Browse entries in the PDBbind-CN Database
HEADER 5W92_COMPLEX COMPND 5W92_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 122 ARG GLY SER HIS MET GLU ASP PHE VAL ARG GLN CYS PHE SEQRES 2 A 122 ASN PRO MET ILE VAL GLU LEU ALA GLU LYS ALA MET LYS SEQRES 3 A 122 GLU TYR GLY GLU ASP PRO LYS ILE GLU THR ASN LYS PHE SEQRES 4 A 122 ALA ALA ILE CYS THR HIS LEU GLU VAL CYS PHE MET TYR SEQRES 5 A 122 SER ASP GLY GLY SER LYS HIS ARG PHE GLU ILE ILE GLU SEQRES 6 A 122 GLY ARG ASP ARG ILE MET ALA TRP THR VAL VAL ASN SER SEQRES 7 A 122 ILE CYS ASN THR THR GLY VAL GLU LYS PRO LYS PHE LEU SEQRES 8 A 122 PRO ASP LEU TYR ASP TYR LYS GLU ASN ARG PHE ILE GLU SEQRES 9 A 122 ILE GLY VAL THR ARG ARG GLU VAL HIS ILE TYR TYR LEU SEQRES 10 A 122 GLU LYS ALA ASN LYS SEQRES 1 A 56 SER GLU LYS THR HIS ILE HIS ILE PHE SER PHE THR GLY SEQRES 2 A 56 GLU GLU MET ALA THR LYS ALA ASP TYR THR LEU ASP GLU SEQRES 3 A 56 GLU SER ARG ALA ARG ILE LYS THR ARG LEU PHE THR ILE SEQRES 4 A 56 ARG GLN GLU MET ALA SER ARG SER LEU TRP ASP SER PHE SEQRES 5 A 56 ARG GLN SER GLU HET MN A 1 1 HET MN A 2 1 HET KU A 0 58 ATOM 1 N ARG A -3 118.890 103.295 395.834 1.00 90.40 N ATOM 2 CA ARG A -3 117.761 103.277 396.768 1.00 90.10 C ATOM 3 C ARG A -3 117.856 104.431 397.782 1.00 85.42 C ATOM 4 O ARG A -3 118.602 104.341 398.763 1.00 91.85 O ATOM 5 CB ARG A -3 117.693 101.927 397.496 1.00 87.30 C ATOM 6 HN3 ARG A -3 119.779 103.198 396.365 1.00 0.00 H ATOM 7 HN2 ARG A -3 118.893 104.195 395.313 1.00 0.00 H ATOM 8 HN1 ARG A -3 118.797 102.505 395.164 1.00 0.00 H ATOM 9 N GLY A -2 117.094 105.498 397.542 1.00137.26 N ATOM 10 CA GLY A -2 117.192 106.714 398.321 1.00121.01 C ATOM 11 C GLY A -2 116.007 106.920 399.251 1.00108.27 C ATOM 12 O GLY A -2 114.874 107.101 398.799 1.00105.25 O ATOM 13 H GLY A -2 116.403 105.455 396.766 1.00 0.00 H ATOM 14 N SER A -1 116.291 106.925 400.547 1.00 96.73 N ATOM 15 CA SER A -1 115.275 106.966 401.590 1.00 89.19 C ATOM 16 C SER A -1 114.982 108.393 402.044 1.00 83.31 C ATOM 17 O SER A -1 115.771 109.317 401.838 1.00 75.60 O ATOM 18 CB SER A -1 115.723 106.141 402.795 1.00 88.28 C ATOM 19 OG SER A -1 116.901 106.698 403.362 1.00 84.15 O ATOM 20 HG SER A -1 117.180 106.154 404.141 1.00 0.00 H ATOM 21 H SER A -1 117.291 106.898 400.833 1.00 0.00 H ATOM 22 N HIS A 0 113.828 108.551 402.700 1.00 85.57 N ATOM 23 CA HIS A 0 113.487 109.825 403.326 1.00 79.78 C ATOM 24 C HIS A 0 114.420 110.131 404.488 1.00 78.35 C ATOM 25 O HIS A 0 114.741 111.298 404.747 1.00 79.59 O ATOM 26 CB HIS A 0 112.032 109.805 403.803 1.00 78.35 C ATOM 27 CG HIS A 0 111.527 111.137 404.275 1.00 78.82 C ATOM 28 ND1 HIS A 0 110.230 111.332 404.695 1.00 79.35 N ATOM 29 CD2 HIS A 0 112.142 112.339 404.392 1.00 75.97 C ATOM 30 CE1 HIS A 0 110.066 112.595 405.047 1.00 77.23 C ATOM 31 NE2 HIS A 0 111.212 113.227 404.876 1.00 74.78 N ATOM 32 H HIS A 0 113.163 107.754 402.765 1.00 0.00 H ATOM 33 N MET A 1 114.852 109.102 405.211 1.00 75.69 N ATOM 34 CA MET A 1 115.723 109.341 406.353 1.00 72.69 C ATOM 35 C MET A 1 117.045 109.944 405.899 1.00 70.90 C ATOM 36 O MET A 1 117.576 110.854 406.546 1.00 66.50 O ATOM 37 CB MET A 1 115.936 108.037 407.124 1.00 74.64 C ATOM 38 CG MET A 1 116.937 108.133 408.250 1.00 77.46 C ATOM 39 SD MET A 1 116.583 109.486 409.391 1.00 79.92 S ATOM 40 CE MET A 1 115.845 108.589 410.760 1.00 76.89 C ATOM 41 H MET A 1 114.569 108.132 404.962 1.00 0.00 H ATOM 42 N GLU A 2 117.568 109.481 404.760 1.00 69.82 N ATOM 43 CA GLU A 2 118.837 109.996 404.251 1.00 66.78 C ATOM 44 C GLU A 2 118.739 111.472 403.899 1.00 68.73 C ATOM 45 O GLU A 2 119.623 112.263 404.248 1.00 67.71 O ATOM 46 CB GLU A 2 119.292 109.200 403.027 1.00 63.82 C ATOM 47 CG GLU A 2 120.785 109.362 402.752 1.00 66.30 C ATOM 48 CD GLU A 2 121.169 108.998 401.337 1.00 74.41 C ATOM 49 OE1 GLU A 2 120.534 108.081 400.782 1.00 79.53 O ATOM 50 OE2 GLU A 2 122.126 109.590 400.794 1.00 76.96 O ATOM 51 H GLU A 2 117.064 108.743 404.228 1.00 0.00 H ATOM 52 N ASP A 3 117.691 111.857 403.173 1.00 68.98 N ATOM 53 CA ASP A 3 117.534 113.269 402.847 1.00 70.38 C ATOM 54 C ASP A 3 117.285 114.106 404.104 1.00 73.23 C ATOM 55 O ASP A 3 117.714 115.262 404.175 1.00 75.09 O ATOM 56 CB ASP A 3 116.394 113.445 401.847 1.00 71.00 C ATOM 57 CG ASP A 3 116.698 112.821 400.490 1.00 72.59 C ATOM 58 OD1 ASP A 3 117.889 112.619 400.144 1.00 72.45 O ATOM 59 OD2 ASP A 3 115.727 112.530 399.758 1.00 74.74 O ATOM 60 H ASP A 3 116.994 111.159 402.843 1.00 0.00 H ATOM 61 N PHE A 4 116.604 113.549 405.106 1.00 72.00 N ATOM 62 CA PHE A 4 116.398 114.306 406.335 1.00 70.39 C ATOM 63 C PHE A 4 117.714 114.527 407.078 1.00 66.62 C ATOM 64 O PHE A 4 117.944 115.608 407.628 1.00 64.20 O ATOM 65 CB PHE A 4 115.387 113.606 407.257 1.00 71.72 C ATOM 66 CG PHE A 4 115.449 114.105 408.675 1.00 70.24 C ATOM 67 CD1 PHE A 4 114.941 115.352 409.006 1.00 70.15 C ATOM 68 CD2 PHE A 4 116.078 113.370 409.660 1.00 67.43 C ATOM 69 CE1 PHE A 4 115.023 115.834 410.308 1.00 66.77 C ATOM 70 CE2 PHE A 4 116.177 113.863 410.957 1.00 69.71 C ATOM 71 CZ PHE A 4 115.651 115.094 411.272 1.00 65.14 C ATOM 72 H PHE A 4 116.224 112.585 405.012 1.00 0.00 H ATOM 73 N VAL A 5 118.573 113.505 407.135 1.00 66.59 N ATOM 74 CA VAL A 5 119.884 113.654 407.766 1.00 64.39 C ATOM 75 C VAL A 5 120.659 114.800 407.130 1.00 62.70 C ATOM 76 O VAL A 5 121.203 115.668 407.829 1.00 57.31 O ATOM 77 CB VAL A 5 120.675 112.337 407.678 1.00 68.85 C ATOM 78 CG1 VAL A 5 122.158 112.585 407.939 1.00 67.85 C ATOM 79 CG2 VAL A 5 120.122 111.333 408.662 1.00 73.49 C ATOM 80 H VAL A 5 118.305 112.588 406.724 1.00 0.00 H ATOM 81 N ARG A 6 120.723 114.822 405.792 1.00 59.96 N ATOM 82 CA ARG A 6 121.514 115.839 405.108 1.00 60.06 C ATOM 83 C ARG A 6 120.912 117.231 405.258 1.00 65.01 C ATOM 84 O ARG A 6 121.632 118.226 405.150 1.00 71.81 O ATOM 85 CB ARG A 6 121.664 115.493 403.623 1.00 58.68 C ATOM 86 CG ARG A 6 122.306 114.145 403.348 1.00 58.60 C ATOM 87 CD ARG A 6 122.609 113.911 401.857 1.00 60.46 C ATOM 88 NE ARG A 6 123.019 112.524 401.694 1.00 65.88 N ATOM 89 CZ ARG A 6 124.248 112.077 401.932 1.00 69.00 C ATOM 90 NH1 ARG A 6 125.210 112.927 402.294 1.00 64.67 N ATOM 91 NH2 ARG A 6 124.520 110.781 401.791 1.00 71.42 N ATOM 92 HE ARG A 6 122.306 111.840 401.371 1.00 0.00 H ATOM 93 HH12 ARG A 6 126.171 112.576 402.480 1.00 0.00 H ATOM 94 HH11 ARG A 6 124.999 113.941 402.390 1.00 0.00 H ATOM 95 HH22 ARG A 6 125.481 110.428 401.976 1.00 0.00 H ATOM 96 HH21 ARG A 6 123.772 110.122 401.495 1.00 0.00 H ATOM 97 H ARG A 6 120.206 114.110 405.238 1.00 0.00 H ATOM 98 N GLN A 7 119.606 117.332 405.476 1.00 72.82 N ATOM 99 CA GLN A 7 118.987 118.630 405.714 1.00 77.50 C ATOM 100 C GLN A 7 118.998 119.029 407.187 1.00 75.40 C ATOM 101 O GLN A 7 118.896 120.226 407.492 1.00 75.44 O ATOM 102 CB GLN A 7 117.546 118.633 405.186 1.00 86.50 C ATOM 103 CG GLN A 7 116.913 120.015 405.075 1.00 95.95 C ATOM 104 CD GLN A 7 117.538 120.861 403.983 1.00105.06 C ATOM 105 OE1 GLN A 7 118.160 120.338 403.054 1.00106.57 O ATOM 106 NE2 GLN A 7 117.386 122.182 404.094 1.00110.66 N ATOM 107 HE22 GLN A 7 116.853 122.579 404.894 1.00 0.00 H ATOM 108 HE21 GLN A 7 117.800 122.815 403.380 1.00 0.00 H ATOM 109 H GLN A 7 119.018 116.474 405.477 1.00 0.00 H ATOM 110 N CYS A 8 119.139 118.062 408.100 1.00 69.69 N ATOM 111 CA CYS A 8 119.111 118.307 409.537 1.00 67.11 C ATOM 112 C CYS A 8 120.481 118.678 410.117 1.00 66.75 C ATOM 113 O CYS A 8 120.558 119.509 411.023 1.00 67.83 O ATOM 114 CB CYS A 8 118.577 117.070 410.245 1.00 71.24 C ATOM 115 SG CYS A 8 118.435 117.235 412.008 1.00 75.25 S ATOM 116 H CYS A 8 119.276 117.086 407.768 1.00 0.00 H ATOM 117 N PHE A 9 121.568 118.091 409.625 1.00 61.31 N ATOM 118 CA PHE A 9 122.883 118.277 410.220 1.00 54.83 C ATOM 119 C PHE A 9 123.758 119.068 409.276 1.00 62.17 C ATOM 120 O PHE A 9 123.522 119.099 408.068 1.00 63.35 O ATOM 121 CB PHE A 9 123.544 116.932 410.546 1.00 54.58 C ATOM 122 CG PHE A 9 122.806 116.149 411.614 1.00 61.65 C ATOM 123 CD1 PHE A 9 123.024 116.406 412.959 1.00 57.08 C ATOM 124 CD2 PHE A 9 121.883 115.174 411.270 1.00 60.79 C ATOM 125 CE1 PHE A 9 122.361 115.671 413.938 1.00 55.85 C ATOM 126 CE2 PHE A 9 121.212 114.462 412.234 1.00 60.87 C ATOM 127 CZ PHE A 9 121.451 114.701 413.567 1.00 56.98 C ATOM 128 H PHE A 9 121.475 117.480 408.789 1.00 0.00 H ATOM 129 N ASN A 10 124.782 119.705 409.839 1.00 64.40 N ATOM 130 CA ASN A 10 125.537 120.566 408.956 1.00 64.29 C ATOM 131 C ASN A 10 126.477 119.729 408.085 1.00 62.91 C ATOM 132 O ASN A 10 126.834 118.606 408.451 1.00 57.22 O ATOM 133 CB ASN A 10 126.305 121.623 409.756 1.00 72.30 C ATOM 134 CG ASN A 10 127.583 121.098 410.385 1.00 77.29 C ATOM 135 OD1 ASN A 10 128.581 120.825 409.700 1.00 77.72 O ATOM 136 ND2 ASN A 10 127.582 121.016 411.708 1.00 74.92 N ATOM 137 HD22 ASN A 10 126.723 121.254 412.243 1.00 0.00 H ATOM 138 HD21 ASN A 10 128.441 120.713 412.211 1.00 0.00 H ATOM 139 H ASN A 10 125.023 119.591 410.844 1.00 0.00 H ATOM 140 N PRO A 11 126.860 120.246 406.909 1.00 64.62 N ATOM 141 CA PRO A 11 127.620 119.423 405.947 1.00 61.78 C ATOM 142 C PRO A 11 128.907 118.837 406.489 1.00 63.93 C ATOM 143 O PRO A 11 129.333 117.770 406.021 1.00 68.40 O ATOM 144 CB PRO A 11 127.913 120.401 404.798 1.00 62.67 C ATOM 145 CG PRO A 11 126.792 121.396 404.862 1.00 65.81 C ATOM 146 CD PRO A 11 126.453 121.543 406.337 1.00 65.55 C ATOM 147 N MET A 12 129.571 119.513 407.426 1.00 63.45 N ATOM 148 CA MET A 12 130.791 118.936 407.984 1.00 65.32 C ATOM 149 C MET A 12 130.468 117.738 408.884 1.00 61.59 C ATOM 150 O MET A 12 131.195 116.739 408.880 1.00 61.88 O ATOM 151 CB MET A 12 131.576 120.008 408.739 1.00 71.19 C ATOM 152 CG MET A 12 132.885 119.500 409.338 1.00 87.80 C ATOM 153 SD MET A 12 133.400 120.364 410.843 1.00 97.26 S ATOM 154 CE MET A 12 131.958 120.125 411.876 1.00 94.66 C ATOM 155 H MET A 12 129.226 120.437 407.755 1.00 0.00 H ATOM 156 N ILE A 13 129.377 117.805 409.650 1.00 63.15 N ATOM 157 CA ILE A 13 128.961 116.633 410.426 1.00 63.03 C ATOM 158 C ILE A 13 128.647 115.474 409.493 1.00 60.93 C ATOM 159 O ILE A 13 129.113 114.341 409.691 1.00 58.65 O ATOM 160 CB ILE A 13 127.750 116.958 411.312 1.00 62.19 C ATOM 161 CG1 ILE A 13 128.093 118.034 412.327 1.00 69.99 C ATOM 162 CG2 ILE A 13 127.263 115.694 412.018 1.00 62.08 C ATOM 163 CD1 ILE A 13 129.247 117.674 413.162 1.00 73.52 C ATOM 164 H ILE A 13 128.824 118.685 409.696 1.00 0.00 H ATOM 165 N VAL A 14 127.841 115.751 408.462 1.00 59.77 N ATOM 166 CA VAL A 14 127.437 114.727 407.505 1.00 61.52 C ATOM 167 C VAL A 14 128.668 114.044 406.903 1.00 65.31 C ATOM 168 O VAL A 14 128.824 112.817 406.985 1.00 67.53 O ATOM 169 CB VAL A 14 126.544 115.358 406.420 1.00 57.51 C ATOM 170 CG1 VAL A 14 126.457 114.449 405.241 1.00 54.17 C ATOM 171 CG2 VAL A 14 125.141 115.554 406.972 1.00 58.53 C ATOM 172 H VAL A 14 127.493 116.723 408.339 1.00 0.00 H ATOM 173 N GLU A 15 129.581 114.837 406.321 1.00 60.70 N ATOM 174 CA GLU A 15 130.771 114.275 405.685 1.00 62.34 C ATOM 175 C GLU A 15 131.591 113.470 406.679 1.00 61.28 C ATOM 176 O GLU A 15 132.145 112.428 406.327 1.00 57.27 O ATOM 177 CB GLU A 15 131.608 115.402 405.094 1.00 64.54 C ATOM 178 CG GLU A 15 132.104 115.153 403.670 1.00 75.75 C ATOM 179 H GLU A 15 129.440 115.867 406.323 1.00 0.00 H ATOM 180 N LEU A 16 131.685 113.933 407.933 1.00 61.20 N ATOM 181 CA LEU A 16 132.426 113.168 408.937 1.00 65.32 C ATOM 182 C LEU A 16 131.726 111.855 409.259 1.00 67.42 C ATOM 183 O LEU A 16 132.383 110.820 409.442 1.00 73.16 O ATOM 184 CB LEU A 16 132.615 114.000 410.208 1.00 66.13 C ATOM 185 CG LEU A 16 133.738 115.050 410.148 1.00 66.48 C ATOM 186 CD1 LEU A 16 133.825 115.830 411.457 1.00 62.37 C ATOM 187 CD2 LEU A 16 135.080 114.403 409.816 1.00 65.16 C ATOM 188 H LEU A 16 131.233 114.833 408.192 1.00 0.00 H ATOM 189 N ALA A 17 130.394 111.872 409.337 1.00 60.62 N ATOM 190 CA ALA A 17 129.672 110.627 409.588 1.00 60.76 C ATOM 191 C ALA A 17 129.830 109.661 408.421 1.00 66.66 C ATOM 192 O ALA A 17 129.968 108.445 408.619 1.00 66.51 O ATOM 193 CB ALA A 17 128.197 110.914 409.832 1.00 55.20 C ATOM 194 H ALA A 17 129.874 112.765 409.220 1.00 0.00 H ATOM 195 N GLU A 18 129.800 110.183 407.195 1.00 63.31 N ATOM 196 CA GLU A 18 129.967 109.327 406.027 1.00 70.79 C ATOM 197 C GLU A 18 131.323 108.643 406.035 1.00 71.33 C ATOM 198 O GLU A 18 131.426 107.438 405.777 1.00 72.97 O ATOM 199 CB GLU A 18 129.796 110.144 404.755 1.00 77.45 C ATOM 200 CG GLU A 18 128.359 110.291 404.368 1.00 82.85 C ATOM 201 CD GLU A 18 128.177 111.152 403.144 1.00 86.28 C ATOM 202 OE1 GLU A 18 129.049 112.015 402.882 1.00 86.25 O ATOM 203 OE2 GLU A 18 127.155 110.959 402.454 1.00 88.44 O ATOM 204 H GLU A 18 129.657 111.206 407.071 1.00 0.00 H ATOM 205 N LYS A 19 132.382 109.407 406.313 1.00 73.76 N ATOM 206 CA LYS A 19 133.725 108.835 406.357 1.00 75.33 C ATOM 207 C LYS A 19 133.815 107.732 407.409 1.00 76.52 C ATOM 208 O LYS A 19 134.459 106.703 407.182 1.00 78.46 O ATOM 209 CB LYS A 19 134.751 109.940 406.634 1.00 76.33 C ATOM 210 CG LYS A 19 135.640 110.320 405.467 1.00 87.79 C ATOM 211 CD LYS A 19 136.778 111.244 405.919 1.00 94.00 C ATOM 212 CE LYS A 19 138.125 110.839 405.307 1.00 99.64 C ATOM 213 NZ LYS A 19 139.283 111.394 406.082 1.00 99.82 N ATOM 214 HZ1 LYS A 19 139.228 112.433 406.089 1.00 0.00 H ATOM 215 HZ2 LYS A 19 139.248 111.037 407.058 1.00 0.00 H ATOM 216 HZ3 LYS A 19 140.173 111.096 405.634 1.00 0.00 H ATOM 217 H LYS A 19 132.249 110.421 406.500 1.00 0.00 H ATOM 218 N ALA A 20 133.144 107.909 408.555 1.00 72.27 N ATOM 219 CA ALA A 20 133.247 106.903 409.613 1.00 70.32 C ATOM 220 C ALA A 20 132.521 105.617 409.226 1.00 75.57 C ATOM 221 O ALA A 20 133.045 104.513 409.429 1.00 79.20 O ATOM 222 CB ALA A 20 132.717 107.459 410.939 1.00 63.07 C ATOM 223 H ALA A 20 132.554 108.755 408.692 1.00 0.00 H ATOM 224 N MET A 21 131.340 105.737 408.625 1.00 75.86 N ATOM 225 CA MET A 21 130.607 104.556 408.191 1.00 79.39 C ATOM 226 C MET A 21 131.306 103.814 407.063 1.00 86.66 C ATOM 227 O MET A 21 131.268 102.574 407.036 1.00 89.57 O ATOM 228 CB MET A 21 129.201 104.942 407.758 1.00 77.02 C ATOM 229 CG MET A 21 128.427 105.581 408.873 1.00 75.64 C ATOM 230 SD MET A 21 126.696 105.794 408.472 1.00 76.00 S ATOM 231 CE MET A 21 126.438 104.521 407.254 1.00 86.50 C ATOM 232 H MET A 21 130.937 106.682 408.464 1.00 0.00 H ATOM 233 N LYS A 22 131.928 104.535 406.119 1.00 88.53 N ATOM 234 CA LYS A 22 132.699 103.845 405.085 1.00 92.11 C ATOM 235 C LYS A 22 133.842 103.045 405.700 1.00 95.32 C ATOM 236 O LYS A 22 134.172 101.961 405.216 1.00 95.60 O ATOM 237 CB LYS A 22 133.235 104.837 404.053 1.00 92.29 C ATOM 238 CG LYS A 22 132.299 105.107 402.863 1.00 94.47 C ATOM 239 CD LYS A 22 132.254 106.605 402.510 1.00 93.98 C ATOM 240 CE LYS A 22 131.250 106.922 401.402 1.00 94.66 C ATOM 241 NZ LYS A 22 131.173 108.393 401.105 1.00 94.11 N ATOM 242 HZ1 LYS A 22 130.879 108.904 401.962 1.00 0.00 H ATOM 243 HZ2 LYS A 22 132.107 108.733 400.801 1.00 0.00 H ATOM 244 HZ3 LYS A 22 130.479 108.557 400.348 1.00 0.00 H ATOM 245 H LYS A 22 131.863 105.573 406.122 1.00 0.00 H ATOM 246 N GLU A 23 134.421 103.536 406.797 1.00101.44 N ATOM 247 CA GLU A 23 135.523 102.834 407.448 1.00108.84 C ATOM 248 C GLU A 23 135.066 101.544 408.124 1.00111.31 C ATOM 249 O GLU A 23 135.790 100.545 408.098 1.00119.16 O ATOM 250 CB GLU A 23 136.200 103.755 408.461 1.00111.87 C ATOM 251 CG GLU A 23 137.452 104.416 407.934 1.00118.33 C ATOM 252 CD GLU A 23 138.233 105.126 409.021 1.00122.11 C ATOM 253 OE1 GLU A 23 137.717 106.115 409.581 1.00121.07 O ATOM 254 OE2 GLU A 23 139.367 104.696 409.317 1.00127.24 O ATOM 255 H GLU A 23 134.081 104.435 407.195 1.00 0.00 H ATOM 256 N TYR A 24 133.886 101.544 408.749 1.00108.75 N ATOM 257 CA TYR A 24 133.344 100.305 409.303 1.00111.01 C ATOM 258 C TYR A 24 132.788 99.381 408.231 1.00110.35 C ATOM 259 O TYR A 24 132.407 98.249 408.548 1.00114.59 O ATOM 260 CB TYR A 24 132.235 100.597 410.317 1.00115.20 C ATOM 261 CG TYR A 24 132.699 100.849 411.737 1.00119.13 C ATOM 262 CD1 TYR A 24 133.562 101.902 412.029 1.00119.35 C ATOM 263 CD2 TYR A 24 132.258 100.046 412.794 1.00122.08 C ATOM 264 CE1 TYR A 24 133.982 102.149 413.326 1.00120.55 C ATOM 265 CE2 TYR A 24 132.674 100.286 414.099 1.00123.93 C ATOM 266 CZ TYR A 24 133.536 101.341 414.355 1.00122.59 C ATOM 267 OH TYR A 24 133.960 101.594 415.635 1.00122.28 O ATOM 268 HH TYR A 24 134.443 100.803 415.984 1.00 0.00 H ATOM 269 H TYR A 24 133.350 102.430 408.842 1.00 0.00 H ATOM 270 N GLY A 25 132.722 99.832 406.983 1.00106.96 N ATOM 271 CA GLY A 25 132.155 99.027 405.923 1.00107.37 C ATOM 272 C GLY A 25 130.644 99.075 405.928 1.00106.80 C ATOM 273 O GLY A 25 129.983 98.043 405.779 1.00110.66 O ATOM 274 H GLY A 25 133.085 100.782 406.764 1.00 0.00 H ATOM 275 N GLU A 26 130.085 100.271 406.116 1.00103.51 N ATOM 276 CA GLU A 26 128.643 100.465 406.115 1.00102.27 C ATOM 277 C GLU A 26 128.286 101.612 405.176 1.00 96.71 C ATOM 278 O GLU A 26 129.130 102.444 404.827 1.00 92.73 O ATOM 279 CB GLU A 26 128.124 100.715 407.532 1.00105.77 C ATOM 280 CG GLU A 26 128.485 99.578 408.471 1.00114.19 C ATOM 281 CD GLU A 26 127.644 99.555 409.730 1.00118.10 C ATOM 282 OE1 GLU A 26 126.584 98.887 409.732 1.00119.58 O ATOM 283 OE2 GLU A 26 128.049 100.206 410.718 1.00118.66 O ATOM 284 H GLU A 26 130.702 101.094 406.269 1.00 0.00 H ATOM 285 N ASP A 27 127.020 101.634 404.757 1.00 97.38 N ATOM 286 CA ASP A 27 126.548 102.509 403.687 1.00 96.48 C ATOM 287 C ASP A 27 125.491 103.469 404.214 1.00 91.07 C ATOM 288 O ASP A 27 124.428 103.015 404.673 1.00 91.67 O ATOM 289 CB ASP A 27 125.973 101.686 402.528 1.00100.24 C ATOM 290 CG ASP A 27 125.869 102.481 401.239 1.00102.70 C ATOM 291 OD1 ASP A 27 125.782 103.727 401.292 1.00100.24 O ATOM 292 OD2 ASP A 27 125.864 101.855 400.157 1.00108.36 O ATOM 293 H ASP A 27 126.336 100.998 405.214 1.00 0.00 H ATOM 294 N PRO A 28 125.722 104.784 404.145 1.00 87.21 N ATOM 295 CA PRO A 28 124.696 105.739 404.587 1.00 85.14 C ATOM 296 C PRO A 28 123.400 105.658 403.798 1.00 89.11 C ATOM 297 O PRO A 28 122.359 106.073 404.321 1.00 89.25 O ATOM 298 CB PRO A 28 125.382 107.101 404.395 1.00 85.68 C ATOM 299 CG PRO A 28 126.861 106.793 404.302 1.00 81.39 C ATOM 300 CD PRO A 28 126.930 105.464 403.644 1.00 86.41 C ATOM 301 N LYS A 29 123.422 105.140 402.562 1.00 89.51 N ATOM 302 CA LYS A 29 122.200 105.039 401.771 1.00 87.74 C ATOM 303 C LYS A 29 121.295 103.903 402.226 1.00 85.29 C ATOM 304 O LYS A 29 120.118 103.875 401.845 1.00 90.30 O ATOM 305 CB LYS A 29 122.531 104.851 400.285 1.00 90.46 C ATOM 306 CG LYS A 29 123.433 105.925 399.703 1.00 90.49 C ATOM 307 CD LYS A 29 122.651 106.897 398.839 1.00 94.83 C ATOM 308 CE LYS A 29 123.529 108.055 398.375 1.00 97.57 C ATOM 309 NZ LYS A 29 122.718 109.229 397.933 1.00 98.34 N ATOM 310 HZ1 LYS A 29 122.105 108.947 397.141 1.00 0.00 H ATOM 311 HZ2 LYS A 29 122.132 109.562 398.725 1.00 0.00 H ATOM 312 HZ3 LYS A 29 123.354 109.992 397.626 1.00 0.00 H ATOM 313 H LYS A 29 124.322 104.806 402.162 1.00 0.00 H ATOM 314 N ILE A 30 121.810 102.962 403.014 1.00 81.72 N ATOM 315 CA ILE A 30 121.047 101.791 403.444 1.00 84.33 C ATOM 316 C ILE A 30 120.832 101.788 404.953 1.00 85.56 C ATOM 317 O ILE A 30 119.692 101.781 405.427 1.00 87.21 O ATOM 318 CB ILE A 30 121.717 100.482 402.973 1.00 86.54 C ATOM 319 CG1 ILE A 30 121.703 100.398 401.446 1.00 90.25 C ATOM 320 CG2 ILE A 30 120.998 99.292 403.564 1.00 87.79 C ATOM 321 CD1 ILE A 30 123.034 100.069 400.839 1.00 93.14 C ATOM 322 H ILE A 30 122.794 103.064 403.336 1.00 0.00 H ATOM 323 N GLU A 31 121.915 101.771 405.730 1.00 82.49 N ATOM 324 CA GLU A 31 121.800 101.802 407.192 1.00 79.25 C ATOM 325 C GLU A 31 121.566 103.248 407.628 1.00 74.19 C ATOM 326 O GLU A 31 122.397 103.892 408.276 1.00 74.35 O ATOM 327 CB GLU A 31 123.037 101.201 407.843 1.00 79.84 C ATOM 328 H GLU A 31 122.858 101.735 405.292 1.00 0.00 H ATOM 329 N THR A 32 120.394 103.766 407.245 1.00 72.44 N ATOM 330 CA THR A 32 120.156 105.203 407.357 1.00 73.53 C ATOM 331 C THR A 32 119.876 105.618 408.785 1.00 75.03 C ATOM 332 O THR A 32 120.175 106.756 409.169 1.00 77.24 O ATOM 333 CB THR A 32 119.001 105.620 406.455 1.00 73.75 C ATOM 334 OG1 THR A 32 117.821 104.912 406.849 1.00 73.32 O ATOM 335 CG2 THR A 32 119.328 105.283 404.994 1.00 75.01 C ATOM 336 HG1 THR A 32 117.067 105.179 406.266 1.00 0.00 H ATOM 337 H THR A 32 119.651 103.145 406.867 1.00 0.00 H ATOM 338 N ASN A 33 119.311 104.717 409.584 1.00 70.95 N ATOM 339 CA ASN A 33 119.122 105.017 410.996 1.00 74.13 C ATOM 340 C ASN A 33 120.459 105.171 411.703 1.00 77.00 C ATOM 341 O ASN A 33 120.636 106.090 412.513 1.00 75.62 O ATOM 342 CB ASN A 33 118.282 103.924 411.653 1.00 77.44 C ATOM 343 CG ASN A 33 116.839 103.971 411.205 1.00 83.12 C ATOM 344 OD1 ASN A 33 116.238 102.944 410.888 1.00 91.13 O ATOM 345 ND2 ASN A 33 116.274 105.178 411.164 1.00 80.57 N ATOM 346 HD22 ASN A 33 116.821 106.018 411.441 1.00 0.00 H ATOM 347 HD21 ASN A 33 115.286 105.280 410.855 1.00 0.00 H ATOM 348 H ASN A 33 119.005 103.800 409.201 1.00 0.00 H ATOM 349 N LYS A 34 121.416 104.284 411.406 1.00 73.00 N ATOM 350 CA LYS A 34 122.746 104.433 411.986 1.00 73.21 C ATOM 351 C LYS A 34 123.423 105.707 411.489 1.00 73.77 C ATOM 352 O LYS A 34 124.133 106.381 412.245 1.00 72.08 O ATOM 353 CB LYS A 34 123.593 103.209 411.661 1.00 80.64 C ATOM 354 CG LYS A 34 124.982 103.242 412.275 1.00 87.45 C ATOM 355 CD LYS A 34 125.456 101.853 412.696 1.00 95.84 C ATOM 356 CE LYS A 34 126.737 101.940 413.516 1.00 96.12 C ATOM 357 NZ LYS A 34 127.378 100.610 413.718 1.00 98.92 N ATOM 358 HZ1 LYS A 34 126.719 99.981 414.220 1.00 0.00 H ATOM 359 HZ2 LYS A 34 127.617 100.198 412.794 1.00 0.00 H ATOM 360 HZ3 LYS A 34 128.244 100.726 414.281 1.00 0.00 H ATOM 361 H LYS A 34 121.212 103.491 410.764 1.00 0.00 H ATOM 362 N PHE A 35 123.226 106.043 410.215 1.00 72.90 N ATOM 363 CA PHE A 35 123.691 107.326 409.692 1.00 67.48 C ATOM 364 C PHE A 35 123.207 108.482 410.571 1.00 69.31 C ATOM 365 O PHE A 35 123.994 109.347 410.971 1.00 66.28 O ATOM 366 CB PHE A 35 123.198 107.478 408.249 1.00 64.80 C ATOM 367 CG PHE A 35 123.798 108.640 407.496 1.00 67.55 C ATOM 368 CD1 PHE A 35 125.018 109.184 407.868 1.00 67.63 C ATOM 369 CD2 PHE A 35 123.142 109.171 406.387 1.00 69.20 C ATOM 370 CE1 PHE A 35 125.566 110.242 407.156 1.00 67.52 C ATOM 371 CE2 PHE A 35 123.689 110.233 405.675 1.00 69.77 C ATOM 372 CZ PHE A 35 124.904 110.768 406.061 1.00 68.10 C ATOM 373 H PHE A 35 122.733 105.381 409.582 1.00 0.00 H ATOM 374 N ALA A 36 121.914 108.501 410.900 1.00 70.51 N ATOM 375 CA ALA A 36 121.377 109.601 411.697 1.00 67.20 C ATOM 376 C ALA A 36 121.960 109.605 413.103 1.00 64.74 C ATOM 377 O ALA A 36 122.240 110.670 413.671 1.00 63.04 O ATOM 378 CB ALA A 36 119.855 109.504 411.763 1.00 61.97 C ATOM 379 H ALA A 36 121.288 107.731 410.588 1.00 0.00 H ATOM 380 N ALA A 37 122.141 108.425 413.681 1.00 60.98 N ATOM 381 CA ALA A 37 122.669 108.328 415.037 1.00 60.22 C ATOM 382 C ALA A 37 124.109 108.809 415.096 1.00 61.57 C ATOM 383 O ALA A 37 124.490 109.541 416.014 1.00 65.30 O ATOM 384 CB ALA A 37 122.551 106.878 415.531 1.00 59.63 C ATOM 385 H ALA A 37 121.903 107.557 413.160 1.00 0.00 H ATOM 386 N ILE A 38 124.916 108.449 414.099 1.00 67.00 N ATOM 387 CA ILE A 38 126.317 108.853 414.110 1.00 60.65 C ATOM 388 C ILE A 38 126.445 110.369 413.997 1.00 59.25 C ATOM 389 O ILE A 38 127.257 110.982 414.701 1.00 62.27 O ATOM 390 CB ILE A 38 127.075 108.106 412.999 1.00 60.70 C ATOM 391 CG1 ILE A 38 127.367 106.689 413.485 1.00 64.95 C ATOM 392 CG2 ILE A 38 128.359 108.833 412.625 1.00 57.45 C ATOM 393 CD1 ILE A 38 127.643 105.697 412.375 1.00 71.67 C ATOM 394 H ILE A 38 124.546 107.879 413.312 1.00 0.00 H ATOM 395 N CYS A 39 125.649 111.000 413.121 1.00 58.74 N ATOM 396 CA CYS A 39 125.641 112.461 413.037 1.00 56.14 C ATOM 397 C CYS A 39 125.276 113.065 414.384 1.00 60.37 C ATOM 398 O CYS A 39 125.938 113.991 414.863 1.00 57.42 O ATOM 399 CB CYS A 39 124.659 112.937 411.961 1.00 53.88 C ATOM 400 SG CYS A 39 125.119 112.542 410.231 1.00 60.14 S ATOM 401 H CYS A 39 125.031 110.445 412.495 1.00 0.00 H ATOM 402 N THR A 40 124.218 112.539 415.010 1.00 61.81 N ATOM 403 CA THR A 40 123.764 113.067 416.288 1.00 57.44 C ATOM 404 C THR A 40 124.863 113.006 417.328 1.00 57.41 C ATOM 405 O THR A 40 125.149 114.005 417.996 1.00 58.00 O ATOM 406 CB THR A 40 122.547 112.284 416.778 1.00 60.67 C ATOM 407 OG1 THR A 40 121.544 112.268 415.757 1.00 62.68 O ATOM 408 CG2 THR A 40 121.993 112.892 418.041 1.00 55.79 C ATOM 409 HG1 THR A 40 121.909 111.836 414.944 1.00 0.00 H ATOM 410 H THR A 40 123.712 111.740 414.577 1.00 0.00 H ATOM 411 N HIS A 41 125.462 111.820 417.499 1.00 60.46 N ATOM 412 CA HIS A 41 126.592 111.652 418.410 1.00 62.99 C ATOM 413 C HIS A 41 127.691 112.657 418.099 1.00 61.37 C ATOM 414 O HIS A 41 128.247 113.299 419.005 1.00 60.37 O ATOM 415 CB HIS A 41 127.117 110.216 418.297 1.00 65.71 C ATOM 416 CG HIS A 41 128.317 109.925 419.147 1.00 67.88 C ATOM 417 ND1 HIS A 41 129.609 110.086 418.694 1.00 63.84 N ATOM 418 CD2 HIS A 41 128.419 109.456 420.416 1.00 67.41 C ATOM 419 CE1 HIS A 41 130.457 109.741 419.649 1.00 64.35 C ATOM 420 NE2 HIS A 41 129.761 109.354 420.705 1.00 69.11 N ATOM 421 H HIS A 41 125.113 110.996 416.969 1.00 0.00 H ATOM 422 N LEU A 42 127.986 112.835 416.817 1.00 56.77 N ATOM 423 CA LEU A 42 129.031 113.766 416.421 1.00 58.20 C ATOM 424 C LEU A 42 128.689 115.184 416.863 1.00 59.23 C ATOM 425 O LEU A 42 129.509 115.871 417.496 1.00 58.28 O ATOM 426 CB LEU A 42 129.228 113.695 414.909 1.00 60.12 C ATOM 427 CG LEU A 42 130.354 112.792 414.411 1.00 65.47 C ATOM 428 CD1 LEU A 42 130.313 112.689 412.893 1.00 68.76 C ATOM 429 CD2 LEU A 42 131.707 113.340 414.850 1.00 65.31 C ATOM 430 H LEU A 42 127.466 112.304 416.090 1.00 0.00 H ATOM 431 N GLU A 43 127.474 115.640 416.552 1.00 54.47 N ATOM 432 CA GLU A 43 127.105 116.999 416.933 1.00 54.16 C ATOM 433 C GLU A 43 127.142 117.160 418.450 1.00 55.87 C ATOM 434 O GLU A 43 127.611 118.184 418.969 1.00 53.67 O ATOM 435 CB GLU A 43 125.718 117.350 416.379 1.00 53.00 C ATOM 436 CG GLU A 43 125.303 118.806 416.661 1.00 61.98 C ATOM 437 CD GLU A 43 124.035 119.251 415.930 1.00 67.20 C ATOM 438 OE1 GLU A 43 123.740 120.475 415.912 1.00 71.41 O ATOM 439 OE2 GLU A 43 123.333 118.386 415.379 1.00 67.94 O ATOM 440 H GLU A 43 126.798 115.034 416.044 1.00 0.00 H ATOM 441 N VAL A 44 126.671 116.153 419.182 1.00 50.16 N ATOM 442 CA VAL A 44 126.720 116.240 420.639 1.00 53.15 C ATOM 443 C VAL A 44 128.164 116.348 421.116 1.00 53.83 C ATOM 444 O VAL A 44 128.483 117.169 421.988 1.00 54.47 O ATOM 445 CB VAL A 44 126.008 115.045 421.286 1.00 51.82 C ATOM 446 CG1 VAL A 44 126.350 114.981 422.758 1.00 52.26 C ATOM 447 CG2 VAL A 44 124.494 115.153 421.111 1.00 49.50 C ATOM 448 H VAL A 44 126.271 115.311 418.720 1.00 0.00 H ATOM 449 N CYS A 45 129.063 115.528 420.545 1.00 51.32 N ATOM 450 CA CYS A 45 130.471 115.632 420.908 1.00 57.43 C ATOM 451 C CYS A 45 130.996 117.046 420.655 1.00 58.64 C ATOM 452 O CYS A 45 131.760 117.591 421.462 1.00 61.67 O ATOM 453 CB CYS A 45 131.292 114.587 420.145 1.00 60.77 C ATOM 454 SG CYS A 45 131.128 112.870 420.811 1.00 64.05 S ATOM 455 H CYS A 45 128.755 114.822 419.847 1.00 0.00 H ATOM 456 N PHE A 46 130.564 117.680 419.572 1.00 51.19 N ATOM 457 CA PHE A 46 131.090 119.008 419.280 1.00 53.59 C ATOM 458 C PHE A 46 130.467 120.071 420.187 1.00 60.60 C ATOM 459 O PHE A 46 131.160 121.009 420.605 1.00 54.99 O ATOM 460 CB PHE A 46 130.872 119.343 417.805 1.00 54.31 C ATOM 461 CG PHE A 46 131.711 118.501 416.857 1.00 59.24 C ATOM 462 CD1 PHE A 46 132.688 117.646 417.340 1.00 64.38 C ATOM 463 CD2 PHE A 46 131.509 118.554 415.495 1.00 65.33 C ATOM 464 CE1 PHE A 46 133.444 116.866 416.477 1.00 72.42 C ATOM 465 CE2 PHE A 46 132.270 117.777 414.622 1.00 67.79 C ATOM 466 CZ PHE A 46 133.239 116.944 415.116 1.00 71.60 C ATOM 467 H PHE A 46 129.863 117.238 418.943 1.00 0.00 H ATOM 468 N MET A 47 129.166 119.956 420.495 1.00 55.49 N ATOM 469 CA MET A 47 128.548 120.929 421.389 1.00 61.49 C ATOM 470 C MET A 47 129.152 120.834 422.778 1.00 57.08 C ATOM 471 O MET A 47 129.428 121.855 423.425 1.00 59.03 O ATOM 472 CB MET A 47 127.036 120.721 421.460 1.00 58.53 C ATOM 473 CG MET A 47 126.308 121.017 420.164 1.00 56.63 C ATOM 474 SD MET A 47 124.585 120.535 420.298 1.00 64.19 S ATOM 475 CE MET A 47 124.060 121.804 421.487 1.00 66.99 C ATOM 476 H MET A 47 128.602 119.178 420.099 1.00 0.00 H ATOM 477 N TYR A 48 129.387 119.607 423.231 1.00 59.14 N ATOM 478 CA TYR A 48 130.039 119.357 424.508 1.00 60.84 C ATOM 479 C TYR A 48 131.392 120.061 424.578 1.00 61.42 C ATOM 480 O TYR A 48 131.668 120.815 425.518 1.00 60.65 O ATOM 481 CB TYR A 48 130.199 117.849 424.682 1.00 53.64 C ATOM 482 CG TYR A 48 130.331 117.349 426.113 1.00 62.85 C ATOM 483 CD1 TYR A 48 131.531 117.460 426.803 1.00 64.97 C ATOM 484 CD2 TYR A 48 129.270 116.719 426.752 1.00 65.82 C ATOM 485 CE1 TYR A 48 131.664 116.973 428.102 1.00 65.76 C ATOM 486 CE2 TYR A 48 129.389 116.228 428.053 1.00 69.16 C ATOM 487 CZ TYR A 48 130.586 116.356 428.718 1.00 66.82 C ATOM 488 OH TYR A 48 130.690 115.862 430.004 1.00 59.13 O ATOM 489 HH TYR A 48 130.510 114.889 429.998 1.00 0.00 H ATOM 490 H TYR A 48 129.094 118.795 422.651 1.00 0.00 H ATOM 491 N SER A 49 132.249 119.832 423.576 1.00 58.30 N ATOM 492 CA SER A 49 133.583 120.425 423.597 1.00 63.37 C ATOM 493 C SER A 49 133.552 121.944 423.575 1.00 62.24 C ATOM 494 O SER A 49 134.564 122.580 423.894 1.00 67.00 O ATOM 495 CB SER A 49 134.392 119.948 422.410 1.00 59.69 C ATOM 496 OG SER A 49 133.838 120.495 421.237 1.00 63.33 O ATOM 497 HG SER A 49 132.899 120.196 421.146 1.00 0.00 H ATOM 498 H SER A 49 131.963 119.229 422.778 1.00 0.00 H ATOM 499 N ASP A 50 132.431 122.535 423.178 1.00 59.11 N ATOM 500 CA ASP A 50 132.248 123.979 423.156 1.00 63.47 C ATOM 501 C ASP A 50 131.670 124.509 424.463 1.00 67.89 C ATOM 502 O ASP A 50 131.560 125.724 424.627 1.00 70.38 O ATOM 503 CB ASP A 50 131.319 124.338 421.988 1.00 70.90 C ATOM 504 CG ASP A 50 131.362 125.802 421.617 1.00 84.67 C ATOM 505 OD1 ASP A 50 132.344 126.495 421.963 1.00 90.73 O ATOM 506 OD2 ASP A 50 130.397 126.265 420.967 1.00 89.79 O ATOM 507 H ASP A 50 131.642 121.934 422.866 1.00 0.00 H ATOM 508 N GLY A 51 131.279 123.626 425.390 1.00 68.58 N ATOM 509 CA GLY A 51 130.612 124.066 426.599 1.00 73.66 C ATOM 510 C GLY A 51 131.524 124.635 427.665 1.00 79.09 C ATOM 511 O GLY A 51 131.047 125.365 428.541 1.00 84.85 O ATOM 512 H GLY A 51 131.456 122.612 425.241 1.00 0.00 H ATOM 513 N GLY A 52 132.819 124.336 427.611 1.00 78.72 N ATOM 514 CA GLY A 52 133.750 124.747 428.638 1.00 80.37 C ATOM 515 C GLY A 52 134.520 126.000 428.269 1.00 80.89 C ATOM 516 O GLY A 52 134.112 126.789 427.408 1.00 80.45 O ATOM 517 H GLY A 52 133.174 123.788 426.802 1.00 0.00 H ATOM 518 N SER A 53 135.647 126.193 428.947 1.00 76.35 N ATOM 519 CA SER A 53 136.554 127.264 428.581 1.00 84.90 C ATOM 520 C SER A 53 137.172 126.978 427.209 1.00 87.83 C ATOM 521 O SER A 53 136.969 125.915 426.609 1.00 86.95 O ATOM 522 CB SER A 53 137.637 127.435 429.645 1.00 88.17 C ATOM 523 OG SER A 53 138.422 126.262 429.757 1.00 89.91 O ATOM 524 HG SER A 53 139.116 126.396 430.451 1.00 0.00 H ATOM 525 H SER A 53 135.880 125.571 429.747 1.00 0.00 H ATOM 526 N LYS A 73 137.969 127.942 426.731 1.00 89.33 N ATOM 527 CA LYS A 73 138.508 127.981 425.371 1.00 89.04 C ATOM 528 C LYS A 73 139.115 126.664 424.895 1.00 86.38 C ATOM 529 O LYS A 73 138.613 126.038 423.951 1.00 81.42 O ATOM 530 CB LYS A 73 139.565 129.085 425.265 1.00 94.76 C ATOM 531 H LYS A 73 138.223 128.720 427.373 1.00 0.00 H ATOM 532 N HIS A 74 140.212 126.246 425.512 1.00 92.22 N ATOM 533 CA HIS A 74 140.863 125.031 425.045 1.00 96.12 C ATOM 534 C HIS A 74 140.795 123.951 426.116 1.00 89.10 C ATOM 535 O HIS A 74 141.783 123.251 426.365 1.00 89.20 O ATOM 536 CB HIS A 74 142.300 125.322 424.619 1.00109.43 C ATOM 537 CG HIS A 74 143.221 125.672 425.747 1.00122.71 C ATOM 538 ND1 HIS A 74 143.444 124.831 426.817 1.00125.74 N ATOM 539 CD2 HIS A 74 143.988 126.769 425.965 1.00127.51 C ATOM 540 CE1 HIS A 74 144.294 125.401 427.653 1.00128.67 C ATOM 541 NE2 HIS A 74 144.643 126.576 427.158 1.00129.44 N ATOM 542 H HIS A 74 140.601 126.778 426.317 1.00 0.00 H ATOM 543 N ARG A 75 139.637 123.815 426.774 1.00 81.34 N ATOM 544 CA ARG A 75 139.539 122.841 427.852 1.00 73.12 C ATOM 545 C ARG A 75 139.542 121.411 427.322 1.00 67.22 C ATOM 546 O ARG A 75 140.150 120.526 427.932 1.00 68.14 O ATOM 547 CB ARG A 75 138.288 123.107 428.686 1.00 72.27 C ATOM 548 CG ARG A 75 137.797 121.891 429.460 1.00 68.70 C ATOM 549 CD ARG A 75 136.915 122.277 430.664 1.00 72.84 C ATOM 550 NE ARG A 75 136.616 121.110 431.493 1.00 73.05 N ATOM 551 CZ ARG A 75 135.760 121.105 432.511 1.00 75.82 C ATOM 552 NH1 ARG A 75 135.112 122.216 432.848 1.00 72.39 N ATOM 553 NH2 ARG A 75 135.556 119.982 433.189 1.00 73.75 N ATOM 554 HE ARG A 75 137.108 120.221 431.271 1.00 0.00 H ATOM 555 HH12 ARG A 75 134.444 122.207 433.645 1.00 0.00 H ATOM 556 HH11 ARG A 75 135.273 123.094 432.315 1.00 0.00 H ATOM 557 HH22 ARG A 75 134.888 119.970 433.986 1.00 0.00 H ATOM 558 HH21 ARG A 75 136.064 119.114 432.923 1.00 0.00 H ATOM 559 H ARG A 75 138.816 124.399 426.518 1.00 0.00 H ATOM 560 N PHE A 76 138.904 121.155 426.187 1.00 63.64 N ATOM 561 CA PHE A 76 138.751 119.785 425.716 1.00 68.14 C ATOM 562 C PHE A 76 139.609 119.507 424.491 1.00 68.76 C ATOM 563 O PHE A 76 139.789 120.367 423.631 1.00 62.71 O ATOM 564 CB PHE A 76 137.292 119.494 425.407 1.00 67.31 C ATOM 565 CG PHE A 76 136.425 119.549 426.619 1.00 65.10 C ATOM 566 CD1 PHE A 76 136.428 118.507 427.529 1.00 66.34 C ATOM 567 CD2 PHE A 76 135.651 120.665 426.879 1.00 62.10 C ATOM 568 CE1 PHE A 76 135.638 118.561 428.676 1.00 67.05 C ATOM 569 CE2 PHE A 76 134.858 120.725 428.012 1.00 65.71 C ATOM 570 CZ PHE A 76 134.857 119.673 428.916 1.00 65.53 C ATOM 571 H PHE A 76 138.510 121.939 425.629 1.00 0.00 H ATOM 572 N GLU A 77 140.147 118.302 424.421 1.00 73.42 N ATOM 573 CA GLU A 77 140.714 117.780 423.186 1.00 69.99 C ATOM 574 C GLU A 77 139.657 116.905 422.521 1.00 67.54 C ATOM 575 O GLU A 77 139.057 116.039 423.173 1.00 66.49 O ATOM 576 CB GLU A 77 141.992 116.982 423.458 1.00 71.55 C ATOM 577 CG GLU A 77 142.731 116.594 422.210 1.00 74.58 C ATOM 578 CD GLU A 77 143.561 117.738 421.648 1.00 74.62 C ATOM 579 OE1 GLU A 77 144.508 118.183 422.339 1.00 74.90 O ATOM 580 OE2 GLU A 77 143.258 118.196 420.521 1.00 71.17 O ATOM 581 H GLU A 77 140.166 117.708 425.275 1.00 0.00 H ATOM 582 N ILE A 78 139.392 117.171 421.251 1.00 65.09 N ATOM 583 CA ILE A 78 138.404 116.429 420.477 1.00 65.79 C ATOM 584 C ILE A 78 139.101 115.238 419.841 1.00 64.70 C ATOM 585 O ILE A 78 139.988 115.409 419.000 1.00 68.07 O ATOM 586 CB ILE A 78 137.771 117.321 419.398 1.00 70.29 C ATOM 587 CG1 ILE A 78 136.766 118.298 420.005 1.00 68.78 C ATOM 588 CG2 ILE A 78 137.056 116.488 418.346 1.00 73.93 C ATOM 589 CD1 ILE A 78 136.655 119.608 419.234 1.00 67.16 C ATOM 590 H ILE A 78 139.911 117.943 420.786 1.00 0.00 H ATOM 591 N ILE A 79 138.687 114.033 420.215 1.00 64.44 N ATOM 592 CA ILE A 79 139.259 112.809 419.672 1.00 69.03 C ATOM 593 C ILE A 79 138.322 112.142 418.667 1.00 69.24 C ATOM 594 O ILE A 79 138.774 111.587 417.661 1.00 74.14 O ATOM 595 CB ILE A 79 139.640 111.837 420.810 1.00 71.26 C ATOM 596 CG1 ILE A 79 140.836 112.392 421.577 1.00 73.54 C ATOM 597 CG2 ILE A 79 139.974 110.457 420.272 1.00 71.63 C ATOM 598 CD1 ILE A 79 140.703 112.298 423.037 1.00 77.70 C ATOM 599 H ILE A 79 137.927 113.961 420.921 1.00 0.00 H ATOM 600 N GLU A 80 137.018 112.236 418.902 1.00 63.72 N ATOM 601 CA GLU A 80 136.023 111.769 417.950 1.00 63.45 C ATOM 602 C GLU A 80 136.083 112.640 416.711 1.00 65.05 C ATOM 603 O GLU A 80 136.478 113.805 416.774 1.00 65.40 O ATOM 604 CB GLU A 80 134.620 111.828 418.579 1.00 65.45 C ATOM 605 CG GLU A 80 133.470 111.375 417.704 1.00 67.11 C ATOM 606 CD GLU A 80 133.618 109.936 417.227 1.00 70.47 C ATOM 607 OE1 GLU A 80 133.240 108.999 417.969 1.00 65.40 O ATOM 608 OE2 GLU A 80 134.124 109.750 416.091 1.00 75.23 O ATOM 609 H GLU A 80 136.698 112.658 419.797 1.00 0.00 H ATOM 610 N GLY A 81 135.734 112.057 415.564 1.00 64.43 N ATOM 611 CA GLY A 81 135.733 112.789 414.315 1.00 64.98 C ATOM 612 C GLY A 81 137.041 112.781 413.563 1.00 69.83 C ATOM 613 O GLY A 81 137.121 113.396 412.500 1.00 78.34 O ATOM 614 H GLY A 81 135.456 111.055 415.567 1.00 0.00 H ATOM 615 N ARG A 82 138.066 112.114 414.075 1.00 68.98 N ATOM 616 CA ARG A 82 139.328 111.939 413.376 1.00 73.03 C ATOM 617 C ARG A 82 139.420 110.532 412.797 1.00 78.57 C ATOM 618 O ARG A 82 138.670 109.631 413.176 1.00 78.45 O ATOM 619 CB ARG A 82 140.505 112.156 414.318 1.00 71.14 C ATOM 620 CG ARG A 82 140.475 113.387 415.145 1.00 68.19 C ATOM 621 CD ARG A 82 141.801 113.483 415.842 1.00 72.06 C ATOM 622 NE ARG A 82 141.801 114.529 416.843 1.00 69.40 N ATOM 623 CZ ARG A 82 142.468 115.669 416.725 1.00 70.10 C ATOM 624 NH1 ARG A 82 143.199 115.909 415.631 1.00 64.25 N ATOM 625 NH2 ARG A 82 142.395 116.563 417.711 1.00 68.24 N ATOM 626 HE ARG A 82 141.244 114.377 417.708 1.00 0.00 H ATOM 627 HH12 ARG A 82 143.721 116.804 415.541 1.00 0.00 H ATOM 628 HH11 ARG A 82 143.245 115.201 414.871 1.00 0.00 H ATOM 629 HH22 ARG A 82 142.911 117.463 417.636 1.00 0.00 H ATOM 630 HH21 ARG A 82 141.822 116.361 418.555 1.00 0.00 H ATOM 631 H ARG A 82 137.962 111.696 415.022 1.00 0.00 H ATOM 632 N ASP A 83 140.382 110.336 411.895 1.00 79.09 N ATOM 633 CA ASP A 83 140.679 108.983 411.458 1.00 83.90 C ATOM 634 C ASP A 83 141.332 108.208 412.594 1.00 84.99 C ATOM 635 O ASP A 83 142.008 108.780 413.453 1.00 85.55 O ATOM 636 CB ASP A 83 141.588 108.989 410.239 1.00 95.03 C ATOM 637 CG ASP A 83 142.807 109.857 410.435 1.00101.20 C ATOM 638 OD1 ASP A 83 143.783 109.382 411.062 1.00100.88 O ATOM 639 OD2 ASP A 83 142.784 111.012 409.950 1.00104.87 O ATOM 640 H ASP A 83 140.913 111.142 411.509 1.00 0.00 H ATOM 641 N ARG A 84 141.115 106.889 412.588 1.00 83.70 N ATOM 642 CA ARG A 84 141.506 106.061 413.719 1.00 82.39 C ATOM 643 C ARG A 84 142.967 106.281 414.097 1.00 86.04 C ATOM 644 O ARG A 84 143.297 106.393 415.282 1.00 86.62 O ATOM 645 CB ARG A 84 141.242 104.591 413.395 1.00 86.73 C ATOM 646 H ARG A 84 140.660 106.448 411.763 1.00 0.00 H ATOM 647 N ILE A 85 143.852 106.391 413.103 1.00 87.67 N ATOM 648 CA ILE A 85 145.286 106.464 413.384 1.00 88.92 C ATOM 649 C ILE A 85 145.634 107.770 414.086 1.00 83.04 C ATOM 650 O ILE A 85 146.383 107.781 415.072 1.00 82.96 O ATOM 651 CB ILE A 85 146.101 106.289 412.091 1.00 96.18 C ATOM 652 CG1 ILE A 85 146.094 104.818 411.662 1.00105.20 C ATOM 653 CG2 ILE A 85 147.530 106.801 412.279 1.00 93.74 C ATOM 654 CD1 ILE A 85 144.930 104.467 410.749 1.00110.08 C ATOM 655 H ILE A 85 143.518 106.425 412.119 1.00 0.00 H ATOM 656 N MET A 86 145.100 108.890 413.594 1.00 77.50 N ATOM 657 CA MET A 86 145.408 110.166 414.226 1.00 77.62 C ATOM 658 C MET A 86 144.751 110.281 415.594 1.00 76.38 C ATOM 659 O MET A 86 145.344 110.832 416.529 1.00 77.70 O ATOM 660 CB MET A 86 144.975 111.324 413.331 1.00 80.65 C ATOM 661 CG MET A 86 145.421 112.687 413.850 1.00 84.86 C ATOM 662 SD MET A 86 147.215 112.850 414.024 1.00 95.60 S ATOM 663 CE MET A 86 147.324 114.517 414.676 1.00 95.01 C ATOM 664 H MET A 86 144.470 108.852 412.767 1.00 0.00 H ATOM 665 N ALA A 87 143.522 109.783 415.734 1.00 72.08 N ATOM 666 CA ALA A 87 142.880 109.816 417.039 1.00 68.43 C ATOM 667 C ALA A 87 143.725 109.076 418.068 1.00 75.54 C ATOM 668 O ALA A 87 143.937 109.566 419.184 1.00 76.70 O ATOM 669 CB ALA A 87 141.476 109.215 416.954 1.00 63.00 C ATOM 670 H ALA A 87 143.026 109.374 414.916 1.00 0.00 H ATOM 671 N TRP A 88 144.259 107.916 417.695 1.00 76.66 N ATOM 672 CA TRP A 88 145.102 107.179 418.625 1.00 77.29 C ATOM 673 C TRP A 88 146.403 107.925 418.895 1.00 73.53 C ATOM 674 O TRP A 88 146.899 107.914 420.027 1.00 68.47 O ATOM 675 CB TRP A 88 145.373 105.770 418.093 1.00 80.14 C ATOM 676 CG TRP A 88 144.336 104.764 418.529 1.00 87.26 C ATOM 677 CD1 TRP A 88 143.470 104.072 417.728 1.00 89.63 C ATOM 678 CD2 TRP A 88 144.058 104.344 419.873 1.00 87.79 C ATOM 679 NE1 TRP A 88 142.679 103.240 418.490 1.00 88.74 N ATOM 680 CE2 TRP A 88 143.016 103.394 419.808 1.00 88.49 C ATOM 681 CE3 TRP A 88 144.590 104.678 421.124 1.00 87.16 C ATOM 682 CZ2 TRP A 88 142.493 102.776 420.945 1.00 89.16 C ATOM 683 CZ3 TRP A 88 144.064 104.065 422.256 1.00 85.97 C ATOM 684 CH2 TRP A 88 143.028 103.124 422.155 1.00 85.65 C ATOM 685 HE1 TRP A 88 141.946 102.600 418.124 1.00 0.00 H ATOM 686 H TRP A 88 144.075 107.538 416.744 1.00 0.00 H ATOM 687 N THR A 89 146.953 108.608 417.884 1.00 69.48 N ATOM 688 CA THR A 89 148.191 109.351 418.101 1.00 67.93 C ATOM 689 C THR A 89 147.994 110.438 419.152 1.00 63.53 C ATOM 690 O THR A 89 148.855 110.653 420.010 1.00 66.58 O ATOM 691 CB THR A 89 148.690 109.956 416.777 1.00 72.21 C ATOM 692 OG1 THR A 89 148.970 108.910 415.835 1.00 76.60 O ATOM 693 CG2 THR A 89 149.963 110.763 416.998 1.00 70.40 C ATOM 694 HG1 THR A 89 148.145 108.390 415.666 1.00 0.00 H ATOM 695 H THR A 89 146.500 108.610 416.948 1.00 0.00 H ATOM 696 N VAL A 90 146.848 111.113 419.122 1.00 66.72 N ATOM 697 CA VAL A 90 146.589 112.170 420.095 1.00 67.68 C ATOM 698 C VAL A 90 146.329 111.566 421.464 1.00 67.65 C ATOM 699 O VAL A 90 146.590 112.198 422.499 1.00 64.61 O ATOM 700 CB VAL A 90 145.423 113.052 419.607 1.00 63.43 C ATOM 701 CG1 VAL A 90 144.919 113.958 420.718 1.00 62.12 C ATOM 702 CG2 VAL A 90 145.867 113.881 418.397 1.00 64.95 C ATOM 703 H VAL A 90 146.133 110.886 418.402 1.00 0.00 H ATOM 704 N VAL A 91 145.842 110.328 421.507 1.00 67.40 N ATOM 705 CA VAL A 91 145.644 109.678 422.795 1.00 67.23 C ATOM 706 C VAL A 91 146.986 109.421 423.476 1.00 69.56 C ATOM 707 O VAL A 91 147.138 109.668 424.681 1.00 70.72 O ATOM 708 CB VAL A 91 144.824 108.383 422.627 1.00 68.96 C ATOM 709 CG1 VAL A 91 144.882 107.520 423.902 1.00 69.07 C ATOM 710 CG2 VAL A 91 143.373 108.716 422.255 1.00 62.82 C ATOM 711 H VAL A 91 145.604 109.828 420.626 1.00 0.00 H ATOM 712 N ASN A 92 147.976 108.898 422.735 1.00 74.19 N ATOM 713 CA ASN A 92 149.264 108.629 423.384 1.00 81.59 C ATOM 714 C ASN A 92 149.921 109.913 423.867 1.00 82.24 C ATOM 715 O ASN A 92 150.485 109.946 424.966 1.00 86.44 O ATOM 716 CB ASN A 92 150.240 107.889 422.472 1.00 89.34 C ATOM 717 CG ASN A 92 149.625 106.730 421.753 1.00 96.72 C ATOM 718 OD1 ASN A 92 149.050 106.891 420.695 1.00101.04 O ATOM 719 ND2 ASN A 92 149.768 105.541 422.313 1.00103.35 N ATOM 720 HD22 ASN A 92 150.268 105.450 423.220 1.00 0.00 H ATOM 721 HD21 ASN A 92 149.380 104.696 421.846 1.00 0.00 H ATOM 722 H ASN A 92 147.833 108.689 421.726 1.00 0.00 H ATOM 723 N SER A 93 149.875 110.974 423.056 1.00 77.57 N ATOM 724 CA SER A 93 150.468 112.241 423.476 1.00 77.76 C ATOM 725 C SER A 93 149.831 112.733 424.761 1.00 62.70 C ATOM 726 O SER A 93 150.523 113.203 425.669 1.00 64.03 O ATOM 727 CB SER A 93 150.320 113.307 422.384 1.00 74.56 C ATOM 728 OG SER A 93 150.794 112.864 421.138 1.00 74.60 O ATOM 729 HG SER A 93 150.283 112.064 420.857 1.00 0.00 H ATOM 730 H SER A 93 149.417 110.898 422.125 1.00 0.00 H ATOM 731 N ILE A 94 148.503 112.687 424.830 1.00 60.86 N ATOM 732 CA ILE A 94 147.826 113.065 426.063 1.00 69.85 C ATOM 733 C ILE A 94 148.292 112.170 427.205 1.00 75.77 C ATOM 734 O ILE A 94 148.641 112.649 428.289 1.00 79.06 O ATOM 735 CB ILE A 94 146.298 113.004 425.886 1.00 66.98 C ATOM 736 CG1 ILE A 94 145.842 114.124 424.953 1.00 65.53 C ATOM 737 CG2 ILE A 94 145.599 113.088 427.247 1.00 64.55 C ATOM 738 CD1 ILE A 94 144.391 114.054 424.598 1.00 57.52 C ATOM 739 H ILE A 94 147.949 112.381 424.005 1.00 0.00 H ATOM 740 N CYS A 95 148.334 110.859 426.963 1.00 77.60 N ATOM 741 CA CYS A 95 148.755 109.925 428.001 1.00 84.96 C ATOM 742 C CYS A 95 150.192 110.192 428.429 1.00 87.89 C ATOM 743 O CYS A 95 150.490 110.272 429.628 1.00 83.51 O ATOM 744 CB CYS A 95 148.596 108.485 427.508 1.00 87.29 C ATOM 745 SG CYS A 95 146.883 107.902 427.472 1.00 87.23 S ATOM 746 H CYS A 95 148.064 110.499 426.025 1.00 0.00 H ATOM 747 N ASN A 96 151.101 110.343 427.459 1.00 89.39 N ATOM 748 CA ASN A 96 152.508 110.514 427.796 1.00 94.16 C ATOM 749 C ASN A 96 152.818 111.899 428.346 1.00 93.99 C ATOM 750 O ASN A 96 153.945 112.125 428.805 1.00 98.89 O ATOM 751 CB ASN A 96 153.390 110.226 426.578 1.00100.07 C ATOM 752 CG ASN A 96 153.427 108.743 426.217 1.00106.36 C ATOM 753 OD1 ASN A 96 152.490 108.212 425.616 1.00104.75 O ATOM 754 ND2 ASN A 96 154.509 108.063 426.606 1.00109.50 N ATOM 755 HD22 ASN A 96 155.276 108.551 427.111 1.00 0.00 H ATOM 756 HD21 ASN A 96 154.584 107.046 426.404 1.00 0.00 H ATOM 757 H ASN A 96 150.803 110.338 426.463 1.00 0.00 H ATOM 758 N THR A 97 151.848 112.812 428.329 1.00 86.64 N ATOM 759 CA THR A 97 151.996 114.152 428.883 1.00 87.97 C ATOM 760 C THR A 97 151.331 114.293 430.247 1.00 91.65 C ATOM 761 O THR A 97 151.861 114.979 431.127 1.00 94.52 O ATOM 762 CB THR A 97 151.420 115.179 427.898 1.00 89.47 C ATOM 763 OG1 THR A 97 152.394 115.457 426.885 1.00 96.60 O ATOM 764 CG2 THR A 97 150.997 116.481 428.591 1.00 87.46 C ATOM 765 HG1 THR A 97 152.026 116.119 426.248 1.00 0.00 H ATOM 766 H THR A 97 150.937 112.555 427.898 1.00 0.00 H ATOM 767 N THR A 98 150.202 113.617 430.457 1.00 89.16 N ATOM 768 CA THR A 98 149.437 113.734 431.691 1.00 89.15 C ATOM 769 C THR A 98 149.745 112.631 432.700 1.00 95.11 C ATOM 770 O THR A 98 149.575 112.843 433.906 1.00 90.96 O ATOM 771 CB THR A 98 147.943 113.681 431.378 1.00 88.50 C ATOM 772 OG1 THR A 98 147.651 112.432 430.732 1.00 86.89 O ATOM 773 CG2 THR A 98 147.558 114.820 430.452 1.00 90.84 C ATOM 774 HG1 THR A 98 148.173 112.366 429.893 1.00 0.00 H ATOM 775 H THR A 98 149.854 112.981 429.711 1.00 0.00 H ATOM 776 N GLY A 99 150.163 111.455 432.236 1.00 99.39 N ATOM 777 CA GLY A 99 150.285 110.297 433.088 1.00101.87 C ATOM 778 C GLY A 99 149.035 109.444 433.184 1.00106.50 C ATOM 779 O GLY A 99 149.040 108.452 433.926 1.00112.83 O ATOM 780 H GLY A 99 150.409 111.369 431.229 1.00 0.00 H ATOM 781 N VAL A 100 147.959 109.806 432.479 1.00104.17 N ATOM 782 CA VAL A 100 146.786 108.945 432.419 1.00103.12 C ATOM 783 C VAL A 100 147.137 107.657 431.675 1.00103.58 C ATOM 784 O VAL A 100 148.028 107.632 430.814 1.00102.61 O ATOM 785 CB VAL A 100 145.617 109.682 431.742 1.00100.73 C ATOM 786 CG1 VAL A 100 144.320 108.875 431.836 1.00101.22 C ATOM 787 CG2 VAL A 100 145.419 111.042 432.384 1.00 99.49 C ATOM 788 H VAL A 100 147.959 110.712 431.968 1.00 0.00 H ATOM 789 N GLU A 101 146.445 106.570 432.025 1.00103.04 N ATOM 790 CA GLU A 101 146.658 105.297 431.354 1.00103.39 C ATOM 791 C GLU A 101 145.860 105.231 430.057 1.00 98.23 C ATOM 792 O GLU A 101 144.796 105.840 429.923 1.00 94.74 O ATOM 793 CB GLU A 101 146.293 104.123 432.266 1.00107.38 C ATOM 794 CG GLU A 101 144.903 104.170 432.867 1.00108.21 C ATOM 795 CD GLU A 101 144.571 102.900 433.638 1.00113.94 C ATOM 796 OE1 GLU A 101 145.004 101.817 433.192 1.00116.45 O ATOM 797 OE2 GLU A 101 143.897 102.984 434.692 1.00114.80 O ATOM 798 H GLU A 101 145.743 106.634 432.789 1.00 0.00 H ATOM 799 N LYS A 102 146.396 104.489 429.098 1.00 98.69 N ATOM 800 CA LYS A 102 145.804 104.405 427.764 1.00 97.53 C ATOM 801 C LYS A 102 144.506 103.611 427.788 1.00 97.36 C ATOM 802 O LYS A 102 144.524 102.433 428.167 1.00101.78 O ATOM 803 CB LYS A 102 146.787 103.751 426.797 1.00101.12 C ATOM 804 CG LYS A 102 148.072 104.526 426.581 1.00105.25 C ATOM 805 CD LYS A 102 148.729 104.174 425.246 1.00105.08 C ATOM 806 CE LYS A 102 147.697 103.837 424.179 1.00104.08 C ATOM 807 NZ LYS A 102 148.321 103.230 422.961 1.00106.98 N ATOM 808 HZ1 LYS A 102 149.003 103.900 422.552 1.00 0.00 H ATOM 809 HZ2 LYS A 102 148.812 102.352 423.225 1.00 0.00 H ATOM 810 HZ3 LYS A 102 147.580 103.018 422.263 1.00 0.00 H ATOM 811 H LYS A 102 147.263 103.951 429.301 1.00 0.00 H ATOM 812 N PRO A 103 143.377 104.187 427.379 1.00 92.56 N ATOM 813 CA PRO A 103 142.141 103.400 427.314 1.00 90.27 C ATOM 814 C PRO A 103 142.258 102.276 426.296 1.00 89.91 C ATOM 815 O PRO A 103 143.045 102.340 425.350 1.00 84.32 O ATOM 816 CB PRO A 103 141.080 104.426 426.893 1.00 83.97 C ATOM 817 CG PRO A 103 141.854 105.526 426.261 1.00 80.90 C ATOM 818 CD PRO A 103 143.170 105.583 426.965 1.00 83.14 C ATOM 819 N LYS A 104 141.476 101.219 426.519 1.00 95.25 N ATOM 820 CA LYS A 104 141.448 100.113 425.569 1.00 94.89 C ATOM 821 C LYS A 104 140.740 100.521 424.289 1.00 91.41 C ATOM 822 O LYS A 104 141.147 100.124 423.191 1.00 93.87 O ATOM 823 CB LYS A 104 140.762 98.900 426.196 1.00 95.72 C ATOM 824 H LYS A 104 140.884 101.183 427.373 1.00 0.00 H ATOM 825 N PHE A 105 139.681 101.312 424.413 1.00 86.42 N ATOM 826 CA PHE A 105 138.880 101.768 423.294 1.00 83.41 C ATOM 827 C PHE A 105 139.034 103.272 423.153 1.00 83.96 C ATOM 828 O PHE A 105 139.271 103.979 424.138 1.00 81.47 O ATOM 829 CB PHE A 105 137.401 101.431 423.496 1.00 85.95 C ATOM 830 CG PHE A 105 137.080 99.977 423.331 1.00 93.53 C ATOM 831 CD1 PHE A 105 137.059 99.398 422.069 1.00 94.04 C ATOM 832 CD2 PHE A 105 136.799 99.187 424.438 1.00 98.35 C ATOM 833 CE1 PHE A 105 136.760 98.058 421.909 1.00 99.10 C ATOM 834 CE2 PHE A 105 136.498 97.845 424.290 1.00101.85 C ATOM 835 CZ PHE A 105 136.478 97.279 423.020 1.00102.76 C ATOM 836 H PHE A 105 139.410 101.622 425.368 1.00 0.00 H ATOM 837 N LEU A 106 138.884 103.752 421.924 1.00 83.93 N ATOM 838 CA LEU A 106 139.013 105.176 421.634 1.00 81.02 C ATOM 839 C LEU A 106 137.922 105.971 422.342 1.00 80.14 C ATOM 840 O LEU A 106 136.731 105.712 422.118 1.00 75.20 O ATOM 841 CB LEU A 106 138.926 105.415 420.134 1.00 78.45 C ATOM 842 CG LEU A 106 140.228 105.530 419.350 1.00 83.79 C ATOM 843 CD1 LEU A 106 139.934 105.675 417.857 1.00 84.46 C ATOM 844 CD2 LEU A 106 141.045 106.709 419.862 1.00 81.22 C ATOM 845 H LEU A 106 138.669 103.095 421.147 1.00 0.00 H ATOM 846 N PRO A 107 138.263 106.945 423.171 1.00 79.85 N ATOM 847 CA PRO A 107 137.227 107.819 423.735 1.00 75.75 C ATOM 848 C PRO A 107 136.839 108.922 422.763 1.00 71.11 C ATOM 849 O PRO A 107 137.315 108.937 421.611 1.00 65.47 O ATOM 850 CB PRO A 107 137.896 108.380 424.995 1.00 78.26 C ATOM 851 CG PRO A 107 139.337 108.465 424.606 1.00 81.76 C ATOM 852 CD PRO A 107 139.607 107.298 423.659 1.00 81.59 C ATOM 853 N ASP A 108 135.977 109.843 423.216 1.00 64.07 N ATOM 854 CA ASP A 108 135.455 110.917 422.380 1.00 65.30 C ATOM 855 C ASP A 108 136.113 112.264 422.641 1.00 64.11 C ATOM 856 O ASP A 108 136.217 113.077 421.711 1.00 60.12 O ATOM 857 CB ASP A 108 133.947 111.075 422.590 1.00 68.79 C ATOM 858 CG ASP A 108 133.147 109.925 422.004 1.00 71.26 C ATOM 859 OD1 ASP A 108 133.270 109.654 420.801 1.00 69.55 O ATOM 860 OD2 ASP A 108 132.396 109.288 422.766 1.00 71.73 O ATOM 861 H ASP A 108 135.667 109.789 424.207 1.00 0.00 H ATOM 862 N LEU A 109 136.548 112.516 423.878 1.00 61.41 N ATOM 863 CA LEU A 109 137.145 113.781 424.274 1.00 59.75 C ATOM 864 C LEU A 109 138.178 113.530 425.357 1.00 65.34 C ATOM 865 O LEU A 109 138.195 112.472 425.996 1.00 69.35 O ATOM 866 CB LEU A 109 136.101 114.775 424.797 1.00 58.37 C ATOM 867 CG LEU A 109 134.874 115.121 423.952 1.00 62.99 C ATOM 868 CD1 LEU A 109 133.818 115.783 424.797 1.00 66.13 C ATOM 869 CD2 LEU A 109 135.281 116.020 422.810 1.00 64.74 C ATOM 870 H LEU A 109 136.455 111.769 424.595 1.00 0.00 H ATOM 871 N TYR A 110 139.022 114.537 425.587 1.00 63.10 N ATOM 872 CA TYR A 110 139.855 114.577 426.780 1.00 71.32 C ATOM 873 C TYR A 110 139.625 115.899 427.490 1.00 73.89 C ATOM 874 O TYR A 110 139.647 116.956 426.851 1.00 75.61 O ATOM 875 CB TYR A 110 141.343 114.401 426.464 1.00 71.64 C ATOM 876 CG TYR A 110 142.179 114.356 427.725 1.00 74.09 C ATOM 877 CD1 TYR A 110 142.212 113.214 428.509 1.00 72.88 C ATOM 878 CD2 TYR A 110 142.908 115.464 428.152 1.00 75.48 C ATOM 879 CE1 TYR A 110 142.965 113.159 429.671 1.00 75.40 C ATOM 880 CE2 TYR A 110 143.663 115.419 429.317 1.00 74.35 C ATOM 881 CZ TYR A 110 143.683 114.267 430.071 1.00 79.06 C ATOM 882 OH TYR A 110 144.428 114.210 431.236 1.00 83.93 O ATOM 883 HH TYR A 110 144.106 114.902 431.867 1.00 0.00 H ATOM 884 H TYR A 110 139.086 115.313 424.897 1.00 0.00 H ATOM 885 N ASP A 111 139.418 115.836 428.808 1.00 73.69 N ATOM 886 CA ASP A 111 139.208 117.026 429.632 1.00 71.53 C ATOM 887 C ASP A 111 140.549 117.458 430.221 1.00 71.88 C ATOM 888 O ASP A 111 141.093 116.782 431.097 1.00 70.05 O ATOM 889 CB ASP A 111 138.195 116.740 430.742 1.00 69.41 C ATOM 890 CG ASP A 111 137.700 118.015 431.431 1.00 74.63 C ATOM 891 OD1 ASP A 111 138.451 119.016 431.516 1.00 76.73 O ATOM 892 OD2 ASP A 111 136.542 118.013 431.892 1.00 79.37 O ATOM 893 H ASP A 111 139.406 114.903 429.267 1.00 0.00 H ATOM 894 N TYR A 112 141.085 118.586 429.755 1.00 74.21 N ATOM 895 CA TYR A 112 142.350 119.057 430.322 1.00 78.03 C ATOM 896 C TYR A 112 142.175 119.584 431.740 1.00 79.08 C ATOM 897 O TYR A 112 143.118 119.539 432.535 1.00 82.22 O ATOM 898 CB TYR A 112 142.973 120.138 429.439 1.00 76.21 C ATOM 899 CG TYR A 112 143.756 119.566 428.276 1.00 78.93 C ATOM 900 CD1 TYR A 112 144.877 118.768 428.495 1.00 81.90 C ATOM 901 CD2 TYR A 112 143.356 119.797 426.960 1.00 75.83 C ATOM 902 CE1 TYR A 112 145.586 118.236 427.439 1.00 84.18 C ATOM 903 CE2 TYR A 112 144.061 119.261 425.893 1.00 75.04 C ATOM 904 CZ TYR A 112 145.173 118.490 426.140 1.00 79.49 C ATOM 905 OH TYR A 112 145.875 117.954 425.095 1.00 79.90 O ATOM 906 HH TYR A 112 145.281 117.361 424.570 1.00 0.00 H ATOM 907 H TYR A 112 140.612 119.123 429.000 1.00 0.00 H ATOM 908 N LYS A 113 140.990 120.095 432.070 1.00 74.60 N ATOM 909 CA LYS A 113 140.770 120.653 433.398 1.00 76.62 C ATOM 910 C LYS A 113 140.673 119.547 434.444 1.00 80.45 C ATOM 911 O LYS A 113 141.344 119.603 435.481 1.00 82.59 O ATOM 912 CB LYS A 113 139.509 121.523 433.403 1.00 75.10 C ATOM 913 CG LYS A 113 139.126 122.041 434.781 1.00 83.18 C ATOM 914 CD LYS A 113 138.106 123.176 434.696 1.00 86.45 C ATOM 915 CE LYS A 113 137.389 123.379 436.029 1.00 86.47 C ATOM 916 NZ LYS A 113 136.615 124.647 436.045 1.00 86.35 N ATOM 917 HZ1 LYS A 113 137.261 125.448 435.893 1.00 0.00 H ATOM 918 HZ2 LYS A 113 135.902 124.626 435.288 1.00 0.00 H ATOM 919 HZ3 LYS A 113 136.142 124.751 436.965 1.00 0.00 H ATOM 920 H LYS A 113 140.216 120.096 431.375 1.00 0.00 H ATOM 921 N GLU A 114 139.853 118.527 434.187 1.00 78.69 N ATOM 922 CA GLU A 114 139.692 117.426 435.134 1.00 80.22 C ATOM 923 C GLU A 114 140.639 116.267 434.855 1.00 81.67 C ATOM 924 O GLU A 114 140.674 115.311 435.637 1.00 79.06 O ATOM 925 CB GLU A 114 138.250 116.919 435.121 1.00 80.01 C ATOM 926 CG GLU A 114 137.219 118.040 435.164 1.00 85.20 C ATOM 927 CD GLU A 114 136.685 118.301 436.569 1.00 93.44 C ATOM 928 OE1 GLU A 114 137.282 117.780 437.543 1.00 93.61 O ATOM 929 OE2 GLU A 114 135.677 119.041 436.695 1.00 97.36 O ATOM 930 H GLU A 114 139.318 118.515 433.295 1.00 0.00 H ATOM 931 N ASN A 115 141.384 116.324 433.749 1.00 79.78 N ATOM 932 CA ASN A 115 142.425 115.349 433.421 1.00 81.99 C ATOM 933 C ASN A 115 141.861 113.927 433.293 1.00 79.82 C ATOM 934 O ASN A 115 142.309 112.993 433.965 1.00 80.06 O ATOM 935 CB ASN A 115 143.570 115.425 434.445 1.00 88.47 C ATOM 936 CG ASN A 115 144.550 116.561 434.134 1.00 92.83 C ATOM 937 OD1 ASN A 115 145.300 116.498 433.156 1.00 95.43 O ATOM 938 ND2 ASN A 115 144.524 117.611 434.945 1.00 92.61 N ATOM 939 HD22 ASN A 115 143.876 117.624 435.759 1.00 0.00 H ATOM 940 HD21 ASN A 115 145.151 118.421 434.767 1.00 0.00 H ATOM 941 H ASN A 115 141.215 117.105 433.083 1.00 0.00 H ATOM 942 N ARG A 116 140.894 113.763 432.377 1.00 77.55 N ATOM 943 CA ARG A 116 140.303 112.447 432.135 1.00 77.78 C ATOM 944 C ARG A 116 139.691 112.378 430.739 1.00 69.78 C ATOM 945 O ARG A 116 139.263 113.386 430.183 1.00 72.12 O ATOM 946 CB ARG A 116 139.242 112.100 433.201 1.00 79.01 C ATOM 947 CG ARG A 116 138.063 113.078 433.262 1.00 78.52 C ATOM 948 CD ARG A 116 137.317 113.081 434.619 1.00 79.21 C ATOM 949 NE ARG A 116 136.275 114.106 434.613 1.00 78.28 N ATOM 950 CZ ARG A 116 135.480 114.423 435.637 1.00 74.98 C ATOM 951 NH1 ARG A 116 135.586 113.802 436.810 1.00 74.21 N ATOM 952 NH2 ARG A 116 134.573 115.386 435.476 1.00 67.24 N ATOM 953 HE ARG A 116 136.141 114.637 433.729 1.00 0.00 H ATOM 954 HH12 ARG A 116 134.957 114.064 437.596 1.00 0.00 H ATOM 955 HH11 ARG A 116 136.298 113.055 436.941 1.00 0.00 H ATOM 956 HH22 ARG A 116 133.945 115.646 436.263 1.00 0.00 H ATOM 957 HH21 ARG A 116 134.493 115.878 434.563 1.00 0.00 H ATOM 958 H ARG A 116 140.560 114.583 431.832 1.00 0.00 H ATOM 959 N PHE A 117 139.653 111.171 430.186 1.00 74.09 N ATOM 960 CA PHE A 117 138.940 110.908 428.941 1.00 73.71 C ATOM 961 C PHE A 117 137.442 110.795 429.188 1.00 72.24 C ATOM 962 O PHE A 117 136.999 110.279 430.219 1.00 71.57 O ATOM 963 CB PHE A 117 139.437 109.615 428.301 1.00 74.58 C ATOM 964 CG PHE A 117 140.840 109.694 427.826 1.00 75.43 C ATOM 965 CD1 PHE A 117 141.851 109.032 428.494 1.00 74.30 C ATOM 966 CD2 PHE A 117 141.159 110.452 426.710 1.00 72.54 C ATOM 967 CE1 PHE A 117 143.157 109.117 428.051 1.00 76.79 C ATOM 968 CE2 PHE A 117 142.464 110.532 426.262 1.00 70.07 C ATOM 969 CZ PHE A 117 143.464 109.867 426.932 1.00 71.25 C ATOM 970 H PHE A 117 140.148 110.387 430.657 1.00 0.00 H ATOM 971 N ILE A 118 136.660 111.257 428.215 1.00 68.29 N ATOM 972 CA ILE A 118 135.203 111.237 428.291 1.00 69.67 C ATOM 973 C ILE A 118 134.664 110.367 427.166 1.00 70.45 C ATOM 974 O ILE A 118 135.020 110.570 425.997 1.00 71.36 O ATOM 975 CB ILE A 118 134.607 112.655 428.202 1.00 68.59 C ATOM 976 CG1 ILE A 118 135.255 113.595 429.239 1.00 68.93 C ATOM 977 CG2 ILE A 118 133.114 112.592 428.436 1.00 69.26 C ATOM 978 CD1 ILE A 118 134.794 115.074 429.141 1.00 62.09 C ATOM 979 H ILE A 118 137.108 111.650 427.362 1.00 0.00 H ATOM 980 N GLU A 119 133.803 109.404 427.512 1.00 67.96 N ATOM 981 CA GLU A 119 133.021 108.662 426.525 1.00 67.31 C ATOM 982 C GLU A 119 131.611 109.242 426.514 1.00 69.83 C ATOM 983 O GLU A 119 130.886 109.133 427.512 1.00 74.00 O ATOM 984 CB GLU A 119 132.989 107.159 426.828 1.00 64.72 C ATOM 985 CG GLU A 119 131.943 106.428 425.970 1.00 66.53 C ATOM 986 CD GLU A 119 132.230 106.568 424.446 1.00 69.47 C ATOM 987 OE1 GLU A 119 131.291 106.550 423.619 1.00 68.59 O ATOM 988 OE2 GLU A 119 133.410 106.662 424.077 1.00 67.45 O ATOM 989 H GLU A 119 133.686 109.175 428.520 1.00 0.00 H ATOM 990 N ILE A 120 131.224 109.865 425.391 1.00 67.60 N ATOM 991 CA ILE A 120 129.880 110.412 425.236 1.00 68.44 C ATOM 992 C ILE A 120 128.978 109.329 424.680 1.00 70.40 C ATOM 993 O ILE A 120 129.352 108.616 423.740 1.00 64.28 O ATOM 994 CB ILE A 120 129.853 111.638 424.311 1.00 71.14 C ATOM 995 CG1 ILE A 120 130.812 112.731 424.793 1.00 71.96 C ATOM 996 CG2 ILE A 120 128.420 112.154 424.193 1.00 70.60 C ATOM 997 CD1 ILE A 120 130.249 113.615 425.855 1.00 72.02 C ATOM 998 H ILE A 120 131.902 109.961 424.608 1.00 0.00 H ATOM 999 N GLY A 121 127.785 109.211 425.261 1.00 71.47 N ATOM 1000 CA GLY A 121 126.760 108.305 424.761 1.00 68.62 C ATOM 1001 C GLY A 121 125.472 109.047 424.445 1.00 65.15 C ATOM 1002 O GLY A 121 125.095 109.986 425.156 1.00 66.11 O ATOM 1003 H GLY A 121 127.578 109.787 426.102 1.00 0.00 H ATOM 1004 N VAL A 122 124.825 108.640 423.354 1.00 61.01 N ATOM 1005 CA VAL A 122 123.500 109.116 422.978 1.00 63.28 C ATOM 1006 C VAL A 122 122.656 107.887 422.693 1.00 71.25 C ATOM 1007 O VAL A 122 122.976 107.108 421.784 1.00 73.27 O ATOM 1008 CB VAL A 122 123.527 110.049 421.752 1.00 63.46 C ATOM 1009 CG1 VAL A 122 122.129 110.604 421.486 1.00 62.48 C ATOM 1010 CG2 VAL A 122 124.512 111.204 421.959 1.00 58.17 C ATOM 1011 H VAL A 122 125.291 107.945 422.737 1.00 0.00 H ATOM 1012 N THR A 123 121.596 107.699 423.475 1.00 70.13 N ATOM 1013 CA THR A 123 120.748 106.528 423.352 1.00 77.91 C ATOM 1014 C THR A 123 119.294 106.961 423.266 1.00 85.30 C ATOM 1015 O THR A 123 118.913 108.043 423.723 1.00 84.90 O ATOM 1016 CB THR A 123 120.926 105.569 424.540 1.00 79.48 C ATOM 1017 OG1 THR A 123 119.899 104.570 424.508 1.00 82.05 O ATOM 1018 CG2 THR A 123 120.815 106.334 425.831 1.00 74.71 C ATOM 1019 HG1 THR A 123 119.961 104.061 423.661 1.00 0.00 H ATOM 1020 H THR A 123 121.368 108.413 424.196 1.00 0.00 H ATOM 1021 N ARG A 124 118.484 106.091 422.670 1.00 91.85 N ATOM 1022 CA ARG A 124 117.045 106.274 422.621 1.00 93.42 C ATOM 1023 C ARG A 124 116.305 105.387 423.614 1.00 94.79 C ATOM 1024 O ARG A 124 115.085 105.533 423.758 1.00 97.63 O ATOM 1025 CB ARG A 124 116.535 106.009 421.196 1.00 95.29 C ATOM 1026 CG ARG A 124 117.480 106.538 420.109 1.00 94.79 C ATOM 1027 CD ARG A 124 117.550 105.588 418.924 1.00 99.05 C ATOM 1028 NE ARG A 124 118.883 105.530 418.324 1.00 96.81 N ATOM 1029 CZ ARG A 124 119.204 104.749 417.297 1.00101.95 C ATOM 1030 NH1 ARG A 124 118.290 103.963 416.743 1.00111.65 N ATOM 1031 NH2 ARG A 124 120.439 104.744 416.827 1.00101.82 N ATOM 1032 HE ARG A 124 119.626 106.137 418.726 1.00 0.00 H ATOM 1033 HH12 ARG A 124 118.546 103.354 415.940 1.00 0.00 H ATOM 1034 HH11 ARG A 124 117.318 103.956 417.112 1.00 0.00 H ATOM 1035 HH22 ARG A 124 120.687 104.132 416.024 1.00 0.00 H ATOM 1036 HH21 ARG A 124 121.163 105.352 417.261 1.00 0.00 H ATOM 1037 H ARG A 124 118.897 105.248 422.222 1.00 0.00 H ATOM 1038 N ARG A 125 117.007 104.479 424.296 1.00 94.05 N ATOM 1039 CA ARG A 125 116.425 103.646 425.341 1.00 95.50 C ATOM 1040 C ARG A 125 116.674 104.298 426.707 1.00 93.95 C ATOM 1041 O ARG A 125 117.127 105.446 426.798 1.00 89.00 O ATOM 1042 CB ARG A 125 116.994 102.229 425.261 1.00 92.86 C ATOM 1043 H ARG A 125 118.016 104.361 424.071 1.00 0.00 H ATOM 1044 N GLU A 126 116.381 103.573 427.785 1.00 92.49 N ATOM 1045 CA GLU A 126 116.528 104.128 429.125 1.00 97.73 C ATOM 1046 C GLU A 126 118.002 104.332 429.448 1.00 95.38 C ATOM 1047 O GLU A 126 118.859 103.527 429.070 1.00 92.33 O ATOM 1048 CB GLU A 126 115.852 103.208 430.169 1.00110.74 C ATOM 1049 CG GLU A 126 116.436 103.262 431.591 1.00116.32 C ATOM 1050 CD GLU A 126 115.700 104.228 432.522 1.00123.28 C ATOM 1051 OE1 GLU A 126 116.281 104.631 433.559 1.00125.71 O ATOM 1052 OE2 GLU A 126 114.542 104.586 432.221 1.00126.19 O ATOM 1053 H GLU A 126 116.042 102.597 427.669 1.00 0.00 H ATOM 1054 N VAL A 127 118.293 105.440 430.135 1.00 99.44 N ATOM 1055 CA VAL A 127 119.675 105.884 430.312 1.00 99.52 C ATOM 1056 C VAL A 127 120.466 104.861 431.113 1.00 99.53 C ATOM 1057 O VAL A 127 121.647 104.605 430.828 1.00 94.45 O ATOM 1058 CB VAL A 127 119.704 107.269 430.986 1.00 99.66 C ATOM 1059 CG1 VAL A 127 119.365 108.342 429.986 1.00 92.81 C ATOM 1060 CG2 VAL A 127 118.718 107.301 432.166 1.00106.25 C ATOM 1061 H VAL A 127 117.521 105.998 430.552 1.00 0.00 H ATOM 1062 N HIS A 128 119.822 104.265 432.130 1.00 95.04 N ATOM 1063 CA HIS A 128 120.482 103.296 433.001 1.00 94.98 C ATOM 1064 C HIS A 128 120.990 102.097 432.214 1.00 93.37 C ATOM 1065 O HIS A 128 122.152 101.697 432.355 1.00 90.71 O ATOM 1066 CB HIS A 128 119.519 102.837 434.106 1.00101.13 C ATOM 1067 H HIS A 128 118.824 104.501 432.302 1.00 0.00 H ATOM 1068 N ILE A 129 120.130 101.507 431.378 1.00 98.55 N ATOM 1069 CA ILE A 129 120.529 100.342 430.588 1.00101.68 C ATOM 1070 C ILE A 129 121.769 100.658 429.762 1.00 96.43 C ATOM 1071 O ILE A 129 122.755 99.914 429.780 1.00 97.07 O ATOM 1072 CB ILE A 129 119.365 99.869 429.698 1.00102.45 C ATOM 1073 H ILE A 129 119.164 101.881 431.288 1.00 0.00 H ATOM 1074 N TYR A 130 121.753 101.782 429.049 1.00 92.62 N ATOM 1075 CA TYR A 130 122.860 102.077 428.145 1.00 89.58 C ATOM 1076 C TYR A 130 124.146 102.355 428.916 1.00 85.12 C ATOM 1077 O TYR A 130 125.229 101.922 428.500 1.00 78.64 O ATOM 1078 CB TYR A 130 122.504 103.259 427.240 1.00 93.01 C ATOM 1079 CG TYR A 130 123.481 103.505 426.101 1.00 98.15 C ATOM 1080 CD1 TYR A 130 123.543 102.642 425.010 1.00102.61 C ATOM 1081 CD2 TYR A 130 124.324 104.603 426.109 1.00 98.92 C ATOM 1082 CE1 TYR A 130 124.427 102.865 423.962 1.00101.31 C ATOM 1083 CE2 TYR A 130 125.203 104.840 425.062 1.00102.34 C ATOM 1084 CZ TYR A 130 125.254 103.968 423.995 1.00101.83 C ATOM 1085 OH TYR A 130 126.141 104.214 422.965 1.00102.07 O ATOM 1086 HH TYR A 130 125.935 105.092 422.557 1.00 0.00 H ATOM 1087 H TYR A 130 120.957 102.446 429.136 1.00 0.00 H ATOM 1088 N TYR A 131 124.054 103.071 430.044 1.00 86.40 N ATOM 1089 CA TYR A 131 125.258 103.345 430.824 1.00 87.61 C ATOM 1090 C TYR A 131 125.983 102.045 431.156 1.00 89.31 C ATOM 1091 O TYR A 131 127.188 101.910 430.904 1.00 87.79 O ATOM 1092 CB TYR A 131 124.910 104.136 432.097 1.00 89.46 C ATOM 1093 CG TYR A 131 126.132 104.595 432.888 1.00 92.25 C ATOM 1094 CD1 TYR A 131 126.580 105.908 432.824 1.00 86.88 C ATOM 1095 CD2 TYR A 131 126.831 103.710 433.701 1.00100.52 C ATOM 1096 CE1 TYR A 131 127.705 106.321 433.525 1.00 89.71 C ATOM 1097 CE2 TYR A 131 127.950 104.112 434.406 1.00101.69 C ATOM 1098 CZ TYR A 131 128.382 105.414 434.318 1.00 97.82 C ATOM 1099 OH TYR A 131 129.497 105.794 435.034 1.00100.29 O ATOM 1100 HH TYR A 131 129.682 106.753 434.870 1.00 0.00 H ATOM 1101 H TYR A 131 123.131 103.430 430.362 1.00 0.00 H ATOM 1102 N LEU A 132 125.240 101.056 431.667 1.00 87.56 N ATOM 1103 CA LEU A 132 125.835 99.785 432.073 1.00 90.22 C ATOM 1104 C LEU A 132 126.568 99.111 430.919 1.00 93.02 C ATOM 1105 O LEU A 132 127.721 98.687 431.063 1.00 93.30 O ATOM 1106 CB LEU A 132 124.749 98.862 432.629 1.00 95.97 C ATOM 1107 H LEU A 132 124.215 101.196 431.778 1.00 0.00 H ATOM 1108 N GLU A 133 125.907 98.984 429.766 1.00 98.15 N ATOM 1109 CA GLU A 133 126.555 98.362 428.618 1.00107.37 C ATOM 1110 C GLU A 133 127.835 99.099 428.240 1.00107.34 C ATOM 1111 O GLU A 133 128.853 98.469 427.928 1.00108.90 O ATOM 1112 CB GLU A 133 125.589 98.314 427.435 1.00112.73 C ATOM 1113 CG GLU A 133 124.192 97.859 427.811 1.00121.47 C ATOM 1114 CD GLU A 133 123.271 97.717 426.609 1.00125.68 C ATOM 1115 OE1 GLU A 133 123.732 97.967 425.468 1.00124.75 O ATOM 1116 OE2 GLU A 133 122.088 97.348 426.809 1.00127.60 O ATOM 1117 H GLU A 133 124.929 99.329 429.687 1.00 0.00 H ATOM 1118 N LYS A 134 127.816 100.432 428.293 1.00106.44 N ATOM 1119 CA LYS A 134 128.995 101.191 427.882 1.00109.63 C ATOM 1120 C LYS A 134 130.145 101.029 428.870 1.00112.64 C ATOM 1121 O LYS A 134 131.314 101.097 428.472 1.00112.41 O ATOM 1122 CB LYS A 134 128.642 102.669 427.706 1.00107.99 C ATOM 1123 CG LYS A 134 129.806 103.520 427.209 1.00108.00 C ATOM 1124 CD LYS A 134 129.863 103.586 425.676 1.00109.52 C ATOM 1125 CE LYS A 134 128.527 104.002 425.076 1.00110.76 C ATOM 1126 NZ LYS A 134 128.659 104.758 423.801 1.00108.74 N ATOM 1127 HZ1 LYS A 134 129.209 105.624 423.969 1.00 0.00 H ATOM 1128 HZ2 LYS A 134 129.146 104.167 423.098 1.00 0.00 H ATOM 1129 HZ3 LYS A 134 127.713 105.009 423.449 1.00 0.00 H ATOM 1130 H LYS A 134 126.965 100.929 428.626 1.00 0.00 H ATOM 1131 N ALA A 135 129.843 100.802 430.149 1.00116.38 N ATOM 1132 CA ALA A 135 130.905 100.617 431.132 1.00119.36 C ATOM 1133 C ALA A 135 131.734 99.378 430.818 1.00124.55 C ATOM 1134 O ALA A 135 132.972 99.428 430.812 1.00124.93 O ATOM 1135 CB ALA A 135 130.308 100.529 432.535 1.00118.53 C ATOM 1136 H ALA A 135 128.847 100.757 430.447 1.00 0.00 H ATOM 1137 N ASN A 136 131.064 98.255 430.538 1.00127.63 N ATOM 1138 CA ASN A 136 131.781 97.006 430.312 1.00132.70 C ATOM 1139 C ASN A 136 132.584 97.031 429.016 1.00132.78 C ATOM 1140 O ASN A 136 133.589 96.320 428.905 1.00137.66 O ATOM 1141 CB ASN A 136 130.800 95.833 430.310 1.00136.66 C ATOM 1142 H ASN A 136 130.026 98.273 430.481 1.00 0.00 H ATOM 1143 N LYS A 137 132.172 97.831 428.034 1.00127.00 N ATOM 1144 CA LYS A 137 132.900 97.908 426.766 1.00122.33 C ATOM 1145 C LYS A 137 134.084 98.863 426.892 1.00118.26 C ATOM 1146 O LYS A 137 134.632 99.049 427.980 1.00118.38 O ATOM 1147 CB LYS A 137 131.971 98.349 425.625 1.00117.71 C ATOM 1148 CG LYS A 137 132.553 98.141 424.223 1.00116.78 C ATOM 1149 CD LYS A 137 131.513 98.375 423.119 1.00116.78 C ATOM 1150 CE LYS A 137 132.079 98.060 421.728 1.00115.37 C ATOM 1151 NZ LYS A 137 131.101 98.339 420.635 1.00112.11 N ATOM 1152 HZ1 LYS A 137 130.251 97.756 420.775 1.00 0.00 H ATOM 1153 HZ2 LYS A 137 130.839 99.345 420.654 1.00 0.00 H ATOM 1154 HZ3 LYS A 137 131.533 98.109 419.718 1.00 0.00 H ATOM 1155 H LYS A 137 131.319 98.410 428.170 1.00 0.00 H TER 1156 LYS A 137 ATOM 1157 N SER A 140 137.230 99.708 430.510 1.00128.73 N ATOM 1158 CA SER A 140 137.861 101.019 430.666 1.00126.83 C ATOM 1159 C SER A 140 137.421 101.698 431.968 1.00127.13 C ATOM 1160 O SER A 140 136.464 102.471 431.978 1.00126.67 O ATOM 1161 CB SER A 140 137.538 101.917 429.467 1.00121.11 C ATOM 1162 OG SER A 140 138.208 101.487 428.291 1.00120.61 O ATOM 1163 HG SER A 140 137.975 102.090 427.541 1.00 0.00 H ATOM 1164 HN3 SER A 140 136.196 99.822 430.491 1.00 0.00 H ATOM 1165 HN2 SER A 140 137.498 99.098 431.309 1.00 0.00 H ATOM 1166 HN1 SER A 140 137.548 99.275 429.620 1.00 0.00 H ATOM 1167 N GLU A 141 138.146 101.424 433.059 1.00125.30 N ATOM 1168 CA GLU A 141 137.719 101.892 434.377 1.00122.23 C ATOM 1169 C GLU A 141 137.907 103.398 434.546 1.00115.84 C ATOM 1170 O GLU A 141 137.102 104.054 435.217 1.00115.29 O ATOM 1171 CB GLU A 141 138.479 101.136 435.469 1.00127.23 C ATOM 1172 H GLU A 141 139.023 100.872 432.968 1.00 0.00 H ATOM 1173 N LYS A 142 138.959 103.966 433.952 1.00110.46 N ATOM 1174 CA LYS A 142 139.339 105.346 434.243 1.00103.52 C ATOM 1175 C LYS A 142 138.600 106.374 433.390 1.00 94.47 C ATOM 1176 O LYS A 142 138.506 107.541 433.794 1.00 85.84 O ATOM 1177 CB LYS A 142 140.848 105.518 434.056 1.00102.70 C ATOM 1178 H LYS A 142 139.518 103.416 433.269 1.00 0.00 H ATOM 1179 N THR A 143 138.074 105.968 432.235 1.00 92.76 N ATOM 1180 CA THR A 143 137.422 106.894 431.321 1.00 86.79 C ATOM 1181 C THR A 143 136.072 107.356 431.871 1.00 85.50 C ATOM 1182 O THR A 143 135.217 106.537 432.224 1.00 89.18 O ATOM 1183 CB THR A 143 137.250 106.220 429.958 1.00 88.94 C ATOM 1184 OG1 THR A 143 138.538 105.882 429.421 1.00 93.27 O ATOM 1185 CG2 THR A 143 136.525 107.133 428.983 1.00 83.99 C ATOM 1186 HG1 THR A 143 138.423 105.446 428.540 1.00 0.00 H ATOM 1187 H THR A 143 138.131 104.961 431.980 1.00 0.00 H ATOM 1188 N HIS A 144 135.882 108.673 431.946 1.00 80.45 N ATOM 1189 CA HIS A 144 134.610 109.231 432.397 1.00 79.04 C ATOM 1190 C HIS A 144 133.531 109.023 431.335 1.00 79.87 C ATOM 1191 O HIS A 144 133.783 109.146 430.133 1.00 79.09 O ATOM 1192 CB HIS A 144 134.769 110.719 432.705 1.00 76.42 C ATOM 1193 CG HIS A 144 133.918 111.208 433.831 1.00 81.71 C ATOM 1194 ND1 HIS A 144 134.060 110.758 435.128 1.00 87.31 N ATOM 1195 CD2 HIS A 144 132.918 112.120 433.857 1.00 81.41 C ATOM 1196 CE1 HIS A 144 133.187 111.377 435.905 1.00 86.63 C ATOM 1197 NE2 HIS A 144 132.474 112.200 435.156 1.00 86.29 N ATOM 1198 H HIS A 144 136.654 109.316 431.678 1.00 0.00 H ATOM 1199 N ILE A 145 132.325 108.696 431.786 1.00 79.55 N ATOM 1200 CA ILE A 145 131.209 108.356 430.913 1.00 75.92 C ATOM 1201 C ILE A 145 130.101 109.385 431.117 1.00 73.08 C ATOM 1202 O ILE A 145 129.776 109.744 432.254 1.00 71.01 O ATOM 1203 CB ILE A 145 130.693 106.928 431.212 1.00 78.90 C ATOM 1204 CG1 ILE A 145 131.857 105.934 431.277 1.00 81.78 C ATOM 1205 CG2 ILE A 145 129.732 106.459 430.160 1.00 74.66 C ATOM 1206 CD1 ILE A 145 131.421 104.458 431.306 1.00 78.99 C ATOM 1207 H ILE A 145 132.170 108.682 432.814 1.00 0.00 H ATOM 1208 N HIS A 146 129.518 109.855 430.016 1.00 71.21 N ATOM 1209 CA HIS A 146 128.399 110.797 430.049 1.00 68.61 C ATOM 1210 C HIS A 146 127.418 110.409 428.950 1.00 69.33 C ATOM 1211 O HIS A 146 127.763 110.464 427.764 1.00 69.58 O ATOM 1212 CB HIS A 146 128.872 112.244 429.830 1.00 67.61 C ATOM 1213 CG HIS A 146 127.870 113.290 430.236 1.00 65.50 C ATOM 1214 ND1 HIS A 146 128.232 114.492 430.818 1.00 61.92 N ATOM 1215 CD2 HIS A 146 126.516 113.302 430.171 1.00 63.94 C ATOM 1216 CE1 HIS A 146 127.145 115.203 431.076 1.00 63.73 C ATOM 1217 NE2 HIS A 146 126.089 114.495 430.709 1.00 65.20 N ATOM 1218 H HIS A 146 129.874 109.538 429.091 1.00 0.00 H ATOM 1219 N ILE A 147 126.187 110.080 429.334 1.00 71.31 N ATOM 1220 CA ILE A 147 125.135 109.634 428.419 1.00 73.85 C ATOM 1221 C ILE A 147 124.049 110.696 428.371 1.00 67.25 C ATOM 1222 O ILE A 147 123.625 111.210 429.410 1.00 67.99 O ATOM 1223 CB ILE A 147 124.517 108.278 428.839 1.00 87.45 C ATOM 1224 CG1 ILE A 147 125.534 107.159 428.713 1.00 94.32 C ATOM 1225 CG2 ILE A 147 123.305 107.933 428.001 1.00 87.46 C ATOM 1226 CD1 ILE A 147 126.434 107.068 429.849 1.00 95.85 C ATOM 1227 H ILE A 147 125.958 110.144 430.347 1.00 0.00 H ATOM 1228 N PHE A 148 123.592 111.010 427.168 1.00 70.77 N ATOM 1229 CA PHE A 148 122.424 111.850 426.952 1.00 68.80 C ATOM 1230 C PHE A 148 121.327 111.028 426.295 1.00 70.27 C ATOM 1231 O PHE A 148 121.601 110.175 425.444 1.00 67.07 O ATOM 1232 CB PHE A 148 122.750 113.045 426.055 1.00 67.87 C ATOM 1233 CG PHE A 148 123.764 113.979 426.633 1.00 65.24 C ATOM 1234 CD1 PHE A 148 125.100 113.846 426.299 1.00 58.15 C ATOM 1235 CD2 PHE A 148 123.384 114.993 427.514 1.00 68.95 C ATOM 1236 CE1 PHE A 148 126.052 114.705 426.815 1.00 60.21 C ATOM 1237 CE2 PHE A 148 124.334 115.864 428.045 1.00 70.30 C ATOM 1238 CZ PHE A 148 125.678 115.726 427.688 1.00 62.93 C ATOM 1239 H PHE A 148 124.093 110.637 426.336 1.00 0.00 H ATOM 1240 N SER A 149 120.090 111.298 426.687 1.00 75.47 N ATOM 1241 CA SER A 149 118.922 110.677 426.092 1.00 73.81 C ATOM 1242 C SER A 149 118.228 111.634 425.133 1.00 68.17 C ATOM 1243 O SER A 149 118.364 112.856 425.224 1.00 70.34 O ATOM 1244 CB SER A 149 117.937 110.238 427.171 1.00 79.29 C ATOM 1245 OG SER A 149 116.606 110.345 426.704 1.00 82.35 O ATOM 1246 HG SER A 149 115.983 110.056 427.417 1.00 0.00 H ATOM 1247 H SER A 149 119.951 111.985 427.455 1.00 0.00 H ATOM 1248 N PHE A 150 117.474 111.052 424.202 1.00 70.44 N ATOM 1249 CA PHE A 150 116.572 111.809 423.344 1.00 73.54 C ATOM 1250 C PHE A 150 115.340 112.304 424.088 1.00 81.65 C ATOM 1251 O PHE A 150 114.566 113.083 423.526 1.00 90.70 O ATOM 1252 CB PHE A 150 116.150 110.950 422.146 1.00 71.47 C ATOM 1253 CG PHE A 150 117.137 110.984 421.010 1.00 71.67 C ATOM 1254 CD1 PHE A 150 117.113 112.019 420.088 1.00 66.33 C ATOM 1255 CD2 PHE A 150 118.086 109.982 420.865 1.00 74.24 C ATOM 1256 CE1 PHE A 150 118.025 112.070 419.049 1.00 67.13 C ATOM 1257 CE2 PHE A 150 118.998 110.013 419.819 1.00 69.78 C ATOM 1258 CZ PHE A 150 118.972 111.066 418.914 1.00 69.74 C ATOM 1259 H PHE A 150 117.531 110.020 424.083 1.00 0.00 H ATOM 1260 N THR A 151 115.129 111.874 425.323 1.00 78.20 N ATOM 1261 CA THR A 151 114.000 112.371 426.086 1.00 80.30 C ATOM 1262 C THR A 151 114.390 113.499 427.029 1.00 80.41 C ATOM 1263 O THR A 151 113.506 114.183 427.562 1.00 86.48 O ATOM 1264 CB THR A 151 113.339 111.220 426.870 1.00 79.97 C ATOM 1265 OG1 THR A 151 114.214 110.768 427.914 1.00 82.73 O ATOM 1266 CG2 THR A 151 113.029 110.051 425.945 1.00 71.07 C ATOM 1267 HG1 THR A 151 115.062 110.446 427.516 1.00 0.00 H ATOM 1268 H THR A 151 115.775 111.178 425.747 1.00 0.00 H ATOM 1269 N GLY A 152 115.684 113.721 427.235 1.00 73.35 N ATOM 1270 CA GLY A 152 116.142 114.761 428.132 1.00 74.68 C ATOM 1271 C GLY A 152 116.836 114.271 429.382 1.00 82.61 C ATOM 1272 O GLY A 152 117.161 115.087 430.248 1.00 87.37 O ATOM 1273 H GLY A 152 116.385 113.133 426.740 1.00 0.00 H ATOM 1274 N GLU A 153 117.060 112.977 429.519 1.00 88.50 N ATOM 1275 CA GLU A 153 117.757 112.463 430.683 1.00 88.97 C ATOM 1276 C GLU A 153 119.260 112.429 430.429 1.00 83.45 C ATOM 1277 O GLU A 153 119.726 112.392 429.286 1.00 83.96 O ATOM 1278 CB GLU A 153 117.260 111.061 431.034 1.00 97.12 C ATOM 1279 CG GLU A 153 115.746 110.887 431.074 1.00105.14 C ATOM 1280 CD GLU A 153 115.328 109.528 430.531 1.00109.11 C ATOM 1281 OE1 GLU A 153 115.614 109.251 429.338 1.00111.05 O ATOM 1282 OE2 GLU A 153 114.745 108.732 431.294 1.00106.77 O ATOM 1283 H GLU A 153 116.733 112.318 428.784 1.00 0.00 H ATOM 1284 N GLU A 154 120.023 112.439 431.519 1.00 79.49 N ATOM 1285 CA GLU A 154 121.461 112.268 431.416 1.00 81.79 C ATOM 1286 C GLU A 154 121.932 111.504 432.643 1.00 82.99 C ATOM 1287 O GLU A 154 121.249 111.468 433.663 1.00 87.49 O ATOM 1288 CB GLU A 154 122.189 113.620 431.258 1.00 78.98 C ATOM 1289 CG GLU A 154 122.174 114.501 432.507 1.00 83.10 C ATOM 1290 CD GLU A 154 122.855 115.869 432.312 1.00 78.86 C ATOM 1291 OE1 GLU A 154 122.330 116.860 432.855 1.00 78.64 O ATOM 1292 OE2 GLU A 154 123.920 115.956 431.657 1.00 72.53 O ATOM 1293 H GLU A 154 119.585 112.571 432.453 1.00 0.00 H ATOM 1294 N MET A 155 123.078 110.845 432.509 1.00 82.01 N ATOM 1295 CA MET A 155 123.725 110.171 433.626 1.00 78.99 C ATOM 1296 C MET A 155 125.221 110.212 433.367 1.00 77.24 C ATOM 1297 O MET A 155 125.663 109.877 432.262 1.00 78.13 O ATOM 1298 CB MET A 155 123.244 108.725 433.773 1.00 79.88 C ATOM 1299 H MET A 155 123.529 110.809 431.573 1.00 0.00 H ATOM 1300 N ALA A 156 125.990 110.651 434.360 1.00 72.49 N ATOM 1301 CA ALA A 156 127.437 110.695 434.236 1.00 76.35 C ATOM 1302 C ALA A 156 128.086 109.928 435.383 1.00 80.59 C ATOM 1303 O ALA A 156 127.490 109.723 436.443 1.00 87.92 O ATOM 1304 CB ALA A 156 127.960 112.141 434.192 1.00 76.68 C ATOM 1305 H ALA A 156 125.546 110.970 435.245 1.00 0.00 H ATOM 1306 N THR A 157 129.330 109.512 435.145 1.00 80.31 N ATOM 1307 CA THR A 157 130.098 108.762 436.127 1.00 83.78 C ATOM 1308 C THR A 157 130.226 109.552 437.420 1.00 85.45 C ATOM 1309 O THR A 157 130.485 110.760 437.400 1.00 80.41 O ATOM 1310 CB THR A 157 131.482 108.434 435.561 1.00 80.41 C ATOM 1311 OG1 THR A 157 131.320 107.665 434.365 1.00 80.08 O ATOM 1312 CG2 THR A 157 132.308 107.621 436.551 1.00 81.35 C ATOM 1313 HG1 THR A 157 130.836 106.828 434.576 1.00 0.00 H ATOM 1314 H THR A 157 129.766 109.731 434.227 1.00 0.00 H ATOM 1315 N LYS A 158 130.015 108.860 438.544 1.00 83.56 N ATOM 1316 CA LYS A 158 130.073 109.415 439.898 1.00 84.83 C ATOM 1317 C LYS A 158 129.225 110.679 440.051 1.00 85.77 C ATOM 1318 O LYS A 158 129.461 111.482 440.970 1.00 87.73 O ATOM 1319 CB LYS A 158 131.523 109.681 440.331 1.00 83.59 C ATOM 1320 H LYS A 158 129.792 107.849 438.450 1.00 0.00 H ATOM 1321 N ALA A 159 128.227 110.850 439.177 1.00 83.76 N ATOM 1322 CA ALA A 159 127.305 111.987 439.188 1.00 86.06 C ATOM 1323 C ALA A 159 128.013 113.304 438.894 1.00 83.75 C ATOM 1324 O ALA A 159 127.542 114.369 439.304 1.00 77.26 O ATOM 1325 CB ALA A 159 126.537 112.083 440.517 1.00 83.18 C ATOM 1326 H ALA A 159 128.097 110.127 438.441 1.00 0.00 H ATOM 1327 N ASP A 160 129.152 113.242 438.216 1.00 74.12 N ATOM 1328 CA ASP A 160 129.936 114.422 437.871 1.00 80.59 C ATOM 1329 C ASP A 160 129.679 114.723 436.399 1.00 77.49 C ATOM 1330 O ASP A 160 130.162 114.004 435.511 1.00 70.86 O ATOM 1331 CB ASP A 160 131.420 114.189 438.160 1.00 86.64 C ATOM 1332 CG ASP A 160 132.295 115.431 437.917 1.00 89.13 C ATOM 1333 OD1 ASP A 160 131.937 116.309 437.089 1.00 83.77 O ATOM 1334 OD2 ASP A 160 133.373 115.503 438.559 1.00 91.11 O ATOM 1335 H ASP A 160 129.501 112.309 437.917 1.00 0.00 H ATOM 1336 N TYR A 161 128.923 115.787 436.144 1.00 78.68 N ATOM 1337 CA TYR A 161 128.426 116.093 434.812 1.00 76.25 C ATOM 1338 C TYR A 161 129.331 117.037 434.031 1.00 73.11 C ATOM 1339 O TYR A 161 128.947 117.466 432.936 1.00 75.96 O ATOM 1340 CB TYR A 161 127.011 116.661 434.918 1.00 75.74 C ATOM 1341 CG TYR A 161 126.028 115.664 435.518 1.00 77.59 C ATOM 1342 CD1 TYR A 161 125.776 115.611 436.883 1.00 81.48 C ATOM 1343 CD2 TYR A 161 125.383 114.742 434.702 1.00 76.81 C ATOM 1344 CE1 TYR A 161 124.874 114.669 437.416 1.00 80.72 C ATOM 1345 CE2 TYR A 161 124.487 113.810 435.210 1.00 75.56 C ATOM 1346 CZ TYR A 161 124.239 113.781 436.569 1.00 80.12 C ATOM 1347 OH TYR A 161 123.355 112.847 437.043 1.00 87.31 O ATOM 1348 HH TYR A 161 123.274 112.940 438.025 1.00 0.00 H ATOM 1349 H TYR A 161 128.678 116.425 436.928 1.00 0.00 H ATOM 1350 N THR A 162 130.517 117.359 434.566 1.00 71.75 N ATOM 1351 CA THR A 162 131.595 118.077 433.867 1.00 70.37 C ATOM 1352 C THR A 162 131.222 119.515 433.534 1.00 69.06 C ATOM 1353 O THR A 162 131.784 120.458 434.105 1.00 70.92 O ATOM 1354 CB THR A 162 132.001 117.357 432.575 1.00 68.79 C ATOM 1355 OG1 THR A 162 132.399 116.021 432.885 1.00 71.97 O ATOM 1356 CG2 THR A 162 133.172 118.074 431.891 1.00 67.19 C ATOM 1357 HG1 THR A 162 131.643 115.542 433.308 1.00 0.00 H ATOM 1358 H THR A 162 130.689 117.079 435.553 1.00 0.00 H ATOM 1359 N LEU A 163 130.285 119.685 432.603 1.00 67.10 N ATOM 1360 CA LEU A 163 129.836 121.006 432.203 1.00 66.47 C ATOM 1361 C LEU A 163 128.781 121.540 433.151 1.00 71.70 C ATOM 1362 O LEU A 163 128.132 120.795 433.885 1.00 82.55 O ATOM 1363 CB LEU A 163 129.266 120.970 430.794 1.00 63.20 C ATOM 1364 CG LEU A 163 130.230 120.406 429.738 1.00 67.63 C ATOM 1365 CD1 LEU A 163 129.471 120.101 428.461 1.00 69.02 C ATOM 1366 CD2 LEU A 163 131.385 121.367 429.473 1.00 64.37 C ATOM 1367 H LEU A 163 129.864 118.849 432.150 1.00 0.00 H ATOM 1368 N ASP A 164 128.597 122.855 433.107 1.00 70.49 N ATOM 1369 CA ASP A 164 127.540 123.491 433.869 1.00 72.84 C ATOM 1370 C ASP A 164 126.180 123.141 433.267 1.00 73.41 C ATOM 1371 O ASP A 164 126.075 122.569 432.176 1.00 75.60 O ATOM 1372 CB ASP A 164 127.743 125.005 433.902 1.00 80.25 C ATOM 1373 CG ASP A 164 127.755 125.623 432.515 1.00 89.12 C ATOM 1374 OD1 ASP A 164 127.897 126.864 432.423 1.00 95.67 O ATOM 1375 OD2 ASP A 164 127.632 124.878 431.514 1.00 88.55 O ATOM 1376 H ASP A 164 129.222 123.439 432.515 1.00 0.00 H ATOM 1377 N GLU A 165 125.127 123.515 433.993 1.00 70.90 N ATOM 1378 CA GLU A 165 123.774 123.103 433.634 1.00 70.67 C ATOM 1379 C GLU A 165 123.351 123.657 432.275 1.00 69.56 C ATOM 1380 O GLU A 165 122.712 122.951 431.483 1.00 70.94 O ATOM 1381 CB GLU A 165 122.805 123.539 434.733 1.00 69.64 C ATOM 1382 H GLU A 165 125.272 124.112 434.832 1.00 0.00 H ATOM 1383 N GLU A 166 123.713 124.909 431.972 1.00 69.62 N ATOM 1384 CA GLU A 166 123.234 125.527 430.734 1.00 71.09 C ATOM 1385 C GLU A 166 123.818 124.845 429.497 1.00 68.87 C ATOM 1386 O GLU A 166 123.133 124.709 428.474 1.00 68.81 O ATOM 1387 CB GLU A 166 123.555 127.022 430.732 1.00 74.57 C ATOM 1388 CG GLU A 166 122.944 127.799 431.922 1.00 84.15 C ATOM 1389 CD GLU A 166 123.823 127.761 433.168 1.00 87.30 C ATOM 1390 OE1 GLU A 166 123.713 128.674 434.021 1.00 90.37 O ATOM 1391 OE2 GLU A 166 124.633 126.812 433.290 1.00 86.96 O ATOM 1392 H GLU A 166 124.333 125.442 432.614 1.00 0.00 H ATOM 1393 N SER A 167 125.078 124.406 429.558 1.00 64.01 N ATOM 1394 CA SER A 167 125.653 123.737 428.392 1.00 63.71 C ATOM 1395 C SER A 167 125.007 122.383 428.174 1.00 63.34 C ATOM 1396 O SER A 167 124.757 121.979 427.031 1.00 61.18 O ATOM 1397 CB SER A 167 127.161 123.574 428.546 1.00 62.68 C ATOM 1398 OG SER A 167 127.790 124.827 428.741 1.00 69.99 O ATOM 1399 HG SER A 167 127.431 125.251 429.560 1.00 0.00 H ATOM 1400 H SER A 167 125.642 124.538 430.422 1.00 0.00 H ATOM 1401 N ARG A 168 124.751 121.655 429.257 1.00 65.07 N ATOM 1402 CA ARG A 168 124.078 120.377 429.111 1.00 64.81 C ATOM 1403 C ARG A 168 122.647 120.580 428.649 1.00 65.70 C ATOM 1404 O ARG A 168 122.160 119.843 427.785 1.00 66.60 O ATOM 1405 CB ARG A 168 124.125 119.613 430.428 1.00 71.99 C ATOM 1406 CG ARG A 168 125.503 119.063 430.724 1.00 70.65 C ATOM 1407 CD ARG A 168 125.847 119.250 432.183 1.00 70.38 C ATOM 1408 NE ARG A 168 124.889 118.572 433.056 1.00 69.08 N ATOM 1409 CZ ARG A 168 124.609 118.992 434.276 1.00 72.74 C ATOM 1410 NH1 ARG A 168 125.237 120.067 434.741 1.00 75.45 N ATOM 1411 NH2 ARG A 168 123.739 118.340 435.036 1.00 76.80 N ATOM 1412 HE ARG A 168 124.407 117.722 432.700 1.00 0.00 H ATOM 1413 HH12 ARG A 168 125.032 120.415 435.699 1.00 0.00 H ATOM 1414 HH11 ARG A 168 125.934 120.560 434.147 1.00 0.00 H ATOM 1415 HH22 ARG A 168 123.528 118.682 435.995 1.00 0.00 H ATOM 1416 HH21 ARG A 168 123.268 117.487 434.673 1.00 0.00 H ATOM 1417 H ARG A 168 125.030 121.998 430.199 1.00 0.00 H ATOM 1418 N ALA A 169 121.973 121.602 429.187 1.00 64.29 N ATOM 1419 CA ALA A 169 120.592 121.868 428.794 1.00 68.05 C ATOM 1420 C ALA A 169 120.489 122.124 427.294 1.00 68.72 C ATOM 1421 O ALA A 169 119.577 121.619 426.632 1.00 71.57 O ATOM 1422 CB ALA A 169 120.035 123.052 429.598 1.00 60.88 C ATOM 1423 H ALA A 169 122.436 122.212 429.891 1.00 0.00 H ATOM 1424 N ARG A 170 121.436 122.863 426.724 1.00 66.78 N ATOM 1425 CA ARG A 170 121.344 123.143 425.289 1.00 72.35 C ATOM 1426 C ARG A 170 121.521 121.876 424.461 1.00 63.11 C ATOM 1427 O ARG A 170 120.868 121.700 423.422 1.00 59.32 O ATOM 1428 CB ARG A 170 122.376 124.193 424.882 1.00 81.06 C ATOM 1429 CG ARG A 170 121.832 125.159 423.820 1.00 95.15 C ATOM 1430 CD ARG A 170 122.852 126.210 423.403 1.00102.03 C ATOM 1431 NE ARG A 170 124.188 125.627 423.312 1.00104.68 N ATOM 1432 CZ ARG A 170 124.843 125.403 422.177 1.00102.10 C ATOM 1433 NH1 ARG A 170 124.295 125.721 421.010 1.00104.14 N ATOM 1434 NH2 ARG A 170 126.055 124.860 422.213 1.00 97.69 N ATOM 1435 HE ARG A 170 124.662 125.368 424.201 1.00 0.00 H ATOM 1436 HH12 ARG A 170 124.813 125.543 420.126 1.00 0.00 H ATOM 1437 HH11 ARG A 170 123.347 126.148 420.980 1.00 0.00 H ATOM 1438 HH22 ARG A 170 126.572 124.683 421.328 1.00 0.00 H ATOM 1439 HH21 ARG A 170 126.487 124.612 423.126 1.00 0.00 H ATOM 1440 H ARG A 170 122.227 123.235 427.287 1.00 0.00 H ATOM 1441 N ILE A 171 122.382 120.968 424.908 1.00 62.09 N ATOM 1442 CA ILE A 171 122.478 119.672 424.241 1.00 62.77 C ATOM 1443 C ILE A 171 121.148 118.932 424.298 1.00 63.87 C ATOM 1444 O ILE A 171 120.709 118.331 423.304 1.00 64.01 O ATOM 1445 CB ILE A 171 123.616 118.862 424.875 1.00 64.71 C ATOM 1446 CG1 ILE A 171 124.951 119.578 424.599 1.00 62.44 C ATOM 1447 CG2 ILE A 171 123.591 117.422 424.381 1.00 62.41 C ATOM 1448 CD1 ILE A 171 126.185 118.792 424.966 1.00 59.24 C ATOM 1449 H ILE A 171 122.985 121.179 425.729 1.00 0.00 H ATOM 1450 N LYS A 172 120.480 118.966 425.453 1.00 61.43 N ATOM 1451 CA LYS A 172 119.248 118.188 425.583 1.00 63.49 C ATOM 1452 C LYS A 172 118.137 118.779 424.726 1.00 64.92 C ATOM 1453 O LYS A 172 117.349 118.037 424.117 1.00 57.44 O ATOM 1454 CB LYS A 172 118.810 118.106 427.047 1.00 62.56 C ATOM 1455 CG LYS A 172 119.882 117.523 427.967 1.00 66.41 C ATOM 1456 CD LYS A 172 119.310 117.209 429.336 1.00 69.16 C ATOM 1457 CE LYS A 172 119.788 118.197 430.384 1.00 76.73 C ATOM 1458 NZ LYS A 172 120.155 117.574 431.702 1.00 79.57 N ATOM 1459 HZ1 LYS A 172 119.325 117.089 432.098 1.00 0.00 H ATOM 1460 HZ2 LYS A 172 120.923 116.888 431.558 1.00 0.00 H ATOM 1461 HZ3 LYS A 172 120.470 118.316 432.359 1.00 0.00 H ATOM 1462 H LYS A 172 120.830 119.537 426.249 1.00 0.00 H ATOM 1463 N THR A 173 118.064 120.114 424.674 1.00 66.52 N ATOM 1464 CA THR A 173 117.125 120.792 423.787 1.00 68.16 C ATOM 1465 C THR A 173 117.336 120.359 422.343 1.00 61.05 C ATOM 1466 O THR A 173 116.390 120.003 421.632 1.00 60.72 O ATOM 1467 CB THR A 173 117.316 122.303 423.892 1.00 66.70 C ATOM 1468 OG1 THR A 173 116.815 122.764 425.150 1.00 65.33 O ATOM 1469 CG2 THR A 173 116.598 123.003 422.745 1.00 59.54 C ATOM 1470 HG1 THR A 173 117.308 122.318 425.884 1.00 0.00 H ATOM 1471 H THR A 173 118.691 120.681 425.280 1.00 0.00 H ATOM 1472 N ARG A 174 118.579 120.390 421.892 1.00 56.97 N ATOM 1473 CA ARG A 174 118.847 120.027 420.511 1.00 58.99 C ATOM 1474 C ARG A 174 118.444 118.585 420.248 1.00 60.99 C ATOM 1475 O ARG A 174 117.850 118.276 419.211 1.00 60.09 O ATOM 1476 CB ARG A 174 120.322 120.249 420.190 1.00 58.58 C ATOM 1477 CG ARG A 174 120.759 119.650 418.860 1.00 61.26 C ATOM 1478 CD ARG A 174 120.135 120.373 417.664 1.00 59.35 C ATOM 1479 NE ARG A 174 120.773 119.923 416.429 1.00 61.98 N ATOM 1480 CZ ARG A 174 120.159 119.844 415.251 1.00 56.63 C ATOM 1481 NH1 ARG A 174 118.886 120.212 415.150 1.00 55.55 N ATOM 1482 NH2 ARG A 174 120.824 119.413 414.181 1.00 52.97 N ATOM 1483 HE ARG A 174 121.774 119.646 416.474 1.00 0.00 H ATOM 1484 HH12 ARG A 174 118.399 120.153 414.233 1.00 0.00 H ATOM 1485 HH11 ARG A 174 118.377 120.559 415.988 1.00 0.00 H ATOM 1486 HH22 ARG A 174 120.344 119.351 413.260 1.00 0.00 H ATOM 1487 HH21 ARG A 174 121.823 119.138 414.266 1.00 0.00 H ATOM 1488 H ARG A 174 119.358 120.672 422.521 1.00 0.00 H ATOM 1489 N LEU A 175 118.737 117.684 421.183 1.00 63.43 N ATOM 1490 CA LEU A 175 118.304 116.295 421.011 1.00 66.45 C ATOM 1491 C LEU A 175 116.791 116.181 420.901 1.00 65.96 C ATOM 1492 O LEU A 175 116.289 115.412 420.072 1.00 68.06 O ATOM 1493 CB LEU A 175 118.793 115.423 422.167 1.00 66.65 C ATOM 1494 CG LEU A 175 120.305 115.191 422.222 1.00 63.71 C ATOM 1495 CD1 LEU A 175 120.665 114.496 423.513 1.00 61.24 C ATOM 1496 CD2 LEU A 175 120.716 114.366 421.027 1.00 59.48 C ATOM 1497 H LEU A 175 119.270 117.964 422.031 1.00 0.00 H ATOM 1498 N PHE A 176 116.032 116.934 421.720 1.00 60.53 N ATOM 1499 CA PHE A 176 114.583 116.778 421.631 1.00 65.04 C ATOM 1500 C PHE A 176 114.042 117.378 420.340 1.00 66.49 C ATOM 1501 O PHE A 176 112.989 116.952 419.849 1.00 69.36 O ATOM 1502 CB PHE A 176 113.891 117.409 422.829 1.00 71.55 C ATOM 1503 CG PHE A 176 112.539 116.821 423.115 1.00 72.70 C ATOM 1504 CD1 PHE A 176 111.409 117.306 422.474 1.00 78.11 C ATOM 1505 CD2 PHE A 176 112.403 115.762 423.994 1.00 75.30 C ATOM 1506 CE1 PHE A 176 110.152 116.769 422.723 1.00 81.00 C ATOM 1507 CE2 PHE A 176 111.149 115.219 424.258 1.00 85.10 C ATOM 1508 CZ PHE A 176 110.021 115.722 423.613 1.00 85.34 C ATOM 1509 H PHE A 176 116.462 117.602 422.391 1.00 0.00 H ATOM 1510 N THR A 177 114.755 118.349 419.770 1.00 59.97 N ATOM 1511 CA THR A 177 114.333 118.924 418.498 1.00 64.92 C ATOM 1512 C THR A 177 114.559 117.958 417.347 1.00 64.74 C ATOM 1513 O THR A 177 113.697 117.823 416.468 1.00 59.97 O ATOM 1514 CB THR A 177 115.068 120.236 418.266 1.00 63.20 C ATOM 1515 OG1 THR A 177 114.532 121.206 419.177 1.00 70.30 O ATOM 1516 CG2 THR A 177 114.884 120.704 416.821 1.00 55.84 C ATOM 1517 HG1 THR A 177 114.669 120.895 420.107 1.00 0.00 H ATOM 1518 H THR A 177 115.617 118.699 420.235 1.00 0.00 H ATOM 1519 N ILE A 178 115.705 117.268 417.339 1.00 60.44 N ATOM 1520 CA ILE A 178 115.905 116.198 416.366 1.00 62.71 C ATOM 1521 C ILE A 178 114.781 115.186 416.471 1.00 67.43 C ATOM 1522 O ILE A 178 114.249 114.712 415.457 1.00 66.14 O ATOM 1523 CB ILE A 178 117.276 115.526 416.560 1.00 56.96 C ATOM 1524 CG1 ILE A 178 118.420 116.463 416.128 1.00 55.48 C ATOM 1525 CG2 ILE A 178 117.353 114.269 415.729 1.00 56.82 C ATOM 1526 CD1 ILE A 178 119.798 115.996 416.639 1.00 51.27 C ATOM 1527 H ILE A 178 116.453 117.494 418.025 1.00 0.00 H ATOM 1528 N ARG A 179 114.374 114.862 417.699 1.00 67.98 N ATOM 1529 CA ARG A 179 113.304 113.889 417.861 1.00 68.85 C ATOM 1530 C ARG A 179 112.006 114.387 417.231 1.00 70.00 C ATOM 1531 O ARG A 179 111.346 113.652 416.490 1.00 74.37 O ATOM 1532 CB ARG A 179 113.102 113.570 419.337 1.00 70.36 C ATOM 1533 CG ARG A 179 111.856 112.766 419.618 1.00 73.93 C ATOM 1534 CD ARG A 179 111.758 112.445 421.100 1.00 78.01 C ATOM 1535 NE ARG A 179 110.474 111.828 421.417 1.00 84.69 N ATOM 1536 CZ ARG A 179 110.248 111.126 422.514 1.00 89.82 C ATOM 1537 NH1 ARG A 179 111.222 110.960 423.401 1.00 90.95 N ATOM 1538 NH2 ARG A 179 109.056 110.588 422.714 1.00 94.31 N ATOM 1539 HE ARG A 179 109.692 111.947 420.741 1.00 0.00 H ATOM 1540 HH12 ARG A 179 111.049 110.409 424.266 1.00 0.00 H ATOM 1541 HH11 ARG A 179 112.157 111.381 423.231 1.00 0.00 H ATOM 1542 HH22 ARG A 179 108.873 110.035 423.575 1.00 0.00 H ATOM 1543 HH21 ARG A 179 108.302 110.718 422.010 1.00 0.00 H ATOM 1544 H ARG A 179 114.817 115.300 418.532 1.00 0.00 H ATOM 1545 N GLN A 180 111.634 115.642 417.487 1.00 71.40 N ATOM 1546 CA GLN A 180 110.404 116.166 416.897 1.00 73.65 C ATOM 1547 C GLN A 180 110.480 116.187 415.376 1.00 70.19 C ATOM 1548 O GLN A 180 109.502 115.853 414.697 1.00 72.18 O ATOM 1549 CB GLN A 180 110.123 117.569 417.418 1.00 69.29 C ATOM 1550 CG GLN A 180 109.667 117.593 418.842 1.00 73.94 C ATOM 1551 CD GLN A 180 109.159 118.963 419.217 1.00 78.32 C ATOM 1552 OE1 GLN A 180 109.916 119.799 419.712 1.00 79.42 O ATOM 1553 NE2 GLN A 180 107.875 119.212 418.966 1.00 80.27 N ATOM 1554 HE22 GLN A 180 107.274 118.474 418.547 1.00 0.00 H ATOM 1555 HE21 GLN A 180 107.473 120.145 419.189 1.00 0.00 H ATOM 1556 H GLN A 180 112.216 116.244 418.103 1.00 0.00 H ATOM 1557 N GLU A 181 111.627 116.578 414.822 1.00 65.15 N ATOM 1558 CA GLU A 181 111.736 116.692 413.370 1.00 71.97 C ATOM 1559 C GLU A 181 111.553 115.341 412.701 1.00 74.95 C ATOM 1560 O GLU A 181 111.014 115.265 411.591 1.00 79.84 O ATOM 1561 CB GLU A 181 113.083 117.304 412.976 1.00 67.82 C ATOM 1562 CG GLU A 181 113.163 118.809 413.199 1.00 76.04 C ATOM 1563 CD GLU A 181 112.049 119.573 412.514 1.00 85.17 C ATOM 1564 OE1 GLU A 181 111.108 119.993 413.212 1.00 91.22 O ATOM 1565 OE2 GLU A 181 112.115 119.768 411.282 1.00 88.92 O ATOM 1566 H GLU A 181 112.445 116.802 415.424 1.00 0.00 H ATOM 1567 N MET A 182 111.986 114.268 413.362 1.00 73.03 N ATOM 1568 CA MET A 182 111.753 112.933 412.825 1.00 77.01 C ATOM 1569 C MET A 182 110.290 112.553 412.932 1.00 79.33 C ATOM 1570 O MET A 182 109.707 112.032 411.979 1.00 83.36 O ATOM 1571 CB MET A 182 112.614 111.909 413.558 1.00 78.00 C ATOM 1572 CG MET A 182 114.065 112.296 413.610 1.00 77.33 C ATOM 1573 SD MET A 182 115.128 110.861 413.611 1.00 82.62 S ATOM 1574 CE MET A 182 115.209 110.451 415.318 1.00 86.71 C ATOM 1575 H MET A 182 112.492 114.383 414.263 1.00 0.00 H ATOM 1576 N ALA A 183 109.683 112.796 414.089 1.00 80.64 N ATOM 1577 CA ALA A 183 108.293 112.397 414.287 1.00 74.97 C ATOM 1578 C ALA A 183 107.372 113.149 413.337 1.00 71.50 C ATOM 1579 O ALA A 183 106.415 112.578 412.810 1.00 75.89 O ATOM 1580 CB ALA A 183 107.886 112.632 415.745 1.00 72.50 C ATOM 1581 H ALA A 183 110.200 113.272 414.856 1.00 0.00 H ATOM 1582 N SER A 184 107.648 114.433 413.102 1.00 72.96 N ATOM 1583 CA SER A 184 106.867 115.194 412.134 1.00 79.13 C ATOM 1584 C SER A 184 106.936 114.570 410.747 1.00 81.31 C ATOM 1585 O SER A 184 105.993 114.692 409.960 1.00 83.13 O ATOM 1586 CB SER A 184 107.359 116.638 412.084 1.00 80.78 C ATOM 1587 OG SER A 184 107.215 117.162 410.775 1.00 82.98 O ATOM 1588 HG SER A 184 106.260 117.136 410.514 1.00 0.00 H ATOM 1589 H SER A 184 108.427 114.895 413.614 1.00 0.00 H ATOM 1590 N ARG A 185 108.037 113.909 410.431 1.00 78.06 N ATOM 1591 CA ARG A 185 108.187 113.218 409.167 1.00 79.19 C ATOM 1592 C ARG A 185 107.870 111.731 409.276 1.00 82.98 C ATOM 1593 O ARG A 185 107.983 111.010 408.279 1.00 84.09 O ATOM 1594 CB ARG A 185 109.605 113.415 408.656 1.00 76.05 C ATOM 1595 CG ARG A 185 109.961 114.782 408.149 1.00 74.91 C ATOM 1596 CD ARG A 185 111.459 114.957 408.337 1.00 71.31 C ATOM 1597 NE ARG A 185 111.989 116.188 407.751 1.00 68.18 N ATOM 1598 CZ ARG A 185 112.107 117.333 408.413 1.00 61.77 C ATOM 1599 NH1 ARG A 185 111.675 117.410 409.666 1.00 57.97 N ATOM 1600 NH2 ARG A 185 112.627 118.396 407.816 1.00 54.69 N ATOM 1601 HE ARG A 185 112.292 116.165 406.756 1.00 0.00 H ATOM 1602 HH12 ARG A 185 111.763 118.303 410.193 1.00 0.00 H ATOM 1603 HH11 ARG A 185 111.248 116.578 410.121 1.00 0.00 H ATOM 1604 HH22 ARG A 185 112.719 119.292 408.336 1.00 0.00 H ATOM 1605 HH21 ARG A 185 112.944 118.334 406.827 1.00 0.00 H ATOM 1606 H ARG A 185 108.822 113.885 411.113 1.00 0.00 H ATOM 1607 N SER A 186 107.492 111.263 410.464 1.00 84.62 N ATOM 1608 CA SER A 186 107.128 109.865 410.708 1.00 89.99 C ATOM 1609 C SER A 186 108.313 108.916 410.514 1.00 88.81 C ATOM 1610 O SER A 186 108.151 107.785 410.052 1.00 93.60 O ATOM 1611 CB SER A 186 105.938 109.432 409.845 1.00 94.73 C ATOM 1612 OG SER A 186 104.796 110.222 410.120 1.00100.00 O ATOM 1613 HG SER A 186 104.044 109.922 409.551 1.00 0.00 H ATOM 1614 H SER A 186 107.453 111.927 411.263 1.00 0.00 H ATOM 1615 N LEU A 187 109.505 109.365 410.895 1.00 81.26 N ATOM 1616 CA LEU A 187 110.689 108.517 410.954 1.00 80.04 C ATOM 1617 C LEU A 187 111.138 108.203 412.372 1.00 77.99 C ATOM 1618 O LEU A 187 112.131 107.486 412.541 1.00 80.40 O ATOM 1619 CB LEU A 187 111.874 109.157 410.211 1.00 84.55 C ATOM 1620 CG LEU A 187 111.898 109.370 408.689 1.00 88.80 C ATOM 1621 CD1 LEU A 187 111.500 108.082 407.939 1.00 85.57 C ATOM 1622 CD2 LEU A 187 111.081 110.546 408.246 1.00 91.39 C ATOM 1623 H LEU A 187 109.597 110.366 411.163 1.00 0.00 H ATOM 1624 N TRP A 188 110.482 108.757 413.393 1.00 78.81 N ATOM 1625 CA TRP A 188 110.965 108.552 414.755 1.00 82.27 C ATOM 1626 C TRP A 188 110.841 107.093 415.175 1.00 88.67 C ATOM 1627 O TRP A 188 111.813 106.492 415.648 1.00 88.69 O ATOM 1628 CB TRP A 188 110.213 109.445 415.740 1.00 77.41 C ATOM 1629 CG TRP A 188 110.500 109.059 417.147 1.00 78.72 C ATOM 1630 CD1 TRP A 188 109.651 108.454 418.019 1.00 81.91 C ATOM 1631 CD2 TRP A 188 111.738 109.237 417.843 1.00 77.77 C ATOM 1632 NE1 TRP A 188 110.285 108.250 419.222 1.00 83.85 N ATOM 1633 CE2 TRP A 188 111.569 108.716 419.135 1.00 77.29 C ATOM 1634 CE3 TRP A 188 112.978 109.791 417.492 1.00 77.30 C ATOM 1635 CZ2 TRP A 188 112.587 108.736 420.085 1.00 76.93 C ATOM 1636 CZ3 TRP A 188 113.990 109.808 418.433 1.00 76.28 C ATOM 1637 CH2 TRP A 188 113.785 109.287 419.719 1.00 76.68 C ATOM 1638 HE1 TRP A 188 109.858 107.812 420.063 1.00 0.00 H ATOM 1639 H TRP A 188 109.632 109.331 413.220 1.00 0.00 H ATOM 1640 N ASP A 189 109.653 106.505 415.017 1.00 93.68 N ATOM 1641 CA ASP A 189 109.419 105.174 415.576 1.00103.22 C ATOM 1642 C ASP A 189 110.332 104.134 414.938 1.00 95.87 C ATOM 1643 O ASP A 189 110.864 103.257 415.631 1.00 91.44 O ATOM 1644 CB ASP A 189 107.950 104.784 415.418 1.00117.09 C ATOM 1645 CG ASP A 189 107.100 105.267 416.572 1.00130.27 C ATOM 1646 OD1 ASP A 189 107.389 104.884 417.728 1.00140.29 O ATOM 1647 OD2 ASP A 189 106.151 106.039 416.325 1.00134.39 O ATOM 1648 H ASP A 189 108.895 106.992 414.497 1.00 0.00 H ATOM 1649 N SER A 190 110.535 104.220 413.622 1.00 93.15 N ATOM 1650 CA SER A 190 111.546 103.385 412.983 1.00 94.50 C ATOM 1651 C SER A 190 112.930 103.668 413.563 1.00 89.32 C ATOM 1652 O SER A 190 113.734 102.749 413.751 1.00 91.62 O ATOM 1653 CB SER A 190 111.530 103.616 411.470 1.00 95.50 C ATOM 1654 OG SER A 190 112.679 103.073 410.846 1.00 94.55 O ATOM 1655 HG SER A 190 112.634 103.241 409.871 1.00 0.00 H ATOM 1656 H SER A 190 109.972 104.883 413.052 1.00 0.00 H ATOM 1657 N PHE A 191 113.219 104.930 413.885 1.00 81.33 N ATOM 1658 CA PHE A 191 114.534 105.246 414.442 1.00 80.29 C ATOM 1659 C PHE A 191 114.664 104.762 415.880 1.00 85.33 C ATOM 1660 O PHE A 191 115.742 104.314 416.288 1.00 87.19 O ATOM 1661 CB PHE A 191 114.809 106.746 414.362 1.00 75.72 C ATOM 1662 CG PHE A 191 116.175 107.147 414.873 1.00 74.08 C ATOM 1663 CD1 PHE A 191 116.349 107.612 416.162 1.00 76.03 C ATOM 1664 CD2 PHE A 191 117.286 107.046 414.062 1.00 69.33 C ATOM 1665 CE1 PHE A 191 117.599 107.999 416.610 1.00 74.76 C ATOM 1666 CE2 PHE A 191 118.534 107.404 414.519 1.00 67.64 C ATOM 1667 CZ PHE A 191 118.693 107.878 415.787 1.00 70.62 C ATOM 1668 H PHE A 191 112.516 105.682 413.741 1.00 0.00 H ATOM 1669 N ARG A 192 113.580 104.840 416.664 1.00 88.65 N ATOM 1670 CA ARG A 192 113.654 104.434 418.065 1.00 92.28 C ATOM 1671 C ARG A 192 113.774 102.920 418.201 1.00 96.09 C ATOM 1672 O ARG A 192 114.551 102.425 419.028 1.00 99.70 O ATOM 1673 CB ARG A 192 112.432 104.956 418.828 1.00 96.38 C ATOM 1674 CG ARG A 192 112.441 104.683 420.339 1.00100.35 C ATOM 1675 CD ARG A 192 111.041 104.828 420.942 1.00107.45 C ATOM 1676 NE ARG A 192 111.039 105.566 422.207 1.00111.12 N ATOM 1677 CZ ARG A 192 110.116 106.460 422.555 1.00111.70 C ATOM 1678 NH1 ARG A 192 109.115 106.739 421.725 1.00110.66 N ATOM 1679 NH2 ARG A 192 110.199 107.081 423.729 1.00111.83 N ATOM 1680 HE ARG A 192 111.811 105.379 422.879 1.00 0.00 H ATOM 1681 HH12 ARG A 192 108.394 107.437 421.996 1.00 0.00 H ATOM 1682 HH11 ARG A 192 109.054 106.259 420.805 1.00 0.00 H ATOM 1683 HH22 ARG A 192 109.478 107.779 424.000 1.00 0.00 H ATOM 1684 HH21 ARG A 192 110.985 106.868 424.375 1.00 0.00 H ATOM 1685 H ARG A 192 112.682 105.191 416.273 1.00 0.00 H ATOM 1686 N GLN A 193 113.021 102.164 417.400 1.00 93.65 N ATOM 1687 CA GLN A 193 113.079 100.710 417.473 1.00 95.80 C ATOM 1688 C GLN A 193 114.290 100.125 416.752 1.00 99.83 C ATOM 1689 O GLN A 193 114.463 98.904 416.764 1.00104.13 O ATOM 1690 CB GLN A 193 111.785 100.103 416.912 1.00 97.89 C ATOM 1691 H GLN A 193 112.384 102.618 416.715 1.00 0.00 H ATOM 1692 N SER A 194 115.127 100.958 416.124 1.00 99.56 N ATOM 1693 CA SER A 194 116.326 100.467 415.449 1.00100.50 C ATOM 1694 C SER A 194 117.461 100.174 416.428 1.00104.44 C ATOM 1695 O SER A 194 118.219 99.217 416.232 1.00109.28 O ATOM 1696 CB SER A 194 116.791 101.480 414.404 1.00 98.97 C ATOM 1697 OG SER A 194 118.194 101.415 414.244 1.00 99.57 O ATOM 1698 HG SER A 194 118.478 102.077 413.565 1.00 0.00 H ATOM 1699 H SER A 194 114.920 101.977 416.116 1.00 0.00 H ATOM 1700 N GLU A 195 117.611 100.991 417.466 1.00104.19 N ATOM 1701 CA GLU A 195 118.604 100.725 418.506 1.00105.08 C ATOM 1702 C GLU A 195 118.190 99.536 419.371 1.00110.76 C ATOM 1703 O GLU A 195 118.708 98.430 419.216 1.00114.64 O ATOM 1704 CB GLU A 195 118.819 101.965 419.382 1.00 99.58 C ATOM 1705 CG GLU A 195 119.893 101.778 420.446 1.00100.06 C ATOM 1706 CD GLU A 195 120.038 102.979 421.367 1.00 97.60 C ATOM 1707 OE1 GLU A 195 120.655 102.834 422.442 1.00 98.06 O ATOM 1708 OE2 GLU A 195 119.537 104.067 421.020 1.00 95.45 O ATOM 1709 H GLU A 195 117.010 101.836 417.540 1.00 0.00 H TER 1710 GLU A 195 HETATM 1711 MN MN A 1 130.816 107.978 422.116 1.00 66.86 MN HETATM 1712 MN MN A 2 133.699 107.869 419.750 1.00 76.09 MN HETATM 1713 O HOH 3 108.288 104.386 419.665 1.00 76.47 O HETATM 1714 O HOH 4 136.244 108.384 419.507 1.00 65.43 O HETATM 1715 O HOH 5 130.657 114.272 432.980 1.00 65.52 O HETATM 1716 O HOH 6 134.646 107.023 421.860 1.00 55.07 O HETATM 1717 O HOH 7 132.320 118.867 437.345 1.00110.66 O HETATM 1718 O HOH 8 118.013 122.571 416.248 1.00 62.58 O HETATM 1719 O HOH 9 123.969 122.731 417.502 1.00 86.32 O HETATM 1720 O HOH 10 137.796 123.177 424.536 1.00 67.74 O HETATM 1721 O HOH 11 126.390 106.990 421.354 1.00 67.14 O HETATM 1722 O HOH 12 107.469 108.270 413.606 1.00 67.34 O HETATM 1723 O HOH 13 111.727 106.198 402.841 1.00 76.24 O HETATM 1724 O HOH 14 136.265 107.531 416.798 1.00 75.43 O HETATM 1725 O HOH 15 107.519 111.789 419.804 1.00 87.78 O HETATM 1726 O HOH 16 119.981 124.136 421.193 1.00 69.99 O HETATM 1727 O HOH 17 113.135 106.108 405.354 1.00 81.07 O HETATM 1728 O HOH 18 115.872 120.998 409.290 1.00 78.79 O HETATM 1729 C1 KU A 0 127.248 104.885 417.000 1.00 0.09 C HETATM 1730 C2 KU A 0 128.521 104.694 416.460 1.00 0.10 C HETATM 1731 C21 KU A 0 129.339 105.820 416.350 1.00 0.09 C HETATM 1732 C22 KU A 0 128.856 107.057 416.755 1.00 0.03 C HETATM 1733 N5 KU A 0 127.637 107.220 417.261 1.00 -0.29 N HETATM 1734 C23 KU A 0 126.847 106.157 417.383 1.00 0.03 C HETATM 1735 H13 KU A 0 125.854 106.289 417.797 1.00 0.08 H HETATM 1736 H12 KU A 0 129.498 107.925 416.655 1.00 0.08 H HETATM 1737 CL2 KU A 0 130.930 105.693 415.695 1.00 -0.06 CL HETATM 1738 C3 KU A 0 129.038 103.350 416.042 1.00 0.22 C HETATM 1739 N1 KU A 0 129.358 102.474 417.004 1.00 -0.25 N HETATM 1740 C20 KU A 0 130.019 101.188 416.729 1.00 0.04 C HETATM 1741 C19 KU A 0 130.587 100.823 418.080 1.00 -0.03 C HETATM 1742 C18 KU A 0 129.479 101.280 419.019 1.00 -0.01 C HETATM 1743 C4 KU A 0 129.113 102.664 418.456 1.00 0.13 C HETATM 1744 C5 KU A 0 129.887 103.830 419.030 1.00 0.16 C HETATM 1745 N2 KU A 0 131.118 104.042 418.557 1.00 -0.30 N HETATM 1746 C6 KU A 0 131.837 105.070 419.025 1.00 0.11 C HETATM 1747 C16 KU A 0 131.338 105.926 419.967 1.00 0.18 C HETATM 1748 C17 KU A 0 130.044 105.738 420.464 1.00 0.26 C HETATM 1749 N4 KU A 0 129.337 104.664 419.966 1.00 -0.19 N HETATM 1750 H20 KU A 0 128.408 104.492 420.294 1.00 0.25 H HETATM 1751 O6 KU A 0 129.513 106.465 421.318 1.00 -0.40 O HETATM 1752 O5 KU A 0 132.018 106.970 420.462 1.00 -0.33 O HETATM 1753 H21 KU A 0 132.812 106.659 420.880 1.00 0.25 H HETATM 1754 C7 KU A 0 133.225 105.216 418.450 1.00 0.20 C HETATM 1755 N3 KU A 0 133.640 104.187 417.720 1.00 -0.29 N HETATM 1756 C8 KU A 0 134.999 104.080 417.212 1.00 0.05 C HETATM 1757 C9 KU A 0 136.039 103.908 418.302 1.00 0.09 C HETATM 1758 S1 KU A 0 135.962 102.316 419.085 1.00 -0.00 S HETATM 1759 C10 KU A 0 134.579 102.393 420.183 1.00 0.09 C HETATM 1760 C11 KU A 0 133.641 101.375 420.184 1.00 -0.04 C HETATM 1761 C12 KU A 0 132.566 101.441 421.054 1.00 -0.06 C HETATM 1762 C13 KU A 0 132.437 102.503 421.922 1.00 -0.06 C HETATM 1763 C14 KU A 0 133.376 103.508 421.925 1.00 -0.06 C HETATM 1764 C15 KU A 0 134.455 103.458 421.058 1.00 -0.04 C HETATM 1765 H5 KU A 0 135.197 104.248 421.065 1.00 0.06 H HETATM 1766 H4 KU A 0 133.271 104.343 422.609 1.00 0.06 H HETATM 1767 H3 KU A 0 131.595 102.547 422.603 1.00 0.06 H HETATM 1768 H2 KU A 0 131.822 100.653 421.052 1.00 0.06 H HETATM 1769 H1 KU A 0 133.747 100.533 419.509 1.00 0.06 H HETATM 1770 O3 KU A 0 135.689 101.338 418.072 1.00 -0.17 O HETATM 1771 O4 KU A 0 137.144 102.148 419.885 1.00 -0.17 O HETATM 1772 H17 KU A 0 135.878 104.683 419.066 1.00 0.05 H HETATM 1773 H18 KU A 0 137.037 104.033 417.857 1.00 0.05 H HETATM 1774 H15 KU A 0 135.052 103.211 416.539 1.00 0.05 H HETATM 1775 H16 KU A 0 135.233 104.995 416.648 1.00 0.05 H HETATM 1776 H19 KU A 0 132.991 103.455 417.511 1.00 0.18 H HETATM 1777 O2 KU A 0 133.915 106.206 418.670 1.00 -0.39 O HETATM 1778 H14 KU A 0 128.046 102.860 418.635 1.00 0.08 H HETATM 1779 H6 KU A 0 129.842 101.356 420.055 1.00 0.03 H HETATM 1780 H7 KU A 0 128.619 100.596 418.981 1.00 0.03 H HETATM 1781 H8 KU A 0 130.760 99.740 418.162 1.00 0.03 H HETATM 1782 H9 KU A 0 131.526 101.360 418.278 1.00 0.03 H HETATM 1783 H10 KU A 0 129.296 100.434 416.384 1.00 0.05 H HETATM 1784 H11 KU A 0 130.816 101.302 415.979 1.00 0.05 H HETATM 1785 O1 KU A 0 129.227 103.090 414.855 1.00 -0.38 O HETATM 1786 CL1 KU A 0 126.161 103.561 417.196 1.00 -0.06 CL CONECT 1 2 6 7 8 CONECT 6 1 CONECT 7 1 CONECT 8 1 CONECT 420 418 419 1711 CONECT 607 606 1712 CONECT 859 858 1712 CONECT 860 858 1711 CONECT 987 986 1711 CONECT 993 992 1711 CONECT 1157 1158 1164 1165 1166 CONECT 1164 1157 CONECT 1165 1157 CONECT 1166 1157 CONECT 1711 420 860 987 993 CONECT 1712 607 859 CONECT 1729 1730 1734 1786 CONECT 1730 1729 1731 1738 CONECT 1731 1730 1732 1737 CONECT 1732 1731 1733 1736 CONECT 1733 1732 1734 CONECT 1734 1729 1733 1735 CONECT 1735 1734 CONECT 1736 1732 CONECT 1737 1731 CONECT 1738 1730 1739 1785 CONECT 1739 1738 1740 1743 CONECT 1740 1739 1741 1783 1784 CONECT 1741 1740 1742 1781 1782 CONECT 1742 1741 1743 1779 1780 CONECT 1743 1739 1742 1744 1778 CONECT 1744 1743 1745 1749 CONECT 1745 1744 1746 CONECT 1746 1745 1747 1754 CONECT 1747 1746 1748 1752 CONECT 1748 1747 1749 1751 CONECT 1749 1744 1748 1750 CONECT 1750 1749 CONECT 1751 1748 CONECT 1752 1747 1753 CONECT 1753 1752 CONECT 1754 1746 1755 1777 CONECT 1755 1754 1756 1776 CONECT 1756 1755 1757 1774 1775 CONECT 1757 1756 1758 1772 1773 CONECT 1758 1757 1759 1770 1771 CONECT 1759 1758 1760 1764 CONECT 1760 1759 1761 1769 CONECT 1761 1760 1762 1768 CONECT 1762 1761 1763 1767 CONECT 1763 1762 1764 1766 CONECT 1764 1759 1763 1765 CONECT 1765 1764 CONECT 1766 1763 CONECT 1767 1762 CONECT 1768 1761 CONECT 1769 1760 CONECT 1770 1758 CONECT 1771 1758 CONECT 1772 1757 CONECT 1773 1757 CONECT 1774 1756 CONECT 1775 1756 CONECT 1776 1755 CONECT 1777 1754 CONECT 1778 1743 CONECT 1779 1742 CONECT 1780 1742 CONECT 1781 1741 CONECT 1782 1741 CONECT 1783 1740 CONECT 1784 1740 CONECT 1785 1738 CONECT 1786 1729 MASTER 0 0 0 0 0 0 0 0 1784 2 74 15 END
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197aa, >5W73_1|Chain... at 93%
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5web
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197aa, >5WF3_1|Chain... at 92%
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197aa, >5WFM_1|Chain... at 92%
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197aa, >5WFW_1|Chain... at 92%
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197aa, >5WFZ_1|Chain... at 92%
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Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
5wfz
RCSB PDB
PDBbind
KU0
Entry Information
PDB ID
5w92
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Polymerase acidic protein
Ligand Name
KU0
EC.Number
E.C.3.1.-.-
Resolution
2.3(Å)
Affinity (Kd/Ki/IC50)
Ki=0.02uM
Release Year
2018
Protein/NA Sequence
Check fasta file
Primary Reference
(2017) Sci Rep Vol. 7: pp. 17139-17139
Ligand Properties
Formula
C
2
3
H
2
1
Cl
2
N
5
O
6
S
Molecular Weight
566.414
Exact Mass
565.059
No. of atoms
58
No. of bonds
61
Polar Surface Area
170.8
LOGP Value
2.00 (
Computed with XLOGP3
)
3.77 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 3
No. of Hydrogen Bond Acceptors: 7
No. of Rotatable Bonds: 10
No. of Nitrogen and Oxygen Atoms: 11
No. of Rings: 4
Canonical SMILES
O=C(c1nc([nH]c(=O)c1O)[C@@H]1CCCN1C(=O)c1c(Cl)cncc1Cl)NCCS(=O)(=O)c1ccccc1
InChI String
InChI=1S/C23H21Cl2N5O6S/c24-14-11-26-12-15(25)17(14)23(34)30-9-4-7-16(30)20-28-18(19(31)22(33)29-20)21(32)27-8-10-37(35,36)13-5-2-1-3-6-13/h1-3,5-6,11-12,16,31H,4,7-10H2,(H,27,32)(H,28,29,33)/t16-/m0/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
C3W5S0
Entrez Gene ID
No matched NCBI Entrez Gene ID found!
ASD
Information of known allosteric effects of PDB entries
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