.36 C ATOM 436 O LYS A 146 80.184 100.454 127.351 1.00 19.69 O ATOM 437 CB LYS A 146 82.705 102.093 127.658 1.00 19.82 C ATOM 438 CG LYS A 146 83.705 103.137 127.396 1.00 27.57 C ATOM 439 CD LYS A 146 84.323 103.569 128.729 1.00 32.69 C ATOM 440 CE LYS A 146 84.747 102.360 129.524 1.00 35.27 C ATOM 441 NZ LYS A 146 85.375 102.812 130.787 1.00 42.86 N ATOM 442 HZ1 LYS A 146 86.205 103.399 130.569 1.00 0.00 H ATOM 443 HZ2 LYS A 146 84.688 103.370 131.334 1.00 0.00 H ATOM 444 HZ3 LYS A 146 85.671 101.983 131.342 1.00 0.00 H ATOM 445 H LYS A 146 80.235 102.604 126.207 1.00 0.00 H ATOM 446 N ARG A 147 81.655 99.144 126.292 1.00 11.43 N ATOM 447 CA ARG A 147 80.926 97.931 126.615 1.00 14.60 C ATOM 448 C ARG A 147 81.900 96.818 126.933 1.00 12.15 C ATOM 449 O ARG A 147 83.046 96.845 126.493 1.00 14.56 O ATOM 450 CB ARG A 147 80.063 97.473 125.447 1.00 15.41 C ATOM 451 CG ARG A 147 79.024 98.488 125.005 1.00 19.20 C ATOM 452 CD ARG A 147 78.105 98.919 126.156 1.00 23.86 C ATOM 453 NE ARG A 147 77.031 99.826 125.691 1.00 27.97 N ATOM 454 CZ ARG A 147 75.932 99.334 125.145 1.00 20.36 C ATOM 455 NH1 ARG A 147 75.824 98.020 124.993 1.00 21.34 N ATOM 456 NH2 ARG A 147 74.943 100.107 124.711 1.00 21.16 N ATOM 457 HE ARG A 147 77.142 100.855 125.794 1.00 0.00 H ATOM 458 HH12 ARG A 147 74.967 97.615 124.566 1.00 0.00 H ATOM 459 HH11 ARG A 147 76.596 97.396 125.301 1.00 0.00 H ATOM 460 HH22 ARG A 147 74.095 99.678 124.288 1.00 0.00 H ATOM 461 HH21 ARG A 147 75.016 101.141 124.795 1.00 0.00 H ATOM 462 H ARG A 147 82.521 99.083 125.719 1.00 0.00 H ATOM 463 N VAL A 148 81.431 95.781 127.631 1.00 12.54 N ATOM 464 CA VAL A 148 82.169 94.532 127.713 1.00 12.36 C ATOM 465 C VAL A 148 81.165 93.414 127.452 1.00 10.45 C ATOM 466 O VAL A 148 80.029 93.410 127.991 1.00 14.69 O ATOM 467 CB VAL A 148 82.895 94.327 129.085 1.00 16.10 C ATOM 468 CG1 VAL A 148 81.938 94.377 130.211 1.00 16.33 C ATOM 469 CG2 VAL A 148 83.666 92.994 129.090 1.00 16.61 C ATOM 470 H VAL A 148 80.520 95.869 128.125 1.00 0.00 H ATOM 471 N PHE A 149 81.563 92.532 126.555 1.00 11.32 N ATOM 472 CA PHE A 149 80.751 91.348 126.221 1.00 11.38 C ATOM 473 C PHE A 149 81.501 90.076 126.607 1.00 11.70 C ATOM 474 O PHE A 149 82.617 89.833 126.144 1.00 12.04 O ATOM 475 CB PHE A 149 80.432 91.332 124.712 1.00 12.14 C ATOM 476 CG PHE A 149 79.730 92.581 124.261 1.00 12.22 C ATOM 477 CD1 PHE A 149 78.368 92.710 124.439 1.00 13.16 C ATOM 478 CD2 PHE A 149 80.458 93.617 123.700 1.00 12.59 C ATOM 479 CE1 PHE A 149 77.672 93.881 124.046 1.00 14.33 C ATOM 480 CE2 PHE A 149 79.791 94.802 123.305 1.00 12.38 C ATOM 481 CZ PHE A 149 78.381 94.912 123.503 1.00 13.88 C ATOM 482 H PHE A 149 82.472 92.676 126.071 1.00 0.00 H ATOM 483 N ASP A 150 80.908 89.318 127.543 1.00 11.42 N ATOM 484 CA ASP A 150 81.577 88.121 128.047 1.00 12.12 C ATOM 485 C ASP A 150 81.352 86.994 127.048 1.00 12.84 C ATOM 486 O ASP A 150 80.522 86.104 127.278 1.00 11.89 O ATOM 487 CB ASP A 150 81.034 87.733 129.433 1.00 13.18 C ATOM 488 CG ASP A 150 81.666 86.435 129.970 1.00 12.78 C ATOM 489 OD1 ASP A 150 82.745 86.053 129.479 1.00 14.33 O ATOM 490 OD2 ASP A 150 81.036 85.819 130.881 1.00 15.30 O ATOM 491 H ASP A 150 79.972 89.583 127.910 1.00 0.00 H ATOM 492 N THR A 151 82.089 87.044 125.929 1.00 11.80 N ATOM 493 CA THR A 151 81.877 86.076 124.877 1.00 11.59 C ATOM 494 C THR A 151 82.490 84.693 125.193 1.00 12.46 C ATOM 495 O THR A 151 82.463 83.809 124.335 1.00 13.44 O ATOM 496 CB THR A 151 82.426 86.621 123.541 1.00 12.13 C ATOM 497 OG1 THR A 151 83.695 87.220 123.812 1.00 12.20 O ATOM 498 CG2 THR A 151 81.493 87.765 123.053 1.00 13.16 C ATOM 499 HG1 THR A 151 84.307 86.538 124.186 1.00 0.00 H ATOM 500 H THR A 151 82.815 87.781 125.818 1.00 0.00 H ATOM 501 N TYR A 152 82.972 84.484 126.424 1.00 11.60 N ATOM 502 CA TYR A 152 83.198 83.121 126.930 1.00 13.12 C ATOM 503 C TYR A 152 81.866 82.438 127.255 1.00 12.53 C ATOM 504 O TYR A 152 81.832 81.189 127.389 1.00 13.93 O ATOM 505 CB TYR A 152 84.085 83.193 128.202 1.00 12.95 C ATOM 506 CG TYR A 152 84.243 81.877 128.928 1.00 12.96 C ATOM 507 CD1 TYR A 152 85.125 80.927 128.419 1.00 13.75 C ATOM 508 CD2 TYR A 152 83.537 81.599 130.097 1.00 16.93 C ATOM 509 CE1 TYR A 152 85.282 79.683 129.029 1.00 22.31 C ATOM 510 CE2 TYR A 152 83.712 80.342 130.739 1.00 19.41 C ATOM 511 CZ TYR A 152 84.591 79.410 130.159 1.00 22.66 C ATOM 512 OH TYR A 152 84.801 78.139 130.708 1.00 26.83 O ATOM 513 HH TYR A 152 83.943 77.646 130.733 1.00 0.00 H ATOM 514 H TYR A 152 83.190 85.298 127.033 1.00 0.00 H ATOM 515 N SER A 153 80.802 83.232 127.456 1.00 12.46 N ATOM 516 CA SER A 153 79.494 82.751 127.892 1.00 12.19 C ATOM 517 C SER A 153 78.477 82.904 126.738 1.00 12.55 C ATOM 518 O SER A 153 78.558 83.850 125.938 1.00 14.56 O ATOM 519 CB SER A 153 78.976 83.522 129.094 1.00 15.03 C ATOM 520 OG SER A 153 79.886 83.419 130.160 1.00 16.85 O ATOM 521 HG SER A 153 79.997 82.467 130.407 1.00 0.00 H ATOM 522 H SER A 153 80.917 84.252 127.291 1.00 0.00 H ATOM 523 N PRO A 154 77.487 82.010 126.647 1.00 13.59 N ATOM 524 CA PRO A 154 76.489 82.145 125.576 1.00 12.29 C ATOM 525 C PRO A 154 75.726 83.476 125.639 1.00 13.81 C ATOM 526 O PRO A 154 75.491 84.066 126.698 1.00 15.58 O ATOM 527 CB PRO A 154 75.513 80.950 125.813 1.00 13.95 C ATOM 528 CG PRO A 154 76.266 80.011 126.670 1.00 19.19 C ATOM 529 CD PRO A 154 77.211 80.853 127.526 1.00 15.56 C ATOM 530 N HIS A 155 75.320 83.900 124.447 1.00 10.63 N ATOM 531 CA HIS A 155 74.400 85.033 124.192 1.00 12.29 C ATOM 532 C HIS A 155 75.068 86.385 124.175 1.00 12.75 C ATOM 533 O HIS A 155 74.524 87.328 123.608 1.00 14.30 O ATOM 534 CB HIS A 155 73.238 85.091 125.211 1.00 11.79 C ATOM 535 CG HIS A 155 72.383 83.875 125.184 1.00 14.20 C ATOM 536 ND1 HIS A 155 71.553 83.590 124.122 1.00 17.20 N ATOM 537 CD2 HIS A 155 72.288 82.836 126.042 1.00 17.30 C ATOM 538 CE1 HIS A 155 70.953 82.425 124.352 1.00 23.18 C ATOM 539 NE2 HIS A 155 71.390 81.950 125.505 1.00 19.63 N ATOM 540 H HIS A 155 75.681 83.389 123.616 1.00 0.00 H ATOM 541 N GLU A 156 76.270 86.464 124.727 1.00 11.54 N ATOM 542 CA GLU A 156 76.961 87.744 124.745 1.00 11.60 C ATOM 543 C GLU A 156 77.403 88.167 123.329 1.00 11.62 C ATOM 544 O GLU A 156 77.412 89.400 123.016 1.00 13.32 O ATOM 545 CB GLU A 156 78.166 87.659 125.702 1.00 12.16 C ATOM 546 CG GLU A 156 77.686 87.578 127.191 1.00 12.13 C ATOM 547 CD GLU A 156 77.291 88.951 127.692 1.00 17.61 C ATOM 548 OE1 GLU A 156 78.151 89.836 127.793 1.00 16.96 O ATOM 549 OE2 GLU A 156 76.093 89.175 127.929 1.00 28.08 O ATOM 550 H GLU A 156 76.714 85.621 125.143 1.00 0.00 H ATOM 551 N ASP A 157 77.776 87.199 122.496 1.00 11.17 N ATOM 552 CA ASP A 157 78.105 87.563 121.129 1.00 11.70 C ATOM 553 C ASP A 157 76.926 88.147 120.366 1.00 11.62 C ATOM 554 O ASP A 157 77.127 89.026 119.540 1.00 12.08 O ATOM 555 CB ASP A 157 78.706 86.376 120.363 1.00 12.53 C ATOM 556 CG ASP A 157 77.721 85.207 120.159 1.00 11.90 C ATOM 557 OD1 ASP A 157 76.784 85.016 120.974 1.00 12.70 O ATOM 558 OD2 ASP A 157 77.956 84.469 119.168 1.00 13.19 O ATOM 559 H ASP A 157 77.830 86.210 122.814 1.00 0.00 H ATOM 560 N GLU A 158 75.709 87.651 120.628 1.00 12.12 N ATOM 561 CA GLU A 158 74.505 88.224 120.050 1.00 13.96 C ATOM 562 C GLU A 158 74.305 89.667 120.477 1.00 11.60 C ATOM 563 O GLU A 158 73.941 90.523 119.661 1.00 11.93 O ATOM 564 CB GLU A 158 73.287 87.420 120.456 1.00 16.04 C ATOM 565 CG GLU A 158 73.315 86.047 119.979 1.00 17.54 C ATOM 566 CD GLU A 158 72.193 85.216 120.675 1.00 18.77 C ATOM 567 OE1 GLU A 158 71.631 85.525 121.805 1.00 22.29 O ATOM 568 OE2 GLU A 158 71.863 84.259 120.024 1.00 20.02 O ATOM 569 H GLU A 158 75.624 86.832 121.263 1.00 0.00 H ATOM 570 N ALA A 159 74.524 89.952 121.754 1.00 11.91 N ATOM 571 CA ALA A 159 74.457 91.341 122.224 1.00 12.94 C ATOM 572 C ALA A 159 75.520 92.192 121.540 1.00 13.36 C ATOM 573 O ALA A 159 75.232 93.353 121.167 1.00 13.83 O ATOM 574 CB ALA A 159 74.618 91.395 123.708 1.00 13.31 C ATOM 575 H ALA A 159 74.744 89.188 122.425 1.00 0.00 H ATOM 576 N MET A 160 76.714 91.625 121.348 1.00 11.51 N ATOM 577 CA MET A 160 77.798 92.378 120.714 1.00 12.85 C ATOM 578 C MET A 160 77.401 92.740 119.275 1.00 12.95 C ATOM 579 O MET A 160 77.636 93.859 118.795 1.00 12.29 O ATOM 580 CB MET A 160 79.096 91.567 120.738 1.00 12.81 C ATOM 581 CG MET A 160 80.234 92.401 120.235 1.00 12.70 C ATOM 582 SD MET A 160 81.819 91.550 120.469 1.00 17.88 S ATOM 583 CE MET A 160 81.706 90.398 119.175 1.00 19.12 C ATOM 584 H MET A 160 76.875 90.643 121.651 1.00 0.00 H ATOM 585 N VAL A 161 76.796 91.788 118.585 1.00 11.51 N ATOM 586 CA VAL A 161 76.426 92.009 117.179 1.00 12.21 C ATOM 587 C VAL A 161 75.363 93.106 117.093 1.00 13.74 C ATOM 588 O VAL A 161 75.485 94.029 116.295 1.00 14.28 O ATOM 589 CB VAL A 161 75.911 90.695 116.526 1.00 13.11 C ATOM 590 CG1 VAL A 161 75.081 90.979 115.231 1.00 12.29 C ATOM 591 CG2 VAL A 161 77.091 89.781 116.186 1.00 13.30 C ATOM 592 H VAL A 161 76.581 90.878 119.039 1.00 0.00 H ATOM 593 N LEU A 162 74.360 93.036 117.946 1.00 12.81 N ATOM 594 CA LEU A 162 73.331 94.051 117.945 1.00 11.85 C ATOM 595 C LEU A 162 73.917 95.441 118.269 1.00 13.17 C ATOM 596 O LEU A 162 73.518 96.435 117.649 1.00 14.33 O ATOM 597 CB LEU A 162 72.236 93.662 118.950 1.00 13.14 C ATOM 598 CG LEU A 162 71.292 92.589 118.408 1.00 17.06 C ATOM 599 CD1 LEU A 162 70.627 91.804 119.561 1.00 17.50 C ATOM 600 CD2 LEU A 162 70.226 93.207 117.497 1.00 17.70 C ATOM 601 H LEU A 162 74.309 92.247 118.622 1.00 0.00 H ATOM 602 N PHE A 163 74.879 95.514 119.192 1.00 12.24 N ATOM 603 CA PHE A 163 75.508 96.790 119.523 1.00 12.86 C ATOM 604 C PHE A 163 76.365 97.317 118.352 1.00 16.03 C ATOM 605 O PHE A 163 76.219 98.482 117.932 1.00 13.06 O ATOM 606 CB PHE A 163 76.366 96.602 120.783 1.00 13.11 C ATOM 607 CG PHE A 163 77.219 97.793 121.105 1.00 14.83 C ATOM 608 CD1 PHE A 163 76.651 98.926 121.671 1.00 18.58 C ATOM 609 CD2 PHE A 163 78.550 97.808 120.772 1.00 13.99 C ATOM 610 CE1 PHE A 163 77.440 100.028 121.937 1.00 18.20 C ATOM 611 CE2 PHE A 163 79.346 98.915 121.037 1.00 13.96 C ATOM 612 CZ PHE A 163 78.763 100.013 121.615 1.00 15.88 C ATOM 613 H PHE A 163 75.185 94.650 119.683 1.00 0.00 H ATOM 614 N LEU A 164 77.229 96.466 117.817 1.00 12.16 N ATOM 615 CA LEU A 164 78.124 96.932 116.745 1.00 12.53 C ATOM 616 C LEU A 164 77.356 97.334 115.509 1.00 16.38 C ATOM 617 O LEU A 164 77.739 98.268 114.796 1.00 13.41 O ATOM 618 CB LEU A 164 79.143 95.854 116.407 1.00 12.81 C ATOM 619 CG LEU A 164 80.212 95.541 117.463 1.00 14.58 C ATOM 620 CD1 LEU A 164 80.966 94.287 117.010 1.00 17.32 C ATOM 621 CD2 LEU A 164 81.140 96.737 117.722 1.00 18.31 C ATOM 622 H LEU A 164 77.274 95.482 118.150 1.00 0.00 H ATOM 623 N ASN A 165 76.231 96.689 115.262 1.00 15.41 N ATOM 624 CA ASN A 165 75.489 97.061 114.054 1.00 12.71 C ATOM 625 C ASN A 165 74.836 98.447 114.177 1.00 15.96 C ATOM 626 O ASN A 165 74.493 99.051 113.141 1.00 18.49 O ATOM 627 CB ASN A 165 74.425 95.986 113.730 1.00 16.70 C ATOM 628 CG ASN A 165 75.033 94.788 112.979 1.00 15.09 C ATOM 629 OD1 ASN A 165 76.095 94.901 112.338 1.00 20.01 O ATOM 630 ND2 ASN A 165 74.345 93.629 113.032 1.00 19.73 N ATOM 631 HD22 ASN A 165 73.462 93.573 113.578 1.00 0.00 H ATOM 632 HD21 ASN A 165 74.698 92.791 112.527 1.00 0.00 H ATOM 633 H ASN A 165 75.884 95.945 115.901 1.00 0.00 H ATOM 634 N MET A 166 74.670 98.954 115.408 1.00 13.87 N ATOM 635 CA MET A 166 74.139 100.302 115.584 1.00 18.59 C ATOM 636 C MET A 166 75.235 101.360 115.579 1.00 15.32 C ATOM 637 O MET A 166 74.921 102.548 115.523 1.00 19.76 O ATOM 638 CB MET A 166 73.336 100.404 116.896 1.00 22.88 C ATOM 639 CG MET A 166 71.966 99.783 116.781 1.00 28.37 C ATOM 640 SD MET A 166 70.931 100.171 118.212 1.00 33.13 S ATOM 641 CE MET A 166 71.969 99.566 119.501 1.00 25.79 C ATOM 642 H MET A 166 74.921 98.384 116.241 1.00 0.00 H ATOM 643 N VAL A 167 76.506 100.949 115.672 1.00 12.86 N ATOM 644 CA VAL A 167 77.620 101.916 115.587 1.00 13.57 C ATOM 645 C VAL A 167 77.738 102.526 114.173 1.00 14.79 C ATOM 646 O VAL A 167 77.722 101.804 113.166 1.00 16.07 O ATOM 647 CB VAL A 167 78.954 101.258 116.005 1.00 16.15 C ATOM 648 CG1 VAL A 167 80.132 102.232 115.856 1.00 17.93 C ATOM 649 CG2 VAL A 167 78.909 100.796 117.493 1.00 15.84 C ATOM 650 H VAL A 167 76.711 99.938 115.805 1.00 0.00 H ATOM 651 N ALA A 168 77.817 103.853 114.107 1.00 14.18 N ATOM 652 CA ALA A 168 77.929 104.544 112.796 1.00 13.19 C ATOM 653 C ALA A 168 79.220 104.205 112.071 1.00 17.75 C ATOM 654 O ALA A 168 80.276 104.055 112.675 1.00 15.80 O ATOM 655 CB ALA A 168 77.819 106.037 112.991 1.00 16.01 C ATOM 656 H ALA A 168 77.800 104.413 114.983 1.00 0.00 H ATOM 657 N PRO A 169 79.145 104.118 110.733 1.00 14.56 N ATOM 658 CA PRO A 169 80.361 103.830 109.973 1.00 14.73 C ATOM 659 C PRO A 169 81.335 104.941 110.236 1.00 19.53 C ATOM 660 O PRO A 169 80.901 106.047 110.496 1.00 21.85 O ATOM 661 CB PRO A 169 79.908 103.858 108.494 1.00 18.28 C ATOM 662 CG PRO A 169 78.381 103.878 108.540 1.00 25.21 C ATOM 663 CD PRO A 169 77.921 104.243 109.913 1.00 17.95 C ATOM 664 N GLY A 170 82.608 104.726 110.200 1.00 21.32 N ATOM 665 CA GLY A 170 83.296 105.986 110.485 1.00 25.38 C ATOM 666 C GLY A 170 83.609 106.346 111.936 1.00 21.89 C ATOM 667 O GLY A 170 84.564 107.070 112.147 1.00 17.56 O ATOM 668 H GLY A 170 83.066 103.813 110.002 1.00 0.00 H ATOM 669 N ARG A 171 82.846 105.864 112.922 1.00 17.01 N ATOM 670 CA ARG A 171 83.396 105.835 114.263 1.00 15.59 C ATOM 671 C ARG A 171 84.705 105.081 114.342 1.00 14.26 C ATOM 672 O ARG A 171 84.966 104.175 113.573 1.00 14.74 O ATOM 673 CB ARG A 171 82.429 105.160 115.253 1.00 10.29 C ATOM 674 CG ARG A 171 81.084 105.844 115.458 1.00 11.16 C ATOM 675 CD ARG A 171 81.234 107.283 115.856 1.00 12.79 C ATOM 676 NE ARG A 171 80.000 107.749 116.456 1.00 14.66 N ATOM 677 CZ ARG A 171 79.685 109.023 116.646 1.00 15.03 C ATOM 678 NH1 ARG A 171 80.495 110.010 116.187 1.00 14.47 N ATOM 679 NH2 ARG A 171 78.560 109.328 117.315 1.00 16.56 N ATOM 680 HE ARG A 171 79.311 107.032 116.760 1.00 0.00 H ATOM 681 HH12 ARG A 171 80.239 111.006 116.341 1.00 0.00 H ATOM 682 HH11 ARG A 171 81.372 109.770 115.681 1.00 0.00 H ATOM 683 HH22 ARG A 171 78.301 110.323 117.471 1.00 0.00 H ATOM 684 HH21 ARG A 171 77.948 108.569 117.677 1.00 0.00 H ATOM 685 H ARG A 171 81.883 105.519 112.732 1.00 0.00 H ATOM 686 N VAL A 172 85.525 105.446 115.327 1.00 13.60 N ATOM 687 CA VAL A 172 86.689 104.627 115.669 1.00 11.60 C ATOM 688 C VAL A 172 86.238 103.475 116.614 1.00 10.91 C ATOM 689 O VAL A 172 85.567 103.705 117.640 1.00 13.06 O ATOM 690 CB VAL A 172 87.782 105.437 116.348 1.00 14.91 C ATOM 691 CG1 VAL A 172 89.021 104.563 116.583 1.00 15.88 C ATOM 692 CG2 VAL A 172 88.165 106.605 115.491 1.00 17.07 C ATOM 693 H VAL A 172 85.336 106.320 115.857 1.00 0.00 H ATOM 694 N LEU A 173 86.521 102.252 116.193 1.00 11.26 N ATOM 695 CA LEU A 173 86.126 101.069 116.956 1.00 12.53 C ATOM 696 C LEU A 173 87.360 100.370 117.535 1.00 11.22 C ATOM 697 O LEU A 173 88.345 100.124 116.831 1.00 15.13 O ATOM 698 CB LEU A 173 85.368 100.114 116.024 1.00 13.52 C ATOM 699 CG LEU A 173 84.877 98.862 116.668 1.00 20.47 C ATOM 700 CD1 LEU A 173 83.783 99.213 117.710 1.00 18.94 C ATOM 701 CD2 LEU A 173 84.359 98.028 115.490 1.00 21.07 C ATOM 702 H LEU A 173 87.037 102.130 115.298 1.00 0.00 H ATOM 703 N ILE A 174 87.333 100.130 118.847 1.00 11.28 N ATOM 704 CA ILE A 174 88.483 99.547 119.531 1.00 11.95 C ATOM 705 C ILE A 174 88.018 98.322 120.294 1.00 12.99 C ATOM 706 O ILE A 174 86.983 98.371 120.946 1.00 12.81 O ATOM 707 CB ILE A 174 89.107 100.529 120.516 1.00 14.37 C ATOM 708 CG1 ILE A 174 89.678 101.714 119.743 1.00 13.53 C ATOM 709 CG2 ILE A 174 90.153 99.846 121.372 1.00 13.11 C ATOM 710 CD1 ILE A 174 90.002 102.925 120.653 1.00 14.39 C ATOM 711 H ILE A 174 86.478 100.362 119.392 1.00 0.00 H ATOM 712 N CYS A 175 88.708 97.192 120.116 1.00 13.63 N ATOM 713 CA CYS A 175 88.346 95.982 120.833 1.00 13.47 C ATOM 714 C CYS A 175 89.567 95.439 121.568 1.00 14.85 C ATOM 715 O CYS A 175 90.682 95.503 121.040 1.00 14.77 O ATOM 716 CB CYS A 175 87.826 94.888 119.874 1.00 13.77 C ATOM 717 SG CYS A 175 86.330 95.299 118.963 1.00 15.59 S ATOM 718 H CYS A 175 89.513 97.179 119.457 1.00 0.00 H ATOM 719 N THR A 176 89.364 94.853 122.750 1.00 13.16 N ATOM 720 CA THR A 176 90.474 94.182 123.413 1.00 13.16 C ATOM 721 C THR A 176 89.961 93.060 124.291 1.00 12.86 C ATOM 722 O THR A 176 88.942 93.209 124.939 1.00 13.45 O ATOM 723 CB THR A 176 91.311 95.219 124.233 1.00 15.00 C ATOM 724 OG1 THR A 176 92.412 94.528 124.827 1.00 15.36 O ATOM 725 CG2 THR A 176 90.491 95.974 125.296 1.00 14.88 C ATOM 726 HG1 THR A 176 92.957 95.167 125.352 1.00 0.00 H ATOM 727 H THR A 176 88.423 94.875 123.193 1.00 0.00 H ATOM 728 N VAL A 177 90.690 91.951 124.342 1.00 14.19 N ATOM 729 CA VAL A 177 90.223 90.757 125.071 1.00 12.34 C ATOM 730 C VAL A 177 90.859 90.649 126.482 1.00 13.79 C ATOM 731 O VAL A 177 92.063 90.837 126.656 1.00 16.13 O ATOM 732 CB VAL A 177 90.542 89.464 124.307 1.00 14.36 C ATOM 733 CG1 VAL A 177 90.270 88.219 125.156 1.00 14.93 C ATOM 734 CG2 VAL A 177 89.718 89.416 123.077 1.00 14.05 C ATOM 735 H VAL A 177 91.610 91.924 123.858 1.00 0.00 H ATOM 736 N LYS A 178 90.036 90.367 127.478 1.00 14.06 N ATOM 737 CA LYS A 178 90.492 90.030 128.842 1.00 13.03 C ATOM 738 C LYS A 178 90.164 88.551 129.058 1.00 16.65 C ATOM 739 O LYS A 178 88.989 88.171 128.973 1.00 15.08 O ATOM 740 CB LYS A 178 89.794 90.877 129.882 1.00 13.44 C ATOM 741 CG LYS A 178 90.440 90.696 131.314 1.00 15.34 C ATOM 742 CD LYS A 178 89.748 91.518 132.409 1.00 20.47 C ATOM 743 CE LYS A 178 90.451 91.363 133.775 1.00 20.84 C ATOM 744 NZ LYS A 178 89.514 91.732 134.848 1.00 26.00 N ATOM 745 HZ1 LYS A 178 89.214 92.719 134.720 1.00 0.00 H ATOM 746 HZ2 LYS A 178 88.683 91.108 134.810 1.00 0.00 H ATOM 747 HZ3 LYS A 178 89.986 91.628 135.769 1.00 0.00 H ATOM 748 H LYS A 178 89.013 90.383 127.291 1.00 0.00 H ATOM 749 N ASP A 179 91.189 87.732 129.354 1.00 15.59 N ATOM 750 CA ASP A 179 91.046 86.309 129.758 1.00 15.71 C ATOM 751 C ASP A 179 90.630 85.405 128.577 1.00 17.37 C ATOM 752 O ASP A 179 91.460 84.690 128.024 1.00 16.83 O ATOM 753 CB ASP A 179 90.099 86.192 130.962 1.00 15.70 C ATOM 754 CG ASP A 179 89.892 84.750 131.429 1.00 15.51 C ATOM 755 OD1 ASP A 179 90.519 83.835 130.878 1.00 16.74 O ATOM 756 OD2 ASP A 179 89.075 84.602 132.339 1.00 19.09 O ATOM 757 H ASP A 179 92.151 88.123 129.296 1.00 0.00 H ATOM 758 N GLU A 180 89.371 85.444 128.174 1.00 15.50 N ATOM 759 CA GLU A 180 88.912 84.546 127.144 1.00 14.82 C ATOM 760 C GLU A 180 87.757 85.209 126.412 1.00 10.41 C ATOM 761 O GLU A 180 86.781 85.587 127.071 1.00 12.57 O ATOM 762 CB GLU A 180 88.480 83.204 127.789 1.00 12.48 C ATOM 763 CG GLU A 180 88.682 81.917 126.932 1.00 13.78 C ATOM 764 CD GLU A 180 87.974 81.949 125.566 1.00 14.50 C ATOM 765 OE1 GLU A 180 86.701 81.927 125.562 1.00 13.80 O ATOM 766 OE2 GLU A 180 88.680 82.017 124.553 1.00 14.81 O ATOM 767 H GLU A 180 88.710 86.124 128.601 1.00 0.00 H ATOM 768 N GLY A 181 87.824 85.224 125.074 1.00 11.83 N ATOM 769 CA GLY A 181 86.774 85.899 124.316 1.00 13.53 C ATOM 770 C GLY A 181 86.201 85.063 123.203 1.00 12.36 C ATOM 771 O GLY A 181 85.387 85.552 122.396 1.00 12.81 O ATOM 772 H GLY A 181 88.614 84.761 124.581 1.00 0.00 H ATOM 773 N SER A 182 86.603 83.796 123.133 1.00 13.36 N ATOM 774 CA SER A 182 86.281 83.002 121.915 1.00 12.66 C ATOM 775 C SER A 182 85.270 81.864 122.061 1.00 12.66 C ATOM 776 O SER A 182 84.689 81.463 121.040 1.00 12.61 O ATOM 777 CB SER A 182 87.540 82.384 121.340 1.00 13.46 C ATOM 778 OG SER A 182 87.923 81.244 122.114 1.00 15.90 O ATOM 779 HG SER A 182 88.094 81.523 123.048 1.00 0.00 H ATOM 780 H SER A 182 87.134 83.367 123.917 1.00 0.00 H ATOM 781 N PHE A 183 85.070 81.362 123.274 1.00 12.24 N ATOM 782 CA PHE A 183 84.323 80.073 123.409 1.00 11.93 C ATOM 783 C PHE A 183 82.905 80.201 122.803 1.00 13.20 C ATOM 784 O PHE A 183 82.453 79.320 122.061 1.00 12.69 O ATOM 785 CB PHE A 183 84.262 79.659 124.887 1.00 13.52 C ATOM 786 CG PHE A 183 83.569 78.343 125.160 1.00 12.34 C ATOM 787 CD1 PHE A 183 83.415 77.364 124.182 1.00 15.05 C ATOM 788 CD2 PHE A 183 83.054 78.117 126.423 1.00 13.70 C ATOM 789 CE1 PHE A 183 82.775 76.134 124.508 1.00 13.18 C ATOM 790 CE2 PHE A 183 82.383 76.939 126.747 1.00 12.39 C ATOM 791 CZ PHE A 183 82.248 75.942 125.773 1.00 13.39 C ATOM 792 H PHE A 183 85.427 81.857 124.116 1.00 0.00 H ATOM 793 N HIS A 184 82.255 81.338 123.058 1.00 12.61 N ATOM 794 CA HIS A 184 80.957 81.622 122.458 1.00 11.83 C ATOM 795 C HIS A 184 80.952 82.842 121.501 1.00 14.14 C ATOM 796 O HIS A 184 79.959 83.543 121.399 1.00 13.06 O ATOM 797 CB HIS A 184 79.899 81.758 123.561 1.00 9.83 C ATOM 798 CG HIS A 184 79.590 80.428 124.164 1.00 13.91 C ATOM 799 ND1 HIS A 184 78.658 79.580 123.609 1.00 14.87 N ATOM 800 CD2 HIS A 184 80.127 79.781 125.224 1.00 12.74 C ATOM 801 CE1 HIS A 184 78.646 78.445 124.290 1.00 14.81 C ATOM 802 NE2 HIS A 184 79.520 78.544 125.280 1.00 14.18 N ATOM 803 H HIS A 184 82.683 82.037 123.698 1.00 0.00 H ATOM 804 N LEU A 185 82.049 83.027 120.786 1.00 10.73 N ATOM 805 CA LEU A 185 82.121 84.056 119.733 1.00 12.23 C ATOM 806 C LEU A 185 81.771 83.277 118.493 1.00 14.23 C ATOM 807 O LEU A 185 82.628 82.665 117.870 1.00 13.75 O ATOM 808 CB LEU A 185 83.512 84.628 119.645 1.00 13.33 C ATOM 809 CG LEU A 185 83.634 85.801 118.672 1.00 14.64 C ATOM 810 CD1 LEU A 185 82.859 86.993 119.238 1.00 14.02 C ATOM 811 CD2 LEU A 185 85.133 86.063 118.503 1.00 19.68 C ATOM 812 H LEU A 185 82.881 82.432 120.971 1.00 0.00 H ATOM 813 N LYS A 186 80.497 83.275 118.136 1.00 11.95 N ATOM 814 CA LYS A 186 80.077 82.327 117.127 1.00 11.45 C ATOM 815 C LYS A 186 80.033 82.967 115.721 1.00 11.15 C ATOM 816 O LYS A 186 80.539 84.056 115.503 1.00 14.59 O ATOM 817 CB LYS A 186 78.718 81.740 117.485 1.00 12.03 C ATOM 818 CG LYS A 186 78.765 80.973 118.778 1.00 12.54 C ATOM 819 CD LYS A 186 79.971 80.027 118.883 1.00 12.65 C ATOM 820 CE LYS A 186 79.674 78.909 119.963 1.00 12.66 C ATOM 821 NZ LYS A 186 80.874 78.043 120.148 1.00 13.08 N ATOM 822 HZ1 LYS A 186 81.115 77.589 119.244 1.00 0.00 H ATOM 823 HZ2 LYS A 186 81.674 78.625 120.470 1.00 0.00 H ATOM 824 HZ3 LYS A 186 80.667 77.313 120.859 1.00 0.00 H ATOM 825 H LYS A 186 79.818 83.935 118.567 1.00 0.00 H ATOM 826 N ASP A 187 79.510 82.217 114.749 1.00 13.54 N ATOM 827 CA ASP A 187 79.796 82.594 113.352 1.00 15.15 C ATOM 828 C ASP A 187 79.265 83.964 112.931 1.00 15.74 C ATOM 829 O ASP A 187 79.934 84.631 112.126 1.00 16.97 O ATOM 830 CB ASP A 187 79.256 81.519 112.381 1.00 17.25 C ATOM 831 CG ASP A 187 80.052 80.202 112.433 1.00 18.13 C ATOM 832 OD1 ASP A 187 81.112 80.132 113.074 1.00 23.37 O ATOM 833 OD2 ASP A 187 79.600 79.240 111.793 1.00 25.29 O ATOM 834 H ASP A 187 78.918 81.391 114.970 1.00 0.00 H ATOM 835 N THR A 188 78.092 84.397 113.394 1.00 14.13 N ATOM 836 CA THR A 188 77.591 85.685 112.954 1.00 15.07 C ATOM 837 C THR A 188 78.492 86.810 113.458 1.00 17.33 C ATOM 838 O THR A 188 78.846 87.756 112.726 1.00 16.67 O ATOM 839 CB THR A 188 76.175 85.906 113.444 1.00 18.04 C ATOM 840 OG1 THR A 188 75.335 84.913 112.849 1.00 21.69 O ATOM 841 CG2 THR A 188 75.657 87.284 113.038 1.00 17.38 C ATOM 842 HG1 THR A 188 75.651 84.013 113.115 1.00 0.00 H ATOM 843 H THR A 188 77.543 83.819 114.062 1.00 0.00 H ATOM 844 N ALA A 189 78.888 86.724 114.718 1.00 13.64 N ATOM 845 CA ALA A 189 79.827 87.699 115.260 1.00 13.04 C ATOM 846 C ALA A 189 81.207 87.675 114.552 1.00 12.95 C ATOM 847 O ALA A 189 81.783 88.744 114.236 1.00 13.64 O ATOM 848 CB ALA A 189 79.972 87.463 116.772 1.00 12.95 C ATOM 849 H ALA A 189 78.528 85.959 115.323 1.00 0.00 H ATOM 850 N LYS A 190 81.718 86.474 114.259 1.00 14.92 N ATOM 851 CA LYS A 190 82.990 86.390 113.551 1.00 13.39 C ATOM 852 C LYS A 190 82.864 86.997 112.137 1.00 15.85 C ATOM 853 O LYS A 190 83.787 87.691 111.697 1.00 14.80 O ATOM 854 CB LYS A 190 83.473 84.942 113.511 1.00 14.18 C ATOM 855 CG LYS A 190 84.022 84.512 114.902 1.00 14.52 C ATOM 856 CD LYS A 190 84.625 83.078 114.972 1.00 17.28 C ATOM 857 CE LYS A 190 85.544 83.061 116.187 1.00 23.53 C ATOM 858 NZ LYS A 190 86.488 81.903 116.317 1.00 27.79 N ATOM 859 HZ1 LYS A 190 85.944 81.018 116.367 1.00 0.00 H ATOM 860 HZ2 LYS A 190 87.119 81.877 115.491 1.00 0.00 H ATOM 861 HZ3 LYS A 190 87.053 82.014 117.183 1.00 0.00 H ATOM 862 H LYS A 190 81.212 85.608 114.534 1.00 0.00 H ATOM 863 N ALA A 191 81.727 86.785 111.490 1.00 14.43 N ATOM 864 CA ALA A 191 81.524 87.353 110.147 1.00 15.81 C ATOM 865 C ALA A 191 81.462 88.859 110.238 1.00 17.04 C ATOM 866 O ALA A 191 81.970 89.568 109.364 1.00 17.32 O ATOM 867 CB ALA A 191 80.275 86.811 109.525 1.00 18.22 C ATOM 868 H ALA A 191 80.977 86.216 111.932 1.00 0.00 H ATOM 869 N LEU A 192 80.846 89.386 111.295 1.00 15.03 N ATOM 870 CA LEU A 192 80.797 90.837 111.437 1.00 15.31 C ATOM 871 C LEU A 192 82.212 91.391 111.634 1.00 15.05 C ATOM 872 O LEU A 192 82.590 92.389 110.999 1.00 18.58 O ATOM 873 CB LEU A 192 79.899 91.199 112.626 1.00 17.25 C ATOM 874 CG LEU A 192 79.639 92.674 112.801 1.00 16.11 C ATOM 875 CD1 LEU A 192 79.092 93.242 111.535 1.00 22.03 C ATOM 876 CD2 LEU A 192 78.619 92.865 113.919 1.00 16.75 C ATOM 877 H LEU A 192 80.406 88.771 112.009 1.00 0.00 H ATOM 878 N LEU A 193 83.017 90.756 112.503 1.00 12.51 N ATOM 879 CA LEU A 193 84.378 91.228 112.671 1.00 16.27 C ATOM 880 C LEU A 193 85.156 91.139 111.347 1.00 17.50 C ATOM 881 O LEU A 193 85.941 92.028 111.039 1.00 16.32 O ATOM 882 CB LEU A 193 85.107 90.447 113.763 1.00 17.88 C ATOM 883 CG LEU A 193 84.470 90.583 115.158 1.00 16.47 C ATOM 884 CD1 LEU A 193 85.198 89.697 116.141 1.00 17.98 C ATOM 885 CD2 LEU A 193 84.523 92.036 115.633 1.00 18.94 C ATOM 886 H LEU A 193 82.670 89.940 113.046 1.00 0.00 H ATOM 887 N ARG A 194 84.940 90.082 110.591 1.00 15.90 N ATOM 888 CA ARG A 194 85.600 89.958 109.269 1.00 16.18 C ATOM 889 C ARG A 194 85.210 91.139 108.397 1.00 21.43 C ATOM 890 O ARG A 194 86.065 91.695 107.666 1.00 20.94 O ATOM 891 CB ARG A 194 85.218 88.606 108.627 1.00 15.58 C ATOM 892 CG ARG A 194 85.954 88.368 107.314 1.00 21.74 C ATOM 893 CD ARG A 194 85.627 87.003 106.737 1.00 26.72 C ATOM 894 NE ARG A 194 86.173 85.912 107.551 1.00 27.18 N ATOM 895 CZ ARG A 194 85.454 85.082 108.312 1.00 42.39 C ATOM 896 NH1 ARG A 194 84.125 85.189 108.399 1.00 38.90 N ATOM 897 NH2 ARG A 194 86.075 84.132 109.009 1.00 38.54 N ATOM 898 HE ARG A 194 87.204 85.773 107.535 1.00 0.00 H ATOM 899 HH12 ARG A 194 83.588 84.530 108.999 1.00 0.00 H ATOM 900 HH11 ARG A 194 83.627 85.931 107.867 1.00 0.00 H ATOM 901 HH22 ARG A 194 85.525 83.480 109.605 1.00 0.00 H ATOM 902 HH21 ARG A 194 87.110 84.042 108.958 1.00 0.00 H ATOM 903 H ARG A 194 84.303 89.330 110.923 1.00 0.00 H ATOM 904 N SER A 195 83.949 91.550 108.476 1.00 17.73 N ATOM 905 CA SER A 195 83.452 92.631 107.606 1.00 16.26 C ATOM 906 C SER A 195 84.098 93.950 107.973 1.00 25.50 C ATOM 907 O SER A 195 84.106 94.877 107.142 1.00 25.47 O ATOM 908 CB SER A 195 81.917 92.766 107.662 1.00 22.47 C ATOM 909 OG SER A 195 81.499 93.377 108.879 1.00 26.36 O ATOM 910 HG SER A 195 81.797 92.823 109.644 1.00 0.00 H ATOM 911 H SER A 195 83.305 91.104 109.160 1.00 0.00 H ATOM 912 N LEU A 196 84.636 94.075 109.191 1.00 21.10 N ATOM 913 CA LEU A 196 85.381 95.299 109.553 1.00 21.38 C ATOM 914 C LEU A 196 86.804 95.306 109.042 1.00 22.66 C ATOM 915 O LEU A 196 87.539 96.320 109.187 1.00 26.67 O ATOM 916 CB LEU A 196 85.480 95.481 111.055 1.00 26.91 C ATOM 917 CG LEU A 196 84.177 95.292 111.772 1.00 24.94 C ATOM 918 CD1 LEU A 196 84.562 95.360 113.243 1.00 28.54 C ATOM 919 CD2 LEU A 196 83.237 96.408 111.387 1.00 29.63 C ATOM 920 H LEU A 196 84.530 93.308 109.886 1.00 0.00 H ATOM 921 N GLY A 197 87.234 94.178 108.486 1.00 19.11 N ATOM 922 CA GLY A 197 88.610 94.040 108.075 1.00 20.15 C ATOM 923 C GLY A 197 89.489 93.370 109.080 1.00 20.34 C ATOM 924 O GLY A 197 90.688 93.167 108.848 1.00 22.00 O ATOM 925 H GLY A 197 86.573 93.388 108.346 1.00 0.00 H ATOM 926 N SER A 198 88.915 93.016 110.228 1.00 18.59 N ATOM 927 CA SER A 198 89.725 92.309 111.222 1.00 18.70 C ATOM 928 C SER A 198 90.230 90.970 110.713 1.00 17.74 C ATOM 929 O SER A 198 89.449 90.172 110.158 1.00 20.28 O ATOM 930 CB SER A 198 88.932 92.077 112.541 1.00 17.22 C ATOM 931 OG SER A 198 89.721 91.333 113.476 1.00 18.07 O ATOM 932 HG SER A 198 90.548 91.836 113.682 1.00 0.00 H ATOM 933 H SER A 198 87.916 93.236 110.414 1.00 0.00 H ATOM 934 N GLN A 199 91.492 90.685 110.995 1.00 19.34 N ATOM 935 CA GLN A 199 92.109 89.413 110.608 1.00 25.11 C ATOM 936 C GLN A 199 92.047 88.440 111.750 1.00 22.54 C ATOM 937 O GLN A 199 91.734 87.257 111.555 1.00 32.33 O ATOM 938 CB GLN A 199 93.566 89.604 110.195 1.00 28.87 C ATOM 939 CG GLN A 199 93.770 90.605 109.121 1.00 37.44 C ATOM 940 CD GLN A 199 93.163 90.157 107.828 1.00 39.76 C ATOM 941 OE1 GLN A 199 92.216 90.773 107.321 1.00 44.51 O ATOM 942 NE2 GLN A 199 93.701 89.074 107.270 1.00 43.88 N ATOM 943 HE22 GLN A 199 94.496 88.590 107.734 1.00 0.00 H ATOM 944 HE21 GLN A 199 93.326 88.712 106.370 1.00 0.00 H ATOM 945 H GLN A 199 92.064 91.386 111.508 1.00 0.00 H ATOM 946 N ALA A 200 92.347 88.916 112.953 1.00 18.75 N ATOM 947 CA ALA A 200 92.446 88.070 114.140 1.00 20.16 C ATOM 948 C ALA A 200 91.083 87.746 114.733 1.00 17.92 C ATOM 949 O ALA A 200 90.860 86.650 115.245 1.00 21.67 O ATOM 950 CB ALA A 200 93.332 88.731 115.211 1.00 23.57 C ATOM 951 H ALA A 200 92.519 89.937 113.055 1.00 0.00 H ATOM 952 N GLY A 201 90.184 88.705 114.699 1.00 17.83 N ATOM 953 CA GLY A 201 88.891 88.502 115.343 1.00 18.99 C ATOM 954 C GLY A 201 88.104 87.314 114.823 1.00 17.69 C ATOM 955 O GLY A 201 87.593 86.515 115.608 1.00 16.81 O ATOM 956 H GLY A 201 90.393 89.602 114.216 1.00 0.00 H ATOM 957 N PRO A 202 88.021 87.164 113.491 1.00 15.02 N ATOM 958 CA PRO A 202 87.278 85.997 112.981 1.00 15.33 C ATOM 959 C PRO A 202 87.979 84.671 113.271 1.00 17.89 C ATOM 960 O PRO A 202 87.366 83.632 113.197 1.00 24.33 O ATOM 961 CB PRO A 202 87.188 86.253 111.473 1.00 18.51 C ATOM 962 CG PRO A 202 87.525 87.708 111.305 1.00 18.74 C ATOM 963 CD PRO A 202 88.380 88.123 112.425 1.00 16.00 C ATOM 964 N ALA A 203 89.262 84.730 113.603 1.00 17.09 N ATOM 965 CA ALA A 203 90.085 83.585 113.891 1.00 21.26 C ATOM 966 C ALA A 203 90.290 83.376 115.397 1.00 19.30 C ATOM 967 O ALA A 203 91.039 82.497 115.806 1.00 19.13 O ATOM 968 CB ALA A 203 91.441 83.744 113.188 1.00 24.03 C ATOM 969 H ALA A 203 89.704 85.670 113.659 1.00 0.00 H ATOM 970 N LEU A 204 89.644 84.172 116.248 1.00 14.11 N ATOM 971 CA LEU A 204 89.989 84.153 117.669 1.00 15.63 C ATOM 972 C LEU A 204 89.749 82.796 118.289 1.00 18.09 C ATOM 973 O LEU A 204 88.663 82.212 118.101 1.00 18.00 O ATOM 974 CB LEU A 204 89.168 85.221 118.414 1.00 14.43 C ATOM 975 CG LEU A 204 89.610 85.547 119.830 1.00 15.69 C ATOM 976 CD1 LEU A 204 90.885 86.373 119.776 1.00 16.95 C ATOM 977 CD2 LEU A 204 88.465 86.277 120.564 1.00 15.79 C ATOM 978 H LEU A 204 88.896 84.806 115.902 1.00 0.00 H ATOM 979 N GLY A 205 90.744 82.318 119.030 1.00 15.38 N ATOM 980 CA GLY A 205 90.664 81.016 119.709 1.00 17.00 C ATOM 981 C GLY A 205 90.858 81.077 121.206 1.00 17.12 C ATOM 982 O GLY A 205 91.012 82.167 121.777 1.00 16.87 O ATOM 983 H GLY A 205 91.610 82.885 119.133 1.00 0.00 H ATOM 984 N TRP A 206 90.811 79.889 121.835 1.00 16.48 N ATOM 985 CA TRP A 206 90.814 79.693 123.276 1.00 15.08 C ATOM 986 C TRP A 206 91.946 80.442 123.972 1.00 19.18 C ATOM 987 O TRP A 206 93.135 80.172 123.726 1.00 19.68 O ATOM 988 CB TRP A 206 90.907 78.170 123.594 1.00 16.04 C ATOM 989 CG TRP A 206 90.873 77.856 125.028 1.00 18.21 C ATOM 990 CD1 TRP A 206 91.954 77.468 125.815 1.00 17.94 C ATOM 991 CD2 TRP A 206 89.731 77.833 125.893 1.00 16.31 C ATOM 992 NE1 TRP A 206 91.543 77.256 127.080 1.00 18.62 N ATOM 993 CE2 TRP A 206 90.185 77.461 127.178 1.00 16.09 C ATOM 994 CE3 TRP A 206 88.373 78.121 125.721 1.00 15.45 C ATOM 995 CZ2 TRP A 206 89.333 77.368 128.271 1.00 14.90 C ATOM 996 CZ3 TRP A 206 87.531 78.026 126.774 1.00 15.32 C ATOM 997 CH2 TRP A 206 87.997 77.614 128.055 1.00 15.64 C ATOM 998 HE1 TRP A 206 92.162 76.978 127.868 1.00 0.00 H ATOM 999 H TRP A 206 90.769 79.037 121.240 1.00 0.00 H ATOM 1000 N ARG A 207 91.551 81.431 124.769 1.00 15.25 N ATOM 1001 CA ARG A 207 92.447 82.230 125.612 1.00 18.10 C ATOM 1002 C ARG A 207 93.478 82.994 124.801 1.00 17.01 C ATOM 1003 O ARG A 207 94.491 83.395 125.375 1.00 20.09 O ATOM 1004 CB ARG A 207 93.124 81.316 126.692 1.00 17.66 C ATOM 1005 CG ARG A 207 92.145 80.774 127.714 1.00 15.91 C ATOM 1006 CD ARG A 207 92.843 79.860 128.718 1.00 16.84 C ATOM 1007 NE ARG A 207 91.984 79.556 129.857 1.00 17.94 N ATOM 1008 CZ ARG A 207 92.353 78.825 130.930 1.00 18.33 C ATOM 1009 NH1 ARG A 207 91.521 78.668 131.932 1.00 19.02 N ATOM 1010 NH2 ARG A 207 93.576 78.308 131.009 1.00 19.69 N ATOM 1011 HE ARG A 207 91.014 79.931 129.841 1.00 0.00 H ATOM 1012 HH12 ARG A 207 91.804 78.105 132.759 1.00 0.00 H ATOM 1013 HH11 ARG A 207 90.579 79.106 131.899 1.00 0.00 H ATOM 1014 HH22 ARG A 207 93.850 77.746 131.840 1.00 0.00 H ATOM 1015 HH21 ARG A 207 94.258 78.466 130.240 1.00 0.00 H ATOM 1016 H ARG A 207 90.535 81.653 124.796 1.00 0.00 H ATOM 1017 N ASP A 208 93.224 83.240 123.507 1.00 18.05 N ATOM 1018 CA ASP A 208 94.028 84.158 122.685 1.00 18.37 C ATOM 1019 C ASP A 208 93.852 85.591 123.192 1.00 15.16 C ATOM 1020 O ASP A 208 92.782 85.985 123.680 1.00 17.42 O ATOM 1021 CB ASP A 208 93.643 84.211 121.208 1.00 15.74 C ATOM 1022 CG ASP A 208 93.890 82.919 120.440 1.00 16.20 C ATOM 1023 OD1 ASP A 208 94.430 81.952 121.001 1.00 20.29 O ATOM 1024 OD2 ASP A 208 93.538 82.909 119.263 1.00 19.13 O ATOM 1025 H ASP A 208 92.418 82.757 123.062 1.00 0.00 H ATOM 1026 N THR A 209 94.913 86.374 123.052 1.00 15.96 N ATOM 1027 CA THR A 209 94.795 87.809 123.301 1.00 15.58 C ATOM 1028 C THR A 209 94.694 88.521 121.968 1.00 16.68 C ATOM 1029 O THR A 209 95.161 88.055 120.958 1.00 18.16 O ATOM 1030 CB THR A 209 95.978 88.321 124.107 1.00 19.56 C ATOM 1031 OG1 THR A 209 97.175 88.017 123.362 1.00 19.97 O ATOM 1032 CG2 THR A 209 95.993 87.716 125.506 1.00 18.79 C ATOM 1033 HG1 THR A 209 97.965 88.340 123.863 1.00 0.00 H ATOM 1034 H THR A 209 95.827 85.968 122.766 1.00 0.00 H ATOM 1035 N TRP A 210 94.039 89.664 121.962 1.00 13.13 N ATOM 1036 CA TRP A 210 93.655 90.364 120.747 1.00 15.80 C ATOM 1037 C TRP A 210 93.359 91.829 121.063 1.00 15.42 C ATOM 1038 O TRP A 210 92.629 92.163 122.010 1.00 14.61 O ATOM 1039 CB TRP A 210 92.392 89.704 120.107 1.00 14.67 C ATOM 1040 CG TRP A 210 91.843 90.432 118.917 1.00 17.50 C ATOM 1041 CD1 TRP A 210 92.537 90.848 117.815 1.00 17.28 C ATOM 1042 CD2 TRP A 210 90.475 90.815 118.697 1.00 15.76 C ATOM 1043 NE1 TRP A 210 91.694 91.477 116.929 1.00 16.56 N ATOM 1044 CE2 TRP A 210 90.420 91.480 117.444 1.00 15.45 C ATOM 1045 CE3 TRP A 210 89.300 90.673 119.436 1.00 15.94 C ATOM 1046 CZ2 TRP A 210 89.235 91.996 116.899 1.00 15.43 C ATOM 1047 CZ3 TRP A 210 88.097 91.184 118.881 1.00 15.98 C ATOM 1048 CH2 TRP A 210 88.072 91.839 117.636 1.00 14.27 C ATOM 1049 HE1 TRP A 210 91.976 91.885 116.015 1.00 0.00 H ATOM 1050 H TRP A 210 93.783 90.089 122.876 1.00 0.00 H ATOM 1051 N ALA A 211 94.009 92.698 120.289 1.00 16.92 N ATOM 1052 CA ALA A 211 93.796 94.138 120.335 1.00 14.62 C ATOM 1053 C ALA A 211 93.568 94.663 118.934 1.00 15.72 C ATOM 1054 O ALA A 211 94.266 94.294 117.993 1.00 20.10 O ATOM 1055 CB ALA A 211 95.013 94.841 120.980 1.00 14.84 C ATOM 1056 H ALA A 211 94.708 92.327 119.614 1.00 0.00 H ATOM 1057 N PHE A 212 92.584 95.546 118.782 1.00 14.11 N ATOM 1058 CA PHE A 212 92.106 95.972 117.478 1.00 15.70 C ATOM 1059 C PHE A 212 91.716 97.441 117.524 1.00 15.81 C ATOM 1060 O PHE A 212 91.092 97.884 118.476 1.00 15.59 O ATOM 1061 CB PHE A 212 90.862 95.132 117.070 1.00 16.12 C ATOM 1062 CG PHE A 212 90.169 95.617 115.840 1.00 15.07 C ATOM 1063 CD1 PHE A 212 89.154 96.574 115.906 1.00 15.15 C ATOM 1064 CD2 PHE A 212 90.544 95.126 114.588 1.00 16.80 C ATOM 1065 CE1 PHE A 212 88.504 97.013 114.755 1.00 18.99 C ATOM 1066 CE2 PHE A 212 89.897 95.571 113.433 1.00 15.81 C ATOM 1067 CZ PHE A 212 88.895 96.506 113.509 1.00 19.93 C ATOM 1068 H PHE A 212 92.139 95.948 119.632 1.00 0.00 H ATOM 1069 N VAL A 213 92.089 98.190 116.491 1.00 16.28 N ATOM 1070 CA VAL A 213 91.666 99.583 116.264 1.00 11.98 C ATOM 1071 C VAL A 213 91.345 99.771 114.796 1.00 13.23 C ATOM 1072 O VAL A 213 92.213 99.590 113.965 1.00 16.68 O ATOM 1073 CB VAL A 213 92.795 100.572 116.626 1.00 19.53 C ATOM 1074 CG1 VAL A 213 92.276 102.021 116.453 1.00 17.52 C ATOM 1075 CG2 VAL A 213 93.325 100.289 118.036 1.00 20.17 C ATOM 1076 H VAL A 213 92.727 97.761 115.791 1.00 0.00 H ATOM 1077 N GLY A 214 90.114 100.144 114.473 1.00 12.99 N ATOM 1078 CA GLY A 214 89.738 100.420 113.083 1.00 18.01 C ATOM 1079 C GLY A 214 88.587 101.418 112.943 1.00 20.52 C ATOM 1080 O GLY A 214 87.901 101.726 113.916 1.00 18.55 O ATOM 1081 H GLY A 214 89.400 100.243 115.222 1.00 0.00 H ATOM 1082 N ARG A 215 88.411 102.003 111.747 1.00 17.22 N ATOM 1083 CA ARG A 215 87.225 102.781 111.421 1.00 16.63 C ATOM 1084 C ARG A 215 86.087 101.799 111.186 1.00 24.23 C ATOM 1085 O ARG A 215 86.293 100.806 110.492 1.00 27.76 O ATOM 1086 CB ARG A 215 87.491 103.671 110.171 1.00 20.08 C ATOM 1087 CG ARG A 215 86.353 104.563 109.795 1.00 23.18 C ATOM 1088 CD ARG A 215 86.630 105.476 108.595 1.00 20.49 C ATOM 1089 NE ARG A 215 85.395 106.098 108.126 1.00 24.79 N ATOM 1090 CZ ARG A 215 84.535 105.505 107.281 1.00 35.00 C ATOM 1091 NH1 ARG A 215 84.794 104.295 106.787 1.00 32.82 N ATOM 1092 NH2 ARG A 215 83.415 106.116 106.912 1.00 29.12 N ATOM 1093 HE ARG A 215 85.168 107.055 108.465 1.00 0.00 H ATOM 1094 HH12 ARG A 215 84.121 103.845 106.134 1.00 0.00 H ATOM 1095 HH11 ARG A 215 85.669 103.800 107.055 1.00 0.00 H ATOM 1096 HH22 ARG A 215 82.758 105.646 106.257 1.00 0.00 H ATOM 1097 HH21 ARG A 215 83.195 107.064 107.278 1.00 0.00 H ATOM 1098 H ARG A 215 89.152 101.896 111.025 1.00 0.00 H ATOM 1099 N LYS A 216 84.888 102.055 111.739 1.00 19.36 N ATOM 1100 CA LYS A 216 83.809 101.065 111.650 1.00 25.06 C ATOM 1101 C LYS A 216 83.595 100.644 110.225 1.00 27.67 C ATOM 1102 O LYS A 216 83.568 99.446 109.931 1.00 28.06 O ATOM 1103 CB LYS A 216 82.494 101.603 112.246 1.00 22.47 C ATOM 1104 CG LYS A 216 81.220 100.746 111.832 1.00 28.03 C ATOM 1105 CD LYS A 216 80.867 99.682 112.841 1.00 29.82 C ATOM 1106 CE LYS A 216 79.823 98.715 112.322 1.00 25.83 C ATOM 1107 NZ LYS A 216 78.467 99.317 112.024 1.00 22.70 N ATOM 1108 HZ1 LYS A 216 78.075 99.733 112.893 1.00 0.00 H ATOM 1109 HZ2 LYS A 216 78.569 100.056 111.299 1.00 0.00 H ATOM 1110 HZ3 LYS A 216 77.828 98.574 111.676 1.00 0.00 H ATOM 1111 H LYS A 216 84.725 102.957 112.231 1.00 0.00 H ATOM 1112 N GLY A 217 83.445 101.609 109.326 1.00 24.59 N ATOM 1113 CA GLY A 217 83.227 101.259 107.928 1.00 29.26 C ATOM 1114 C GLY A 217 84.474 101.041 107.076 1.00 34.29 C ATOM 1115 O GLY A 217 84.405 101.101 105.822 1.00 27.68 O ATOM 1116 H GLY A 217 83.483 102.607 109.617 1.00 0.00 H ATOM 1117 N GLY A 218 85.608 100.806 107.743 1.00 24.30 N ATOM 1118 CA GLY A 218 86.892 100.594 107.072 1.00 24.57 C ATOM 1119 C GLY A 218 87.719 101.843 106.953 1.00 22.31 C ATOM 1120 O GLY A 218 87.170 102.994 106.945 1.00 26.37 O ATOM 1121 H GLY A 218 85.577 100.772 108.782 1.00 0.00 H ATOM 1122 N PRO A 219 89.050 101.684 106.908 1.00 20.57 N ATOM 1123 CA PRO A 219 89.835 100.467 107.077 1.00 19.76 C ATOM 1124 C PRO A 219 90.275 100.208 108.524 1.00 22.28 C ATOM 1125 O PRO A 219 90.057 101.055 109.385 1.00 20.27 O ATOM 1126 CB PRO A 219 91.064 100.749 106.239 1.00 21.65 C ATOM 1127 CG PRO A 219 91.287 102.183 106.514 1.00 20.83 C ATOM 1128 CD PRO A 219 89.911 102.818 106.536 1.00 20.58 C ATOM 1129 N VAL A 220 90.985 99.100 108.710 1.00 19.73 N ATOM 1130 CA VAL A 220 91.675 98.723 109.976 1.00 18.81 C ATOM 1131 C VAL A 220 92.896 99.610 110.147 1.00 23.32 C ATOM 1132 O VAL A 220 93.604 99.862 109.168 1.00 22.14 O ATOM 1133 CB VAL A 220 92.098 97.255 109.971 1.00 24.51 C ATOM 1134 CG1 VAL A 220 92.866 96.856 111.270 1.00 20.65 C ATOM 1135 CG2 VAL A 220 90.851 96.418 109.786 1.00 26.94 C ATOM 1136 H VAL A 220 91.066 98.443 107.908 1.00 0.00 H ATOM 1137 N PHE A 221 93.147 100.099 111.359 1.00 17.04 N ATOM 1138 CA PHE A 221 94.333 100.939 111.600 1.00 18.18 C ATOM 1139 C PHE A 221 95.446 100.172 112.309 1.00 19.31 C ATOM 1140 O PHE A 221 96.632 100.357 111.993 1.00 22.58 O ATOM 1141 CB PHE A 221 93.966 102.200 112.425 1.00 16.75 C ATOM 1142 CG PHE A 221 92.973 103.116 111.750 1.00 15.45 C ATOM 1143 CD1 PHE A 221 93.164 103.541 110.427 1.00 15.57 C ATOM 1144 CD2 PHE A 221 91.805 103.498 112.397 1.00 18.51 C ATOM 1145 CE1 PHE A 221 92.289 104.398 109.847 1.00 17.32 C ATOM 1146 CE2 PHE A 221 90.904 104.333 111.796 1.00 16.29 C ATOM 1147 CZ PHE A 221 91.131 104.782 110.515 1.00 16.41 C ATOM 1148 H PHE A 221 92.499 99.886 112.144 1.00 0.00 H ATOM 1149 N GLY A 222 95.108 99.301 113.259 1.00 17.37 N ATOM 1150 CA GLY A 222 96.098 98.505 113.951 1.00 15.72 C ATOM 1151 C GLY A 222 95.450 97.217 114.433 1.00 16.99 C ATOM 1152 O GLY A 222 94.275 97.228 114.768 1.00 18.17 O ATOM 1153 H GLY A 222 94.105 99.190 113.510 1.00 0.00 H ATOM 1154 N GLU A 223 96.216 96.146 114.500 1.00 19.30 N ATOM 1155 CA GLU A 223 95.718 94.874 115.080 1.00 19.39 C ATOM 1156 C GLU A 223 96.884 94.051 115.591 1.00 21.26 C ATOM 1157 O GLU A 223 97.923 93.978 114.930 1.00 22.74 O ATOM 1158 CB GLU A 223 94.902 94.092 114.037 1.00 22.17 C ATOM 1159 CG GLU A 223 94.212 92.816 114.582 1.00 18.58 C ATOM 1160 CD GLU A 223 93.112 92.314 113.657 1.00 24.69 C ATOM 1161 OE1 GLU A 223 93.223 92.461 112.417 1.00 23.15 O ATOM 1162 OE2 GLU A 223 92.103 91.796 114.153 1.00 21.45 O ATOM 1163 H GLU A 223 97.190 96.194 114.139 1.00 0.00 H ATOM 1164 N LYS A 224 96.736 93.455 116.776 1.00 18.77 N ATOM 1165 CA LYS A 224 97.691 92.447 117.277 1.00 19.28 C ATOM 1166 C LYS A 224 96.940 91.250 117.847 1.00 22.33 C ATOM 1167 O LYS A 224 95.819 91.402 118.337 1.00 20.73 O ATOM 1168 CB LYS A 224 98.584 93.026 118.374 1.00 20.86 C ATOM 1169 CG LYS A 224 99.681 93.931 117.880 1.00 30.32 C ATOM 1170 CD LYS A 224 100.743 94.137 118.955 1.00 27.35 C ATOM 1171 CE LYS A 224 101.830 95.094 118.415 1.00 30.71 C ATOM 1172 NZ LYS A 224 102.830 95.399 119.451 1.00 32.57 N ATOM 1173 HZ1 LYS A 224 102.361 95.851 120.262 1.00 0.00 H ATOM 1174 HZ2 LYS A 224 103.286 94.517 119.761 1.00 0.00 H ATOM 1175 HZ3 LYS A 224 103.547 96.043 119.060 1.00 0.00 H ATOM 1176 H LYS A 224 95.919 93.710 117.367 1.00 0.00 H ATOM 1177 N HIS A 225 97.585 90.082 117.887 1.00 18.19 N ATOM 1178 CA HIS A 225 96.933 88.823 118.271 1.00 20.22 C ATOM 1179 C HIS A 225 98.029 87.912 118.765 1.00 22.69 C ATOM 1180 O HIS A 225 99.050 87.793 118.086 1.00 27.42 O ATOM 1181 CB HIS A 225 96.216 88.223 117.048 1.00 19.32 C ATOM 1182 CG HIS A 225 95.599 86.871 117.279 1.00 22.92 C ATOM 1183 ND1 HIS A 225 95.666 85.861 116.346 1.00 33.79 N ATOM 1184 CD2 HIS A 225 94.885 86.379 118.320 1.00 21.46 C ATOM 1185 CE1 HIS A 225 95.029 84.795 116.809 1.00 22.75 C ATOM 1186 NE2 HIS A 225 94.553 85.081 118.009 1.00 23.04 N ATOM 1187 H HIS A 225 98.594 90.063 117.635 1.00 0.00 H ATOM 1188 N SER A 226 97.845 87.281 119.921 1.00 21.39 N ATOM 1189 CA SER A 226 98.758 86.227 120.373 1.00 22.47 C ATOM 1190 C SER A 226 97.948 84.963 120.609 1.00 19.43 C ATOM 1191 O SER A 226 97.053 84.932 121.470 1.00 20.92 O ATOM 1192 CB SER A 226 99.498 86.654 121.649 1.00 25.69 C ATOM 1193 OG SER A 226 100.357 85.624 122.145 1.00 27.85 O ATOM 1194 HG SER A 226 101.033 85.400 121.457 1.00 0.00 H ATOM 1195 H SER A 226 97.034 87.541 120.518 1.00 0.00 H ATOM 1196 N LYS A 227 98.274 83.898 119.874 1.00 20.58 N ATOM 1197 CA LYS A 227 97.593 82.626 120.092 1.00 23.39 C ATOM 1198 C LYS A 227 98.003 81.946 121.408 1.00 25.20 C ATOM 1199 O LYS A 227 99.180 81.853 121.745 1.00 26.38 O ATOM 1200 CB LYS A 227 97.877 81.700 118.890 1.00 25.51 C ATOM 1201 CG LYS A 227 97.092 80.418 118.908 1.00 37.76 C ATOM 1202 CD LYS A 227 96.863 79.938 117.476 1.00 48.75 C ATOM 1203 CE LYS A 227 95.898 78.757 117.414 1.00 42.36 C ATOM 1204 NZ LYS A 227 95.296 78.699 116.057 1.00 48.69 N ATOM 1205 HZ1 LYS A 227 94.783 79.584 115.869 1.00 0.00 H ATOM 1206 HZ2 LYS A 227 96.049 78.576 115.350 1.00 0.00 H ATOM 1207 HZ3 LYS A 227 94.636 77.896 116.006 1.00 0.00 H ATOM 1208 H LYS A 227 99.013 83.975 119.146 1.00 0.00 H ATOM 1209 N SER A 228 97.048 81.470 122.195 1.00 24.21 N ATOM 1210 CA SER A 228 97.417 80.667 123.336 1.00 21.41 C ATOM 1211 C SER A 228 98.198 79.400 122.912 1.00 30.36 C ATOM 1212 O SER A 228 97.814 78.730 121.966 1.00 27.18 O ATOM 1213 CB SER A 228 96.188 80.234 124.094 1.00 26.10 C ATOM 1214 OG SER A 228 96.531 79.115 124.895 1.00 27.22 O ATOM 1215 HG SER A 228 95.734 78.816 125.401 1.00 0.00 H ATOM 1216 H SER A 228 96.048 81.672 121.993 1.00 0.00 H ATOM 1217 N PRO A 229 99.285 79.063 123.623 1.00 26.72 N ATOM 1218 CA PRO A 229 100.071 77.889 123.221 1.00 28.48 C ATOM 1219 C PRO A 229 99.496 76.557 123.716 1.00 27.47 C ATOM 1220 O PRO A 229 99.929 75.481 123.277 1.00 30.98 O ATOM 1221 CB PRO A 229 101.432 78.170 123.869 1.00 20.04 C ATOM 1222 CG PRO A 229 101.097 78.891 125.109 1.00 30.22 C ATOM 1223 CD PRO A 229 99.944 79.809 124.716 1.00 23.54 C ATOM 1224 N ALA A 230 98.533 76.607 124.627 1.00 27.01 N ATOM 1225 CA ALA A 230 98.031 75.379 125.235 1.00 26.99 C ATOM 1226 C ALA A 230 96.724 75.639 125.951 1.00 29.39 C ATOM 1227 O ALA A 230 96.505 76.747 126.448 1.00 25.69 O ATOM 1228 CB ALA A 230 99.054 74.804 126.225 1.00 26.98 C ATOM 1229 H ALA A 230 98.134 77.525 124.909 1.00 0.00 H ATOM 1230 N LEU A 231 95.871 74.620 126.049 1.00 21.91 N ATOM 1231 CA LEU A 231 94.579 74.815 126.710 1.00 24.14 C ATOM 1232 C LEU A 231 94.688 75.373 128.130 1.00 22.74 C ATOM 1233 O LEU A 231 93.791 76.093 128.585 1.00 21.80 O ATOM 1234 CB LEU A 231 93.795 73.492 126.710 1.00 23.78 C ATOM 1235 CG LEU A 231 93.469 72.975 125.299 1.00 25.44 C ATOM 1236 CD1 LEU A 231 92.627 71.714 125.403 1.00 28.23 C ATOM 1237 CD2 LEU A 231 92.719 74.014 124.484 1.00 28.36 C ATOM 1238 H LEU A 231 96.122 73.690 125.658 1.00 0.00 H ATOM 1239 N SER A 232 95.785 75.069 128.840 1.00 22.69 N ATOM 1240 CA SER A 232 95.980 75.562 130.196 1.00 25.12 C ATOM 1241 C SER A 232 96.729 76.898 130.244 1.00 22.69 C ATOM 1242 O SER A 232 97.064 77.362 131.347 1.00 24.36 O ATOM 1243 CB SER A 232 96.765 74.533 131.022 1.00 24.99 C ATOM 1244 OG SER A 232 97.882 74.102 130.266 1.00 30.01 O ATOM 1245 HG SER A 232 98.459 74.879 130.060 1.00 0.00 H ATOM 1246 H SER A 232 96.515 74.465 128.411 1.00 0.00 H ATOM 1247 N SER A 233 97.012 77.469 129.081 1.00 22.41 N ATOM 1248 CA SER A 233 97.764 78.729 128.998 1.00 22.35 C ATOM 1249 C SER A 233 96.972 79.834 128.305 1.00 22.24 C ATOM 1250 O SER A 233 95.919 79.575 127.732 1.00 22.98 O ATOM 1251 CB SER A 233 99.062 78.516 128.250 1.00 26.03 C ATOM 1252 OG SER A 233 99.824 77.534 128.946 1.00 29.30 O ATOM 1253 HG SER A 233 99.312 76.688 128.986 1.00 0.00 H ATOM 1254 H SER A 233 96.693 77.012 128.203 1.00 0.00 H ATOM 1255 N TRP A 234 97.503 81.046 128.372 1.00 22.13 N ATOM 1256 CA TRP A 234 96.938 82.188 127.693 1.00 21.04 C ATOM 1257 C TRP A 234 97.876 82.722 126.631 1.00 19.15 C ATOM 1258 O TRP A 234 99.079 82.474 126.662 1.00 22.37 O ATOM 1259 CB TRP A 234 96.641 83.314 128.693 1.00 19.26 C ATOM 1260 CG TRP A 234 95.399 83.091 129.508 1.00 18.79 C ATOM 1261 CD1 TRP A 234 94.152 83.661 129.272 1.00 17.60 C ATOM 1262 CD2 TRP A 234 95.244 82.261 130.665 1.00 17.99 C ATOM 1263 NE1 TRP A 234 93.269 83.255 130.221 1.00 19.26 N ATOM 1264 CE2 TRP A 234 93.887 82.374 131.080 1.00 21.09 C ATOM 1265 CE3 TRP A 234 96.112 81.424 131.398 1.00 24.31 C ATOM 1266 CZ2 TRP A 234 93.371 81.696 132.189 1.00 19.27 C ATOM 1267 CZ3 TRP A 234 95.601 80.734 132.507 1.00 20.70 C ATOM 1268 CH2 TRP A 234 94.240 80.880 132.906 1.00 24.31 C ATOM 1269 HE1 TRP A 234 92.278 83.563 130.288 1.00 0.00 H ATOM 1270 H TRP A 234 98.365 81.181 128.939 1.00 0.00 H ATOM 1271 N GLY A 235 97.344 83.489 125.698 1.00 21.47 N ATOM 1272 CA GLY A 235 98.196 84.204 124.776 1.00 19.61 C ATOM 1273 C GLY A 235 99.048 85.192 125.553 1.00 18.69 C ATOM 1274 O GLY A 235 98.739 85.543 126.689 1.00 22.90 O ATOM 1275 H GLY A 235 96.310 83.579 125.626 1.00 0.00 H ATOM 1276 N ASP A 236 100.112 85.644 124.917 1.00 23.02 N ATOM 1277 CA ASP A 236 100.981 86.654 125.526 1.00 26.70 C ATOM 1278 C ASP A 236 100.261 87.972 125.607 1.00 25.15 C ATOM 1279 O ASP A 236 99.503 88.282 124.699 1.00 24.77 O ATOM 1280 CB ASP A 236 102.240 86.848 124.686 1.00 26.57 C ATOM 1281 CG ASP A 236 103.134 85.617 124.664 1.00 31.30 C ATOM 1282 OD1 ASP A 236 103.210 84.921 125.710 1.00 30.55 O ATOM 1283 OD2 ASP A 236 103.762 85.370 123.614 1.00 41.99 O ATOM 1284 H ASP A 236 100.337 85.278 123.970 1.00 0.00 H ATOM 1285 N PRO A 237 100.526 88.772 126.659 1.00 25.64 N ATOM 1286 CA PRO A 237 99.942 90.122 126.601 1.00 25.39 C ATOM 1287 C PRO A 237 100.336 90.824 125.304 1.00 22.63 C ATOM 1288 O PRO A 237 101.446 90.604 124.808 1.00 24.93 O ATOM 1289 CB PRO A 237 100.543 90.824 127.821 1.00 23.67 C ATOM 1290 CG PRO A 237 100.901 89.748 128.749 1.00 28.44 C ATOM 1291 CD PRO A 237 101.312 88.581 127.889 1.00 25.47 C ATOM 1292 N VAL A 238 99.442 91.626 124.719 1.00 18.71 N ATOM 1293 CA VAL A 238 99.793 92.373 123.534 1.00 18.58 C ATOM 1294 C VAL A 238 99.444 93.816 123.779 1.00 17.33 C ATOM 1295 O VAL A 238 98.421 94.131 124.408 1.00 20.25 O ATOM 1296 CB VAL A 238 99.124 91.855 122.224 1.00 22.18 C ATOM 1297 CG1 VAL A 238 99.616 90.444 121.949 1.00 22.61 C ATOM 1298 CG2 VAL A 238 97.593 91.847 122.279 1.00 19.87 C ATOM 1299 H VAL A 238 98.486 91.713 125.120 1.00 0.00 H ATOM 1300 N LEU A 239 100.351 94.695 123.336 1.00 19.46 N ATOM 1301 CA LEU A 239 100.178 96.132 123.486 1.00 19.59 C ATOM 1302 C LEU A 239 100.285 96.779 122.112 1.00 23.52 C ATOM 1303 O LEU A 239 101.358 96.825 121.509 1.00 23.79 O ATOM 1304 CB LEU A 239 101.218 96.712 124.445 1.00 23.92 C ATOM 1305 CG LEU A 239 101.133 98.215 124.721 1.00 26.65 C ATOM 1306 CD1 LEU A 239 99.763 98.602 125.193 1.00 29.63 C ATOM 1307 CD2 LEU A 239 102.166 98.567 125.779 1.00 31.23 C ATOM 1308 H LEU A 239 101.209 94.339 122.868 1.00 0.00 H ATOM 1309 N LEU A 240 99.146 97.222 121.586 1.00 20.77 N ATOM 1310 CA LEU A 240 99.049 97.787 120.271 1.00 20.85 C ATOM 1311 C LEU A 240 99.132 99.290 120.432 1.00 18.69 C ATOM 1312 O LEU A 240 98.391 99.847 121.259 1.00 20.26 O ATOM 1313 CB LEU A 240 97.713 97.417 119.632 1.00 18.65 C ATOM 1314 CG LEU A 240 97.324 98.024 118.311 1.00 16.87 C ATOM 1315 CD1 LEU A 240 98.360 97.678 117.204 1.00 17.09 C ATOM 1316 CD2 LEU A 240 95.911 97.479 117.938 1.00 17.35 C ATOM 1317 H LEU A 240 98.280 97.155 122.158 1.00 0.00 H ATOM 1318 N LYS A 241 100.047 99.942 119.706 1.00 22.17 N ATOM 1319 CA LYS A 241 100.073 101.400 119.690 1.00 19.86 C ATOM 1320 C LYS A 241 99.854 101.851 118.288 1.00 18.96 C ATOM 1321 O LYS A 241 100.555 101.429 117.403 1.00 25.53 O ATOM 1322 CB LYS A 241 101.388 101.978 120.202 1.00 23.31 C ATOM 1323 CG LYS A 241 101.841 101.425 121.507 1.00 26.87 C ATOM 1324 CD LYS A 241 103.266 101.899 121.840 1.00 40.82 C ATOM 1325 CE LYS A 241 103.439 103.396 121.508 1.00 47.44 C ATOM 1326 NZ LYS A 241 102.399 104.317 122.128 1.00 47.98 N ATOM 1327 HZ1 LYS A 241 101.453 104.045 121.793 1.00 0.00 H ATOM 1328 HZ2 LYS A 241 102.438 104.235 123.164 1.00 0.00 H ATOM 1329 HZ3 LYS A 241 102.597 105.299 121.849 1.00 0.00 H ATOM 1330 H LYS A 241 100.744 99.406 119.150 1.00 0.00 H ATOM 1331 N THR A 242 98.856 102.700 118.083 1.00 17.82 N ATOM 1332 CA THR A 242 98.425 103.019 116.730 1.00 19.18 C ATOM 1333 C THR A 242 98.085 104.479 116.640 1.00 17.45 C ATOM 1334 O THR A 242 97.367 105.014 117.499 1.00 20.04 O ATOM 1335 CB THR A 242 97.165 102.180 116.334 1.00 21.96 C ATOM 1336 OG1 THR A 242 97.459 100.781 116.414 1.00 25.94 O ATOM 1337 CG2 THR A 242 96.695 102.513 114.919 1.00 26.71 C ATOM 1338 HG1 THR A 242 96.655 100.261 116.162 1.00 0.00 H ATOM 1339 H THR A 242 98.378 103.141 118.895 1.00 0.00 H ATOM 1340 N ASP A 243 98.556 105.151 115.574 1.00 19.86 N ATOM 1341 CA ASP A 243 98.164 106.510 115.301 1.00 17.29 C ATOM 1342 C ASP A 243 96.949 106.439 114.393 1.00 21.25 C ATOM 1343 O ASP A 243 97.021 105.847 113.303 1.00 25.40 O ATOM 1344 CB ASP A 243 99.291 107.339 114.628 1.00 20.27 C ATOM 1345 CG ASP A 243 100.421 107.669 115.592 1.00 32.76 C ATOM 1346 OD1 ASP A 243 100.157 107.859 116.800 1.00 27.92 O ATOM 1347 OD2 ASP A 243 101.575 107.758 115.137 1.00 45.72 O ATOM 1348 H ASP A 243 99.221 104.677 114.930 1.00 0.00 H ATOM 1349 N VAL A 244 95.844 106.990 114.862 1.00 16.41 N ATOM 1350 CA VAL A 244 94.554 106.945 114.184 1.00 15.04 C ATOM 1351 C VAL A 244 94.282 108.294 113.561 1.00 14.80 C ATOM 1352 O VAL A 244 94.325 109.341 114.202 1.00 14.32 O ATOM 1353 CB VAL A 244 93.416 106.556 115.195 1.00 14.32 C ATOM 1354 CG1 VAL A 244 92.005 106.667 114.540 1.00 16.50 C ATOM 1355 CG2 VAL A 244 93.680 105.141 115.662 1.00 17.87 C ATOM 1356 H VAL A 244 95.898 107.488 115.773 1.00 0.00 H ATOM 1357 N PRO A 245 93.997 108.309 112.253 1.00 15.41 N ATOM 1358 CA PRO A 245 93.733 109.603 111.614 1.00 13.51 C ATOM 1359 C PRO A 245 92.424 110.213 112.071 1.00 16.48 C ATOM 1360 O PRO A 245 91.460 109.447 112.249 1.00 18.39 O ATOM 1361 CB PRO A 245 93.656 109.252 110.117 1.00 16.03 C ATOM 1362 CG PRO A 245 93.220 107.815 110.114 1.00 17.57 C ATOM 1363 CD PRO A 245 93.828 107.158 111.339 1.00 16.07 C ATOM 1364 N LEU A 246 92.409 111.521 112.325 1.00 13.99 N ATOM 1365 CA LEU A 246 91.192 112.208 112.737 1.00 15.43 C ATOM 1366 C LEU A 246 90.499 112.840 111.556 1.00 18.56 C ATOM 1367 O LEU A 246 91.168 113.376 110.651 1.00 23.19 O ATOM 1368 CB LEU A 246 91.463 113.291 113.784 1.00 18.89 C ATOM 1369 CG LEU A 246 91.680 112.710 115.190 1.00 19.76 C ATOM 1370 CD1 LEU A 246 91.937 113.850 116.131 1.00 23.06 C ATOM 1371 CD2 LEU A 246 90.475 111.842 115.627 1.00 21.54 C ATOM 1372 H LEU A 246 93.289 112.066 112.227 1.00 0.00 H ATOM 1373 N SER A 247 89.167 112.825 111.582 1.00 15.64 N ATOM 1374 CA SER A 247 88.357 113.583 110.630 1.00 19.72 C ATOM 1375 C SER A 247 88.306 115.030 111.010 1.00 19.48 C ATOM 1376 O SER A 247 88.423 115.377 112.203 1.00 22.51 O ATOM 1377 CB SER A 247 86.934 113.060 110.588 1.00 24.16 C ATOM 1378 OG SER A 247 86.957 111.675 110.468 1.00 32.84 O ATOM 1379 HG SER A 247 87.427 111.425 109.634 1.00 0.00 H ATOM 1380 H SER A 247 88.686 112.253 112.306 1.00 0.00 H ATOM 1381 N SER A 248 88.080 115.878 109.997 1.00 24.51 N ATOM 1382 CA SER A 248 87.999 117.311 110.239 1.00 30.37 C ATOM 1383 C SER A 248 86.830 117.981 109.510 1.00 29.15 C ATOM 1384 O SER A 248 86.196 117.362 108.651 1.00 29.14 O ATOM 1385 CB SER A 248 89.323 117.961 109.822 1.00 31.49 C ATOM 1386 OG SER A 248 89.204 119.363 109.828 1.00 50.49 O ATOM 1387 HG SER A 248 90.066 119.767 109.557 1.00 0.00 H ATOM 1388 H SER A 248 87.962 115.510 109.032 1.00 0.00 H ATOM 1389 N ALA A 249 86.547 119.221 109.916 1.00 32.76 N ATOM 1390 CA ALA A 249 85.829 120.260 109.149 1.00 42.66 C ATOM 1391 C ALA A 249 84.425 120.415 109.667 1.00 40.66 C ATOM 1392 O ALA A 249 84.207 121.183 110.598 1.00 39.20 O ATOM 1393 CB ALA A 249 85.816 119.984 107.639 1.00 43.39 C ATOM 1394 H ALA A 249 86.865 119.483 110.871 1.00 0.00 H TER 1395 ALA A 249 HETATM 1396 O HOH 1 83.898 76.407 131.456 1.00 33.98 O HETATM 1397 O HOH 2 94.592 112.989 127.108 1.00 30.67 O HETATM 1398 O HOH 3 74.769 96.098 124.674 1.00 37.71 O HETATM 1399 O HOH 4 98.422 96.603 136.580 1.00 27.04 O HETATM 1400 O HOH 5 92.750 103.171 134.895 1.00 33.38 O HETATM 1401 O HOH 6 84.532 101.217 132.348 1.00 49.62 O HETATM 1402 O HOH 7 73.050 83.890 117.979 1.00 26.77 O HETATM 1403 O HOH 8 97.941 89.317 132.542 1.00 26.76 O HETATM 1404 O HOH 9 77.955 96.413 111.917 1.00 35.80 O HETATM 1405 O HOH 10 92.637 113.797 123.000 1.00 40.60 O HETATM 1406 O HOH 11 95.941 88.330 108.038 1.00 42.15 O HETATM 1407 O HOH 12 92.944 87.103 105.909 1.00 46.64 O HETATM 1408 O HOH 13 69.863 82.696 120.320 1.00 23.41 O HETATM 1409 O HOH 14 88.705 85.860 107.959 1.00 42.57 O HETATM 1410 O HOH 15 100.018 75.475 130.713 1.00 41.38 O HETATM 1411 O HOH 16 94.615 114.176 119.295 1.00 22.90 O HETATM 1412 O HOH 17 76.274 93.172 110.417 1.00 38.97 O HETATM 1413 O HOH 18 95.331 111.869 131.181 1.00 27.57 O HETATM 1414 O HOH 19 81.415 105.246 105.503 1.00 40.68 O HETATM 1415 O HOH 20 102.613 93.036 129.965 1.00 28.21 O HETATM 1416 O HOH 21 87.516 99.089 135.951 1.00 35.99 O HETATM 1417 O HOH 22 99.979 110.817 123.335 1.00 34.14 O HETATM 1418 O HOH 23 89.534 116.734 114.140 1.00 28.40 O HETATM 1419 O HOH 24 88.929 109.067 112.776 1.00 26.76 O HETATM 1420 O HOH 25 90.977 85.467 109.805 1.00 36.92 O HETATM 1421 O HOH 26 100.668 105.824 118.365 1.00 29.77 O HETATM 1422 O HOH 27 75.916 82.739 121.978 1.00 13.34 O HETATM 1423 O HOH 28 78.894 84.918 123.549 1.00 13.21 O HETATM 1424 O HOH 29 91.843 75.477 130.258 1.00 28.12 O HETATM 1425 O HOH 30 99.219 91.555 132.248 1.00 35.47 O HETATM 1426 O HOH 31 102.244 85.396 120.303 1.00 41.27 O HETATM 1427 O HOH 32 85.699 82.585 111.126 1.00 43.54 O HETATM 1428 O HOH 33 91.251 83.293 134.783 1.00 37.40 O HETATM 1429 O HOH 34 78.867 100.341 109.607 1.00 37.96 O HETATM 1430 O HOH 35 86.269 106.456 129.922 1.00 41.73 O HETATM 1431 O HOH 36 78.816 86.653 132.094 1.00 24.72 O HETATM 1432 O HOH 37 73.792 98.203 110.690 1.00 42.40 O HETATM 1433 O HOH 38 93.857 78.640 121.639 1.00 38.24 O HETATM 1434 O HOH 39 87.702 78.769 121.080 1.00 23.65 O HETATM 1435 O HOH 40 88.529 90.631 107.439 1.00 31.96 O HETATM 1436 O HOH 41 77.503 85.062 116.576 1.00 17.39 O HETATM 1437 O HOH 42 93.710 81.612 116.901 1.00 32.55 O HETATM 1438 O HOH 43 79.921 80.954 131.270 1.00 18.38 O HETATM 1439 O HOH 44 88.030 98.528 110.668 1.00 21.98 O HETATM 1440 O HOH 45 77.525 92.454 128.357 1.00 34.84 O HETATM 1441 O HOH 46 76.518 80.087 122.033 1.00 13.60 O HETATM 1442 O HOH 47 101.704 82.474 126.006 1.00 31.34 O HETATM 1443 O HOH 48 88.043 109.319 109.688 1.00 40.71 O HETATM 1444 O HOH 49 93.247 84.170 135.122 1.00 35.64 O HETATM 1445 O HOH 50 75.344 84.158 129.405 1.00 28.74 O HETATM 1446 O HOH 51 73.325 94.720 122.545 1.00 20.51 O HETATM 1447 O HOH 52 73.711 88.040 127.262 1.00 32.35 O HETATM 1448 O HOH 53 84.736 80.967 118.343 1.00 34.76 O HETATM 1449 O HOH 54 82.905 110.601 126.847 1.00 25.67 O HETATM 1450 O HOH 55 78.968 107.967 110.089 1.00 22.38 O HETATM 1451 O HOH 56 94.844 93.689 110.550 1.00 33.71 O HETATM 1452 O HOH 57 92.055 94.678 106.981 1.00 30.59 O HETATM 1453 O HOH 58 85.320 94.577 136.228 1.00 39.56 O HETATM 1454 O HOH 59 80.716 79.338 129.132 1.00 18.47 O HETATM 1455 O HOH 60 70.677 79.297 125.912 1.00 19.54 O HETATM 1456 O HOH 61 91.711 115.298 108.719 1.00 27.39 O HETATM 1457 O HOH 62 82.376 85.952 106.379 1.00 32.92 O HETATM 1458 O HOH 63 91.932 107.205 133.797 1.00 16.41 O HETATM 1459 O HOH 64 101.990 98.429 118.393 1.00 26.35 O HETATM 1460 O HOH 65 81.980 88.824 106.672 1.00 26.82 O HETATM 1461 O HOH 66 98.174 87.306 128.784 1.00 22.91 O HETATM 1462 O HOH 67 75.164 91.779 127.507 1.00 41.36 O HETATM 1463 O HOH 68 77.301 89.082 110.804 1.00 21.28 O HETATM 1464 O HOH 69 90.272 84.727 123.563 1.00 15.47 O HETATM 1465 O HOH 70 82.110 77.546 117.670 1.00 20.28 O HETATM 1466 O HOH 71 71.427 96.216 115.775 1.00 21.57 O HETATM 1467 O HOH 72 85.761 108.401 109.964 1.00 25.92 O HETATM 1468 O HOH 73 85.221 96.834 132.909 1.00 37.85 O HETATM 1469 O HOH 74 97.488 106.981 124.375 1.00 21.34 O HETATM 1470 O HOH 75 96.248 104.187 133.772 1.00 35.34 O HETATM 1471 O HOH 76 82.376 90.378 131.606 1.00 20.17 O HETATM 1472 O HOH 77 95.173 112.725 109.647 1.00 20.44 O HETATM 1473 O HOH 78 89.905 116.473 120.837 1.00 31.95 O HETATM 1474 O HOH 79 91.867 77.967 134.826 1.00 27.96 O HETATM 1475 O HOH 80 71.989 88.520 124.089 1.00 33.22 O HETATM 1476 O HOH 81 89.163 109.990 124.731 1.00 24.80 O HETATM 1477 O HOH 82 97.055 72.224 128.292 1.00 31.68 O HETATM 1478 O HOH 83 85.855 97.938 130.592 1.00 30.79 O HETATM 1479 O HOH 84 81.704 83.396 110.258 1.00 25.27 O HETATM 1480 O HOH 85 101.433 109.801 118.466 1.00 40.53 O HETATM 1481 O HOH 86 91.453 76.234 137.940 1.00 31.89 O HETATM 1482 O HOH 87 84.822 79.092 136.146 1.00 37.46 O HETATM 1483 O HOH 88 71.721 93.943 114.198 1.00 26.69 O HETATM 1484 O HOH 89 99.621 81.436 130.300 1.00 29.59 O HETATM 1485 O HOH 90 79.488 109.369 112.627 1.00 23.30 O HETATM 1486 O HOH 91 102.800 93.846 122.043 1.00 31.20 O HETATM 1487 O HOH 92 75.594 82.900 118.565 1.00 20.15 O HETATM 1488 O HOH 93 98.812 96.590 113.242 1.00 29.46 O HETATM 1489 O HOH 94 82.212 92.195 134.017 1.00 46.67 O HETATM 1490 O HOH 95 78.928 96.417 129.015 1.00 21.17 O HETATM 1491 O HOH 96 76.098 83.033 115.055 1.00 17.59 O HETATM 1492 O HOH 97 83.124 94.744 104.381 1.00 42.34 O HETATM 1493 O HOH 98 84.711 98.175 128.510 1.00 29.00 O HETATM 1494 O HOH 99 72.593 98.666 123.699 1.00 28.51 O HETATM 1495 O HOH 100 86.497 110.682 126.160 1.00 28.87 O HETATM 1496 O HOH 101 99.491 78.708 132.327 1.00 43.14 O HETATM 1497 O HOH 102 100.474 110.184 129.660 1.00 34.17 O HETATM 1498 O HOH 103 99.936 90.265 116.118 1.00 33.74 O HETATM 1499 O HOH 104 95.128 76.903 123.539 1.00 36.99 O HETATM 1500 O HOH 105 100.693 84.011 118.181 1.00 29.70 O HETATM 1501 O HOH 106 96.890 72.027 125.038 1.00 28.58 O HETATM 1502 O HOH 107 89.899 77.751 119.991 1.00 23.13 O HETATM 1503 O HOH 108 82.259 77.607 111.984 1.00 40.48 O HETATM 1504 O HOH 109 80.177 91.420 130.206 1.00 31.91 O HETATM 1505 O HOH 110 91.443 110.779 125.767 1.00 26.26 O HETATM 1506 O HOH 111 81.781 113.876 124.080 1.00 23.64 O HETATM 1507 O HOH 112 100.349 84.200 128.816 1.00 35.70 O HETATM 1508 O HOH 113 103.943 98.225 122.061 1.00 37.20 O HETATM 1509 O HOH 114 83.908 88.217 134.157 1.00 28.47 O HETATM 1510 O HOH 115 100.422 96.678 131.846 1.00 34.12 O HETATM 1511 O HOH 116 72.390 89.210 117.452 1.00 18.01 O HETATM 1512 O HOH 117 78.248 76.560 111.983 1.00 33.04 O HETATM 1513 O HOH 118 90.471 112.940 122.868 1.00 36.81 O HETATM 1514 O HOH 119 98.931 103.873 112.021 1.00 34.18 O HETATM 1515 O HOH 120 75.815 101.303 118.969 1.00 31.03 O HETATM 1516 O HOH 121 87.033 100.342 131.952 1.00 34.53 O HETATM 1517 O HOH 122 87.114 79.480 118.083 1.00 39.72 O HETATM 1518 O HOH 123 87.691 106.757 112.032 1.00 32.57 O HETATM 1519 O HOH 124 77.667 105.514 116.848 1.00 10.01 O HETATM 1520 O HOH 125 82.547 79.965 115.944 1.00 26.23 O HETATM 1521 O HOH 126 78.473 94.510 130.597 1.00 40.36 O HETATM 1522 O HOH 127 77.315 106.187 120.970 1.00 33.28 O HETATM 1523 O HOH 128 75.192 90.891 111.490 1.00 25.72 O HETATM 1524 O HOH 129 92.923 75.657 132.833 1.00 37.15 O HETATM 1525 O HOH 130 68.788 86.380 123.221 1.00 25.41 O HETATM 1526 O HOH 131 70.739 82.447 117.512 1.00 37.42 O HETATM 1527 O HOH 132 71.374 98.047 113.545 1.00 32.85 O HETATM 1528 O HOH 133 75.896 98.180 110.280 1.00 43.94 O HETATM 1529 O HOH 134 100.594 103.302 113.692 1.00 40.63 O HETATM 1530 O HOH 135 101.473 98.256 130.263 1.00 40.47 O HETATM 1531 O HOH 136 81.639 77.012 130.595 1.00 32.87 O HETATM 1532 O HOH 137 80.673 111.538 109.741 1.00 30.25 O HETATM 1533 O HOH 138 83.438 81.768 111.114 1.00 43.74 O HETATM 1534 O HOH 139 78.676 90.524 108.738 1.00 29.12 O HETATM 1535 O HOH 140 80.986 80.984 133.672 1.00 42.63 O HETATM 1536 O HOH 141 72.471 97.504 126.120 1.00 40.13 O HETATM 1537 O HOH 142 72.540 96.983 121.504 1.00 24.83 O HETATM 1538 O HOH 143 101.121 95.217 133.756 1.00 46.84 O HETATM 1539 O HOH 144 77.586 83.720 109.521 1.00 38.85 O HETATM 1540 O HOH 145 106.464 84.579 127.280 1.00 38.57 O HETATM 1541 O HOH 146 83.525 90.273 105.081 1.00 32.62 O HETATM 1542 O HOH 147 68.497 83.879 126.635 1.00 50.47 O HETATM 1543 O HOH 148 74.271 97.869 128.328 1.00 44.11 O HETATM 1544 O HOH 149 73.683 84.563 116.123 1.00 35.66 O HETATM 1545 O HOH 150 98.869 71.889 123.383 1.00 46.07 O HETATM 1546 O HOH 151 76.514 86.480 130.507 1.00 33.14 O HETATM 1547 O HOH 152 69.251 86.039 125.839 1.00 40.22 O HETATM 1548 O HOH 153 96.938 96.162 110.758 1.00 39.91 O HETATM 1549 O HOH 154 79.373 89.440 106.415 1.00 39.38 O HETATM 1550 O HOH 155 102.620 106.251 111.629 1.00 33.67 O HETATM 1551 O HOH 156 93.631 105.492 135.337 1.00 25.90 O HETATM 1552 O HOH 157 79.793 82.780 108.530 1.00 44.39 O HETATM 1553 O HOH 158 84.624 77.852 118.506 1.00 33.48 O HETATM 1554 O HOH 159 74.703 86.275 116.894 1.00 33.78 O HETATM 1555 O HOH 160 104.290 99.242 119.535 1.00 44.04 O HETATM 1556 O HOH 161 72.466 89.968 112.838 1.00 32.97 O HETATM 1557 O HOH 162 80.185 109.445 108.253 1.00 30.36 O HETATM 1558 O HOH 163 91.830 117.490 113.247 1.00 36.01 O HETATM 1559 O HOH 164 97.284 116.502 118.280 1.00 43.32 O HETATM 1560 O HOH 165 83.216 98.906 130.396 1.00 41.70 O HETATM 1561 O HOH 166 77.146 80.283 131.587 1.00 26.07 O HETATM 1562 O HOH 167 99.775 86.421 130.904 1.00 39.68 O HETATM 1563 O HOH 168 70.665 91.527 114.319 1.00 27.88 O HETATM 1564 O HOH 169 72.004 87.782 113.422 1.00 37.29 O HETATM 1565 O HOH 170 73.459 87.699 115.753 1.00 27.52 O HETATM 1566 O HOH 171 101.365 81.705 117.507 1.00 43.04 O HETATM 1567 O HOH 172 76.390 87.088 109.023 1.00 30.23 O HETATM 1568 O HOH 173 75.156 93.962 126.835 1.00 33.74 O HETATM 1569 O HOH 174 71.467 100.335 127.579 1.00 32.44 O HETATM 1570 O HOH 175 83.787 74.518 133.213 1.00 35.17 O HETATM 1571 O HOH 176 87.488 88.137 103.832 1.00 49.73 O HETATM 1572 O HOH 177 70.016 89.705 122.603 1.00 38.71 O HETATM 1573 O HOH 178 82.288 92.127 103.942 1.00 38.17 O HETATM 1574 O HOH 179 75.556 82.031 130.900 1.00 37.53 O HETATM 1575 O HOH 180 85.299 88.434 103.619 1.00 49.71 O HETATM 1576 O HOH 181 99.198 115.047 119.400 1.00 45.45 O HETATM 1577 O HOH 182 106.274 82.207 128.480 1.00 40.51 O HETATM 1578 O HOH 183 70.016 89.705 116.289 1.00 21.81 O HETATM 1579 O HOH 184 79.944 76.860 132.931 1.00 48.42 O HETATM 1580 O HOH 185 77.781 87.058 106.503 1.00 43.33 O HETATM 1581 O HOH 186 84.484 89.771 100.885 1.00 53.19 O HETATM 1582 C8 LEC A 187 87.698 77.376 137.833 1.00 0.03 C HETATM 1583 C7 LEC A 187 88.439 78.085 136.730 1.00 0.17 C HETATM 1584 O7 LEC A 187 89.666 78.058 136.622 1.00 -0.40 O HETATM 1585 N2 LEC A 187 87.665 78.770 135.849 1.00 -0.28 N HETATM 1586 C2 LEC A 187 88.275 79.448 134.706 1.00 0.13 C HETATM 1587 C3 LEC A 187 87.719 80.856 134.458 1.00 0.12 C HETATM 1588 O3 LEC A 187 88.374 81.695 135.413 1.00 -0.34 O HETATM 1589 C1 LEC A 187 87.490 81.957 136.467 1.00 0.19 C HETATM 1590 C2 LEC A 187 88.359 82.556 137.568 1.00 0.12 C HETATM 1591 C3 LEC A 187 87.532 83.277 138.625 1.00 0.11 C HETATM 1592 C4 LEC A 187 86.408 84.111 138.010 1.00 0.11 C HETATM 1593 C5 LEC A 187 85.645 83.365 136.916 1.00 0.11 C HETATM 1594 C6 LEC A 187 84.747 84.322 136.145 1.00 0.07 C HETATM 1595 O6 LEC A 187 85.560 85.322 135.555 1.00 -0.39 O HETATM 1596 H31 LEC A 187 86.027 85.791 136.236 1.00 0.21 H HETATM 1597 H23 LEC A 187 84.025 84.788 136.831 1.00 0.06 H HETATM 1598 H24 LEC A 187 84.206 83.773 135.361 1.00 0.06 H HETATM 1599 O5 LEC A 187 86.547 82.863 135.966 1.00 -0.34 O HETATM 1600 H22 LEC A 187 85.054 82.552 137.363 1.00 0.06 H HETATM 1601 O4 LEC A 187 87.010 85.263 137.456 1.00 -0.39 O HETATM 1602 H30 LEC A 187 86.337 85.828 137.095 1.00 0.21 H HETATM 1603 H21 LEC A 187 85.699 84.401 138.800 1.00 0.06 H HETATM 1604 O3 LEC A 187 88.407 84.129 139.338 1.00 -0.39 O HETATM 1605 H29 LEC A 187 88.775 84.772 138.744 1.00 0.21 H HETATM 1606 H20 LEC A 187 87.092 82.536 139.309 1.00 0.06 H HETATM 1607 N2 LEC A 187 89.167 81.501 138.183 1.00 -0.28 N HETATM 1608 C7 LEC A 187 90.483 81.385 137.984 1.00 0.17 C HETATM 1609 C8 LEC A 187 91.209 80.614 139.053 1.00 0.03 C HETATM 1610 H25 LEC A 187 92.281 80.569 138.809 1.00 0.05 H HETATM 1611 H26 LEC A 187 90.802 79.593 139.109 1.00 0.05 H HETATM 1612 H27 LEC A 187 91.075 81.116 140.023 1.00 0.05 H HETATM 1613 O7 LEC A 187 91.103 81.847 137.004 1.00 -0.40 O HETATM 1614 H28 LEC A 187 88.714 80.838 138.779 1.00 0.19 H HETATM 1615 H19 LEC A 187 89.036 83.290 137.108 1.00 0.06 H HETATM 1616 H18 LEC A 187 86.991 81.043 136.822 1.00 0.09 H HETATM 1617 C4 LEC A 187 88.208 81.390 133.118 1.00 0.11 C HETATM 1618 O4 LEC A 187 87.523 82.609 132.807 1.00 -0.39 O HETATM 1619 H8 LEC A 187 87.830 82.939 131.971 1.00 0.21 H HETATM 1620 C5 LEC A 187 87.872 80.437 132.000 1.00 0.11 C HETATM 1621 C6 LEC A 187 88.376 80.946 130.656 1.00 0.07 C HETATM 1622 O6 LEC A 187 89.817 81.140 130.627 1.00 -0.39 O HETATM 1623 H12 LEC A 187 90.063 81.776 131.288 1.00 0.21 H HETATM 1624 H10 LEC A 187 87.888 81.908 130.440 1.00 0.06 H HETATM 1625 H11 LEC A 187 88.105 80.215 129.880 1.00 0.06 H HETATM 1626 O5 LEC A 187 88.600 79.232 132.271 1.00 -0.34 O HETATM 1627 C1 LEC A 187 88.127 78.600 133.451 1.00 0.21 C HETATM 1628 O1 LEC A 187 88.974 77.460 133.620 1.00 -0.28 O HETATM 1629 C1' LEC A 187 88.762 76.299 132.916 1.00 0.10 C HETATM 1630 C2' LEC A 187 89.449 75.184 133.341 1.00 -0.02 C HETATM 1631 C3' LEC A 187 89.253 73.977 132.681 1.00 -0.03 C HETATM 1632 C4' LEC A 187 88.365 73.924 131.625 1.00 0.19 C HETATM 1633 N1' LEC A 187 88.170 72.686 130.972 1.00 0.31 N HETATM 1634 O2' LEC A 187 88.835 71.601 131.465 1.00 0.17 O HETATM 1635 O1' LEC A 187 87.309 72.681 129.899 1.00 0.17 O HETATM 1636 C5' LEC A 187 87.658 75.032 131.192 1.00 -0.03 C HETATM 1637 C6' LEC A 187 87.861 76.247 131.844 1.00 -0.02 C HETATM 1638 H17 LEC A 187 87.330 77.138 131.527 1.00 0.06 H HETATM 1639 H16 LEC A 187 86.962 74.957 130.364 1.00 0.07 H HETATM 1640 H15 LEC A 187 89.790 73.088 132.991 1.00 0.07 H HETATM 1641 H14 LEC A 187 90.133 75.247 134.179 1.00 0.06 H HETATM 1642 H13 LEC A 187 87.075 78.305 133.325 1.00 0.10 H HETATM 1643 H9 LEC A 187 86.788 80.255 131.961 1.00 0.06 H HETATM 1644 H7 LEC A 187 89.294 81.557 133.163 1.00 0.06 H HETATM 1645 H6 LEC A 187 86.622 80.882 134.539 1.00 0.06 H HETATM 1646 H5 LEC A 187 89.349 79.552 134.922 1.00 0.06 H HETATM 1647 H4 LEC A 187 86.675 78.811 135.982 1.00 0.19 H HETATM 1648 H1 LEC A 187 86.618 77.547 137.718 1.00 0.05 H HETATM 1649 H2 LEC A 187 88.029 77.766 138.807 1.00 0.05 H HETATM 1650 H3 LEC A 187 87.906 76.297 137.780 1.00 0.05 H CONECT 1 2 6 7 8 CONECT 6 1 CONECT 7 1 CONECT 8 1 CONECT 1582 1583 1648 1649 1650 CONECT 1583 1582 1584 1585 CONECT 1584 1583 CONECT 1585 1583 1586 1647 CONECT 1586 1585 1587 1627 1646 CONECT 1587 1586 1588 1617 1645 CONECT 1588 1587 1589 CONECT 1589 1588 1590 1599 1616 CONECT 1590 1589 1591 1607 1615 CONECT 1591 1590 1592 1604 1606 CONECT 1592 1591 1593 1601 1603 CONECT 1593 1592 1594 1599 1600 CONECT 1594 1593 1595 1597 1598 CONECT 1595 1594 1596 CONECT 1596 1595 CONECT 1597 1594 CONECT 1598 1594 CONECT 1599 1589 1593 CONECT 1600 1593 CONECT 1601 1592 1602 CONECT 1602 1601 CONECT 1603 1592 CONECT 1604 1591 1605 CONECT 1605 1604 CONECT 1606 1591 CONECT 1607 1590 1608 1614 CONECT 1608 1607 1609 1613 CONECT 1609 1608 1610 1611 1612 CONECT 1610 1609 CONECT 1611 1609 CONECT 1612 1609 CONECT 1613 1608 CONECT 1614 1607 CONECT 1615 1590 CONECT 1616 1589 CONECT 1617 1587 1618 1620 1644 CONECT 1618 1617 1619 CONECT 1619 1618 CONECT 1620 1617 1621 1626 1643 CONECT 1621 1620 1622 1624 1625 CONECT 1622 1621 1623 CONECT 1623 1622 CONECT 1624 1621 CONECT 1625 1621 CONECT 1626 1620 1627 CONECT 1627 1586 1626 1628 1642 CONECT 1628 1627 1629 CONECT 1629 1628 1630 1637 CONECT 1630 1629 1631 1641 CONECT 1631 1630 1632 1640 CONECT 1632 1631 1633 1636 CONECT 1633 1632 1634 1635 CONECT 1634 1633 CONECT 1635 1633 CONECT 1636 1632 1637 1639 CONECT 1637 1629 1636 1638 CONECT 1638 1637 CONECT 1639 1636 CONECT 1640 1631 CONECT 1641 1630 CONECT 1642 1627 CONECT 1643 1620 CONECT 1644 1617 CONECT 1645 1587 CONECT 1646 1586 CONECT 1647 1585 CONECT 1648 1582 CONECT 1649 1582 CONECT 1650 1582 MASTER 0 0 0 0 0 0 0 0 1649 1 73 12 END
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Related entries of code: 5ggo
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
5ggj
RCSB PDB
PDBbind
164aa, >5GGJ_1|Chains... *
5ggk
RCSB PDB
PDBbind
164aa, >5GGK_1|Chains... at 100%
5ggl
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164aa, >5GGL_1|Chains... at 100%
5ggn
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164aa, >5GGN_1|Chains... at 100%
5ggp
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PDBbind
164aa, >5GGP_1|Chains... at 100%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
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PDBbind
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PDBbind
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1y3n
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PDBbind
2-mer
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PDBbind
2-mer
2igw
RCSB PDB
PDBbind
2-mer
2r1x
RCSB PDB
PDBbind
2-mer
2r1y
RCSB PDB
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2-mer
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RCSB PDB
PDBbind
2-mer
2rkm
RCSB PDB
PDBbind
2-mer
2rok
RCSB PDB
PDBbind
2-mer
2tpi
RCSB PDB
PDBbind
2-mer
2vl1
RCSB PDB
PDBbind
2-mer
2wly
RCSB PDB
PDBbind
2-mer
2wlz
RCSB PDB
PDBbind
2-mer
2wyn
RCSB PDB
PDBbind
2-mer
3bbb
RCSB PDB
PDBbind
2-mer
3bpc
RCSB PDB
PDBbind
2-mer
3gss
RCSB PDB
PDBbind
2-mer
3ijy
RCSB PDB
PDBbind
2-mer
3ikc
RCSB PDB
PDBbind
2-mer
3ng4
RCSB PDB
PDBbind
2-mer
3oy8
RCSB PDB
PDBbind
2-mer
3qlb
RCSB PDB
PDBbind
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PDBbind
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PDBbind
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PDBbind
2-mer
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4cd8
RCSB PDB
PDBbind
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RCSB PDB
PDBbind
2-mer
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PDBbind
2-mer
4k3l
RCSB PDB
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4lk7
RCSB PDB
PDBbind
2-mer
4lkk
RCSB PDB
PDBbind
2-mer
4nku
RCSB PDB
PDBbind
2-mer
4oak
RCSB PDB
PDBbind
2-mer
4oel
RCSB PDB
PDBbind
2-mer
4oem
RCSB PDB
PDBbind
2-mer
4qfl
RCSB PDB
PDBbind
2-mer
4qfn
RCSB PDB
PDBbind
2-mer
4qfo
RCSB PDB
PDBbind
2-mer
4qfp
RCSB PDB
PDBbind
2-mer
4v27
RCSB PDB
PDBbind
2-mer
4x6h
RCSB PDB
PDBbind
2-mer
4yw2
RCSB PDB
PDBbind
2-mer
5gub
RCSB PDB
PDBbind
2-mer
5gx6
RCSB PDB
PDBbind
2-mer
5gx7
RCSB PDB
PDBbind
2-mer
5j41
RCSB PDB
PDBbind
2-mer
5l7f
RCSB PDB
PDBbind
2-mer
5lne
RCSB PDB
PDBbind
2-mer
5lyr
RCSB PDB
PDBbind
2-mer
5m17
RCSB PDB
PDBbind
2-mer
5m1z
RCSB PDB
PDBbind
2-mer
5m5d
RCSB PDB
PDBbind
2-mer
5m77
RCSB PDB
PDBbind
2-mer
5o58
RCSB PDB
PDBbind
2-mer
5oxk
RCSB PDB
PDBbind
2-mer
5oxl
RCSB PDB
PDBbind
2-mer
5oxm
RCSB PDB
PDBbind
2-mer
5oxn
RCSB PDB
PDBbind
2-mer
5vkm
RCSB PDB
PDBbind
2-mer
5xs8
RCSB PDB
PDBbind
2-mer
6fam
RCSB PDB
PDBbind
2-mer
6hmg
RCSB PDB
PDBbind
2-mer
6p7q
RCSB PDB
PDBbind
2-mer
6kdi
RCSB PDB
PDBbind
2-mer
6idg
RCSB PDB
PDBbind
2-mer
6a87
RCSB PDB
PDBbind
2-mer
6inz
RCSB PDB
PDBbind
2-mer
Entry Information
PDB ID
5ggo
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
N-terminal domain of human protein O-mannose beta-1,2-N-acetylglucosaminyltransferase
Ligand Name
2-mer
EC.Number
E.C.2.4.1
Resolution
1.5(Å)
Affinity (Kd/Ki/IC50)
Kd=0.8mM
Release Year
2016
Protein/NA Sequence
Check fasta file
Primary Reference
(2016) Proc.Natl.Acad.Sci.USA Vol.113 : pp. 9280-9285
Ligand Properties
Formula
C
2
2
H
3
1
N
3
O
1
3
Molecular Weight
545.494
Exact Mass
545.186
No. of atoms
69
No. of bonds
71
Polar Surface Area
242.09
LOGP Value
-2.01 (
Computed with XLOGP3
)
-1.81 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 7
No. of Hydrogen Bond Acceptors: 9
No. of Rotatable Bonds: 15
No. of Nitrogen and Oxygen Atoms: 16
No. of Rings: 3
Canonical SMILES
OC[C@H]1O[C@@H](Oc2ccc(cc2)N(=O)=O)[C@@H]([C@H]([C@@H]1O)O[C@@H]1O[C@H](CO)[C@@H]([C@@H]([C@H]1NC(=O)C)O)O)NC(=O)C
InChI String
InChI=1S/C22H31N3O13/c1-9(28)23-15-19(32)17(30)13(7-26)36-21(15)38-20-16(24-10(2)29)22(37-14(8-27)18(20)31)35-12-5-3-11(4-6-12)25(33)34/h3-6,13-22,26-27,30-32H,7-8H2,1-2H3,(H,23,28)(H,24,29)/t13-,14-,15-,16-,17+,18-,19-,20-,21+,22-/m1/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
Q8WZA1
Entrez Gene ID
NCBI Entrez Gene ID:
55624
ASD
Information of known allosteric effects of PDB entries
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