Browse entries in the PDBbind-CN Database
HEADER 2QBX_COMPLEX COMPND 2QBX_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 B 176 GLU GLU THR LEU MET ASP SER THR THR ALA THR ALA GLU SEQRES 2 B 176 LEU GLY TRP MET VAL HIS PRO PRO SER GLY TRP GLU GLU SEQRES 3 B 176 VAL SER GLY TYR ASP GLU ASN MET ASN THR ILE ARG THR SEQRES 4 B 176 TYR GLN VAL CYS ASN VAL PHE GLU SER SER GLN ASN ASN SEQRES 5 B 176 TRP LEU ARG THR LYS PHE ILE ARG ARG ARG GLY ALA HIS SEQRES 6 B 176 ARG ILE HIS VAL GLU MET LYS PHE SER VAL ARG ASP CYS SEQRES 7 B 176 SER SER ILE PRO SER VAL PRO GLY SER CYS LYS GLU THR SEQRES 8 B 176 PHE ASN LEU TYR TYR TYR GLU ALA ASP PHE ASP SER ALA SEQRES 9 B 176 THR LYS THR PHE PRO ASN TRP MET GLU ASN PRO TRP VAL SEQRES 10 B 176 LYS VAL ASP THR ILE ALA ALA ASP GLU SER PHE SER GLN SEQRES 11 B 176 VAL ASP LEU GLY GLY ARG VAL MET LYS ILE ASN THR GLU SEQRES 12 B 176 VAL ARG SER PHE GLY PRO VAL SER ARG SER GLY PHE TYR SEQRES 13 B 176 LEU ALA PHE GLN ASP TYR GLY GLY CYS MET SER LEU ILE SEQRES 14 B 176 ALA VAL ARG VAL PHE TYR ARG HET NON A 177 191 SSBOND 1 CYS B 105 CYS B 115 SSBOND 2 CYS B 70 CYS B 192 ATOM 1 N GLU B 28 19.584 23.690 2.717 1.00 54.81 N ATOM 2 CA GLU B 28 18.556 22.762 3.295 1.00 54.68 C ATOM 3 C GLU B 28 18.928 21.308 3.116 1.00 54.18 C ATOM 4 O GLU B 28 19.322 20.891 2.018 1.00 54.89 O ATOM 5 CB GLU B 28 17.153 23.018 2.713 1.00 54.44 C ATOM 6 CG GLU B 28 17.002 22.733 1.250 1.00 54.54 C ATOM 7 CD GLU B 28 15.718 23.307 0.649 1.00 55.81 C ATOM 8 OE1 GLU B 28 15.193 24.338 1.127 1.00 57.67 O ATOM 9 OE2 GLU B 28 15.226 22.716 -0.327 1.00 56.48 O ATOM 10 HA GLU B 28 18.531 22.977 4.363 1.00 0.00 H ATOM 11 HB2 GLU B 28 16.445 22.390 3.253 1.00 0.00 H ATOM 12 HB3 GLU B 28 16.906 24.067 2.879 1.00 0.00 H ATOM 13 HG2 GLU B 28 17.853 23.165 0.724 1.00 0.00 H ATOM 14 HG3 GLU B 28 16.998 21.652 1.107 1.00 0.00 H ATOM 15 HN3 GLU B 28 19.680 23.509 1.718 1.00 0.00 H ATOM 16 HN2 GLU B 28 20.480 23.534 3.180 1.00 0.00 H ATOM 17 HN1 GLU B 28 19.289 24.655 2.862 1.00 0.00 H ATOM 18 N GLU B 29 18.659 20.540 4.166 1.00 53.21 N ATOM 19 CA GLU B 29 19.124 19.184 4.307 1.00 52.37 C ATOM 20 C GLU B 29 18.072 18.087 4.428 1.00 50.52 C ATOM 21 O GLU B 29 17.125 18.201 5.143 1.00 49.31 O ATOM 22 CB GLU B 29 20.130 19.089 5.425 1.00 52.17 C ATOM 23 CG GLU B 29 21.374 18.412 4.980 1.00 54.09 C ATOM 24 CD GLU B 29 22.112 17.725 6.085 1.00 54.77 C ATOM 25 OE1 GLU B 29 23.330 17.942 6.153 1.00 58.90 O ATOM 26 OE2 GLU B 29 21.498 16.992 6.878 1.00 55.89 O ATOM 27 HA GLU B 29 19.585 18.972 3.342 1.00 0.00 H ATOM 28 HB2 GLU B 29 20.376 20.094 5.767 1.00 0.00 H ATOM 29 HB3 GLU B 29 19.693 18.523 6.248 1.00 0.00 H ATOM 30 HG2 GLU B 29 21.111 17.669 4.227 1.00 0.00 H ATOM 31 HG3 GLU B 29 22.033 19.159 4.537 1.00 0.00 H ATOM 32 H GLU B 29 18.090 20.933 4.916 1.00 0.00 H ATOM 33 N THR B 30 18.284 17.004 3.687 1.00 48.99 N ATOM 34 CA THR B 30 17.217 16.053 3.398 1.00 48.32 C ATOM 35 C THR B 30 17.141 14.969 4.468 1.00 47.07 C ATOM 36 O THR B 30 18.147 14.344 4.805 1.00 46.68 O ATOM 37 CB THR B 30 17.409 15.390 2.021 1.00 48.27 C ATOM 38 OG1 THR B 30 17.245 16.371 0.989 1.00 48.75 O ATOM 39 CG2 THR B 30 16.395 14.275 1.821 1.00 49.04 C ATOM 40 HA THR B 30 16.285 16.618 3.391 1.00 0.00 H ATOM 41 HB THR B 30 18.413 14.967 1.974 1.00 0.00 H ATOM 42 HG1 THR B 30 17.365 15.955 0.132 1.00 0.00 H ATOM 43 HG23 THR B 30 16.519 13.528 2.605 1.00 0.00 H ATOM 44 HG21 THR B 30 15.388 14.689 1.867 1.00 0.00 H ATOM 45 HG22 THR B 30 16.554 13.811 0.848 1.00 0.00 H ATOM 46 H THR B 30 19.217 16.834 3.311 1.00 0.00 H ATOM 47 N LEU B 31 15.942 14.750 4.998 1.00 46.01 N ATOM 48 CA LEU B 31 15.738 13.758 6.047 1.00 44.93 C ATOM 49 C LEU B 31 15.217 12.446 5.471 1.00 43.80 C ATOM 50 O LEU B 31 15.735 11.372 5.780 1.00 43.23 O ATOM 51 CB LEU B 31 14.768 14.289 7.104 1.00 44.80 C ATOM 52 CG LEU B 31 15.399 14.875 8.369 1.00 45.17 C ATOM 53 CD1 LEU B 31 16.870 15.189 8.141 1.00 45.61 C ATOM 54 CD2 LEU B 31 14.645 16.117 8.821 1.00 44.19 C ATOM 55 HA LEU B 31 16.703 13.565 6.516 1.00 0.00 H ATOM 56 HB2 LEU B 31 14.166 15.070 6.640 1.00 0.00 H ATOM 57 HB3 LEU B 31 14.122 13.465 7.406 1.00 0.00 H ATOM 58 HG LEU B 31 15.330 14.129 9.161 1.00 0.00 H ATOM 59 HD21 LEU B 31 14.677 16.867 8.031 1.00 0.00 H ATOM 60 HD22 LEU B 31 13.609 15.854 9.033 1.00 0.00 H ATOM 61 HD23 LEU B 31 15.112 16.516 9.722 1.00 0.00 H ATOM 62 HD11 LEU B 31 17.399 14.274 7.875 1.00 0.00 H ATOM 63 HD12 LEU B 31 16.964 15.913 7.332 1.00 0.00 H ATOM 64 HD13 LEU B 31 17.297 15.604 9.054 1.00 0.00 H ATOM 65 H LEU B 31 15.144 15.290 4.662 1.00 0.00 H ATOM 66 N MET B 32 14.191 12.539 4.632 1.00 42.44 N ATOM 67 CA MET B 32 13.896 11.492 3.661 1.00 41.63 C ATOM 68 C MET B 32 13.727 12.070 2.261 1.00 40.60 C ATOM 69 O MET B 32 13.490 13.267 2.097 1.00 40.23 O ATOM 70 CB MET B 32 12.638 10.722 4.069 1.00 41.06 C ATOM 71 CG MET B 32 11.897 10.084 2.905 1.00 41.62 C ATOM 72 SD MET B 32 10.223 9.575 3.341 1.00 43.80 S ATOM 73 CE MET B 32 9.360 11.142 3.254 1.00 46.69 C ATOM 74 HA MET B 32 14.742 10.804 3.645 1.00 0.00 H ATOM 75 HB2 MET B 32 12.929 9.934 4.764 1.00 0.00 H ATOM 76 HB3 MET B 32 11.960 11.414 4.569 1.00 0.00 H ATOM 77 HG2 MET B 32 12.454 9.207 2.575 1.00 0.00 H ATOM 78 HG3 MET B 32 11.841 10.805 2.089 1.00 0.00 H ATOM 79 HE1 MET B 32 9.803 11.839 3.965 1.00 0.00 H ATOM 80 HE2 MET B 32 9.445 11.546 2.245 1.00 0.00 H ATOM 81 HE3 MET B 32 8.309 10.990 3.499 1.00 0.00 H ATOM 82 H MET B 32 13.594 13.365 4.668 1.00 0.00 H ATOM 83 N ASP B 33 13.850 11.212 1.253 1.00 39.85 N ATOM 84 CA ASP B 33 13.353 11.522 -0.082 1.00 39.54 C ATOM 85 C ASP B 33 12.929 10.257 -0.821 1.00 38.69 C ATOM 86 O ASP B 33 13.741 9.361 -1.052 1.00 39.33 O ATOM 87 CB ASP B 33 14.415 12.271 -0.889 1.00 39.22 C ATOM 88 CG ASP B 33 13.899 12.747 -2.232 1.00 40.02 C ATOM 89 OD1 ASP B 33 13.162 11.984 -2.892 1.00 39.24 O ATOM 90 OD2 ASP B 33 14.229 13.885 -2.629 1.00 40.63 O ATOM 91 HA ASP B 33 12.477 12.161 0.029 1.00 0.00 H ATOM 92 HB2 ASP B 33 14.744 13.137 -0.314 1.00 0.00 H ATOM 93 HB3 ASP B 33 15.261 11.605 -1.056 1.00 0.00 H ATOM 94 H ASP B 33 14.304 10.314 1.418 1.00 0.00 H ATOM 95 N SER B 34 11.654 10.191 -1.188 1.00 38.36 N ATOM 96 CA SER B 34 11.063 8.955 -1.688 1.00 37.78 C ATOM 97 C SER B 34 11.594 8.612 -3.076 1.00 39.18 C ATOM 98 O SER B 34 11.611 7.447 -3.474 1.00 39.05 O ATOM 99 CB SER B 34 9.538 9.065 -1.720 1.00 37.06 C ATOM 100 OG SER B 34 9.110 9.932 -2.757 1.00 33.36 O ATOM 101 HA SER B 34 11.345 8.152 -1.008 1.00 0.00 H ATOM 102 HB2 SER B 34 9.189 9.454 -0.764 1.00 0.00 H ATOM 103 HB3 SER B 34 9.113 8.075 -1.885 1.00 0.00 H ATOM 104 HG SER B 34 8.151 9.983 -2.755 1.00 0.00 H ATOM 105 H SER B 34 11.073 11.027 -1.118 1.00 0.00 H ATOM 106 N THR B 35 12.025 9.634 -3.808 1.00 39.62 N ATOM 107 CA THR B 35 12.474 9.455 -5.184 1.00 40.72 C ATOM 108 C THR B 35 13.920 8.971 -5.233 1.00 42.15 C ATOM 109 O THR B 35 14.512 8.865 -6.307 1.00 42.72 O ATOM 110 CB THR B 35 12.352 10.761 -5.991 1.00 40.25 C ATOM 111 OG1 THR B 35 13.469 11.611 -5.704 1.00 37.46 O ATOM 112 CG2 THR B 35 11.063 11.487 -5.638 1.00 41.11 C ATOM 113 HA THR B 35 11.827 8.701 -5.631 1.00 0.00 H ATOM 114 HB THR B 35 12.339 10.514 -7.053 1.00 0.00 H ATOM 115 HG1 THR B 35 13.481 11.815 -4.766 1.00 0.00 H ATOM 116 HG23 THR B 35 10.212 10.841 -5.856 1.00 0.00 H ATOM 117 HG21 THR B 35 11.068 11.738 -4.577 1.00 0.00 H ATOM 118 HG22 THR B 35 10.988 12.400 -6.229 1.00 0.00 H ATOM 119 H THR B 35 12.042 10.567 -3.397 1.00 0.00 H ATOM 120 N THR B 36 14.481 8.680 -4.064 1.00 43.64 N ATOM 121 CA THR B 36 15.852 8.191 -3.974 1.00 44.49 C ATOM 122 C THR B 36 15.888 6.728 -3.546 1.00 45.00 C ATOM 123 O THR B 36 16.960 6.141 -3.395 1.00 45.80 O ATOM 124 CB THR B 36 16.685 9.026 -2.984 1.00 44.83 C ATOM 125 OG1 THR B 36 17.627 9.829 -3.706 1.00 46.51 O ATOM 126 CG2 THR B 36 17.432 8.119 -2.019 1.00 45.69 C ATOM 127 HA THR B 36 16.286 8.286 -4.969 1.00 0.00 H ATOM 128 HB THR B 36 16.011 9.667 -2.416 1.00 0.00 H ATOM 129 HG1 THR B 36 18.145 10.348 -3.086 1.00 0.00 H ATOM 130 HG23 THR B 36 16.716 7.508 -1.469 1.00 0.00 H ATOM 131 HG21 THR B 36 18.109 7.473 -2.579 1.00 0.00 H ATOM 132 HG22 THR B 36 18.005 8.728 -1.319 1.00 0.00 H ATOM 133 H THR B 36 13.939 8.802 -3.208 1.00 0.00 H ATOM 134 N ALA B 37 14.710 6.144 -3.351 1.00 45.29 N ATOM 135 CA ALA B 37 14.603 4.733 -3.000 1.00 45.81 C ATOM 136 C ALA B 37 15.399 3.862 -3.966 1.00 46.57 C ATOM 137 O ALA B 37 15.279 4.000 -5.183 1.00 46.33 O ATOM 138 CB ALA B 37 13.145 4.303 -2.972 1.00 45.73 C ATOM 139 HA ALA B 37 15.026 4.601 -2.004 1.00 0.00 H ATOM 140 HB1 ALA B 37 12.607 4.895 -2.232 1.00 0.00 H ATOM 141 HB2 ALA B 37 12.702 4.459 -3.956 1.00 0.00 H ATOM 142 HB3 ALA B 37 13.084 3.247 -2.708 1.00 0.00 H ATOM 143 H ALA B 37 13.859 6.697 -3.449 1.00 0.00 H ATOM 144 N THR B 38 16.210 2.975 -3.437 1.00 47.11 N ATOM 145 CA THR B 38 16.860 1.981 -4.240 1.00 47.62 C ATOM 146 C THR B 38 16.105 0.680 -4.169 1.00 48.47 C ATOM 147 O THR B 38 16.677 -0.330 -4.327 1.00 49.31 O ATOM 148 CB THR B 38 18.306 1.791 -3.818 1.00 47.26 C ATOM 149 OG1 THR B 38 18.378 1.296 -2.486 1.00 45.60 O ATOM 150 CG2 THR B 38 19.021 3.068 -3.872 1.00 47.00 C ATOM 151 HA THR B 38 16.863 2.326 -5.274 1.00 0.00 H ATOM 152 HB THR B 38 18.762 1.076 -4.503 1.00 0.00 H ATOM 153 HG1 THR B 38 17.925 0.451 -2.435 1.00 0.00 H ATOM 154 HG23 THR B 38 18.977 3.465 -4.886 1.00 0.00 H ATOM 155 HG21 THR B 38 18.555 3.773 -3.184 1.00 0.00 H ATOM 156 HG22 THR B 38 20.061 2.913 -3.585 1.00 0.00 H ATOM 157 H THR B 38 16.381 2.994 -2.432 1.00 0.00 H ATOM 158 N ALA B 39 14.806 0.719 -3.930 1.00 49.28 N ATOM 159 CA ALA B 39 14.125 -0.401 -3.339 1.00 48.96 C ATOM 160 C ALA B 39 12.659 -0.475 -3.679 1.00 49.22 C ATOM 161 O ALA B 39 12.241 0.065 -4.638 1.00 49.31 O ATOM 162 CB ALA B 39 14.802 -1.624 -3.715 1.00 49.50 C ATOM 163 HA ALA B 39 14.163 -0.262 -2.259 1.00 0.00 H ATOM 164 HB1 ALA B 39 14.795 -1.723 -4.800 1.00 0.00 H ATOM 165 HB2 ALA B 39 15.832 -1.592 -3.359 1.00 0.00 H ATOM 166 HB3 ALA B 39 14.288 -2.475 -3.268 1.00 0.00 H ATOM 167 H ALA B 39 14.277 1.558 -4.169 1.00 0.00 H ATOM 168 N GLU B 40 11.846 -1.117 -2.880 1.00 20.00 N ATOM 169 CA GLU B 40 10.512 -0.593 -2.674 1.00 20.00 C ATOM 170 C GLU B 40 10.536 0.396 -1.551 1.00 20.00 C ATOM 171 O GLU B 40 11.461 0.456 -0.791 1.00 20.00 O ATOM 172 CB GLU B 40 9.529 -1.710 -2.424 1.00 20.00 C ATOM 173 CG GLU B 40 9.709 -2.804 -3.416 1.00 20.00 C ATOM 174 HA GLU B 40 10.179 -0.079 -3.576 1.00 0.00 H ATOM 175 HB2 GLU B 40 9.686 -2.107 -1.421 1.00 0.00 H ATOM 176 HB3 GLU B 40 8.515 -1.318 -2.503 1.00 0.00 H ATOM 177 HG2 GLU B 40 9.548 -2.412 -4.420 1.00 0.00 H ATOM 178 HG3 GLU B 40 10.721 -3.201 -3.337 1.00 0.00 H ATOM 179 H GLU B 40 12.146 -1.971 -2.411 1.00 0.00 H ATOM 180 N LEU B 41 9.538 1.222 -1.491 1.00 36.65 N ATOM 181 CA LEU B 41 9.418 2.114 -0.381 1.00 38.00 C ATOM 182 C LEU B 41 9.098 1.289 0.849 1.00 37.67 C ATOM 183 O LEU B 41 9.770 1.375 1.857 1.00 37.57 O ATOM 184 CB LEU B 41 8.364 3.153 -0.689 1.00 37.97 C ATOM 185 CG LEU B 41 8.952 4.144 -1.675 1.00 39.37 C ATOM 186 CD1 LEU B 41 8.065 5.261 -2.007 1.00 40.35 C ATOM 187 CD2 LEU B 41 10.252 4.638 -1.265 1.00 39.05 C ATOM 188 HA LEU B 41 10.345 2.655 -0.191 1.00 0.00 H ATOM 189 HB2 LEU B 41 7.488 2.673 -1.125 1.00 0.00 H ATOM 190 HB3 LEU B 41 8.075 3.669 0.226 1.00 0.00 H ATOM 191 HG LEU B 41 9.077 3.562 -2.588 1.00 0.00 H ATOM 192 HD21 LEU B 41 10.161 5.139 -0.301 1.00 0.00 H ATOM 193 HD22 LEU B 41 10.946 3.802 -1.177 1.00 0.00 H ATOM 194 HD23 LEU B 41 10.623 5.343 -2.009 1.00 0.00 H ATOM 195 HD11 LEU B 41 7.147 4.875 -2.450 1.00 0.00 H ATOM 196 HD12 LEU B 41 7.826 5.816 -1.100 1.00 0.00 H ATOM 197 HD13 LEU B 41 8.564 5.921 -2.717 1.00 0.00 H ATOM 198 H LEU B 41 8.840 1.235 -2.235 1.00 0.00 H ATOM 199 N GLY B 42 8.100 0.441 0.693 1.00 36.16 N ATOM 200 CA GLY B 42 7.685 -0.488 1.692 1.00 35.80 C ATOM 201 C GLY B 42 6.916 0.180 2.792 1.00 35.39 C ATOM 202 O GLY B 42 6.994 -0.214 3.907 1.00 35.40 O ATOM 203 HA3 GLY B 42 8.567 -0.965 2.118 1.00 0.00 H ATOM 204 HA2 GLY B 42 7.052 -1.245 1.229 1.00 0.00 H ATOM 205 H GLY B 42 7.596 0.450 -0.194 1.00 0.00 H ATOM 206 N TRP B 43 6.173 1.210 2.453 1.00 33.80 N ATOM 207 CA TRP B 43 5.414 1.983 3.418 1.00 32.34 C ATOM 208 C TRP B 43 4.210 1.157 3.747 1.00 32.60 C ATOM 209 O TRP B 43 3.801 0.352 2.936 1.00 33.15 O ATOM 210 CB TRP B 43 4.984 3.359 2.836 1.00 30.66 C ATOM 211 CG TRP B 43 6.133 4.250 2.542 1.00 28.52 C ATOM 212 CD1 TRP B 43 7.428 3.980 2.768 1.00 26.58 C ATOM 213 CD2 TRP B 43 6.083 5.592 2.015 1.00 28.56 C ATOM 214 NE1 TRP B 43 8.194 5.050 2.446 1.00 26.79 N ATOM 215 CE2 TRP B 43 7.400 6.046 1.940 1.00 26.09 C ATOM 216 CE3 TRP B 43 5.042 6.445 1.590 1.00 26.85 C ATOM 217 CZ2 TRP B 43 7.737 7.310 1.435 1.00 26.80 C ATOM 218 CZ3 TRP B 43 5.379 7.712 1.097 1.00 27.60 C ATOM 219 CH2 TRP B 43 6.718 8.131 1.039 1.00 27.23 C ATOM 220 HA TRP B 43 6.015 2.198 4.301 1.00 0.00 H ATOM 221 HB2 TRP B 43 4.432 3.188 1.912 1.00 0.00 H ATOM 222 HB3 TRP B 43 4.336 3.855 3.559 1.00 0.00 H ATOM 223 HE1 TRP B 43 9.206 5.106 2.562 1.00 0.00 H ATOM 224 HD1 TRP B 43 7.809 3.035 3.155 1.00 0.00 H ATOM 225 HZ2 TRP B 43 8.777 7.628 1.361 1.00 0.00 H ATOM 226 HH2 TRP B 43 6.950 9.131 0.671 1.00 0.00 H ATOM 227 HZ3 TRP B 43 4.591 8.382 0.754 1.00 0.00 H ATOM 228 HE3 TRP B 43 4.001 6.126 1.644 1.00 0.00 H ATOM 229 H TRP B 43 6.128 1.477 1.470 1.00 0.00 H ATOM 230 N MET B 44 3.643 1.370 4.933 1.00 32.68 N ATOM 231 CA MET B 44 2.494 0.646 5.376 1.00 33.10 C ATOM 232 C MET B 44 1.225 1.240 4.828 1.00 33.17 C ATOM 233 O MET B 44 0.995 2.429 4.937 1.00 32.95 O ATOM 234 CB MET B 44 2.366 0.699 6.883 1.00 33.86 C ATOM 235 CG MET B 44 1.102 0.013 7.436 1.00 36.64 C ATOM 236 SD MET B 44 1.163 -1.779 7.341 1.00 41.39 S ATOM 237 CE MET B 44 2.914 -2.065 7.616 1.00 42.70 C ATOM 238 HA MET B 44 2.629 -0.377 5.025 1.00 0.00 H ATOM 239 HB2 MET B 44 3.238 0.210 7.317 1.00 0.00 H ATOM 240 HB3 MET B 44 2.348 1.745 7.188 1.00 0.00 H ATOM 241 HG2 MET B 44 0.242 0.360 6.864 1.00 0.00 H ATOM 242 HG3 MET B 44 0.982 0.300 8.481 1.00 0.00 H ATOM 243 HE1 MET B 44 3.489 -1.565 6.837 1.00 0.00 H ATOM 244 HE2 MET B 44 3.197 -1.668 8.591 1.00 0.00 H ATOM 245 HE3 MET B 44 3.115 -3.136 7.587 1.00 0.00 H ATOM 246 H MET B 44 4.045 2.077 5.549 1.00 0.00 H ATOM 247 N VAL B 45 0.359 0.353 4.372 1.00 32.98 N ATOM 248 CA VAL B 45 -0.892 0.685 3.781 1.00 33.51 C ATOM 249 C VAL B 45 -1.950 0.022 4.626 1.00 33.64 C ATOM 250 O VAL B 45 -1.817 -1.144 4.978 1.00 35.19 O ATOM 251 CB VAL B 45 -0.888 0.225 2.325 1.00 33.94 C ATOM 252 CG1 VAL B 45 -2.282 0.123 1.758 1.00 36.50 C ATOM 253 CG2 VAL B 45 -0.046 1.228 1.498 1.00 33.97 C ATOM 254 HA VAL B 45 -1.090 1.757 3.756 1.00 0.00 H ATOM 255 HB VAL B 45 -0.454 -0.774 2.275 1.00 0.00 H ATOM 256 HG11 VAL B 45 -2.858 -0.596 2.340 1.00 0.00 H ATOM 257 HG12 VAL B 45 -2.764 1.099 1.805 1.00 0.00 H ATOM 258 HG13 VAL B 45 -2.228 -0.208 0.721 1.00 0.00 H ATOM 259 HG21 VAL B 45 -0.488 2.221 1.575 1.00 0.00 H ATOM 260 HG22 VAL B 45 0.973 1.251 1.885 1.00 0.00 H ATOM 261 HG23 VAL B 45 -0.032 0.915 0.454 1.00 0.00 H ATOM 262 H VAL B 45 0.603 -0.634 4.449 1.00 0.00 H ATOM 263 N HIS B 46 -2.968 0.792 4.987 1.00 33.37 N ATOM 264 CA HIS B 46 -4.034 0.358 5.857 1.00 33.93 C ATOM 265 C HIS B 46 -5.317 1.029 5.380 1.00 33.61 C ATOM 266 O HIS B 46 -5.474 2.204 5.573 1.00 33.46 O ATOM 267 CB HIS B 46 -3.751 0.761 7.320 1.00 33.85 C ATOM 268 CG HIS B 46 -4.936 0.622 8.228 1.00 34.47 C ATOM 269 ND1 HIS B 46 -5.987 1.520 8.232 1.00 35.50 N ATOM 270 CD2 HIS B 46 -5.220 -0.292 9.191 1.00 36.39 C ATOM 271 CE1 HIS B 46 -6.876 1.145 9.137 1.00 35.92 C ATOM 272 NE2 HIS B 46 -6.437 0.044 9.730 1.00 36.21 N ATOM 273 HA HIS B 46 -4.121 -0.728 5.822 1.00 0.00 H ATOM 274 HB2 HIS B 46 -2.950 0.128 7.702 1.00 0.00 H ATOM 275 HB3 HIS B 46 -3.428 1.802 7.333 1.00 0.00 H ATOM 276 HD2 HIS B 46 -4.596 -1.137 9.483 1.00 0.00 H ATOM 277 HE1 HIS B 46 -7.813 1.656 9.358 1.00 0.00 H ATOM 278 H HIS B 46 -2.999 1.746 4.629 1.00 0.00 H ATOM 279 N PRO B 47 -6.228 0.284 4.746 1.00 34.66 N ATOM 280 CA PRO B 47 -6.172 -1.147 4.376 1.00 35.14 C ATOM 281 C PRO B 47 -5.389 -1.364 3.106 1.00 35.88 C ATOM 282 O PRO B 47 -5.256 -0.420 2.299 1.00 37.41 O ATOM 283 CB PRO B 47 -7.638 -1.517 4.189 1.00 35.63 C ATOM 284 CG PRO B 47 -8.349 -0.182 3.873 1.00 34.68 C ATOM 285 CD PRO B 47 -7.490 0.929 4.344 1.00 34.84 C ATOM 286 HA PRO B 47 -5.668 -1.756 5.126 1.00 0.00 H ATOM 287 HD3 PRO B 47 -7.316 1.647 3.543 1.00 0.00 H ATOM 288 HD2 PRO B 47 -7.949 1.437 5.192 1.00 0.00 H ATOM 289 HG3 PRO B 47 -9.311 -0.147 4.385 1.00 0.00 H ATOM 290 HG2 PRO B 47 -8.508 -0.095 2.798 1.00 0.00 H ATOM 291 HB2 PRO B 47 -7.754 -2.218 3.363 1.00 0.00 H ATOM 292 HB3 PRO B 47 -8.041 -1.960 5.100 1.00 0.00 H ATOM 293 N PRO B 48 -4.874 -2.595 2.895 1.00 36.14 N ATOM 294 CA PRO B 48 -4.010 -2.903 1.721 1.00 35.54 C ATOM 295 C PRO B 48 -4.767 -2.779 0.406 1.00 34.69 C ATOM 296 O PRO B 48 -4.191 -2.737 -0.688 1.00 34.45 O ATOM 297 CB PRO B 48 -3.571 -4.357 1.971 1.00 35.95 C ATOM 298 CG PRO B 48 -4.001 -4.666 3.381 1.00 35.79 C ATOM 299 CD PRO B 48 -5.107 -3.790 3.737 1.00 35.52 C ATOM 300 HA PRO B 48 -3.174 -2.210 1.630 1.00 0.00 H ATOM 301 HD3 PRO B 48 -6.065 -4.254 3.502 1.00 0.00 H ATOM 302 HD2 PRO B 48 -5.079 -3.534 4.796 1.00 0.00 H ATOM 303 HG3 PRO B 48 -3.167 -4.500 4.063 1.00 0.00 H ATOM 304 HG2 PRO B 48 -4.321 -5.706 3.447 1.00 0.00 H ATOM 305 HB2 PRO B 48 -4.060 -5.030 1.266 1.00 0.00 H ATOM 306 HB3 PRO B 48 -2.490 -4.452 1.872 1.00 0.00 H ATOM 307 N SER B 49 -6.068 -2.800 0.585 1.00 33.72 N ATOM 308 CA SER B 49 -7.128 -2.359 -0.308 1.00 33.74 C ATOM 309 C SER B 49 -7.057 -0.904 -0.882 1.00 33.85 C ATOM 310 O SER B 49 -7.662 -0.585 -1.930 1.00 33.52 O ATOM 311 CB SER B 49 -8.342 -2.439 0.610 1.00 33.88 C ATOM 312 OG SER B 49 -9.532 -2.115 0.015 1.00 35.64 O ATOM 313 HA SER B 49 -7.104 -2.969 -1.211 1.00 0.00 H ATOM 314 HB2 SER B 49 -8.182 -1.756 1.445 1.00 0.00 H ATOM 315 HB3 SER B 49 -8.417 -3.459 0.986 1.00 0.00 H ATOM 316 HG SER B 49 -9.490 -1.213 -0.312 1.00 0.00 H ATOM 317 H SER B 49 -6.380 -3.180 1.479 1.00 0.00 H ATOM 318 N GLY B 50 -6.356 -0.014 -0.183 1.00 33.48 N ATOM 319 CA GLY B 50 -6.438 1.441 -0.480 1.00 33.09 C ATOM 320 C GLY B 50 -5.279 1.888 -1.329 1.00 32.41 C ATOM 321 O GLY B 50 -5.272 1.642 -2.542 1.00 33.02 O ATOM 322 HA3 GLY B 50 -6.428 1.997 0.458 1.00 0.00 H ATOM 323 HA2 GLY B 50 -7.368 1.644 -1.011 1.00 0.00 H ATOM 324 H GLY B 50 -5.750 -0.337 0.572 1.00 0.00 H ATOM 325 N TRP B 51 -4.272 2.491 -0.702 1.00 31.67 N ATOM 326 CA TRP B 51 -3.052 2.918 -1.413 1.00 32.27 C ATOM 327 C TRP B 51 -2.326 1.723 -2.001 1.00 32.38 C ATOM 328 O TRP B 51 -2.475 0.654 -1.480 1.00 33.75 O ATOM 329 CB TRP B 51 -2.089 3.712 -0.489 1.00 31.70 C ATOM 330 CG TRP B 51 -2.627 5.086 -0.059 1.00 32.36 C ATOM 331 CD1 TRP B 51 -3.377 5.367 1.040 1.00 31.85 C ATOM 332 CD2 TRP B 51 -2.432 6.341 -0.739 1.00 31.93 C ATOM 333 NE1 TRP B 51 -3.657 6.707 1.087 1.00 32.97 N ATOM 334 CE2 TRP B 51 -3.089 7.327 0.011 1.00 32.03 C ATOM 335 CE3 TRP B 51 -1.768 6.716 -1.916 1.00 32.03 C ATOM 336 CZ2 TRP B 51 -3.102 8.684 -0.366 1.00 33.47 C ATOM 337 CZ3 TRP B 51 -1.758 8.065 -2.287 1.00 32.39 C ATOM 338 CH2 TRP B 51 -2.436 9.034 -1.514 1.00 31.09 C ATOM 339 HA TRP B 51 -3.370 3.580 -2.219 1.00 0.00 H ATOM 340 HB2 TRP B 51 -1.907 3.119 0.407 1.00 0.00 H ATOM 341 HB3 TRP B 51 -1.150 3.862 -1.021 1.00 0.00 H ATOM 342 HE1 TRP B 51 -4.204 7.170 1.813 1.00 0.00 H ATOM 343 HD1 TRP B 51 -3.707 4.633 1.776 1.00 0.00 H ATOM 344 HZ2 TRP B 51 -3.623 9.431 0.233 1.00 0.00 H ATOM 345 HH2 TRP B 51 -2.430 10.076 -1.834 1.00 0.00 H ATOM 346 HZ3 TRP B 51 -1.220 8.372 -3.184 1.00 0.00 H ATOM 347 HE3 TRP B 51 -1.268 5.969 -2.532 1.00 0.00 H ATOM 348 H TRP B 51 -4.346 2.663 0.301 1.00 0.00 H ATOM 349 N GLU B 52 -1.490 1.912 -3.030 1.00 32.61 N ATOM 350 CA GLU B 52 -0.727 0.795 -3.642 1.00 31.93 C ATOM 351 C GLU B 52 0.527 1.271 -4.296 1.00 31.52 C ATOM 352 O GLU B 52 0.483 2.211 -5.067 1.00 32.54 O ATOM 353 CB GLU B 52 -1.558 0.098 -4.725 1.00 32.14 C ATOM 354 CG GLU B 52 -0.781 -1.054 -5.439 1.00 33.65 C ATOM 355 HA GLU B 52 -0.487 0.110 -2.828 1.00 0.00 H ATOM 356 HB2 GLU B 52 -2.453 -0.320 -4.263 1.00 0.00 H ATOM 357 HB3 GLU B 52 -1.848 0.838 -5.471 1.00 0.00 H ATOM 358 HG2 GLU B 52 0.112 -0.648 -5.914 1.00 0.00 H ATOM 359 HG3 GLU B 52 -0.493 -1.806 -4.704 1.00 0.00 H ATOM 360 H GLU B 52 -1.374 2.853 -3.405 1.00 0.00 H ATOM 361 N GLU B 53 1.656 0.643 -4.021 1.00 31.07 N ATOM 362 CA GLU B 53 2.895 1.109 -4.592 1.00 31.35 C ATOM 363 C GLU B 53 2.923 0.740 -6.072 1.00 32.59 C ATOM 364 O GLU B 53 2.640 -0.399 -6.417 1.00 33.89 O ATOM 365 CB GLU B 53 4.074 0.549 -3.846 1.00 30.71 C ATOM 366 CG GLU B 53 5.363 1.187 -4.186 1.00 31.01 C ATOM 367 CD GLU B 53 6.469 0.727 -3.307 1.00 35.07 C ATOM 368 OE1 GLU B 53 6.168 0.161 -2.213 1.00 38.94 O ATOM 369 OE2 GLU B 53 7.645 0.955 -3.673 1.00 34.51 O ATOM 370 HA GLU B 53 2.961 2.193 -4.502 1.00 0.00 H ATOM 371 HB2 GLU B 53 3.898 0.681 -2.778 1.00 0.00 H ATOM 372 HB3 GLU B 53 4.148 -0.515 -4.072 1.00 0.00 H ATOM 373 HG2 GLU B 53 5.612 0.945 -5.219 1.00 0.00 H ATOM 374 HG3 GLU B 53 5.258 2.267 -4.082 1.00 0.00 H ATOM 375 H GLU B 53 1.651 -0.170 -3.406 1.00 0.00 H ATOM 376 N VAL B 54 3.189 1.712 -6.948 1.00 33.16 N ATOM 377 CA VAL B 54 3.127 1.515 -8.414 1.00 33.16 C ATOM 378 C VAL B 54 4.306 2.293 -8.924 1.00 33.65 C ATOM 379 O VAL B 54 4.707 3.261 -8.273 1.00 34.17 O ATOM 380 CB VAL B 54 1.793 2.028 -8.989 1.00 33.62 C ATOM 381 CG1 VAL B 54 1.754 1.947 -10.521 1.00 35.20 C ATOM 382 CG2 VAL B 54 0.673 1.203 -8.460 1.00 32.84 C ATOM 383 HA VAL B 54 3.169 0.467 -8.710 1.00 0.00 H ATOM 384 HB VAL B 54 1.695 3.072 -8.690 1.00 0.00 H ATOM 385 HG11 VAL B 54 2.559 2.554 -10.936 1.00 0.00 H ATOM 386 HG12 VAL B 54 1.882 0.910 -10.832 1.00 0.00 H ATOM 387 HG13 VAL B 54 0.794 2.320 -10.879 1.00 0.00 H ATOM 388 HG21 VAL B 54 0.819 0.163 -8.753 1.00 0.00 H ATOM 389 HG22 VAL B 54 0.652 1.276 -7.373 1.00 0.00 H ATOM 390 HG23 VAL B 54 -0.270 1.568 -8.868 1.00 0.00 H ATOM 391 H VAL B 54 3.447 2.632 -6.591 1.00 0.00 H ATOM 392 N SER B 55 4.953 1.848 -10.002 1.00 33.35 N ATOM 393 CA SER B 55 6.026 2.677 -10.582 1.00 32.79 C ATOM 394 C SER B 55 5.344 3.874 -11.330 1.00 31.62 C ATOM 395 O SER B 55 4.193 3.811 -11.751 1.00 30.08 O ATOM 396 CB SER B 55 6.962 1.886 -11.510 1.00 32.48 C ATOM 397 OG SER B 55 6.224 1.283 -12.554 1.00 32.95 O ATOM 398 HA SER B 55 6.670 3.041 -9.782 1.00 0.00 H ATOM 399 HB2 SER B 55 7.469 1.112 -10.934 1.00 0.00 H ATOM 400 HB3 SER B 55 7.702 2.563 -11.937 1.00 0.00 H ATOM 401 HG SER B 55 6.821 0.793 -13.125 1.00 0.00 H ATOM 402 H SER B 55 4.710 0.949 -10.418 1.00 0.00 H ATOM 403 N GLY B 56 6.038 4.987 -11.440 1.00 30.51 N ATOM 404 CA GLY B 56 5.410 6.132 -12.089 1.00 30.33 C ATOM 405 C GLY B 56 6.427 7.153 -12.465 1.00 29.73 C ATOM 406 O GLY B 56 7.616 7.030 -12.116 1.00 29.91 O ATOM 407 HA3 GLY B 56 4.690 6.580 -11.404 1.00 0.00 H ATOM 408 HA2 GLY B 56 4.894 5.794 -12.988 1.00 0.00 H ATOM 409 H GLY B 56 6.991 5.047 -11.081 1.00 0.00 H ATOM 410 N TYR B 57 5.957 8.167 -13.170 1.00 29.22 N ATOM 411 CA TYR B 57 6.817 9.255 -13.581 1.00 28.98 C ATOM 412 C TYR B 57 6.855 10.407 -12.582 1.00 29.57 C ATOM 413 O TYR B 57 5.869 10.801 -11.987 1.00 27.61 O ATOM 414 CB TYR B 57 6.337 9.795 -14.914 1.00 28.96 C ATOM 415 CG TYR B 57 6.225 8.744 -15.999 1.00 28.31 C ATOM 416 CD1 TYR B 57 7.336 8.026 -16.418 1.00 27.62 C ATOM 417 CD2 TYR B 57 5.004 8.488 -16.618 1.00 25.98 C ATOM 418 CE1 TYR B 57 7.234 7.047 -17.431 1.00 28.01 C ATOM 419 CE2 TYR B 57 4.901 7.530 -17.595 1.00 28.53 C ATOM 420 CZ TYR B 57 6.023 6.833 -18.011 1.00 27.93 C ATOM 421 OH TYR B 57 5.857 5.893 -18.964 1.00 30.00 O ATOM 422 HA TYR B 57 7.825 8.846 -13.649 1.00 0.00 H ATOM 423 HB3 TYR B 57 7.039 10.559 -15.248 1.00 0.00 H ATOM 424 HB2 TYR B 57 5.355 10.244 -14.769 1.00 0.00 H ATOM 425 HD2 TYR B 57 4.121 9.055 -16.323 1.00 0.00 H ATOM 426 HE2 TYR B 57 3.932 7.317 -18.046 1.00 0.00 H ATOM 427 HE1 TYR B 57 8.108 6.475 -17.741 1.00 0.00 H ATOM 428 HD1 TYR B 57 8.304 8.221 -15.957 1.00 0.00 H ATOM 429 HH TYR B 57 6.704 5.486 -19.162 1.00 0.00 H ATOM 430 H TYR B 57 4.971 8.183 -13.429 1.00 0.00 H ATOM 431 N ASP B 58 8.027 10.984 -12.450 1.00 31.52 N ATOM 432 CA ASP B 58 8.158 12.343 -11.938 1.00 32.81 C ATOM 433 C ASP B 58 8.268 13.155 -13.203 1.00 34.34 C ATOM 434 O ASP B 58 7.647 12.784 -14.230 1.00 33.69 O ATOM 435 CB ASP B 58 9.480 12.415 -11.189 1.00 32.19 C ATOM 436 CG ASP B 58 10.668 12.359 -12.102 1.00 33.83 C ATOM 437 OD1 ASP B 58 10.491 12.172 -13.342 1.00 35.11 O ATOM 438 OD2 ASP B 58 11.789 12.519 -11.591 1.00 34.80 O ATOM 439 HA ASP B 58 7.353 12.670 -11.279 1.00 0.00 H ATOM 440 HB2 ASP B 58 9.514 13.350 -10.630 1.00 0.00 H ATOM 441 HB3 ASP B 58 9.534 11.576 -10.495 1.00 0.00 H ATOM 442 H ASP B 58 8.867 10.469 -12.712 1.00 0.00 H ATOM 443 N GLU B 59 8.832 14.343 -13.056 1.00 36.20 N ATOM 444 CA GLU B 59 8.318 15.543 -13.693 1.00 36.69 C ATOM 445 C GLU B 59 9.061 15.566 -14.978 1.00 36.64 C ATOM 446 O GLU B 59 8.604 16.060 -15.962 1.00 37.13 O ATOM 447 CB GLU B 59 8.721 16.785 -12.896 1.00 36.67 C ATOM 448 CG GLU B 59 7.866 17.077 -11.690 1.00 39.16 C ATOM 449 CD GLU B 59 8.201 18.353 -11.002 1.00 38.08 C ATOM 450 OE1 GLU B 59 9.368 18.662 -10.889 1.00 44.93 O ATOM 451 OE2 GLU B 59 7.303 19.071 -10.601 1.00 42.12 O ATOM 452 HA GLU B 59 7.232 15.542 -13.784 1.00 0.00 H ATOM 453 HB2 GLU B 59 9.748 16.650 -12.557 1.00 0.00 H ATOM 454 HB3 GLU B 59 8.670 17.646 -13.563 1.00 0.00 H ATOM 455 HG2 GLU B 59 6.825 17.124 -12.011 1.00 0.00 H ATOM 456 HG3 GLU B 59 7.989 16.261 -10.978 1.00 0.00 H ATOM 457 H GLU B 59 9.663 14.419 -12.470 1.00 0.00 H ATOM 458 N ASN B 60 10.234 14.955 -14.916 1.00 20.00 N ATOM 459 CA ASN B 60 11.135 14.712 -16.024 1.00 20.00 C ATOM 460 C ASN B 60 10.999 13.329 -16.609 1.00 20.00 C ATOM 461 O ASN B 60 11.912 12.854 -17.190 1.00 33.52 O ATOM 462 CB ASN B 60 12.574 14.794 -15.550 1.00 20.00 C ATOM 463 CG ASN B 60 12.870 16.038 -14.838 1.00 20.00 C ATOM 464 OD1 ASN B 60 12.804 17.080 -15.399 1.00 20.00 O ATOM 465 ND2 ASN B 60 13.200 15.938 -13.589 1.00 20.00 N ATOM 466 HA ASN B 60 10.879 15.465 -16.770 1.00 0.00 H ATOM 467 HB2 ASN B 60 12.768 13.956 -14.881 1.00 0.00 H ATOM 468 HB3 ASN B 60 13.231 14.725 -16.417 1.00 0.00 H ATOM 469 HD22 ASN B 60 13.245 15.021 -13.145 1.00 0.00 H ATOM 470 HD21 ASN B 60 13.415 16.777 -13.050 1.00 0.00 H ATOM 471 H ASN B 60 10.532 14.623 -13.999 1.00 0.00 H ATOM 472 N MET B 61 9.888 12.666 -16.386 1.00 34.52 N ATOM 473 CA MET B 61 9.681 11.331 -16.948 1.00 34.72 C ATOM 474 C MET B 61 10.736 10.278 -16.533 1.00 34.57 C ATOM 475 O MET B 61 10.961 9.304 -17.268 1.00 34.26 O ATOM 476 CB MET B 61 9.627 11.408 -18.502 1.00 34.60 C ATOM 477 CG MET B 61 8.539 12.290 -19.044 1.00 33.52 C ATOM 478 SD MET B 61 6.933 11.921 -18.400 1.00 32.75 S ATOM 479 CE MET B 61 6.428 10.463 -19.352 1.00 32.97 C ATOM 480 HA MET B 61 8.732 10.993 -16.532 1.00 0.00 H ATOM 481 HB2 MET B 61 10.584 11.790 -18.858 1.00 0.00 H ATOM 482 HB3 MET B 61 9.473 10.400 -18.888 1.00 0.00 H ATOM 483 HG2 MET B 61 8.510 12.174 -20.127 1.00 0.00 H ATOM 484 HG3 MET B 61 8.779 13.324 -18.797 1.00 0.00 H ATOM 485 HE1 MET B 61 6.405 10.713 -20.413 1.00 0.00 H ATOM 486 HE2 MET B 61 7.141 9.656 -19.183 1.00 0.00 H ATOM 487 HE3 MET B 61 5.436 10.146 -19.030 1.00 0.00 H ATOM 488 H MET B 61 9.158 13.088 -15.812 1.00 0.00 H ATOM 489 N ASN B 62 11.405 10.473 -15.398 1.00 34.39 N ATOM 490 CA ASN B 62 12.179 9.391 -14.825 1.00 34.78 C ATOM 491 C ASN B 62 11.183 8.542 -14.089 1.00 34.17 C ATOM 492 O ASN B 62 10.224 9.038 -13.560 1.00 34.27 O ATOM 493 CB ASN B 62 13.209 9.842 -13.806 1.00 35.17 C ATOM 494 CG ASN B 62 14.128 10.872 -14.327 1.00 37.07 C ATOM 495 OD1 ASN B 62 14.980 10.604 -15.178 1.00 40.00 O ATOM 496 ND2 ASN B 62 13.979 12.089 -13.809 1.00 40.20 N ATOM 497 HA ASN B 62 12.722 8.890 -15.627 1.00 0.00 H ATOM 498 HB2 ASN B 62 12.686 10.249 -12.941 1.00 0.00 H ATOM 499 HB3 ASN B 62 13.796 8.976 -13.500 1.00 0.00 H ATOM 500 HD22 ASN B 62 13.259 12.260 -13.107 1.00 0.00 H ATOM 501 HD21 ASN B 62 14.585 12.851 -14.114 1.00 0.00 H ATOM 502 H ASN B 62 11.372 11.381 -14.934 1.00 0.00 H ATOM 503 N THR B 63 11.434 7.256 -14.000 1.00 34.29 N ATOM 504 CA THR B 63 10.485 6.383 -13.326 1.00 33.83 C ATOM 505 C THR B 63 10.877 5.869 -11.933 1.00 33.56 C ATOM 506 O THR B 63 12.032 5.529 -11.732 1.00 33.72 O ATOM 507 CB THR B 63 10.337 5.041 -14.200 1.00 33.40 C ATOM 508 OG1 THR B 63 9.554 5.257 -15.380 1.00 31.08 O ATOM 509 CG2 THR B 63 9.725 3.903 -13.416 1.00 33.63 C ATOM 510 HA THR B 63 9.596 7.004 -13.217 1.00 0.00 H ATOM 511 HB THR B 63 11.353 4.766 -14.482 1.00 0.00 H ATOM 512 HG1 THR B 63 9.488 4.436 -15.874 1.00 0.00 H ATOM 513 HG23 THR B 63 10.312 3.728 -12.514 1.00 0.00 H ATOM 514 HG21 THR B 63 8.702 4.161 -13.141 1.00 0.00 H ATOM 515 HG22 THR B 63 9.721 3.002 -14.029 1.00 0.00 H ATOM 516 H THR B 63 12.289 6.871 -14.401 1.00 0.00 H ATOM 517 N ILE B 64 9.961 5.848 -10.951 1.00 33.40 N ATOM 518 CA ILE B 64 10.171 6.160 -9.510 1.00 32.91 C ATOM 519 C ILE B 64 9.032 5.377 -8.786 1.00 32.11 C ATOM 520 O ILE B 64 8.038 4.972 -9.410 1.00 31.20 O ATOM 521 CB ILE B 64 10.387 7.646 -8.981 1.00 32.40 C ATOM 522 CG1 ILE B 64 9.227 8.573 -9.291 1.00 33.91 C ATOM 523 CG2 ILE B 64 11.761 8.178 -9.394 1.00 33.94 C ATOM 524 CD1 ILE B 64 9.357 9.873 -8.501 1.00 34.15 C ATOM 525 HA ILE B 64 11.189 5.852 -9.273 1.00 0.00 H ATOM 526 HB ILE B 64 10.390 7.612 -7.892 1.00 0.00 H ATOM 527 HG12 ILE B 64 9.223 8.799 -10.357 1.00 0.00 H ATOM 528 HG13 ILE B 64 8.292 8.081 -9.022 1.00 0.00 H ATOM 529 HD11 ILE B 64 9.358 9.650 -7.434 1.00 0.00 H ATOM 530 HD12 ILE B 64 10.290 10.369 -8.771 1.00 0.00 H ATOM 531 HD13 ILE B 64 8.516 10.525 -8.736 1.00 0.00 H ATOM 532 HG21 ILE B 64 12.538 7.539 -8.974 1.00 0.00 H ATOM 533 HG22 ILE B 64 11.837 8.178 -10.481 1.00 0.00 H ATOM 534 HG23 ILE B 64 11.883 9.195 -9.020 1.00 0.00 H ATOM 535 H ILE B 64 9.013 5.589 -11.223 1.00 0.00 H ATOM 536 N ARG B 65 9.205 5.115 -7.492 1.00 31.90 N ATOM 537 CA ARG B 65 8.143 4.509 -6.687 1.00 31.72 C ATOM 538 C ARG B 65 7.116 5.566 -6.249 1.00 30.18 C ATOM 539 O ARG B 65 7.473 6.616 -5.733 1.00 30.56 O ATOM 540 CB ARG B 65 8.725 3.774 -5.447 1.00 32.63 C ATOM 541 CG ARG B 65 9.835 2.716 -5.748 1.00 35.85 C ATOM 542 CD ARG B 65 9.410 1.766 -6.892 1.00 38.37 C ATOM 543 NE ARG B 65 8.306 0.880 -6.504 1.00 40.32 N ATOM 544 CZ ARG B 65 7.604 0.136 -7.357 1.00 40.70 C ATOM 545 NH1 ARG B 65 7.858 0.161 -8.644 1.00 42.78 N ATOM 546 NH2 ARG B 65 6.648 -0.650 -6.922 1.00 41.86 N ATOM 547 HA ARG B 65 7.637 3.772 -7.311 1.00 0.00 H ATOM 548 HB2 ARG B 65 9.149 4.525 -4.780 1.00 0.00 H ATOM 549 HB3 ARG B 65 7.904 3.265 -4.943 1.00 0.00 H ATOM 550 HG2 ARG B 65 10.750 3.233 -6.037 1.00 0.00 H ATOM 551 HG3 ARG B 65 10.020 2.129 -4.848 1.00 0.00 H ATOM 552 HD2 ARG B 65 10.267 1.155 -7.176 1.00 0.00 H ATOM 553 HD3 ARG B 65 9.094 2.365 -7.746 1.00 0.00 H ATOM 554 HE ARG B 65 8.060 0.831 -5.515 1.00 0.00 H ATOM 555 HH12 ARG B 65 7.310 -0.415 -9.283 1.00 0.00 H ATOM 556 HH11 ARG B 65 8.603 0.757 -9.005 1.00 0.00 H ATOM 557 HH22 ARG B 65 6.114 -1.217 -7.581 1.00 0.00 H ATOM 558 HH21 ARG B 65 6.438 -0.694 -5.925 1.00 0.00 H ATOM 559 H ARG B 65 10.097 5.341 -7.052 1.00 0.00 H ATOM 560 N THR B 66 5.849 5.258 -6.442 1.00 27.95 N ATOM 561 CA THR B 66 4.792 6.133 -6.127 1.00 27.92 C ATOM 562 C THR B 66 3.686 5.288 -5.454 1.00 28.38 C ATOM 563 O THR B 66 3.759 4.074 -5.480 1.00 28.11 O ATOM 564 CB THR B 66 4.196 6.774 -7.398 1.00 27.90 C ATOM 565 OG1 THR B 66 3.562 5.758 -8.141 1.00 27.64 O ATOM 566 CG2 THR B 66 5.241 7.446 -8.289 1.00 26.61 C ATOM 567 HA THR B 66 5.163 6.928 -5.480 1.00 0.00 H ATOM 568 HB THR B 66 3.503 7.552 -7.078 1.00 0.00 H ATOM 569 HG1 THR B 66 4.206 5.087 -8.378 1.00 0.00 H ATOM 570 HG23 THR B 66 5.741 8.236 -7.728 1.00 0.00 H ATOM 571 HG21 THR B 66 5.974 6.706 -8.609 1.00 0.00 H ATOM 572 HG22 THR B 66 4.750 7.874 -9.163 1.00 0.00 H ATOM 573 H THR B 66 5.624 4.345 -6.837 1.00 0.00 H ATOM 574 N TYR B 67 2.680 5.953 -4.867 1.00 27.71 N ATOM 575 CA TYR B 67 1.548 5.314 -4.256 1.00 27.51 C ATOM 576 C TYR B 67 0.335 5.910 -4.869 1.00 27.74 C ATOM 577 O TYR B 67 0.250 7.099 -4.888 1.00 28.05 O ATOM 578 CB TYR B 67 1.557 5.517 -2.722 1.00 27.62 C ATOM 579 CG TYR B 67 2.475 4.538 -2.004 1.00 26.77 C ATOM 580 CD1 TYR B 67 2.034 3.236 -1.711 1.00 27.04 C ATOM 581 CD2 TYR B 67 3.774 4.877 -1.671 1.00 25.77 C ATOM 582 CE1 TYR B 67 2.829 2.312 -1.045 1.00 23.76 C ATOM 583 CE2 TYR B 67 4.608 3.939 -1.008 1.00 29.21 C ATOM 584 CZ TYR B 67 4.107 2.645 -0.730 1.00 27.46 C ATOM 585 OH TYR B 67 4.884 1.699 -0.112 1.00 29.55 O ATOM 586 HA TYR B 67 1.574 4.237 -4.424 1.00 0.00 H ATOM 587 HB3 TYR B 67 0.542 5.383 -2.347 1.00 0.00 H ATOM 588 HB2 TYR B 67 1.892 6.532 -2.506 1.00 0.00 H ATOM 589 HD2 TYR B 67 4.158 5.867 -1.918 1.00 0.00 H ATOM 590 HE2 TYR B 67 5.622 4.212 -0.717 1.00 0.00 H ATOM 591 HE1 TYR B 67 2.432 1.332 -0.779 1.00 0.00 H ATOM 592 HD1 TYR B 67 1.031 2.940 -2.018 1.00 0.00 H ATOM 593 HH TYR B 67 5.661 1.525 -0.648 1.00 0.00 H ATOM 594 H TYR B 67 2.721 6.972 -4.854 1.00 0.00 H ATOM 595 N GLN B 68 -0.577 5.077 -5.394 1.00 28.49 N ATOM 596 CA GLN B 68 -1.882 5.499 -5.854 1.00 29.73 C ATOM 597 C GLN B 68 -3.019 4.889 -5.069 1.00 29.51 C ATOM 598 O GLN B 68 -2.879 3.833 -4.417 1.00 31.38 O ATOM 599 CB GLN B 68 -2.135 5.070 -7.307 1.00 30.02 C ATOM 600 CG GLN B 68 -0.960 5.227 -8.217 1.00 32.34 C ATOM 601 CD GLN B 68 -1.325 4.985 -9.688 1.00 31.68 C ATOM 602 OE1 GLN B 68 -0.509 5.220 -10.560 1.00 34.03 O ATOM 603 NE2 GLN B 68 -2.539 4.510 -9.954 1.00 33.30 N ATOM 604 HA GLN B 68 -1.865 6.582 -5.734 1.00 0.00 H ATOM 605 HB2 GLN B 68 -2.426 4.020 -7.306 1.00 0.00 H ATOM 606 HB3 GLN B 68 -2.954 5.672 -7.702 1.00 0.00 H ATOM 607 HG2 GLN B 68 -0.570 6.240 -8.114 1.00 0.00 H ATOM 608 HG3 GLN B 68 -0.192 4.512 -7.924 1.00 0.00 H ATOM 609 HE22 GLN B 68 -3.193 4.327 -9.193 1.00 0.00 H ATOM 610 HE21 GLN B 68 -2.816 4.329 -10.919 1.00 0.00 H ATOM 611 H GLN B 68 -0.336 4.089 -5.473 1.00 0.00 H ATOM 612 N VAL B 69 -4.172 5.510 -5.231 1.00 28.34 N ATOM 613 CA VAL B 69 -5.378 5.113 -4.568 1.00 28.17 C ATOM 614 C VAL B 69 -6.452 5.712 -5.430 1.00 28.59 C ATOM 615 O VAL B 69 -6.381 6.899 -5.800 1.00 28.99 O ATOM 616 CB VAL B 69 -5.493 5.628 -3.094 1.00 28.17 C ATOM 617 CG1 VAL B 69 -5.651 7.132 -3.010 1.00 26.95 C ATOM 618 CG2 VAL B 69 -6.658 4.989 -2.400 1.00 28.90 C ATOM 619 HA VAL B 69 -5.436 4.029 -4.465 1.00 0.00 H ATOM 620 HB VAL B 69 -4.559 5.353 -2.605 1.00 0.00 H ATOM 621 HG11 VAL B 69 -4.785 7.613 -3.465 1.00 0.00 H ATOM 622 HG12 VAL B 69 -6.555 7.431 -3.540 1.00 0.00 H ATOM 623 HG13 VAL B 69 -5.726 7.430 -1.964 1.00 0.00 H ATOM 624 HG21 VAL B 69 -7.576 5.235 -2.933 1.00 0.00 H ATOM 625 HG22 VAL B 69 -6.523 3.907 -2.387 1.00 0.00 H ATOM 626 HG23 VAL B 69 -6.719 5.361 -1.377 1.00 0.00 H ATOM 627 H VAL B 69 -4.206 6.313 -5.860 1.00 0.00 H ATOM 628 N CYS B 70 -7.422 4.891 -5.818 1.00 28.46 N ATOM 629 CA CYS B 70 -8.496 5.383 -6.624 1.00 28.27 C ATOM 630 C CYS B 70 -9.698 4.519 -6.462 1.00 28.45 C ATOM 631 O CYS B 70 -10.127 3.856 -7.413 1.00 29.38 O ATOM 632 CB CYS B 70 -8.088 5.456 -8.094 1.00 28.57 C ATOM 633 SG CYS B 70 -9.453 6.229 -9.088 1.00 27.87 S ATOM 634 HA CYS B 70 -8.739 6.392 -6.290 1.00 0.00 H ATOM 635 HB2 CYS B 70 -7.894 4.450 -8.466 1.00 0.00 H ATOM 636 HB3 CYS B 70 -7.185 6.058 -8.190 1.00 0.00 H ATOM 637 H CYS B 70 -7.401 3.910 -5.541 1.00 0.00 H ATOM 638 N ASN B 71 -10.241 4.529 -5.255 1.00 28.59 N ATOM 639 CA ASN B 71 -11.398 3.688 -4.905 1.00 29.09 C ATOM 640 C ASN B 71 -12.697 4.471 -4.978 1.00 28.84 C ATOM 641 O ASN B 71 -13.528 4.450 -4.073 1.00 27.61 O ATOM 642 CB ASN B 71 -11.252 3.057 -3.517 1.00 28.89 C ATOM 643 CG ASN B 71 -10.106 2.061 -3.418 1.00 29.94 C ATOM 644 OD1 ASN B 71 -9.460 1.704 -4.405 1.00 31.53 O ATOM 645 ND2 ASN B 71 -9.812 1.645 -2.187 1.00 27.13 N ATOM 646 HA ASN B 71 -11.428 2.886 -5.642 1.00 0.00 H ATOM 647 HB2 ASN B 71 -11.081 3.853 -2.793 1.00 0.00 H ATOM 648 HB3 ASN B 71 -12.180 2.540 -3.274 1.00 0.00 H ATOM 649 HD22 ASN B 71 -10.370 1.963 -1.394 1.00 0.00 H ATOM 650 HD21 ASN B 71 -9.029 1.009 -2.037 1.00 0.00 H ATOM 651 H ASN B 71 -9.844 5.141 -4.542 1.00 0.00 H ATOM 652 N VAL B 72 -12.912 5.105 -6.114 1.00 29.94 N ATOM 653 CA VAL B 72 -14.087 5.967 -6.282 1.00 30.76 C ATOM 654 C VAL B 72 -15.399 5.236 -6.514 1.00 32.21 C ATOM 655 O VAL B 72 -16.458 5.844 -6.552 1.00 33.53 O ATOM 656 CB VAL B 72 -13.889 6.948 -7.417 1.00 30.94 C ATOM 657 CG1 VAL B 72 -12.683 7.845 -7.152 1.00 28.52 C ATOM 658 CG2 VAL B 72 -13.768 6.175 -8.794 1.00 32.76 C ATOM 659 HA VAL B 72 -14.170 6.478 -5.323 1.00 0.00 H ATOM 660 HB VAL B 72 -14.761 7.598 -7.481 1.00 0.00 H ATOM 661 HG11 VAL B 72 -12.842 8.402 -6.229 1.00 0.00 H ATOM 662 HG12 VAL B 72 -11.788 7.230 -7.058 1.00 0.00 H ATOM 663 HG13 VAL B 72 -12.561 8.542 -7.981 1.00 0.00 H ATOM 664 HG21 VAL B 72 -12.915 5.497 -8.755 1.00 0.00 H ATOM 665 HG22 VAL B 72 -14.680 5.604 -8.970 1.00 0.00 H ATOM 666 HG23 VAL B 72 -13.626 6.893 -9.601 1.00 0.00 H ATOM 667 H VAL B 72 -12.253 4.995 -6.885 1.00 0.00 H ATOM 668 N PHE B 73 -15.388 3.929 -6.657 1.00 34.47 N ATOM 669 CA PHE B 73 -16.688 3.231 -6.839 1.00 35.48 C ATOM 670 C PHE B 73 -17.092 2.432 -5.613 1.00 36.77 C ATOM 671 O PHE B 73 -17.949 1.582 -5.694 1.00 37.19 O ATOM 672 CB PHE B 73 -16.646 2.353 -8.051 1.00 34.40 C ATOM 673 CG PHE B 73 -16.566 3.105 -9.342 1.00 33.56 C ATOM 674 CD1 PHE B 73 -17.668 3.747 -9.854 1.00 31.66 C ATOM 675 CD2 PHE B 73 -15.402 3.121 -10.075 1.00 32.40 C ATOM 676 CE1 PHE B 73 -17.599 4.401 -11.070 1.00 31.91 C ATOM 677 CE2 PHE B 73 -15.350 3.788 -11.306 1.00 33.62 C ATOM 678 CZ PHE B 73 -16.463 4.411 -11.786 1.00 30.94 C ATOM 679 HA PHE B 73 -17.448 3.999 -6.983 1.00 0.00 H ATOM 680 HB2 PHE B 73 -15.772 1.705 -7.976 1.00 0.00 H ATOM 681 HB3 PHE B 73 -17.549 1.743 -8.064 1.00 0.00 H ATOM 682 HD2 PHE B 73 -14.516 2.612 -9.696 1.00 0.00 H ATOM 683 HE2 PHE B 73 -14.422 3.809 -11.878 1.00 0.00 H ATOM 684 HZ PHE B 73 -16.431 4.917 -12.751 1.00 0.00 H ATOM 685 HE1 PHE B 73 -18.480 4.916 -11.453 1.00 0.00 H ATOM 686 HD1 PHE B 73 -18.605 3.740 -9.296 1.00 0.00 H ATOM 687 H PHE B 73 -14.511 3.408 -6.643 1.00 0.00 H ATOM 688 N GLU B 74 -16.497 2.787 -4.476 1.00 38.69 N ATOM 689 CA GLU B 74 -16.573 2.029 -3.232 1.00 40.35 C ATOM 690 C GLU B 74 -16.741 3.044 -2.116 1.00 41.17 C ATOM 691 O GLU B 74 -15.888 3.925 -1.962 1.00 42.91 O ATOM 692 CB GLU B 74 -15.279 1.210 -3.045 1.00 40.22 C ATOM 693 CG GLU B 74 -15.499 -0.176 -2.490 1.00 41.92 C ATOM 694 HA GLU B 74 -17.406 1.327 -3.236 1.00 0.00 H ATOM 695 HB2 GLU B 74 -14.790 1.117 -4.015 1.00 0.00 H ATOM 696 HB3 GLU B 74 -14.626 1.753 -2.361 1.00 0.00 H ATOM 697 HG2 GLU B 74 -15.976 -0.103 -1.513 1.00 0.00 H ATOM 698 HG3 GLU B 74 -16.140 -0.740 -3.168 1.00 0.00 H ATOM 699 H GLU B 74 -15.950 3.648 -4.475 1.00 0.00 H ATOM 700 N SER B 75 -17.825 2.941 -1.344 1.00 41.76 N ATOM 701 CA SER B 75 -18.077 3.886 -0.251 1.00 42.05 C ATOM 702 C SER B 75 -17.223 3.640 1.029 1.00 42.19 C ATOM 703 O SER B 75 -16.453 2.662 1.136 1.00 42.91 O ATOM 704 CB SER B 75 -19.544 3.862 0.095 1.00 41.80 C ATOM 705 OG SER B 75 -19.862 2.571 0.534 1.00 43.04 O ATOM 706 HA SER B 75 -17.773 4.867 -0.617 1.00 0.00 H ATOM 707 HB2 SER B 75 -20.137 4.110 -0.785 1.00 0.00 H ATOM 708 HB3 SER B 75 -19.750 4.584 0.886 1.00 0.00 H ATOM 709 HG SER B 75 -20.794 2.532 0.761 1.00 0.00 H ATOM 710 H SER B 75 -18.492 2.189 -1.518 1.00 0.00 H ATOM 711 N SER B 76 -17.354 4.568 1.972 1.00 41.77 N ATOM 712 CA SER B 76 -16.699 4.510 3.274 1.00 41.37 C ATOM 713 C SER B 76 -15.202 4.437 3.140 1.00 40.55 C ATOM 714 O SER B 76 -14.551 3.664 3.855 1.00 41.83 O ATOM 715 CB SER B 76 -17.221 3.311 4.107 1.00 41.66 C ATOM 716 OG SER B 76 -18.630 3.391 4.297 1.00 43.24 O ATOM 717 HA SER B 76 -16.946 5.433 3.799 1.00 0.00 H ATOM 718 HB2 SER B 76 -16.730 3.313 5.080 1.00 0.00 H ATOM 719 HB3 SER B 76 -16.984 2.384 3.584 1.00 0.00 H ATOM 720 HG SER B 76 -18.925 2.638 4.814 1.00 0.00 H ATOM 721 H SER B 76 -17.950 5.371 1.772 1.00 0.00 H ATOM 722 N GLN B 77 -14.628 5.222 2.236 1.00 39.10 N ATOM 723 CA GLN B 77 -13.208 5.082 1.960 1.00 37.66 C ATOM 724 C GLN B 77 -12.441 5.820 3.040 1.00 36.96 C ATOM 725 O GLN B 77 -12.753 6.978 3.338 1.00 36.57 O ATOM 726 CB GLN B 77 -12.849 5.602 0.565 1.00 37.59 C ATOM 727 CG GLN B 77 -13.151 4.606 -0.561 1.00 37.14 C ATOM 728 CD GLN B 77 -12.653 3.169 -0.261 1.00 35.10 C ATOM 729 OE1 GLN B 77 -11.465 2.874 -0.405 1.00 35.38 O ATOM 730 NE2 GLN B 77 -13.558 2.290 0.100 1.00 32.85 N ATOM 731 HA GLN B 77 -12.937 4.026 1.970 1.00 0.00 H ATOM 732 HB2 GLN B 77 -13.418 6.513 0.380 1.00 0.00 H ATOM 733 HB3 GLN B 77 -11.783 5.830 0.546 1.00 0.00 H ATOM 734 HG2 GLN B 77 -14.230 4.573 -0.714 1.00 0.00 H ATOM 735 HG3 GLN B 77 -12.667 4.957 -1.472 1.00 0.00 H ATOM 736 HE22 GLN B 77 -14.531 2.575 0.208 1.00 0.00 H ATOM 737 HE21 GLN B 77 -13.288 1.322 0.273 1.00 0.00 H ATOM 738 H GLN B 77 -15.181 5.920 1.738 1.00 0.00 H ATOM 739 N ASN B 78 -11.483 5.128 3.660 1.00 35.50 N ATOM 740 CA ASN B 78 -10.599 5.745 4.657 1.00 35.12 C ATOM 741 C ASN B 78 -9.230 5.120 4.579 1.00 34.08 C ATOM 742 O ASN B 78 -8.895 4.274 5.400 1.00 34.19 O ATOM 743 CB ASN B 78 -11.180 5.603 6.084 1.00 34.96 C ATOM 744 CG ASN B 78 -10.415 6.415 7.137 1.00 33.93 C ATOM 745 OD1 ASN B 78 -9.412 7.078 6.863 1.00 29.25 O ATOM 746 ND2 ASN B 78 -10.886 6.331 8.363 1.00 32.49 N ATOM 747 HA ASN B 78 -10.520 6.810 4.437 1.00 0.00 H ATOM 748 HB2 ASN B 78 -12.216 5.942 6.071 1.00 0.00 H ATOM 749 HB3 ASN B 78 -11.147 4.551 6.368 1.00 0.00 H ATOM 750 HD22 ASN B 78 -11.718 5.773 8.552 1.00 0.00 H ATOM 751 HD21 ASN B 78 -10.419 6.824 9.124 1.00 0.00 H ATOM 752 H ASN B 78 -11.361 4.141 3.435 1.00 0.00 H ATOM 753 N ASN B 79 -8.423 5.579 3.614 1.00 33.31 N ATOM 754 CA ASN B 79 -7.223 4.856 3.231 1.00 32.75 C ATOM 755 C ASN B 79 -5.957 5.557 3.690 1.00 31.91 C ATOM 756 O ASN B 79 -5.704 6.693 3.308 1.00 32.00 O ATOM 757 CB ASN B 79 -7.219 4.603 1.697 1.00 32.87 C ATOM 758 CG ASN B 79 -8.496 3.895 1.206 1.00 32.77 C ATOM 759 OD1 ASN B 79 -8.830 2.806 1.667 1.00 31.02 O ATOM 760 ND2 ASN B 79 -9.183 4.496 0.255 1.00 31.19 N ATOM 761 HA ASN B 79 -7.235 3.892 3.740 1.00 0.00 H ATOM 762 HB2 ASN B 79 -7.133 5.562 1.186 1.00 0.00 H ATOM 763 HB3 ASN B 79 -6.358 3.982 1.448 1.00 0.00 H ATOM 764 HD22 ASN B 79 -8.875 5.400 -0.103 1.00 0.00 H ATOM 765 HD21 ASN B 79 -10.023 4.057 -0.123 1.00 0.00 H ATOM 766 H ASN B 79 -8.655 6.452 3.140 1.00 0.00 H ATOM 767 N TRP B 80 -5.158 4.859 4.503 1.00 31.20 N ATOM 768 CA TRP B 80 -3.898 5.385 5.052 1.00 30.06 C ATOM 769 C TRP B 80 -2.695 4.734 4.427 1.00 29.65 C ATOM 770 O TRP B 80 -2.717 3.555 4.047 1.00 29.72 O ATOM 771 CB TRP B 80 -3.813 5.180 6.567 1.00 29.53 C ATOM 772 CG TRP B 80 -4.765 6.048 7.323 1.00 28.90 C ATOM 773 CD1 TRP B 80 -6.097 6.051 7.220 1.00 27.15 C ATOM 774 CD2 TRP B 80 -4.420 7.080 8.283 1.00 28.51 C ATOM 775 NE1 TRP B 80 -6.629 7.019 8.040 1.00 28.81 N ATOM 776 CE2 TRP B 80 -5.616 7.662 8.707 1.00 27.70 C ATOM 777 CE3 TRP B 80 -3.210 7.560 8.812 1.00 27.75 C ATOM 778 CZ2 TRP B 80 -5.657 8.711 9.673 1.00 29.84 C ATOM 779 CZ3 TRP B 80 -3.244 8.610 9.756 1.00 28.17 C ATOM 780 CH2 TRP B 80 -4.463 9.169 10.175 1.00 27.86 C ATOM 781 HA TRP B 80 -3.897 6.450 4.821 1.00 0.00 H ATOM 782 HB2 TRP B 80 -4.039 4.137 6.791 1.00 0.00 H ATOM 783 HB3 TRP B 80 -2.798 5.409 6.893 1.00 0.00 H ATOM 784 HE1 TRP B 80 -7.623 7.227 8.137 1.00 0.00 H ATOM 785 HD1 TRP B 80 -6.677 5.385 6.581 1.00 0.00 H ATOM 786 HZ2 TRP B 80 -6.605 9.136 10.002 1.00 0.00 H ATOM 787 HH2 TRP B 80 -4.461 9.976 10.908 1.00 0.00 H ATOM 788 HZ3 TRP B 80 -2.309 8.993 10.166 1.00 0.00 H ATOM 789 HE3 TRP B 80 -2.259 7.128 8.499 1.00 0.00 H ATOM 790 H TRP B 80 -5.436 3.911 4.756 1.00 0.00 H ATOM 791 N LEU B 81 -1.659 5.557 4.340 1.00 29.07 N ATOM 792 CA LEU B 81 -0.350 5.227 3.890 1.00 29.02 C ATOM 793 C LEU B 81 0.620 5.867 4.879 1.00 29.93 C ATOM 794 O LEU B 81 0.441 7.068 5.209 1.00 30.71 O ATOM 795 CB LEU B 81 -0.153 5.878 2.542 1.00 28.87 C ATOM 796 CG LEU B 81 1.258 5.953 2.017 1.00 27.61 C ATOM 797 CD1 LEU B 81 1.751 4.541 1.712 1.00 27.70 C ATOM 798 CD2 LEU B 81 1.239 6.851 0.765 1.00 28.56 C ATOM 799 HA LEU B 81 -0.197 4.150 3.819 1.00 0.00 H ATOM 800 HB2 LEU B 81 -0.744 5.319 1.817 1.00 0.00 H ATOM 801 HB3 LEU B 81 -0.533 6.897 2.610 1.00 0.00 H ATOM 802 HG LEU B 81 1.945 6.383 2.746 1.00 0.00 H ATOM 803 HD21 LEU B 81 0.576 6.416 0.017 1.00 0.00 H ATOM 804 HD22 LEU B 81 0.880 7.844 1.037 1.00 0.00 H ATOM 805 HD23 LEU B 81 2.248 6.927 0.359 1.00 0.00 H ATOM 806 HD11 LEU B 81 1.729 3.945 2.624 1.00 0.00 H ATOM 807 HD12 LEU B 81 1.103 4.085 0.963 1.00 0.00 H ATOM 808 HD13 LEU B 81 2.771 4.588 1.332 1.00 0.00 H ATOM 809 H LEU B 81 -1.816 6.524 4.624 1.00 0.00 H ATOM 810 N ARG B 82 1.644 5.124 5.311 1.00 29.69 N ATOM 811 CA ARG B 82 2.560 5.592 6.352 1.00 30.14 C ATOM 812 C ARG B 82 4.009 5.327 5.974 1.00 30.53 C ATOM 813 O ARG B 82 4.388 4.176 5.688 1.00 30.77 O ATOM 814 CB ARG B 82 2.261 4.876 7.687 1.00 30.22 C ATOM 815 CG ARG B 82 3.180 5.247 8.848 1.00 29.95 C ATOM 816 CD ARG B 82 2.811 4.417 10.057 1.00 31.66 C ATOM 817 NE ARG B 82 3.466 3.092 10.007 1.00 34.31 N ATOM 818 CZ ARG B 82 3.020 1.980 10.605 1.00 34.25 C ATOM 819 NH1 ARG B 82 1.891 1.977 11.307 1.00 35.43 N ATOM 820 NH2 ARG B 82 3.724 0.861 10.503 1.00 34.05 N ATOM 821 HA ARG B 82 2.411 6.666 6.459 1.00 0.00 H ATOM 822 HB2 ARG B 82 1.238 5.117 7.977 1.00 0.00 H ATOM 823 HB3 ARG B 82 2.346 3.802 7.520 1.00 0.00 H ATOM 824 HG2 ARG B 82 4.216 5.049 8.572 1.00 0.00 H ATOM 825 HG3 ARG B 82 3.064 6.305 9.082 1.00 0.00 H ATOM 826 HD2 ARG B 82 1.730 4.280 10.080 1.00 0.00 H ATOM 827 HD3 ARG B 82 3.129 4.939 10.959 1.00 0.00 H ATOM 828 HE ARG B 82 4.331 3.019 9.471 1.00 0.00 H ATOM 829 HH12 ARG B 82 1.571 1.118 11.754 1.00 0.00 H ATOM 830 HH11 ARG B 82 1.345 2.834 11.399 1.00 0.00 H ATOM 831 HH22 ARG B 82 3.394 0.008 10.954 1.00 0.00 H ATOM 832 HH21 ARG B 82 4.596 0.853 9.973 1.00 0.00 H ATOM 833 H ARG B 82 1.792 4.201 4.902 1.00 0.00 H ATOM 834 N THR B 83 4.810 6.386 5.985 1.00 30.54 N ATOM 835 CA THR B 83 6.202 6.314 5.633 1.00 31.74 C ATOM 836 C THR B 83 6.975 5.450 6.595 1.00 32.70 C ATOM 837 O THR B 83 6.481 5.019 7.621 1.00 32.98 O ATOM 838 CB THR B 83 6.867 7.702 5.687 1.00 31.89 C ATOM 839 OG1 THR B 83 6.906 8.156 7.040 1.00 32.63 O ATOM 840 CG2 THR B 83 6.126 8.726 4.824 1.00 31.49 C ATOM 841 HA THR B 83 6.228 5.899 4.625 1.00 0.00 H ATOM 842 HB THR B 83 7.878 7.604 5.290 1.00 0.00 H ATOM 843 HG1 THR B 83 7.413 7.536 7.570 1.00 0.00 H ATOM 844 HG23 THR B 83 6.098 8.377 3.792 1.00 0.00 H ATOM 845 HG21 THR B 83 5.109 8.845 5.197 1.00 0.00 H ATOM 846 HG22 THR B 83 6.646 9.683 4.871 1.00 0.00 H ATOM 847 H THR B 83 4.421 7.289 6.255 1.00 0.00 H ATOM 848 N LYS B 84 8.229 5.215 6.287 1.00 34.17 N ATOM 849 CA LYS B 84 9.084 4.608 7.288 1.00 35.89 C ATOM 850 C LYS B 84 9.407 5.691 8.339 1.00 36.04 C ATOM 851 O LYS B 84 8.945 6.836 8.236 1.00 36.25 O ATOM 852 CB LYS B 84 10.334 3.972 6.646 1.00 35.71 C ATOM 853 CG LYS B 84 9.960 2.647 5.927 1.00 37.88 C ATOM 854 CD LYS B 84 11.187 1.934 5.423 1.00 38.33 C ATOM 855 CE LYS B 84 10.840 0.601 4.792 1.00 39.92 C ATOM 856 NZ LYS B 84 11.973 0.144 3.905 1.00 42.50 N ATOM 857 HA LYS B 84 8.581 3.779 7.786 1.00 0.00 H ATOM 858 HB2 LYS B 84 10.759 4.667 5.921 1.00 0.00 H ATOM 859 HB3 LYS B 84 11.070 3.764 7.422 1.00 0.00 H ATOM 860 HG2 LYS B 84 9.434 1.998 6.628 1.00 0.00 H ATOM 861 HG3 LYS B 84 9.308 2.872 5.083 1.00 0.00 H ATOM 862 HD2 LYS B 84 11.679 2.560 4.679 1.00 0.00 H ATOM 863 HD3 LYS B 84 11.866 1.764 6.259 1.00 0.00 H ATOM 864 HE2 LYS B 84 9.934 0.708 4.196 1.00 0.00 H ATOM 865 HE3 LYS B 84 10.673 -0.138 5.576 1.00 0.00 H ATOM 866 HZ1 LYS B 84 12.128 0.835 3.171 1.00 0.00 H ATOM 867 HZ2 LYS B 84 12.821 0.043 4.463 1.00 0.00 H ATOM 868 HZ3 LYS B 84 11.733 -0.753 3.484 1.00 0.00 H ATOM 869 H LYS B 84 8.593 5.454 5.365 1.00 0.00 H ATOM 870 N PHE B 85 10.155 5.287 9.354 1.00 36.20 N ATOM 871 CA PHE B 85 10.553 6.127 10.437 1.00 36.39 C ATOM 872 C PHE B 85 11.638 7.003 9.884 1.00 35.94 C ATOM 873 O PHE B 85 12.568 6.500 9.291 1.00 36.07 O ATOM 874 CB PHE B 85 11.087 5.237 11.559 1.00 36.82 C ATOM 875 CG PHE B 85 11.640 5.970 12.757 1.00 35.88 C ATOM 876 CD1 PHE B 85 10.788 6.564 13.680 1.00 38.27 C ATOM 877 CD2 PHE B 85 12.999 5.938 13.028 1.00 36.73 C ATOM 878 CE1 PHE B 85 11.285 7.179 14.833 1.00 38.15 C ATOM 879 CE2 PHE B 85 13.527 6.542 14.184 1.00 39.77 C ATOM 880 CZ PHE B 85 12.658 7.174 15.087 1.00 38.54 C ATOM 881 HA PHE B 85 9.739 6.729 10.840 1.00 0.00 H ATOM 882 HB2 PHE B 85 10.271 4.600 11.901 1.00 0.00 H ATOM 883 HB3 PHE B 85 11.883 4.616 11.147 1.00 0.00 H ATOM 884 HD2 PHE B 85 13.671 5.436 12.333 1.00 0.00 H ATOM 885 HE2 PHE B 85 14.600 6.519 14.376 1.00 0.00 H ATOM 886 HZ PHE B 85 13.052 7.658 15.981 1.00 0.00 H ATOM 887 HE1 PHE B 85 10.602 7.661 15.532 1.00 0.00 H ATOM 888 HD1 PHE B 85 9.713 6.550 13.502 1.00 0.00 H ATOM 889 H PHE B 85 10.466 4.316 9.362 1.00 0.00 H ATOM 890 N ILE B 86 11.494 8.307 10.089 1.00 35.87 N ATOM 891 CA ILE B 86 12.434 9.326 9.651 1.00 35.84 C ATOM 892 C ILE B 86 13.188 9.883 10.869 1.00 36.75 C ATOM 893 O ILE B 86 12.580 10.433 11.764 1.00 37.95 O ATOM 894 CB ILE B 86 11.648 10.459 8.955 1.00 35.25 C ATOM 895 CG1 ILE B 86 10.749 9.875 7.869 1.00 35.08 C ATOM 896 CG2 ILE B 86 12.566 11.462 8.352 1.00 35.10 C ATOM 897 CD1 ILE B 86 9.960 10.905 7.087 1.00 35.60 C ATOM 898 HA ILE B 86 13.154 8.898 8.954 1.00 0.00 H ATOM 899 HB ILE B 86 11.040 10.959 9.709 1.00 0.00 H ATOM 900 HG12 ILE B 86 11.375 9.322 7.169 1.00 0.00 H ATOM 901 HG13 ILE B 86 10.043 9.192 8.342 1.00 0.00 H ATOM 902 HD11 ILE B 86 9.316 11.461 7.768 1.00 0.00 H ATOM 903 HD12 ILE B 86 10.649 11.591 6.595 1.00 0.00 H ATOM 904 HD13 ILE B 86 9.350 10.401 6.338 1.00 0.00 H ATOM 905 HG21 ILE B 86 13.188 11.899 9.133 1.00 0.00 H ATOM 906 HG22 ILE B 86 13.200 10.974 7.612 1.00 0.00 H ATOM 907 HG23 ILE B 86 11.981 12.245 7.870 1.00 0.00 H ATOM 908 H ILE B 86 10.662 8.617 10.591 1.00 0.00 H ATOM 909 N ARG B 87 14.501 9.740 10.904 1.00 37.93 N ATOM 910 CA ARG B 87 15.298 10.307 11.980 1.00 39.57 C ATOM 911 C ARG B 87 15.306 11.827 11.912 1.00 40.33 C ATOM 912 O ARG B 87 15.347 12.401 10.843 1.00 40.70 O ATOM 913 CB ARG B 87 16.741 9.752 11.973 1.00 39.16 C ATOM 914 CG ARG B 87 16.833 8.296 12.465 1.00 40.97 C ATOM 915 CD ARG B 87 18.281 7.725 12.432 1.00 40.85 C ATOM 916 HA ARG B 87 14.833 10.009 12.920 1.00 0.00 H ATOM 917 HB2 ARG B 87 17.126 9.799 10.954 1.00 0.00 H ATOM 918 HB3 ARG B 87 17.356 10.377 12.621 1.00 0.00 H ATOM 919 HG2 ARG B 87 16.467 8.253 13.491 1.00 0.00 H ATOM 920 HG3 ARG B 87 16.201 7.675 11.829 1.00 0.00 H ATOM 921 HD2 ARG B 87 18.657 7.751 11.409 1.00 0.00 H ATOM 922 HD3 ARG B 87 18.923 8.330 13.072 1.00 0.00 H ATOM 923 H ARG B 87 14.966 9.220 10.160 1.00 0.00 H ATOM 924 N ARG B 88 15.292 12.469 13.077 1.00 41.62 N ATOM 925 CA ARG B 88 15.129 13.920 13.169 1.00 42.23 C ATOM 926 C ARG B 88 16.462 14.618 12.908 1.00 43.07 C ATOM 927 O ARG B 88 16.502 15.771 12.458 1.00 42.61 O ATOM 928 CB ARG B 88 14.565 14.289 14.550 1.00 41.65 C ATOM 929 CG ARG B 88 14.333 15.776 14.773 1.00 42.38 C ATOM 930 CD ARG B 88 13.737 16.050 16.150 1.00 41.45 C ATOM 931 NE ARG B 88 14.624 15.679 17.248 1.00 39.95 N ATOM 932 CZ ARG B 88 15.557 16.470 17.805 1.00 42.59 C ATOM 933 NH1 ARG B 88 15.780 17.707 17.366 1.00 41.37 N ATOM 934 NH2 ARG B 88 16.298 16.009 18.817 1.00 41.83 N ATOM 935 HA ARG B 88 14.424 14.257 12.409 1.00 0.00 H ATOM 936 HB2 ARG B 88 13.612 13.775 14.675 1.00 0.00 H ATOM 937 HB3 ARG B 88 15.267 13.939 15.307 1.00 0.00 H ATOM 938 HG2 ARG B 88 15.285 16.300 14.689 1.00 0.00 H ATOM 939 HG3 ARG B 88 13.648 16.146 14.010 1.00 0.00 H ATOM 940 HD2 ARG B 88 12.811 15.482 16.246 1.00 0.00 H ATOM 941 HD3 ARG B 88 13.518 17.115 16.227 1.00 0.00 H ATOM 942 HE ARG B 88 14.527 14.737 17.626 1.00 0.00 H ATOM 943 HH12 ARG B 88 16.495 18.284 17.809 1.00 0.00 H ATOM 944 HH11 ARG B 88 15.236 18.078 16.587 1.00 0.00 H ATOM 945 HH22 ARG B 88 17.007 16.606 19.243 1.00 0.00 H ATOM 946 HH21 ARG B 88 16.154 15.061 19.164 1.00 0.00 H ATOM 947 H ARG B 88 15.399 11.931 13.937 1.00 0.00 H ATOM 948 N ARG B 89 17.537 13.897 13.211 1.00 44.52 N ATOM 949 CA ARG B 89 18.928 14.378 13.104 1.00 45.69 C ATOM 950 C ARG B 89 19.080 15.841 13.515 1.00 46.25 C ATOM 951 O ARG B 89 19.696 16.655 12.795 1.00 47.81 O ATOM 952 CB ARG B 89 19.479 14.120 11.685 1.00 45.74 C ATOM 953 CG ARG B 89 19.331 12.667 11.218 1.00 45.47 C ATOM 954 HA ARG B 89 19.526 13.806 13.814 1.00 0.00 H ATOM 955 HB2 ARG B 89 18.943 14.762 10.986 1.00 0.00 H ATOM 956 HB3 ARG B 89 20.538 14.378 11.675 1.00 0.00 H ATOM 957 HG2 ARG B 89 19.872 12.011 11.900 1.00 0.00 H ATOM 958 HG3 ARG B 89 18.276 12.395 11.210 1.00 0.00 H ATOM 959 H ARG B 89 17.390 12.943 13.541 1.00 0.00 H ATOM 960 N GLY B 90 18.503 16.194 14.654 1.00 45.96 N ATOM 961 CA GLY B 90 18.722 17.549 15.205 1.00 46.38 C ATOM 962 C GLY B 90 17.860 18.696 14.682 1.00 46.06 C ATOM 963 O GLY B 90 18.022 19.828 15.122 1.00 46.68 O ATOM 964 HA3 GLY B 90 19.762 17.812 15.009 1.00 0.00 H ATOM 965 HA2 GLY B 90 18.560 17.489 16.281 1.00 0.00 H ATOM 966 H GLY B 90 17.908 15.531 15.151 1.00 0.00 H ATOM 967 N ALA B 91 16.938 18.406 13.769 1.00 45.60 N ATOM 968 CA ALA B 91 16.053 19.399 13.195 1.00 45.28 C ATOM 969 C ALA B 91 14.965 19.811 14.169 1.00 45.20 C ATOM 970 O ALA B 91 14.541 19.026 14.993 1.00 44.35 O ATOM 971 CB ALA B 91 15.406 18.829 11.923 1.00 45.84 C ATOM 972 HA ALA B 91 16.646 20.282 12.958 1.00 0.00 H ATOM 973 HB1 ALA B 91 16.184 18.574 11.204 1.00 0.00 H ATOM 974 HB2 ALA B 91 14.836 17.935 12.176 1.00 0.00 H ATOM 975 HB3 ALA B 91 14.740 19.575 11.490 1.00 0.00 H ATOM 976 H ALA B 91 16.850 17.439 13.458 1.00 0.00 H ATOM 977 N HIS B 92 14.484 21.037 14.041 1.00 45.43 N ATOM 978 CA HIS B 92 13.357 21.480 14.843 1.00 46.22 C ATOM 979 C HIS B 92 12.132 21.803 13.983 1.00 45.69 C ATOM 980 O HIS B 92 11.034 21.459 14.357 1.00 46.79 O ATOM 981 CB HIS B 92 13.782 22.659 15.731 1.00 47.17 C ATOM 982 CG HIS B 92 15.042 22.380 16.488 1.00 48.69 C ATOM 983 ND1 HIS B 92 16.227 23.043 16.237 1.00 50.27 N ATOM 984 CD2 HIS B 92 15.332 21.416 17.393 1.00 49.98 C ATOM 985 CE1 HIS B 92 17.182 22.530 16.993 1.00 51.39 C ATOM 986 NE2 HIS B 92 16.664 21.542 17.704 1.00 52.21 N ATOM 987 HA HIS B 92 13.050 20.661 15.494 1.00 0.00 H ATOM 988 HB2 HIS B 92 13.939 23.534 15.100 1.00 0.00 H ATOM 989 HB3 HIS B 92 12.984 22.866 16.444 1.00 0.00 H ATOM 990 HD2 HIS B 92 14.639 20.679 17.799 1.00 0.00 H ATOM 991 HE1 HIS B 92 18.219 22.864 17.025 1.00 0.00 H ATOM 992 H HIS B 92 14.909 21.678 13.372 1.00 0.00 H ATOM 993 N ARG B 93 12.296 22.460 12.843 1.00 44.69 N ATOM 994 CA ARG B 93 11.148 22.654 11.969 1.00 43.61 C ATOM 995 C ARG B 93 11.291 21.729 10.759 1.00 41.71 C ATOM 996 O ARG B 93 12.340 21.663 10.120 1.00 41.06 O ATOM 997 CB ARG B 93 10.942 24.120 11.576 1.00 44.01 C ATOM 998 CG ARG B 93 9.573 24.364 10.894 1.00 45.42 C ATOM 999 CD ARG B 93 8.765 25.480 11.547 1.00 48.73 C ATOM 1000 NE ARG B 93 7.483 25.791 10.877 1.00 49.88 N ATOM 1001 CZ ARG B 93 6.247 25.583 11.375 1.00 51.73 C ATOM 1002 NH1 ARG B 93 6.028 25.037 12.573 1.00 52.45 N ATOM 1003 NH2 ARG B 93 5.194 25.940 10.652 1.00 52.32 N ATOM 1004 HA ARG B 93 10.241 22.388 12.512 1.00 0.00 H ATOM 1005 HB2 ARG B 93 11.000 24.735 12.474 1.00 0.00 H ATOM 1006 HB3 ARG B 93 11.734 24.412 10.886 1.00 0.00 H ATOM 1007 HG2 ARG B 93 9.748 24.628 9.851 1.00 0.00 H ATOM 1008 HG3 ARG B 93 8.993 23.442 10.942 1.00 0.00 H ATOM 1009 HD2 ARG B 93 9.375 26.384 11.550 1.00 0.00 H ATOM 1010 HD3 ARG B 93 8.549 25.186 12.574 1.00 0.00 H ATOM 1011 HE ARG B 93 7.540 26.204 9.946 1.00 0.00 H ATOM 1012 HH12 ARG B 93 5.073 24.901 12.905 1.00 0.00 H ATOM 1013 HH11 ARG B 93 6.816 24.756 13.157 1.00 0.00 H ATOM 1014 HH22 ARG B 93 4.252 25.790 11.014 1.00 0.00 H ATOM 1015 HH21 ARG B 93 5.326 26.365 9.734 1.00 0.00 H ATOM 1016 H ARG B 93 13.213 22.824 12.582 1.00 0.00 H ATOM 1017 N ILE B 94 10.238 20.966 10.496 1.00 39.55 N ATOM 1018 CA ILE B 94 10.281 19.983 9.424 1.00 37.97 C ATOM 1019 C ILE B 94 9.528 20.495 8.236 1.00 36.21 C ATOM 1020 O ILE B 94 8.396 20.962 8.378 1.00 35.53 O ATOM 1021 CB ILE B 94 9.679 18.637 9.863 1.00 37.61 C ATOM 1022 CG1 ILE B 94 10.492 18.069 11.028 1.00 35.90 C ATOM 1023 CG2 ILE B 94 9.642 17.646 8.667 1.00 37.57 C ATOM 1024 CD1 ILE B 94 11.940 17.901 10.734 1.00 35.52 C ATOM 1025 HA ILE B 94 11.327 19.821 9.165 1.00 0.00 H ATOM 1026 HB ILE B 94 8.653 18.790 10.198 1.00 0.00 H ATOM 1027 HG12 ILE B 94 10.391 18.745 11.877 1.00 0.00 H ATOM 1028 HG13 ILE B 94 10.080 17.094 11.290 1.00 0.00 H ATOM 1029 HD11 ILE B 94 12.062 17.217 9.894 1.00 0.00 H ATOM 1030 HD12 ILE B 94 12.373 18.869 10.482 1.00 0.00 H ATOM 1031 HD13 ILE B 94 12.443 17.494 11.611 1.00 0.00 H ATOM 1032 HG21 ILE B 94 9.031 18.066 7.868 1.00 0.00 H ATOM 1033 HG22 ILE B 94 10.656 17.481 8.302 1.00 0.00 H ATOM 1034 HG23 ILE B 94 9.213 16.699 8.995 1.00 0.00 H ATOM 1035 H ILE B 94 9.389 21.070 11.051 1.00 0.00 H ATOM 1036 N HIS B 95 10.128 20.367 7.061 1.00 35.44 N ATOM 1037 CA HIS B 95 9.439 20.754 5.819 1.00 35.00 C ATOM 1038 C HIS B 95 9.166 19.521 4.942 1.00 34.01 C ATOM 1039 O HIS B 95 10.058 18.695 4.701 1.00 35.02 O ATOM 1040 CB HIS B 95 10.278 21.792 5.071 1.00 35.44 C ATOM 1041 CG HIS B 95 10.587 23.010 5.876 1.00 35.54 C ATOM 1042 ND1 HIS B 95 9.672 24.014 6.077 1.00 38.92 N ATOM 1043 CD2 HIS B 95 11.710 23.391 6.530 1.00 39.45 C ATOM 1044 CE1 HIS B 95 10.213 24.961 6.823 1.00 39.33 C ATOM 1045 NE2 HIS B 95 11.448 24.603 7.119 1.00 38.44 N ATOM 1046 HA HIS B 95 8.475 21.198 6.067 1.00 0.00 H ATOM 1047 HB2 HIS B 95 11.219 21.327 4.777 1.00 0.00 H ATOM 1048 HB3 HIS B 95 9.731 22.099 4.179 1.00 0.00 H ATOM 1049 HD2 HIS B 95 12.648 22.838 6.580 1.00 0.00 H ATOM 1050 HE1 HIS B 95 9.722 25.881 7.140 1.00 0.00 H ATOM 1051 H HIS B 95 11.077 19.996 7.017 1.00 0.00 H ATOM 1052 N VAL B 96 7.937 19.392 4.478 1.00 32.82 N ATOM 1053 CA VAL B 96 7.555 18.251 3.674 1.00 31.94 C ATOM 1054 C VAL B 96 7.152 18.713 2.285 1.00 31.67 C ATOM 1055 O VAL B 96 6.079 19.265 2.117 1.00 30.58 O ATOM 1056 CB VAL B 96 6.344 17.462 4.257 1.00 31.47 C ATOM 1057 CG1 VAL B 96 6.140 16.186 3.458 1.00 30.10 C ATOM 1058 CG2 VAL B 96 6.544 17.139 5.728 1.00 31.58 C ATOM 1059 HA VAL B 96 8.425 17.595 3.657 1.00 0.00 H ATOM 1060 HB VAL B 96 5.456 18.089 4.179 1.00 0.00 H ATOM 1061 HG11 VAL B 96 5.943 16.439 2.416 1.00 0.00 H ATOM 1062 HG12 VAL B 96 7.039 15.572 3.520 1.00 0.00 H ATOM 1063 HG13 VAL B 96 5.293 15.635 3.866 1.00 0.00 H ATOM 1064 HG21 VAL B 96 7.441 16.531 5.847 1.00 0.00 H ATOM 1065 HG22 VAL B 96 6.655 18.066 6.290 1.00 0.00 H ATOM 1066 HG23 VAL B 96 5.679 16.589 6.099 1.00 0.00 H ATOM 1067 H VAL B 96 7.244 20.110 4.690 1.00 0.00 H ATOM 1068 N GLU B 97 7.995 18.413 1.298 1.00 31.56 N ATOM 1069 CA GLU B 97 7.652 18.623 -0.117 1.00 31.88 C ATOM 1070 C GLU B 97 6.940 17.423 -0.729 1.00 30.65 C ATOM 1071 O GLU B 97 7.504 16.340 -0.787 1.00 30.56 O ATOM 1072 CB GLU B 97 8.904 18.883 -0.957 1.00 31.54 C ATOM 1073 CG GLU B 97 8.538 19.503 -2.304 1.00 34.17 C ATOM 1074 CD GLU B 97 9.716 19.691 -3.220 1.00 35.10 C ATOM 1075 OE1 GLU B 97 9.496 20.194 -4.341 1.00 43.08 O ATOM 1076 OE2 GLU B 97 10.841 19.331 -2.859 1.00 38.04 O ATOM 1077 HA GLU B 97 6.988 19.487 -0.130 1.00 0.00 H ATOM 1078 HB2 GLU B 97 9.561 19.565 -0.417 1.00 0.00 H ATOM 1079 HB3 GLU B 97 9.422 17.939 -1.127 1.00 0.00 H ATOM 1080 HG2 GLU B 97 7.817 18.852 -2.799 1.00 0.00 H ATOM 1081 HG3 GLU B 97 8.083 20.477 -2.123 1.00 0.00 H ATOM 1082 H GLU B 97 8.909 18.025 1.531 1.00 0.00 H ATOM 1083 N MET B 98 5.742 17.653 -1.249 1.00 29.28 N ATOM 1084 CA MET B 98 4.987 16.646 -1.900 1.00 28.66 C ATOM 1085 C MET B 98 4.831 16.916 -3.401 1.00 28.92 C ATOM 1086 O MET B 98 4.447 18.000 -3.796 1.00 29.23 O ATOM 1087 CB MET B 98 3.606 16.551 -1.238 1.00 28.03 C ATOM 1088 CG MET B 98 3.649 15.999 0.189 1.00 28.32 C ATOM 1089 SD MET B 98 2.240 16.519 1.223 1.00 27.79 S ATOM 1090 CE MET B 98 2.614 18.288 1.419 1.00 26.40 C ATOM 1091 HA MET B 98 5.523 15.703 -1.799 1.00 0.00 H ATOM 1092 HB2 MET B 98 3.168 17.549 -1.209 1.00 0.00 H ATOM 1093 HB3 MET B 98 2.978 15.897 -1.842 1.00 0.00 H ATOM 1094 HG2 MET B 98 4.569 16.343 0.663 1.00 0.00 H ATOM 1095 HG3 MET B 98 3.654 14.910 0.136 1.00 0.00 H ATOM 1096 HE1 MET B 98 3.583 18.402 1.905 1.00 0.00 H ATOM 1097 HE2 MET B 98 2.640 18.763 0.438 1.00 0.00 H ATOM 1098 HE3 MET B 98 1.842 18.756 2.030 1.00 0.00 H ATOM 1099 H MET B 98 5.349 18.591 -1.178 1.00 0.00 H ATOM 1100 N LYS B 99 5.112 15.912 -4.237 1.00 29.00 N ATOM 1101 CA LYS B 99 4.640 15.907 -5.629 1.00 28.89 C ATOM 1102 C LYS B 99 3.542 14.895 -5.811 1.00 28.18 C ATOM 1103 O LYS B 99 3.678 13.766 -5.340 1.00 28.93 O ATOM 1104 CB LYS B 99 5.814 15.649 -6.563 1.00 29.97 C ATOM 1105 CG LYS B 99 6.760 16.862 -6.465 1.00 31.15 C ATOM 1106 CD LYS B 99 8.102 16.709 -7.049 1.00 33.19 C ATOM 1107 CE LYS B 99 8.854 18.073 -6.898 1.00 35.10 C ATOM 1108 NZ LYS B 99 8.062 19.180 -7.581 1.00 37.33 N ATOM 1109 HA LYS B 99 4.219 16.882 -5.876 1.00 0.00 H ATOM 1110 HB2 LYS B 99 6.338 14.742 -6.261 1.00 0.00 H ATOM 1111 HB3 LYS B 99 5.458 15.537 -7.587 1.00 0.00 H ATOM 1112 HG2 LYS B 99 6.275 17.699 -6.967 1.00 0.00 H ATOM 1113 HG3 LYS B 99 6.885 17.097 -5.408 1.00 0.00 H ATOM 1114 HD2 LYS B 99 8.647 15.925 -6.523 1.00 0.00 H ATOM 1115 HD3 LYS B 99 8.019 16.447 -8.104 1.00 0.00 H ATOM 1116 HE2 LYS B 99 9.839 17.996 -7.358 1.00 0.00 H ATOM 1117 HE3 LYS B 99 8.967 18.309 -5.840 1.00 0.00 H ATOM 1118 HZ1 LYS B 99 7.958 18.960 -8.572 1.00 0.00 H ATOM 1119 HZ2 LYS B 99 7.141 19.253 -7.149 1.00 0.00 H ATOM 1120 HZ3 LYS B 99 8.559 20.065 -7.478 1.00 0.00 H ATOM 1121 H LYS B 99 5.670 15.127 -3.900 1.00 0.00 H ATOM 1122 N PHE B 100 2.470 15.282 -6.485 1.00 26.84 N ATOM 1123 CA PHE B 100 1.307 14.430 -6.649 1.00 26.61 C ATOM 1124 C PHE B 100 0.456 14.785 -7.862 1.00 27.60 C ATOM 1125 O PHE B 100 0.617 15.853 -8.455 1.00 28.97 O ATOM 1126 CB PHE B 100 0.436 14.482 -5.394 1.00 26.92 C ATOM 1127 CG PHE B 100 -0.108 15.862 -5.054 1.00 24.85 C ATOM 1128 CD1 PHE B 100 0.710 16.830 -4.505 1.00 26.32 C ATOM 1129 CD2 PHE B 100 -1.416 16.169 -5.273 1.00 25.49 C ATOM 1130 CE1 PHE B 100 0.233 18.076 -4.190 1.00 25.46 C ATOM 1131 CE2 PHE B 100 -1.901 17.409 -4.965 1.00 25.31 C ATOM 1132 CZ PHE B 100 -1.057 18.364 -4.409 1.00 25.90 C ATOM 1133 HA PHE B 100 1.692 13.423 -6.812 1.00 0.00 H ATOM 1134 HB2 PHE B 100 -0.410 13.810 -5.539 1.00 0.00 H ATOM 1135 HB3 PHE B 100 1.034 14.135 -4.551 1.00 0.00 H ATOM 1136 HD2 PHE B 100 -2.083 15.419 -5.698 1.00 0.00 H ATOM 1137 HE2 PHE B 100 -2.947 17.649 -5.155 1.00 0.00 H ATOM 1138 HZ PHE B 100 -1.446 19.349 -4.151 1.00 0.00 H ATOM 1139 HE1 PHE B 100 0.898 18.827 -3.764 1.00 0.00 H ATOM 1140 HD1 PHE B 100 1.758 16.598 -4.318 1.00 0.00 H ATOM 1141 H PHE B 100 2.461 16.212 -6.904 1.00 0.00 H ATOM 1142 N SER B 101 -0.467 13.888 -8.211 1.00 27.63 N ATOM 1143 CA SER B 101 -1.360 14.039 -9.351 1.00 26.66 C ATOM 1144 C SER B 101 -2.726 13.680 -8.882 1.00 27.38 C ATOM 1145 O SER B 101 -2.927 12.603 -8.367 1.00 28.71 O ATOM 1146 CB SER B 101 -0.969 13.104 -10.493 1.00 26.74 C ATOM 1147 OG SER B 101 0.301 13.436 -11.044 1.00 24.78 O ATOM 1148 HA SER B 101 -1.308 15.062 -9.725 1.00 0.00 H ATOM 1149 HB2 SER B 101 -1.722 13.173 -11.278 1.00 0.00 H ATOM 1150 HB3 SER B 101 -0.932 12.082 -10.115 1.00 0.00 H ATOM 1151 HG SER B 101 0.276 14.333 -11.386 1.00 0.00 H ATOM 1152 H SER B 101 -0.553 13.044 -7.644 1.00 0.00 H ATOM 1153 N VAL B 102 -3.682 14.582 -9.023 1.00 28.54 N ATOM 1154 CA VAL B 102 -5.055 14.289 -8.672 1.00 29.28 C ATOM 1155 C VAL B 102 -5.768 14.147 -9.998 1.00 30.88 C ATOM 1156 O VAL B 102 -5.580 14.969 -10.904 1.00 31.71 O ATOM 1157 CB VAL B 102 -5.725 15.424 -7.866 1.00 29.08 C ATOM 1158 CG1 VAL B 102 -7.239 15.234 -7.799 1.00 27.04 C ATOM 1159 CG2 VAL B 102 -5.126 15.505 -6.446 1.00 29.68 C ATOM 1160 HA VAL B 102 -5.101 13.401 -8.042 1.00 0.00 H ATOM 1161 HB VAL B 102 -5.528 16.364 -8.381 1.00 0.00 H ATOM 1162 HG11 VAL B 102 -7.649 15.235 -8.809 1.00 0.00 H ATOM 1163 HG12 VAL B 102 -7.464 14.283 -7.315 1.00 0.00 H ATOM 1164 HG13 VAL B 102 -7.681 16.049 -7.225 1.00 0.00 H ATOM 1165 HG21 VAL B 102 -5.289 14.559 -5.930 1.00 0.00 H ATOM 1166 HG22 VAL B 102 -4.056 15.703 -6.515 1.00 0.00 H ATOM 1167 HG23 VAL B 102 -5.611 16.310 -5.894 1.00 0.00 H ATOM 1168 H VAL B 102 -3.447 15.505 -9.387 1.00 0.00 H ATOM 1169 N ARG B 103 -6.556 13.085 -10.122 1.00 31.86 N ATOM 1170 CA ARG B 103 -7.494 12.964 -11.209 1.00 32.35 C ATOM 1171 C ARG B 103 -8.781 13.597 -10.752 1.00 32.98 C ATOM 1172 O ARG B 103 -9.399 13.174 -9.768 1.00 33.38 O ATOM 1173 CB ARG B 103 -7.700 11.511 -11.588 1.00 32.22 C ATOM 1174 CG ARG B 103 -8.511 11.310 -12.854 1.00 33.56 C ATOM 1175 CD ARG B 103 -8.673 9.853 -13.214 1.00 31.53 C ATOM 1176 NE ARG B 103 -9.584 9.689 -14.328 1.00 30.09 N ATOM 1177 CZ ARG B 103 -9.674 8.602 -15.103 1.00 31.88 C ATOM 1178 NH1 ARG B 103 -8.900 7.546 -14.906 1.00 29.74 N ATOM 1179 NH2 ARG B 103 -10.552 8.574 -16.112 1.00 31.74 N ATOM 1180 HA ARG B 103 -7.119 13.465 -12.101 1.00 0.00 H ATOM 1181 HB2 ARG B 103 -6.722 11.052 -11.731 1.00 0.00 H ATOM 1182 HB3 ARG B 103 -8.217 11.013 -10.768 1.00 0.00 H ATOM 1183 HG2 ARG B 103 -9.499 11.746 -12.709 1.00 0.00 H ATOM 1184 HG3 ARG B 103 -8.008 11.819 -13.676 1.00 0.00 H ATOM 1185 HD2 ARG B 103 -9.065 9.314 -12.351 1.00 0.00 H ATOM 1186 HD3 ARG B 103 -7.700 9.443 -13.486 1.00 0.00 H ATOM 1187 HE ARG B 103 -10.209 10.467 -14.539 1.00 0.00 H ATOM 1188 HH12 ARG B 103 -8.988 6.729 -15.511 1.00 0.00 H ATOM 1189 HH11 ARG B 103 -8.216 7.549 -14.150 1.00 0.00 H ATOM 1190 HH22 ARG B 103 -10.622 7.746 -16.704 1.00 0.00 H ATOM 1191 HH21 ARG B 103 -11.151 9.380 -16.289 1.00 0.00 H ATOM 1192 H ARG B 103 -6.496 12.337 -9.431 1.00 0.00 H ATOM 1193 N ASP B 104 -9.180 14.639 -11.465 1.00 33.77 N ATOM 1194 CA ASP B 104 -10.399 15.352 -11.125 1.00 33.97 C ATOM 1195 C ASP B 104 -11.571 14.478 -11.370 1.00 34.00 C ATOM 1196 O ASP B 104 -11.604 13.727 -12.342 1.00 33.44 O ATOM 1197 CB ASP B 104 -10.562 16.709 -11.873 1.00 34.70 C ATOM 1198 CG ASP B 104 -10.012 16.685 -13.240 1.00 33.77 C ATOM 1199 OD1 ASP B 104 -8.842 17.023 -13.417 1.00 41.04 O ATOM 1200 OD2 ASP B 104 -10.721 16.313 -14.146 1.00 35.58 O ATOM 1201 HA ASP B 104 -10.332 15.604 -10.067 1.00 0.00 H ATOM 1202 HB2 ASP B 104 -11.624 16.949 -11.930 1.00 0.00 H ATOM 1203 HB3 ASP B 104 -10.046 17.483 -11.305 1.00 0.00 H ATOM 1204 H ASP B 104 -8.624 14.945 -12.264 1.00 0.00 H ATOM 1205 N CYS B 105 -12.549 14.591 -10.479 1.00 34.50 N ATOM 1206 CA CYS B 105 -13.694 13.736 -10.515 1.00 35.60 C ATOM 1207 C CYS B 105 -14.438 13.920 -11.825 1.00 35.88 C ATOM 1208 O CYS B 105 -15.117 13.010 -12.283 1.00 36.43 O ATOM 1209 CB CYS B 105 -14.597 14.090 -9.353 1.00 36.31 C ATOM 1210 SG CYS B 105 -13.778 13.850 -7.784 1.00 39.22 S ATOM 1211 HA CYS B 105 -13.382 12.695 -10.438 1.00 0.00 H ATOM 1212 HB2 CYS B 105 -15.484 13.458 -9.389 1.00 0.00 H ATOM 1213 HB3 CYS B 105 -14.893 15.135 -9.441 1.00 0.00 H ATOM 1214 H CYS B 105 -12.482 15.304 -9.753 1.00 0.00 H ATOM 1215 N SER B 106 -14.350 15.137 -12.376 1.00 35.84 N ATOM 1216 CA SER B 106 -14.942 15.495 -13.692 1.00 36.09 C ATOM 1217 C SER B 106 -14.444 14.608 -14.798 1.00 34.54 C ATOM 1218 O SER B 106 -15.160 14.342 -15.714 1.00 34.62 O ATOM 1219 CB SER B 106 -14.557 16.927 -14.103 1.00 35.65 C ATOM 1220 OG SER B 106 -15.459 17.822 -13.532 1.00 38.91 O ATOM 1221 HA SER B 106 -16.019 15.386 -13.562 1.00 0.00 H ATOM 1222 HB2 SER B 106 -14.590 17.017 -15.189 1.00 0.00 H ATOM 1223 HB3 SER B 106 -13.549 17.150 -13.752 1.00 0.00 H ATOM 1224 HG SER B 106 -15.223 18.717 -13.785 1.00 0.00 H ATOM 1225 H SER B 106 -13.847 15.861 -11.863 1.00 0.00 H ATOM 1226 N SER B 107 -13.181 14.226 -14.717 1.00 34.24 N ATOM 1227 CA SER B 107 -12.560 13.382 -15.722 1.00 34.26 C ATOM 1228 C SER B 107 -12.630 11.891 -15.400 1.00 34.02 C ATOM 1229 O SER B 107 -11.818 11.142 -15.876 1.00 35.41 O ATOM 1230 CB SER B 107 -11.092 13.763 -15.866 1.00 34.20 C ATOM 1231 OG SER B 107 -10.300 13.094 -14.889 1.00 35.28 O ATOM 1232 HA SER B 107 -13.118 13.547 -16.643 1.00 0.00 H ATOM 1233 HB2 SER B 107 -10.987 14.840 -15.736 1.00 0.00 H ATOM 1234 HB3 SER B 107 -10.745 13.483 -16.861 1.00 0.00 H ATOM 1235 HG SER B 107 -10.387 12.145 -15.003 1.00 0.00 H ATOM 1236 H SER B 107 -12.623 14.535 -13.921 1.00 0.00 H ATOM 1237 N ILE B 108 -13.565 11.443 -14.567 1.00 33.71 N ATOM 1238 CA ILE B 108 -13.663 9.987 -14.275 1.00 33.21 C ATOM 1239 C ILE B 108 -15.023 9.512 -14.797 1.00 32.71 C ATOM 1240 O ILE B 108 -16.065 9.940 -14.284 1.00 31.16 O ATOM 1241 CB ILE B 108 -13.496 9.636 -12.751 1.00 33.33 C ATOM 1242 CG1 ILE B 108 -12.156 10.181 -12.210 1.00 34.22 C ATOM 1243 CG2 ILE B 108 -13.543 8.104 -12.550 1.00 33.00 C ATOM 1244 CD1 ILE B 108 -11.932 10.114 -10.717 1.00 32.19 C ATOM 1245 HA ILE B 108 -12.839 9.475 -14.772 1.00 0.00 H ATOM 1246 HB ILE B 108 -14.316 10.101 -12.203 1.00 0.00 H ATOM 1247 HG12 ILE B 108 -11.356 9.615 -12.687 1.00 0.00 H ATOM 1248 HG13 ILE B 108 -12.085 11.228 -12.505 1.00 0.00 H ATOM 1249 HD11 ILE B 108 -12.706 10.689 -10.209 1.00 0.00 H ATOM 1250 HD12 ILE B 108 -11.976 9.075 -10.391 1.00 0.00 H ATOM 1251 HD13 ILE B 108 -10.953 10.530 -10.479 1.00 0.00 H ATOM 1252 HG21 ILE B 108 -14.501 7.722 -12.903 1.00 0.00 H ATOM 1253 HG22 ILE B 108 -12.735 7.640 -13.115 1.00 0.00 H ATOM 1254 HG23 ILE B 108 -13.426 7.874 -11.491 1.00 0.00 H ATOM 1255 H ILE B 108 -14.214 12.097 -14.129 1.00 0.00 H ATOM 1256 N PRO B 109 -15.025 8.687 -15.866 1.00 32.78 N ATOM 1257 CA PRO B 109 -16.313 8.249 -16.385 1.00 33.16 C ATOM 1258 C PRO B 109 -17.140 7.564 -15.328 1.00 34.16 C ATOM 1259 O PRO B 109 -16.623 6.743 -14.553 1.00 34.42 O ATOM 1260 CB PRO B 109 -15.942 7.297 -17.531 1.00 33.18 C ATOM 1261 CG PRO B 109 -14.573 7.737 -17.955 1.00 33.80 C ATOM 1262 CD PRO B 109 -13.908 8.204 -16.692 1.00 33.13 C ATOM 1263 HA PRO B 109 -16.933 9.080 -16.720 1.00 0.00 H ATOM 1264 HD3 PRO B 109 -13.388 7.382 -16.200 1.00 0.00 H ATOM 1265 HD2 PRO B 109 -13.202 9.008 -16.899 1.00 0.00 H ATOM 1266 HG3 PRO B 109 -14.638 8.550 -18.678 1.00 0.00 H ATOM 1267 HG2 PRO B 109 -14.022 6.906 -18.394 1.00 0.00 H ATOM 1268 HB2 PRO B 109 -15.925 6.264 -17.184 1.00 0.00 H ATOM 1269 HB3 PRO B 109 -16.650 7.391 -18.355 1.00 0.00 H ATOM 1270 N SER B 110 -18.413 7.931 -15.283 1.00 35.26 N ATOM 1271 CA SER B 110 -19.379 7.262 -14.435 1.00 36.83 C ATOM 1272 C SER B 110 -19.118 7.385 -12.908 1.00 37.05 C ATOM 1273 O SER B 110 -19.744 6.659 -12.144 1.00 36.95 O ATOM 1274 CB SER B 110 -19.488 5.767 -14.856 1.00 36.89 C ATOM 1275 OG SER B 110 -19.831 5.614 -16.237 1.00 37.79 O ATOM 1276 HA SER B 110 -20.325 7.781 -14.592 1.00 0.00 H ATOM 1277 HB2 SER B 110 -20.255 5.287 -14.249 1.00 0.00 H ATOM 1278 HB3 SER B 110 -18.529 5.282 -14.677 1.00 0.00 H ATOM 1279 HG SER B 110 -19.887 4.680 -16.450 1.00 0.00 H ATOM 1280 H SER B 110 -18.723 8.710 -15.864 1.00 0.00 H ATOM 1281 N VAL B 111 -18.263 8.311 -12.443 1.00 38.18 N ATOM 1282 CA VAL B 111 -18.063 8.420 -10.977 1.00 38.60 C ATOM 1283 C VAL B 111 -19.303 8.906 -10.290 1.00 38.43 C ATOM 1284 O VAL B 111 -19.965 9.806 -10.816 1.00 38.49 O ATOM 1285 CB VAL B 111 -16.950 9.412 -10.418 1.00 39.16 C ATOM 1286 CG1 VAL B 111 -15.633 8.684 -10.148 1.00 39.61 C ATOM 1287 CG2 VAL B 111 -16.836 10.694 -11.227 1.00 39.28 C ATOM 1288 HA VAL B 111 -17.754 7.396 -10.768 1.00 0.00 H ATOM 1289 HB VAL B 111 -17.278 9.766 -9.441 1.00 0.00 H ATOM 1290 HG11 VAL B 111 -15.798 7.899 -9.410 1.00 0.00 H ATOM 1291 HG12 VAL B 111 -15.267 8.242 -11.075 1.00 0.00 H ATOM 1292 HG13 VAL B 111 -14.898 9.394 -9.768 1.00 0.00 H ATOM 1293 HG21 VAL B 111 -16.576 10.450 -12.257 1.00 0.00 H ATOM 1294 HG22 VAL B 111 -17.790 11.221 -11.207 1.00 0.00 H ATOM 1295 HG23 VAL B 111 -16.061 11.327 -10.795 1.00 0.00 H ATOM 1296 H VAL B 111 -17.762 8.926 -13.084 1.00 0.00 H ATOM 1297 N PRO B 112 -19.560 8.358 -9.074 1.00 38.18 N ATOM 1298 CA PRO B 112 -20.531 8.874 -8.105 1.00 38.30 C ATOM 1299 C PRO B 112 -20.146 10.272 -7.581 1.00 38.38 C ATOM 1300 O PRO B 112 -18.968 10.629 -7.582 1.00 37.82 O ATOM 1301 CB PRO B 112 -20.495 7.833 -6.970 1.00 38.45 C ATOM 1302 CG PRO B 112 -19.869 6.589 -7.616 1.00 38.61 C ATOM 1303 CD PRO B 112 -18.904 7.127 -8.591 1.00 38.27 C ATOM 1304 HA PRO B 112 -21.520 9.002 -8.544 1.00 0.00 H ATOM 1305 HD3 PRO B 112 -17.951 7.354 -8.113 1.00 0.00 H ATOM 1306 HD2 PRO B 112 -18.741 6.424 -9.408 1.00 0.00 H ATOM 1307 HG3 PRO B 112 -20.630 5.990 -8.116 1.00 0.00 H ATOM 1308 HG2 PRO B 112 -19.362 5.979 -6.868 1.00 0.00 H ATOM 1309 HB2 PRO B 112 -19.883 8.187 -6.140 1.00 0.00 H ATOM 1310 HB3 PRO B 112 -21.501 7.617 -6.611 1.00 0.00 H ATOM 1311 N GLY B 113 -21.140 11.027 -7.113 1.00 38.43 N ATOM 1312 CA GLY B 113 -20.927 12.406 -6.664 1.00 39.23 C ATOM 1313 C GLY B 113 -20.085 12.557 -5.390 1.00 39.29 C ATOM 1314 O GLY B 113 -19.691 13.665 -5.007 1.00 39.24 O ATOM 1315 HA3 GLY B 113 -21.903 12.855 -6.478 1.00 0.00 H ATOM 1316 HA2 GLY B 113 -20.426 12.948 -7.466 1.00 0.00 H ATOM 1317 H GLY B 113 -22.079 10.632 -7.066 1.00 0.00 H ATOM 1318 N SER B 114 -19.782 11.438 -4.742 1.00 38.91 N ATOM 1319 CA SER B 114 -19.074 11.480 -3.489 1.00 38.58 C ATOM 1320 C SER B 114 -17.596 11.498 -3.752 1.00 37.72 C ATOM 1321 O SER B 114 -16.825 11.511 -2.815 1.00 38.40 O ATOM 1322 CB SER B 114 -19.470 10.290 -2.622 1.00 38.25 C ATOM 1323 OG SER B 114 -18.947 9.106 -3.172 1.00 41.82 O ATOM 1324 HA SER B 114 -19.339 12.388 -2.947 1.00 0.00 H ATOM 1325 HB2 SER B 114 -20.557 10.220 -2.578 1.00 0.00 H ATOM 1326 HB3 SER B 114 -19.075 10.427 -1.616 1.00 0.00 H ATOM 1327 HG SER B 114 -19.199 8.360 -2.622 1.00 0.00 H ATOM 1328 H SER B 114 -20.054 10.538 -5.137 1.00 0.00 H ATOM 1329 N CYS B 115 -17.200 11.513 -5.029 1.00 36.82 N ATOM 1330 CA CYS B 115 -15.801 11.611 -5.420 1.00 35.84 C ATOM 1331 C CYS B 115 -15.090 12.817 -4.783 1.00 35.67 C ATOM 1332 O CYS B 115 -15.689 13.889 -4.637 1.00 35.83 O ATOM 1333 CB CYS B 115 -15.703 11.700 -6.944 1.00 35.35 C ATOM 1334 SG CYS B 115 -14.013 11.818 -7.547 1.00 36.72 S ATOM 1335 HA CYS B 115 -15.298 10.714 -5.057 1.00 0.00 H ATOM 1336 HB2 CYS B 115 -16.250 12.583 -7.274 1.00 0.00 H ATOM 1337 HB3 CYS B 115 -16.161 10.809 -7.372 1.00 0.00 H ATOM 1338 H CYS B 115 -17.908 11.453 -5.761 1.00 0.00 H ATOM 1339 N LYS B 116 -13.807 12.635 -4.438 1.00 35.05 N ATOM 1340 CA LYS B 116 -13.025 13.641 -3.754 1.00 34.18 C ATOM 1341 C LYS B 116 -11.773 13.932 -4.519 1.00 33.72 C ATOM 1342 O LYS B 116 -11.340 13.133 -5.391 1.00 31.82 O ATOM 1343 CB LYS B 116 -12.601 13.148 -2.372 1.00 34.96 C ATOM 1344 CG LYS B 116 -13.732 12.872 -1.459 1.00 37.36 C ATOM 1345 CD LYS B 116 -14.420 14.157 -0.993 1.00 41.78 C ATOM 1346 CE LYS B 116 -15.918 13.936 -0.943 1.00 42.90 C ATOM 1347 NZ LYS B 116 -16.258 12.662 -0.225 1.00 45.66 N ATOM 1348 HA LYS B 116 -13.646 14.533 -3.668 1.00 0.00 H ATOM 1349 HB2 LYS B 116 -12.028 12.229 -2.496 1.00 0.00 H ATOM 1350 HB3 LYS B 116 -11.969 13.909 -1.915 1.00 0.00 H ATOM 1351 HG2 LYS B 116 -14.461 12.251 -1.979 1.00 0.00 H ATOM 1352 HG3 LYS B 116 -13.358 12.337 -0.586 1.00 0.00 H ATOM 1353 HD2 LYS B 116 -14.058 14.424 -0.000 1.00 0.00 H ATOM 1354 HD3 LYS B 116 -14.194 14.964 -1.690 1.00 0.00 H ATOM 1355 HE2 LYS B 116 -16.304 13.884 -1.961 1.00 0.00 H ATOM 1356 HE3 LYS B 116 -16.383 14.773 -0.422 1.00 0.00 H ATOM 1357 HZ1 LYS B 116 -15.829 11.874 -0.711 1.00 0.00 H ATOM 1358 HZ2 LYS B 116 -15.904 12.707 0.731 1.00 0.00 H ATOM 1359 HZ3 LYS B 116 -17.271 12.542 -0.208 1.00 0.00 H ATOM 1360 H LYS B 116 -13.362 11.746 -4.669 1.00 0.00 H ATOM 1361 N GLU B 117 -11.163 15.067 -4.158 1.00 32.93 N ATOM 1362 CA GLU B 117 -9.999 15.562 -4.864 1.00 32.74 C ATOM 1363 C GLU B 117 -8.885 16.047 -3.967 1.00 32.75 C ATOM 1364 O GLU B 117 -7.898 16.596 -4.461 1.00 33.59 O ATOM 1365 CB GLU B 117 -10.420 16.649 -5.853 1.00 32.65 C ATOM 1366 CG GLU B 117 -11.380 16.127 -6.946 1.00 33.27 C ATOM 1367 CD GLU B 117 -11.694 17.138 -8.061 1.00 33.43 C ATOM 1368 OE1 GLU B 117 -10.859 18.002 -8.332 1.00 33.20 O ATOM 1369 OE2 GLU B 117 -12.769 17.034 -8.679 1.00 33.26 O ATOM 1370 HA GLU B 117 -9.578 14.711 -5.399 1.00 0.00 H ATOM 1371 HB2 GLU B 117 -10.919 17.446 -5.303 1.00 0.00 H ATOM 1372 HB3 GLU B 117 -9.527 17.046 -6.335 1.00 0.00 H ATOM 1373 HG2 GLU B 117 -10.928 15.247 -7.403 1.00 0.00 H ATOM 1374 HG3 GLU B 117 -12.318 15.846 -6.468 1.00 0.00 H ATOM 1375 H GLU B 117 -11.527 15.597 -3.366 1.00 0.00 H ATOM 1376 N THR B 118 -8.995 15.799 -2.658 1.00 32.98 N ATOM 1377 CA THR B 118 -7.934 16.165 -1.691 1.00 32.41 C ATOM 1378 C THR B 118 -7.429 14.955 -0.917 1.00 31.45 C ATOM 1379 O THR B 118 -8.084 13.931 -0.917 1.00 32.27 O ATOM 1380 CB THR B 118 -8.461 17.196 -0.711 1.00 32.50 C ATOM 1381 OG1 THR B 118 -9.569 16.651 0.039 1.00 32.05 O ATOM 1382 CG2 THR B 118 -8.960 18.435 -1.514 1.00 33.50 C ATOM 1383 HA THR B 118 -7.102 16.577 -2.262 1.00 0.00 H ATOM 1384 HB THR B 118 -7.666 17.478 -0.021 1.00 0.00 H ATOM 1385 HG1 THR B 118 -9.275 15.877 0.524 1.00 0.00 H ATOM 1386 HG23 THR B 118 -8.131 18.855 -2.084 1.00 0.00 H ATOM 1387 HG21 THR B 118 -9.754 18.129 -2.196 1.00 0.00 H ATOM 1388 HG22 THR B 118 -9.343 19.185 -0.822 1.00 0.00 H ATOM 1389 H THR B 118 -9.839 15.342 -2.313 1.00 0.00 H ATOM 1390 N PHE B 119 -6.251 15.082 -0.302 1.00 30.10 N ATOM 1391 CA PHE B 119 -5.837 14.218 0.784 1.00 29.08 C ATOM 1392 C PHE B 119 -5.350 14.975 2.043 1.00 28.82 C ATOM 1393 O PHE B 119 -5.003 16.168 1.985 1.00 28.02 O ATOM 1394 CB PHE B 119 -4.775 13.237 0.305 1.00 28.82 C ATOM 1395 CG PHE B 119 -3.464 13.870 -0.046 1.00 27.52 C ATOM 1396 CD1 PHE B 119 -2.406 13.791 0.815 1.00 23.91 C ATOM 1397 CD2 PHE B 119 -3.291 14.521 -1.279 1.00 28.84 C ATOM 1398 CE1 PHE B 119 -1.190 14.363 0.494 1.00 27.33 C ATOM 1399 CE2 PHE B 119 -2.070 15.103 -1.616 1.00 27.78 C ATOM 1400 CZ PHE B 119 -1.013 15.005 -0.744 1.00 28.94 C ATOM 1401 HA PHE B 119 -6.730 13.675 1.093 1.00 0.00 H ATOM 1402 HB2 PHE B 119 -4.601 12.508 1.097 1.00 0.00 H ATOM 1403 HB3 PHE B 119 -5.156 12.727 -0.580 1.00 0.00 H ATOM 1404 HD2 PHE B 119 -4.123 14.572 -1.982 1.00 0.00 H ATOM 1405 HE2 PHE B 119 -1.955 15.631 -2.563 1.00 0.00 H ATOM 1406 HZ PHE B 119 -0.042 15.423 -1.011 1.00 0.00 H ATOM 1407 HE1 PHE B 119 -0.364 14.316 1.204 1.00 0.00 H ATOM 1408 HD1 PHE B 119 -2.523 13.271 1.766 1.00 0.00 H ATOM 1409 H PHE B 119 -5.616 15.818 -0.610 1.00 0.00 H ATOM 1410 N ASN B 120 -5.321 14.271 3.181 1.00 28.32 N ATOM 1411 CA ASN B 120 -4.660 14.791 4.393 1.00 27.97 C ATOM 1412 C ASN B 120 -3.285 14.258 4.631 1.00 27.60 C ATOM 1413 O ASN B 120 -3.005 13.070 4.371 1.00 27.45 O ATOM 1414 CB ASN B 120 -5.459 14.483 5.657 1.00 28.68 C ATOM 1415 CG ASN B 120 -6.793 15.149 5.677 1.00 27.58 C ATOM 1416 OD1 ASN B 120 -6.924 16.302 5.313 1.00 31.20 O ATOM 1417 ND2 ASN B 120 -7.789 14.425 6.081 1.00 28.00 N ATOM 1418 HA ASN B 120 -4.600 15.862 4.198 1.00 0.00 H ATOM 1419 HB2 ASN B 120 -5.607 13.405 5.721 1.00 0.00 H ATOM 1420 HB3 ASN B 120 -4.888 14.822 6.521 1.00 0.00 H ATOM 1421 HD22 ASN B 120 -7.632 13.462 6.377 1.00 0.00 H ATOM 1422 HD21 ASN B 120 -8.730 14.818 6.103 1.00 0.00 H ATOM 1423 H ASN B 120 -5.766 13.354 3.211 1.00 0.00 H ATOM 1424 N LEU B 121 -2.452 15.146 5.194 1.00 27.59 N ATOM 1425 CA LEU B 121 -1.114 14.867 5.690 1.00 27.66 C ATOM 1426 C LEU B 121 -1.065 14.988 7.223 1.00 28.60 C ATOM 1427 O LEU B 121 -1.603 15.953 7.786 1.00 27.75 O ATOM 1428 CB LEU B 121 -0.140 15.877 5.100 1.00 27.61 C ATOM 1429 CG LEU B 121 1.274 15.840 5.668 1.00 27.62 C ATOM 1430 CD1 LEU B 121 1.945 14.590 5.249 1.00 27.57 C ATOM 1431 CD2 LEU B 121 2.084 17.044 5.208 1.00 28.36 C ATOM 1432 HA LEU B 121 -0.844 13.852 5.399 1.00 0.00 H ATOM 1433 HB2 LEU B 121 -0.075 15.694 4.027 1.00 0.00 H ATOM 1434 HB3 LEU B 121 -0.545 16.874 5.273 1.00 0.00 H ATOM 1435 HG LEU B 121 1.208 15.874 6.755 1.00 0.00 H ATOM 1436 HD21 LEU B 121 2.146 17.044 4.120 1.00 0.00 H ATOM 1437 HD22 LEU B 121 1.597 17.959 5.546 1.00 0.00 H ATOM 1438 HD23 LEU B 121 3.087 16.988 5.630 1.00 0.00 H ATOM 1439 HD11 LEU B 121 1.382 13.734 5.622 1.00 0.00 H ATOM 1440 HD12 LEU B 121 1.990 14.551 4.161 1.00 0.00 H ATOM 1441 HD13 LEU B 121 2.956 14.567 5.657 1.00 0.00 H ATOM 1442 H LEU B 121 -2.788 16.105 5.282 1.00 0.00 H ATOM 1443 N TYR B 122 -0.383 14.021 7.866 1.00 29.22 N ATOM 1444 CA TYR B 122 -0.283 13.905 9.326 1.00 28.91 C ATOM 1445 C TYR B 122 1.151 13.526 9.667 1.00 30.58 C ATOM 1446 O TYR B 122 1.851 12.878 8.853 1.00 29.75 O ATOM 1447 CB TYR B 122 -1.143 12.783 9.894 1.00 28.81 C ATOM 1448 CG TYR B 122 -2.627 12.858 9.697 1.00 29.32 C ATOM 1449 CD1 TYR B 122 -3.440 13.412 10.659 1.00 29.24 C ATOM 1450 CD2 TYR B 122 -3.241 12.286 8.561 1.00 30.24 C ATOM 1451 CE1 TYR B 122 -4.821 13.464 10.481 1.00 30.89 C ATOM 1452 CE2 TYR B 122 -4.593 12.341 8.379 1.00 28.18 C ATOM 1453 CZ TYR B 122 -5.390 12.933 9.341 1.00 29.36 C ATOM 1454 OH TYR B 122 -6.766 12.966 9.207 1.00 30.26 O ATOM 1455 HA TYR B 122 -0.608 14.858 9.744 1.00 0.00 H ATOM 1456 HB3 TYR B 122 -0.961 12.748 10.968 1.00 0.00 H ATOM 1457 HB2 TYR B 122 -0.803 11.853 9.439 1.00 0.00 H ATOM 1458 HD2 TYR B 122 -2.622 11.790 7.813 1.00 0.00 H ATOM 1459 HE2 TYR B 122 -5.042 11.920 7.479 1.00 0.00 H ATOM 1460 HE1 TYR B 122 -5.452 13.924 11.242 1.00 0.00 H ATOM 1461 HD1 TYR B 122 -2.999 13.815 11.571 1.00 0.00 H ATOM 1462 HH TYR B 122 -7.103 12.068 9.159 1.00 0.00 H ATOM 1463 H TYR B 122 0.097 13.321 7.300 1.00 0.00 H ATOM 1464 N TYR B 123 1.602 13.917 10.864 1.00 31.37 N ATOM 1465 CA TYR B 123 2.811 13.300 11.437 1.00 31.93 C ATOM 1466 C TYR B 123 2.544 12.750 12.833 1.00 31.73 C ATOM 1467 O TYR B 123 1.505 13.014 13.442 1.00 30.59 O ATOM 1468 CB TYR B 123 3.957 14.256 11.477 1.00 32.43 C ATOM 1469 CG TYR B 123 3.820 15.334 12.526 1.00 35.32 C ATOM 1470 CD1 TYR B 123 3.047 16.469 12.286 1.00 34.88 C ATOM 1471 CD2 TYR B 123 4.515 15.247 13.741 1.00 35.80 C ATOM 1472 CE1 TYR B 123 2.942 17.447 13.222 1.00 36.12 C ATOM 1473 CE2 TYR B 123 4.409 16.226 14.686 1.00 34.75 C ATOM 1474 CZ TYR B 123 3.639 17.324 14.423 1.00 35.71 C ATOM 1475 OH TYR B 123 3.534 18.306 15.363 1.00 35.77 O ATOM 1476 HA TYR B 123 3.081 12.473 10.781 1.00 0.00 H ATOM 1477 HB3 TYR B 123 4.039 14.735 10.501 1.00 0.00 H ATOM 1478 HB2 TYR B 123 4.867 13.692 11.681 1.00 0.00 H ATOM 1479 HD2 TYR B 123 5.151 14.383 13.934 1.00 0.00 H ATOM 1480 HE2 TYR B 123 4.932 16.133 15.638 1.00 0.00 H ATOM 1481 HE1 TYR B 123 2.318 18.321 13.036 1.00 0.00 H ATOM 1482 HD1 TYR B 123 2.521 16.572 11.337 1.00 0.00 H ATOM 1483 HH TYR B 123 2.964 19.004 15.033 1.00 0.00 H ATOM 1484 H TYR B 123 1.108 14.644 11.381 1.00 0.00 H ATOM 1485 N TYR B 124 3.482 11.926 13.286 1.00 32.00 N ATOM 1486 CA TYR B 124 3.530 11.429 14.656 1.00 32.19 C ATOM 1487 C TYR B 124 5.013 11.270 15.027 1.00 32.16 C ATOM 1488 O TYR B 124 5.769 10.655 14.269 1.00 32.01 O ATOM 1489 CB TYR B 124 2.781 10.088 14.725 1.00 33.22 C ATOM 1490 CG TYR B 124 3.040 9.291 16.000 1.00 34.35 C ATOM 1491 CD1 TYR B 124 2.305 9.540 17.165 1.00 34.83 C ATOM 1492 CD2 TYR B 124 4.016 8.306 16.038 1.00 34.37 C ATOM 1493 CE1 TYR B 124 2.528 8.800 18.339 1.00 33.61 C ATOM 1494 CE2 TYR B 124 4.253 7.564 17.198 1.00 36.17 C ATOM 1495 CZ TYR B 124 3.506 7.818 18.350 1.00 34.26 C ATOM 1496 OH TYR B 124 3.764 7.098 19.494 1.00 34.70 O ATOM 1497 HA TYR B 124 3.052 12.112 15.358 1.00 0.00 H ATOM 1498 HB3 TYR B 124 3.088 9.481 13.874 1.00 0.00 H ATOM 1499 HB2 TYR B 124 1.712 10.290 14.659 1.00 0.00 H ATOM 1500 HD2 TYR B 124 4.610 8.107 15.146 1.00 0.00 H ATOM 1501 HE2 TYR B 124 5.019 6.789 17.204 1.00 0.00 H ATOM 1502 HE1 TYR B 124 1.937 8.997 19.233 1.00 0.00 H ATOM 1503 HD1 TYR B 124 1.546 10.322 17.162 1.00 0.00 H ATOM 1504 HH TYR B 124 3.172 7.387 20.193 1.00 0.00 H ATOM 1505 H TYR B 124 4.210 11.624 12.639 1.00 0.00 H ATOM 1506 N GLU B 125 5.447 11.822 16.164 1.00 32.42 N ATOM 1507 CA GLU B 125 6.837 11.656 16.595 1.00 32.64 C ATOM 1508 C GLU B 125 7.011 10.431 17.479 1.00 32.72 C ATOM 1509 O GLU B 125 6.099 10.042 18.177 1.00 31.86 O ATOM 1510 CB GLU B 125 7.333 12.859 17.377 1.00 33.15 C ATOM 1511 CG GLU B 125 7.034 14.217 16.806 1.00 33.53 C ATOM 1512 CD GLU B 125 7.713 15.273 17.641 1.00 33.44 C ATOM 1513 OE1 GLU B 125 8.957 15.209 17.724 1.00 34.25 O ATOM 1514 OE2 GLU B 125 7.009 16.137 18.219 1.00 34.28 O ATOM 1515 HA GLU B 125 7.417 11.542 15.679 1.00 0.00 H ATOM 1516 HB2 GLU B 125 6.884 12.814 18.369 1.00 0.00 H ATOM 1517 HB3 GLU B 125 8.416 12.770 17.465 1.00 0.00 H ATOM 1518 HG2 GLU B 125 7.403 14.270 15.782 1.00 0.00 H ATOM 1519 HG3 GLU B 125 5.957 14.385 16.812 1.00 0.00 H ATOM 1520 H GLU B 125 4.803 12.365 16.738 1.00 0.00 H ATOM 1521 N ALA B 126 8.193 9.827 17.446 1.00 33.19 N ATOM 1522 CA ALA B 126 8.435 8.633 18.227 1.00 34.15 C ATOM 1523 C ALA B 126 9.893 8.587 18.666 1.00 34.64 C ATOM 1524 O ALA B 126 10.742 9.171 18.023 1.00 35.58 O ATOM 1525 CB ALA B 126 8.056 7.384 17.442 1.00 34.00 C ATOM 1526 HA ALA B 126 7.807 8.662 19.117 1.00 0.00 H ATOM 1527 HB1 ALA B 126 6.998 7.426 17.184 1.00 0.00 H ATOM 1528 HB2 ALA B 126 8.652 7.334 16.531 1.00 0.00 H ATOM 1529 HB3 ALA B 126 8.248 6.501 18.052 1.00 0.00 H ATOM 1530 H ALA B 126 8.939 10.209 16.864 1.00 0.00 H ATOM 1531 N ASP B 127 10.140 7.903 19.784 1.00 35.17 N ATOM 1532 CA ASP B 127 11.458 7.780 20.411 1.00 35.19 C ATOM 1533 C ASP B 127 12.291 6.672 19.765 1.00 36.05 C ATOM 1534 O ASP B 127 13.522 6.644 19.871 1.00 35.94 O ATOM 1535 CB ASP B 127 11.280 7.463 21.895 1.00 35.15 C ATOM 1536 CG ASP B 127 10.699 8.621 22.674 1.00 34.21 C ATOM 1537 OD1 ASP B 127 10.822 9.766 22.218 1.00 33.01 O ATOM 1538 OD2 ASP B 127 10.134 8.387 23.754 1.00 31.94 O ATOM 1539 HA ASP B 127 11.984 8.725 20.276 1.00 0.00 H ATOM 1540 HB2 ASP B 127 10.612 6.607 21.991 1.00 0.00 H ATOM 1541 HB3 ASP B 127 12.253 7.212 22.317 1.00 0.00 H ATOM 1542 H ASP B 127 9.355 7.432 20.234 1.00 0.00 H ATOM 1543 N PHE B 128 11.595 5.765 19.095 1.00 36.72 N ATOM 1544 CA PHE B 128 12.209 4.725 18.335 1.00 37.12 C ATOM 1545 C PHE B 128 11.229 4.300 17.251 1.00 37.29 C ATOM 1546 O PHE B 128 10.067 4.741 17.226 1.00 36.74 O ATOM 1547 CB PHE B 128 12.583 3.539 19.264 1.00 37.64 C ATOM 1548 CG PHE B 128 11.390 2.782 19.850 1.00 37.57 C ATOM 1549 CD1 PHE B 128 10.633 3.330 20.876 1.00 36.67 C ATOM 1550 CD2 PHE B 128 11.088 1.493 19.414 1.00 37.50 C ATOM 1551 CE1 PHE B 128 9.568 2.637 21.422 1.00 38.43 C ATOM 1552 CE2 PHE B 128 10.013 0.783 19.947 1.00 37.26 C ATOM 1553 CZ PHE B 128 9.249 1.349 20.955 1.00 38.25 C ATOM 1554 HA PHE B 128 13.132 5.073 17.871 1.00 0.00 H ATOM 1555 HB2 PHE B 128 13.183 2.834 18.689 1.00 0.00 H ATOM 1556 HB3 PHE B 128 13.176 3.930 20.091 1.00 0.00 H ATOM 1557 HD2 PHE B 128 11.704 1.031 18.642 1.00 0.00 H ATOM 1558 HE2 PHE B 128 9.775 -0.213 19.573 1.00 0.00 H ATOM 1559 HZ PHE B 128 8.409 0.801 21.382 1.00 0.00 H ATOM 1560 HE1 PHE B 128 8.974 3.090 22.216 1.00 0.00 H ATOM 1561 HD1 PHE B 128 10.881 4.321 21.257 1.00 0.00 H ATOM 1562 H PHE B 128 10.577 5.812 19.124 1.00 0.00 H ATOM 1563 N ASP B 129 11.704 3.428 16.374 1.00 37.12 N ATOM 1564 CA ASP B 129 10.881 2.873 15.328 1.00 37.38 C ATOM 1565 C ASP B 129 9.918 1.910 15.954 1.00 37.79 C ATOM 1566 O ASP B 129 10.178 0.707 16.017 1.00 39.04 O ATOM 1567 CB ASP B 129 11.743 2.187 14.253 1.00 37.10 C ATOM 1568 CG ASP B 129 10.905 1.639 13.075 1.00 36.96 C ATOM 1569 OD1 ASP B 129 9.672 1.870 12.976 1.00 36.85 O ATOM 1570 OD2 ASP B 129 11.505 0.969 12.234 1.00 35.31 O ATOM 1571 HA ASP B 129 10.329 3.668 14.826 1.00 0.00 H ATOM 1572 HB2 ASP B 129 12.458 2.912 13.865 1.00 0.00 H ATOM 1573 HB3 ASP B 129 12.281 1.358 14.714 1.00 0.00 H ATOM 1574 H ASP B 129 12.680 3.141 16.441 1.00 0.00 H ATOM 1575 N SER B 130 8.788 2.446 16.394 1.00 37.93 N ATOM 1576 CA SER B 130 7.838 1.715 17.192 1.00 37.95 C ATOM 1577 C SER B 130 6.593 1.226 16.417 1.00 38.65 C ATOM 1578 O SER B 130 5.765 0.437 16.933 1.00 38.02 O ATOM 1579 CB SER B 130 7.430 2.649 18.330 1.00 38.52 C ATOM 1580 OG SER B 130 6.685 3.727 17.812 1.00 38.08 O ATOM 1581 HA SER B 130 8.309 0.798 17.547 1.00 0.00 H ATOM 1582 HB2 SER B 130 8.323 3.030 18.825 1.00 0.00 H ATOM 1583 HB3 SER B 130 6.823 2.100 19.050 1.00 0.00 H ATOM 1584 HG SER B 130 6.430 4.312 18.529 1.00 0.00 H ATOM 1585 H SER B 130 8.583 3.417 16.157 1.00 0.00 H ATOM 1586 N ALA B 131 6.436 1.679 15.175 1.00 38.72 N ATOM 1587 CA ALA B 131 5.205 1.388 14.467 1.00 39.20 C ATOM 1588 C ALA B 131 5.103 -0.100 14.074 1.00 39.25 C ATOM 1589 O ALA B 131 6.100 -0.778 13.865 1.00 38.46 O ATOM 1590 CB ALA B 131 5.062 2.298 13.221 1.00 39.63 C ATOM 1591 HA ALA B 131 4.380 1.599 15.148 1.00 0.00 H ATOM 1592 HB1 ALA B 131 5.051 3.342 13.534 1.00 0.00 H ATOM 1593 HB2 ALA B 131 5.904 2.128 12.550 1.00 0.00 H ATOM 1594 HB3 ALA B 131 4.131 2.062 12.705 1.00 0.00 H ATOM 1595 H ALA B 131 7.173 2.224 14.727 1.00 0.00 H ATOM 1596 N THR B 132 3.864 -0.560 13.992 1.00 39.12 N ATOM 1597 CA THR B 132 3.493 -1.921 13.664 1.00 39.78 C ATOM 1598 C THR B 132 2.242 -1.792 12.772 1.00 40.66 C ATOM 1599 O THR B 132 1.856 -0.678 12.394 1.00 40.35 O ATOM 1600 CB THR B 132 3.078 -2.685 14.931 1.00 39.77 C ATOM 1601 OG1 THR B 132 1.932 -2.039 15.526 1.00 39.75 O ATOM 1602 CG2 THR B 132 4.219 -2.756 15.936 1.00 39.30 C ATOM 1603 HA THR B 132 4.321 -2.449 13.190 1.00 0.00 H ATOM 1604 HB THR B 132 2.821 -3.706 14.649 1.00 0.00 H ATOM 1605 HG1 THR B 132 1.672 -2.516 16.318 1.00 0.00 H ATOM 1606 HG23 THR B 132 5.077 -3.245 15.475 1.00 0.00 H ATOM 1607 HG21 THR B 132 4.495 -1.747 16.242 1.00 0.00 H ATOM 1608 HG22 THR B 132 3.899 -3.327 16.808 1.00 0.00 H ATOM 1609 H THR B 132 3.108 0.099 14.175 1.00 0.00 H ATOM 1610 N LYS B 133 1.566 -2.902 12.488 1.00 41.57 N ATOM 1611 CA LYS B 133 0.377 -2.852 11.639 1.00 41.45 C ATOM 1612 C LYS B 133 -0.751 -2.085 12.277 1.00 41.73 C ATOM 1613 O LYS B 133 -1.451 -1.400 11.592 1.00 42.10 O ATOM 1614 CB LYS B 133 -0.106 -4.252 11.289 1.00 41.93 C ATOM 1615 HA LYS B 133 0.674 -2.330 10.730 1.00 0.00 H ATOM 1616 HB2 LYS B 133 0.682 -4.784 10.756 1.00 0.00 H ATOM 1617 HB3 LYS B 133 -0.353 -4.789 12.205 1.00 0.00 H ATOM 1618 H LYS B 133 1.880 -3.796 12.866 1.00 0.00 H ATOM 1619 N THR B 134 -0.908 -2.223 13.593 1.00 42.61 N ATOM 1620 CA THR B 134 -2.035 -1.696 14.379 1.00 42.14 C ATOM 1621 C THR B 134 -1.676 -0.436 15.201 1.00 41.11 C ATOM 1622 O THR B 134 -2.549 0.272 15.709 1.00 40.86 O ATOM 1623 CB THR B 134 -2.553 -2.825 15.364 1.00 43.01 C ATOM 1624 OG1 THR B 134 -1.432 -3.500 15.976 1.00 43.19 O ATOM 1625 CG2 THR B 134 -3.398 -3.865 14.608 1.00 42.96 C ATOM 1626 HA THR B 134 -2.807 -1.402 13.668 1.00 0.00 H ATOM 1627 HB THR B 134 -3.167 -2.347 16.128 1.00 0.00 H ATOM 1628 HG1 THR B 134 -1.756 -4.181 16.570 1.00 0.00 H ATOM 1629 HG23 THR B 134 -4.249 -3.369 14.140 1.00 0.00 H ATOM 1630 HG21 THR B 134 -2.786 -4.340 13.841 1.00 0.00 H ATOM 1631 HG22 THR B 134 -3.756 -4.620 15.309 1.00 0.00 H ATOM 1632 H THR B 134 -0.186 -2.737 14.098 1.00 0.00 H ATOM 1633 N PHE B 135 -0.392 -0.173 15.364 1.00 39.97 N ATOM 1634 CA PHE B 135 0.028 0.980 16.143 1.00 39.89 C ATOM 1635 C PHE B 135 0.989 1.853 15.346 1.00 38.43 C ATOM 1636 O PHE B 135 1.880 1.325 14.680 1.00 37.11 O ATOM 1637 CB PHE B 135 0.699 0.564 17.471 1.00 39.95 C ATOM 1638 CG PHE B 135 1.355 1.728 18.208 1.00 40.04 C ATOM 1639 CD1 PHE B 135 0.611 2.536 19.054 1.00 41.35 C ATOM 1640 CD2 PHE B 135 2.699 2.007 18.039 1.00 39.03 C ATOM 1641 CE1 PHE B 135 1.190 3.614 19.726 1.00 41.57 C ATOM 1642 CE2 PHE B 135 3.296 3.088 18.694 1.00 41.18 C ATOM 1643 CZ PHE B 135 2.528 3.900 19.549 1.00 41.69 C ATOM 1644 HA PHE B 135 -0.873 1.548 16.375 1.00 0.00 H ATOM 1645 HB2 PHE B 135 -0.060 0.127 18.120 1.00 0.00 H ATOM 1646 HB3 PHE B 135 1.463 -0.183 17.254 1.00 0.00 H ATOM 1647 HD2 PHE B 135 3.301 1.375 17.386 1.00 0.00 H ATOM 1648 HE2 PHE B 135 4.354 3.302 18.543 1.00 0.00 H ATOM 1649 HZ PHE B 135 2.985 4.745 20.065 1.00 0.00 H ATOM 1650 HE1 PHE B 135 0.585 4.230 20.391 1.00 0.00 H ATOM 1651 HD1 PHE B 135 -0.449 2.325 19.198 1.00 0.00 H ATOM 1652 H PHE B 135 0.308 -0.782 14.941 1.00 0.00 H ATOM 1653 N PRO B 136 0.828 3.190 15.438 1.00 38.37 N ATOM 1654 CA PRO B 136 -0.267 3.901 16.085 1.00 38.38 C ATOM 1655 C PRO B 136 -1.632 3.780 15.392 1.00 38.75 C ATOM 1656 O PRO B 136 -1.703 3.513 14.186 1.00 38.40 O ATOM 1657 CB PRO B 136 0.215 5.365 16.102 1.00 38.61 C ATOM 1658 CG PRO B 136 1.294 5.458 15.131 1.00 38.82 C ATOM 1659 CD PRO B 136 1.871 4.112 14.940 1.00 38.41 C ATOM 1660 HA PRO B 136 -0.462 3.475 17.069 1.00 0.00 H ATOM 1661 HD3 PRO B 136 2.078 3.927 13.886 1.00 0.00 H ATOM 1662 HD2 PRO B 136 2.790 4.001 15.515 1.00 0.00 H ATOM 1663 HG3 PRO B 136 2.062 6.139 15.499 1.00 0.00 H ATOM 1664 HG2 PRO B 136 0.905 5.829 14.183 1.00 0.00 H ATOM 1665 HB2 PRO B 136 -0.600 6.033 15.824 1.00 0.00 H ATOM 1666 HB3 PRO B 136 0.578 5.630 17.095 1.00 0.00 H ATOM 1667 N ASN B 137 -2.703 3.998 16.152 1.00 38.81 N ATOM 1668 CA ASN B 137 -4.036 3.938 15.587 1.00 40.29 C ATOM 1669 C ASN B 137 -4.136 4.813 14.331 1.00 40.03 C ATOM 1670 O ASN B 137 -3.667 5.965 14.277 1.00 40.03 O ATOM 1671 CB ASN B 137 -5.130 4.407 16.547 1.00 41.05 C ATOM 1672 CG ASN B 137 -5.067 3.732 17.894 1.00 44.81 C ATOM 1673 OD1 ASN B 137 -5.087 4.412 18.929 1.00 49.54 O ATOM 1674 ND2 ASN B 137 -4.978 2.401 17.901 1.00 46.22 N ATOM 1675 HA ASN B 137 -4.196 2.884 15.359 1.00 0.00 H ATOM 1676 HB2 ASN B 137 -5.026 5.482 16.693 1.00 0.00 H ATOM 1677 HB3 ASN B 137 -6.100 4.195 16.098 1.00 0.00 H ATOM 1678 HD22 ASN B 137 -4.965 1.886 17.021 1.00 0.00 H ATOM 1679 HD21 ASN B 137 -4.923 1.898 18.787 1.00 0.00 H ATOM 1680 H ASN B 137 -2.584 4.210 17.143 1.00 0.00 H ATOM 1681 N TRP B 138 -4.804 4.238 13.349 1.00 39.50 N ATOM 1682 CA TRP B 138 -5.016 4.834 12.048 1.00 38.75 C ATOM 1683 C TRP B 138 -6.090 5.883 12.147 1.00 39.03 C ATOM 1684 O TRP B 138 -7.169 5.727 11.592 1.00 38.70 O ATOM 1685 CB TRP B 138 -5.390 3.706 11.086 1.00 37.42 C ATOM 1686 CG TRP B 138 -4.258 2.733 10.999 1.00 35.69 C ATOM 1687 CD1 TRP B 138 -4.133 1.574 11.669 1.00 34.88 C ATOM 1688 CD2 TRP B 138 -3.051 2.894 10.244 1.00 35.62 C ATOM 1689 NE1 TRP B 138 -2.932 0.983 11.379 1.00 34.70 N ATOM 1690 CE2 TRP B 138 -2.258 1.765 10.484 1.00 34.53 C ATOM 1691 CE3 TRP B 138 -2.578 3.873 9.365 1.00 34.58 C ATOM 1692 CZ2 TRP B 138 -1.023 1.581 9.873 1.00 35.57 C ATOM 1693 CZ3 TRP B 138 -1.342 3.682 8.768 1.00 34.26 C ATOM 1694 CH2 TRP B 138 -0.586 2.557 9.028 1.00 34.00 C ATOM 1695 HA TRP B 138 -4.121 5.333 11.678 1.00 0.00 H ATOM 1696 HB2 TRP B 138 -6.281 3.196 11.452 1.00 0.00 H ATOM 1697 HB3 TRP B 138 -5.590 4.121 10.098 1.00 0.00 H ATOM 1698 HE1 TRP B 138 -2.595 0.102 11.768 1.00 0.00 H ATOM 1699 HD1 TRP B 138 -4.881 1.163 12.347 1.00 0.00 H ATOM 1700 HZ2 TRP B 138 -0.426 0.689 10.063 1.00 0.00 H ATOM 1701 HH2 TRP B 138 0.385 2.446 8.545 1.00 0.00 H ATOM 1702 HZ3 TRP B 138 -0.959 4.435 8.079 1.00 0.00 H ATOM 1703 HE3 TRP B 138 -3.167 4.765 9.154 1.00 0.00 H ATOM 1704 H TRP B 138 -5.197 3.312 13.518 1.00 0.00 H ATOM 1705 N MET B 139 -5.808 6.918 12.928 1.00 40.18 N ATOM 1706 CA MET B 139 -6.716 8.051 13.061 1.00 41.69 C ATOM 1707 C MET B 139 -6.068 9.272 13.661 1.00 40.81 C ATOM 1708 O MET B 139 -5.070 9.162 14.373 1.00 40.40 O ATOM 1709 CB MET B 139 -7.904 7.695 13.930 1.00 41.58 C ATOM 1710 CG MET B 139 -7.507 7.456 15.390 1.00 45.11 C ATOM 1711 SD MET B 139 -8.845 6.735 16.331 1.00 45.10 S ATOM 1712 CE MET B 139 -9.707 8.228 16.856 1.00 47.78 C ATOM 1713 HA MET B 139 -7.026 8.284 12.042 1.00 0.00 H ATOM 1714 HB2 MET B 139 -8.624 8.513 13.892 1.00 0.00 H ATOM 1715 HB3 MET B 139 -8.365 6.788 13.539 1.00 0.00 H ATOM 1716 HG2 MET B 139 -7.231 8.409 15.842 1.00 0.00 H ATOM 1717 HG3 MET B 139 -6.652 6.781 15.418 1.00 0.00 H ATOM 1718 HE1 MET B 139 -9.033 8.846 17.449 1.00 0.00 H ATOM 1719 HE2 MET B 139 -10.034 8.785 15.978 1.00 0.00 H ATOM 1720 HE3 MET B 139 -10.574 7.953 17.457 1.00 0.00 H ATOM 1721 H MET B 139 -4.932 6.921 13.450 1.00 0.00 H ATOM 1722 N GLU B 140 -6.632 10.441 13.377 1.00 40.89 N ATOM 1723 CA GLU B 140 -6.204 11.676 14.024 1.00 41.08 C ATOM 1724 C GLU B 140 -6.238 11.543 15.542 1.00 40.74 C ATOM 1725 O GLU B 140 -7.262 11.179 16.121 1.00 40.49 O ATOM 1726 CB GLU B 140 -7.083 12.847 13.579 1.00 40.61 C ATOM 1727 CG GLU B 140 -6.479 14.214 13.853 1.00 41.31 C ATOM 1728 CD GLU B 140 -7.361 15.348 13.367 1.00 42.66 C ATOM 1729 OE1 GLU B 140 -8.216 15.105 12.489 1.00 45.35 O ATOM 1730 OE2 GLU B 140 -7.200 16.483 13.863 1.00 44.62 O ATOM 1731 HA GLU B 140 -5.175 11.871 13.722 1.00 0.00 H ATOM 1732 HB2 GLU B 140 -7.256 12.757 12.507 1.00 0.00 H ATOM 1733 HB3 GLU B 140 -8.035 12.781 14.106 1.00 0.00 H ATOM 1734 HG2 GLU B 140 -6.331 14.322 14.928 1.00 0.00 H ATOM 1735 HG3 GLU B 140 -5.516 14.279 13.347 1.00 0.00 H ATOM 1736 H GLU B 140 -7.384 10.476 12.689 1.00 0.00 H ATOM 1737 N ASN B 141 -5.112 11.840 16.183 1.00 39.77 N ATOM 1738 CA ASN B 141 -4.916 11.500 17.587 1.00 39.13 C ATOM 1739 C ASN B 141 -4.791 9.995 17.803 1.00 38.18 C ATOM 1740 O ASN B 141 -5.731 9.344 18.260 1.00 39.09 O ATOM 1741 CB ASN B 141 -6.057 12.061 18.438 1.00 39.36 C ATOM 1742 CG ASN B 141 -5.796 11.924 19.925 1.00 39.54 C ATOM 1743 OD1 ASN B 141 -4.647 11.862 20.362 1.00 38.16 O ATOM 1744 ND2 ASN B 141 -6.865 11.875 20.712 1.00 41.81 N ATOM 1745 HA ASN B 141 -3.976 11.955 17.899 1.00 0.00 H ATOM 1746 HB2 ASN B 141 -6.183 13.117 18.201 1.00 0.00 H ATOM 1747 HB3 ASN B 141 -6.973 11.523 18.193 1.00 0.00 H ATOM 1748 HD22 ASN B 141 -7.799 11.930 20.307 1.00 0.00 H ATOM 1749 HD21 ASN B 141 -6.751 11.783 21.721 1.00 0.00 H ATOM 1750 H ASN B 141 -4.365 12.318 15.679 1.00 0.00 H ATOM 1751 N PRO B 142 -3.625 9.450 17.473 1.00 36.50 N ATOM 1752 CA PRO B 142 -2.352 10.027 17.914 1.00 35.60 C ATOM 1753 C PRO B 142 -1.665 10.805 16.796 1.00 35.18 C ATOM 1754 O PRO B 142 -0.666 11.482 17.040 1.00 35.07 O ATOM 1755 CB PRO B 142 -1.524 8.795 18.283 1.00 36.38 C ATOM 1756 CG PRO B 142 -2.071 7.711 17.424 1.00 36.16 C ATOM 1757 CD PRO B 142 -3.542 7.989 17.299 1.00 36.56 C ATOM 1758 HA PRO B 142 -2.479 10.737 18.731 1.00 0.00 H ATOM 1759 HD3 PRO B 142 -3.915 7.690 16.319 1.00 0.00 H ATOM 1760 HD2 PRO B 142 -4.105 7.470 18.075 1.00 0.00 H ATOM 1761 HG3 PRO B 142 -1.906 6.739 17.889 1.00 0.00 H ATOM 1762 HG2 PRO B 142 -1.597 7.728 16.443 1.00 0.00 H ATOM 1763 HB2 PRO B 142 -0.468 8.961 18.069 1.00 0.00 H ATOM 1764 HB3 PRO B 142 -1.646 8.550 19.338 1.00 0.00 H ATOM 1765 N TRP B 143 -2.201 10.705 15.584 1.00 33.70 N ATOM 1766 CA TRP B 143 -1.655 11.431 14.443 1.00 33.08 C ATOM 1767 C TRP B 143 -1.996 12.915 14.521 1.00 32.17 C ATOM 1768 O TRP B 143 -3.120 13.288 14.858 1.00 32.57 O ATOM 1769 CB TRP B 143 -2.178 10.840 13.132 1.00 31.09 C ATOM 1770 CG TRP B 143 -1.568 9.516 12.786 1.00 30.97 C ATOM 1771 CD1 TRP B 143 -2.106 8.282 13.008 1.00 29.15 C ATOM 1772 CD2 TRP B 143 -0.301 9.293 12.154 1.00 28.59 C ATOM 1773 NE1 TRP B 143 -1.254 7.305 12.554 1.00 29.40 N ATOM 1774 CE2 TRP B 143 -0.138 7.900 12.026 1.00 27.66 C ATOM 1775 CE3 TRP B 143 0.711 10.137 11.685 1.00 27.32 C ATOM 1776 CZ2 TRP B 143 0.995 7.331 11.448 1.00 27.34 C ATOM 1777 CZ3 TRP B 143 1.835 9.570 11.112 1.00 29.03 C ATOM 1778 CH2 TRP B 143 1.967 8.181 10.998 1.00 28.77 C ATOM 1779 HA TRP B 143 -0.570 11.328 14.470 1.00 0.00 H ATOM 1780 HB2 TRP B 143 -3.257 10.711 13.218 1.00 0.00 H ATOM 1781 HB3 TRP B 143 -1.960 11.541 12.326 1.00 0.00 H ATOM 1782 HE1 TRP B 143 -1.424 6.300 12.602 1.00 0.00 H ATOM 1783 HD1 TRP B 143 -3.072 8.098 13.478 1.00 0.00 H ATOM 1784 HZ2 TRP B 143 1.102 6.250 11.358 1.00 0.00 H ATOM 1785 HH2 TRP B 143 2.865 7.767 10.540 1.00 0.00 H ATOM 1786 HZ3 TRP B 143 2.632 10.216 10.743 1.00 0.00 H ATOM 1787 HE3 TRP B 143 0.616 11.220 11.769 1.00 0.00 H ATOM 1788 H TRP B 143 -3.015 10.105 15.448 1.00 0.00 H ATOM 1789 N VAL B 144 -1.018 13.759 14.207 1.00 32.24 N ATOM 1790 CA VAL B 144 -1.213 15.211 14.242 1.00 32.55 C ATOM 1791 C VAL B 144 -1.413 15.673 12.795 1.00 32.09 C ATOM 1792 O VAL B 144 -0.536 15.512 11.999 1.00 30.76 O ATOM 1793 CB VAL B 144 -0.007 15.968 14.930 1.00 32.40 C ATOM 1794 CG1 VAL B 144 -0.252 17.500 15.014 1.00 30.84 C ATOM 1795 CG2 VAL B 144 0.260 15.407 16.314 1.00 33.24 C ATOM 1796 HA VAL B 144 -2.085 15.451 14.850 1.00 0.00 H ATOM 1797 HB VAL B 144 0.870 15.806 14.304 1.00 0.00 H ATOM 1798 HG11 VAL B 144 -0.378 17.902 14.009 1.00 0.00 H ATOM 1799 HG12 VAL B 144 -1.152 17.691 15.598 1.00 0.00 H ATOM 1800 HG13 VAL B 144 0.602 17.978 15.494 1.00 0.00 H ATOM 1801 HG21 VAL B 144 -0.630 15.527 16.931 1.00 0.00 H ATOM 1802 HG22 VAL B 144 0.508 14.349 16.234 1.00 0.00 H ATOM 1803 HG23 VAL B 144 1.094 15.943 16.767 1.00 0.00 H ATOM 1804 H VAL B 144 -0.108 13.386 13.935 1.00 0.00 H ATOM 1805 N LYS B 145 -2.581 16.224 12.488 1.00 33.47 N ATOM 1806 CA LYS B 145 -2.900 16.750 11.149 1.00 34.50 C ATOM 1807 C LYS B 145 -2.033 17.935 10.831 1.00 34.99 C ATOM 1808 O LYS B 145 -1.943 18.872 11.625 1.00 35.34 O ATOM 1809 CB LYS B 145 -4.365 17.184 11.070 1.00 34.37 C ATOM 1810 CG LYS B 145 -4.906 17.372 9.648 1.00 35.01 C ATOM 1811 CD LYS B 145 -6.440 17.555 9.715 1.00 35.97 C ATOM 1812 CE LYS B 145 -7.063 17.860 8.343 1.00 38.62 C ATOM 1813 NZ LYS B 145 -8.512 17.307 8.234 1.00 40.83 N ATOM 1814 HA LYS B 145 -2.717 15.952 10.429 1.00 0.00 H ATOM 1815 HB2 LYS B 145 -4.971 16.425 11.566 1.00 0.00 H ATOM 1816 HB3 LYS B 145 -4.467 18.131 11.600 1.00 0.00 H ATOM 1817 HG2 LYS B 145 -4.451 18.254 9.197 1.00 0.00 H ATOM 1818 HG3 LYS B 145 -4.668 16.495 9.047 1.00 0.00 H ATOM 1819 HD2 LYS B 145 -6.884 16.638 10.104 1.00 0.00 H ATOM 1820 HD3 LYS B 145 -6.664 18.380 10.391 1.00 0.00 H ATOM 1821 HE2 LYS B 145 -6.450 17.402 7.567 1.00 0.00 H ATOM 1822 HE3 LYS B 145 -7.085 18.940 8.197 1.00 0.00 H ATOM 1823 HZ1 LYS B 145 -8.499 16.295 8.364 1.00 0.00 H ATOM 1824 HZ2 LYS B 145 -9.093 17.736 8.954 1.00 0.00 H ATOM 1825 HZ3 LYS B 145 -8.891 17.528 7.313 1.00 0.00 H ATOM 1826 H LYS B 145 -3.293 16.286 13.215 1.00 0.00 H ATOM 1827 N VAL B 146 -1.344 17.868 9.698 1.00 35.73 N ATOM 1828 CA VAL B 146 -0.574 19.006 9.197 1.00 35.78 C ATOM 1829 C VAL B 146 -1.531 19.890 8.390 1.00 35.51 C ATOM 1830 O VAL B 146 -1.738 21.052 8.725 1.00 35.77 O ATOM 1831 CB VAL B 146 0.654 18.573 8.377 1.00 36.15 C ATOM 1832 CG1 VAL B 146 1.276 19.772 7.638 1.00 35.83 C ATOM 1833 CG2 VAL B 146 1.696 17.881 9.290 1.00 35.49 C ATOM 1834 HA VAL B 146 -0.162 19.570 10.034 1.00 0.00 H ATOM 1835 HB VAL B 146 0.328 17.855 7.625 1.00 0.00 H ATOM 1836 HG11 VAL B 146 0.538 20.203 6.962 1.00 0.00 H ATOM 1837 HG12 VAL B 146 1.587 20.523 8.364 1.00 0.00 H ATOM 1838 HG13 VAL B 146 2.142 19.436 7.067 1.00 0.00 H ATOM 1839 HG21 VAL B 146 2.014 18.576 10.067 1.00 0.00 H ATOM 1840 HG22 VAL B 146 1.247 17.001 9.750 1.00 0.00 H ATOM 1841 HG23 VAL B 146 2.558 17.581 8.694 1.00 0.00 H ATOM 1842 H VAL B 146 -1.352 17.000 9.163 1.00 0.00 H ATOM 1843 N ASP B 147 -2.157 19.327 7.367 1.00 34.87 N ATOM 1844 CA ASP B 147 -3.065 20.083 6.532 1.00 34.76 C ATOM 1845 C ASP B 147 -3.778 19.145 5.590 1.00 34.47 C ATOM 1846 O ASP B 147 -3.310 18.033 5.345 1.00 34.16 O ATOM 1847 CB ASP B 147 -2.268 21.130 5.725 1.00 34.47 C ATOM 1848 CG ASP B 147 -3.140 22.299 5.210 1.00 36.64 C ATOM 1849 OD1 ASP B 147 -4.319 22.379 5.608 1.00 36.51 O ATOM 1850 OD2 ASP B 147 -2.644 23.132 4.387 1.00 36.57 O ATOM 1851 HA ASP B 147 -3.799 20.593 7.156 1.00 0.00 H ATOM 1852 HB2 ASP B 147 -1.485 21.538 6.365 1.00 0.00 H ATOM 1853 HB3 ASP B 147 -1.813 20.634 4.868 1.00 0.00 H ATOM 1854 H ASP B 147 -1.996 18.341 7.164 1.00 0.00 H ATOM 1855 N THR B 148 -4.912 19.608 5.074 1.00 34.96 N ATOM 1856 CA THR B 148 -5.578 19.024 3.899 1.00 34.80 C ATOM 1857 C THR B 148 -4.932 19.557 2.634 1.00 35.34 C ATOM 1858 O THR B 148 -4.800 20.762 2.497 1.00 36.31 O ATOM 1859 CB THR B 148 -7.009 19.393 3.874 1.00 33.87 C ATOM 1860 OG1 THR B 148 -7.627 18.856 5.032 1.00 34.07 O ATOM 1861 CG2 THR B 148 -7.723 18.816 2.642 1.00 34.86 C ATOM 1862 HA THR B 148 -5.480 17.940 3.956 1.00 0.00 H ATOM 1863 HB THR B 148 -7.082 20.480 3.840 1.00 0.00 H ATOM 1864 HG1 THR B 148 -7.533 17.901 5.030 1.00 0.00 H ATOM 1865 HG23 THR B 148 -7.264 19.215 1.738 1.00 0.00 H ATOM 1866 HG21 THR B 148 -7.633 17.730 2.647 1.00 0.00 H ATOM 1867 HG22 THR B 148 -8.776 19.095 2.670 1.00 0.00 H ATOM 1868 H THR B 148 -5.347 20.416 5.519 1.00 0.00 H ATOM 1869 N ILE B 149 -4.525 18.669 1.726 1.00 35.56 N ATOM 1870 CA ILE B 149 -3.751 19.045 0.544 1.00 35.26 C ATOM 1871 C ILE B 149 -4.634 18.895 -0.687 1.00 35.72 C ATOM 1872 O ILE B 149 -5.427 17.964 -0.804 1.00 35.49 O ATOM 1873 CB ILE B 149 -2.440 18.216 0.383 1.00 35.51 C ATOM 1874 CG1 ILE B 149 -1.677 18.071 1.721 1.00 34.63 C ATOM 1875 CG2 ILE B 149 -1.563 18.806 -0.707 1.00 35.15 C ATOM 1876 CD1 ILE B 149 -0.909 19.273 2.156 1.00 33.93 C ATOM 1877 HA ILE B 149 -3.437 20.082 0.665 1.00 0.00 H ATOM 1878 HB ILE B 149 -2.721 17.208 0.078 1.00 0.00 H ATOM 1879 HG12 ILE B 149 -2.404 17.837 2.499 1.00 0.00 H ATOM 1880 HG13 ILE B 149 -0.976 17.243 1.620 1.00 0.00 H ATOM 1881 HD11 ILE B 149 -0.162 19.518 1.401 1.00 0.00 H ATOM 1882 HD12 ILE B 149 -1.592 20.113 2.280 1.00 0.00 H ATOM 1883 HD13 ILE B 149 -0.413 19.063 3.104 1.00 0.00 H ATOM 1884 HG21 ILE B 149 -2.105 18.797 -1.653 1.00 0.00 H ATOM 1885 HG22 ILE B 149 -1.302 19.832 -0.446 1.00 0.00 H ATOM 1886 HG23 ILE B 149 -0.654 18.212 -0.802 1.00 0.00 H ATOM 1887 H ILE B 149 -4.764 17.687 1.862 1.00 0.00 H ATOM 1888 N ALA B 150 -4.521 19.878 -1.574 1.00 36.57 N ATOM 1889 CA ALA B 150 -5.269 19.935 -2.807 1.00 37.09 C ATOM 1890 C ALA B 150 -4.411 20.512 -3.882 1.00 37.24 C ATOM 1891 O ALA B 150 -3.516 21.284 -3.623 1.00 36.57 O ATOM 1892 CB ALA B 150 -6.537 20.776 -2.656 1.00 37.36 C ATOM 1893 HA ALA B 150 -5.568 18.920 -3.070 1.00 0.00 H ATOM 1894 HB1 ALA B 150 -7.173 20.338 -1.887 1.00 0.00 H ATOM 1895 HB2 ALA B 150 -6.266 21.792 -2.370 1.00 0.00 H ATOM 1896 HB3 ALA B 150 -7.074 20.796 -3.605 1.00 0.00 H ATOM 1897 H ALA B 150 -3.868 20.635 -1.372 1.00 0.00 H ATOM 1898 N ALA B 151 -4.689 20.083 -5.100 1.00 38.78 N ATOM 1899 CA ALA B 151 -4.120 20.667 -6.283 1.00 39.81 C ATOM 1900 C ALA B 151 -4.606 22.103 -6.480 1.00 40.63 C ATOM 1901 O ALA B 151 -5.811 22.366 -6.553 1.00 41.13 O ATOM 1902 CB ALA B 151 -4.499 19.828 -7.478 1.00 40.46 C ATOM 1903 HA ALA B 151 -3.036 20.693 -6.173 1.00 0.00 H ATOM 1904 HB1 ALA B 151 -4.115 18.816 -7.346 1.00 0.00 H ATOM 1905 HB2 ALA B 151 -5.585 19.797 -7.569 1.00 0.00 H ATOM 1906 HB3 ALA B 151 -4.070 20.266 -8.379 1.00 0.00 H ATOM 1907 H ALA B 151 -5.337 19.302 -5.205 1.00 0.00 H ATOM 1908 N ASP B 152 -3.659 23.024 -6.578 1.00 42.21 N ATOM 1909 CA ASP B 152 -3.931 24.380 -7.083 1.00 43.65 C ATOM 1910 C ASP B 152 -3.309 24.629 -8.494 1.00 44.63 C ATOM 1911 O ASP B 152 -2.917 23.684 -9.249 1.00 44.56 O ATOM 1912 CB ASP B 152 -3.287 25.422 -6.149 1.00 44.17 C ATOM 1913 CG ASP B 152 -1.764 25.399 -6.218 1.00 43.73 C ATOM 1914 OD1 ASP B 152 -1.232 24.694 -7.085 1.00 42.97 O ATOM 1915 OD2 ASP B 152 -1.103 26.095 -5.420 1.00 47.06 O ATOM 1916 HA ASP B 152 -5.016 24.472 -7.133 1.00 0.00 H ATOM 1917 HB2 ASP B 152 -3.636 26.414 -6.436 1.00 0.00 H ATOM 1918 HB3 ASP B 152 -3.595 25.212 -5.125 1.00 0.00 H ATOM 1919 H ASP B 152 -2.709 22.786 -6.294 1.00 0.00 H ATOM 1920 N GLU B 153 -3.189 25.918 -8.824 1.00 44.96 N ATOM 1921 CA GLU B 153 -3.151 26.346 -10.199 1.00 44.91 C ATOM 1922 C GLU B 153 -1.796 26.529 -10.762 1.00 43.97 C ATOM 1923 O GLU B 153 -1.682 27.073 -11.837 1.00 43.56 O ATOM 1924 CB GLU B 153 -3.902 27.654 -10.214 1.00 45.53 C ATOM 1925 CG GLU B 153 -5.323 27.489 -9.750 1.00 48.58 C ATOM 1926 CD GLU B 153 -6.220 26.866 -10.794 1.00 54.90 C ATOM 1927 OE1 GLU B 153 -7.460 26.864 -10.538 1.00 59.25 O ATOM 1928 OE2 GLU B 153 -5.703 26.386 -11.854 1.00 57.40 O ATOM 1929 HA GLU B 153 -3.589 25.571 -10.829 1.00 0.00 H ATOM 1930 HB2 GLU B 153 -3.395 28.359 -9.555 1.00 0.00 H ATOM 1931 HB3 GLU B 153 -3.906 28.047 -11.231 1.00 0.00 H ATOM 1932 HG2 GLU B 153 -5.327 26.853 -8.865 1.00 0.00 H ATOM 1933 HG3 GLU B 153 -5.720 28.471 -9.493 1.00 0.00 H ATOM 1934 H GLU B 153 -3.123 26.617 -8.084 1.00 0.00 H ATOM 1935 N SER B 154 -0.768 26.072 -10.054 1.00 43.49 N ATOM 1936 CA SER B 154 0.570 26.094 -10.606 1.00 44.25 C ATOM 1937 C SER B 154 0.989 24.675 -10.866 1.00 43.97 C ATOM 1938 O SER B 154 1.049 23.864 -9.946 1.00 45.89 O ATOM 1939 CB SER B 154 1.573 26.792 -9.675 1.00 44.30 C ATOM 1940 OG SER B 154 1.241 28.163 -9.561 1.00 44.42 O ATOM 1941 HA SER B 154 0.561 26.669 -11.532 1.00 0.00 H ATOM 1942 HB2 SER B 154 2.578 26.695 -10.086 1.00 0.00 H ATOM 1943 HB3 SER B 154 1.538 26.327 -8.690 1.00 0.00 H ATOM 1944 HG SER B 154 1.870 28.596 -8.979 1.00 0.00 H ATOM 1945 H SER B 154 -0.923 25.703 -9.116 1.00 0.00 H ATOM 1946 N PHE B 155 1.261 24.362 -12.121 1.00 43.01 N ATOM 1947 CA PHE B 155 1.630 22.999 -12.470 1.00 41.09 C ATOM 1948 C PHE B 155 2.186 22.873 -13.873 1.00 40.76 C ATOM 1949 O PHE B 155 2.129 23.800 -14.696 1.00 39.86 O ATOM 1950 CB PHE B 155 0.428 22.081 -12.287 1.00 39.97 C ATOM 1951 CG PHE B 155 -0.817 22.525 -13.031 1.00 38.38 C ATOM 1952 CD1 PHE B 155 -1.861 23.136 -12.364 1.00 35.37 C ATOM 1953 CD2 PHE B 155 -0.955 22.292 -14.405 1.00 36.00 C ATOM 1954 CE1 PHE B 155 -3.042 23.511 -13.049 1.00 34.06 C ATOM 1955 CE2 PHE B 155 -2.119 22.690 -15.089 1.00 35.65 C ATOM 1956 CZ PHE B 155 -3.157 23.301 -14.404 1.00 34.89 C ATOM 1957 HA PHE B 155 2.433 22.700 -11.797 1.00 0.00 H ATOM 1958 HB2 PHE B 155 0.701 21.087 -12.641 1.00 0.00 H ATOM 1959 HB3 PHE B 155 0.192 22.035 -11.224 1.00 0.00 H ATOM 1960 HD2 PHE B 155 -0.152 21.797 -14.951 1.00 0.00 H ATOM 1961 HE2 PHE B 155 -2.204 22.517 -16.162 1.00 0.00 H ATOM 1962 HZ PHE B 155 -4.057 23.613 -14.934 1.00 0.00 H ATOM 1963 HE1 PHE B 155 -3.865 23.969 -12.500 1.00 0.00 H ATOM 1964 HD1 PHE B 155 -1.774 23.332 -11.295 1.00 0.00 H ATOM 1965 H PHE B 155 1.212 25.078 -12.846 1.00 0.00 H ATOM 1966 N SER B 156 2.770 21.701 -14.097 1.00 41.56 N ATOM 1967 CA SER B 156 3.221 21.225 -15.415 1.00 40.86 C ATOM 1968 C SER B 156 2.263 20.133 -15.858 1.00 39.14 C ATOM 1969 O SER B 156 1.832 19.322 -15.063 1.00 38.85 O ATOM 1970 CB SER B 156 4.636 20.625 -15.319 1.00 41.86 C ATOM 1971 HA SER B 156 3.240 22.056 -16.120 1.00 0.00 H ATOM 1972 HB2 SER B 156 5.329 21.387 -14.962 1.00 0.00 H ATOM 1973 HB3 SER B 156 4.627 19.786 -14.624 1.00 0.00 H ATOM 1974 H SER B 156 2.917 21.086 -13.297 1.00 0.00 H ATOM 1975 N GLN B 157 1.908 20.145 -17.127 1.00 37.96 N ATOM 1976 CA GLN B 157 0.970 19.169 -17.664 1.00 36.53 C ATOM 1977 C GLN B 157 1.487 18.693 -19.004 1.00 35.45 C ATOM 1978 O GLN B 157 1.771 19.485 -19.873 1.00 34.94 O ATOM 1979 CB GLN B 157 -0.384 19.799 -17.849 1.00 35.94 C ATOM 1980 CG GLN B 157 -1.386 18.866 -18.441 1.00 35.54 C ATOM 1981 CD GLN B 157 -2.781 19.424 -18.369 1.00 32.16 C ATOM 1982 OE1 GLN B 157 -3.286 19.691 -17.276 1.00 33.78 O ATOM 1983 NE2 GLN B 157 -3.411 19.597 -19.518 1.00 25.28 N ATOM 1984 HA GLN B 157 0.877 18.332 -16.972 1.00 0.00 H ATOM 1985 HB2 GLN B 157 -0.749 20.130 -16.877 1.00 0.00 H ATOM 1986 HB3 GLN B 157 -0.279 20.660 -18.509 1.00 0.00 H ATOM 1987 HG2 GLN B 157 -1.130 18.690 -19.486 1.00 0.00 H ATOM 1988 HG3 GLN B 157 -1.355 17.922 -17.896 1.00 0.00 H ATOM 1989 HE22 GLN B 157 -2.947 19.360 -20.395 1.00 0.00 H ATOM 1990 HE21 GLN B 157 -4.361 19.968 -19.528 1.00 0.00 H ATOM 1991 H GLN B 157 2.299 20.854 -17.747 1.00 0.00 H ATOM 1992 N VAL B 158 1.578 17.395 -19.190 1.00 34.73 N ATOM 1993 CA VAL B 158 2.006 16.891 -20.504 1.00 34.91 C ATOM 1994 C VAL B 158 1.003 15.903 -20.997 1.00 34.47 C ATOM 1995 O VAL B 158 0.195 15.424 -20.246 1.00 34.80 O ATOM 1996 CB VAL B 158 3.404 16.227 -20.443 1.00 34.81 C ATOM 1997 CG1 VAL B 158 4.441 17.271 -20.072 1.00 34.74 C ATOM 1998 CG2 VAL B 158 3.413 15.079 -19.443 1.00 33.35 C ATOM 1999 HA VAL B 158 2.075 17.739 -21.186 1.00 0.00 H ATOM 2000 HB VAL B 158 3.646 15.815 -21.423 1.00 0.00 H ATOM 2001 HG11 VAL B 158 4.445 18.061 -20.823 1.00 0.00 H ATOM 2002 HG12 VAL B 158 4.196 17.695 -19.098 1.00 0.00 H ATOM 2003 HG13 VAL B 158 5.425 16.804 -20.029 1.00 0.00 H ATOM 2004 HG21 VAL B 158 3.160 15.459 -18.453 1.00 0.00 H ATOM 2005 HG22 VAL B 158 2.680 14.330 -19.744 1.00 0.00 H ATOM 2006 HG23 VAL B 158 4.405 14.629 -19.418 1.00 0.00 H ATOM 2007 H VAL B 158 1.355 16.747 -18.435 1.00 0.00 H ATOM 2008 N ASP B 159 1.066 15.580 -22.261 1.00 35.67 N ATOM 2009 CA ASP B 159 0.050 14.717 -22.855 1.00 36.72 C ATOM 2010 C ASP B 159 0.687 13.363 -23.098 1.00 36.48 C ATOM 2011 O ASP B 159 1.586 13.266 -23.931 1.00 37.69 O ATOM 2012 CB ASP B 159 -0.419 15.330 -24.154 1.00 37.72 C ATOM 2013 CG ASP B 159 -1.334 14.438 -24.910 1.00 41.02 C ATOM 2014 OD1 ASP B 159 -2.538 14.347 -24.518 1.00 38.75 O ATOM 2015 OD2 ASP B 159 -0.821 13.864 -25.919 1.00 48.06 O ATOM 2016 HA ASP B 159 -0.813 14.606 -22.199 1.00 0.00 H ATOM 2017 HB2 ASP B 159 -0.942 16.260 -23.932 1.00 0.00 H ATOM 2018 HB3 ASP B 159 0.452 15.543 -24.774 1.00 0.00 H ATOM 2019 H ASP B 159 1.830 15.933 -22.837 1.00 0.00 H ATOM 2020 N LEU B 160 0.230 12.339 -22.385 1.00 35.18 N ATOM 2021 CA LEU B 160 0.736 10.985 -22.577 1.00 35.01 C ATOM 2022 C LEU B 160 -0.167 10.187 -23.511 1.00 34.98 C ATOM 2023 O LEU B 160 -0.832 9.240 -23.088 1.00 33.75 O ATOM 2024 CB LEU B 160 0.869 10.267 -21.232 1.00 34.60 C ATOM 2025 CG LEU B 160 1.754 10.946 -20.186 1.00 34.98 C ATOM 2026 CD1 LEU B 160 1.992 10.021 -19.002 1.00 35.25 C ATOM 2027 CD2 LEU B 160 3.074 11.386 -20.801 1.00 35.23 C ATOM 2028 HA LEU B 160 1.721 11.059 -23.037 1.00 0.00 H ATOM 2029 HB2 LEU B 160 -0.130 10.168 -20.808 1.00 0.00 H ATOM 2030 HB3 LEU B 160 1.281 9.276 -21.423 1.00 0.00 H ATOM 2031 HG LEU B 160 1.235 11.834 -19.825 1.00 0.00 H ATOM 2032 HD21 LEU B 160 3.598 10.515 -21.195 1.00 0.00 H ATOM 2033 HD22 LEU B 160 2.880 12.091 -21.609 1.00 0.00 H ATOM 2034 HD23 LEU B 160 3.687 11.866 -20.038 1.00 0.00 H ATOM 2035 HD11 LEU B 160 1.036 9.766 -18.544 1.00 0.00 H ATOM 2036 HD12 LEU B 160 2.486 9.112 -19.346 1.00 0.00 H ATOM 2037 HD13 LEU B 160 2.624 10.525 -18.270 1.00 0.00 H ATOM 2038 H LEU B 160 -0.493 12.504 -21.685 1.00 0.00 H ATOM 2039 N GLY B 161 -0.186 10.574 -24.782 1.00 35.93 N ATOM 2040 CA GLY B 161 -0.937 9.848 -25.789 1.00 36.36 C ATOM 2041 C GLY B 161 -2.432 10.065 -25.666 1.00 36.34 C ATOM 2042 O GLY B 161 -3.225 9.169 -25.955 1.00 38.16 O ATOM 2043 HA3 GLY B 161 -0.728 8.784 -25.682 1.00 0.00 H ATOM 2044 HA2 GLY B 161 -0.615 10.183 -26.775 1.00 0.00 H ATOM 2045 H GLY B 161 0.341 11.403 -25.057 1.00 0.00 H ATOM 2046 N GLY B 162 -2.818 11.262 -25.235 1.00 36.39 N ATOM 2047 CA GLY B 162 -4.221 11.601 -25.083 1.00 36.34 C ATOM 2048 C GLY B 162 -4.693 11.485 -23.647 1.00 36.34 C ATOM 2049 O GLY B 162 -5.885 11.603 -23.364 1.00 36.82 O ATOM 2050 HA3 GLY B 162 -4.813 10.927 -25.702 1.00 0.00 H ATOM 2051 HA2 GLY B 162 -4.372 12.627 -25.419 1.00 0.00 H ATOM 2052 H GLY B 162 -2.110 11.960 -25.005 1.00 0.00 H ATOM 2053 N ARG B 163 -3.753 11.252 -22.737 1.00 36.32 N ATOM 2054 CA ARG B 163 -4.020 11.381 -21.309 1.00 35.55 C ATOM 2055 C ARG B 163 -3.004 12.301 -20.639 1.00 33.81 C ATOM 2056 O ARG B 163 -1.796 12.144 -20.820 1.00 32.05 O ATOM 2057 CB ARG B 163 -4.010 10.008 -20.636 1.00 36.25 C ATOM 2058 CG ARG B 163 -4.879 8.971 -21.328 1.00 39.37 C ATOM 2059 CD ARG B 163 -5.336 7.895 -20.356 1.00 43.95 C ATOM 2060 NE ARG B 163 -5.298 6.564 -20.955 1.00 46.26 N ATOM 2061 CZ ARG B 163 -4.182 5.880 -21.183 1.00 50.92 C ATOM 2062 NH1 ARG B 163 -3.005 6.400 -20.862 1.00 53.58 N ATOM 2063 NH2 ARG B 163 -4.242 4.674 -21.732 1.00 51.62 N ATOM 2064 HA ARG B 163 -5.009 11.824 -21.194 1.00 0.00 H ATOM 2065 HB2 ARG B 163 -2.984 9.641 -20.622 1.00 0.00 H ATOM 2066 HB3 ARG B 163 -4.366 10.126 -19.613 1.00 0.00 H ATOM 2067 HG2 ARG B 163 -5.755 9.465 -21.749 1.00 0.00 H ATOM 2068 HG3 ARG B 163 -4.306 8.505 -22.130 1.00 0.00 H ATOM 2069 HD2 ARG B 163 -6.358 8.112 -20.045 1.00 0.00 H ATOM 2070 HD3 ARG B 163 -4.682 7.907 -19.484 1.00 0.00 H ATOM 2071 HE ARG B 163 -6.185 6.132 -21.215 1.00 0.00 H ATOM 2072 HH12 ARG B 163 -2.150 5.873 -21.038 1.00 0.00 H ATOM 2073 HH11 ARG B 163 -2.955 7.327 -20.439 1.00 0.00 H ATOM 2074 HH22 ARG B 163 -3.385 4.150 -21.907 1.00 0.00 H ATOM 2075 HH21 ARG B 163 -5.146 4.271 -21.980 1.00 0.00 H ATOM 2076 H ARG B 163 -2.821 10.976 -23.045 1.00 0.00 H ATOM 2077 N VAL B 164 -3.502 13.260 -19.866 1.00 32.76 N ATOM 2078 CA VAL B 164 -2.660 14.238 -19.242 1.00 33.51 C ATOM 2079 C VAL B 164 -2.328 13.778 -17.847 1.00 33.56 C ATOM 2080 O VAL B 164 -3.196 13.591 -17.061 1.00 34.53 O ATOM 2081 CB VAL B 164 -3.225 15.703 -19.310 1.00 32.21 C ATOM 2082 CG1 VAL B 164 -3.765 16.032 -20.598 1.00 32.46 C ATOM 2083 CG2 VAL B 164 -4.211 15.948 -18.325 1.00 32.83 C ATOM 2084 HA VAL B 164 -1.734 14.309 -19.813 1.00 0.00 H ATOM 2085 HB VAL B 164 -2.363 16.343 -19.119 1.00 0.00 H ATOM 2086 HG11 VAL B 164 -2.983 15.941 -21.352 1.00 0.00 H ATOM 2087 HG12 VAL B 164 -4.581 15.349 -20.834 1.00 0.00 H ATOM 2088 HG13 VAL B 164 -4.139 17.056 -20.583 1.00 0.00 H ATOM 2089 HG21 VAL B 164 -5.044 15.259 -18.467 1.00 0.00 H ATOM 2090 HG22 VAL B 164 -3.779 15.799 -17.335 1.00 0.00 H ATOM 2091 HG23 VAL B 164 -4.567 16.974 -18.417 1.00 0.00 H ATOM 2092 H VAL B 164 -4.510 13.301 -19.713 1.00 0.00 H ATOM 2093 N MET B 165 -1.045 13.542 -17.704 1.00 20.00 N ATOM 2094 CA MET B 165 -0.192 13.972 -16.643 1.00 20.00 C ATOM 2095 C MET B 165 -0.071 15.419 -16.262 1.00 20.00 C ATOM 2096 O MET B 165 0.535 16.213 -16.934 1.00 20.00 O ATOM 2097 CB MET B 165 1.070 13.177 -16.605 1.00 20.00 C ATOM 2098 CG MET B 165 1.461 12.907 -15.207 1.00 20.00 C ATOM 2099 SD MET B 165 2.823 11.902 -15.120 1.00 20.00 S ATOM 2100 CE MET B 165 4.000 12.869 -15.981 1.00 20.00 C ATOM 2101 HA MET B 165 -0.807 13.729 -15.776 1.00 0.00 H ATOM 2102 HB2 MET B 165 0.916 12.232 -17.125 1.00 0.00 H ATOM 2103 HB3 MET B 165 1.864 13.737 -17.099 1.00 0.00 H ATOM 2104 HG2 MET B 165 0.630 12.422 -14.695 1.00 0.00 H ATOM 2105 HG3 MET B 165 1.687 13.853 -14.714 1.00 0.00 H ATOM 2106 HE1 MET B 165 3.650 13.044 -16.998 1.00 0.00 H ATOM 2107 HE2 MET B 165 4.128 13.823 -15.470 1.00 0.00 H ATOM 2108 HE3 MET B 165 4.953 12.340 -16.009 1.00 0.00 H ATOM 2109 H MET B 165 -0.605 12.986 -18.437 1.00 0.00 H ATOM 2110 N LYS B 166 -0.584 15.695 -15.088 1.00 34.67 N ATOM 2111 CA LYS B 166 -0.393 16.925 -14.385 1.00 35.34 C ATOM 2112 C LYS B 166 0.180 16.715 -12.972 1.00 35.30 C ATOM 2113 O LYS B 166 -0.419 16.065 -12.173 1.00 35.24 O ATOM 2114 CB LYS B 166 -1.729 17.635 -14.340 1.00 34.63 C ATOM 2115 CG LYS B 166 -1.827 18.620 -13.272 1.00 34.59 C ATOM 2116 CD LYS B 166 -2.784 19.631 -13.615 1.00 34.61 C ATOM 2117 CE LYS B 166 -4.052 19.414 -12.975 1.00 35.12 C ATOM 2118 NZ LYS B 166 -5.032 20.263 -13.583 1.00 38.76 N ATOM 2119 HA LYS B 166 0.346 17.531 -14.909 1.00 0.00 H ATOM 2120 HB2 LYS B 166 -1.883 18.142 -15.293 1.00 0.00 H ATOM 2121 HB3 LYS B 166 -2.511 16.890 -14.196 1.00 0.00 H ATOM 2122 HG2 LYS B 166 -2.140 18.125 -12.353 1.00 0.00 H ATOM 2123 HG3 LYS B 166 -0.852 19.084 -13.119 1.00 0.00 H ATOM 2124 HD2 LYS B 166 -2.396 20.602 -13.307 1.00 0.00 H ATOM 2125 HD3 LYS B 166 -2.930 19.626 -14.695 1.00 0.00 H ATOM 2126 HE2 LYS B 166 -3.971 19.650 -11.914 1.00 0.00 H ATOM 2127 HE3 LYS B 166 -4.348 18.371 -13.093 1.00 0.00 H ATOM 2128 HZ1 LYS B 166 -4.752 21.237 -13.472 1.00 0.00 H ATOM 2129 HZ2 LYS B 166 -5.104 20.040 -14.576 1.00 0.00 H ATOM 2130 HZ3 LYS B 166 -5.935 20.114 -13.133 1.00 0.00 H ATOM 2131 H LYS B 166 -1.161 14.981 -14.644 1.00 0.00 H ATOM 2132 N ILE B 167 1.338 17.276 -12.680 1.00 35.30 N ATOM 2133 CA ILE B 167 1.961 17.144 -11.368 1.00 35.55 C ATOM 2134 C ILE B 167 2.004 18.431 -10.520 1.00 36.04 C ATOM 2135 O ILE B 167 2.750 19.329 -10.832 1.00 35.31 O ATOM 2136 CB ILE B 167 3.367 16.611 -11.491 1.00 34.85 C ATOM 2137 CG1 ILE B 167 3.377 15.227 -12.090 1.00 34.85 C ATOM 2138 CG2 ILE B 167 4.032 16.593 -10.198 1.00 35.51 C ATOM 2139 CD1 ILE B 167 4.697 14.735 -12.291 1.00 36.02 C ATOM 2140 HA ILE B 167 1.311 16.446 -10.841 1.00 0.00 H ATOM 2141 HB ILE B 167 3.911 17.281 -12.157 1.00 0.00 H ATOM 2142 HG12 ILE B 167 2.849 14.550 -11.418 1.00 0.00 H ATOM 2143 HG13 ILE B 167 2.864 15.257 -13.051 1.00 0.00 H ATOM 2144 HD11 ILE B 167 5.232 15.401 -12.968 1.00 0.00 H ATOM 2145 HD12 ILE B 167 5.217 14.693 -11.334 1.00 0.00 H ATOM 2146 HD13 ILE B 167 4.649 13.736 -12.724 1.00 0.00 H ATOM 2147 HG21 ILE B 167 4.075 17.606 -9.799 1.00 0.00 H ATOM 2148 HG22 ILE B 167 3.474 15.955 -9.513 1.00 0.00 H ATOM 2149 HG23 ILE B 167 5.043 16.204 -10.316 1.00 0.00 H ATOM 2150 H ILE B 167 1.815 17.822 -13.398 1.00 0.00 H ATOM 2151 N ASN B 168 1.246 18.485 -9.423 1.00 36.66 N ATOM 2152 CA ASN B 168 1.362 19.607 -8.476 1.00 36.71 C ATOM 2153 C ASN B 168 2.471 19.380 -7.450 1.00 36.40 C ATOM 2154 O ASN B 168 2.785 18.255 -7.113 1.00 37.14 O ATOM 2155 CB ASN B 168 0.068 19.871 -7.738 1.00 37.06 C ATOM 2156 CG ASN B 168 -1.115 20.081 -8.663 1.00 39.45 C ATOM 2157 OD1 ASN B 168 -1.581 19.140 -9.296 1.00 41.25 O ATOM 2158 ND2 ASN B 168 -1.661 21.306 -8.676 1.00 42.31 N ATOM 2159 HA ASN B 168 1.608 20.476 -9.086 1.00 0.00 H ATOM 2160 HB2 ASN B 168 -0.143 19.018 -7.093 1.00 0.00 H ATOM 2161 HB3 ASN B 168 0.193 20.765 -7.127 1.00 0.00 H ATOM 2162 HD22 ASN B 168 -1.238 22.059 -8.133 1.00 0.00 H ATOM 2163 HD21 ASN B 168 -2.499 21.485 -9.229 1.00 0.00 H ATOM 2164 H ASN B 168 0.576 17.738 -9.238 1.00 0.00 H ATOM 2165 N THR B 169 3.066 20.474 -6.991 1.00 35.63 N ATOM 2166 CA THR B 169 3.992 20.500 -5.877 1.00 34.79 C ATOM 2167 C THR B 169 3.445 21.404 -4.757 1.00 35.29 C ATOM 2168 O THR B 169 2.959 22.516 -4.991 1.00 35.34 O ATOM 2169 CB THR B 169 5.329 21.036 -6.321 1.00 34.10 C ATOM 2170 OG1 THR B 169 5.771 20.277 -7.448 1.00 32.81 O ATOM 2171 CG2 THR B 169 6.387 20.943 -5.201 1.00 32.52 C ATOM 2172 HA THR B 169 4.110 19.482 -5.507 1.00 0.00 H ATOM 2173 HB THR B 169 5.209 22.088 -6.578 1.00 0.00 H ATOM 2174 HG1 THR B 169 6.623 20.608 -7.741 1.00 0.00 H ATOM 2175 HG23 THR B 169 6.054 21.521 -4.339 1.00 0.00 H ATOM 2176 HG21 THR B 169 6.518 19.900 -4.912 1.00 0.00 H ATOM 2177 HG22 THR B 169 7.334 21.343 -5.564 1.00 0.00 H ATOM 2178 H THR B 169 2.857 21.358 -7.455 1.00 0.00 H ATOM 2179 N GLU B 170 3.569 20.935 -3.532 1.00 35.06 N ATOM 2180 CA GLU B 170 2.925 21.567 -2.419 1.00 35.80 C ATOM 2181 C GLU B 170 3.895 21.287 -1.292 1.00 35.91 C ATOM 2182 O GLU B 170 4.344 20.152 -1.141 1.00 36.54 O ATOM 2183 CB GLU B 170 1.565 20.880 -2.244 1.00 36.22 C ATOM 2184 CG GLU B 170 0.386 21.669 -1.781 1.00 38.71 C ATOM 2185 CD GLU B 170 0.252 23.054 -2.379 1.00 41.70 C ATOM 2186 OE1 GLU B 170 -0.250 23.209 -3.517 1.00 43.85 O ATOM 2187 OE2 GLU B 170 0.596 23.997 -1.658 1.00 43.01 O ATOM 2188 HA GLU B 170 2.722 22.635 -2.501 1.00 0.00 H ATOM 2189 HB2 GLU B 170 1.300 20.455 -3.212 1.00 0.00 H ATOM 2190 HB3 GLU B 170 1.709 20.075 -1.523 1.00 0.00 H ATOM 2191 HG2 GLU B 170 -0.514 21.107 -2.031 1.00 0.00 H ATOM 2192 HG3 GLU B 170 0.457 21.776 -0.699 1.00 0.00 H ATOM 2193 H GLU B 170 4.137 20.103 -3.372 1.00 0.00 H ATOM 2194 N VAL B 171 4.300 22.321 -0.557 1.00 35.34 N ATOM 2195 CA VAL B 171 5.112 22.146 0.622 1.00 34.64 C ATOM 2196 C VAL B 171 4.284 22.540 1.831 1.00 35.80 C ATOM 2197 O VAL B 171 3.396 23.417 1.754 1.00 33.31 O ATOM 2198 CB VAL B 171 6.442 22.960 0.575 1.00 34.60 C ATOM 2199 CG1 VAL B 171 7.282 22.677 1.810 1.00 35.39 C ATOM 2200 CG2 VAL B 171 7.269 22.586 -0.628 1.00 33.81 C ATOM 2201 HA VAL B 171 5.409 21.099 0.681 1.00 0.00 H ATOM 2202 HB VAL B 171 6.168 24.014 0.526 1.00 0.00 H ATOM 2203 HG11 VAL B 171 6.723 22.962 2.701 1.00 0.00 H ATOM 2204 HG12 VAL B 171 7.518 21.614 1.852 1.00 0.00 H ATOM 2205 HG13 VAL B 171 8.206 23.254 1.760 1.00 0.00 H ATOM 2206 HG21 VAL B 171 7.512 21.524 -0.584 1.00 0.00 H ATOM 2207 HG22 VAL B 171 6.702 22.793 -1.536 1.00 0.00 H ATOM 2208 HG23 VAL B 171 8.189 23.171 -0.631 1.00 0.00 H ATOM 2209 H VAL B 171 4.028 23.264 -0.836 1.00 0.00 H ATOM 2210 N ARG B 172 4.526 21.812 2.928 1.00 36.83 N ATOM 2211 CA ARG B 172 3.963 22.126 4.238 1.00 37.56 C ATOM 2212 C ARG B 172 5.032 21.917 5.298 1.00 38.52 C ATOM 2213 O ARG B 172 5.946 21.057 5.164 1.00 38.01 O ATOM 2214 CB ARG B 172 2.807 21.200 4.579 1.00 37.65 C ATOM 2215 CG ARG B 172 1.608 21.367 3.700 1.00 37.37 C ATOM 2216 CD ARG B 172 0.847 22.666 4.007 1.00 36.55 C ATOM 2217 NE ARG B 172 -0.366 22.721 3.187 1.00 34.72 N ATOM 2218 CZ ARG B 172 -0.369 23.046 1.899 1.00 34.07 C ATOM 2219 NH1 ARG B 172 0.748 23.378 1.274 1.00 33.74 N ATOM 2220 NH2 ARG B 172 -1.505 23.055 1.236 1.00 38.05 N ATOM 2221 HA ARG B 172 3.611 23.157 4.212 1.00 0.00 H ATOM 2222 HB2 ARG B 172 3.155 20.171 4.491 1.00 0.00 H ATOM 2223 HB3 ARG B 172 2.506 21.393 5.609 1.00 0.00 H ATOM 2224 HG2 ARG B 172 1.934 21.387 2.660 1.00 0.00 H ATOM 2225 HG3 ARG B 172 0.938 20.521 3.854 1.00 0.00 H ATOM 2226 HD2 ARG B 172 1.481 23.523 3.778 1.00 0.00 H ATOM 2227 HD3 ARG B 172 0.575 22.688 5.062 1.00 0.00 H ATOM 2228 HE ARG B 172 -1.257 22.497 3.630 1.00 0.00 H ATOM 2229 HH12 ARG B 172 0.725 23.624 0.284 1.00 0.00 H ATOM 2230 HH11 ARG B 172 1.633 23.388 1.781 1.00 0.00 H ATOM 2231 HH22 ARG B 172 -1.516 23.303 0.247 1.00 0.00 H ATOM 2232 HH21 ARG B 172 -2.375 22.814 1.711 1.00 0.00 H ATOM 2233 H ARG B 172 5.134 20.997 2.845 1.00 0.00 H ATOM 2234 N SER B 173 4.883 22.676 6.376 1.00 39.16 N ATOM 2235 CA SER B 173 5.824 22.608 7.475 1.00 39.83 C ATOM 2236 C SER B 173 5.113 22.301 8.785 1.00 40.12 C ATOM 2237 O SER B 173 3.900 22.489 8.930 1.00 40.40 O ATOM 2238 CB SER B 173 6.664 23.893 7.567 1.00 39.72 C ATOM 2239 OG SER B 173 5.867 25.063 7.566 1.00 40.57 O ATOM 2240 HA SER B 173 6.513 21.786 7.280 1.00 0.00 H ATOM 2241 HB2 SER B 173 7.341 23.930 6.714 1.00 0.00 H ATOM 2242 HB3 SER B 173 7.245 23.866 8.489 1.00 0.00 H ATOM 2243 HG SER B 173 6.434 25.835 7.625 1.00 0.00 H ATOM 2244 H SER B 173 4.092 23.318 6.432 1.00 0.00 H ATOM 2245 N PHE B 174 5.867 21.782 9.731 1.00 40.88 N ATOM 2246 CA PHE B 174 5.299 21.501 11.025 1.00 41.80 C ATOM 2247 C PHE B 174 6.391 21.476 12.047 1.00 42.15 C ATOM 2248 O PHE B 174 7.561 21.260 11.741 1.00 42.76 O ATOM 2249 CB PHE B 174 4.486 20.175 11.037 1.00 42.28 C ATOM 2250 CG PHE B 174 5.306 18.922 10.812 1.00 41.57 C ATOM 2251 CD1 PHE B 174 5.370 18.343 9.569 1.00 41.51 C ATOM 2252 CD2 PHE B 174 5.981 18.317 11.849 1.00 42.67 C ATOM 2253 CE1 PHE B 174 6.086 17.203 9.360 1.00 42.21 C ATOM 2254 CE2 PHE B 174 6.710 17.155 11.638 1.00 42.83 C ATOM 2255 CZ PHE B 174 6.760 16.609 10.392 1.00 42.78 C ATOM 2256 HA PHE B 174 4.592 22.294 11.269 1.00 0.00 H ATOM 2257 HB2 PHE B 174 3.993 20.088 12.006 1.00 0.00 H ATOM 2258 HB3 PHE B 174 3.732 20.232 10.251 1.00 0.00 H ATOM 2259 HD2 PHE B 174 5.942 18.756 12.846 1.00 0.00 H ATOM 2260 HE2 PHE B 174 7.239 16.682 12.465 1.00 0.00 H ATOM 2261 HZ PHE B 174 7.336 15.700 10.217 1.00 0.00 H ATOM 2262 HE1 PHE B 174 6.122 16.761 8.364 1.00 0.00 H ATOM 2263 HD1 PHE B 174 4.839 18.803 8.735 1.00 0.00 H ATOM 2264 H PHE B 174 6.850 21.579 9.549 1.00 0.00 H ATOM 2265 N GLY B 175 5.997 21.709 13.275 1.00 43.03 N ATOM 2266 CA GLY B 175 6.919 21.552 14.370 1.00 43.69 C ATOM 2267 C GLY B 175 6.624 22.438 15.564 1.00 44.33 C ATOM 2268 O GLY B 175 5.564 23.072 15.644 1.00 43.53 O ATOM 2269 HA3 GLY B 175 7.921 21.786 14.010 1.00 0.00 H ATOM 2270 HA2 GLY B 175 6.886 20.513 14.699 1.00 0.00 H ATOM 2271 H GLY B 175 5.037 22.002 13.455 1.00 0.00 H ATOM 2272 N PRO B 176 7.585 22.486 16.494 1.00 44.98 N ATOM 2273 CA PRO B 176 8.836 21.751 16.298 1.00 45.59 C ATOM 2274 C PRO B 176 8.855 20.452 17.075 1.00 45.42 C ATOM 2275 O PRO B 176 7.813 20.075 17.643 1.00 45.11 O ATOM 2276 CB PRO B 176 9.855 22.685 16.978 1.00 46.46 C ATOM 2277 CG PRO B 176 9.028 23.443 18.111 1.00 46.22 C ATOM 2278 CD PRO B 176 7.553 23.193 17.795 1.00 45.74 C ATOM 2279 HA PRO B 176 9.010 21.510 15.249 1.00 0.00 H ATOM 2280 HD3 PRO B 176 7.091 22.573 18.563 1.00 0.00 H ATOM 2281 HD2 PRO B 176 7.008 24.134 17.713 1.00 0.00 H ATOM 2282 HG3 PRO B 176 9.245 24.511 18.088 1.00 0.00 H ATOM 2283 HG2 PRO B 176 9.278 23.044 19.094 1.00 0.00 H ATOM 2284 HB2 PRO B 176 10.669 22.109 17.418 1.00 0.00 H ATOM 2285 HB3 PRO B 176 10.262 23.396 16.260 1.00 0.00 H ATOM 2286 N VAL B 177 9.906 19.690 16.823 1.00 44.77 N ATOM 2287 CA VAL B 177 9.953 18.243 16.972 1.00 44.00 C ATOM 2288 C VAL B 177 11.133 17.972 17.887 1.00 43.00 C ATOM 2289 O VAL B 177 12.172 18.547 17.695 1.00 42.23 O ATOM 2290 CB VAL B 177 10.140 17.460 15.569 1.00 43.76 C ATOM 2291 CG1 VAL B 177 8.878 17.330 14.826 1.00 43.52 C ATOM 2292 CG2 VAL B 177 11.168 18.073 14.688 1.00 44.66 C ATOM 2293 HA VAL B 177 9.008 17.879 17.375 1.00 0.00 H ATOM 2294 HB VAL B 177 10.487 16.466 15.853 1.00 0.00 H ATOM 2295 HG11 VAL B 177 8.159 16.775 15.428 1.00 0.00 H ATOM 2296 HG12 VAL B 177 8.482 18.322 14.608 1.00 0.00 H ATOM 2297 HG13 VAL B 177 9.060 16.797 13.893 1.00 0.00 H ATOM 2298 HG21 VAL B 177 10.882 19.099 14.457 1.00 0.00 H ATOM 2299 HG22 VAL B 177 12.131 18.069 15.198 1.00 0.00 H ATOM 2300 HG23 VAL B 177 11.242 17.499 13.765 1.00 0.00 H ATOM 2301 H VAL B 177 10.754 20.155 16.497 1.00 0.00 H ATOM 2302 N SER B 178 10.974 17.107 18.881 1.00 42.59 N ATOM 2303 CA SER B 178 11.971 16.981 19.937 1.00 42.00 C ATOM 2304 C SER B 178 12.591 15.587 19.947 1.00 41.98 C ATOM 2305 O SER B 178 13.659 15.377 20.522 1.00 42.10 O ATOM 2306 CB SER B 178 11.349 17.290 21.301 1.00 42.13 C ATOM 2307 OG SER B 178 9.949 17.073 21.284 1.00 41.07 O ATOM 2308 HA SER B 178 12.762 17.704 19.737 1.00 0.00 H ATOM 2309 HB2 SER B 178 11.545 18.332 21.554 1.00 0.00 H ATOM 2310 HB3 SER B 178 11.801 16.643 22.053 1.00 0.00 H ATOM 2311 HG SER B 178 9.585 17.274 22.149 1.00 0.00 H ATOM 2312 H SER B 178 10.140 16.520 18.906 1.00 0.00 H ATOM 2313 N ARG B 179 11.913 14.640 19.307 1.00 41.29 N ATOM 2314 CA ARG B 179 12.107 13.226 19.606 1.00 39.41 C ATOM 2315 C ARG B 179 12.952 12.546 18.533 1.00 39.54 C ATOM 2316 O ARG B 179 13.264 13.145 17.503 1.00 38.73 O ATOM 2317 CB ARG B 179 10.758 12.517 19.740 1.00 39.04 C ATOM 2318 CG ARG B 179 9.811 13.168 20.734 1.00 37.54 C ATOM 2319 CD ARG B 179 8.746 12.190 21.205 1.00 36.33 C ATOM 2320 NE ARG B 179 7.968 12.724 22.319 1.00 35.38 N ATOM 2321 CZ ARG B 179 8.179 12.413 23.594 1.00 33.63 C ATOM 2322 NH1 ARG B 179 9.149 11.570 23.921 1.00 33.78 N ATOM 2323 NH2 ARG B 179 7.422 12.947 24.543 1.00 33.63 N ATOM 2324 HA ARG B 179 12.640 13.156 20.554 1.00 0.00 H ATOM 2325 HB2 ARG B 179 10.276 12.510 18.762 1.00 0.00 H ATOM 2326 HB3 ARG B 179 10.940 11.492 20.062 1.00 0.00 H ATOM 2327 HG2 ARG B 179 10.383 13.513 21.596 1.00 0.00 H ATOM 2328 HG3 ARG B 179 9.326 14.019 20.257 1.00 0.00 H ATOM 2329 HD2 ARG B 179 9.231 11.268 21.524 1.00 0.00 H ATOM 2330 HD3 ARG B 179 8.072 11.976 20.375 1.00 0.00 H ATOM 2331 HE ARG B 179 7.214 13.377 22.105 1.00 0.00 H ATOM 2332 HH12 ARG B 179 9.310 11.332 24.900 1.00 0.00 H ATOM 2333 HH11 ARG B 179 9.734 11.159 23.194 1.00 0.00 H ATOM 2334 HH22 ARG B 179 7.585 12.707 25.521 1.00 0.00 H ATOM 2335 HH21 ARG B 179 6.676 13.597 24.295 1.00 0.00 H ATOM 2336 H ARG B 179 11.240 14.909 18.589 1.00 0.00 H ATOM 2337 N SER B 180 13.318 11.293 18.781 1.00 39.35 N ATOM 2338 CA SER B 180 14.330 10.618 17.978 1.00 39.59 C ATOM 2339 C SER B 180 13.972 10.652 16.496 1.00 38.82 C ATOM 2340 O SER B 180 14.850 10.736 15.637 1.00 38.99 O ATOM 2341 CB SER B 180 14.505 9.171 18.443 1.00 40.01 C ATOM 2342 OG SER B 180 14.636 8.292 17.339 1.00 43.00 O ATOM 2343 HA SER B 180 15.272 11.150 18.113 1.00 0.00 H ATOM 2344 HB2 SER B 180 13.635 8.878 19.030 1.00 0.00 H ATOM 2345 HB3 SER B 180 15.400 9.101 19.062 1.00 0.00 H ATOM 2346 HG SER B 180 15.404 8.543 16.821 1.00 0.00 H ATOM 2347 H SER B 180 12.880 10.791 19.553 1.00 0.00 H ATOM 2348 N GLY B 181 12.677 10.587 16.204 1.00 37.64 N ATOM 2349 CA GLY B 181 12.194 10.712 14.837 1.00 36.95 C ATOM 2350 C GLY B 181 10.685 10.819 14.735 1.00 36.29 C ATOM 2351 O GLY B 181 9.986 11.022 15.727 1.00 35.75 O ATOM 2352 HA3 GLY B 181 12.517 9.835 14.275 1.00 0.00 H ATOM 2353 HA2 GLY B 181 12.634 11.606 14.396 1.00 0.00 H ATOM 2354 H GLY B 181 12.004 10.446 16.958 1.00 0.00 H ATOM 2355 N PHE B 182 10.187 10.682 13.509 1.00 35.37 N ATOM 2356 CA PHE B 182 8.752 10.772 13.227 1.00 34.06 C ATOM 2357 C PHE B 182 8.383 9.992 11.951 1.00 33.88 C ATOM 2358 O PHE B 182 9.264 9.525 11.181 1.00 33.47 O ATOM 2359 CB PHE B 182 8.340 12.231 13.064 1.00 33.41 C ATOM 2360 CG PHE B 182 9.108 12.946 11.979 1.00 33.71 C ATOM 2361 CD1 PHE B 182 8.596 13.047 10.684 1.00 32.80 C ATOM 2362 CD2 PHE B 182 10.337 13.485 12.238 1.00 33.03 C ATOM 2363 CE1 PHE B 182 9.307 13.657 9.701 1.00 33.51 C ATOM 2364 CE2 PHE B 182 11.052 14.123 11.242 1.00 34.00 C ATOM 2365 CZ PHE B 182 10.527 14.218 9.978 1.00 33.07 C ATOM 2366 HA PHE B 182 8.219 10.331 14.069 1.00 0.00 H ATOM 2367 HB2 PHE B 182 7.278 12.267 12.819 1.00 0.00 H ATOM 2368 HB3 PHE B 182 8.511 12.748 14.008 1.00 0.00 H ATOM 2369 HD2 PHE B 182 10.758 13.411 13.241 1.00 0.00 H ATOM 2370 HE2 PHE B 182 12.031 14.550 11.460 1.00 0.00 H ATOM 2371 HZ PHE B 182 11.079 14.739 9.195 1.00 0.00 H ATOM 2372 HE1 PHE B 182 8.906 13.701 8.688 1.00 0.00 H ATOM 2373 HD1 PHE B 182 7.614 12.631 10.459 1.00 0.00 H ATOM 2374 H PHE B 182 10.829 10.508 12.736 1.00 0.00 H ATOM 2375 N TYR B 183 7.072 9.869 11.747 1.00 33.35 N ATOM 2376 CA TYR B 183 6.491 9.234 10.573 1.00 32.53 C ATOM 2377 C TYR B 183 5.610 10.268 9.953 1.00 31.55 C ATOM 2378 O TYR B 183 5.085 11.121 10.696 1.00 30.80 O ATOM 2379 CB TYR B 183 5.577 8.078 10.979 1.00 32.99 C ATOM 2380 CG TYR B 183 6.258 6.952 11.713 1.00 33.70 C ATOM 2381 CD1 TYR B 183 6.767 5.842 11.014 1.00 34.77 C ATOM 2382 CD2 TYR B 183 6.373 6.977 13.094 1.00 31.85 C ATOM 2383 CE1 TYR B 183 7.381 4.814 11.668 1.00 33.65 C ATOM 2384 CE2 TYR B 183 6.974 5.949 13.774 1.00 34.85 C ATOM 2385 CZ TYR B 183 7.479 4.861 13.069 1.00 35.81 C ATOM 2386 OH TYR B 183 8.095 3.839 13.761 1.00 34.44 O ATOM 2387 HA TYR B 183 7.278 8.862 9.917 1.00 0.00 H ATOM 2388 HB3 TYR B 183 5.128 7.669 10.074 1.00 0.00 H ATOM 2389 HB2 TYR B 183 4.794 8.477 11.624 1.00 0.00 H ATOM 2390 HD2 TYR B 183 5.979 7.828 13.649 1.00 0.00 H ATOM 2391 HE2 TYR B 183 7.056 5.984 14.860 1.00 0.00 H ATOM 2392 HE1 TYR B 183 7.789 3.970 11.113 1.00 0.00 H ATOM 2393 HD1 TYR B 183 6.669 5.803 9.929 1.00 0.00 H ATOM 2394 HH TYR B 183 8.388 3.166 13.142 1.00 0.00 H ATOM 2395 H TYR B 183 6.439 10.241 12.455 1.00 0.00 H ATOM 2396 N LEU B 184 5.420 10.190 8.620 1.00 29.80 N ATOM 2397 CA LEU B 184 4.282 10.868 7.977 1.00 28.80 C ATOM 2398 C LEU B 184 3.162 9.888 7.597 1.00 28.58 C ATOM 2399 O LEU B 184 3.412 8.709 7.352 1.00 27.48 O ATOM 2400 CB LEU B 184 4.731 11.700 6.754 1.00 28.63 C ATOM 2401 CG LEU B 184 5.940 12.616 7.037 1.00 29.70 C ATOM 2402 CD1 LEU B 184 6.337 13.422 5.807 1.00 29.64 C ATOM 2403 CD2 LEU B 184 5.621 13.559 8.219 1.00 30.26 C ATOM 2404 HA LEU B 184 3.872 11.556 8.716 1.00 0.00 H ATOM 2405 HB2 LEU B 184 4.999 11.014 5.951 1.00 0.00 H ATOM 2406 HB3 LEU B 184 3.895 12.322 6.435 1.00 0.00 H ATOM 2407 HG LEU B 184 6.787 11.982 7.300 1.00 0.00 H ATOM 2408 HD21 LEU B 184 4.755 14.172 7.969 1.00 0.00 H ATOM 2409 HD22 LEU B 184 5.403 12.966 9.107 1.00 0.00 H ATOM 2410 HD23 LEU B 184 6.480 14.202 8.411 1.00 0.00 H ATOM 2411 HD11 LEU B 184 6.604 12.741 4.999 1.00 0.00 H ATOM 2412 HD12 LEU B 184 5.499 14.046 5.497 1.00 0.00 H ATOM 2413 HD13 LEU B 184 7.192 14.054 6.049 1.00 0.00 H ATOM 2414 H LEU B 184 6.074 9.654 8.049 1.00 0.00 H ATOM 2415 N ALA B 185 1.929 10.398 7.545 1.00 28.85 N ATOM 2416 CA ALA B 185 0.794 9.662 7.050 1.00 29.57 C ATOM 2417 C ALA B 185 -0.084 10.447 6.060 1.00 30.72 C ATOM 2418 O ALA B 185 -0.484 11.609 6.278 1.00 32.20 O ATOM 2419 CB ALA B 185 -0.074 9.164 8.199 1.00 29.15 C ATOM 2420 HA ALA B 185 1.220 8.822 6.501 1.00 0.00 H ATOM 2421 HB1 ALA B 185 0.516 8.510 8.841 1.00 0.00 H ATOM 2422 HB2 ALA B 185 -0.433 10.016 8.777 1.00 0.00 H ATOM 2423 HB3 ALA B 185 -0.924 8.612 7.798 1.00 0.00 H ATOM 2424 H ALA B 185 1.784 11.354 7.871 1.00 0.00 H ATOM 2425 N PHE B 186 -0.461 9.753 5.011 1.00 30.73 N ATOM 2426 CA PHE B 186 -1.296 10.314 3.992 1.00 30.38 C ATOM 2427 C PHE B 186 -2.631 9.594 4.062 1.00 29.96 C ATOM 2428 O PHE B 186 -2.654 8.407 4.077 1.00 31.60 O ATOM 2429 CB PHE B 186 -0.567 10.139 2.682 1.00 29.42 C ATOM 2430 CG PHE B 186 0.812 10.681 2.728 1.00 28.28 C ATOM 2431 CD1 PHE B 186 1.871 9.884 3.059 1.00 29.17 C ATOM 2432 CD2 PHE B 186 1.043 12.024 2.475 1.00 29.94 C ATOM 2433 CE1 PHE B 186 3.149 10.401 3.128 1.00 28.97 C ATOM 2434 CE2 PHE B 186 2.316 12.546 2.542 1.00 28.96 C ATOM 2435 CZ PHE B 186 3.367 11.723 2.864 1.00 29.31 C ATOM 2436 HA PHE B 186 -1.499 11.378 4.111 1.00 0.00 H ATOM 2437 HB2 PHE B 186 -0.518 9.076 2.447 1.00 0.00 H ATOM 2438 HB3 PHE B 186 -1.122 10.658 1.900 1.00 0.00 H ATOM 2439 HD2 PHE B 186 0.207 12.675 2.220 1.00 0.00 H ATOM 2440 HE2 PHE B 186 2.488 13.603 2.341 1.00 0.00 H ATOM 2441 HZ PHE B 186 4.379 12.126 2.909 1.00 0.00 H ATOM 2442 HE1 PHE B 186 3.985 9.754 3.393 1.00 0.00 H ATOM 2443 HD1 PHE B 186 1.705 8.828 3.271 1.00 0.00 H ATOM 2444 H PHE B 186 -0.150 8.786 4.919 1.00 0.00 H ATOM 2445 N GLN B 187 -3.733 10.324 4.153 1.00 30.44 N ATOM 2446 CA GLN B 187 -5.063 9.731 4.238 1.00 30.50 C ATOM 2447 C GLN B 187 -5.906 10.153 3.060 1.00 31.44 C ATOM 2448 O GLN B 187 -6.036 11.344 2.805 1.00 32.05 O ATOM 2449 CB GLN B 187 -5.760 10.180 5.522 1.00 30.04 C ATOM 2450 CG GLN B 187 -7.193 9.653 5.729 1.00 29.77 C ATOM 2451 CD GLN B 187 -7.937 10.424 6.801 1.00 29.10 C ATOM 2452 OE1 GLN B 187 -7.659 11.596 6.990 1.00 31.93 O ATOM 2453 NE2 GLN B 187 -8.892 9.783 7.500 1.00 26.30 N ATOM 2454 HA GLN B 187 -4.949 8.647 4.237 1.00 0.00 H ATOM 2455 HB2 GLN B 187 -5.156 9.845 6.365 1.00 0.00 H ATOM 2456 HB3 GLN B 187 -5.802 11.269 5.516 1.00 0.00 H ATOM 2457 HG2 GLN B 187 -7.739 9.741 4.790 1.00 0.00 H ATOM 2458 HG3 GLN B 187 -7.143 8.604 6.021 1.00 0.00 H ATOM 2459 HE22 GLN B 187 -9.092 8.801 7.309 1.00 0.00 H ATOM 2460 HE21 GLN B 187 -9.416 10.279 8.221 1.00 0.00 H ATOM 2461 H GLN B 187 -3.648 11.340 4.164 1.00 0.00 H ATOM 2462 N ASP B 188 -6.504 9.170 2.381 1.00 32.51 N ATOM 2463 CA ASP B 188 -7.493 9.378 1.292 1.00 32.78 C ATOM 2464 C ASP B 188 -8.864 8.958 1.785 1.00 32.59 C ATOM 2465 O ASP B 188 -9.012 8.090 2.633 1.00 33.01 O ATOM 2466 CB ASP B 188 -7.105 8.600 -0.002 1.00 33.03 C ATOM 2467 CG ASP B 188 -8.310 8.288 -0.913 1.00 34.16 C ATOM 2468 OD1 ASP B 188 -8.731 9.153 -1.732 1.00 36.53 O ATOM 2469 OD2 ASP B 188 -8.858 7.164 -0.805 1.00 38.02 O ATOM 2470 HA ASP B 188 -7.505 10.436 1.029 1.00 0.00 H ATOM 2471 HB2 ASP B 188 -6.391 9.201 -0.566 1.00 0.00 H ATOM 2472 HB3 ASP B 188 -6.637 7.659 0.287 1.00 0.00 H ATOM 2473 H ASP B 188 -6.265 8.210 2.627 1.00 0.00 H ATOM 2474 N TYR B 189 -9.877 9.600 1.249 1.00 33.14 N ATOM 2475 CA TYR B 189 -11.240 9.374 1.686 1.00 33.13 C ATOM 2476 C TYR B 189 -12.174 9.363 0.454 1.00 32.29 C ATOM 2477 O TYR B 189 -13.278 9.865 0.478 1.00 32.25 O ATOM 2478 CB TYR B 189 -11.622 10.387 2.785 1.00 33.78 C ATOM 2479 CG TYR B 189 -10.919 11.722 2.650 1.00 35.26 C ATOM 2480 CD1 TYR B 189 -11.315 12.663 1.704 1.00 35.75 C ATOM 2481 CD2 TYR B 189 -9.858 12.036 3.452 1.00 35.46 C ATOM 2482 CE1 TYR B 189 -10.660 13.899 1.576 1.00 35.05 C ATOM 2483 CE2 TYR B 189 -9.185 13.239 3.319 1.00 37.44 C ATOM 2484 CZ TYR B 189 -9.585 14.185 2.396 1.00 35.88 C ATOM 2485 OH TYR B 189 -8.873 15.387 2.329 1.00 35.21 O ATOM 2486 HA TYR B 189 -11.348 8.396 2.155 1.00 0.00 H ATOM 2487 HB3 TYR B 189 -11.365 9.958 3.754 1.00 0.00 H ATOM 2488 HB2 TYR B 189 -12.698 10.557 2.738 1.00 0.00 H ATOM 2489 HD2 TYR B 189 -9.535 11.325 4.212 1.00 0.00 H ATOM 2490 HE2 TYR B 189 -8.323 13.443 3.955 1.00 0.00 H ATOM 2491 HE1 TYR B 189 -10.997 14.626 0.837 1.00 0.00 H ATOM 2492 HD1 TYR B 189 -12.154 12.435 1.046 1.00 0.00 H ATOM 2493 HH TYR B 189 -9.256 15.947 1.650 1.00 0.00 H ATOM 2494 H TYR B 189 -9.699 10.275 0.506 1.00 0.00 H ATOM 2495 N GLY B 190 -11.715 8.728 -0.621 1.00 31.90 N ATOM 2496 CA GLY B 190 -12.585 8.434 -1.766 1.00 31.61 C ATOM 2497 C GLY B 190 -12.356 9.264 -3.017 1.00 31.20 C ATOM 2498 O GLY B 190 -13.309 9.580 -3.747 1.00 32.37 O ATOM 2499 HA3 GLY B 190 -13.616 8.589 -1.448 1.00 0.00 H ATOM 2500 HA2 GLY B 190 -12.442 7.387 -2.032 1.00 0.00 H ATOM 2501 H GLY B 190 -10.737 8.439 -0.650 1.00 0.00 H ATOM 2502 N GLY B 191 -11.101 9.602 -3.266 1.00 30.67 N ATOM 2503 CA GLY B 191 -10.693 10.179 -4.528 1.00 30.76 C ATOM 2504 C GLY B 191 -9.757 9.293 -5.317 1.00 30.65 C ATOM 2505 O GLY B 191 -9.636 8.094 -5.077 1.00 30.47 O ATOM 2506 HA3 GLY B 191 -10.189 11.125 -4.329 1.00 0.00 H ATOM 2507 HA2 GLY B 191 -11.584 10.363 -5.129 1.00 0.00 H ATOM 2508 H GLY B 191 -10.397 9.450 -2.543 1.00 0.00 H ATOM 2509 N CYS B 192 -9.038 9.925 -6.231 1.00 30.55 N ATOM 2510 CA CYS B 192 -8.310 9.231 -7.255 1.00 30.29 C ATOM 2511 C CYS B 192 -7.086 10.033 -7.536 1.00 30.10 C ATOM 2512 O CYS B 192 -7.196 11.068 -8.185 1.00 31.12 O ATOM 2513 CB CYS B 192 -9.185 9.131 -8.514 1.00 30.58 C ATOM 2514 SG CYS B 192 -8.577 7.954 -9.764 1.00 30.68 S ATOM 2515 HA CYS B 192 -8.041 8.222 -6.944 1.00 0.00 H ATOM 2516 HB2 CYS B 192 -9.237 10.119 -8.972 1.00 0.00 H ATOM 2517 HB3 CYS B 192 -10.185 8.820 -8.211 1.00 0.00 H ATOM 2518 H CYS B 192 -9.000 10.944 -6.207 1.00 0.00 H ATOM 2519 N MET B 193 -5.932 9.558 -7.065 1.00 29.52 N ATOM 2520 CA MET B 193 -4.733 10.321 -7.081 1.00 30.06 C ATOM 2521 C MET B 193 -3.529 9.442 -6.956 1.00 29.09 C ATOM 2522 O MET B 193 -3.618 8.289 -6.612 1.00 29.88 O ATOM 2523 CB MET B 193 -4.728 11.304 -5.909 1.00 31.04 C ATOM 2524 CG MET B 193 -4.588 10.661 -4.518 1.00 32.14 C ATOM 2525 SD MET B 193 -5.059 11.739 -3.126 1.00 33.94 S ATOM 2526 CE MET B 193 -6.822 11.867 -3.429 1.00 33.43 C ATOM 2527 HA MET B 193 -4.694 10.853 -8.032 1.00 0.00 H ATOM 2528 HB2 MET B 193 -3.894 11.992 -6.049 1.00 0.00 H ATOM 2529 HB3 MET B 193 -5.665 11.861 -5.931 1.00 0.00 H ATOM 2530 HG2 MET B 193 -3.547 10.368 -4.383 1.00 0.00 H ATOM 2531 HG3 MET B 193 -5.221 9.774 -4.489 1.00 0.00 H ATOM 2532 HE1 MET B 193 -6.989 12.308 -4.412 1.00 0.00 H ATOM 2533 HE2 MET B 193 -7.268 10.873 -3.395 1.00 0.00 H ATOM 2534 HE3 MET B 193 -7.276 12.497 -2.664 1.00 0.00 H ATOM 2535 H MET B 193 -5.909 8.614 -6.680 1.00 0.00 H ATOM 2536 N SER B 194 -2.387 10.033 -7.209 1.00 27.85 N ATOM 2537 CA SER B 194 -1.133 9.388 -7.034 1.00 27.69 C ATOM 2538 C SER B 194 -0.175 10.355 -6.343 1.00 28.29 C ATOM 2539 O SER B 194 0.013 11.522 -6.771 1.00 27.14 O ATOM 2540 CB SER B 194 -0.557 8.922 -8.377 1.00 28.15 C ATOM 2541 OG SER B 194 0.820 8.764 -8.224 1.00 25.46 O ATOM 2542 HA SER B 194 -1.270 8.501 -6.416 1.00 0.00 H ATOM 2543 HB2 SER B 194 -0.761 9.667 -9.146 1.00 0.00 H ATOM 2544 HB3 SER B 194 -1.009 7.973 -8.664 1.00 0.00 H ATOM 2545 HG SER B 194 1.211 9.603 -7.968 1.00 0.00 H ATOM 2546 H SER B 194 -2.399 10.996 -7.545 1.00 0.00 H ATOM 2547 N LEU B 195 0.383 9.862 -5.239 1.00 28.13 N ATOM 2548 CA LEU B 195 1.445 10.520 -4.540 1.00 28.43 C ATOM 2549 C LEU B 195 2.755 10.053 -5.147 1.00 28.69 C ATOM 2550 O LEU B 195 3.124 8.877 -5.009 1.00 28.34 O ATOM 2551 CB LEU B 195 1.354 10.192 -3.048 1.00 28.16 C ATOM 2552 CG LEU B 195 2.347 10.821 -2.090 1.00 28.88 C ATOM 2553 CD1 LEU B 195 2.196 12.333 -2.040 1.00 30.15 C ATOM 2554 CD2 LEU B 195 2.091 10.241 -0.721 1.00 29.47 C ATOM 2555 HA LEU B 195 1.377 11.604 -4.636 1.00 0.00 H ATOM 2556 HB2 LEU B 195 0.359 10.489 -2.716 1.00 0.00 H ATOM 2557 HB3 LEU B 195 1.460 9.111 -2.952 1.00 0.00 H ATOM 2558 HG LEU B 195 3.361 10.607 -2.429 1.00 0.00 H ATOM 2559 HD21 LEU B 195 1.070 10.471 -0.416 1.00 0.00 H ATOM 2560 HD22 LEU B 195 2.227 9.160 -0.754 1.00 0.00 H ATOM 2561 HD23 LEU B 195 2.791 10.675 -0.007 1.00 0.00 H ATOM 2562 HD11 LEU B 195 2.366 12.747 -3.034 1.00 0.00 H ATOM 2563 HD12 LEU B 195 1.189 12.586 -1.708 1.00 0.00 H ATOM 2564 HD13 LEU B 195 2.925 12.747 -1.343 1.00 0.00 H ATOM 2565 H LEU B 195 0.038 8.974 -4.874 1.00 0.00 H ATOM 2566 N ILE B 196 3.452 10.997 -5.805 1.00 28.84 N ATOM 2567 CA ILE B 196 4.605 10.763 -6.662 1.00 28.37 C ATOM 2568 C ILE B 196 5.946 10.899 -5.944 1.00 29.42 C ATOM 2569 O ILE B 196 6.899 10.147 -6.212 1.00 30.04 O ATOM 2570 CB ILE B 196 4.544 11.738 -7.881 1.00 28.18 C ATOM 2571 CG1 ILE B 196 3.406 11.368 -8.817 1.00 28.39 C ATOM 2572 CG2 ILE B 196 5.809 11.690 -8.695 1.00 28.55 C ATOM 2573 CD1 ILE B 196 3.054 12.404 -9.774 1.00 29.62 C ATOM 2574 HA ILE B 196 4.549 9.726 -6.993 1.00 0.00 H ATOM 2575 HB ILE B 196 4.399 12.735 -7.464 1.00 0.00 H ATOM 2576 HG12 ILE B 196 3.697 10.476 -9.372 1.00 0.00 H ATOM 2577 HG13 ILE B 196 2.526 11.148 -8.213 1.00 0.00 H ATOM 2578 HD11 ILE B 196 2.747 13.302 -9.238 1.00 0.00 H ATOM 2579 HD12 ILE B 196 3.919 12.630 -10.398 1.00 0.00 H ATOM 2580 HD13 ILE B 196 2.234 12.054 -10.401 1.00 0.00 H ATOM 2581 HG21 ILE B 196 6.654 11.975 -8.068 1.00 0.00 H ATOM 2582 HG22 ILE B 196 5.959 10.678 -9.071 1.00 0.00 H ATOM 2583 HG23 ILE B 196 5.727 12.382 -9.533 1.00 0.00 H ATOM 2584 H ILE B 196 3.145 11.963 -5.693 1.00 0.00 H ATOM 2585 N ALA B 197 6.040 11.869 -5.049 1.00 30.20 N ATOM 2586 CA ALA B 197 7.264 12.104 -4.303 1.00 31.21 C ATOM 2587 C ALA B 197 7.000 12.809 -2.966 1.00 31.46 C ATOM 2588 O ALA B 197 6.033 13.560 -2.814 1.00 31.89 O ATOM 2589 CB ALA B 197 8.254 12.946 -5.132 1.00 32.12 C ATOM 2590 HA ALA B 197 7.696 11.125 -4.094 1.00 0.00 H ATOM 2591 HB1 ALA B 197 8.498 12.416 -6.053 1.00 0.00 H ATOM 2592 HB2 ALA B 197 7.798 13.906 -5.374 1.00 0.00 H ATOM 2593 HB3 ALA B 197 9.163 13.109 -4.553 1.00 0.00 H ATOM 2594 H ALA B 197 5.232 12.467 -4.878 1.00 0.00 H ATOM 2595 N VAL B 198 7.889 12.539 -2.012 1.00 31.76 N ATOM 2596 CA VAL B 198 7.865 13.112 -0.680 1.00 31.51 C ATOM 2597 C VAL B 198 9.337 13.302 -0.392 1.00 32.29 C ATOM 2598 O VAL B 198 10.092 12.325 -0.338 1.00 30.92 O ATOM 2599 CB VAL B 198 7.209 12.167 0.378 1.00 31.55 C ATOM 2600 CG1 VAL B 198 6.959 12.904 1.668 1.00 31.81 C ATOM 2601 CG2 VAL B 198 5.885 11.644 -0.135 1.00 30.67 C ATOM 2602 HA VAL B 198 7.270 14.024 -0.627 1.00 0.00 H ATOM 2603 HB VAL B 198 7.896 11.339 0.555 1.00 0.00 H ATOM 2604 HG11 VAL B 198 7.905 13.273 2.063 1.00 0.00 H ATOM 2605 HG12 VAL B 198 6.289 13.744 1.481 1.00 0.00 H ATOM 2606 HG13 VAL B 198 6.502 12.227 2.389 1.00 0.00 H ATOM 2607 HG21 VAL B 198 5.215 12.482 -0.329 1.00 0.00 H ATOM 2608 HG22 VAL B 198 6.049 11.087 -1.058 1.00 0.00 H ATOM 2609 HG23 VAL B 198 5.441 10.987 0.613 1.00 0.00 H ATOM 2610 H VAL B 198 8.639 11.884 -2.233 1.00 0.00 H ATOM 2611 N ARG B 199 9.755 14.570 -0.331 1.00 33.23 N ATOM 2612 CA ARG B 199 11.026 14.943 0.242 1.00 34.43 C ATOM 2613 C ARG B 199 10.772 15.650 1.569 1.00 34.53 C ATOM 2614 O ARG B 199 9.940 16.552 1.677 1.00 32.57 O ATOM 2615 CB ARG B 199 11.833 15.843 -0.682 1.00 34.45 C ATOM 2616 CG ARG B 199 13.251 16.045 -0.175 1.00 36.74 C ATOM 2617 CD ARG B 199 14.119 16.730 -1.203 1.00 37.55 C ATOM 2618 NE ARG B 199 13.585 18.051 -1.487 1.00 39.61 N ATOM 2619 CZ ARG B 199 14.008 19.161 -0.885 1.00 41.85 C ATOM 2620 NH1 ARG B 199 14.986 19.116 0.052 1.00 42.43 N ATOM 2621 NH2 ARG B 199 13.466 20.322 -1.234 1.00 39.72 N ATOM 2622 HA ARG B 199 11.613 14.038 0.394 1.00 0.00 H ATOM 2623 HB2 ARG B 199 11.873 15.388 -1.672 1.00 0.00 H ATOM 2624 HB3 ARG B 199 11.340 16.813 -0.749 1.00 0.00 H ATOM 2625 HG2 ARG B 199 13.220 16.657 0.726 1.00 0.00 H ATOM 2626 HG3 ARG B 199 13.684 15.073 0.062 1.00 0.00 H ATOM 2627 HD2 ARG B 199 14.133 16.139 -2.119 1.00 0.00 H ATOM 2628 HD3 ARG B 199 15.134 16.824 -0.817 1.00 0.00 H ATOM 2629 HE ARG B 199 12.846 18.133 -2.185 1.00 0.00 H ATOM 2630 HH12 ARG B 199 15.299 19.975 0.504 1.00 0.00 H ATOM 2631 HH11 ARG B 199 15.409 18.223 0.305 1.00 0.00 H ATOM 2632 HH22 ARG B 199 13.775 21.184 -0.786 1.00 0.00 H ATOM 2633 HH21 ARG B 199 12.741 20.351 -1.950 1.00 0.00 H ATOM 2634 H ARG B 199 9.152 15.303 -0.704 1.00 0.00 H ATOM 2635 N VAL B 200 11.490 15.192 2.580 1.00 35.86 N ATOM 2636 CA VAL B 200 11.367 15.730 3.934 1.00 37.24 C ATOM 2637 C VAL B 200 12.687 16.414 4.250 1.00 38.17 C ATOM 2638 O VAL B 200 13.742 15.816 4.096 1.00 36.43 O ATOM 2639 CB VAL B 200 11.070 14.607 4.962 1.00 36.94 C ATOM 2640 CG1 VAL B 200 11.019 15.150 6.392 1.00 37.17 C ATOM 2641 CG2 VAL B 200 9.781 13.934 4.597 1.00 37.07 C ATOM 2642 HA VAL B 200 10.535 16.432 3.995 1.00 0.00 H ATOM 2643 HB VAL B 200 11.881 13.879 4.929 1.00 0.00 H ATOM 2644 HG11 VAL B 200 11.979 15.601 6.642 1.00 0.00 H ATOM 2645 HG12 VAL B 200 10.233 15.901 6.466 1.00 0.00 H ATOM 2646 HG13 VAL B 200 10.809 14.333 7.082 1.00 0.00 H ATOM 2647 HG21 VAL B 200 8.974 14.666 4.610 1.00 0.00 H ATOM 2648 HG22 VAL B 200 9.867 13.504 3.599 1.00 0.00 H ATOM 2649 HG23 VAL B 200 9.568 13.144 5.317 1.00 0.00 H ATOM 2650 H VAL B 200 12.154 14.436 2.409 1.00 0.00 H ATOM 2651 N PHE B 201 12.617 17.675 4.650 1.00 40.27 N ATOM 2652 CA PHE B 201 13.838 18.431 4.955 1.00 42.77 C ATOM 2653 C PHE B 201 13.712 19.535 6.052 1.00 43.36 C ATOM 2654 O PHE B 201 12.637 19.820 6.546 1.00 42.80 O ATOM 2655 CB PHE B 201 14.374 19.032 3.646 1.00 41.78 C ATOM 2656 CG PHE B 201 13.533 20.164 3.098 1.00 42.66 C ATOM 2657 CD1 PHE B 201 12.432 19.908 2.294 1.00 41.16 C ATOM 2658 CD2 PHE B 201 13.861 21.492 3.382 1.00 41.34 C ATOM 2659 CE1 PHE B 201 11.673 20.950 1.775 1.00 41.99 C ATOM 2660 CE2 PHE B 201 13.115 22.523 2.869 1.00 41.66 C ATOM 2661 CZ PHE B 201 12.002 22.252 2.070 1.00 41.66 C ATOM 2662 HA PHE B 201 14.531 17.714 5.394 1.00 0.00 H ATOM 2663 HB2 PHE B 201 15.380 19.410 3.829 1.00 0.00 H ATOM 2664 HB3 PHE B 201 14.415 18.241 2.897 1.00 0.00 H ATOM 2665 HD2 PHE B 201 14.719 21.711 4.018 1.00 0.00 H ATOM 2666 HE2 PHE B 201 13.391 23.555 3.085 1.00 0.00 H ATOM 2667 HZ PHE B 201 11.396 23.070 1.681 1.00 0.00 H ATOM 2668 HE1 PHE B 201 10.818 20.735 1.135 1.00 0.00 H ATOM 2669 HD1 PHE B 201 12.159 18.878 2.067 1.00 0.00 H ATOM 2670 H PHE B 201 11.707 18.125 4.747 1.00 0.00 H ATOM 2671 N TYR B 202 14.850 19.970 6.514 1.00 46.46 N ATOM 2672 CA TYR B 202 15.037 21.258 7.104 1.00 48.45 C ATOM 2673 C TYR B 202 16.352 21.747 6.580 1.00 51.41 C ATOM 2674 O TYR B 202 16.836 21.286 5.594 1.00 52.20 O ATOM 2675 CB TYR B 202 15.170 21.070 8.598 1.00 49.76 C ATOM 2676 CG TYR B 202 16.479 20.453 8.967 1.00 49.97 C ATOM 2677 CD1 TYR B 202 16.723 19.146 8.730 1.00 49.04 C ATOM 2678 CD2 TYR B 202 17.481 21.211 9.523 1.00 51.01 C ATOM 2679 CE1 TYR B 202 17.900 18.596 9.048 1.00 50.28 C ATOM 2680 CE2 TYR B 202 18.661 20.672 9.837 1.00 51.84 C ATOM 2681 CZ TYR B 202 18.874 19.364 9.604 1.00 51.22 C ATOM 2682 OH TYR B 202 20.068 18.821 9.924 1.00 50.97 O ATOM 2683 HA TYR B 202 14.219 21.943 6.883 1.00 0.00 H ATOM 2684 HB3 TYR B 202 14.365 20.423 8.945 1.00 0.00 H ATOM 2685 HB2 TYR B 202 15.089 22.042 9.084 1.00 0.00 H ATOM 2686 HD2 TYR B 202 17.309 22.271 9.711 1.00 0.00 H ATOM 2687 HE2 TYR B 202 19.446 21.286 10.279 1.00 0.00 H ATOM 2688 HE1 TYR B 202 18.077 17.537 8.862 1.00 0.00 H ATOM 2689 HD1 TYR B 202 15.949 18.530 8.273 1.00 0.00 H ATOM 2690 HH TYR B 202 20.064 17.888 9.699 1.00 0.00 H ATOM 2691 H TYR B 202 15.659 19.352 6.450 1.00 0.00 H ATOM 2692 N ARG B 203 16.969 22.632 7.320 1.00 55.07 N ATOM 2693 CA ARG B 203 17.283 23.970 6.885 1.00 57.21 C ATOM 2694 C ARG B 203 18.249 24.458 7.912 1.00 58.47 C ATOM 2695 O ARG B 203 17.921 24.411 9.076 1.00 58.86 O ATOM 2696 CB ARG B 203 16.048 24.825 6.975 1.00 57.77 C ATOM 2697 CG ARG B 203 15.892 25.766 5.859 1.00 59.99 C ATOM 2698 CD ARG B 203 14.490 26.219 5.833 1.00 62.42 C ATOM 2699 NE ARG B 203 14.073 26.585 4.508 1.00 63.21 N ATOM 2700 CZ ARG B 203 13.205 27.540 4.249 1.00 63.94 C ATOM 2701 NH1 ARG B 203 12.668 28.238 5.223 1.00 63.10 N ATOM 2702 NH2 ARG B 203 12.889 27.796 3.005 1.00 66.26 N ATOM 2703 HA ARG B 203 17.663 24.002 5.864 1.00 0.00 H ATOM 2704 HB2 ARG B 203 15.177 24.169 6.996 1.00 0.00 H ATOM 2705 HB3 ARG B 203 16.093 25.396 7.902 1.00 0.00 H ATOM 2706 HG2 ARG B 203 16.554 26.620 6.001 1.00 0.00 H ATOM 2707 HG3 ARG B 203 16.137 25.270 4.920 1.00 0.00 H ATOM 2708 HD2 ARG B 203 14.386 27.084 6.488 1.00 0.00 H ATOM 2709 HD3 ARG B 203 13.851 25.413 6.194 1.00 0.00 H ATOM 2710 HE ARG B 203 14.473 26.074 3.721 1.00 0.00 H ATOM 2711 HH12 ARG B 203 11.996 28.976 5.011 1.00 0.00 H ATOM 2712 HH11 ARG B 203 12.923 28.042 6.191 1.00 0.00 H ATOM 2713 HH22 ARG B 203 12.218 28.533 2.791 1.00 0.00 H ATOM 2714 HH21 ARG B 203 13.314 27.258 2.250 1.00 0.00 H ATOM 2715 H ARG B 203 17.245 22.358 8.263 1.00 0.00 H TER 2716 ARG B 203 HETATM 2717 N NON A 1 -8.091 15.939 -16.013 1.00 0.24 N HETATM 2718 CA NON A 1 -6.643 15.609 -16.181 1.00 0.09 C HETATM 2719 C NON A 1 -6.279 14.346 -15.401 1.00 0.23 C HETATM 2720 O NON A 1 -7.083 13.816 -14.641 1.00 -0.39 O HETATM 2721 N NON A 1 -5.089 13.828 -15.646 1.00 -0.26 N HETATM 2722 CA NON A 1 -4.645 12.621 -14.986 1.00 0.15 C HETATM 2723 C NON A 1 -5.539 11.370 -15.209 1.00 0.21 C HETATM 2724 O NON A 1 -5.798 10.618 -14.254 1.00 -0.39 O HETATM 2725 N NON A 1 -5.948 11.126 -16.465 1.00 -0.26 N HETATM 2726 CA NON A 1 -6.822 10.007 -16.816 1.00 0.13 C HETATM 2727 C NON A 1 -6.056 8.695 -16.918 1.00 0.20 C HETATM 2728 O NON A 1 -6.615 7.654 -17.238 1.00 -0.39 O HETATM 2729 N NON A 1 -4.767 8.753 -16.690 1.00 -0.26 N HETATM 2730 CA NON A 1 -3.921 7.563 -16.608 1.00 0.14 C HETATM 2731 C NON A 1 -3.991 6.828 -15.243 1.00 0.21 C HETATM 2732 O NON A 1 -3.402 5.750 -15.112 1.00 -0.39 O HETATM 2733 N NON A 1 -4.656 7.422 -14.246 1.00 -0.26 N HETATM 2734 CA NON A 1 -4.827 6.792 -12.938 1.00 0.13 C HETATM 2735 C NON A 1 -6.117 5.981 -12.972 1.00 0.20 C HETATM 2736 O NON A 1 -7.214 6.536 -13.044 1.00 -0.39 O HETATM 2737 N NON A 1 -6.001 4.670 -12.875 1.00 -0.26 N HETATM 2738 CA NON A 1 -7.166 3.818 -13.116 1.00 0.13 C HETATM 2739 C NON A 1 -7.984 3.620 -11.866 1.00 0.21 C HETATM 2740 O NON A 1 -7.420 3.359 -10.805 1.00 -0.39 O HETATM 2741 N NON A 1 -9.311 3.716 -11.983 1.00 -0.25 N HETATM 2742 CA NON A 1 -10.119 3.344 -10.838 1.00 0.13 C HETATM 2743 C NON A 1 -9.840 1.906 -10.420 1.00 0.20 C HETATM 2744 O NON A 1 -9.711 1.058 -11.275 1.00 -0.39 O HETATM 2745 N NON A 1 -9.680 1.669 -9.125 1.00 -0.26 N HETATM 2746 CA NON A 1 -9.772 0.313 -8.592 1.00 0.13 C HETATM 2747 C NON A 1 -11.213 -0.043 -8.477 1.00 0.20 C HETATM 2748 O NON A 1 -12.073 0.778 -8.101 1.00 -0.39 O HETATM 2749 N NON A 1 -11.468 -1.313 -8.680 1.00 -0.26 N HETATM 2750 CA NON A 1 -12.794 -1.847 -8.806 1.00 0.13 C HETATM 2751 C NON A 1 -13.133 -2.648 -7.570 1.00 0.21 C HETATM 2752 O NON A 1 -12.267 -3.329 -7.061 1.00 -0.39 O HETATM 2753 N NON A 1 -14.394 -2.594 -7.118 1.00 -0.25 N HETATM 2754 CA NON A 1 -14.785 -3.144 -5.801 1.00 0.13 C HETATM 2755 C NON A 1 -14.466 -4.632 -5.619 1.00 0.20 C HETATM 2756 O NON A 1 -14.680 -5.458 -6.545 1.00 -0.39 O HETATM 2757 N NON A 1 -14.023 -4.941 -4.390 1.00 -0.26 N HETATM 2758 CA NON A 1 -12.910 -5.868 -4.141 1.00 0.11 C HETATM 2759 C NON A 1 -13.217 -7.070 -3.193 1.00 0.12 C HETATM 2760 O NON A 1 -13.825 -6.930 -2.108 1.00 -0.37 O HETATM 2761 H89 NON A 1 -12.890 -8.066 -3.486 1.00 0.14 H HETATM 2762 CB NON A 1 -11.744 -5.012 -3.594 1.00 0.00 C HETATM 2763 CG NON A 1 -11.038 -4.175 -4.663 1.00 0.04 C HETATM 2764 CD NON A 1 -10.797 -2.696 -4.300 1.00 0.17 C HETATM 2765 OE1 NON A 1 -11.750 -1.904 -4.234 1.00 -0.40 O HETATM 2766 NE2 NON A 1 -9.541 -2.334 -4.021 1.00 -0.30 N HETATM 2767 H94 NON A 1 -9.336 -1.385 -3.780 1.00 0.18 H HETATM 2768 H95 NON A 1 -8.806 -3.012 -4.053 1.00 0.18 H HETATM 2769 H92 NON A 1 -11.652 -4.204 -5.575 1.00 0.05 H HETATM 2770 H93 NON A 1 -10.060 -4.638 -4.864 1.00 0.05 H HETATM 2771 H90 NON A 1 -11.004 -5.685 -3.136 1.00 0.03 H HETATM 2772 H91 NON A 1 -12.143 -4.331 -2.828 1.00 0.03 H HETATM 2773 H88 NON A 1 -12.609 -6.296 -5.109 1.00 0.08 H HETATM 2774 H87 NON A 1 -14.473 -4.519 -3.603 1.00 0.19 H HETATM 2775 CB NON A 1 -16.294 -2.864 -5.716 1.00 -0.01 C HETATM 2776 CG NON A 1 -16.518 -1.733 -6.658 1.00 -0.03 C HETATM 2777 CD NON A 1 -15.558 -1.985 -7.792 1.00 0.04 C HETATM 2778 H85 NON A 1 -15.992 -2.675 -8.530 1.00 0.05 H HETATM 2779 H86 NON A 1 -15.279 -1.044 -8.289 1.00 0.05 H HETATM 2780 H83 NON A 1 -16.298 -0.772 -6.170 1.00 0.03 H HETATM 2781 H84 NON A 1 -17.556 -1.731 -7.022 1.00 0.03 H HETATM 2782 H81 NON A 1 -16.579 -2.580 -4.692 1.00 0.03 H HETATM 2783 H82 NON A 1 -16.871 -3.748 -6.026 1.00 0.03 H HETATM 2784 H80 NON A 1 -14.261 -2.591 -5.008 1.00 0.08 H HETATM 2785 CB NON A 1 -12.732 -2.784 -9.957 1.00 -0.01 C HETATM 2786 CG NON A 1 -13.810 -2.839 -10.973 1.00 -0.04 C HETATM 2787 CD1 NON A 1 -13.316 -1.993 -12.045 1.00 -0.06 C HETATM 2788 H74 NON A 1 -14.054 -1.966 -12.861 1.00 0.02 H HETATM 2789 H75 NON A 1 -12.366 -2.398 -12.423 1.00 0.02 H HETATM 2790 H76 NON A 1 -13.155 -0.974 -11.663 1.00 0.02 H HETATM 2791 CD2 NON A 1 -13.852 -4.289 -11.392 1.00 -0.06 C HETATM 2792 H77 NON A 1 -14.230 -4.901 -10.559 1.00 0.02 H HETATM 2793 H78 NON A 1 -12.839 -4.622 -11.662 1.00 0.02 H HETATM 2794 H79 NON A 1 -14.518 -4.401 -12.260 1.00 0.02 H HETATM 2795 H73 NON A 1 -14.784 -2.495 -10.595 1.00 0.03 H HETATM 2796 H71 NON A 1 -12.657 -3.795 -9.530 1.00 0.03 H HETATM 2797 H72 NON A 1 -11.806 -2.546 -10.501 1.00 0.03 H HETATM 2798 H70 NON A 1 -13.534 -1.050 -8.971 1.00 0.08 H HETATM 2799 H69 NON A 1 -10.696 -1.944 -8.751 1.00 0.19 H HETATM 2800 CB NON A 1 -9.190 0.137 -7.201 1.00 -0.01 C HETATM 2801 CG NON A 1 -7.736 0.006 -7.165 1.00 -0.02 C HETATM 2802 CD NON A 1 -7.106 1.401 -7.060 1.00 0.06 C HETATM 2803 NE NON A 1 -5.736 1.422 -7.573 1.00 -0.27 N HETATM 2804 CZ NON A 1 -4.639 1.509 -6.830 1.00 0.29 C HETATM 2805 NH1 NON A 1 -4.725 1.587 -5.504 1.00 -0.28 N HETATM 2806 H65 NON A 1 -3.869 1.654 -4.936 1.00 0.26 H HETATM 2807 H66 NON A 1 -5.648 1.580 -5.046 1.00 0.26 H HETATM 2808 NH2 NON A 1 -3.441 1.529 -7.445 1.00 -0.28 N HETATM 2809 H67 NON A 1 -3.388 1.468 -8.472 1.00 0.26 H HETATM 2810 H68 NON A 1 -2.578 1.605 -6.888 1.00 0.26 H HETATM 2811 H64 NON A 1 -5.612 1.365 -8.594 1.00 0.26 H HETATM 2812 H62 NON A 1 -7.095 1.707 -6.004 1.00 0.07 H HETATM 2813 H63 NON A 1 -7.714 2.110 -7.641 1.00 0.07 H HETATM 2814 H60 NON A 1 -7.388 -0.486 -8.085 1.00 0.03 H HETATM 2815 H61 NON A 1 -7.442 -0.597 -6.293 1.00 0.03 H HETATM 2816 H58 NON A 1 -9.628 -0.769 -6.758 1.00 0.03 H HETATM 2817 H59 NON A 1 -9.471 1.013 -6.598 1.00 0.03 H HETATM 2818 H57 NON A 1 -9.261 -0.372 -9.285 1.00 0.08 H HETATM 2819 H56 NON A 1 -9.493 2.431 -8.504 1.00 0.19 H HETATM 2820 CB NON A 1 -11.537 3.485 -11.360 1.00 -0.01 C HETATM 2821 CG NON A 1 -11.406 4.482 -12.476 1.00 -0.03 C HETATM 2822 CD NON A 1 -10.143 4.127 -13.123 1.00 0.04 C HETATM 2823 H54 NON A 1 -10.279 3.300 -13.835 1.00 0.05 H HETATM 2824 H55 NON A 1 -9.706 4.992 -13.644 1.00 0.05 H HETATM 2825 H52 NON A 1 -11.368 5.508 -12.081 1.00 0.03 H HETATM 2826 H53 NON A 1 -12.245 4.392 -13.181 1.00 0.03 H HETATM 2827 H50 NON A 1 -12.209 3.861 -10.575 1.00 0.03 H HETATM 2828 H51 NON A 1 -11.915 2.523 -11.736 1.00 0.03 H HETATM 2829 H49 NON A 1 -9.938 4.018 -9.988 1.00 0.08 H HETATM 2830 CB NON A 1 -6.708 2.454 -13.633 1.00 0.00 C HETATM 2831 CG NON A 1 -5.752 2.607 -14.790 1.00 0.04 C HETATM 2832 CD NON A 1 -4.336 2.294 -14.402 1.00 0.17 C HETATM 2833 OE1 NON A 1 -3.761 2.804 -13.369 1.00 -0.40 O HETATM 2834 NE2 NON A 1 -3.725 1.450 -15.238 1.00 -0.30 N HETATM 2835 H47 NON A 1 -2.778 1.177 -15.069 1.00 0.18 H HETATM 2836 H48 NON A 1 -4.215 1.091 -16.033 1.00 0.18 H HETATM 2837 H45 NON A 1 -5.799 3.644 -15.153 1.00 0.05 H HETATM 2838 H46 NON A 1 -6.058 1.923 -15.595 1.00 0.05 H HETATM 2839 H43 NON A 1 -7.587 1.882 -13.966 1.00 0.03 H HETATM 2840 H44 NON A 1 -6.204 1.912 -12.819 1.00 0.03 H HETATM 2841 H42 NON A 1 -7.798 4.298 -13.878 1.00 0.08 H HETATM 2842 H41 NON A 1 -5.120 4.260 -12.638 1.00 0.19 H HETATM 2843 CB NON A 1 -4.960 7.809 -11.752 1.00 -0.00 C HETATM 2844 CG1 NON A 1 -3.799 8.795 -11.699 1.00 -0.05 C HETATM 2845 CD1 NON A 1 -3.960 9.846 -10.674 1.00 -0.06 C HETATM 2846 H38 NON A 1 -3.088 10.516 -10.696 1.00 0.02 H HETATM 2847 H39 NON A 1 -4.040 9.380 -9.681 1.00 0.02 H HETATM 2848 H40 NON A 1 -4.872 10.425 -10.882 1.00 0.02 H HETATM 2849 H33 NON A 1 -3.710 9.280 -12.682 1.00 0.03 H HETATM 2850 H34 NON A 1 -2.877 8.235 -11.481 1.00 0.03 H HETATM 2851 CG2 NON A 1 -5.041 7.041 -10.405 1.00 -0.06 C HETATM 2852 H35 NON A 1 -5.878 6.328 -10.439 1.00 0.02 H HETATM 2853 H36 NON A 1 -5.202 7.756 -9.584 1.00 0.02 H HETATM 2854 H37 NON A 1 -4.101 6.495 -10.237 1.00 0.02 H HETATM 2855 H32 NON A 1 -5.891 8.379 -11.892 1.00 0.03 H HETATM 2856 H31 NON A 1 -3.968 6.132 -12.748 1.00 0.08 H HETATM 2857 H30 NON A 1 -5.050 8.328 -14.401 1.00 0.19 H HETATM 2858 CB NON A 1 -2.464 7.947 -16.897 1.00 0.00 C HETATM 2859 CG NON A 1 -1.929 8.954 -15.890 1.00 -0.04 C HETATM 2860 CD1 NON A 1 -1.996 10.303 -15.997 1.00 0.02 C HETATM 2861 NE1 NON A 1 -1.422 10.898 -14.900 1.00 -0.29 N HETATM 2862 CE2 NON A 1 -0.992 9.938 -14.042 1.00 0.06 C HETATM 2863 CD2 NON A 1 -1.301 8.689 -14.626 1.00 -0.02 C HETATM 2864 CE3 NON A 1 -0.947 7.528 -13.939 1.00 -0.07 C HETATM 2865 CZ3 NON A 1 -0.306 7.642 -12.728 1.00 -0.08 C HETATM 2866 CH2 NON A 1 -0.027 8.900 -12.158 1.00 -0.08 C HETATM 2867 CZ2 NON A 1 -0.375 10.055 -12.787 1.00 -0.04 C HETATM 2868 H27 NON A 1 -0.184 11.023 -12.338 1.00 0.05 H HETATM 2869 H29 NON A 1 0.475 8.948 -11.199 1.00 0.05 H HETATM 2870 H28 NON A 1 -0.009 6.744 -12.200 1.00 0.05 H HETATM 2871 H26 NON A 1 -1.173 6.552 -14.353 1.00 0.05 H HETATM 2872 H25 NON A 1 -1.332 11.913 -14.752 1.00 0.22 H HETATM 2873 H24 NON A 1 -2.442 10.839 -16.834 1.00 0.08 H HETATM 2874 H22 NON A 1 -2.406 8.386 -17.904 1.00 0.04 H HETATM 2875 H23 NON A 1 -1.843 7.040 -16.856 1.00 0.04 H HETATM 2876 H21 NON A 1 -4.259 6.860 -17.384 1.00 0.08 H HETATM 2877 H20 NON A 1 -4.343 9.650 -16.567 1.00 0.19 H HETATM 2878 CB NON A 1 -7.557 10.258 -18.150 1.00 -0.00 C HETATM 2879 CG NON A 1 -8.502 11.448 -18.141 1.00 0.00 C HETATM 2880 CD NON A 1 -7.783 12.820 -18.164 1.00 0.04 C HETATM 2881 OE1 NON A 1 -6.561 12.901 -18.457 1.00 -0.57 O HETATM 2882 OE2 NON A 1 -8.458 13.834 -17.904 1.00 -0.57 O HETATM 2883 H18 NON A 1 -9.118 11.395 -17.231 1.00 0.04 H HETATM 2884 H19 NON A 1 -9.151 11.382 -19.027 1.00 0.04 H HETATM 2885 H16 NON A 1 -8.141 9.358 -18.394 1.00 0.03 H HETATM 2886 H17 NON A 1 -6.801 10.427 -18.931 1.00 0.03 H HETATM 2887 H15 NON A 1 -7.574 9.906 -16.020 1.00 0.08 H HETATM 2888 H14 NON A 1 -5.641 11.738 -17.194 1.00 0.19 H HETATM 2889 CB NON A 1 -4.428 12.932 -13.503 1.00 0.08 C HETATM 2890 CG NON A 1 -3.245 13.820 -13.297 1.00 0.18 C HETATM 2891 OD1 NON A 1 -2.213 13.577 -13.883 1.00 -0.40 O HETATM 2892 ND2 NON A 1 -3.374 14.841 -12.452 1.00 -0.30 N HETATM 2893 H12 NON A 1 -2.603 15.456 -12.290 1.00 0.18 H HETATM 2894 H13 NON A 1 -4.242 14.993 -11.980 1.00 0.18 H HETATM 2895 H10 NON A 1 -4.266 11.989 -12.960 1.00 0.06 H HETATM 2896 H11 NON A 1 -5.324 13.433 -13.108 1.00 0.06 H HETATM 2897 H9 NON A 1 -3.663 12.370 -15.414 1.00 0.08 H HETATM 2898 H8 NON A 1 -4.483 14.280 -16.301 1.00 0.19 H HETATM 2899 CB NON A 1 -5.739 16.801 -15.787 1.00 0.10 C HETATM 2900 OG NON A 1 -5.996 17.245 -14.464 1.00 -0.39 O HETATM 2901 H7 NON A 1 -6.902 17.522 -14.395 1.00 0.21 H HETATM 2902 H5 NON A 1 -5.923 17.633 -16.483 1.00 0.06 H HETATM 2903 H6 NON A 1 -4.687 16.488 -15.859 1.00 0.06 H HETATM 2904 H4 NON A 1 -6.471 15.402 -17.248 1.00 0.11 H HETATM 2905 H1 NON A 1 -8.308 16.774 -16.535 1.00 0.20 H HETATM 2906 H2 NON A 1 -8.290 16.092 -15.037 1.00 0.20 H HETATM 2907 H3 NON A 1 -8.652 15.174 -16.354 1.00 0.20 H CONECT 1 2 15 16 17 CONECT 15 1 CONECT 16 1 CONECT 17 1 CONECT 633 632 2514 CONECT 1210 1209 1334 CONECT 1334 1210 1333 CONECT 2514 633 2513 CONECT 2717 2718 2905 2906 2907 CONECT 2718 2717 2719 2899 2904 CONECT 2719 2718 2720 2721 CONECT 2720 2719 CONECT 2721 2719 2722 2898 CONECT 2722 2721 2723 2889 2897 CONECT 2723 2722 2724 2725 CONECT 2724 2723 CONECT 2725 2723 2726 2888 CONECT 2726 2725 2727 2878 2887 CONECT 2727 2726 2728 2729 CONECT 2728 2727 CONECT 2729 2727 2730 2877 CONECT 2730 2729 2731 2858 2876 CONECT 2731 2730 2732 2733 CONECT 2732 2731 CONECT 2733 2731 2734 2857 CONECT 2734 2733 2735 2843 2856 CONECT 2735 2734 2736 2737 CONECT 2736 2735 CONECT 2737 2735 2738 2842 CONECT 2738 2737 2739 2830 2841 CONECT 2739 2738 2740 2741 CONECT 2740 2739 CONECT 2741 2739 2742 2822 CONECT 2742 2741 2743 2820 2829 CONECT 2743 2742 2744 2745 CONECT 2744 2743 CONECT 2745 2743 2746 2819 CONECT 2746 2745 2747 2800 2818 CONECT 2747 2746 2748 2749 CONECT 2748 2747 CONECT 2749 2747 2750 2799 CONECT 2750 2749 2751 2785 2798 CONECT 2751 2750 2752 2753 CONECT 2752 2751 CONECT 2753 2751 2754 2777 CONECT 2754 2753 2755 2775 2784 CONECT 2755 2754 2756 2757 CONECT 2756 2755 CONECT 2757 2755 2758 2774 CONECT 2758 2757 2759 2762 2773 CONECT 2759 2758 2760 2761 CONECT 2760 2759 CONECT 2761 2759 CONECT 2762 2758 2763 2771 2772 CONECT 2763 2762 2764 2769 2770 CONECT 2764 2763 2765 2766 CONECT 2765 2764 CONECT 2766 2764 2767 2768 CONECT 2767 2766 CONECT 2768 2766 CONECT 2769 2763 CONECT 2770 2763 CONECT 2771 2762 CONECT 2772 2762 CONECT 2773 2758 CONECT 2774 2757 CONECT 2775 2754 2776 2782 2783 CONECT 2776 2775 2777 2780 2781 CONECT 2777 2753 2776 2778 2779 CONECT 2778 2777 CONECT 2779 2777 CONECT 2780 2776 CONECT 2781 2776 CONECT 2782 2775 CONECT 2783 2775 CONECT 2784 2754 CONECT 2785 2750 2786 2796 2797 CONECT 2786 2785 2787 2791 2795 CONECT 2787 2786 2788 2789 2790 CONECT 2788 2787 CONECT 2789 2787 CONECT 2790 2787 CONECT 2791 2786 2792 2793 2794 CONECT 2792 2791 CONECT 2793 2791 CONECT 2794 2791 CONECT 2795 2786 CONECT 2796 2785 CONECT 2797 2785 CONECT 2798 2750 CONECT 2799 2749 CONECT 2800 2746 2801 2816 2817 CONECT 2801 2800 2802 2814 2815 CONECT 2802 2801 2803 2812 2813 CONECT 2803 2802 2804 2811 CONECT 2804 2803 2805 2808 CONECT 2805 2804 2806 2807 CONECT 2806 2805 CONECT 2807 2805 CONECT 2808 2804 2809 2810 CONECT 2809 2808 CONECT 2810 2808 CONECT 2811 2803 CONECT 2812 2802 CONECT 2813 2802 CONECT 2814 2801 CONECT 2815 2801 CONECT 2816 2800 CONECT 2817 2800 CONECT 2818 2746 CONECT 2819 2745 CONECT 2820 2742 2821 2827 2828 CONECT 2821 2820 2822 2825 2826 CONECT 2822 2741 2821 2823 2824 CONECT 2823 2822 CONECT 2824 2822 CONECT 2825 2821 CONECT 2826 2821 CONECT 2827 2820 CONECT 2828 2820 CONECT 2829 2742 CONECT 2830 2738 2831 2839 2840 CONECT 2831 2830 2832 2837 2838 CONECT 2832 2831 2833 2834 CONECT 2833 2832 CONECT 2834 2832 2835 2836 CONECT 2835 2834 CONECT 2836 2834 CONECT 2837 2831 CONECT 2838 2831 CONECT 2839 2830 CONECT 2840 2830 CONECT 2841 2738 CONECT 2842 2737 CONECT 2843 2734 2844 2851 2855 CONECT 2844 2843 2845 2849 2850 CONECT 2845 2844 2846 2847 2848 CONECT 2846 2845 CONECT 2847 2845 CONECT 2848 2845 CONECT 2849 2844 CONECT 2850 2844 CONECT 2851 2843 2852 2853 2854 CONECT 2852 2851 CONECT 2853 2851 CONECT 2854 2851 CONECT 2855 2843 CONECT 2856 2734 CONECT 2857 2733 CONECT 2858 2730 2859 2874 2875 CONECT 2859 2858 2860 2863 CONECT 2860 2859 2861 2873 CONECT 2861 2860 2862 2872 CONECT 2862 2861 2863 2867 CONECT 2863 2859 2862 2864 CONECT 2864 2863 2865 2871 CONECT 2865 2864 2866 2870 CONECT 2866 2865 2867 2869 CONECT 2867 2862 2866 2868 CONECT 2868 2867 CONECT 2869 2866 CONECT 2870 2865 CONECT 2871 2864 CONECT 2872 2861 CONECT 2873 2860 CONECT 2874 2858 CONECT 2875 2858 CONECT 2876 2730 CONECT 2877 2729 CONECT 2878 2726 2879 2885 2886 CONECT 2879 2878 2880 2883 2884 CONECT 2880 2879 2881 2882 CONECT 2881 2880 CONECT 2882 2880 CONECT 2883 2879 CONECT 2884 2879 CONECT 2885 2878 CONECT 2886 2878 CONECT 2887 2726 CONECT 2888 2725 CONECT 2889 2722 2890 2895 2896 CONECT 2890 2889 2891 2892 CONECT 2891 2890 CONECT 2892 2890 2893 2894 CONECT 2893 2892 CONECT 2894 2892 CONECT 2895 2889 CONECT 2896 2889 CONECT 2897 2722 CONECT 2898 2721 CONECT 2899 2718 2900 2902 2903 CONECT 2900 2899 2901 CONECT 2901 2900 CONECT 2902 2899 CONECT 2903 2899 CONECT 2904 2718 CONECT 2905 2717 CONECT 2906 2717 CONECT 2907 2717 MASTER 0 0 0 0 0 0 0 0 2906 1 199 14 END
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RCSB PDB
PDBbind
12-mer
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PDBbind
12-mer
6pit
RCSB PDB
PDBbind
12-mer
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12-mer
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PDBbind
12-mer
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12-mer
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PDBbind
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PDBbind
12-mer
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PDBbind
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Entry Information
PDB ID
2qbx
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Ephrin type-B receptor 2
Ligand Name
12-mer
EC.Number
E.C.2.7.10.1
Resolution
2.3(Å)
Affinity (Kd/Ki/IC50)
Kd=6uM
Release Year
2007
Protein/NA Sequence
Check fasta file
Primary Reference
(2007) J.Biol.Chem. Vol. 282: pp. 36505-36513
Ligand Properties
Formula
C
6
1
H
9
6
N
1
8
O
1
7
Molecular Weight
1353.530
Exact Mass
1352.720
No. of atoms
192
No. of bonds
195
Polar Surface Area
586.73
LOGP Value
-3.69 (
Computed with XLOGP3
)
-1.63 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 14
No. of Hydrogen Bond Acceptors: 17
No. of Rotatable Bonds: 51
No. of Nitrogen and Oxygen Atoms: 35
No. of Rings: 4
Canonical SMILES
O=C[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H]([C@H](CC)C)NC(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CO)[NH3+])CC(=O)N)CCC(=O)O)CCC(=O)N)CCC[NH+]=C(N)N)CC(C)C)CCC(=O)N
InChI String
InChI=1S/C61H94N18O17/c1-5-32(4)50(77-55(91)41(26-33-28-69-37-12-7-6-11-35(33)37)75-53(89)39(18-21-49(85)86)71-54(90)42(27-48(65)84)74-51(87)36(62)30-81)58(94)73-40(17-20-47(64)83)59(95)78-23-10-15-45(78)57(93)72-38(13-8-22-68-61(66)67)52(88)76-43(25-31(2)3)60(96)79-24-9-14-44(79)56(92)70-34(29-80)16-19-46(63)82/h6-7,11-12,28-29,31-32,34,36,38-45,50,69,81H,5,8-10,13-27,30,62H2,1-4H3,(H2,63,82)(H2,64,83)(H2,65,84)(H,70,92)(H,71,90)(H,72,93)(H,73,94)(H,74,87)(H,75,89)(H,76,88)(H,77,91)(H,85,86)(H4,66,67,68)/p+2/t32-,34-,36-,38-,39-,40-,41-,42-,43-,44-,45-,50-/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):
P29323
Entrez Gene ID
NCBI Entrez Gene ID:
2048
ASD
Information of known allosteric effects of PDB entries
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