Browse entries in the PDBbind-CN Database
HEADER 3VTB_COMPLEX COMPND 3VTB_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 37 LYS LEU SER GLU GLU GLN GLN HIS ILE ILE ALA ILE LEU SEQRES 2 A 37 LEU ASP ALA HIS HIS LYS THR TYR ASP PRO THR TYR ALA SEQRES 3 A 37 ASP PHE ARG ASP PHE ARG PRO PRO VAL ARG MET SEQRES 1 A 203 SER PRO LEU SER MET LEU PRO HIS LEU ALA ASP LEU VAL SEQRES 2 A 203 SER TYR SER ILE GLN LYS VAL ILE GLY PHE ALA LYS MET SEQRES 3 A 203 ILE PRO GLY PHE ARG ASP LEU THR SER ASP ASP GLN ILE SEQRES 4 A 203 VAL LEU LEU LYS SER SER ALA ILE GLU VAL ILE MET LEU SEQRES 5 A 203 ARG SER ASN GLN SER PHE THR MET ASP ASP MET SER TRP SEQRES 6 A 203 ASP CYS GLY SER GLN ASP TYR LYS TYR ASP VAL THR ASP SEQRES 7 A 203 VAL SER LYS ALA GLY HIS THR LEU GLU LEU ILE GLU PRO SEQRES 8 A 203 LEU ILE LYS PHE GLN VAL GLY LEU LYS LYS LEU ASN LEU SEQRES 9 A 203 HIS GLU GLU GLU HIS VAL LEU LEU MET ALA ILE CYS ILE SEQRES 10 A 203 VAL SER PRO ASP ARG PRO GLY VAL GLN ASP ALA LYS LEU SEQRES 11 A 203 VAL GLU ALA ILE GLN ASP ARG LEU SER ASN THR LEU GLN SEQRES 12 A 203 THR TYR ILE ARG CYS ARG HIS PRO PRO PRO GLY SER HIS SEQRES 13 A 203 GLN LEU TYR ALA LYS MET ILE GLN LYS LEU ALA ASP LEU SEQRES 14 A 203 ARG SER LEU ASN GLU GLU HIS SER LYS GLN TYR ARG SER SEQRES 15 A 203 LEU SER PHE GLN PRO GLU ASN SER MET LYS LEU THR PRO SEQRES 16 A 203 LEU VAL LEU GLU VAL PHE GLY ASN HET TKA A 279 88 ATOM 1 N LYS A 123 42.889 0.386 3.653 1.00 76.83 N ATOM 2 CA LYS A 123 42.210 -0.603 2.768 1.00 76.35 C ATOM 3 C LYS A 123 40.878 -0.110 2.218 1.00 75.37 C ATOM 4 O LYS A 123 40.829 0.594 1.211 1.00 76.10 O ATOM 5 CB LYS A 123 41.952 -1.922 3.508 1.00 76.71 C ATOM 6 CG LYS A 123 41.160 -2.926 2.669 1.00 74.36 C ATOM 7 CD LYS A 123 40.253 -3.812 3.507 1.00 77.43 C ATOM 8 CE LYS A 123 41.048 -4.749 4.397 1.00 83.47 C ATOM 9 NZ LYS A 123 40.154 -5.621 5.216 1.00 83.42 N ATOM 10 HZ1 LYS A 123 39.551 -5.027 5.820 1.00 0.00 H ATOM 11 HZ2 LYS A 123 39.558 -6.194 4.585 1.00 0.00 H ATOM 12 HZ3 LYS A 123 40.733 -6.247 5.811 1.00 0.00 H ATOM 13 HN3 LYS A 123 42.276 0.601 4.465 1.00 0.00 H ATOM 14 HN2 LYS A 123 43.075 1.258 3.118 1.00 0.00 H ATOM 15 HN1 LYS A 123 43.788 -0.013 3.992 1.00 0.00 H ATOM 16 N LEU A 124 39.801 -0.483 2.905 1.00 74.55 N ATOM 17 CA LEU A 124 38.447 -0.153 2.481 1.00 72.30 C ATOM 18 C LEU A 124 38.293 -0.558 1.023 1.00 70.25 C ATOM 19 O LEU A 124 38.486 0.246 0.113 1.00 69.45 O ATOM 20 CB LEU A 124 38.134 1.340 2.664 1.00 72.60 C ATOM 21 CG LEU A 124 37.629 1.752 4.053 1.00 70.27 C ATOM 22 CD1 LEU A 124 37.007 3.140 3.980 1.00 66.34 C ATOM 23 CD2 LEU A 124 36.597 0.746 4.548 1.00 66.98 C ATOM 24 H LEU A 124 39.931 -1.032 3.779 1.00 0.00 H ATOM 25 N SER A 125 37.964 -1.827 0.815 1.00 68.91 N ATOM 26 CA SER A 125 37.782 -2.357 -0.525 1.00 67.57 C ATOM 27 C SER A 125 36.568 -1.714 -1.180 1.00 67.73 C ATOM 28 O SER A 125 35.972 -0.783 -0.636 1.00 68.06 O ATOM 29 CB SER A 125 37.593 -3.874 -0.468 1.00 63.89 C ATOM 30 OG SER A 125 36.451 -4.210 0.300 1.00 63.26 O ATOM 31 HG SER A 125 36.348 -5.194 0.323 1.00 0.00 H ATOM 32 H SER A 125 37.833 -2.457 1.632 1.00 0.00 H ATOM 33 N GLU A 126 36.211 -2.214 -2.357 1.00 67.85 N ATOM 34 CA GLU A 126 35.066 -1.701 -3.092 1.00 67.86 C ATOM 35 C GLU A 126 33.785 -2.140 -2.399 1.00 65.69 C ATOM 36 O GLU A 126 32.845 -1.356 -2.253 1.00 65.05 O ATOM 37 CB GLU A 126 35.080 -2.237 -4.529 1.00 73.70 C ATOM 38 CG GLU A 126 36.283 -1.791 -5.362 1.00 80.33 C ATOM 39 CD GLU A 126 36.177 -0.345 -5.824 1.00 84.66 C ATOM 40 OE1 GLU A 126 35.219 -0.027 -6.560 1.00 86.64 O ATOM 41 OE2 GLU A 126 37.048 0.471 -5.455 1.00 86.88 O ATOM 42 H GLU A 126 36.765 -2.994 -2.764 1.00 0.00 H ATOM 43 N GLU A 127 33.762 -3.399 -1.971 1.00 63.79 N ATOM 44 CA GLU A 127 32.597 -3.966 -1.310 1.00 63.12 C ATOM 45 C GLU A 127 32.328 -3.346 0.062 1.00 62.23 C ATOM 46 O GLU A 127 31.177 -3.241 0.481 1.00 62.37 O ATOM 47 CB GLU A 127 32.753 -5.485 -1.172 1.00 64.88 C ATOM 48 CG GLU A 127 31.554 -6.167 -0.516 1.00 72.10 C ATOM 49 CD GLU A 127 31.675 -7.681 -0.476 1.00 76.18 C ATOM 50 OE1 GLU A 127 31.822 -8.293 -1.555 1.00 75.51 O ATOM 51 OE2 GLU A 127 31.617 -8.259 0.633 1.00 80.23 O ATOM 52 H GLU A 127 34.602 -3.996 -2.113 1.00 0.00 H ATOM 53 N GLN A 128 33.390 -2.933 0.748 1.00 59.68 N ATOM 54 CA GLN A 128 33.273 -2.331 2.070 1.00 58.28 C ATOM 55 C GLN A 128 32.778 -0.887 2.018 1.00 58.90 C ATOM 56 O GLN A 128 32.046 -0.432 2.900 1.00 58.55 O ATOM 57 CB GLN A 128 34.623 -2.410 2.779 1.00 55.60 C ATOM 58 CG GLN A 128 35.021 -3.835 3.157 1.00 48.70 C ATOM 59 CD GLN A 128 36.459 -3.950 3.618 1.00 46.74 C ATOM 60 OE1 GLN A 128 36.822 -4.900 4.305 1.00 50.34 O ATOM 61 NE2 GLN A 128 37.289 -2.989 3.230 1.00 53.22 N ATOM 62 HE22 GLN A 128 36.938 -2.202 2.648 1.00 0.00 H ATOM 63 HE21 GLN A 128 38.291 -3.023 3.508 1.00 0.00 H ATOM 64 H GLN A 128 34.335 -3.043 0.327 1.00 0.00 H ATOM 65 N GLN A 129 33.188 -0.160 0.989 1.00 58.88 N ATOM 66 CA GLN A 129 32.754 1.220 0.826 1.00 59.83 C ATOM 67 C GLN A 129 31.266 1.188 0.488 1.00 59.93 C ATOM 68 O GLN A 129 30.515 2.117 0.806 1.00 59.68 O ATOM 69 CB GLN A 129 33.550 1.892 -0.298 1.00 58.23 C ATOM 70 CG GLN A 129 35.005 2.157 0.068 1.00 64.99 C ATOM 71 CD GLN A 129 35.851 2.550 -1.124 1.00 71.96 C ATOM 72 OE1 GLN A 129 35.520 3.481 -1.856 1.00 75.62 O ATOM 73 NE2 GLN A 129 36.958 1.842 -1.321 1.00 73.50 N ATOM 74 HE22 GLN A 129 37.198 1.063 -0.676 1.00 0.00 H ATOM 75 HE21 GLN A 129 37.584 2.067 -2.120 1.00 0.00 H ATOM 76 H GLN A 129 33.829 -0.582 0.287 1.00 0.00 H ATOM 77 N HIS A 130 30.855 0.093 -0.143 1.00 59.34 N ATOM 78 CA HIS A 130 29.465 -0.122 -0.536 1.00 60.01 C ATOM 79 C HIS A 130 28.616 -0.417 0.714 1.00 58.44 C ATOM 80 O HIS A 130 27.561 0.178 0.918 1.00 59.01 O ATOM 81 CB HIS A 130 29.402 -1.293 -1.526 1.00 61.39 C ATOM 82 CG HIS A 130 28.045 -1.533 -2.108 1.00 66.86 C ATOM 83 ND1 HIS A 130 27.350 -0.566 -2.804 1.00 68.02 N ATOM 84 CD2 HIS A 130 27.268 -2.642 -2.128 1.00 64.87 C ATOM 85 CE1 HIS A 130 26.205 -1.071 -3.229 1.00 65.88 C ATOM 86 NE2 HIS A 130 26.131 -2.329 -2.832 1.00 68.25 N ATOM 87 H HIS A 130 31.554 -0.644 -0.367 1.00 0.00 H ATOM 88 N ILE A 131 29.101 -1.331 1.548 1.00 56.73 N ATOM 89 CA ILE A 131 28.421 -1.716 2.781 1.00 54.74 C ATOM 90 C ILE A 131 28.173 -0.502 3.675 1.00 53.19 C ATOM 91 O ILE A 131 27.118 -0.385 4.300 1.00 52.12 O ATOM 92 CB ILE A 131 29.260 -2.752 3.559 1.00 54.99 C ATOM 93 CG1 ILE A 131 29.373 -4.037 2.738 1.00 53.31 C ATOM 94 CG2 ILE A 131 28.633 -3.033 4.918 1.00 57.22 C ATOM 95 CD1 ILE A 131 30.292 -5.068 3.335 1.00 53.85 C ATOM 96 H ILE A 131 30.003 -1.791 1.312 1.00 0.00 H ATOM 97 N ILE A 132 29.153 0.394 3.733 1.00 51.56 N ATOM 98 CA ILE A 132 29.049 1.602 4.544 1.00 49.23 C ATOM 99 C ILE A 132 28.086 2.599 3.901 1.00 48.38 C ATOM 100 O ILE A 132 27.287 3.235 4.588 1.00 50.52 O ATOM 101 CB ILE A 132 30.436 2.262 4.729 1.00 48.72 C ATOM 102 CG1 ILE A 132 31.346 1.328 5.530 1.00 51.39 C ATOM 103 CG2 ILE A 132 30.295 3.611 5.422 1.00 49.82 C ATOM 104 CD1 ILE A 132 32.737 1.890 5.797 1.00 53.38 C ATOM 105 H ILE A 132 30.020 0.229 3.183 1.00 0.00 H ATOM 106 N ALA A 133 28.158 2.735 2.584 1.00 47.86 N ATOM 107 CA ALA A 133 27.268 3.646 1.874 1.00 46.60 C ATOM 108 C ALA A 133 25.826 3.189 2.075 1.00 45.66 C ATOM 109 O ALA A 133 24.934 4.004 2.330 1.00 42.53 O ATOM 110 CB ALA A 133 27.608 3.672 0.375 1.00 43.24 C ATOM 111 H ALA A 133 28.860 2.184 2.050 1.00 0.00 H ATOM 112 N ILE A 134 25.608 1.880 1.963 1.00 42.17 N ATOM 113 CA ILE A 134 24.278 1.307 2.128 1.00 42.47 C ATOM 114 C ILE A 134 23.723 1.566 3.530 1.00 41.81 C ATOM 115 O ILE A 134 22.599 2.057 3.680 1.00 43.61 O ATOM 116 CB ILE A 134 24.285 -0.237 1.893 1.00 43.30 C ATOM 117 CG1 ILE A 134 24.651 -0.563 0.437 1.00 49.73 C ATOM 118 CG2 ILE A 134 22.924 -0.818 2.255 1.00 41.95 C ATOM 119 CD1 ILE A 134 23.635 -0.099 -0.582 1.00 48.21 C ATOM 120 H ILE A 134 26.408 1.250 1.752 1.00 0.00 H ATOM 121 N LEU A 135 24.511 1.220 4.548 1.00 40.94 N ATOM 122 CA LEU A 135 24.107 1.393 5.944 1.00 38.29 C ATOM 123 C LEU A 135 23.856 2.854 6.316 1.00 39.98 C ATOM 124 O LEU A 135 22.964 3.155 7.108 1.00 39.74 O ATOM 125 CB LEU A 135 25.162 0.795 6.860 1.00 37.60 C ATOM 126 CG LEU A 135 25.249 -0.733 6.729 1.00 38.23 C ATOM 127 CD1 LEU A 135 26.414 -1.253 7.539 1.00 34.86 C ATOM 128 CD2 LEU A 135 23.945 -1.354 7.195 1.00 35.58 C ATOM 129 H LEU A 135 25.446 0.813 4.343 1.00 0.00 H ATOM 130 N LEU A 136 24.649 3.758 5.758 1.00 39.26 N ATOM 131 CA LEU A 136 24.451 5.174 6.030 1.00 41.77 C ATOM 132 C LEU A 136 23.078 5.583 5.495 1.00 43.54 C ATOM 133 O LEU A 136 22.298 6.245 6.186 1.00 46.42 O ATOM 134 CB LEU A 136 25.548 6.004 5.352 1.00 42.77 C ATOM 135 CG LEU A 136 26.947 5.918 5.968 1.00 39.89 C ATOM 136 CD1 LEU A 136 27.930 6.745 5.161 1.00 40.39 C ATOM 137 CD2 LEU A 136 26.889 6.428 7.399 1.00 46.68 C ATOM 138 H LEU A 136 25.415 3.454 5.124 1.00 0.00 H ATOM 139 N ASP A 137 22.778 5.172 4.268 1.00 42.64 N ATOM 140 CA ASP A 137 21.506 5.505 3.643 1.00 42.49 C ATOM 141 C ASP A 137 20.324 4.822 4.327 1.00 41.86 C ATOM 142 O ASP A 137 19.265 5.430 4.510 1.00 40.91 O ATOM 143 CB ASP A 137 21.536 5.129 2.159 1.00 48.82 C ATOM 144 CG ASP A 137 20.323 5.634 1.405 1.00 48.03 C ATOM 145 OD1 ASP A 137 19.572 4.796 0.860 1.00 50.43 O ATOM 146 OD2 ASP A 137 20.125 6.871 1.364 1.00 51.32 O ATOM 147 H ASP A 137 23.468 4.599 3.741 1.00 0.00 H ATOM 148 N ALA A 138 20.500 3.553 4.689 1.00 41.98 N ATOM 149 CA ALA A 138 19.454 2.799 5.372 1.00 38.13 C ATOM 150 C ALA A 138 19.116 3.490 6.693 1.00 38.96 C ATOM 151 O ALA A 138 17.950 3.559 7.095 1.00 38.49 O ATOM 152 CB ALA A 138 19.924 1.370 5.633 1.00 35.98 C ATOM 153 H ALA A 138 21.406 3.087 4.480 1.00 0.00 H ATOM 154 N HIS A 139 20.142 4.005 7.367 1.00 38.35 N ATOM 155 CA HIS A 139 19.922 4.694 8.625 1.00 40.66 C ATOM 156 C HIS A 139 19.136 5.961 8.347 1.00 41.41 C ATOM 157 O HIS A 139 18.127 6.238 8.997 1.00 38.75 O ATOM 158 CB HIS A 139 21.248 5.065 9.292 1.00 41.33 C ATOM 159 CG HIS A 139 21.082 5.824 10.574 1.00 39.46 C ATOM 160 ND1 HIS A 139 20.263 5.388 11.594 1.00 37.61 N ATOM 161 CD2 HIS A 139 21.632 6.986 11.004 1.00 43.14 C ATOM 162 CE1 HIS A 139 20.314 6.248 12.597 1.00 45.20 C ATOM 163 NE2 HIS A 139 21.138 7.228 12.264 1.00 40.66 N ATOM 164 H HIS A 139 21.107 3.913 6.990 1.00 0.00 H ATOM 165 N HIS A 140 19.613 6.720 7.364 1.00 43.23 N ATOM 166 CA HIS A 140 18.983 7.977 6.971 1.00 43.69 C ATOM 167 C HIS A 140 17.514 7.800 6.624 1.00 43.45 C ATOM 168 O HIS A 140 16.692 8.643 6.952 1.00 43.42 O ATOM 169 CB HIS A 140 19.736 8.579 5.785 1.00 42.40 C ATOM 170 CG HIS A 140 21.106 9.072 6.135 1.00 52.44 C ATOM 171 ND1 HIS A 140 22.061 9.362 5.185 1.00 53.86 N ATOM 172 CD2 HIS A 140 21.674 9.346 7.335 1.00 55.69 C ATOM 173 CE1 HIS A 140 23.157 9.793 5.783 1.00 55.81 C ATOM 174 NE2 HIS A 140 22.949 9.794 7.087 1.00 57.05 N ATOM 175 H HIS A 140 20.465 6.407 6.857 1.00 0.00 H ATOM 176 N LYS A 141 17.188 6.693 5.970 1.00 43.17 N ATOM 177 CA LYS A 141 15.814 6.418 5.587 1.00 43.34 C ATOM 178 C LYS A 141 14.948 5.949 6.749 1.00 45.32 C ATOM 179 O LYS A 141 13.717 5.892 6.625 1.00 45.31 O ATOM 180 CB LYS A 141 15.785 5.378 4.466 1.00 43.90 C ATOM 181 CG LYS A 141 16.038 5.967 3.073 1.00 41.62 C ATOM 182 CD LYS A 141 16.561 4.937 2.083 1.00 44.97 C ATOM 183 CE LYS A 141 15.663 3.725 1.987 1.00 56.91 C ATOM 184 NZ LYS A 141 16.236 2.723 1.036 1.00 66.10 N ATOM 185 HZ1 LYS A 141 16.326 3.153 0.093 1.00 0.00 H ATOM 186 HZ2 LYS A 141 17.173 2.424 1.373 1.00 0.00 H ATOM 187 HZ3 LYS A 141 15.606 1.897 0.983 1.00 0.00 H ATOM 188 H LYS A 141 17.931 6.008 5.726 1.00 0.00 H ATOM 189 N THR A 142 15.575 5.638 7.882 1.00 44.06 N ATOM 190 CA THR A 142 14.823 5.161 9.043 1.00 43.95 C ATOM 191 C THR A 142 15.014 5.956 10.327 1.00 42.49 C ATOM 192 O THR A 142 14.567 5.541 11.389 1.00 42.92 O ATOM 193 CB THR A 142 15.148 3.692 9.323 1.00 45.74 C ATOM 194 OG1 THR A 142 16.567 3.532 9.455 1.00 46.58 O ATOM 195 CG2 THR A 142 14.636 2.824 8.183 1.00 39.52 C ATOM 196 HG1 THR A 142 17.009 3.814 8.615 1.00 0.00 H ATOM 197 H THR A 142 16.609 5.735 7.942 1.00 0.00 H ATOM 198 N TYR A 143 15.677 7.101 10.236 1.00 42.73 N ATOM 199 CA TYR A 143 15.879 7.938 11.409 1.00 42.52 C ATOM 200 C TYR A 143 15.662 9.399 11.020 1.00 43.73 C ATOM 201 O TYR A 143 16.481 9.998 10.330 1.00 44.12 O ATOM 202 CB TYR A 143 17.283 7.732 11.987 1.00 35.57 C ATOM 203 CG TYR A 143 17.453 8.296 13.381 1.00 42.58 C ATOM 204 CD1 TYR A 143 17.691 9.655 13.579 1.00 47.46 C ATOM 205 CD2 TYR A 143 17.315 7.484 14.511 1.00 45.67 C ATOM 206 CE1 TYR A 143 17.781 10.198 14.868 1.00 38.33 C ATOM 207 CE2 TYR A 143 17.404 8.019 15.808 1.00 34.26 C ATOM 208 CZ TYR A 143 17.636 9.385 15.974 1.00 47.16 C ATOM 209 OH TYR A 143 17.711 9.947 17.241 1.00 37.01 O ATOM 210 HH TYR A 143 17.880 10.919 17.160 1.00 0.00 H ATOM 211 H TYR A 143 16.057 7.404 9.316 1.00 0.00 H ATOM 212 N ASP A 144 14.528 9.947 11.449 1.00 43.77 N ATOM 213 CA ASP A 144 14.178 11.332 11.175 1.00 45.26 C ATOM 214 C ASP A 144 14.621 12.184 12.362 1.00 47.79 C ATOM 215 O ASP A 144 14.004 12.158 13.430 1.00 49.15 O ATOM 216 CB ASP A 144 12.672 11.447 10.948 1.00 40.40 C ATOM 217 CG ASP A 144 12.180 12.874 11.040 1.00 48.26 C ATOM 218 OD1 ASP A 144 12.984 13.799 10.794 1.00 43.13 O ATOM 219 OD2 ASP A 144 10.988 13.068 11.352 1.00 43.41 O ATOM 220 H ASP A 144 13.867 9.363 12.001 1.00 0.00 H ATOM 221 N PRO A 145 15.717 12.944 12.191 1.00 49.45 N ATOM 222 CA PRO A 145 16.273 13.809 13.234 1.00 51.02 C ATOM 223 C PRO A 145 15.420 15.013 13.632 1.00 52.83 C ATOM 224 O PRO A 145 15.837 15.825 14.455 1.00 54.47 O ATOM 225 CB PRO A 145 17.633 14.201 12.665 1.00 49.11 C ATOM 226 CG PRO A 145 17.383 14.227 11.216 1.00 50.12 C ATOM 227 CD PRO A 145 16.546 12.994 10.976 1.00 49.29 C ATOM 228 N THR A 146 14.236 15.132 13.040 1.00 52.66 N ATOM 229 CA THR A 146 13.329 16.213 13.387 1.00 52.51 C ATOM 230 C THR A 146 12.244 15.610 14.280 1.00 52.31 C ATOM 231 O THR A 146 11.455 16.324 14.905 1.00 51.06 O ATOM 232 CB THR A 146 12.696 16.856 12.131 1.00 51.70 C ATOM 233 OG1 THR A 146 11.901 15.892 11.431 1.00 52.14 O ATOM 234 CG2 THR A 146 13.785 17.369 11.203 1.00 52.31 C ATOM 235 HG1 THR A 146 12.473 15.133 11.154 1.00 0.00 H ATOM 236 H THR A 146 13.954 14.440 12.317 1.00 0.00 H ATOM 237 N TYR A 147 12.217 14.280 14.327 1.00 51.26 N ATOM 238 CA TYR A 147 11.265 13.542 15.156 1.00 51.43 C ATOM 239 C TYR A 147 9.818 14.024 15.012 1.00 51.61 C ATOM 240 O TYR A 147 9.064 14.067 15.987 1.00 51.49 O ATOM 241 CB TYR A 147 11.704 13.627 16.626 1.00 51.15 C ATOM 242 CG TYR A 147 13.182 13.341 16.844 1.00 48.46 C ATOM 243 CD1 TYR A 147 14.094 14.378 17.052 1.00 42.90 C ATOM 244 CD2 TYR A 147 13.674 12.038 16.785 1.00 41.62 C ATOM 245 CE1 TYR A 147 15.465 14.123 17.193 1.00 39.49 C ATOM 246 CE2 TYR A 147 15.037 11.771 16.920 1.00 40.02 C ATOM 247 CZ TYR A 147 15.930 12.814 17.121 1.00 43.08 C ATOM 248 OH TYR A 147 17.285 12.544 17.212 1.00 40.72 O ATOM 249 HH TYR A 147 17.448 11.933 17.973 1.00 0.00 H ATOM 250 H TYR A 147 12.899 13.745 13.752 1.00 0.00 H ATOM 251 N ALA A 148 9.431 14.359 13.786 1.00 52.53 N ATOM 252 CA ALA A 148 8.092 14.861 13.500 1.00 54.03 C ATOM 253 C ALA A 148 6.931 13.903 13.790 1.00 55.70 C ATOM 254 O ALA A 148 5.835 14.346 14.153 1.00 55.02 O ATOM 255 CB ALA A 148 8.027 15.314 12.050 1.00 54.02 C ATOM 256 H ALA A 148 10.107 14.260 13.002 1.00 0.00 H ATOM 257 N ASP A 149 7.153 12.599 13.626 1.00 55.67 N ATOM 258 CA ASP A 149 6.084 11.626 13.861 1.00 54.68 C ATOM 259 C ASP A 149 5.736 11.448 15.336 1.00 54.54 C ATOM 260 O ASP A 149 4.735 10.811 15.671 1.00 54.90 O ATOM 261 CB ASP A 149 6.452 10.257 13.280 1.00 50.49 C ATOM 262 CG ASP A 149 6.853 10.323 11.820 1.00 58.95 C ATOM 263 OD1 ASP A 149 6.223 11.085 11.052 1.00 58.76 O ATOM 264 OD2 ASP A 149 7.799 9.596 11.437 1.00 55.48 O ATOM 265 H ASP A 149 8.094 12.270 13.329 1.00 0.00 H ATOM 266 N PHE A 150 6.563 11.993 16.220 1.00 54.80 N ATOM 267 CA PHE A 150 6.319 11.860 17.654 1.00 56.73 C ATOM 268 C PHE A 150 4.973 12.450 18.059 1.00 57.70 C ATOM 269 O PHE A 150 4.467 12.182 19.150 1.00 57.37 O ATOM 270 CB PHE A 150 7.455 12.525 18.445 1.00 57.98 C ATOM 271 CG PHE A 150 8.699 11.676 18.551 1.00 58.71 C ATOM 272 CD1 PHE A 150 9.145 10.925 17.463 1.00 60.07 C ATOM 273 CD2 PHE A 150 9.427 11.632 19.735 1.00 57.63 C ATOM 274 CE1 PHE A 150 10.299 10.143 17.558 1.00 58.05 C ATOM 275 CE2 PHE A 150 10.581 10.855 19.837 1.00 55.41 C ATOM 276 CZ PHE A 150 11.016 10.109 18.746 1.00 56.32 C ATOM 277 H PHE A 150 7.395 12.521 15.887 1.00 0.00 H ATOM 278 N ARG A 151 4.390 13.238 17.163 1.00 58.74 N ATOM 279 CA ARG A 151 3.102 13.868 17.419 1.00 60.44 C ATOM 280 C ARG A 151 1.949 12.873 17.282 1.00 59.38 C ATOM 281 O ARG A 151 0.826 13.142 17.722 1.00 60.09 O ATOM 282 CB ARG A 151 2.911 15.041 16.460 1.00 62.86 C ATOM 283 CG ARG A 151 4.088 16.005 16.475 1.00 74.27 C ATOM 284 CD ARG A 151 3.957 17.092 15.422 1.00 79.41 C ATOM 285 NE ARG A 151 5.129 17.962 15.405 1.00 84.69 N ATOM 286 CZ ARG A 151 5.564 18.654 16.455 1.00 88.90 C ATOM 287 NH1 ARG A 151 4.924 18.580 17.615 1.00 88.68 N ATOM 288 NH2 ARG A 151 6.636 19.429 16.347 1.00 90.53 N ATOM 289 HE ARG A 151 5.659 18.047 14.514 1.00 0.00 H ATOM 290 HH12 ARG A 151 5.267 19.122 18.434 1.00 0.00 H ATOM 291 HH11 ARG A 151 4.080 17.980 17.706 1.00 0.00 H ATOM 292 HH22 ARG A 151 6.973 19.968 17.170 1.00 0.00 H ATOM 293 HH21 ARG A 151 7.139 19.497 15.439 1.00 0.00 H ATOM 294 H ARG A 151 4.866 13.410 16.254 1.00 0.00 H ATOM 295 N ASP A 152 2.221 11.722 16.677 1.00 56.79 N ATOM 296 CA ASP A 152 1.182 10.715 16.515 1.00 55.19 C ATOM 297 C ASP A 152 1.064 9.876 17.787 1.00 53.02 C ATOM 298 O ASP A 152 0.018 9.298 18.057 1.00 53.38 O ATOM 299 CB ASP A 152 1.485 9.784 15.329 1.00 57.38 C ATOM 300 CG ASP A 152 1.696 10.535 14.019 1.00 61.68 C ATOM 301 OD1 ASP A 152 1.073 11.600 13.828 1.00 58.11 O ATOM 302 OD2 ASP A 152 2.476 10.041 13.173 1.00 61.25 O ATOM 303 H ASP A 152 3.180 11.540 16.318 1.00 0.00 H ATOM 304 N PHE A 153 2.141 9.821 18.563 1.00 51.67 N ATOM 305 CA PHE A 153 2.177 9.037 19.801 1.00 50.96 C ATOM 306 C PHE A 153 1.188 9.577 20.834 1.00 51.53 C ATOM 307 O PHE A 153 0.873 10.770 20.831 1.00 51.16 O ATOM 308 CB PHE A 153 3.585 9.080 20.413 1.00 50.84 C ATOM 309 CG PHE A 153 4.695 8.636 19.475 1.00 48.79 C ATOM 310 CD1 PHE A 153 6.027 8.878 19.807 1.00 45.61 C ATOM 311 CD2 PHE A 153 4.417 7.976 18.282 1.00 45.28 C ATOM 312 CE1 PHE A 153 7.063 8.478 18.970 1.00 46.85 C ATOM 313 CE2 PHE A 153 5.453 7.567 17.436 1.00 48.62 C ATOM 314 CZ PHE A 153 6.779 7.823 17.784 1.00 40.14 C ATOM 315 H PHE A 153 2.989 10.353 18.282 1.00 0.00 H ATOM 316 N ARG A 154 0.701 8.702 21.712 1.00 49.27 N ATOM 317 CA ARG A 154 -0.208 9.127 22.767 1.00 50.38 C ATOM 318 C ARG A 154 0.589 10.142 23.579 1.00 51.67 C ATOM 319 O ARG A 154 1.754 9.910 23.895 1.00 52.27 O ATOM 320 CB ARG A 154 -0.619 7.940 23.643 1.00 47.97 C ATOM 321 CG ARG A 154 -1.624 6.997 22.989 1.00 49.83 C ATOM 322 CD ARG A 154 -1.777 5.699 23.778 1.00 50.20 C ATOM 323 NE ARG A 154 -0.626 4.807 23.618 1.00 46.62 N ATOM 324 CZ ARG A 154 -0.516 3.615 24.199 1.00 50.31 C ATOM 325 NH1 ARG A 154 -1.482 3.156 24.988 1.00 45.12 N ATOM 326 NH2 ARG A 154 0.563 2.875 23.988 1.00 49.66 N ATOM 327 HE ARG A 154 0.156 5.126 23.011 1.00 0.00 H ATOM 328 HH12 ARG A 154 -1.387 2.223 25.438 1.00 0.00 H ATOM 329 HH11 ARG A 154 -2.333 3.730 25.156 1.00 0.00 H ATOM 330 HH22 ARG A 154 0.651 1.943 24.441 1.00 0.00 H ATOM 331 HH21 ARG A 154 1.322 3.226 23.369 1.00 0.00 H ATOM 332 H ARG A 154 0.974 7.701 21.643 1.00 0.00 H ATOM 333 N PRO A 155 -0.036 11.271 23.947 1.00 53.32 N ATOM 334 CA PRO A 155 0.612 12.341 24.718 1.00 55.08 C ATOM 335 C PRO A 155 1.343 11.907 25.984 1.00 56.25 C ATOM 336 O PRO A 155 0.834 11.104 26.765 1.00 55.69 O ATOM 337 CB PRO A 155 -0.546 13.293 25.027 1.00 53.33 C ATOM 338 CG PRO A 155 -1.706 12.344 25.173 1.00 55.22 C ATOM 339 CD PRO A 155 -1.504 11.420 23.986 1.00 52.11 C ATOM 340 N PRO A 156 2.554 12.442 26.206 1.00 56.84 N ATOM 341 CA PRO A 156 3.293 12.065 27.410 1.00 58.65 C ATOM 342 C PRO A 156 2.634 12.747 28.610 1.00 61.20 C ATOM 343 O PRO A 156 2.056 13.829 28.473 1.00 59.14 O ATOM 344 CB PRO A 156 4.697 12.596 27.128 1.00 56.89 C ATOM 345 CG PRO A 156 4.426 13.838 26.343 1.00 49.28 C ATOM 346 CD PRO A 156 3.321 13.407 25.393 1.00 55.25 C ATOM 347 N VAL A 157 2.709 12.110 29.773 1.00 63.87 N ATOM 348 CA VAL A 157 2.122 12.661 30.990 1.00 67.82 C ATOM 349 C VAL A 157 3.154 12.607 32.113 1.00 70.50 C ATOM 350 O VAL A 157 3.554 11.529 32.553 1.00 70.33 O ATOM 351 CB VAL A 157 0.865 11.867 31.414 1.00 68.06 C ATOM 352 CG1 VAL A 157 0.308 12.424 32.718 1.00 66.88 C ATOM 353 CG2 VAL A 157 -0.187 11.942 30.317 1.00 65.61 C ATOM 354 H VAL A 157 3.199 11.194 29.818 1.00 0.00 H ATOM 355 N ARG A 158 3.578 13.778 32.575 1.00 72.82 N ATOM 356 CA ARG A 158 4.581 13.855 33.627 1.00 76.34 C ATOM 357 C ARG A 158 4.042 14.328 34.979 1.00 78.82 C ATOM 358 O ARG A 158 4.738 15.015 35.730 1.00 79.32 O ATOM 359 CB ARG A 158 5.728 14.758 33.162 1.00 73.68 C ATOM 360 CG ARG A 158 6.396 14.273 31.877 1.00 72.24 C ATOM 361 CD ARG A 158 7.579 15.148 31.485 1.00 68.07 C ATOM 362 NE ARG A 158 8.370 14.563 30.404 1.00 66.09 N ATOM 363 CZ ARG A 158 8.004 14.531 29.126 1.00 64.02 C ATOM 364 NH1 ARG A 158 6.847 15.056 28.744 1.00 61.31 N ATOM 365 NH2 ARG A 158 8.799 13.971 28.229 1.00 58.79 N ATOM 366 HE ARG A 158 9.287 14.140 30.653 1.00 0.00 H ATOM 367 HH12 ARG A 158 6.568 15.027 27.743 1.00 0.00 H ATOM 368 HH11 ARG A 158 6.219 15.497 29.446 1.00 0.00 H ATOM 369 HH22 ARG A 158 8.516 13.944 27.228 1.00 0.00 H ATOM 370 HH21 ARG A 158 9.707 13.558 28.524 1.00 0.00 H ATOM 371 H ARG A 158 3.186 14.656 32.178 1.00 0.00 H ATOM 372 N MET A 159 2.804 13.952 35.289 1.00 80.89 N ATOM 373 CA MET A 159 2.187 14.325 36.558 1.00 82.46 C ATOM 374 C MET A 159 2.903 13.635 37.716 1.00 83.38 C ATOM 375 O MET A 159 2.483 12.570 38.174 1.00 83.92 O ATOM 376 CB MET A 159 0.703 13.937 36.578 1.00 84.56 C ATOM 377 CG MET A 159 -0.184 14.757 35.651 1.00 91.16 C ATOM 378 SD MET A 159 -1.953 14.484 35.955 1.00100.65 S ATOM 379 CE MET A 159 -2.338 15.888 37.022 1.00 96.22 C ATOM 380 H MET A 159 2.263 13.379 34.611 1.00 0.00 H TER 381 MET A 159 ATOM 382 N SER A 218 -1.504 7.655 40.403 1.00 75.14 N ATOM 383 CA SER A 218 -0.931 6.417 39.888 1.00 74.62 C ATOM 384 C SER A 218 0.207 6.702 38.909 1.00 73.27 C ATOM 385 O SER A 218 0.044 7.468 37.956 1.00 73.24 O ATOM 386 CB SER A 218 -2.009 5.582 39.185 1.00 79.03 C ATOM 387 OG SER A 218 -2.471 6.211 38.000 1.00 80.16 O ATOM 388 HG SER A 218 -1.713 6.332 37.375 1.00 0.00 H ATOM 389 HN3 SER A 218 -1.878 8.218 39.612 1.00 0.00 H ATOM 390 HN2 SER A 218 -0.767 8.197 40.898 1.00 0.00 H ATOM 391 HN1 SER A 218 -2.274 7.430 41.065 1.00 0.00 H ATOM 392 N PRO A 219 1.380 6.086 39.136 1.00 71.01 N ATOM 393 CA PRO A 219 2.534 6.289 38.258 1.00 69.51 C ATOM 394 C PRO A 219 2.303 5.663 36.886 1.00 67.43 C ATOM 395 O PRO A 219 1.159 5.529 36.442 1.00 68.60 O ATOM 396 CB PRO A 219 3.671 5.618 39.027 1.00 70.03 C ATOM 397 CG PRO A 219 2.972 4.485 39.709 1.00 69.73 C ATOM 398 CD PRO A 219 1.708 5.143 40.220 1.00 69.66 C ATOM 399 N LEU A 220 3.388 5.271 36.227 1.00 64.34 N ATOM 400 CA LEU A 220 3.297 4.676 34.900 1.00 59.49 C ATOM 401 C LEU A 220 2.615 5.645 33.949 1.00 57.36 C ATOM 402 O LEU A 220 2.056 5.246 32.931 1.00 56.27 O ATOM 403 CB LEU A 220 2.516 3.362 34.947 1.00 53.75 C ATOM 404 CG LEU A 220 3.102 2.232 35.793 1.00 56.78 C ATOM 405 CD1 LEU A 220 2.324 0.963 35.523 1.00 52.43 C ATOM 406 CD2 LEU A 220 4.570 2.025 35.461 1.00 55.29 C ATOM 407 H LEU A 220 4.322 5.391 36.668 1.00 0.00 H ATOM 408 N SER A 221 2.668 6.927 34.288 1.00 56.13 N ATOM 409 CA SER A 221 2.060 7.957 33.463 1.00 56.37 C ATOM 410 C SER A 221 2.727 8.101 32.091 1.00 56.18 C ATOM 411 O SER A 221 2.108 8.607 31.154 1.00 57.37 O ATOM 412 CB SER A 221 2.099 9.300 34.194 1.00 56.07 C ATOM 413 OG SER A 221 3.435 9.657 34.508 1.00 61.04 O ATOM 414 HG SER A 221 3.961 9.730 33.672 1.00 0.00 H ATOM 415 H SER A 221 3.156 7.201 35.165 1.00 0.00 H ATOM 416 N MET A 222 3.982 7.669 31.970 1.00 54.31 N ATOM 417 CA MET A 222 4.702 7.763 30.693 1.00 52.24 C ATOM 418 C MET A 222 4.631 6.473 29.875 1.00 50.89 C ATOM 419 O MET A 222 5.121 6.417 28.744 1.00 51.82 O ATOM 420 CB MET A 222 6.178 8.115 30.927 1.00 52.76 C ATOM 421 CG MET A 222 6.431 9.550 31.334 1.00 52.91 C ATOM 422 SD MET A 222 5.882 10.700 30.075 1.00 54.45 S ATOM 423 CE MET A 222 7.314 10.765 29.000 1.00 62.53 C ATOM 424 H MET A 222 4.461 7.257 32.796 1.00 0.00 H ATOM 425 N LEU A 223 4.030 5.436 30.447 1.00 49.29 N ATOM 426 CA LEU A 223 3.916 4.151 29.765 1.00 48.10 C ATOM 427 C LEU A 223 3.285 4.247 28.369 1.00 47.33 C ATOM 428 O LEU A 223 3.822 3.702 27.401 1.00 47.08 O ATOM 429 CB LEU A 223 3.120 3.172 30.627 1.00 45.08 C ATOM 430 CG LEU A 223 3.220 1.702 30.239 1.00 45.71 C ATOM 431 CD1 LEU A 223 4.671 1.336 30.094 1.00 42.35 C ATOM 432 CD2 LEU A 223 2.551 0.840 31.299 1.00 38.38 C ATOM 433 H LEU A 223 3.632 5.542 31.402 1.00 0.00 H ATOM 434 N PRO A 224 2.130 4.925 28.248 1.00 46.32 N ATOM 435 CA PRO A 224 1.500 5.039 26.928 1.00 45.44 C ATOM 436 C PRO A 224 2.381 5.756 25.900 1.00 45.43 C ATOM 437 O PRO A 224 2.527 5.292 24.775 1.00 43.85 O ATOM 438 CB PRO A 224 0.208 5.799 27.224 1.00 46.44 C ATOM 439 CG PRO A 224 -0.128 5.331 28.628 1.00 49.75 C ATOM 440 CD PRO A 224 1.226 5.415 29.305 1.00 45.38 C ATOM 441 N HIS A 225 2.976 6.881 26.284 1.00 45.53 N ATOM 442 CA HIS A 225 3.830 7.614 25.354 1.00 44.95 C ATOM 443 C HIS A 225 5.070 6.814 24.964 1.00 43.44 C ATOM 444 O HIS A 225 5.316 6.581 23.780 1.00 43.72 O ATOM 445 CB HIS A 225 4.265 8.947 25.957 1.00 46.26 C ATOM 446 CG HIS A 225 5.049 9.806 25.015 1.00 50.58 C ATOM 447 ND1 HIS A 225 4.481 10.418 23.918 1.00 50.53 N ATOM 448 CD2 HIS A 225 6.359 10.149 25.001 1.00 50.82 C ATOM 449 CE1 HIS A 225 5.408 11.101 23.268 1.00 57.55 C ATOM 450 NE2 HIS A 225 6.557 10.956 23.904 1.00 55.12 N ATOM 451 H HIS A 225 2.833 7.240 27.250 1.00 0.00 H ATOM 452 N LEU A 226 5.851 6.396 25.957 1.00 42.76 N ATOM 453 CA LEU A 226 7.061 5.630 25.687 1.00 42.00 C ATOM 454 C LEU A 226 6.784 4.273 25.022 1.00 41.19 C ATOM 455 O LEU A 226 7.615 3.775 24.260 1.00 41.45 O ATOM 456 CB LEU A 226 7.876 5.458 26.975 1.00 43.15 C ATOM 457 CG LEU A 226 8.345 6.789 27.593 1.00 42.98 C ATOM 458 CD1 LEU A 226 9.201 6.536 28.828 1.00 38.59 C ATOM 459 CD2 LEU A 226 9.127 7.581 26.566 1.00 39.44 C ATOM 460 H LEU A 226 5.594 6.619 26.940 1.00 0.00 H ATOM 461 N ALA A 227 5.617 3.689 25.282 1.00 40.47 N ATOM 462 CA ALA A 227 5.268 2.408 24.671 1.00 40.93 C ATOM 463 C ALA A 227 5.155 2.656 23.176 1.00 43.44 C ATOM 464 O ALA A 227 5.623 1.859 22.359 1.00 42.12 O ATOM 465 CB ALA A 227 3.949 1.909 25.206 1.00 41.16 C ATOM 466 H ALA A 227 4.945 4.150 25.928 1.00 0.00 H ATOM 467 N ASP A 228 4.524 3.776 22.832 1.00 42.91 N ATOM 468 CA ASP A 228 4.344 4.176 21.443 1.00 43.76 C ATOM 469 C ASP A 228 5.673 4.506 20.777 1.00 42.19 C ATOM 470 O ASP A 228 5.920 4.088 19.648 1.00 41.78 O ATOM 471 CB ASP A 228 3.395 5.376 21.373 1.00 42.86 C ATOM 472 CG ASP A 228 1.959 4.994 21.667 1.00 47.29 C ATOM 473 OD1 ASP A 228 1.145 5.899 21.922 1.00 52.34 O ATOM 474 OD2 ASP A 228 1.635 3.784 21.637 1.00 44.25 O ATOM 475 H ASP A 228 4.145 4.388 23.583 1.00 0.00 H ATOM 476 N LEU A 229 6.528 5.246 21.483 1.00 42.73 N ATOM 477 CA LEU A 229 7.851 5.631 20.968 1.00 41.20 C ATOM 478 C LEU A 229 8.649 4.362 20.658 1.00 38.16 C ATOM 479 O LEU A 229 9.263 4.227 19.602 1.00 37.01 O ATOM 480 CB LEU A 229 8.624 6.428 22.020 1.00 38.61 C ATOM 481 CG LEU A 229 9.772 7.365 21.623 1.00 45.70 C ATOM 482 CD1 LEU A 229 10.829 7.322 22.723 1.00 46.08 C ATOM 483 CD2 LEU A 229 10.385 6.980 20.290 1.00 48.16 C ATOM 484 H LEU A 229 6.249 5.563 22.433 1.00 0.00 H ATOM 485 N VAL A 230 8.652 3.445 21.609 1.00 37.66 N ATOM 486 CA VAL A 230 9.375 2.197 21.428 1.00 39.53 C ATOM 487 C VAL A 230 8.784 1.418 20.269 1.00 36.92 C ATOM 488 O VAL A 230 9.521 0.905 19.432 1.00 42.22 O ATOM 489 CB VAL A 230 9.325 1.351 22.715 1.00 39.00 C ATOM 490 CG1 VAL A 230 9.822 -0.074 22.445 1.00 39.56 C ATOM 491 CG2 VAL A 230 10.182 2.008 23.761 1.00 33.43 C ATOM 492 H VAL A 230 8.133 3.617 22.494 1.00 0.00 H ATOM 493 N SER A 231 7.454 1.346 20.220 1.00 37.94 N ATOM 494 CA SER A 231 6.752 0.620 19.159 1.00 39.08 C ATOM 495 C SER A 231 7.177 1.183 17.811 1.00 38.50 C ATOM 496 O SER A 231 7.489 0.444 16.887 1.00 36.47 O ATOM 497 CB SER A 231 5.237 0.764 19.328 1.00 38.03 C ATOM 498 OG SER A 231 4.543 -0.199 18.554 1.00 37.40 O ATOM 499 HG SER A 231 4.768 -0.077 17.598 1.00 0.00 H ATOM 500 H SER A 231 6.897 1.821 20.959 1.00 0.00 H ATOM 501 N TYR A 232 7.185 2.508 17.719 1.00 36.16 N ATOM 502 CA TYR A 232 7.590 3.221 16.515 1.00 34.14 C ATOM 503 C TYR A 232 9.041 2.845 16.180 1.00 34.31 C ATOM 504 O TYR A 232 9.382 2.522 15.036 1.00 35.11 O ATOM 505 CB TYR A 232 7.499 4.725 16.793 1.00 32.29 C ATOM 506 CG TYR A 232 8.054 5.619 15.715 1.00 37.72 C ATOM 507 CD1 TYR A 232 7.246 6.090 14.684 1.00 40.18 C ATOM 508 CD2 TYR A 232 9.380 6.041 15.755 1.00 44.37 C ATOM 509 CE1 TYR A 232 7.749 6.975 13.722 1.00 44.27 C ATOM 510 CE2 TYR A 232 9.890 6.921 14.797 1.00 35.82 C ATOM 511 CZ TYR A 232 9.070 7.387 13.792 1.00 40.39 C ATOM 512 OH TYR A 232 9.567 8.306 12.889 1.00 41.24 O ATOM 513 HH TYR A 232 8.861 8.539 12.235 1.00 0.00 H ATOM 514 H TYR A 232 6.888 3.063 18.547 1.00 0.00 H ATOM 515 N SER A 233 9.889 2.896 17.198 1.00 33.55 N ATOM 516 CA SER A 233 11.297 2.588 17.036 1.00 36.45 C ATOM 517 C SER A 233 11.547 1.144 16.592 1.00 34.84 C ATOM 518 O SER A 233 12.448 0.880 15.804 1.00 33.20 O ATOM 519 CB SER A 233 12.041 2.908 18.330 1.00 36.82 C ATOM 520 OG SER A 233 11.970 4.304 18.575 1.00 39.64 O ATOM 521 HG SER A 233 11.022 4.575 18.660 1.00 0.00 H ATOM 522 H SER A 233 9.535 3.164 18.138 1.00 0.00 H ATOM 523 N ILE A 234 10.750 0.210 17.085 1.00 36.35 N ATOM 524 CA ILE A 234 10.914 -1.170 16.649 1.00 35.12 C ATOM 525 C ILE A 234 10.692 -1.229 15.139 1.00 35.25 C ATOM 526 O ILE A 234 11.453 -1.875 14.426 1.00 38.10 O ATOM 527 CB ILE A 234 9.915 -2.104 17.361 1.00 33.54 C ATOM 528 CG1 ILE A 234 10.271 -2.186 18.854 1.00 36.35 C ATOM 529 CG2 ILE A 234 9.944 -3.496 16.718 1.00 29.87 C ATOM 530 CD1 ILE A 234 9.303 -2.986 19.686 1.00 29.36 C ATOM 531 H ILE A 234 10.014 0.459 17.777 1.00 0.00 H ATOM 532 N GLN A 235 9.662 -0.542 14.647 1.00 36.70 N ATOM 533 CA GLN A 235 9.366 -0.539 13.209 1.00 38.41 C ATOM 534 C GLN A 235 10.542 -0.005 12.390 1.00 38.30 C ATOM 535 O GLN A 235 10.886 -0.559 11.344 1.00 38.09 O ATOM 536 CB GLN A 235 8.108 0.290 12.906 1.00 39.14 C ATOM 537 CG GLN A 235 6.811 -0.342 13.392 1.00 41.63 C ATOM 538 CD GLN A 235 5.575 0.429 12.953 1.00 44.58 C ATOM 539 OE1 GLN A 235 5.340 0.634 11.762 1.00 39.82 O ATOM 540 NE2 GLN A 235 4.778 0.858 13.917 1.00 52.39 N ATOM 541 HE22 GLN A 235 5.013 0.663 14.911 1.00 0.00 H ATOM 542 HE21 GLN A 235 3.916 1.390 13.681 1.00 0.00 H ATOM 543 H GLN A 235 9.056 0.002 15.294 1.00 0.00 H ATOM 544 N LYS A 236 11.153 1.076 12.866 1.00 37.50 N ATOM 545 CA LYS A 236 12.294 1.672 12.186 1.00 33.06 C ATOM 546 C LYS A 236 13.523 0.763 12.247 1.00 35.84 C ATOM 547 O LYS A 236 14.278 0.649 11.271 1.00 33.67 O ATOM 548 CB LYS A 236 12.622 3.024 12.815 1.00 37.58 C ATOM 549 CG LYS A 236 11.482 4.030 12.710 1.00 35.81 C ATOM 550 CD LYS A 236 11.093 4.248 11.233 1.00 39.50 C ATOM 551 CE LYS A 236 9.813 5.063 11.103 1.00 48.19 C ATOM 552 NZ LYS A 236 9.351 5.136 9.679 1.00 50.03 N ATOM 553 HZ1 LYS A 236 10.088 5.585 9.099 1.00 0.00 H ATOM 554 HZ2 LYS A 236 9.168 4.175 9.326 1.00 0.00 H ATOM 555 HZ3 LYS A 236 8.478 5.698 9.628 1.00 0.00 H ATOM 556 H LYS A 236 10.807 1.507 13.747 1.00 0.00 H ATOM 557 N VAL A 237 13.736 0.118 13.390 1.00 33.67 N ATOM 558 CA VAL A 237 14.885 -0.772 13.517 1.00 37.14 C ATOM 559 C VAL A 237 14.728 -1.924 12.519 1.00 35.68 C ATOM 560 O VAL A 237 15.704 -2.353 11.914 1.00 38.29 O ATOM 561 CB VAL A 237 15.032 -1.328 14.966 1.00 36.69 C ATOM 562 CG1 VAL A 237 16.112 -2.418 15.007 1.00 25.75 C ATOM 563 CG2 VAL A 237 15.420 -0.192 15.918 1.00 33.15 C ATOM 564 H VAL A 237 13.086 0.248 14.191 1.00 0.00 H ATOM 565 N ILE A 238 13.500 -2.411 12.357 1.00 35.87 N ATOM 566 CA ILE A 238 13.210 -3.498 11.413 1.00 38.06 C ATOM 567 C ILE A 238 13.555 -3.064 9.978 1.00 38.16 C ATOM 568 O ILE A 238 14.211 -3.793 9.233 1.00 36.69 O ATOM 569 CB ILE A 238 11.710 -3.895 11.467 1.00 38.93 C ATOM 570 CG1 ILE A 238 11.406 -4.592 12.803 1.00 37.49 C ATOM 571 CG2 ILE A 238 11.356 -4.802 10.274 1.00 37.02 C ATOM 572 CD1 ILE A 238 9.907 -4.791 13.075 1.00 32.55 C ATOM 573 H ILE A 238 12.721 -2.009 12.917 1.00 0.00 H ATOM 574 N GLY A 239 13.111 -1.867 9.604 1.00 38.11 N ATOM 575 CA GLY A 239 13.392 -1.348 8.275 1.00 37.36 C ATOM 576 C GLY A 239 14.887 -1.208 8.045 1.00 35.41 C ATOM 577 O GLY A 239 15.373 -1.389 6.923 1.00 36.11 O ATOM 578 H GLY A 239 12.555 -1.295 10.271 1.00 0.00 H ATOM 579 N PHE A 240 15.625 -0.885 9.104 1.00 35.06 N ATOM 580 CA PHE A 240 17.081 -0.751 9.004 1.00 34.10 C ATOM 581 C PHE A 240 17.664 -2.136 8.753 1.00 34.82 C ATOM 582 O PHE A 240 18.450 -2.341 7.842 1.00 37.49 O ATOM 583 CB PHE A 240 17.653 -0.199 10.309 1.00 32.54 C ATOM 584 CG PHE A 240 19.167 -0.206 10.379 1.00 38.48 C ATOM 585 CD1 PHE A 240 19.918 0.804 9.773 1.00 37.33 C ATOM 586 CD2 PHE A 240 19.840 -1.224 11.063 1.00 30.48 C ATOM 587 CE1 PHE A 240 21.331 0.800 9.851 1.00 36.58 C ATOM 588 CE2 PHE A 240 21.245 -1.243 11.152 1.00 27.53 C ATOM 589 CZ PHE A 240 21.993 -0.225 10.544 1.00 35.44 C ATOM 590 H PHE A 240 15.160 -0.725 10.020 1.00 0.00 H ATOM 591 N ALA A 241 17.262 -3.090 9.574 1.00 35.87 N ATOM 592 CA ALA A 241 17.771 -4.450 9.456 1.00 37.18 C ATOM 593 C ALA A 241 17.599 -5.036 8.061 1.00 38.43 C ATOM 594 O ALA A 241 18.518 -5.668 7.534 1.00 42.29 O ATOM 595 CB ALA A 241 17.092 -5.338 10.494 1.00 32.62 C ATOM 596 H ALA A 241 16.570 -2.866 10.317 1.00 0.00 H ATOM 597 N LYS A 242 16.429 -4.837 7.459 1.00 40.14 N ATOM 598 CA LYS A 242 16.170 -5.368 6.126 1.00 41.74 C ATOM 599 C LYS A 242 17.117 -4.832 5.060 1.00 44.50 C ATOM 600 O LYS A 242 17.230 -5.428 3.984 1.00 43.92 O ATOM 601 CB LYS A 242 14.722 -5.107 5.700 1.00 41.46 C ATOM 602 CG LYS A 242 13.700 -5.861 6.529 1.00 52.38 C ATOM 603 CD LYS A 242 12.423 -6.128 5.740 1.00 63.48 C ATOM 604 CE LYS A 242 11.724 -4.850 5.329 1.00 64.18 C ATOM 605 NZ LYS A 242 10.467 -5.155 4.591 1.00 64.02 N ATOM 606 HZ1 LYS A 242 10.692 -5.706 3.738 1.00 0.00 H ATOM 607 HZ2 LYS A 242 9.832 -5.706 5.203 1.00 0.00 H ATOM 608 HZ3 LYS A 242 10.002 -4.266 4.318 1.00 0.00 H ATOM 609 H LYS A 242 15.688 -4.294 7.947 1.00 0.00 H ATOM 610 N MET A 243 17.785 -3.714 5.346 1.00 43.42 N ATOM 611 CA MET A 243 18.733 -3.138 4.395 1.00 44.39 C ATOM 612 C MET A 243 20.184 -3.541 4.694 1.00 44.91 C ATOM 613 O MET A 243 21.103 -3.139 3.976 1.00 44.60 O ATOM 614 CB MET A 243 18.601 -1.604 4.359 1.00 37.13 C ATOM 615 CG MET A 243 17.287 -1.124 3.713 1.00 46.57 C ATOM 616 SD MET A 243 17.114 0.684 3.533 1.00 53.22 S ATOM 617 CE MET A 243 16.313 1.119 5.110 1.00 44.60 C ATOM 618 H MET A 243 17.629 -3.244 6.261 1.00 0.00 H ATOM 619 N ILE A 244 20.395 -4.326 5.751 1.00 45.33 N ATOM 620 CA ILE A 244 21.742 -4.787 6.084 1.00 45.76 C ATOM 621 C ILE A 244 22.141 -5.838 5.039 1.00 47.97 C ATOM 622 O ILE A 244 21.568 -6.929 4.988 1.00 46.01 O ATOM 623 CB ILE A 244 21.807 -5.441 7.490 1.00 45.16 C ATOM 624 CG1 ILE A 244 21.348 -4.445 8.562 1.00 39.92 C ATOM 625 CG2 ILE A 244 23.242 -5.873 7.800 1.00 40.00 C ATOM 626 CD1 ILE A 244 21.221 -5.056 9.941 1.00 37.90 C ATOM 627 H ILE A 244 19.592 -4.614 6.346 1.00 0.00 H ATOM 628 N PRO A 245 23.137 -5.523 4.191 1.00 49.99 N ATOM 629 CA PRO A 245 23.539 -6.503 3.178 1.00 51.65 C ATOM 630 C PRO A 245 23.799 -7.876 3.783 1.00 53.44 C ATOM 631 O PRO A 245 24.630 -8.021 4.682 1.00 54.74 O ATOM 632 CB PRO A 245 24.786 -5.867 2.546 1.00 52.45 C ATOM 633 CG PRO A 245 25.323 -4.983 3.619 1.00 50.20 C ATOM 634 CD PRO A 245 24.069 -4.384 4.224 1.00 50.47 C ATOM 635 N GLY A 246 23.062 -8.873 3.293 1.00 54.16 N ATOM 636 CA GLY A 246 23.206 -10.232 3.785 1.00 52.88 C ATOM 637 C GLY A 246 22.032 -10.695 4.630 1.00 54.92 C ATOM 638 O GLY A 246 21.687 -11.881 4.635 1.00 53.81 O ATOM 639 H GLY A 246 22.370 -8.674 2.543 1.00 0.00 H ATOM 640 N PHE A 247 21.414 -9.755 5.343 1.00 53.58 N ATOM 641 CA PHE A 247 20.283 -10.047 6.222 1.00 53.30 C ATOM 642 C PHE A 247 19.129 -10.733 5.498 1.00 55.27 C ATOM 643 O PHE A 247 18.504 -11.653 6.031 1.00 52.66 O ATOM 644 CB PHE A 247 19.768 -8.748 6.855 1.00 45.80 C ATOM 645 CG PHE A 247 18.774 -8.961 7.953 1.00 43.93 C ATOM 646 CD1 PHE A 247 19.198 -9.223 9.252 1.00 38.96 C ATOM 647 CD2 PHE A 247 17.408 -8.906 7.693 1.00 43.78 C ATOM 648 CE1 PHE A 247 18.272 -9.429 10.287 1.00 36.52 C ATOM 649 CE2 PHE A 247 16.477 -9.111 8.719 1.00 42.02 C ATOM 650 CZ PHE A 247 16.914 -9.373 10.015 1.00 40.26 C ATOM 651 H PHE A 247 21.750 -8.773 5.272 1.00 0.00 H ATOM 652 N ARG A 248 18.841 -10.272 4.285 1.00 57.43 N ATOM 653 CA ARG A 248 17.748 -10.840 3.512 1.00 62.34 C ATOM 654 C ARG A 248 17.985 -12.299 3.137 1.00 62.61 C ATOM 655 O ARG A 248 17.037 -13.022 2.835 1.00 64.06 O ATOM 656 CB ARG A 248 17.492 -10.008 2.250 1.00 62.01 C ATOM 657 CG ARG A 248 18.658 -9.936 1.279 1.00 73.26 C ATOM 658 CD ARG A 248 18.273 -9.105 0.057 1.00 80.14 C ATOM 659 NE ARG A 248 19.337 -9.028 -0.940 1.00 84.43 N ATOM 660 CZ ARG A 248 19.244 -8.348 -2.081 1.00 87.80 C ATOM 661 NH1 ARG A 248 18.131 -7.683 -2.374 1.00 86.07 N ATOM 662 NH2 ARG A 248 20.263 -8.329 -2.931 1.00 82.15 N ATOM 663 HE ARG A 248 20.223 -9.536 -0.747 1.00 0.00 H ATOM 664 HH12 ARG A 248 18.062 -7.153 -3.266 1.00 0.00 H ATOM 665 HH11 ARG A 248 17.330 -7.693 -1.711 1.00 0.00 H ATOM 666 HH22 ARG A 248 20.188 -7.797 -3.821 1.00 0.00 H ATOM 667 HH21 ARG A 248 21.137 -8.846 -2.707 1.00 0.00 H ATOM 668 H ARG A 248 19.404 -9.495 3.884 1.00 0.00 H ATOM 669 N ASP A 249 19.243 -12.734 3.164 1.00 63.21 N ATOM 670 CA ASP A 249 19.572 -14.120 2.829 1.00 63.12 C ATOM 671 C ASP A 249 19.252 -15.078 3.973 1.00 62.70 C ATOM 672 O ASP A 249 19.162 -16.287 3.763 1.00 62.13 O ATOM 673 CB ASP A 249 21.053 -14.263 2.471 1.00 63.64 C ATOM 674 CG ASP A 249 21.451 -13.414 1.290 1.00 66.98 C ATOM 675 OD1 ASP A 249 20.585 -13.166 0.425 1.00 75.13 O ATOM 676 OD2 ASP A 249 22.634 -13.009 1.220 1.00 63.86 O ATOM 677 H ASP A 249 20.005 -12.077 3.428 1.00 0.00 H ATOM 678 N LEU A 250 19.095 -14.544 5.182 1.00 61.44 N ATOM 679 CA LEU A 250 18.782 -15.380 6.338 1.00 60.15 C ATOM 680 C LEU A 250 17.374 -15.930 6.177 1.00 59.70 C ATOM 681 O LEU A 250 16.601 -15.432 5.358 1.00 58.73 O ATOM 682 CB LEU A 250 18.863 -14.566 7.632 1.00 61.34 C ATOM 683 CG LEU A 250 20.214 -13.919 7.938 1.00 59.44 C ATOM 684 CD1 LEU A 250 20.103 -13.060 9.194 1.00 56.11 C ATOM 685 CD2 LEU A 250 21.258 -15.001 8.110 1.00 58.02 C ATOM 686 H LEU A 250 19.197 -13.516 5.305 1.00 0.00 H ATOM 687 N THR A 251 17.035 -16.958 6.947 1.00 59.29 N ATOM 688 CA THR A 251 15.696 -17.518 6.845 1.00 59.94 C ATOM 689 C THR A 251 14.708 -16.581 7.517 1.00 60.66 C ATOM 690 O THR A 251 15.094 -15.633 8.211 1.00 60.93 O ATOM 691 CB THR A 251 15.577 -18.908 7.519 1.00 60.65 C ATOM 692 OG1 THR A 251 15.735 -18.776 8.937 1.00 54.36 O ATOM 693 CG2 THR A 251 16.635 -19.864 6.968 1.00 62.66 C ATOM 694 HG1 THR A 251 16.626 -18.391 9.134 1.00 0.00 H ATOM 695 H THR A 251 17.721 -17.359 7.617 1.00 0.00 H ATOM 696 N SER A 252 13.428 -16.856 7.299 1.00 59.42 N ATOM 697 CA SER A 252 12.356 -16.071 7.878 1.00 57.30 C ATOM 698 C SER A 252 12.471 -16.100 9.395 1.00 56.95 C ATOM 699 O SER A 252 12.453 -15.057 10.056 1.00 54.91 O ATOM 700 CB SER A 252 11.006 -16.649 7.447 1.00 57.91 C ATOM 701 OG SER A 252 9.930 -15.965 8.054 1.00 56.22 O ATOM 702 HG SER A 252 9.075 -16.364 7.754 1.00 0.00 H ATOM 703 H SER A 252 13.185 -17.664 6.691 1.00 0.00 H ATOM 704 N ASP A 253 12.615 -17.305 9.939 1.00 56.10 N ATOM 705 CA ASP A 253 12.704 -17.485 11.383 1.00 54.86 C ATOM 706 C ASP A 253 13.928 -16.872 12.055 1.00 52.23 C ATOM 707 O ASP A 253 13.829 -16.394 13.181 1.00 51.34 O ATOM 708 CB ASP A 253 12.612 -18.974 11.733 1.00 56.80 C ATOM 709 CG ASP A 253 11.323 -19.605 11.242 1.00 56.24 C ATOM 710 OD1 ASP A 253 11.252 -19.967 10.050 1.00 59.13 O ATOM 711 OD2 ASP A 253 10.373 -19.719 12.044 1.00 60.16 O ATOM 712 H ASP A 253 12.665 -18.139 9.320 1.00 0.00 H ATOM 713 N ASP A 254 15.074 -16.895 11.381 1.00 51.58 N ATOM 714 CA ASP A 254 16.292 -16.321 11.950 1.00 51.52 C ATOM 715 C ASP A 254 16.209 -14.797 11.951 1.00 51.04 C ATOM 716 O ASP A 254 16.708 -14.137 12.857 1.00 50.25 O ATOM 717 CB ASP A 254 17.520 -16.787 11.170 1.00 51.15 C ATOM 718 CG ASP A 254 18.014 -18.146 11.633 1.00 54.15 C ATOM 719 OD1 ASP A 254 18.865 -18.748 10.943 1.00 54.03 O ATOM 720 OD2 ASP A 254 17.554 -18.607 12.700 1.00 46.17 O ATOM 721 H ASP A 254 15.104 -17.327 10.436 1.00 0.00 H ATOM 722 N GLN A 255 15.577 -14.242 10.926 1.00 50.13 N ATOM 723 CA GLN A 255 15.408 -12.804 10.856 1.00 49.54 C ATOM 724 C GLN A 255 14.574 -12.425 12.070 1.00 48.18 C ATOM 725 O GLN A 255 14.902 -11.485 12.794 1.00 48.26 O ATOM 726 CB GLN A 255 14.682 -12.420 9.570 1.00 49.49 C ATOM 727 CG GLN A 255 15.579 -12.390 8.347 1.00 55.30 C ATOM 728 CD GLN A 255 14.790 -12.272 7.063 1.00 57.49 C ATOM 729 OE1 GLN A 255 13.872 -11.468 6.966 1.00 55.64 O ATOM 730 NE2 GLN A 255 15.149 -13.072 6.068 1.00 62.89 N ATOM 731 HE22 GLN A 255 15.936 -13.740 6.196 1.00 0.00 H ATOM 732 HE21 GLN A 255 14.644 -13.031 5.160 1.00 0.00 H ATOM 733 H GLN A 255 15.199 -14.843 10.166 1.00 0.00 H ATOM 734 N ILE A 256 13.509 -13.188 12.301 1.00 46.00 N ATOM 735 CA ILE A 256 12.617 -12.953 13.428 1.00 45.14 C ATOM 736 C ILE A 256 13.336 -13.068 14.767 1.00 44.26 C ATOM 737 O ILE A 256 13.162 -12.236 15.656 1.00 44.25 O ATOM 738 CB ILE A 256 11.412 -13.936 13.395 1.00 44.81 C ATOM 739 CG1 ILE A 256 10.417 -13.481 12.322 1.00 43.88 C ATOM 740 CG2 ILE A 256 10.744 -14.027 14.779 1.00 44.54 C ATOM 741 CD1 ILE A 256 9.124 -14.294 12.284 1.00 50.96 C ATOM 742 H ILE A 256 13.307 -13.978 11.656 1.00 0.00 H ATOM 743 N VAL A 257 14.154 -14.097 14.917 1.00 43.74 N ATOM 744 CA VAL A 257 14.880 -14.275 16.162 1.00 42.83 C ATOM 745 C VAL A 257 15.909 -13.163 16.406 1.00 40.98 C ATOM 746 O VAL A 257 16.092 -12.745 17.543 1.00 40.37 O ATOM 747 CB VAL A 257 15.579 -15.647 16.199 1.00 45.28 C ATOM 748 CG1 VAL A 257 16.273 -15.838 17.530 1.00 53.04 C ATOM 749 CG2 VAL A 257 14.552 -16.746 15.990 1.00 48.98 C ATOM 750 H VAL A 257 14.277 -14.779 14.142 1.00 0.00 H ATOM 751 N LEU A 258 16.569 -12.677 15.355 1.00 39.82 N ATOM 752 CA LEU A 258 17.568 -11.616 15.531 1.00 39.66 C ATOM 753 C LEU A 258 16.934 -10.261 15.869 1.00 38.52 C ATOM 754 O LEU A 258 17.519 -9.455 16.603 1.00 36.91 O ATOM 755 CB LEU A 258 18.440 -11.475 14.273 1.00 37.45 C ATOM 756 CG LEU A 258 19.276 -12.686 13.839 1.00 41.56 C ATOM 757 CD1 LEU A 258 20.055 -12.342 12.573 1.00 43.36 C ATOM 758 CD2 LEU A 258 20.216 -13.094 14.947 1.00 39.03 C ATOM 759 H LEU A 258 16.375 -13.052 14.404 1.00 0.00 H ATOM 760 N LEU A 259 15.745 -10.008 15.330 1.00 38.17 N ATOM 761 CA LEU A 259 15.050 -8.746 15.584 1.00 38.55 C ATOM 762 C LEU A 259 14.411 -8.699 16.956 1.00 39.57 C ATOM 763 O LEU A 259 14.477 -7.676 17.645 1.00 39.25 O ATOM 764 CB LEU A 259 13.986 -8.490 14.518 1.00 39.49 C ATOM 765 CG LEU A 259 14.522 -7.836 13.246 1.00 48.50 C ATOM 766 CD1 LEU A 259 13.389 -7.646 12.240 1.00 52.78 C ATOM 767 CD2 LEU A 259 15.150 -6.482 13.614 1.00 41.67 C ATOM 768 H LEU A 259 15.301 -10.721 14.716 1.00 0.00 H ATOM 769 N LYS A 260 13.799 -9.807 17.364 1.00 37.99 N ATOM 770 CA LYS A 260 13.159 -9.863 18.669 1.00 39.83 C ATOM 771 C LYS A 260 14.158 -9.683 19.805 1.00 38.90 C ATOM 772 O LYS A 260 13.844 -9.069 20.827 1.00 40.61 O ATOM 773 CB LYS A 260 12.432 -11.203 18.850 1.00 48.15 C ATOM 774 CG LYS A 260 11.262 -11.405 17.910 1.00 55.81 C ATOM 775 CD LYS A 260 10.624 -12.775 18.083 1.00 62.12 C ATOM 776 CE LYS A 260 10.000 -12.944 19.452 1.00 64.03 C ATOM 777 NZ LYS A 260 11.005 -12.932 20.539 1.00 71.82 N ATOM 778 HZ1 LYS A 260 11.679 -13.711 20.395 1.00 0.00 H ATOM 779 HZ2 LYS A 260 11.514 -12.025 20.529 1.00 0.00 H ATOM 780 HZ3 LYS A 260 10.525 -13.051 21.454 1.00 0.00 H ATOM 781 H LYS A 260 13.778 -10.642 16.744 1.00 0.00 H ATOM 782 N SER A 261 15.366 -10.210 19.633 1.00 38.57 N ATOM 783 CA SER A 261 16.373 -10.117 20.684 1.00 40.18 C ATOM 784 C SER A 261 17.195 -8.828 20.681 1.00 38.13 C ATOM 785 O SER A 261 17.682 -8.396 21.721 1.00 38.99 O ATOM 786 CB SER A 261 17.320 -11.319 20.614 1.00 36.15 C ATOM 787 OG SER A 261 18.027 -11.334 19.386 1.00 47.57 O ATOM 788 HG SER A 261 17.383 -11.391 18.636 1.00 0.00 H ATOM 789 H SER A 261 15.595 -10.693 18.741 1.00 0.00 H ATOM 790 N SER A 262 17.346 -8.208 19.522 1.00 39.46 N ATOM 791 CA SER A 262 18.150 -6.990 19.444 1.00 38.87 C ATOM 792 C SER A 262 17.355 -5.699 19.458 1.00 38.95 C ATOM 793 O SER A 262 17.918 -4.639 19.706 1.00 38.61 O ATOM 794 CB SER A 262 19.005 -7.011 18.177 1.00 34.80 C ATOM 795 OG SER A 262 18.195 -6.861 17.024 1.00 32.76 O ATOM 796 HG SER A 262 17.542 -7.604 16.982 1.00 0.00 H ATOM 797 H SER A 262 16.893 -8.587 18.666 1.00 0.00 H ATOM 798 N ALA A 263 16.057 -5.778 19.183 1.00 38.03 N ATOM 799 CA ALA A 263 15.235 -4.577 19.127 1.00 39.02 C ATOM 800 C ALA A 263 15.508 -3.552 20.224 1.00 38.75 C ATOM 801 O ALA A 263 15.834 -2.401 19.918 1.00 40.06 O ATOM 802 CB ALA A 263 13.734 -4.948 19.106 1.00 35.74 C ATOM 803 H ALA A 263 15.624 -6.707 19.006 1.00 0.00 H ATOM 804 N ILE A 264 15.382 -3.951 21.489 1.00 37.79 N ATOM 805 CA ILE A 264 15.593 -3.008 22.587 1.00 39.17 C ATOM 806 C ILE A 264 17.036 -2.465 22.641 1.00 39.16 C ATOM 807 O ILE A 264 17.267 -1.317 23.042 1.00 37.33 O ATOM 808 CB ILE A 264 15.225 -3.641 23.944 1.00 40.25 C ATOM 809 CG1 ILE A 264 15.118 -2.546 25.007 1.00 36.58 C ATOM 810 CG2 ILE A 264 16.275 -4.694 24.340 1.00 38.34 C ATOM 811 CD1 ILE A 264 14.046 -1.510 24.691 1.00 43.62 C ATOM 812 H ILE A 264 15.132 -4.939 21.697 1.00 0.00 H ATOM 813 N GLU A 265 17.992 -3.289 22.220 1.00 34.17 N ATOM 814 CA GLU A 265 19.404 -2.908 22.192 1.00 35.06 C ATOM 815 C GLU A 265 19.697 -1.863 21.103 1.00 34.94 C ATOM 816 O GLU A 265 20.443 -0.905 21.342 1.00 32.95 O ATOM 817 CB GLU A 265 20.284 -4.129 21.932 1.00 37.81 C ATOM 818 CG GLU A 265 20.324 -5.129 23.075 1.00 31.65 C ATOM 819 CD GLU A 265 21.272 -6.281 22.782 1.00 49.75 C ATOM 820 OE1 GLU A 265 22.284 -6.067 22.069 1.00 44.89 O ATOM 821 OE2 GLU A 265 21.004 -7.396 23.274 1.00 34.37 O ATOM 822 H GLU A 265 17.725 -4.241 21.898 1.00 0.00 H ATOM 823 N VAL A 266 19.136 -2.066 19.910 1.00 31.38 N ATOM 824 CA VAL A 266 19.343 -1.129 18.812 1.00 32.81 C ATOM 825 C VAL A 266 18.617 0.181 19.110 1.00 33.06 C ATOM 826 O VAL A 266 19.063 1.242 18.667 1.00 36.63 O ATOM 827 CB VAL A 266 18.849 -1.706 17.478 1.00 34.75 C ATOM 828 CG1 VAL A 266 19.178 -0.736 16.327 1.00 22.65 C ATOM 829 CG2 VAL A 266 19.539 -3.057 17.226 1.00 32.98 C ATOM 830 H VAL A 266 18.541 -2.906 19.761 1.00 0.00 H ATOM 831 N ILE A 267 17.503 0.113 19.845 1.00 31.51 N ATOM 832 CA ILE A 267 16.779 1.336 20.209 1.00 36.44 C ATOM 833 C ILE A 267 17.665 2.111 21.207 1.00 38.27 C ATOM 834 O ILE A 267 17.798 3.333 21.113 1.00 38.51 O ATOM 835 CB ILE A 267 15.411 1.032 20.858 1.00 35.34 C ATOM 836 CG1 ILE A 267 14.448 0.471 19.813 1.00 36.76 C ATOM 837 CG2 ILE A 267 14.821 2.301 21.484 1.00 38.92 C ATOM 838 CD1 ILE A 267 13.117 0.056 20.381 1.00 29.49 C ATOM 839 H ILE A 267 17.147 -0.812 20.161 1.00 0.00 H ATOM 840 N MET A 268 18.281 1.403 22.151 1.00 38.21 N ATOM 841 CA MET A 268 19.158 2.074 23.109 1.00 40.24 C ATOM 842 C MET A 268 20.343 2.622 22.347 1.00 39.92 C ATOM 843 O MET A 268 20.754 3.765 22.541 1.00 37.53 O ATOM 844 CB MET A 268 19.645 1.112 24.201 1.00 33.28 C ATOM 845 CG MET A 268 18.589 0.810 25.269 1.00 34.94 C ATOM 846 SD MET A 268 19.016 -0.608 26.349 1.00 41.80 S ATOM 847 CE MET A 268 17.596 -0.675 27.435 1.00 37.39 C ATOM 848 H MET A 268 18.139 0.374 22.207 1.00 0.00 H ATOM 849 N LEU A 269 20.888 1.803 21.457 1.00 38.65 N ATOM 850 CA LEU A 269 22.031 2.227 20.677 1.00 39.84 C ATOM 851 C LEU A 269 21.681 3.450 19.810 1.00 40.59 C ATOM 852 O LEU A 269 22.325 4.509 19.914 1.00 39.29 O ATOM 853 CB LEU A 269 22.510 1.052 19.818 1.00 43.64 C ATOM 854 CG LEU A 269 23.984 0.933 19.414 1.00 53.03 C ATOM 855 CD1 LEU A 269 24.915 1.094 20.612 1.00 47.90 C ATOM 856 CD2 LEU A 269 24.185 -0.437 18.785 1.00 50.87 C ATOM 857 H LEU A 269 20.492 0.851 21.319 1.00 0.00 H ATOM 858 N ARG A 270 20.647 3.316 18.981 1.00 38.80 N ATOM 859 CA ARG A 270 20.238 4.399 18.085 1.00 39.94 C ATOM 860 C ARG A 270 19.773 5.657 18.819 1.00 40.26 C ATOM 861 O ARG A 270 19.836 6.757 18.271 1.00 39.08 O ATOM 862 CB ARG A 270 19.129 3.920 17.128 1.00 31.19 C ATOM 863 CG ARG A 270 17.718 3.974 17.696 1.00 27.91 C ATOM 864 CD ARG A 270 16.759 3.031 16.967 1.00 34.69 C ATOM 865 NE ARG A 270 16.649 3.276 15.528 1.00 35.35 N ATOM 866 CZ ARG A 270 15.825 4.164 14.973 1.00 35.96 C ATOM 867 NH1 ARG A 270 15.021 4.908 15.731 1.00 33.18 N ATOM 868 NH2 ARG A 270 15.808 4.314 13.653 1.00 34.41 N ATOM 869 HE ARG A 270 17.256 2.718 14.895 1.00 0.00 H ATOM 870 HH12 ARG A 270 14.381 5.598 15.289 1.00 0.00 H ATOM 871 HH11 ARG A 270 15.033 4.798 16.765 1.00 0.00 H ATOM 872 HH22 ARG A 270 15.166 5.006 13.217 1.00 0.00 H ATOM 873 HH21 ARG A 270 16.437 3.739 13.056 1.00 0.00 H ATOM 874 H ARG A 270 20.118 2.421 18.970 1.00 0.00 H ATOM 875 N SER A 271 19.314 5.502 20.057 1.00 40.81 N ATOM 876 CA SER A 271 18.839 6.659 20.820 1.00 43.08 C ATOM 877 C SER A 271 19.983 7.563 21.264 1.00 42.93 C ATOM 878 O SER A 271 19.756 8.683 21.710 1.00 45.45 O ATOM 879 CB SER A 271 18.060 6.214 22.053 1.00 34.64 C ATOM 880 OG SER A 271 18.944 5.758 23.057 1.00 36.41 O ATOM 881 HG SER A 271 19.467 4.992 22.712 1.00 0.00 H ATOM 882 H SER A 271 19.292 4.555 20.486 1.00 0.00 H ATOM 883 N ASN A 272 21.210 7.073 21.148 1.00 43.73 N ATOM 884 CA ASN A 272 22.376 7.853 21.541 1.00 43.59 C ATOM 885 C ASN A 272 22.437 9.143 20.703 1.00 45.55 C ATOM 886 O ASN A 272 23.029 10.146 21.117 1.00 43.25 O ATOM 887 CB ASN A 272 23.640 7.021 21.327 1.00 42.74 C ATOM 888 CG ASN A 272 24.837 7.568 22.078 1.00 44.22 C ATOM 889 OD1 ASN A 272 25.878 7.842 21.483 1.00 47.48 O ATOM 890 ND2 ASN A 272 24.696 7.729 23.396 1.00 41.76 N ATOM 891 HD22 ASN A 272 23.796 7.484 23.857 1.00 0.00 H ATOM 892 HD21 ASN A 272 25.486 8.100 23.962 1.00 0.00 H ATOM 893 H ASN A 272 21.342 6.114 20.769 1.00 0.00 H ATOM 894 N GLN A 273 21.804 9.113 19.533 1.00 46.60 N ATOM 895 CA GLN A 273 21.793 10.265 18.639 1.00 49.17 C ATOM 896 C GLN A 273 21.022 11.452 19.221 1.00 48.21 C ATOM 897 O GLN A 273 21.351 12.599 18.942 1.00 48.80 O ATOM 898 CB GLN A 273 21.205 9.878 17.277 1.00 49.48 C ATOM 899 CG GLN A 273 21.409 10.935 16.208 1.00 48.08 C ATOM 900 CD GLN A 273 21.052 10.454 14.811 1.00 51.69 C ATOM 901 OE1 GLN A 273 21.371 9.329 14.429 1.00 38.26 O ATOM 902 NE2 GLN A 273 20.407 11.319 14.032 1.00 43.76 N ATOM 903 HE22 GLN A 273 20.157 12.260 14.396 1.00 0.00 H ATOM 904 HE21 GLN A 273 20.153 11.054 13.059 1.00 0.00 H ATOM 905 H GLN A 273 21.305 8.246 19.249 1.00 0.00 H ATOM 906 N SER A 274 20.001 11.182 20.026 1.00 49.15 N ATOM 907 CA SER A 274 19.227 12.265 20.631 1.00 49.71 C ATOM 908 C SER A 274 19.651 12.508 22.077 1.00 50.44 C ATOM 909 O SER A 274 19.261 13.509 22.685 1.00 48.88 O ATOM 910 CB SER A 274 17.731 11.953 20.592 1.00 47.56 C ATOM 911 OG SER A 274 17.413 10.881 21.459 1.00 46.92 O ATOM 912 HG SER A 274 17.913 10.073 21.181 1.00 0.00 H ATOM 913 H SER A 274 19.750 10.193 20.228 1.00 0.00 H ATOM 914 N PHE A 275 20.440 11.593 22.631 1.00 50.31 N ATOM 915 CA PHE A 275 20.897 11.740 24.009 1.00 52.38 C ATOM 916 C PHE A 275 21.922 12.869 24.089 1.00 53.70 C ATOM 917 O PHE A 275 22.724 13.051 23.173 1.00 54.49 O ATOM 918 CB PHE A 275 21.535 10.442 24.520 1.00 47.71 C ATOM 919 CG PHE A 275 21.981 10.515 25.962 1.00 52.35 C ATOM 920 CD1 PHE A 275 21.054 10.432 26.998 1.00 51.90 C ATOM 921 CD2 PHE A 275 23.323 10.710 26.282 1.00 47.11 C ATOM 922 CE1 PHE A 275 21.455 10.542 28.336 1.00 47.77 C ATOM 923 CE2 PHE A 275 23.734 10.822 27.612 1.00 49.92 C ATOM 924 CZ PHE A 275 22.795 10.737 28.644 1.00 47.23 C ATOM 925 H PHE A 275 20.735 10.764 22.077 1.00 0.00 H ATOM 926 N THR A 276 21.887 13.621 25.186 1.00 54.21 N ATOM 927 CA THR A 276 22.814 14.731 25.397 1.00 55.62 C ATOM 928 C THR A 276 23.412 14.730 26.800 1.00 56.25 C ATOM 929 O THR A 276 22.685 14.655 27.793 1.00 55.60 O ATOM 930 CB THR A 276 22.126 16.092 25.188 1.00 57.31 C ATOM 931 OG1 THR A 276 23.024 17.137 25.576 1.00 58.60 O ATOM 932 CG2 THR A 276 20.857 16.187 26.022 1.00 50.47 C ATOM 933 HG1 THR A 276 22.585 18.014 25.443 1.00 0.00 H ATOM 934 H THR A 276 21.177 13.412 25.917 1.00 0.00 H ATOM 935 N MET A 277 24.737 14.825 26.878 1.00 57.00 N ATOM 936 CA MET A 277 25.410 14.840 28.168 1.00 59.85 C ATOM 937 C MET A 277 25.213 16.170 28.885 1.00 61.53 C ATOM 938 O MET A 277 25.582 16.316 30.049 1.00 63.27 O ATOM 939 CB MET A 277 26.903 14.543 28.007 1.00 58.16 C ATOM 940 CG MET A 277 27.180 13.133 27.512 1.00 62.39 C ATOM 941 SD MET A 277 28.886 12.618 27.713 1.00 64.97 S ATOM 942 CE MET A 277 29.663 13.428 26.308 1.00 60.48 C ATOM 943 H MET A 277 25.299 14.889 26.005 1.00 0.00 H ATOM 944 N ASP A 278 24.628 17.141 28.191 1.00 62.11 N ATOM 945 CA ASP A 278 24.366 18.438 28.797 1.00 62.90 C ATOM 946 C ASP A 278 23.583 18.189 30.076 1.00 62.07 C ATOM 947 O ASP A 278 23.981 18.639 31.145 1.00 63.58 O ATOM 948 CB ASP A 278 23.562 19.315 27.838 1.00 65.85 C ATOM 949 CG ASP A 278 24.394 19.804 26.666 1.00 72.33 C ATOM 950 OD1 ASP A 278 25.251 19.034 26.179 1.00 78.58 O ATOM 951 OD2 ASP A 278 24.188 20.955 26.225 1.00 79.16 O ATOM 952 H ASP A 278 24.354 16.972 27.202 1.00 0.00 H ATOM 953 N ASP A 279 22.481 17.449 29.973 1.00 61.38 N ATOM 954 CA ASP A 279 21.678 17.143 31.150 1.00 58.96 C ATOM 955 C ASP A 279 21.244 15.680 31.263 1.00 56.69 C ATOM 956 O ASP A 279 20.226 15.389 31.882 1.00 56.82 O ATOM 957 CB ASP A 279 20.444 18.041 31.193 1.00 62.50 C ATOM 958 CG ASP A 279 19.532 17.829 30.011 1.00 66.11 C ATOM 959 OD1 ASP A 279 18.443 18.439 29.995 1.00 66.54 O ATOM 960 OD2 ASP A 279 19.903 17.058 29.102 1.00 65.81 O ATOM 961 H ASP A 279 22.190 17.086 29.043 1.00 0.00 H ATOM 962 N MET A 280 22.013 14.766 30.673 1.00 55.71 N ATOM 963 CA MET A 280 21.707 13.328 30.726 1.00 53.49 C ATOM 964 C MET A 280 20.275 12.989 30.315 1.00 52.35 C ATOM 965 O MET A 280 19.583 12.245 31.015 1.00 50.53 O ATOM 966 CB MET A 280 21.926 12.780 32.140 1.00 52.22 C ATOM 967 CG MET A 280 23.275 13.076 32.747 1.00 54.83 C ATOM 968 SD MET A 280 24.605 12.320 31.838 1.00 65.74 S ATOM 969 CE MET A 280 25.360 13.745 31.134 1.00 59.60 C ATOM 970 H MET A 280 22.859 15.080 30.157 1.00 0.00 H ATOM 971 N SER A 281 19.822 13.533 29.194 1.00 51.03 N ATOM 972 CA SER A 281 18.473 13.254 28.730 1.00 51.67 C ATOM 973 C SER A 281 18.471 13.073 27.221 1.00 51.61 C ATOM 974 O SER A 281 19.422 13.457 26.534 1.00 52.59 O ATOM 975 CB SER A 281 17.533 14.404 29.087 1.00 50.76 C ATOM 976 OG SER A 281 17.793 15.528 28.261 1.00 56.05 O ATOM 977 HG SER A 281 18.729 15.823 28.392 1.00 0.00 H ATOM 978 H SER A 281 20.437 14.165 28.642 1.00 0.00 H ATOM 979 N TRP A 282 17.394 12.482 26.717 1.00 51.44 N ATOM 980 CA TRP A 282 17.226 12.269 25.285 1.00 50.88 C ATOM 981 C TRP A 282 16.368 13.430 24.806 1.00 50.49 C ATOM 982 O TRP A 282 15.167 13.479 25.065 1.00 50.35 O ATOM 983 CB TRP A 282 16.508 10.947 25.024 1.00 47.88 C ATOM 984 CG TRP A 282 17.338 9.734 25.318 1.00 40.36 C ATOM 985 CD1 TRP A 282 18.121 9.045 24.439 1.00 39.09 C ATOM 986 CD2 TRP A 282 17.430 9.043 26.567 1.00 44.43 C ATOM 987 NE1 TRP A 282 18.691 7.955 25.060 1.00 38.06 N ATOM 988 CE2 TRP A 282 18.283 7.928 26.367 1.00 41.44 C ATOM 989 CE3 TRP A 282 16.873 9.251 27.835 1.00 36.55 C ATOM 990 CZ2 TRP A 282 18.589 7.025 27.390 1.00 44.54 C ATOM 991 CZ3 TRP A 282 17.180 8.352 28.853 1.00 45.65 C ATOM 992 CH2 TRP A 282 18.030 7.251 28.624 1.00 42.25 C ATOM 993 HE1 TRP A 282 19.327 7.266 24.610 1.00 0.00 H ATOM 994 H TRP A 282 16.646 12.161 27.365 1.00 0.00 H ATOM 995 N ASP A 283 16.993 14.359 24.103 1.00 51.05 N ATOM 996 CA ASP A 283 16.299 15.533 23.613 1.00 52.98 C ATOM 997 C ASP A 283 15.834 15.382 22.167 1.00 51.80 C ATOM 998 O ASP A 283 16.642 15.373 21.245 1.00 52.77 O ATOM 999 CB ASP A 283 17.219 16.751 23.778 1.00 54.50 C ATOM 1000 CG ASP A 283 16.691 17.982 23.086 1.00 60.70 C ATOM 1001 OD1 ASP A 283 15.457 18.190 23.095 1.00 64.46 O ATOM 1002 OD2 ASP A 283 17.517 18.748 22.543 1.00 63.96 O ATOM 1003 H ASP A 283 18.006 14.245 23.897 1.00 0.00 H ATOM 1004 N CYS A 284 14.522 15.273 21.976 1.00 52.28 N ATOM 1005 CA CYS A 284 13.958 15.113 20.640 1.00 53.52 C ATOM 1006 C CYS A 284 13.172 16.308 20.090 1.00 54.50 C ATOM 1007 O CYS A 284 12.048 16.154 19.619 1.00 53.78 O ATOM 1008 CB CYS A 284 13.077 13.863 20.594 1.00 50.27 C ATOM 1009 SG CYS A 284 13.998 12.322 20.854 1.00 55.06 S ATOM 1010 H CYS A 284 13.884 15.302 22.797 1.00 0.00 H ATOM 1011 N GLY A 285 13.762 17.496 20.139 1.00 57.56 N ATOM 1012 CA GLY A 285 13.078 18.656 19.600 1.00 59.98 C ATOM 1013 C GLY A 285 12.447 19.594 20.604 1.00 62.51 C ATOM 1014 O GLY A 285 12.989 20.663 20.875 1.00 64.70 O ATOM 1015 H GLY A 285 14.708 17.594 20.561 1.00 0.00 H ATOM 1016 N SER A 286 11.304 19.203 21.161 1.00 63.80 N ATOM 1017 CA SER A 286 10.603 20.045 22.120 1.00 63.97 C ATOM 1018 C SER A 286 10.604 19.488 23.534 1.00 64.95 C ATOM 1019 O SER A 286 11.044 18.361 23.771 1.00 65.29 O ATOM 1020 CB SER A 286 9.156 20.246 21.673 1.00 64.61 C ATOM 1021 OG SER A 286 8.428 19.034 21.771 1.00 70.12 O ATOM 1022 HG SER A 286 7.495 19.186 21.477 1.00 0.00 H ATOM 1023 H SER A 286 10.903 18.278 20.906 1.00 0.00 H ATOM 1024 N GLN A 287 10.092 20.290 24.467 1.00 64.40 N ATOM 1025 CA GLN A 287 10.002 19.906 25.872 1.00 65.58 C ATOM 1026 C GLN A 287 9.153 18.645 26.021 1.00 65.36 C ATOM 1027 O GLN A 287 9.461 17.767 26.829 1.00 65.05 O ATOM 1028 CB GLN A 287 9.360 21.031 26.688 1.00 69.86 C ATOM 1029 CG GLN A 287 9.487 20.856 28.192 1.00 71.18 C ATOM 1030 CD GLN A 287 10.885 21.177 28.690 1.00 79.37 C ATOM 1031 OE1 GLN A 287 11.874 20.621 28.205 1.00 81.78 O ATOM 1032 NE2 GLN A 287 10.974 22.080 29.665 1.00 77.23 N ATOM 1033 HE22 GLN A 287 10.113 22.523 30.044 1.00 0.00 H ATOM 1034 HE21 GLN A 287 11.905 22.342 30.048 1.00 0.00 H ATOM 1035 H GLN A 287 9.743 21.227 24.182 1.00 0.00 H ATOM 1036 N ASP A 288 8.075 18.572 25.245 1.00 64.93 N ATOM 1037 CA ASP A 288 7.181 17.418 25.279 1.00 65.21 C ATOM 1038 C ASP A 288 7.964 16.145 25.002 1.00 63.53 C ATOM 1039 O ASP A 288 7.762 15.116 25.646 1.00 62.59 O ATOM 1040 CB ASP A 288 6.088 17.555 24.214 1.00 68.67 C ATOM 1041 CG ASP A 288 4.841 18.232 24.734 1.00 75.33 C ATOM 1042 OD1 ASP A 288 3.912 18.459 23.927 1.00 77.64 O ATOM 1043 OD2 ASP A 288 4.786 18.528 25.946 1.00 79.31 O ATOM 1044 H ASP A 288 7.863 19.358 24.597 1.00 0.00 H ATOM 1045 N TYR A 289 8.865 16.236 24.035 1.00 62.66 N ATOM 1046 CA TYR A 289 9.660 15.095 23.623 1.00 62.08 C ATOM 1047 C TYR A 289 11.105 15.148 24.109 1.00 60.34 C ATOM 1048 O TYR A 289 12.038 14.880 23.359 1.00 60.60 O ATOM 1049 CB TYR A 289 9.591 14.985 22.100 1.00 62.05 C ATOM 1050 CG TYR A 289 8.167 15.072 21.581 1.00 62.76 C ATOM 1051 CD1 TYR A 289 7.886 15.650 20.340 1.00 65.04 C ATOM 1052 CD2 TYR A 289 7.095 14.599 22.345 1.00 57.21 C ATOM 1053 CE1 TYR A 289 6.573 15.760 19.879 1.00 62.01 C ATOM 1054 CE2 TYR A 289 5.783 14.704 21.894 1.00 57.45 C ATOM 1055 CZ TYR A 289 5.529 15.285 20.664 1.00 64.07 C ATOM 1056 OH TYR A 289 4.230 15.398 20.225 1.00 64.89 O ATOM 1057 HH TYR A 289 3.826 14.497 20.158 1.00 0.00 H ATOM 1058 H TYR A 289 9.006 17.150 23.559 1.00 0.00 H ATOM 1059 N LYS A 290 11.281 15.510 25.373 1.00 58.89 N ATOM 1060 CA LYS A 290 12.606 15.554 25.970 1.00 59.02 C ATOM 1061 C LYS A 290 12.491 14.614 27.158 1.00 58.84 C ATOM 1062 O LYS A 290 11.775 14.903 28.117 1.00 58.94 O ATOM 1063 CB LYS A 290 12.954 16.967 26.426 1.00 62.66 C ATOM 1064 CG LYS A 290 14.433 17.149 26.727 1.00 66.02 C ATOM 1065 CD LYS A 290 14.793 18.618 26.844 1.00 69.72 C ATOM 1066 CE LYS A 290 16.291 18.797 26.921 1.00 67.69 C ATOM 1067 NZ LYS A 290 16.862 17.973 28.013 1.00 73.55 N ATOM 1068 HZ1 LYS A 290 16.441 18.261 28.919 1.00 0.00 H ATOM 1069 HZ2 LYS A 290 16.652 16.970 27.835 1.00 0.00 H ATOM 1070 HZ3 LYS A 290 17.892 18.111 28.048 1.00 0.00 H ATOM 1071 H LYS A 290 10.454 15.768 25.949 1.00 0.00 H ATOM 1072 N TYR A 291 13.187 13.484 27.088 1.00 57.21 N ATOM 1073 CA TYR A 291 13.095 12.485 28.144 1.00 56.94 C ATOM 1074 C TYR A 291 14.317 12.366 29.043 1.00 56.73 C ATOM 1075 O TYR A 291 15.461 12.444 28.586 1.00 56.57 O ATOM 1076 CB TYR A 291 12.767 11.123 27.522 1.00 51.59 C ATOM 1077 CG TYR A 291 11.773 11.214 26.376 1.00 51.39 C ATOM 1078 CD1 TYR A 291 12.209 11.389 25.058 1.00 51.16 C ATOM 1079 CD2 TYR A 291 10.399 11.163 26.610 1.00 45.72 C ATOM 1080 CE1 TYR A 291 11.305 11.509 24.006 1.00 46.13 C ATOM 1081 CE2 TYR A 291 9.483 11.285 25.562 1.00 40.28 C ATOM 1082 CZ TYR A 291 9.941 11.455 24.265 1.00 37.83 C ATOM 1083 OH TYR A 291 9.042 11.571 23.225 1.00 40.18 O ATOM 1084 HH TYR A 291 8.487 10.753 23.178 1.00 0.00 H ATOM 1085 H TYR A 291 13.805 13.311 26.269 1.00 0.00 H ATOM 1086 N ASP A 292 14.056 12.173 30.332 1.00 55.81 N ATOM 1087 CA ASP A 292 15.120 12.034 31.318 1.00 57.14 C ATOM 1088 C ASP A 292 14.862 10.830 32.220 1.00 55.58 C ATOM 1089 O ASP A 292 13.937 10.054 31.996 1.00 56.94 O ATOM 1090 CB ASP A 292 15.219 13.300 32.171 1.00 61.86 C ATOM 1091 CG ASP A 292 13.983 13.529 33.017 1.00 61.11 C ATOM 1092 OD1 ASP A 292 13.945 14.532 33.751 1.00 70.53 O ATOM 1093 OD2 ASP A 292 13.048 12.707 32.953 1.00 71.41 O ATOM 1094 H ASP A 292 13.066 12.120 30.645 1.00 0.00 H ATOM 1095 N VAL A 293 15.679 10.694 33.253 1.00 55.56 N ATOM 1096 CA VAL A 293 15.560 9.586 34.186 1.00 55.47 C ATOM 1097 C VAL A 293 14.189 9.442 34.851 1.00 55.78 C ATOM 1098 O VAL A 293 13.750 8.327 35.122 1.00 54.86 O ATOM 1099 CB VAL A 293 16.657 9.685 35.274 1.00 57.40 C ATOM 1100 CG1 VAL A 293 16.433 8.639 36.361 1.00 55.02 C ATOM 1101 CG2 VAL A 293 18.022 9.489 34.628 1.00 51.23 C ATOM 1102 H VAL A 293 16.428 11.401 33.401 1.00 0.00 H ATOM 1103 N THR A 294 13.503 10.550 35.111 1.00 55.46 N ATOM 1104 CA THR A 294 12.198 10.447 35.754 1.00 56.91 C ATOM 1105 C THR A 294 11.129 9.935 34.792 1.00 55.68 C ATOM 1106 O THR A 294 10.226 9.196 35.195 1.00 54.98 O ATOM 1107 CB THR A 294 11.756 11.797 36.398 1.00 59.60 C ATOM 1108 OG1 THR A 294 10.378 11.712 36.791 1.00 64.27 O ATOM 1109 CG2 THR A 294 11.940 12.946 35.436 1.00 67.36 C ATOM 1110 HG1 THR A 294 9.820 11.527 35.995 1.00 0.00 H ATOM 1111 H THR A 294 13.893 11.481 34.859 1.00 0.00 H ATOM 1112 N ASP A 295 11.228 10.302 33.518 1.00 55.40 N ATOM 1113 CA ASP A 295 10.253 9.810 32.549 1.00 54.68 C ATOM 1114 C ASP A 295 10.424 8.296 32.428 1.00 54.54 C ATOM 1115 O ASP A 295 9.441 7.552 32.390 1.00 55.12 O ATOM 1116 CB ASP A 295 10.453 10.468 31.186 1.00 52.99 C ATOM 1117 CG ASP A 295 10.400 11.983 31.258 1.00 56.95 C ATOM 1118 OD1 ASP A 295 9.606 12.516 32.066 1.00 55.80 O ATOM 1119 OD2 ASP A 295 11.143 12.643 30.499 1.00 59.62 O ATOM 1120 H ASP A 295 11.995 10.935 33.214 1.00 0.00 H ATOM 1121 N VAL A 296 11.674 7.841 32.385 1.00 53.92 N ATOM 1122 CA VAL A 296 11.955 6.414 32.273 1.00 53.03 C ATOM 1123 C VAL A 296 11.350 5.656 33.449 1.00 53.68 C ATOM 1124 O VAL A 296 10.766 4.582 33.273 1.00 53.43 O ATOM 1125 CB VAL A 296 13.475 6.145 32.219 1.00 55.71 C ATOM 1126 CG1 VAL A 296 13.736 4.645 32.164 1.00 49.36 C ATOM 1127 CG2 VAL A 296 14.078 6.838 30.997 1.00 51.01 C ATOM 1128 H VAL A 296 12.465 8.515 32.432 1.00 0.00 H ATOM 1129 N SER A 297 11.486 6.209 34.653 1.00 52.52 N ATOM 1130 CA SER A 297 10.918 5.562 35.831 1.00 52.85 C ATOM 1131 C SER A 297 9.387 5.584 35.778 1.00 52.58 C ATOM 1132 O SER A 297 8.736 4.723 36.355 1.00 50.68 O ATOM 1133 CB SER A 297 11.399 6.243 37.118 1.00 52.74 C ATOM 1134 OG SER A 297 10.983 7.597 37.172 1.00 58.54 O ATOM 1135 HG SER A 297 11.357 8.087 36.397 1.00 0.00 H ATOM 1136 H SER A 297 12.000 7.107 34.754 1.00 0.00 H ATOM 1137 N LYS A 298 8.815 6.569 35.088 1.00 52.49 N ATOM 1138 CA LYS A 298 7.364 6.660 34.970 1.00 53.42 C ATOM 1139 C LYS A 298 6.869 5.768 33.833 1.00 55.28 C ATOM 1140 O LYS A 298 5.776 5.963 33.291 1.00 52.95 O ATOM 1141 CB LYS A 298 6.931 8.112 34.743 1.00 57.85 C ATOM 1142 CG LYS A 298 7.063 8.992 35.985 1.00 60.56 C ATOM 1143 CD LYS A 298 6.530 10.397 35.740 1.00 69.81 C ATOM 1144 CE LYS A 298 6.646 11.266 36.991 1.00 72.38 C ATOM 1145 NZ LYS A 298 6.122 12.654 36.767 1.00 71.70 N ATOM 1146 HZ1 LYS A 298 6.664 13.109 36.005 1.00 0.00 H ATOM 1147 HZ2 LYS A 298 5.118 12.605 36.499 1.00 0.00 H ATOM 1148 HZ3 LYS A 298 6.221 13.206 37.643 1.00 0.00 H ATOM 1149 H LYS A 298 9.412 7.284 34.626 1.00 0.00 H ATOM 1150 N ALA A 299 7.702 4.792 33.478 1.00 55.81 N ATOM 1151 CA ALA A 299 7.386 3.822 32.438 1.00 55.76 C ATOM 1152 C ALA A 299 7.466 2.448 33.089 1.00 55.74 C ATOM 1153 O ALA A 299 7.226 1.420 32.447 1.00 54.73 O ATOM 1154 CB ALA A 299 8.387 3.925 31.281 1.00 57.07 C ATOM 1155 H ALA A 299 8.618 4.719 33.964 1.00 0.00 H ATOM 1156 N GLY A 300 7.820 2.440 34.375 1.00 55.45 N ATOM 1157 CA GLY A 300 7.916 1.189 35.108 1.00 54.16 C ATOM 1158 C GLY A 300 9.309 0.679 35.438 1.00 53.32 C ATOM 1159 O GLY A 300 9.437 -0.428 35.957 1.00 53.52 O ATOM 1160 H GLY A 300 8.029 3.337 34.857 1.00 0.00 H ATOM 1161 N HIS A 301 10.346 1.462 35.149 1.00 52.19 N ATOM 1162 CA HIS A 301 11.718 1.038 35.438 1.00 53.76 C ATOM 1163 C HIS A 301 12.348 1.749 36.634 1.00 55.47 C ATOM 1164 O HIS A 301 11.999 2.885 36.963 1.00 58.62 O ATOM 1165 CB HIS A 301 12.618 1.232 34.207 1.00 52.29 C ATOM 1166 CG HIS A 301 12.411 0.202 33.137 1.00 53.33 C ATOM 1167 ND1 HIS A 301 12.737 -1.127 33.306 1.00 54.82 N ATOM 1168 CD2 HIS A 301 11.885 0.303 31.893 1.00 54.64 C ATOM 1169 CE1 HIS A 301 12.419 -1.801 32.215 1.00 54.04 C ATOM 1170 NE2 HIS A 301 11.900 -0.957 31.342 1.00 51.62 N ATOM 1171 H HIS A 301 10.179 2.390 34.711 1.00 0.00 H ATOM 1172 N THR A 302 13.282 1.062 37.280 1.00 55.03 N ATOM 1173 CA THR A 302 13.989 1.597 38.440 1.00 53.31 C ATOM 1174 C THR A 302 15.449 1.852 38.076 1.00 53.33 C ATOM 1175 O THR A 302 15.834 1.740 36.913 1.00 53.58 O ATOM 1176 CB THR A 302 13.970 0.597 39.598 1.00 53.71 C ATOM 1177 OG1 THR A 302 14.724 -0.566 39.227 1.00 49.89 O ATOM 1178 CG2 THR A 302 12.535 0.192 39.930 1.00 48.02 C ATOM 1179 HG1 THR A 302 14.318 -0.978 38.424 1.00 0.00 H ATOM 1180 H THR A 302 13.519 0.106 36.947 1.00 0.00 H ATOM 1181 N LEU A 303 16.261 2.193 39.071 1.00 51.48 N ATOM 1182 CA LEU A 303 17.674 2.438 38.823 1.00 49.73 C ATOM 1183 C LEU A 303 18.334 1.143 38.388 1.00 48.61 C ATOM 1184 O LEU A 303 19.445 1.144 37.863 1.00 48.63 O ATOM 1185 CB LEU A 303 18.367 2.975 40.080 1.00 50.82 C ATOM 1186 CG LEU A 303 18.688 4.472 40.034 1.00 48.80 C ATOM 1187 CD1 LEU A 303 17.422 5.241 39.743 1.00 49.31 C ATOM 1188 CD2 LEU A 303 19.317 4.924 41.343 1.00 44.89 C ATOM 1189 H LEU A 303 15.883 2.286 40.036 1.00 0.00 H ATOM 1190 N GLU A 304 17.641 0.037 38.609 1.00 47.58 N ATOM 1191 CA GLU A 304 18.164 -1.262 38.228 1.00 47.56 C ATOM 1192 C GLU A 304 18.551 -1.196 36.748 1.00 47.88 C ATOM 1193 O GLU A 304 19.608 -1.696 36.347 1.00 47.37 O ATOM 1194 CB GLU A 304 17.093 -2.326 38.450 1.00 52.77 C ATOM 1195 CG GLU A 304 17.631 -3.730 38.634 1.00 62.42 C ATOM 1196 CD GLU A 304 18.606 -3.824 39.783 1.00 60.88 C ATOM 1197 OE1 GLU A 304 19.823 -3.680 39.543 1.00 65.83 O ATOM 1198 OE2 GLU A 304 18.154 -4.026 40.928 1.00 63.07 O ATOM 1199 H GLU A 304 16.707 0.100 39.063 1.00 0.00 H ATOM 1200 N LEU A 305 17.698 -0.555 35.947 1.00 45.87 N ATOM 1201 CA LEU A 305 17.938 -0.404 34.514 1.00 46.06 C ATOM 1202 C LEU A 305 18.472 0.980 34.163 1.00 45.89 C ATOM 1203 O LEU A 305 19.406 1.113 33.376 1.00 45.02 O ATOM 1204 CB LEU A 305 16.642 -0.660 33.730 1.00 46.64 C ATOM 1205 CG LEU A 305 16.672 -0.541 32.199 1.00 50.75 C ATOM 1206 CD1 LEU A 305 15.624 -1.457 31.588 1.00 49.28 C ATOM 1207 CD2 LEU A 305 16.424 0.897 31.781 1.00 52.81 C ATOM 1208 H LEU A 305 16.833 -0.149 36.357 1.00 0.00 H ATOM 1209 N ILE A 306 17.879 2.006 34.761 1.00 44.78 N ATOM 1210 CA ILE A 306 18.264 3.385 34.491 1.00 45.73 C ATOM 1211 C ILE A 306 19.724 3.747 34.770 1.00 45.72 C ATOM 1212 O ILE A 306 20.361 4.410 33.953 1.00 47.28 O ATOM 1213 CB ILE A 306 17.363 4.369 35.270 1.00 45.78 C ATOM 1214 CG1 ILE A 306 15.895 4.144 34.897 1.00 48.78 C ATOM 1215 CG2 ILE A 306 17.772 5.798 34.961 1.00 46.38 C ATOM 1216 CD1 ILE A 306 14.924 5.078 35.617 1.00 50.81 C ATOM 1217 H ILE A 306 17.116 1.820 35.443 1.00 0.00 H ATOM 1218 N GLU A 307 20.261 3.337 35.917 1.00 46.76 N ATOM 1219 CA GLU A 307 21.646 3.682 36.215 1.00 47.74 C ATOM 1220 C GLU A 307 22.572 3.167 35.107 1.00 47.07 C ATOM 1221 O GLU A 307 23.325 3.939 34.509 1.00 44.92 O ATOM 1222 CB GLU A 307 22.077 3.123 37.579 1.00 55.45 C ATOM 1223 CG GLU A 307 23.428 3.653 38.044 1.00 59.28 C ATOM 1224 CD GLU A 307 24.446 2.557 38.259 1.00 62.16 C ATOM 1225 OE1 GLU A 307 24.531 1.648 37.408 1.00 65.36 O ATOM 1226 OE2 GLU A 307 25.171 2.611 39.273 1.00 66.81 O ATOM 1227 H GLU A 307 19.700 2.778 36.591 1.00 0.00 H ATOM 1228 N PRO A 308 22.529 1.854 34.814 1.00 44.20 N ATOM 1229 CA PRO A 308 23.415 1.374 33.745 1.00 42.56 C ATOM 1230 C PRO A 308 23.020 1.917 32.366 1.00 42.44 C ATOM 1231 O PRO A 308 23.872 2.072 31.486 1.00 43.07 O ATOM 1232 CB PRO A 308 23.316 -0.159 33.854 1.00 41.56 C ATOM 1233 CG PRO A 308 21.983 -0.401 34.492 1.00 37.44 C ATOM 1234 CD PRO A 308 21.854 0.736 35.501 1.00 45.29 C ATOM 1235 N LEU A 309 21.740 2.229 32.174 1.00 42.05 N ATOM 1236 CA LEU A 309 21.314 2.780 30.895 1.00 43.50 C ATOM 1237 C LEU A 309 22.012 4.121 30.608 1.00 44.23 C ATOM 1238 O LEU A 309 22.534 4.334 29.508 1.00 42.76 O ATOM 1239 CB LEU A 309 19.788 2.968 30.852 1.00 44.43 C ATOM 1240 CG LEU A 309 19.219 3.783 29.675 1.00 47.69 C ATOM 1241 CD1 LEU A 309 19.767 3.266 28.349 1.00 46.91 C ATOM 1242 CD2 LEU A 309 17.690 3.714 29.690 1.00 44.62 C ATOM 1243 H LEU A 309 21.047 2.080 32.935 1.00 0.00 H ATOM 1244 N ILE A 310 22.023 5.017 31.592 1.00 44.64 N ATOM 1245 CA ILE A 310 22.661 6.325 31.424 1.00 44.62 C ATOM 1246 C ILE A 310 24.175 6.156 31.332 1.00 45.50 C ATOM 1247 O ILE A 310 24.851 6.868 30.590 1.00 46.60 O ATOM 1248 CB ILE A 310 22.324 7.272 32.603 1.00 48.96 C ATOM 1249 CG1 ILE A 310 20.808 7.459 32.702 1.00 44.60 C ATOM 1250 CG2 ILE A 310 22.988 8.627 32.386 1.00 43.26 C ATOM 1251 CD1 ILE A 310 20.199 8.083 31.454 1.00 46.59 C ATOM 1252 H ILE A 310 21.570 4.784 32.498 1.00 0.00 H ATOM 1253 N LYS A 311 24.703 5.207 32.097 1.00 44.29 N ATOM 1254 CA LYS A 311 26.125 4.915 32.081 1.00 42.21 C ATOM 1255 C LYS A 311 26.468 4.525 30.647 1.00 41.68 C ATOM 1256 O LYS A 311 27.481 4.952 30.098 1.00 38.77 O ATOM 1257 CB LYS A 311 26.420 3.734 33.011 1.00 46.01 C ATOM 1258 CG LYS A 311 27.619 3.911 33.921 1.00 56.73 C ATOM 1259 CD LYS A 311 27.347 4.947 35.006 1.00 61.93 C ATOM 1260 CE LYS A 311 26.186 4.531 35.897 1.00 66.02 C ATOM 1261 NZ LYS A 311 25.930 5.520 36.979 1.00 69.73 N ATOM 1262 HZ1 LYS A 311 26.779 5.610 37.573 1.00 0.00 H ATOM 1263 HZ2 LYS A 311 25.701 6.442 36.557 1.00 0.00 H ATOM 1264 HZ3 LYS A 311 25.131 5.196 37.561 1.00 0.00 H ATOM 1265 H LYS A 311 24.081 4.658 32.724 1.00 0.00 H ATOM 1266 N PHE A 312 25.611 3.696 30.049 1.00 42.61 N ATOM 1267 CA PHE A 312 25.801 3.225 28.670 1.00 42.33 C ATOM 1268 C PHE A 312 25.828 4.391 27.683 1.00 41.25 C ATOM 1269 O PHE A 312 26.728 4.516 26.854 1.00 40.58 O ATOM 1270 CB PHE A 312 24.665 2.269 28.277 1.00 40.53 C ATOM 1271 CG PHE A 312 24.654 1.907 26.815 1.00 44.13 C ATOM 1272 CD1 PHE A 312 25.490 0.906 26.321 1.00 42.31 C ATOM 1273 CD2 PHE A 312 23.837 2.596 25.926 1.00 39.18 C ATOM 1274 CE1 PHE A 312 25.512 0.602 24.962 1.00 40.09 C ATOM 1275 CE2 PHE A 312 23.855 2.297 24.561 1.00 44.60 C ATOM 1276 CZ PHE A 312 24.696 1.297 24.081 1.00 42.24 C ATOM 1277 H PHE A 312 24.777 3.371 30.579 1.00 0.00 H ATOM 1278 N GLN A 313 24.815 5.239 27.771 1.00 44.45 N ATOM 1279 CA GLN A 313 24.715 6.384 26.889 1.00 43.88 C ATOM 1280 C GLN A 313 25.962 7.258 27.009 1.00 44.50 C ATOM 1281 O GLN A 313 26.533 7.680 26.002 1.00 46.98 O ATOM 1282 CB GLN A 313 23.459 7.181 27.232 1.00 45.99 C ATOM 1283 CG GLN A 313 22.143 6.416 27.048 1.00 42.70 C ATOM 1284 CD GLN A 313 21.897 5.999 25.603 1.00 47.55 C ATOM 1285 OE1 GLN A 313 22.255 6.719 24.673 1.00 42.16 O ATOM 1286 NE2 GLN A 313 21.266 4.839 25.412 1.00 32.85 N ATOM 1287 HE22 GLN A 313 20.981 4.261 26.229 1.00 0.00 H ATOM 1288 HE21 GLN A 313 21.059 4.512 24.447 1.00 0.00 H ATOM 1289 H GLN A 313 24.077 5.080 28.487 1.00 0.00 H ATOM 1290 N VAL A 314 26.402 7.508 28.236 1.00 44.69 N ATOM 1291 CA VAL A 314 27.580 8.343 28.455 1.00 44.10 C ATOM 1292 C VAL A 314 28.859 7.753 27.870 1.00 42.90 C ATOM 1293 O VAL A 314 29.646 8.467 27.255 1.00 44.28 O ATOM 1294 CB VAL A 314 27.793 8.624 29.968 1.00 47.57 C ATOM 1295 CG1 VAL A 314 29.098 9.385 30.187 1.00 47.75 C ATOM 1296 CG2 VAL A 314 26.617 9.445 30.512 1.00 42.84 C ATOM 1297 H VAL A 314 25.901 7.104 29.053 1.00 0.00 H ATOM 1298 N GLY A 315 29.079 6.456 28.059 1.00 41.71 N ATOM 1299 CA GLY A 315 30.280 5.842 27.522 1.00 38.43 C ATOM 1300 C GLY A 315 30.241 5.802 26.005 1.00 38.99 C ATOM 1301 O GLY A 315 31.267 5.928 25.336 1.00 38.94 O ATOM 1302 H GLY A 315 28.393 5.883 28.590 1.00 0.00 H ATOM 1303 N LEU A 316 29.043 5.627 25.454 1.00 39.54 N ATOM 1304 CA LEU A 316 28.865 5.579 24.008 1.00 38.78 C ATOM 1305 C LEU A 316 29.027 6.972 23.398 1.00 39.76 C ATOM 1306 O LEU A 316 29.646 7.137 22.342 1.00 39.27 O ATOM 1307 CB LEU A 316 27.475 5.045 23.677 1.00 39.82 C ATOM 1308 CG LEU A 316 27.125 4.931 22.193 1.00 40.88 C ATOM 1309 CD1 LEU A 316 28.060 3.940 21.503 1.00 37.32 C ATOM 1310 CD2 LEU A 316 25.686 4.470 22.062 1.00 44.97 C ATOM 1311 H LEU A 316 28.212 5.522 26.071 1.00 0.00 H ATOM 1312 N LYS A 317 28.469 7.976 24.065 1.00 40.28 N ATOM 1313 CA LYS A 317 28.554 9.340 23.550 1.00 44.27 C ATOM 1314 C LYS A 317 30.009 9.795 23.508 1.00 44.65 C ATOM 1315 O LYS A 317 30.451 10.409 22.538 1.00 47.17 O ATOM 1316 CB LYS A 317 27.738 10.291 24.426 1.00 49.17 C ATOM 1317 CG LYS A 317 27.392 11.614 23.755 1.00 50.03 C ATOM 1318 CD LYS A 317 26.316 11.421 22.695 1.00 53.64 C ATOM 1319 CE LYS A 317 25.763 12.754 22.208 1.00 52.85 C ATOM 1320 NZ LYS A 317 24.517 12.579 21.410 1.00 44.15 N ATOM 1321 HZ1 LYS A 317 24.719 11.986 20.580 1.00 0.00 H ATOM 1322 HZ2 LYS A 317 23.792 12.120 21.998 1.00 0.00 H ATOM 1323 HZ3 LYS A 317 24.173 13.510 21.098 1.00 0.00 H ATOM 1324 H LYS A 317 27.969 7.790 24.958 1.00 0.00 H ATOM 1325 N LYS A 318 30.757 9.472 24.558 1.00 47.06 N ATOM 1326 CA LYS A 318 32.165 9.850 24.650 1.00 47.49 C ATOM 1327 C LYS A 318 33.045 9.299 23.531 1.00 48.29 C ATOM 1328 O LYS A 318 34.037 9.930 23.153 1.00 47.82 O ATOM 1329 CB LYS A 318 32.736 9.428 26.008 1.00 47.00 C ATOM 1330 CG LYS A 318 32.179 10.231 27.182 1.00 60.04 C ATOM 1331 CD LYS A 318 32.721 9.746 28.526 1.00 61.43 C ATOM 1332 CE LYS A 318 32.220 10.618 29.672 1.00 64.56 C ATOM 1333 NZ LYS A 318 32.664 10.113 31.009 1.00 65.74 N ATOM 1334 HZ1 LYS A 318 32.298 9.150 31.153 1.00 0.00 H ATOM 1335 HZ2 LYS A 318 33.703 10.099 31.045 1.00 0.00 H ATOM 1336 HZ3 LYS A 318 32.298 10.740 31.754 1.00 0.00 H ATOM 1337 H LYS A 318 30.327 8.934 25.337 1.00 0.00 H ATOM 1338 N LEU A 319 32.692 8.133 23.000 1.00 47.24 N ATOM 1339 CA LEU A 319 33.483 7.530 21.931 1.00 48.40 C ATOM 1340 C LEU A 319 33.466 8.398 20.680 1.00 48.74 C ATOM 1341 O LEU A 319 34.272 8.203 19.771 1.00 49.66 O ATOM 1342 CB LEU A 319 32.954 6.136 21.581 1.00 46.35 C ATOM 1343 CG LEU A 319 33.077 5.043 22.646 1.00 48.61 C ATOM 1344 CD1 LEU A 319 32.466 3.746 22.116 1.00 40.33 C ATOM 1345 CD2 LEU A 319 34.546 4.836 23.001 1.00 44.79 C ATOM 1346 H LEU A 319 31.843 7.645 23.350 1.00 0.00 H ATOM 1347 N ASN A 320 32.538 9.348 20.637 1.00 50.35 N ATOM 1348 CA ASN A 320 32.414 10.252 19.499 1.00 51.76 C ATOM 1349 C ASN A 320 32.481 9.507 18.166 1.00 51.95 C ATOM 1350 O ASN A 320 33.217 9.906 17.266 1.00 51.76 O ATOM 1351 CB ASN A 320 33.525 11.310 19.547 1.00 55.10 C ATOM 1352 CG ASN A 320 33.429 12.199 20.770 1.00 58.87 C ATOM 1353 OD1 ASN A 320 32.409 12.852 20.998 1.00 63.91 O ATOM 1354 ND2 ASN A 320 34.495 12.231 21.566 1.00 61.14 N ATOM 1355 HD22 ASN A 320 35.335 11.663 21.334 1.00 0.00 H ATOM 1356 HD21 ASN A 320 34.489 12.824 22.420 1.00 0.00 H ATOM 1357 H ASN A 320 31.882 9.450 21.437 1.00 0.00 H ATOM 1358 N LEU A 321 31.704 8.436 18.031 1.00 50.65 N ATOM 1359 CA LEU A 321 31.717 7.647 16.800 1.00 47.45 C ATOM 1360 C LEU A 321 31.375 8.431 15.542 1.00 46.40 C ATOM 1361 O LEU A 321 30.575 9.363 15.578 1.00 44.93 O ATOM 1362 CB LEU A 321 30.720 6.492 16.897 1.00 48.93 C ATOM 1363 CG LEU A 321 30.829 5.478 18.030 1.00 46.26 C ATOM 1364 CD1 LEU A 321 29.781 4.402 17.797 1.00 40.28 C ATOM 1365 CD2 LEU A 321 32.232 4.884 18.076 1.00 41.21 C ATOM 1366 H LEU A 321 31.078 8.156 18.813 1.00 0.00 H ATOM 1367 N HIS A 322 31.990 8.041 14.426 1.00 46.25 N ATOM 1368 CA HIS A 322 31.689 8.648 13.134 1.00 44.20 C ATOM 1369 C HIS A 322 30.338 8.014 12.810 1.00 44.32 C ATOM 1370 O HIS A 322 30.077 6.893 13.252 1.00 43.66 O ATOM 1371 CB HIS A 322 32.707 8.209 12.085 1.00 47.02 C ATOM 1372 CG HIS A 322 34.044 8.867 12.217 1.00 52.83 C ATOM 1373 ND1 HIS A 322 35.168 8.396 11.574 1.00 58.28 N ATOM 1374 CD2 HIS A 322 34.435 9.970 12.896 1.00 54.33 C ATOM 1375 CE1 HIS A 322 36.194 9.180 11.852 1.00 57.17 C ATOM 1376 NE2 HIS A 322 35.776 10.142 12.653 1.00 53.38 N ATOM 1377 H HIS A 322 32.702 7.285 14.477 1.00 0.00 H ATOM 1378 N GLU A 323 29.474 8.692 12.063 1.00 41.40 N ATOM 1379 CA GLU A 323 28.185 8.077 11.765 1.00 43.55 C ATOM 1380 C GLU A 323 28.358 6.706 11.089 1.00 43.66 C ATOM 1381 O GLU A 323 27.480 5.855 11.182 1.00 44.50 O ATOM 1382 CB GLU A 323 27.319 8.988 10.889 1.00 42.89 C ATOM 1383 CG GLU A 323 25.931 8.413 10.640 1.00 51.14 C ATOM 1384 CD GLU A 323 25.077 9.275 9.734 1.00 53.35 C ATOM 1385 OE1 GLU A 323 25.629 9.855 8.776 1.00 60.48 O ATOM 1386 OE2 GLU A 323 23.851 9.352 9.966 1.00 54.59 O ATOM 1387 H GLU A 323 29.710 9.637 11.700 1.00 0.00 H ATOM 1388 N GLU A 324 29.494 6.502 10.424 1.00 43.34 N ATOM 1389 CA GLU A 324 29.798 5.241 9.744 1.00 46.08 C ATOM 1390 C GLU A 324 29.914 4.118 10.771 1.00 45.17 C ATOM 1391 O GLU A 324 29.387 3.012 10.586 1.00 48.90 O ATOM 1392 CB GLU A 324 31.128 5.341 8.976 1.00 46.87 C ATOM 1393 CG GLU A 324 31.092 6.095 7.643 1.00 44.65 C ATOM 1394 CD GLU A 324 31.050 7.607 7.799 1.00 51.58 C ATOM 1395 OE1 GLU A 324 31.260 8.300 6.780 1.00 46.83 O ATOM 1396 OE2 GLU A 324 30.801 8.103 8.923 1.00 39.99 O ATOM 1397 H GLU A 324 30.194 7.270 10.386 1.00 0.00 H ATOM 1398 N GLU A 325 30.629 4.403 11.851 1.00 44.64 N ATOM 1399 CA GLU A 325 30.816 3.428 12.918 1.00 43.57 C ATOM 1400 C GLU A 325 29.504 3.184 13.657 1.00 42.53 C ATOM 1401 O GLU A 325 29.218 2.062 14.077 1.00 45.00 O ATOM 1402 CB GLU A 325 31.902 3.923 13.875 1.00 44.14 C ATOM 1403 CG GLU A 325 33.290 3.946 13.228 1.00 45.44 C ATOM 1404 CD GLU A 325 34.213 5.007 13.806 1.00 50.82 C ATOM 1405 OE1 GLU A 325 35.400 5.023 13.416 1.00 50.69 O ATOM 1406 OE2 GLU A 325 33.759 5.825 14.636 1.00 50.25 O ATOM 1407 H GLU A 325 31.066 5.343 11.938 1.00 0.00 H ATOM 1408 N HIS A 326 28.703 4.235 13.789 1.00 40.87 N ATOM 1409 CA HIS A 326 27.408 4.155 14.462 1.00 40.61 C ATOM 1410 C HIS A 326 26.482 3.151 13.747 1.00 39.90 C ATOM 1411 O HIS A 326 25.919 2.254 14.384 1.00 39.75 O ATOM 1412 CB HIS A 326 26.770 5.552 14.485 1.00 34.68 C ATOM 1413 CG HIS A 326 25.442 5.629 15.185 1.00 35.60 C ATOM 1414 ND1 HIS A 326 25.314 5.555 16.557 1.00 36.42 N ATOM 1415 CD2 HIS A 326 24.194 5.854 14.704 1.00 29.16 C ATOM 1416 CE1 HIS A 326 24.048 5.736 16.891 1.00 30.43 C ATOM 1417 NE2 HIS A 326 23.346 5.922 15.785 1.00 33.33 N ATOM 1418 H HIS A 326 29.009 5.149 13.399 1.00 0.00 H ATOM 1419 N VAL A 327 26.330 3.285 12.432 1.00 37.88 N ATOM 1420 CA VAL A 327 25.449 2.376 11.712 1.00 39.49 C ATOM 1421 C VAL A 327 26.023 0.971 11.629 1.00 37.27 C ATOM 1422 O VAL A 327 25.281 -0.004 11.608 1.00 37.31 O ATOM 1423 CB VAL A 327 25.113 2.901 10.296 1.00 41.95 C ATOM 1424 CG1 VAL A 327 24.488 4.305 10.416 1.00 43.36 C ATOM 1425 CG2 VAL A 327 26.368 2.928 9.417 1.00 38.63 C ATOM 1426 H VAL A 327 26.838 4.035 11.921 1.00 0.00 H ATOM 1427 N LEU A 328 27.345 0.868 11.610 1.00 38.46 N ATOM 1428 CA LEU A 328 27.989 -0.438 11.548 1.00 38.55 C ATOM 1429 C LEU A 328 27.780 -1.183 12.854 1.00 39.16 C ATOM 1430 O LEU A 328 27.521 -2.381 12.843 1.00 41.74 O ATOM 1431 CB LEU A 328 29.485 -0.290 11.247 1.00 36.96 C ATOM 1432 CG LEU A 328 29.842 -0.077 9.767 1.00 41.64 C ATOM 1433 CD1 LEU A 328 31.298 0.405 9.646 1.00 41.75 C ATOM 1434 CD2 LEU A 328 29.645 -1.386 8.993 1.00 41.96 C ATOM 1435 H LEU A 328 27.928 1.728 11.640 1.00 0.00 H ATOM 1436 N LEU A 329 27.871 -0.471 13.978 1.00 39.42 N ATOM 1437 CA LEU A 329 27.670 -1.091 15.287 1.00 38.19 C ATOM 1438 C LEU A 329 26.217 -1.581 15.455 1.00 40.54 C ATOM 1439 O LEU A 329 25.983 -2.659 16.015 1.00 40.80 O ATOM 1440 CB LEU A 329 28.040 -0.110 16.412 1.00 36.82 C ATOM 1441 CG LEU A 329 28.024 -0.618 17.864 1.00 39.53 C ATOM 1442 CD1 LEU A 329 29.008 -1.785 18.002 1.00 37.25 C ATOM 1443 CD2 LEU A 329 28.404 0.495 18.825 1.00 30.08 C ATOM 1444 H LEU A 329 28.089 0.544 13.922 1.00 0.00 H ATOM 1445 N MET A 330 25.243 -0.810 14.969 1.00 38.57 N ATOM 1446 CA MET A 330 23.839 -1.225 15.074 1.00 39.18 C ATOM 1447 C MET A 330 23.579 -2.496 14.263 1.00 40.47 C ATOM 1448 O MET A 330 22.868 -3.392 14.721 1.00 39.54 O ATOM 1449 CB MET A 330 22.887 -0.119 14.595 1.00 36.87 C ATOM 1450 CG MET A 330 22.795 1.091 15.538 1.00 34.00 C ATOM 1451 SD MET A 330 21.459 2.237 15.054 1.00 39.45 S ATOM 1452 CE MET A 330 22.031 2.708 13.412 1.00 36.37 C ATOM 1453 H MET A 330 25.481 0.093 14.512 1.00 0.00 H ATOM 1454 N ALA A 331 24.159 -2.566 13.064 1.00 40.02 N ATOM 1455 CA ALA A 331 23.983 -3.726 12.186 1.00 40.39 C ATOM 1456 C ALA A 331 24.658 -4.972 12.766 1.00 40.40 C ATOM 1457 O ALA A 331 24.123 -6.077 12.656 1.00 41.07 O ATOM 1458 CB ALA A 331 24.535 -3.417 10.784 1.00 36.69 C ATOM 1459 H ALA A 331 24.753 -1.775 12.743 1.00 0.00 H ATOM 1460 N ILE A 332 25.831 -4.783 13.376 1.00 41.04 N ATOM 1461 CA ILE A 332 26.574 -5.868 14.010 1.00 41.91 C ATOM 1462 C ILE A 332 25.787 -6.387 15.222 1.00 44.05 C ATOM 1463 O ILE A 332 25.848 -7.575 15.554 1.00 42.96 O ATOM 1464 CB ILE A 332 27.964 -5.389 14.483 1.00 38.96 C ATOM 1465 CG1 ILE A 332 28.841 -5.084 13.264 1.00 43.00 C ATOM 1466 CG2 ILE A 332 28.602 -6.440 15.411 1.00 42.18 C ATOM 1467 CD1 ILE A 332 30.168 -4.395 13.605 1.00 44.98 C ATOM 1468 H ILE A 332 26.232 -3.824 13.400 1.00 0.00 H ATOM 1469 N CYS A 333 25.052 -5.486 15.875 1.00 41.72 N ATOM 1470 CA CYS A 333 24.242 -5.846 17.034 1.00 43.00 C ATOM 1471 C CYS A 333 23.064 -6.725 16.596 1.00 41.40 C ATOM 1472 O CYS A 333 22.738 -7.716 17.241 1.00 41.32 O ATOM 1473 CB CYS A 333 23.719 -4.576 17.727 1.00 40.44 C ATOM 1474 SG CYS A 333 22.604 -4.843 19.131 1.00 40.35 S ATOM 1475 H CYS A 333 25.056 -4.498 15.549 1.00 0.00 H ATOM 1476 N ILE A 334 22.437 -6.350 15.491 1.00 40.77 N ATOM 1477 CA ILE A 334 21.303 -7.087 14.962 1.00 41.64 C ATOM 1478 C ILE A 334 21.737 -8.490 14.495 1.00 43.72 C ATOM 1479 O ILE A 334 21.115 -9.492 14.846 1.00 43.08 O ATOM 1480 CB ILE A 334 20.660 -6.306 13.782 1.00 44.33 C ATOM 1481 CG1 ILE A 334 20.149 -4.942 14.280 1.00 41.69 C ATOM 1482 CG2 ILE A 334 19.529 -7.112 13.163 1.00 41.62 C ATOM 1483 CD1 ILE A 334 19.534 -4.079 13.216 1.00 34.43 C ATOM 1484 H ILE A 334 22.767 -5.502 14.987 1.00 0.00 H ATOM 1485 N VAL A 335 22.811 -8.557 13.715 1.00 44.46 N ATOM 1486 CA VAL A 335 23.298 -9.843 13.211 1.00 47.06 C ATOM 1487 C VAL A 335 24.331 -10.482 14.135 1.00 46.26 C ATOM 1488 O VAL A 335 25.517 -10.527 13.819 1.00 48.81 O ATOM 1489 CB VAL A 335 23.905 -9.689 11.795 1.00 47.13 C ATOM 1490 CG1 VAL A 335 24.378 -11.044 11.272 1.00 47.90 C ATOM 1491 CG2 VAL A 335 22.859 -9.109 10.846 1.00 47.42 C ATOM 1492 H VAL A 335 23.313 -7.683 13.459 1.00 0.00 H ATOM 1493 N SER A 336 23.866 -10.970 15.281 1.00 47.93 N ATOM 1494 CA SER A 336 24.725 -11.620 16.272 1.00 49.49 C ATOM 1495 C SER A 336 24.367 -13.105 16.295 1.00 50.75 C ATOM 1496 O SER A 336 23.215 -13.464 16.521 1.00 48.60 O ATOM 1497 CB SER A 336 24.483 -11.010 17.651 1.00 51.75 C ATOM 1498 OG SER A 336 24.675 -9.605 17.616 1.00 59.29 O ATOM 1499 HG SER A 336 24.041 -9.202 16.971 1.00 0.00 H ATOM 1500 H SER A 336 22.849 -10.886 15.482 1.00 0.00 H ATOM 1501 N PRO A 337 25.357 -13.986 16.074 1.00 54.03 N ATOM 1502 CA PRO A 337 25.138 -15.438 16.060 1.00 56.35 C ATOM 1503 C PRO A 337 24.727 -16.106 17.372 1.00 58.06 C ATOM 1504 O PRO A 337 24.032 -17.116 17.355 1.00 60.54 O ATOM 1505 CB PRO A 337 26.468 -15.986 15.538 1.00 55.33 C ATOM 1506 CG PRO A 337 27.041 -14.842 14.760 1.00 60.87 C ATOM 1507 CD PRO A 337 26.727 -13.666 15.634 1.00 53.91 C ATOM 1508 N ASP A 338 25.138 -15.557 18.507 1.00 59.40 N ATOM 1509 CA ASP A 338 24.801 -16.184 19.780 1.00 61.62 C ATOM 1510 C ASP A 338 23.385 -15.965 20.317 1.00 62.59 C ATOM 1511 O ASP A 338 23.050 -16.475 21.392 1.00 64.37 O ATOM 1512 CB ASP A 338 25.800 -15.761 20.853 1.00 62.23 C ATOM 1513 CG ASP A 338 25.776 -14.280 21.108 1.00 64.68 C ATOM 1514 OD1 ASP A 338 26.311 -13.850 22.153 1.00 65.77 O ATOM 1515 OD2 ASP A 338 25.228 -13.550 20.256 1.00 59.51 O ATOM 1516 H ASP A 338 25.699 -14.682 18.489 1.00 0.00 H ATOM 1517 N ARG A 339 22.554 -15.212 19.601 1.00 61.82 N ATOM 1518 CA ARG A 339 21.188 -14.985 20.072 1.00 60.92 C ATOM 1519 C ARG A 339 20.489 -16.343 20.157 1.00 61.13 C ATOM 1520 O ARG A 339 20.380 -17.053 19.161 1.00 61.09 O ATOM 1521 CB ARG A 339 20.407 -14.083 19.103 1.00 58.29 C ATOM 1522 CG ARG A 339 20.988 -12.685 18.850 1.00 45.90 C ATOM 1523 CD ARG A 339 21.007 -11.816 20.097 1.00 41.66 C ATOM 1524 NE ARG A 339 21.308 -10.429 19.748 1.00 43.28 N ATOM 1525 CZ ARG A 339 21.385 -9.434 20.622 1.00 32.51 C ATOM 1526 NH1 ARG A 339 21.189 -9.664 21.913 1.00 33.82 N ATOM 1527 NH2 ARG A 339 21.639 -8.200 20.200 1.00 41.31 N ATOM 1528 HE ARG A 339 21.473 -10.207 18.746 1.00 0.00 H ATOM 1529 HH12 ARG A 339 21.250 -8.882 22.596 1.00 0.00 H ATOM 1530 HH11 ARG A 339 20.974 -10.627 22.243 1.00 0.00 H ATOM 1531 HH22 ARG A 339 21.700 -7.419 20.884 1.00 0.00 H ATOM 1532 HH21 ARG A 339 21.777 -8.015 19.186 1.00 0.00 H ATOM 1533 H ARG A 339 22.875 -14.786 18.708 1.00 0.00 H ATOM 1534 N PRO A 340 20.008 -16.728 21.348 1.00 62.56 N ATOM 1535 CA PRO A 340 19.338 -18.031 21.419 1.00 62.73 C ATOM 1536 C PRO A 340 18.181 -18.171 20.431 1.00 63.24 C ATOM 1537 O PRO A 340 17.463 -17.206 20.138 1.00 62.99 O ATOM 1538 CB PRO A 340 18.893 -18.122 22.882 1.00 61.87 C ATOM 1539 CG PRO A 340 18.811 -16.695 23.326 1.00 63.80 C ATOM 1540 CD PRO A 340 20.000 -16.057 22.659 1.00 64.65 C ATOM 1541 N GLY A 341 18.016 -19.382 19.914 1.00 62.44 N ATOM 1542 CA GLY A 341 16.960 -19.644 18.958 1.00 61.37 C ATOM 1543 C GLY A 341 17.477 -19.579 17.534 1.00 61.81 C ATOM 1544 O GLY A 341 16.790 -19.987 16.601 1.00 63.05 O ATOM 1545 H GLY A 341 18.653 -20.153 20.199 1.00 0.00 H ATOM 1546 N VAL A 342 18.685 -19.059 17.359 1.00 61.09 N ATOM 1547 CA VAL A 342 19.262 -18.961 16.028 1.00 62.34 C ATOM 1548 C VAL A 342 19.500 -20.361 15.480 1.00 63.44 C ATOM 1549 O VAL A 342 19.836 -21.276 16.233 1.00 63.96 O ATOM 1550 CB VAL A 342 20.593 -18.175 16.043 1.00 60.31 C ATOM 1551 CG1 VAL A 342 21.327 -18.368 14.734 1.00 56.57 C ATOM 1552 CG2 VAL A 342 20.313 -16.694 16.251 1.00 57.83 C ATOM 1553 H VAL A 342 19.224 -18.719 18.181 1.00 0.00 H ATOM 1554 N GLN A 343 19.310 -20.516 14.172 1.00 63.53 N ATOM 1555 CA GLN A 343 19.495 -21.797 13.496 1.00 65.50 C ATOM 1556 C GLN A 343 20.728 -21.787 12.605 1.00 64.93 C ATOM 1557 O GLN A 343 21.652 -22.569 12.801 1.00 66.30 O ATOM 1558 CB GLN A 343 18.261 -22.136 12.654 1.00 69.20 C ATOM 1559 CG GLN A 343 17.080 -22.638 13.468 1.00 71.84 C ATOM 1560 CD GLN A 343 17.365 -23.975 14.129 1.00 78.10 C ATOM 1561 OE1 GLN A 343 17.602 -24.976 13.450 1.00 76.98 O ATOM 1562 NE2 GLN A 343 17.347 -23.998 15.457 1.00 74.54 N ATOM 1563 HE22 GLN A 343 17.142 -23.128 15.989 1.00 0.00 H ATOM 1564 HE21 GLN A 343 17.538 -24.886 15.964 1.00 0.00 H ATOM 1565 H GLN A 343 19.018 -19.692 13.609 1.00 0.00 H ATOM 1566 N ASP A 344 20.739 -20.897 11.623 1.00 64.70 N ATOM 1567 CA ASP A 344 21.866 -20.797 10.712 1.00 63.94 C ATOM 1568 C ASP A 344 22.954 -19.899 11.325 1.00 62.76 C ATOM 1569 O ASP A 344 23.358 -18.891 10.746 1.00 62.66 O ATOM 1570 CB ASP A 344 21.380 -20.233 9.380 1.00 65.52 C ATOM 1571 CG ASP A 344 22.323 -20.535 8.243 1.00 66.14 C ATOM 1572 OD1 ASP A 344 22.007 -20.156 7.094 1.00 72.42 O ATOM 1573 OD2 ASP A 344 23.380 -21.148 8.500 1.00 63.14 O ATOM 1574 H ASP A 344 19.927 -20.259 11.503 1.00 0.00 H ATOM 1575 N ALA A 345 23.424 -20.292 12.505 1.00 62.34 N ATOM 1576 CA ALA A 345 24.443 -19.552 13.242 1.00 61.32 C ATOM 1577 C ALA A 345 25.707 -19.210 12.458 1.00 61.50 C ATOM 1578 O ALA A 345 26.309 -18.156 12.674 1.00 60.87 O ATOM 1579 CB ALA A 345 24.812 -20.317 14.503 1.00 61.61 C ATOM 1580 H ALA A 345 23.048 -21.167 12.922 1.00 0.00 H ATOM 1581 N LYS A 346 26.122 -20.097 11.560 1.00 61.68 N ATOM 1582 CA LYS A 346 27.320 -19.852 10.765 1.00 61.36 C ATOM 1583 C LYS A 346 27.066 -18.798 9.688 1.00 60.99 C ATOM 1584 O LYS A 346 27.965 -18.029 9.336 1.00 60.84 O ATOM 1585 CB LYS A 346 27.808 -21.157 10.123 1.00 64.98 C ATOM 1586 CG LYS A 346 27.964 -22.302 11.111 1.00 71.88 C ATOM 1587 CD LYS A 346 28.834 -23.421 10.552 1.00 80.55 C ATOM 1588 CE LYS A 346 30.289 -22.979 10.425 1.00 83.78 C ATOM 1589 NZ LYS A 346 31.189 -24.095 10.009 1.00 85.88 N ATOM 1590 HZ1 LYS A 346 31.145 -24.856 10.716 1.00 0.00 H ATOM 1591 HZ2 LYS A 346 30.882 -24.460 9.085 1.00 0.00 H ATOM 1592 HZ3 LYS A 346 32.165 -23.743 9.937 1.00 0.00 H ATOM 1593 H LYS A 346 25.586 -20.977 11.422 1.00 0.00 H ATOM 1594 N LEU A 347 25.842 -18.759 9.167 1.00 59.93 N ATOM 1595 CA LEU A 347 25.493 -17.779 8.141 1.00 59.08 C ATOM 1596 C LEU A 347 25.434 -16.400 8.796 1.00 58.59 C ATOM 1597 O LEU A 347 25.915 -15.409 8.242 1.00 58.77 O ATOM 1598 CB LEU A 347 24.127 -18.101 7.536 1.00 58.87 C ATOM 1599 CG LEU A 347 23.837 -17.670 6.096 1.00 57.85 C ATOM 1600 CD1 LEU A 347 22.345 -17.412 5.965 1.00 54.27 C ATOM 1601 CD2 LEU A 347 24.615 -16.424 5.726 1.00 59.09 C ATOM 1602 H LEU A 347 25.124 -19.436 9.495 1.00 0.00 H ATOM 1603 N VAL A 348 24.831 -16.346 9.980 1.00 58.44 N ATOM 1604 CA VAL A 348 24.721 -15.093 10.715 1.00 57.35 C ATOM 1605 C VAL A 348 26.132 -14.573 10.969 1.00 56.34 C ATOM 1606 O VAL A 348 26.432 -13.406 10.702 1.00 55.34 O ATOM 1607 CB VAL A 348 23.997 -15.297 12.070 1.00 56.79 C ATOM 1608 CG1 VAL A 348 23.932 -13.984 12.837 1.00 57.17 C ATOM 1609 CG2 VAL A 348 22.600 -15.825 11.837 1.00 55.14 C ATOM 1610 H VAL A 348 24.431 -17.214 10.389 1.00 0.00 H ATOM 1611 N GLU A 349 26.995 -15.458 11.466 1.00 56.10 N ATOM 1612 CA GLU A 349 28.387 -15.117 11.765 1.00 56.79 C ATOM 1613 C GLU A 349 29.119 -14.581 10.540 1.00 55.04 C ATOM 1614 O GLU A 349 29.872 -13.608 10.634 1.00 54.14 O ATOM 1615 CB GLU A 349 29.123 -16.346 12.302 1.00 63.82 C ATOM 1616 CG GLU A 349 29.845 -16.093 13.617 1.00 74.93 C ATOM 1617 CD GLU A 349 30.222 -17.372 14.347 1.00 81.54 C ATOM 1618 OE1 GLU A 349 29.316 -18.181 14.663 1.00 84.63 O ATOM 1619 OE2 GLU A 349 31.426 -17.562 14.610 1.00 84.91 O ATOM 1620 H GLU A 349 26.667 -16.428 11.649 1.00 0.00 H ATOM 1621 N ALA A 350 28.882 -15.208 9.392 1.00 53.60 N ATOM 1622 CA ALA A 350 29.520 -14.792 8.147 1.00 52.80 C ATOM 1623 C ALA A 350 29.090 -13.376 7.793 1.00 52.11 C ATOM 1624 O ALA A 350 29.902 -12.566 7.347 1.00 50.94 O ATOM 1625 CB ALA A 350 29.154 -15.749 7.021 1.00 51.76 C ATOM 1626 H ALA A 350 28.226 -16.015 9.381 1.00 0.00 H ATOM 1627 N ILE A 351 27.807 -13.084 7.986 1.00 51.83 N ATOM 1628 CA ILE A 351 27.288 -11.752 7.700 1.00 51.32 C ATOM 1629 C ILE A 351 27.878 -10.729 8.681 1.00 50.91 C ATOM 1630 O ILE A 351 28.346 -9.667 8.271 1.00 52.33 O ATOM 1631 CB ILE A 351 25.750 -11.718 7.802 1.00 51.61 C ATOM 1632 CG1 ILE A 351 25.147 -12.687 6.786 1.00 49.14 C ATOM 1633 CG2 ILE A 351 25.240 -10.298 7.558 1.00 49.57 C ATOM 1634 CD1 ILE A 351 23.635 -12.757 6.822 1.00 48.25 C ATOM 1635 H ILE A 351 27.164 -13.817 8.347 1.00 0.00 H ATOM 1636 N GLN A 352 27.855 -11.052 9.971 1.00 48.84 N ATOM 1637 CA GLN A 352 28.389 -10.152 10.987 1.00 49.86 C ATOM 1638 C GLN A 352 29.901 -9.942 10.841 1.00 52.19 C ATOM 1639 O GLN A 352 30.391 -8.819 10.991 1.00 49.79 O ATOM 1640 CB GLN A 352 28.067 -10.675 12.389 1.00 48.83 C ATOM 1641 CG GLN A 352 28.794 -9.924 13.497 1.00 49.52 C ATOM 1642 CD GLN A 352 28.433 -10.394 14.890 1.00 46.56 C ATOM 1643 OE1 GLN A 352 27.590 -9.796 15.556 1.00 47.99 O ATOM 1644 NE2 GLN A 352 29.070 -11.472 15.339 1.00 49.44 N ATOM 1645 HE22 GLN A 352 29.776 -11.946 14.740 1.00 0.00 H ATOM 1646 HE21 GLN A 352 28.862 -11.841 16.289 1.00 0.00 H ATOM 1647 H GLN A 352 27.448 -11.964 10.261 1.00 0.00 H ATOM 1648 N ASP A 353 30.637 -11.017 10.552 1.00 52.29 N ATOM 1649 CA ASP A 353 32.089 -10.918 10.375 1.00 54.10 C ATOM 1650 C ASP A 353 32.401 -9.930 9.262 1.00 54.46 C ATOM 1651 O ASP A 353 33.318 -9.113 9.374 1.00 54.73 O ATOM 1652 CB ASP A 353 32.705 -12.276 10.005 1.00 58.58 C ATOM 1653 CG ASP A 353 32.894 -13.183 11.202 1.00 60.62 C ATOM 1654 OD1 ASP A 353 33.251 -12.674 12.281 1.00 64.89 O ATOM 1655 OD2 ASP A 353 32.705 -14.411 11.062 1.00 69.23 O ATOM 1656 H ASP A 353 30.172 -11.942 10.450 1.00 0.00 H ATOM 1657 N ARG A 354 31.635 -10.018 8.181 1.00 54.29 N ATOM 1658 CA ARG A 354 31.824 -9.131 7.042 1.00 54.22 C ATOM 1659 C ARG A 354 31.647 -7.682 7.496 1.00 52.76 C ATOM 1660 O ARG A 354 32.339 -6.779 7.023 1.00 52.30 O ATOM 1661 CB ARG A 354 30.815 -9.483 5.948 1.00 56.19 C ATOM 1662 CG ARG A 354 31.090 -8.844 4.600 1.00 65.91 C ATOM 1663 CD ARG A 354 30.606 -9.751 3.472 1.00 71.87 C ATOM 1664 NE ARG A 354 29.157 -9.935 3.484 1.00 76.94 N ATOM 1665 CZ ARG A 354 28.291 -9.088 2.936 1.00 80.49 C ATOM 1666 NH1 ARG A 354 28.726 -7.994 2.323 1.00 81.58 N ATOM 1667 NH2 ARG A 354 26.987 -9.336 3.002 1.00 77.18 N ATOM 1668 HE ARG A 354 28.778 -10.783 3.951 1.00 0.00 H ATOM 1669 HH12 ARG A 354 28.047 -7.333 1.895 1.00 0.00 H ATOM 1670 HH11 ARG A 354 29.746 -7.798 2.271 1.00 0.00 H ATOM 1671 HH22 ARG A 354 26.309 -8.674 2.573 1.00 0.00 H ATOM 1672 HH21 ARG A 354 26.644 -10.192 3.482 1.00 0.00 H ATOM 1673 H ARG A 354 30.884 -10.736 8.147 1.00 0.00 H ATOM 1674 N LEU A 355 30.713 -7.470 8.419 1.00 51.43 N ATOM 1675 CA LEU A 355 30.449 -6.135 8.951 1.00 49.41 C ATOM 1676 C LEU A 355 31.564 -5.698 9.921 1.00 48.13 C ATOM 1677 O LEU A 355 31.973 -4.537 9.925 1.00 45.42 O ATOM 1678 CB LEU A 355 29.085 -6.120 9.651 1.00 45.64 C ATOM 1679 CG LEU A 355 27.864 -6.349 8.752 1.00 42.40 C ATOM 1680 CD1 LEU A 355 26.651 -6.667 9.595 1.00 40.16 C ATOM 1681 CD2 LEU A 355 27.612 -5.117 7.910 1.00 48.15 C ATOM 1682 H LEU A 355 30.156 -8.275 8.771 1.00 0.00 H ATOM 1683 N SER A 356 32.054 -6.629 10.735 1.00 47.42 N ATOM 1684 CA SER A 356 33.135 -6.338 11.679 1.00 50.70 C ATOM 1685 C SER A 356 34.392 -5.880 10.933 1.00 52.59 C ATOM 1686 O SER A 356 34.979 -4.839 11.251 1.00 51.89 O ATOM 1687 CB SER A 356 33.478 -7.582 12.506 1.00 50.38 C ATOM 1688 OG SER A 356 32.369 -8.017 13.268 1.00 53.07 O ATOM 1689 HG SER A 356 31.620 -8.240 12.661 1.00 0.00 H ATOM 1690 H SER A 356 31.658 -7.590 10.700 1.00 0.00 H ATOM 1691 N ASN A 357 34.806 -6.666 9.943 1.00 53.29 N ATOM 1692 CA ASN A 357 35.989 -6.331 9.161 1.00 55.25 C ATOM 1693 C ASN A 357 35.816 -4.988 8.469 1.00 55.14 C ATOM 1694 O ASN A 357 36.784 -4.257 8.273 1.00 56.23 O ATOM 1695 CB ASN A 357 36.273 -7.424 8.134 1.00 57.79 C ATOM 1696 CG ASN A 357 36.607 -8.750 8.787 1.00 61.82 C ATOM 1697 OD1 ASN A 357 37.464 -8.818 9.670 1.00 66.13 O ATOM 1698 ND2 ASN A 357 35.934 -9.810 8.358 1.00 64.68 N ATOM 1699 HD22 ASN A 357 35.219 -9.704 7.610 1.00 0.00 H ATOM 1700 HD21 ASN A 357 36.121 -10.746 8.770 1.00 0.00 H ATOM 1701 H ASN A 357 34.277 -7.534 9.723 1.00 0.00 H ATOM 1702 N THR A 358 34.583 -4.660 8.101 1.00 53.94 N ATOM 1703 CA THR A 358 34.323 -3.381 7.464 1.00 54.12 C ATOM 1704 C THR A 358 34.527 -2.278 8.504 1.00 53.99 C ATOM 1705 O THR A 358 35.050 -1.203 8.191 1.00 53.42 O ATOM 1706 CB THR A 358 32.885 -3.312 6.915 1.00 55.98 C ATOM 1707 OG1 THR A 358 32.715 -4.310 5.901 1.00 55.32 O ATOM 1708 CG2 THR A 358 32.611 -1.935 6.312 1.00 55.13 C ATOM 1709 HG1 THR A 358 32.879 -5.205 6.290 1.00 0.00 H ATOM 1710 H THR A 358 33.799 -5.323 8.270 1.00 0.00 H ATOM 1711 N LEU A 359 34.117 -2.553 9.742 1.00 52.11 N ATOM 1712 CA LEU A 359 34.266 -1.592 10.830 1.00 51.08 C ATOM 1713 C LEU A 359 35.726 -1.504 11.295 1.00 51.45 C ATOM 1714 O LEU A 359 36.255 -0.408 11.489 1.00 50.73 O ATOM 1715 CB LEU A 359 33.364 -1.967 12.019 1.00 48.28 C ATOM 1716 CG LEU A 359 33.564 -1.083 13.257 1.00 40.19 C ATOM 1717 CD1 LEU A 359 33.233 0.360 12.904 1.00 40.17 C ATOM 1718 CD2 LEU A 359 32.714 -1.574 14.411 1.00 43.05 C ATOM 1719 H LEU A 359 33.680 -3.476 9.938 1.00 0.00 H ATOM 1720 N GLN A 360 36.376 -2.650 11.470 1.00 51.51 N ATOM 1721 CA GLN A 360 37.776 -2.657 11.900 1.00 53.69 C ATOM 1722 C GLN A 360 38.634 -1.902 10.889 1.00 53.38 C ATOM 1723 O GLN A 360 39.502 -1.114 11.262 1.00 55.17 O ATOM 1724 CB GLN A 360 38.304 -4.085 12.025 1.00 53.10 C ATOM 1725 CG GLN A 360 37.568 -4.962 13.018 1.00 54.01 C ATOM 1726 CD GLN A 360 38.027 -6.408 12.942 1.00 62.46 C ATOM 1727 OE1 GLN A 360 39.143 -6.737 13.336 1.00 65.89 O ATOM 1728 NE2 GLN A 360 37.169 -7.276 12.417 1.00 65.12 N ATOM 1729 HE22 GLN A 360 36.234 -6.953 12.096 1.00 0.00 H ATOM 1730 HE21 GLN A 360 37.433 -8.278 12.327 1.00 0.00 H ATOM 1731 H GLN A 360 35.885 -3.551 11.300 1.00 0.00 H ATOM 1732 N THR A 361 38.385 -2.144 9.608 1.00 52.89 N ATOM 1733 CA THR A 361 39.138 -1.489 8.546 1.00 52.99 C ATOM 1734 C THR A 361 38.822 0.002 8.423 1.00 53.39 C ATOM 1735 O THR A 361 39.709 0.807 8.129 1.00 52.02 O ATOM 1736 CB THR A 361 38.859 -2.158 7.198 1.00 56.27 C ATOM 1737 OG1 THR A 361 39.259 -3.532 7.264 1.00 54.23 O ATOM 1738 CG2 THR A 361 39.614 -1.445 6.076 1.00 57.18 C ATOM 1739 HG1 THR A 361 38.746 -3.990 7.976 1.00 0.00 H ATOM 1740 H THR A 361 37.634 -2.818 9.356 1.00 0.00 H ATOM 1741 N TYR A 362 37.558 0.369 8.631 1.00 52.86 N ATOM 1742 CA TYR A 362 37.169 1.772 8.538 1.00 52.14 C ATOM 1743 C TYR A 362 37.847 2.587 9.633 1.00 52.29 C ATOM 1744 O TYR A 362 38.228 3.731 9.410 1.00 52.11 O ATOM 1745 CB TYR A 362 35.644 1.936 8.651 1.00 49.05 C ATOM 1746 CG TYR A 362 35.201 3.390 8.726 1.00 44.70 C ATOM 1747 CD1 TYR A 362 35.232 4.086 9.930 1.00 40.48 C ATOM 1748 CD2 TYR A 362 34.811 4.082 7.581 1.00 41.01 C ATOM 1749 CE1 TYR A 362 34.889 5.445 9.996 1.00 44.69 C ATOM 1750 CE2 TYR A 362 34.469 5.439 7.638 1.00 45.07 C ATOM 1751 CZ TYR A 362 34.513 6.109 8.848 1.00 43.94 C ATOM 1752 OH TYR A 362 34.192 7.449 8.912 1.00 51.42 O ATOM 1753 HH TYR A 362 34.276 7.763 9.847 1.00 0.00 H ATOM 1754 H TYR A 362 36.843 -0.350 8.861 1.00 0.00 H ATOM 1755 N ILE A 363 37.986 1.991 10.814 1.00 52.33 N ATOM 1756 CA ILE A 363 38.605 2.654 11.955 1.00 53.08 C ATOM 1757 C ILE A 363 40.090 2.918 11.707 1.00 54.73 C ATOM 1758 O ILE A 363 40.609 3.993 12.022 1.00 53.17 O ATOM 1759 CB ILE A 363 38.438 1.800 13.238 1.00 50.80 C ATOM 1760 CG1 ILE A 363 36.967 1.795 13.662 1.00 50.15 C ATOM 1761 CG2 ILE A 363 39.320 2.344 14.362 1.00 47.37 C ATOM 1762 CD1 ILE A 363 36.668 0.931 14.867 1.00 42.42 C ATOM 1763 H ILE A 363 37.641 1.017 10.927 1.00 0.00 H ATOM 1764 N ARG A 364 40.763 1.931 11.133 1.00 57.23 N ATOM 1765 CA ARG A 364 42.186 2.042 10.844 1.00 61.39 C ATOM 1766 C ARG A 364 42.473 3.050 9.732 1.00 62.63 C ATOM 1767 O ARG A 364 43.417 3.827 9.825 1.00 63.78 O ATOM 1768 CB ARG A 364 42.752 0.672 10.450 1.00 61.15 C ATOM 1769 CG ARG A 364 42.370 -0.461 11.393 1.00 66.17 C ATOM 1770 CD ARG A 364 42.789 -0.187 12.836 1.00 77.64 C ATOM 1771 NE ARG A 364 42.381 -1.259 13.747 1.00 84.80 N ATOM 1772 CZ ARG A 364 41.123 -1.509 14.109 1.00 84.98 C ATOM 1773 NH1 ARG A 364 40.132 -0.763 13.644 1.00 85.47 N ATOM 1774 NH2 ARG A 364 40.855 -2.515 14.933 1.00 85.20 N ATOM 1775 HE ARG A 364 43.126 -1.869 14.139 1.00 0.00 H ATOM 1776 HH12 ARG A 364 39.152 -0.963 13.930 1.00 0.00 H ATOM 1777 HH11 ARG A 364 40.334 0.023 12.993 1.00 0.00 H ATOM 1778 HH22 ARG A 364 39.873 -2.709 15.215 1.00 0.00 H ATOM 1779 HH21 ARG A 364 41.627 -3.109 15.297 1.00 0.00 H ATOM 1780 H ARG A 364 40.262 1.055 10.883 1.00 0.00 H ATOM 1781 N CYS A 365 41.647 3.054 8.692 1.00 64.09 N ATOM 1782 CA CYS A 365 41.856 3.958 7.567 1.00 65.31 C ATOM 1783 C CYS A 365 41.176 5.315 7.697 1.00 65.96 C ATOM 1784 O CYS A 365 41.706 6.324 7.238 1.00 66.54 O ATOM 1785 CB CYS A 365 41.378 3.297 6.270 1.00 67.15 C ATOM 1786 SG CYS A 365 41.936 1.593 6.053 1.00 74.94 S ATOM 1787 H CYS A 365 40.837 2.401 8.680 1.00 0.00 H ATOM 1788 N ARG A 366 40.005 5.344 8.321 1.00 66.22 N ATOM 1789 CA ARG A 366 39.258 6.590 8.449 1.00 65.64 C ATOM 1790 C ARG A 366 39.291 7.283 9.804 1.00 64.76 C ATOM 1791 O ARG A 366 39.220 8.509 9.864 1.00 64.67 O ATOM 1792 CB ARG A 366 37.798 6.356 8.053 1.00 66.77 C ATOM 1793 CG ARG A 366 37.608 5.869 6.634 1.00 66.84 C ATOM 1794 CD ARG A 366 38.137 6.877 5.629 1.00 74.83 C ATOM 1795 NE ARG A 366 37.782 6.508 4.262 1.00 82.30 N ATOM 1796 CZ ARG A 366 36.543 6.535 3.777 1.00 85.87 C ATOM 1797 NH1 ARG A 366 35.532 6.919 4.547 1.00 89.27 N ATOM 1798 NH2 ARG A 366 36.314 6.173 2.520 1.00 88.04 N ATOM 1799 HE ARG A 366 38.547 6.204 3.626 1.00 0.00 H ATOM 1800 HH12 ARG A 366 34.565 6.939 4.164 1.00 0.00 H ATOM 1801 HH11 ARG A 366 35.707 7.200 5.533 1.00 0.00 H ATOM 1802 HH22 ARG A 366 35.346 6.194 2.141 1.00 0.00 H ATOM 1803 HH21 ARG A 366 37.103 5.868 1.915 1.00 0.00 H ATOM 1804 H ARG A 366 39.615 4.468 8.723 1.00 0.00 H ATOM 1805 N HIS A 367 39.377 6.521 10.891 1.00 64.38 N ATOM 1806 CA HIS A 367 39.391 7.141 12.213 1.00 63.43 C ATOM 1807 C HIS A 367 40.829 7.393 12.640 1.00 63.92 C ATOM 1808 O HIS A 367 41.626 6.462 12.782 1.00 63.75 O ATOM 1809 CB HIS A 367 38.673 6.258 13.247 1.00 59.31 C ATOM 1810 CG HIS A 367 37.905 7.031 14.280 1.00 51.34 C ATOM 1811 ND1 HIS A 367 36.528 6.990 14.374 1.00 40.31 N ATOM 1812 CD2 HIS A 367 38.322 7.866 15.261 1.00 48.15 C ATOM 1813 CE1 HIS A 367 36.132 7.764 15.368 1.00 45.22 C ATOM 1814 NE2 HIS A 367 37.202 8.308 15.923 1.00 52.43 N ATOM 1815 H HIS A 367 39.434 5.487 10.800 1.00 0.00 H ATOM 1816 N PRO A 368 41.182 8.670 12.833 1.00 63.13 N ATOM 1817 CA PRO A 368 42.530 9.068 13.243 1.00 63.64 C ATOM 1818 C PRO A 368 42.721 9.089 14.761 1.00 63.32 C ATOM 1819 O PRO A 368 41.769 9.296 15.518 1.00 65.00 O ATOM 1820 CB PRO A 368 42.660 10.459 12.640 1.00 65.86 C ATOM 1821 CG PRO A 368 41.277 11.014 12.857 1.00 66.55 C ATOM 1822 CD PRO A 368 40.376 9.851 12.463 1.00 63.13 C ATOM 1823 N PRO A 369 43.960 8.864 15.225 1.00 61.51 N ATOM 1824 CA PRO A 369 44.215 8.881 16.667 1.00 59.93 C ATOM 1825 C PRO A 369 44.027 10.312 17.176 1.00 59.13 C ATOM 1826 O PRO A 369 44.126 11.267 16.398 1.00 58.32 O ATOM 1827 CB PRO A 369 45.661 8.405 16.763 1.00 57.08 C ATOM 1828 CG PRO A 369 46.259 8.894 15.476 1.00 55.41 C ATOM 1829 CD PRO A 369 45.191 8.555 14.474 1.00 60.76 C ATOM 1830 N PRO A 370 43.762 10.484 18.484 1.00 58.12 N ATOM 1831 CA PRO A 370 43.624 9.468 19.536 1.00 57.27 C ATOM 1832 C PRO A 370 42.270 8.745 19.552 1.00 57.17 C ATOM 1833 O PRO A 370 42.173 7.601 19.996 1.00 54.90 O ATOM 1834 CB PRO A 370 43.833 10.270 20.828 1.00 56.48 C ATOM 1835 CG PRO A 370 44.474 11.562 20.372 1.00 58.17 C ATOM 1836 CD PRO A 370 43.785 11.830 19.079 1.00 54.54 C ATOM 1837 N GLY A 371 41.234 9.429 19.076 1.00 57.68 N ATOM 1838 CA GLY A 371 39.892 8.869 19.059 1.00 57.78 C ATOM 1839 C GLY A 371 39.743 7.429 18.600 1.00 59.14 C ATOM 1840 O GLY A 371 38.742 6.783 18.904 1.00 59.80 O ATOM 1841 H GLY A 371 41.387 10.389 18.706 1.00 0.00 H ATOM 1842 N SER A 372 40.734 6.922 17.875 1.00 59.53 N ATOM 1843 CA SER A 372 40.691 5.559 17.361 1.00 58.94 C ATOM 1844 C SER A 372 41.395 4.551 18.263 1.00 58.78 C ATOM 1845 O SER A 372 41.431 3.357 17.957 1.00 59.19 O ATOM 1846 CB SER A 372 41.326 5.510 15.971 1.00 57.32 C ATOM 1847 OG SER A 372 42.706 5.833 16.041 1.00 51.63 O ATOM 1848 HG SER A 372 43.099 5.796 15.133 1.00 0.00 H ATOM 1849 H SER A 372 41.564 7.514 17.668 1.00 0.00 H ATOM 1850 N HIS A 373 41.964 5.026 19.364 1.00 58.82 N ATOM 1851 CA HIS A 373 42.672 4.138 20.277 1.00 58.10 C ATOM 1852 C HIS A 373 41.709 3.217 21.007 1.00 57.87 C ATOM 1853 O HIS A 373 40.888 3.675 21.804 1.00 56.17 O ATOM 1854 CB HIS A 373 43.472 4.943 21.305 1.00 60.51 C ATOM 1855 CG HIS A 373 44.174 4.091 22.318 1.00 55.00 C ATOM 1856 ND1 HIS A 373 45.045 3.083 21.964 1.00 55.05 N ATOM 1857 CD2 HIS A 373 44.117 4.082 23.670 1.00 54.64 C ATOM 1858 CE1 HIS A 373 45.491 2.487 23.055 1.00 56.42 C ATOM 1859 NE2 HIS A 373 44.943 3.074 24.104 1.00 59.10 N ATOM 1860 H HIS A 373 41.904 6.042 19.577 1.00 0.00 H ATOM 1861 N GLN A 374 41.816 1.921 20.727 1.00 58.44 N ATOM 1862 CA GLN A 374 40.961 0.930 21.367 1.00 58.66 C ATOM 1863 C GLN A 374 39.512 1.070 20.918 1.00 57.01 C ATOM 1864 O GLN A 374 38.640 0.341 21.393 1.00 58.76 O ATOM 1865 CB GLN A 374 41.023 1.096 22.888 1.00 62.83 C ATOM 1866 CG GLN A 374 42.358 0.755 23.508 1.00 70.72 C ATOM 1867 CD GLN A 374 42.633 -0.726 23.448 1.00 76.90 C ATOM 1868 OE1 GLN A 374 42.716 -1.310 22.365 1.00 79.92 O ATOM 1869 NE2 GLN A 374 42.767 -1.350 24.612 1.00 77.99 N ATOM 1870 HE22 GLN A 374 42.689 -0.815 25.501 1.00 0.00 H ATOM 1871 HE21 GLN A 374 42.950 -2.374 24.635 1.00 0.00 H ATOM 1872 H GLN A 374 42.527 1.608 20.035 1.00 0.00 H ATOM 1873 N LEU A 375 39.256 2.002 20.006 1.00 53.78 N ATOM 1874 CA LEU A 375 37.899 2.241 19.536 1.00 52.65 C ATOM 1875 C LEU A 375 37.097 0.974 19.239 1.00 51.56 C ATOM 1876 O LEU A 375 35.960 0.842 19.690 1.00 49.49 O ATOM 1877 CB LEU A 375 37.899 3.136 18.295 1.00 49.03 C ATOM 1878 CG LEU A 375 36.475 3.520 17.883 1.00 49.67 C ATOM 1879 CD1 LEU A 375 35.765 4.195 19.061 1.00 47.82 C ATOM 1880 CD2 LEU A 375 36.505 4.430 16.672 1.00 45.26 C ATOM 1881 H LEU A 375 40.038 2.570 19.622 1.00 0.00 H ATOM 1882 N TYR A 376 37.675 0.041 18.491 1.00 49.19 N ATOM 1883 CA TYR A 376 36.943 -1.175 18.168 1.00 48.97 C ATOM 1884 C TYR A 376 36.589 -1.994 19.407 1.00 48.31 C ATOM 1885 O TYR A 376 35.437 -2.385 19.595 1.00 49.02 O ATOM 1886 CB TYR A 376 37.734 -2.059 17.206 1.00 51.48 C ATOM 1887 CG TYR A 376 36.971 -3.304 16.819 1.00 48.98 C ATOM 1888 CD1 TYR A 376 35.857 -3.225 15.986 1.00 52.95 C ATOM 1889 CD2 TYR A 376 37.334 -4.556 17.319 1.00 59.12 C ATOM 1890 CE1 TYR A 376 35.122 -4.355 15.656 1.00 55.19 C ATOM 1891 CE2 TYR A 376 36.601 -5.698 16.998 1.00 59.28 C ATOM 1892 CZ TYR A 376 35.496 -5.585 16.162 1.00 59.77 C ATOM 1893 OH TYR A 376 34.774 -6.701 15.814 1.00 65.38 O ATOM 1894 HH TYR A 376 34.028 -6.438 15.219 1.00 0.00 H ATOM 1895 H TYR A 376 38.644 0.178 18.139 1.00 0.00 H ATOM 1896 N ALA A 377 37.591 -2.253 20.242 1.00 47.23 N ATOM 1897 CA ALA A 377 37.408 -3.030 21.454 1.00 44.84 C ATOM 1898 C ALA A 377 36.437 -2.338 22.399 1.00 46.45 C ATOM 1899 O ALA A 377 35.763 -2.993 23.195 1.00 44.78 O ATOM 1900 CB ALA A 377 38.749 -3.244 22.132 1.00 45.12 C ATOM 1901 H ALA A 377 38.538 -1.886 20.019 1.00 0.00 H ATOM 1902 N LYS A 378 36.368 -1.011 22.324 1.00 44.44 N ATOM 1903 CA LYS A 378 35.443 -0.277 23.175 1.00 43.93 C ATOM 1904 C LYS A 378 34.031 -0.420 22.621 1.00 42.77 C ATOM 1905 O LYS A 378 33.076 -0.500 23.376 1.00 42.32 O ATOM 1906 CB LYS A 378 35.818 1.206 23.248 1.00 46.59 C ATOM 1907 CG LYS A 378 37.040 1.516 24.122 1.00 52.22 C ATOM 1908 CD LYS A 378 37.198 3.025 24.305 1.00 56.48 C ATOM 1909 CE LYS A 378 38.395 3.372 25.177 1.00 62.54 C ATOM 1910 NZ LYS A 378 39.680 3.201 24.452 1.00 65.80 N ATOM 1911 HZ1 LYS A 378 39.776 2.211 24.147 1.00 0.00 H ATOM 1912 HZ2 LYS A 378 39.693 3.824 23.619 1.00 0.00 H ATOM 1913 HZ3 LYS A 378 40.468 3.448 25.083 1.00 0.00 H ATOM 1914 H LYS A 378 36.977 -0.497 21.655 1.00 0.00 H ATOM 1915 N MET A 379 33.911 -0.450 21.297 1.00 41.68 N ATOM 1916 CA MET A 379 32.621 -0.595 20.652 1.00 42.85 C ATOM 1917 C MET A 379 32.061 -1.981 20.945 1.00 42.43 C ATOM 1918 O MET A 379 30.883 -2.136 21.258 1.00 44.13 O ATOM 1919 CB MET A 379 32.751 -0.380 19.142 1.00 38.01 C ATOM 1920 CG MET A 379 32.961 1.090 18.755 1.00 41.78 C ATOM 1921 SD MET A 379 33.291 1.344 16.998 1.00 42.80 S ATOM 1922 CE MET A 379 31.591 1.141 16.328 1.00 36.47 C ATOM 1923 H MET A 379 34.765 -0.367 20.709 1.00 0.00 H ATOM 1924 N ILE A 380 32.908 -2.989 20.859 1.00 43.47 N ATOM 1925 CA ILE A 380 32.443 -4.335 21.134 1.00 46.48 C ATOM 1926 C ILE A 380 31.971 -4.425 22.579 1.00 47.79 C ATOM 1927 O ILE A 380 30.946 -5.039 22.858 1.00 48.58 O ATOM 1928 CB ILE A 380 33.548 -5.363 20.873 1.00 49.09 C ATOM 1929 CG1 ILE A 380 34.022 -5.228 19.431 1.00 42.42 C ATOM 1930 CG2 ILE A 380 33.029 -6.773 21.119 1.00 46.13 C ATOM 1931 CD1 ILE A 380 32.893 -5.207 18.425 1.00 58.50 C ATOM 1932 H ILE A 380 33.900 -2.820 20.596 1.00 0.00 H ATOM 1933 N GLN A 381 32.702 -3.786 23.491 1.00 48.20 N ATOM 1934 CA GLN A 381 32.335 -3.805 24.900 1.00 48.38 C ATOM 1935 C GLN A 381 30.926 -3.236 25.116 1.00 47.90 C ATOM 1936 O GLN A 381 30.190 -3.697 26.003 1.00 47.82 O ATOM 1937 CB GLN A 381 33.362 -3.028 25.732 1.00 49.13 C ATOM 1938 CG GLN A 381 33.044 -2.998 27.209 1.00 49.55 C ATOM 1939 CD GLN A 381 32.912 -4.390 27.809 1.00 54.97 C ATOM 1940 OE1 GLN A 381 32.202 -4.587 28.793 1.00 55.12 O ATOM 1941 NE2 GLN A 381 33.601 -5.358 27.222 1.00 61.85 N ATOM 1942 HE22 GLN A 381 34.190 -5.147 26.391 1.00 0.00 H ATOM 1943 HE21 GLN A 381 33.553 -6.329 27.592 1.00 0.00 H ATOM 1944 H GLN A 381 33.550 -3.264 23.191 1.00 0.00 H ATOM 1945 N LYS A 382 30.552 -2.240 24.312 1.00 46.24 N ATOM 1946 CA LYS A 382 29.216 -1.647 24.409 1.00 44.88 C ATOM 1947 C LYS A 382 28.148 -2.695 24.059 1.00 43.53 C ATOM 1948 O LYS A 382 27.062 -2.704 24.639 1.00 43.66 O ATOM 1949 CB LYS A 382 29.079 -0.433 23.474 1.00 46.95 C ATOM 1950 CG LYS A 382 29.911 0.776 23.889 1.00 43.68 C ATOM 1951 CD LYS A 382 29.649 1.164 25.336 1.00 48.80 C ATOM 1952 CE LYS A 382 30.910 1.742 25.970 1.00 50.61 C ATOM 1953 NZ LYS A 382 30.821 1.766 27.461 1.00 49.26 N ATOM 1954 HZ1 LYS A 382 30.012 2.352 27.749 1.00 0.00 H ATOM 1955 HZ2 LYS A 382 30.692 0.797 27.815 1.00 0.00 H ATOM 1956 HZ3 LYS A 382 31.697 2.166 27.853 1.00 0.00 H ATOM 1957 H LYS A 382 31.221 -1.878 23.603 1.00 0.00 H ATOM 1958 N LEU A 383 28.464 -3.577 23.113 1.00 42.65 N ATOM 1959 CA LEU A 383 27.538 -4.638 22.732 1.00 42.19 C ATOM 1960 C LEU A 383 27.320 -5.576 23.920 1.00 41.00 C ATOM 1961 O LEU A 383 26.237 -6.140 24.080 1.00 40.88 O ATOM 1962 CB LEU A 383 28.072 -5.433 21.538 1.00 41.33 C ATOM 1963 CG LEU A 383 28.129 -4.698 20.194 1.00 48.04 C ATOM 1964 CD1 LEU A 383 28.554 -5.687 19.131 1.00 45.67 C ATOM 1965 CD2 LEU A 383 26.771 -4.095 19.829 1.00 48.84 C ATOM 1966 H LEU A 383 29.386 -3.508 22.638 1.00 0.00 H ATOM 1967 N ALA A 384 28.350 -5.743 24.746 1.00 40.30 N ATOM 1968 CA ALA A 384 28.247 -6.587 25.938 1.00 41.33 C ATOM 1969 C ALA A 384 27.419 -5.862 27.003 1.00 39.56 C ATOM 1970 O ALA A 384 26.623 -6.476 27.720 1.00 37.86 O ATOM 1971 CB ALA A 384 29.650 -6.915 26.488 1.00 43.28 C ATOM 1972 H ALA A 384 29.249 -5.263 24.540 1.00 0.00 H ATOM 1973 N ASP A 385 27.608 -4.552 27.112 1.00 37.85 N ATOM 1974 CA ASP A 385 26.845 -3.773 28.087 1.00 36.96 C ATOM 1975 C ASP A 385 25.353 -3.874 27.737 1.00 37.32 C ATOM 1976 O ASP A 385 24.487 -3.927 28.618 1.00 36.09 O ATOM 1977 CB ASP A 385 27.263 -2.290 28.046 1.00 41.35 C ATOM 1978 CG ASP A 385 28.725 -2.064 28.446 1.00 49.20 C ATOM 1979 OD1 ASP A 385 29.235 -0.935 28.233 1.00 49.27 O ATOM 1980 OD2 ASP A 385 29.361 -3.000 28.975 1.00 48.27 O ATOM 1981 H ASP A 385 28.303 -4.077 26.501 1.00 0.00 H ATOM 1982 N LEU A 386 25.064 -3.898 26.440 1.00 36.51 N ATOM 1983 CA LEU A 386 23.693 -3.970 25.961 1.00 39.57 C ATOM 1984 C LEU A 386 23.065 -5.314 26.288 1.00 40.72 C ATOM 1985 O LEU A 386 21.856 -5.404 26.486 1.00 40.38 O ATOM 1986 CB LEU A 386 23.645 -3.691 24.454 1.00 37.88 C ATOM 1987 CG LEU A 386 23.779 -2.206 24.084 1.00 40.99 C ATOM 1988 CD1 LEU A 386 24.008 -2.058 22.604 1.00 40.97 C ATOM 1989 CD2 LEU A 386 22.523 -1.449 24.504 1.00 30.94 C ATOM 1990 H LEU A 386 25.840 -3.864 25.748 1.00 0.00 H ATOM 1991 N ARG A 387 23.886 -6.357 26.358 1.00 42.50 N ATOM 1992 CA ARG A 387 23.373 -7.680 26.705 1.00 45.22 C ATOM 1993 C ARG A 387 22.861 -7.597 28.134 1.00 45.85 C ATOM 1994 O ARG A 387 21.840 -8.181 28.486 1.00 48.44 O ATOM 1995 CB ARG A 387 24.479 -8.733 26.626 1.00 40.02 C ATOM 1996 CG ARG A 387 24.966 -9.012 25.217 1.00 42.99 C ATOM 1997 CD ARG A 387 23.803 -9.395 24.310 1.00 39.51 C ATOM 1998 NE ARG A 387 24.244 -9.602 22.939 1.00 40.88 N ATOM 1999 CZ ARG A 387 24.523 -10.785 22.403 1.00 40.50 C ATOM 2000 NH1 ARG A 387 24.403 -11.895 23.122 1.00 39.12 N ATOM 2001 NH2 ARG A 387 24.939 -10.848 21.144 1.00 37.79 N ATOM 2002 HE ARG A 387 24.348 -8.762 22.334 1.00 0.00 H ATOM 2003 HH12 ARG A 387 24.623 -12.817 22.695 1.00 0.00 H ATOM 2004 HH11 ARG A 387 24.089 -11.842 24.112 1.00 0.00 H ATOM 2005 HH22 ARG A 387 25.160 -11.769 20.715 1.00 0.00 H ATOM 2006 HH21 ARG A 387 25.044 -9.976 20.587 1.00 0.00 H ATOM 2007 H ARG A 387 24.900 -6.230 26.165 1.00 0.00 H ATOM 2008 N SER A 388 23.583 -6.851 28.955 1.00 46.48 N ATOM 2009 CA SER A 388 23.211 -6.691 30.348 1.00 46.89 C ATOM 2010 C SER A 388 21.932 -5.860 30.448 1.00 45.82 C ATOM 2011 O SER A 388 21.026 -6.188 31.212 1.00 46.33 O ATOM 2012 CB SER A 388 24.362 -6.022 31.107 1.00 44.20 C ATOM 2013 OG SER A 388 24.043 -5.875 32.472 1.00 54.82 O ATOM 2014 HG SER A 388 24.799 -5.442 32.942 1.00 0.00 H ATOM 2015 H SER A 388 24.432 -6.371 28.595 1.00 0.00 H ATOM 2016 N LEU A 389 21.857 -4.790 29.660 1.00 45.23 N ATOM 2017 CA LEU A 389 20.683 -3.917 29.663 1.00 42.01 C ATOM 2018 C LEU A 389 19.436 -4.658 29.180 1.00 40.95 C ATOM 2019 O LEU A 389 18.352 -4.473 29.709 1.00 38.95 O ATOM 2020 CB LEU A 389 20.952 -2.692 28.778 1.00 40.92 C ATOM 2021 CG LEU A 389 21.975 -1.722 29.378 1.00 40.83 C ATOM 2022 CD1 LEU A 389 22.301 -0.592 28.401 1.00 39.73 C ATOM 2023 CD2 LEU A 389 21.392 -1.149 30.659 1.00 40.73 C ATOM 2024 H LEU A 389 22.652 -4.569 29.027 1.00 0.00 H ATOM 2025 N ASN A 390 19.606 -5.504 28.174 1.00 40.87 N ATOM 2026 CA ASN A 390 18.505 -6.271 27.630 1.00 42.74 C ATOM 2027 C ASN A 390 17.943 -7.167 28.740 1.00 45.19 C ATOM 2028 O ASN A 390 16.731 -7.252 28.948 1.00 44.77 O ATOM 2029 CB ASN A 390 19.012 -7.141 26.486 1.00 37.77 C ATOM 2030 CG ASN A 390 17.898 -7.693 25.644 1.00 35.20 C ATOM 2031 OD1 ASN A 390 16.786 -7.891 26.124 1.00 44.56 O ATOM 2032 ND2 ASN A 390 18.192 -7.960 24.374 1.00 41.77 N ATOM 2033 HD22 ASN A 390 19.149 -7.775 24.012 1.00 0.00 H ATOM 2034 HD21 ASN A 390 17.465 -8.353 23.743 1.00 0.00 H ATOM 2035 H ASN A 390 20.555 -5.620 27.765 1.00 0.00 H ATOM 2036 N GLU A 391 18.851 -7.831 29.444 1.00 47.40 N ATOM 2037 CA GLU A 391 18.506 -8.737 30.532 1.00 49.59 C ATOM 2038 C GLU A 391 17.624 -8.059 31.576 1.00 48.60 C ATOM 2039 O GLU A 391 16.595 -8.600 31.981 1.00 48.31 O ATOM 2040 CB GLU A 391 19.793 -9.244 31.182 1.00 54.99 C ATOM 2041 CG GLU A 391 19.630 -10.425 32.117 1.00 68.29 C ATOM 2042 CD GLU A 391 20.972 -10.926 32.640 1.00 77.67 C ATOM 2043 OE1 GLU A 391 21.660 -10.166 33.360 1.00 80.02 O ATOM 2044 OE2 GLU A 391 21.345 -12.077 32.322 1.00 79.98 O ATOM 2045 H GLU A 391 19.855 -7.699 29.208 1.00 0.00 H ATOM 2046 N GLU A 392 18.028 -6.870 32.012 1.00 49.43 N ATOM 2047 CA GLU A 392 17.259 -6.134 33.013 1.00 48.45 C ATOM 2048 C GLU A 392 15.909 -5.744 32.424 1.00 47.53 C ATOM 2049 O GLU A 392 14.876 -5.807 33.101 1.00 46.37 O ATOM 2050 CB GLU A 392 18.009 -4.877 33.452 1.00 49.10 C ATOM 2051 CG GLU A 392 17.209 -4.036 34.438 1.00 63.52 C ATOM 2052 CD GLU A 392 16.898 -4.788 35.724 1.00 67.27 C ATOM 2053 OE1 GLU A 392 15.819 -4.547 36.311 1.00 63.72 O ATOM 2054 OE2 GLU A 392 17.742 -5.611 36.148 1.00 62.98 O ATOM 2055 H GLU A 392 18.905 -6.457 31.635 1.00 0.00 H ATOM 2056 N HIS A 393 15.936 -5.333 31.159 1.00 44.22 N ATOM 2057 CA HIS A 393 14.730 -4.946 30.442 1.00 44.51 C ATOM 2058 C HIS A 393 13.735 -6.104 30.526 1.00 43.55 C ATOM 2059 O HIS A 393 12.594 -5.932 30.936 1.00 42.39 O ATOM 2060 CB HIS A 393 15.076 -4.638 28.966 1.00 39.36 C ATOM 2061 CG HIS A 393 14.014 -5.051 27.992 1.00 37.62 C ATOM 2062 ND1 HIS A 393 12.801 -4.404 27.888 1.00 38.37 N ATOM 2063 CD2 HIS A 393 13.965 -6.083 27.117 1.00 35.36 C ATOM 2064 CE1 HIS A 393 12.050 -5.022 26.993 1.00 39.56 C ATOM 2065 NE2 HIS A 393 12.734 -6.043 26.511 1.00 42.28 N ATOM 2066 H HIS A 393 16.850 -5.287 30.665 1.00 0.00 H ATOM 2067 N SER A 394 14.195 -7.289 30.149 1.00 44.98 N ATOM 2068 CA SER A 394 13.352 -8.474 30.151 1.00 48.44 C ATOM 2069 C SER A 394 12.717 -8.798 31.503 1.00 48.43 C ATOM 2070 O SER A 394 11.527 -9.100 31.570 1.00 47.61 O ATOM 2071 CB SER A 394 14.160 -9.667 29.646 1.00 47.92 C ATOM 2072 OG SER A 394 14.612 -9.414 28.327 1.00 60.32 O ATOM 2073 HG SER A 394 15.183 -8.605 28.325 1.00 0.00 H ATOM 2074 H SER A 394 15.186 -7.373 29.844 1.00 0.00 H ATOM 2075 N LYS A 395 13.499 -8.727 32.577 1.00 49.19 N ATOM 2076 CA LYS A 395 12.972 -9.032 33.904 1.00 50.82 C ATOM 2077 C LYS A 395 11.868 -8.078 34.320 1.00 51.53 C ATOM 2078 O LYS A 395 10.810 -8.509 34.773 1.00 51.49 O ATOM 2079 CB LYS A 395 14.101 -9.033 34.942 1.00 54.59 C ATOM 2080 CG LYS A 395 15.101 -10.151 34.696 1.00 60.59 C ATOM 2081 CD LYS A 395 16.345 -10.058 35.563 1.00 69.54 C ATOM 2082 CE LYS A 395 17.377 -11.079 35.088 1.00 70.10 C ATOM 2083 NZ LYS A 395 18.674 -10.987 35.807 1.00 74.68 N ATOM 2084 HZ1 LYS A 395 19.082 -10.041 35.664 1.00 0.00 H ATOM 2085 HZ2 LYS A 395 18.518 -11.149 36.822 1.00 0.00 H ATOM 2086 HZ3 LYS A 395 19.327 -11.707 35.436 1.00 0.00 H ATOM 2087 H LYS A 395 14.496 -8.451 32.470 1.00 0.00 H ATOM 2088 N GLN A 396 12.089 -6.781 34.157 1.00 52.88 N ATOM 2089 CA GLN A 396 11.060 -5.833 34.540 1.00 54.01 C ATOM 2090 C GLN A 396 9.838 -5.937 33.623 1.00 54.69 C ATOM 2091 O GLN A 396 8.712 -5.689 34.055 1.00 53.66 O ATOM 2092 CB GLN A 396 11.617 -4.411 34.542 1.00 54.77 C ATOM 2093 CG GLN A 396 12.812 -4.233 35.467 1.00 73.10 C ATOM 2094 CD GLN A 396 13.063 -2.776 35.837 1.00 83.30 C ATOM 2095 OE1 GLN A 396 14.145 -2.417 36.315 1.00 79.80 O ATOM 2096 NE2 GLN A 396 12.054 -1.933 35.632 1.00 85.96 N ATOM 2097 HE22 GLN A 396 11.161 -2.280 35.227 1.00 0.00 H ATOM 2098 HE21 GLN A 396 12.159 -0.928 35.877 1.00 0.00 H ATOM 2099 H GLN A 396 12.990 -6.447 33.759 1.00 0.00 H ATOM 2100 N TYR A 397 10.048 -6.316 32.366 1.00 55.35 N ATOM 2101 CA TYR A 397 8.920 -6.451 31.448 1.00 57.18 C ATOM 2102 C TYR A 397 8.027 -7.581 31.949 1.00 58.11 C ATOM 2103 O TYR A 397 6.804 -7.513 31.841 1.00 57.91 O ATOM 2104 CB TYR A 397 9.392 -6.767 30.023 1.00 53.15 C ATOM 2105 CG TYR A 397 8.249 -6.922 29.029 1.00 51.89 C ATOM 2106 CD1 TYR A 397 7.475 -5.825 28.640 1.00 50.85 C ATOM 2107 CD2 TYR A 397 7.909 -8.175 28.519 1.00 48.83 C ATOM 2108 CE1 TYR A 397 6.387 -5.972 27.772 1.00 43.71 C ATOM 2109 CE2 TYR A 397 6.825 -8.334 27.657 1.00 47.01 C ATOM 2110 CZ TYR A 397 6.069 -7.231 27.291 1.00 47.99 C ATOM 2111 OH TYR A 397 4.986 -7.401 26.461 1.00 52.08 O ATOM 2112 HH TYR A 397 5.288 -7.788 25.601 1.00 0.00 H ATOM 2113 H TYR A 397 11.014 -6.516 32.037 1.00 0.00 H ATOM 2114 N ARG A 398 8.645 -8.625 32.496 1.00 59.69 N ATOM 2115 CA ARG A 398 7.893 -9.754 33.019 1.00 61.26 C ATOM 2116 C ARG A 398 7.007 -9.300 34.175 1.00 62.57 C ATOM 2117 O ARG A 398 5.874 -9.767 34.319 1.00 60.98 O ATOM 2118 CB ARG A 398 8.842 -10.859 33.492 1.00 63.91 C ATOM 2119 CG ARG A 398 9.235 -11.863 32.407 1.00 70.84 C ATOM 2120 CD ARG A 398 10.118 -12.982 32.964 1.00 75.60 C ATOM 2121 NE ARG A 398 11.514 -12.574 33.132 1.00 78.22 N ATOM 2122 CZ ARG A 398 12.418 -12.553 32.154 1.00 80.40 C ATOM 2123 NH1 ARG A 398 12.082 -12.921 30.924 1.00 81.07 N ATOM 2124 NH2 ARG A 398 13.660 -12.157 32.404 1.00 78.00 N ATOM 2125 HE ARG A 398 11.821 -12.280 34.081 1.00 0.00 H ATOM 2126 HH12 ARG A 398 12.791 -12.903 30.164 1.00 0.00 H ATOM 2127 HH11 ARG A 398 11.109 -13.227 30.720 1.00 0.00 H ATOM 2128 HH22 ARG A 398 14.365 -12.141 31.639 1.00 0.00 H ATOM 2129 HH21 ARG A 398 13.928 -11.863 33.365 1.00 0.00 H ATOM 2130 H ARG A 398 9.684 -8.633 32.550 1.00 0.00 H ATOM 2131 N SER A 399 7.524 -8.382 34.990 1.00 63.25 N ATOM 2132 CA SER A 399 6.768 -7.870 36.131 1.00 65.84 C ATOM 2133 C SER A 399 5.681 -6.906 35.687 1.00 66.22 C ATOM 2134 O SER A 399 4.605 -6.862 36.281 1.00 65.24 O ATOM 2135 CB SER A 399 7.688 -7.155 37.128 1.00 66.92 C ATOM 2136 OG SER A 399 8.562 -8.064 37.771 1.00 73.84 O ATOM 2137 HG SER A 399 9.140 -7.571 38.406 1.00 0.00 H ATOM 2138 H SER A 399 8.484 -8.023 34.811 1.00 0.00 H ATOM 2139 N LEU A 400 5.965 -6.126 34.650 1.00 66.34 N ATOM 2140 CA LEU A 400 4.986 -5.173 34.153 1.00 66.59 C ATOM 2141 C LEU A 400 3.825 -5.913 33.499 1.00 66.30 C ATOM 2142 O LEU A 400 2.670 -5.744 33.888 1.00 64.07 O ATOM 2143 CB LEU A 400 5.624 -4.222 33.138 1.00 67.16 C ATOM 2144 CG LEU A 400 4.745 -3.021 32.778 1.00 69.82 C ATOM 2145 CD1 LEU A 400 4.694 -2.057 33.962 1.00 73.32 C ATOM 2146 CD2 LEU A 400 5.303 -2.316 31.558 1.00 74.78 C ATOM 2147 H LEU A 400 6.895 -6.198 34.190 1.00 0.00 H ATOM 2148 N SER A 401 4.138 -6.742 32.507 1.00 67.98 N ATOM 2149 CA SER A 401 3.107 -7.498 31.804 1.00 69.76 C ATOM 2150 C SER A 401 2.445 -8.485 32.753 1.00 70.63 C ATOM 2151 O SER A 401 1.475 -9.155 32.398 1.00 71.16 O ATOM 2152 CB SER A 401 3.711 -8.243 30.612 1.00 69.02 C ATOM 2153 OG SER A 401 4.699 -9.157 31.035 1.00 68.07 O ATOM 2154 HG SER A 401 5.421 -8.667 31.503 1.00 0.00 H ATOM 2155 H SER A 401 5.134 -6.853 32.228 1.00 0.00 H ATOM 2156 N PHE A 402 2.978 -8.563 33.969 1.00 71.77 N ATOM 2157 CA PHE A 402 2.450 -9.461 34.985 1.00 71.00 C ATOM 2158 C PHE A 402 1.021 -9.042 35.299 1.00 69.94 C ATOM 2159 O PHE A 402 0.211 -9.847 35.755 1.00 70.51 O ATOM 2160 CB PHE A 402 3.309 -9.382 36.253 1.00 76.36 C ATOM 2161 CG PHE A 402 3.497 -10.703 36.947 1.00 82.38 C ATOM 2162 CD1 PHE A 402 2.404 -11.414 37.437 1.00 86.74 C ATOM 2163 CD2 PHE A 402 4.774 -11.245 37.101 1.00 84.80 C ATOM 2164 CE1 PHE A 402 2.578 -12.651 38.072 1.00 91.02 C ATOM 2165 CE2 PHE A 402 4.961 -12.478 37.732 1.00 87.58 C ATOM 2166 CZ PHE A 402 3.862 -13.182 38.219 1.00 90.09 C ATOM 2167 H PHE A 402 3.796 -7.964 34.201 1.00 0.00 H ATOM 2168 N GLN A 403 0.719 -7.771 35.055 1.00 68.05 N ATOM 2169 CA GLN A 403 -0.615 -7.249 35.306 1.00 66.62 C ATOM 2170 C GLN A 403 -1.251 -6.671 34.036 1.00 64.42 C ATOM 2171 O GLN A 403 -0.881 -5.588 33.572 1.00 62.64 O ATOM 2172 CB GLN A 403 -0.565 -6.183 36.398 1.00 70.68 C ATOM 2173 CG GLN A 403 -1.937 -5.703 36.827 1.00 77.62 C ATOM 2174 CD GLN A 403 -1.917 -4.977 38.156 1.00 80.61 C ATOM 2175 OE1 GLN A 403 -2.943 -4.469 38.611 1.00 83.46 O ATOM 2176 NE2 GLN A 403 -0.751 -4.929 38.792 1.00 75.70 N ATOM 2177 HE22 GLN A 403 0.090 -5.372 38.370 1.00 0.00 H ATOM 2178 HE21 GLN A 403 -0.680 -4.448 39.712 1.00 0.00 H ATOM 2179 H GLN A 403 1.451 -7.137 34.677 1.00 0.00 H ATOM 2180 N PRO A 404 -2.232 -7.391 33.466 1.00 62.06 N ATOM 2181 CA PRO A 404 -2.940 -6.983 32.251 1.00 59.57 C ATOM 2182 C PRO A 404 -3.268 -5.489 32.189 1.00 57.58 C ATOM 2183 O PRO A 404 -3.337 -4.919 31.104 1.00 57.24 O ATOM 2184 CB PRO A 404 -4.192 -7.853 32.280 1.00 59.86 C ATOM 2185 CG PRO A 404 -3.689 -9.115 32.881 1.00 61.99 C ATOM 2186 CD PRO A 404 -2.845 -8.603 34.037 1.00 63.88 C ATOM 2187 N GLU A 405 -3.466 -4.860 33.344 1.00 55.34 N ATOM 2188 CA GLU A 405 -3.780 -3.436 33.378 1.00 55.54 C ATOM 2189 C GLU A 405 -2.714 -2.648 32.625 1.00 53.67 C ATOM 2190 O GLU A 405 -3.034 -1.744 31.860 1.00 53.54 O ATOM 2191 CB GLU A 405 -3.852 -2.915 34.820 1.00 59.57 C ATOM 2192 CG GLU A 405 -2.510 -2.911 35.545 1.00 69.56 C ATOM 2193 CD GLU A 405 -2.470 -1.962 36.732 1.00 78.19 C ATOM 2194 OE1 GLU A 405 -3.360 -2.047 37.604 1.00 83.68 O ATOM 2195 OE2 GLU A 405 -1.536 -1.133 36.796 1.00 81.70 O ATOM 2196 H GLU A 405 -3.396 -5.391 34.236 1.00 0.00 H ATOM 2197 N ASN A 406 -1.448 -2.995 32.857 1.00 53.30 N ATOM 2198 CA ASN A 406 -0.323 -2.326 32.203 1.00 51.62 C ATOM 2199 C ASN A 406 -0.059 -2.907 30.822 1.00 51.06 C ATOM 2200 O ASN A 406 0.264 -2.175 29.887 1.00 50.03 O ATOM 2201 CB ASN A 406 0.959 -2.462 33.034 1.00 53.89 C ATOM 2202 CG ASN A 406 0.800 -1.948 34.447 1.00 57.26 C ATOM 2203 OD1 ASN A 406 0.193 -0.900 34.674 1.00 59.49 O ATOM 2204 ND2 ASN A 406 1.357 -2.678 35.409 1.00 62.49 N ATOM 2205 HD22 ASN A 406 1.860 -3.556 35.170 1.00 0.00 H ATOM 2206 HD21 ASN A 406 1.290 -2.370 36.400 1.00 0.00 H ATOM 2207 H ASN A 406 -1.253 -3.767 33.526 1.00 0.00 H ATOM 2208 N SER A 407 -0.182 -4.228 30.709 1.00 50.12 N ATOM 2209 CA SER A 407 0.050 -4.925 29.454 1.00 50.01 C ATOM 2210 C SER A 407 -0.945 -4.416 28.408 1.00 50.46 C ATOM 2211 O SER A 407 -0.635 -4.300 27.225 1.00 52.17 O ATOM 2212 CB SER A 407 -0.111 -6.430 29.683 1.00 49.68 C ATOM 2213 OG SER A 407 0.313 -7.176 28.559 1.00 62.70 O ATOM 2214 HG SER A 407 0.195 -8.142 28.742 1.00 0.00 H ATOM 2215 H SER A 407 -0.453 -4.780 31.547 1.00 0.00 H ATOM 2216 N MET A 408 -2.142 -4.098 28.876 1.00 49.76 N ATOM 2217 CA MET A 408 -3.211 -3.577 28.043 1.00 49.19 C ATOM 2218 C MET A 408 -2.860 -2.181 27.501 1.00 47.25 C ATOM 2219 O MET A 408 -3.394 -1.759 26.473 1.00 46.87 O ATOM 2220 CB MET A 408 -4.501 -3.552 28.888 1.00 51.39 C ATOM 2221 CG MET A 408 -5.641 -2.677 28.422 1.00 52.83 C ATOM 2222 SD MET A 408 -7.047 -2.830 29.581 1.00 57.88 S ATOM 2223 CE MET A 408 -6.707 -1.465 30.702 1.00 54.50 C ATOM 2224 H MET A 408 -2.326 -4.228 29.891 1.00 0.00 H ATOM 2225 N LYS A 409 -1.949 -1.482 28.177 1.00 46.19 N ATOM 2226 CA LYS A 409 -1.534 -0.122 27.770 1.00 45.78 C ATOM 2227 C LYS A 409 -0.444 -0.074 26.690 1.00 44.35 C ATOM 2228 O LYS A 409 -0.070 1.008 26.217 1.00 42.28 O ATOM 2229 CB LYS A 409 -1.029 0.656 28.990 1.00 49.38 C ATOM 2230 CG LYS A 409 -2.099 1.146 29.960 1.00 51.54 C ATOM 2231 CD LYS A 409 -2.642 2.496 29.517 1.00 62.62 C ATOM 2232 CE LYS A 409 -3.434 3.187 30.624 1.00 69.66 C ATOM 2233 NZ LYS A 409 -3.831 4.578 30.237 1.00 68.61 N ATOM 2234 HZ1 LYS A 409 -2.977 5.140 30.045 1.00 0.00 H ATOM 2235 HZ2 LYS A 409 -4.424 4.543 29.383 1.00 0.00 H ATOM 2236 HZ3 LYS A 409 -4.367 5.013 31.015 1.00 0.00 H ATOM 2237 H LYS A 409 -1.514 -1.908 29.021 1.00 0.00 H ATOM 2238 N LEU A 410 0.071 -1.238 26.306 1.00 44.45 N ATOM 2239 CA LEU A 410 1.130 -1.312 25.299 1.00 44.75 C ATOM 2240 C LEU A 410 0.517 -1.313 23.902 1.00 47.19 C ATOM 2241 O LEU A 410 -0.667 -0.994 23.737 1.00 47.86 O ATOM 2242 CB LEU A 410 1.962 -2.586 25.517 1.00 45.30 C ATOM 2243 CG LEU A 410 2.432 -2.799 26.973 1.00 47.80 C ATOM 2244 CD1 LEU A 410 3.172 -4.115 27.129 1.00 41.85 C ATOM 2245 CD2 LEU A 410 3.331 -1.651 27.391 1.00 43.60 C ATOM 2246 H LEU A 410 -0.287 -2.117 26.731 1.00 0.00 H ATOM 2247 N THR A 411 1.317 -1.655 22.894 1.00 45.48 N ATOM 2248 CA THR A 411 0.811 -1.709 21.530 1.00 44.30 C ATOM 2249 C THR A 411 0.914 -3.161 21.077 1.00 42.63 C ATOM 2250 O THR A 411 1.566 -3.970 21.725 1.00 42.47 O ATOM 2251 CB THR A 411 1.629 -0.829 20.556 1.00 41.86 C ATOM 2252 OG1 THR A 411 2.889 -1.455 20.294 1.00 46.28 O ATOM 2253 CG2 THR A 411 1.860 0.567 21.147 1.00 41.92 C ATOM 2254 HG1 THR A 411 3.413 -0.892 19.671 1.00 0.00 H ATOM 2255 H THR A 411 2.313 -1.886 23.083 1.00 0.00 H ATOM 2256 N PRO A 412 0.245 -3.514 19.973 1.00 41.45 N ATOM 2257 CA PRO A 412 0.299 -4.893 19.474 1.00 42.62 C ATOM 2258 C PRO A 412 1.715 -5.353 19.091 1.00 42.21 C ATOM 2259 O PRO A 412 2.117 -6.479 19.412 1.00 43.95 O ATOM 2260 CB PRO A 412 -0.654 -4.860 18.280 1.00 37.55 C ATOM 2261 CG PRO A 412 -1.672 -3.837 18.705 1.00 42.63 C ATOM 2262 CD PRO A 412 -0.806 -2.746 19.283 1.00 37.41 C ATOM 2263 N LEU A 413 2.474 -4.493 18.417 1.00 39.84 N ATOM 2264 CA LEU A 413 3.833 -4.859 18.012 1.00 39.66 C ATOM 2265 C LEU A 413 4.763 -5.053 19.210 1.00 39.49 C ATOM 2266 O LEU A 413 5.587 -5.971 19.217 1.00 38.46 O ATOM 2267 CB LEU A 413 4.419 -3.807 17.047 1.00 36.95 C ATOM 2268 CG LEU A 413 5.866 -4.004 16.550 1.00 38.90 C ATOM 2269 CD1 LEU A 413 6.016 -5.314 15.781 1.00 35.94 C ATOM 2270 CD2 LEU A 413 6.249 -2.837 15.648 1.00 35.68 C ATOM 2271 H LEU A 413 2.099 -3.553 18.176 1.00 0.00 H ATOM 2272 N VAL A 414 4.648 -4.183 20.213 1.00 40.09 N ATOM 2273 CA VAL A 414 5.477 -4.288 21.409 1.00 39.92 C ATOM 2274 C VAL A 414 5.182 -5.630 22.091 1.00 41.30 C ATOM 2275 O VAL A 414 6.104 -6.361 22.458 1.00 43.28 O ATOM 2276 CB VAL A 414 5.201 -3.099 22.386 1.00 44.77 C ATOM 2277 CG1 VAL A 414 5.728 -3.418 23.783 1.00 40.54 C ATOM 2278 CG2 VAL A 414 5.886 -1.813 21.853 1.00 34.44 C ATOM 2279 H VAL A 414 3.953 -3.413 20.142 1.00 0.00 H ATOM 2280 N LEU A 415 3.900 -5.960 22.245 1.00 40.86 N ATOM 2281 CA LEU A 415 3.508 -7.230 22.867 1.00 41.27 C ATOM 2282 C LEU A 415 4.050 -8.428 22.108 1.00 43.27 C ATOM 2283 O LEU A 415 4.468 -9.424 22.707 1.00 43.28 O ATOM 2284 CB LEU A 415 1.984 -7.351 22.939 1.00 41.24 C ATOM 2285 CG LEU A 415 1.289 -6.492 23.993 1.00 47.74 C ATOM 2286 CD1 LEU A 415 -0.227 -6.593 23.825 1.00 47.74 C ATOM 2287 CD2 LEU A 415 1.730 -6.952 25.387 1.00 44.13 C ATOM 2288 H LEU A 415 3.162 -5.304 21.918 1.00 0.00 H ATOM 2289 N GLU A 416 4.041 -8.335 20.784 1.00 44.49 N ATOM 2290 CA GLU A 416 4.527 -9.427 19.957 1.00 47.87 C ATOM 2291 C GLU A 416 6.049 -9.566 20.027 1.00 48.23 C ATOM 2292 O GLU A 416 6.569 -10.666 20.195 1.00 48.81 O ATOM 2293 CB GLU A 416 4.084 -9.222 18.500 1.00 48.65 C ATOM 2294 CG GLU A 416 4.182 -10.485 17.642 1.00 51.43 C ATOM 2295 CD GLU A 416 3.861 -10.237 16.171 1.00 53.07 C ATOM 2296 OE1 GLU A 416 4.725 -9.691 15.453 1.00 50.08 O ATOM 2297 OE2 GLU A 416 2.742 -10.584 15.736 1.00 51.84 O ATOM 2298 H GLU A 416 3.682 -7.470 20.333 1.00 0.00 H ATOM 2299 N VAL A 417 6.763 -8.451 19.918 1.00 48.09 N ATOM 2300 CA VAL A 417 8.226 -8.482 19.947 1.00 48.80 C ATOM 2301 C VAL A 417 8.858 -8.796 21.309 1.00 50.33 C ATOM 2302 O VAL A 417 9.764 -9.620 21.385 1.00 50.42 O ATOM 2303 CB VAL A 417 8.815 -7.157 19.411 1.00 43.79 C ATOM 2304 CG1 VAL A 417 10.331 -7.164 19.543 1.00 49.17 C ATOM 2305 CG2 VAL A 417 8.432 -6.979 17.953 1.00 42.96 C ATOM 2306 H VAL A 417 6.274 -7.540 19.810 1.00 0.00 H ATOM 2307 N PHE A 418 8.392 -8.140 22.372 1.00 52.71 N ATOM 2308 CA PHE A 418 8.933 -8.370 23.713 1.00 55.20 C ATOM 2309 C PHE A 418 8.302 -9.585 24.404 1.00 58.35 C ATOM 2310 O PHE A 418 8.881 -10.144 25.329 1.00 58.10 O ATOM 2311 CB PHE A 418 8.729 -7.131 24.594 1.00 50.30 C ATOM 2312 CG PHE A 418 9.479 -5.911 24.126 1.00 45.47 C ATOM 2313 CD1 PHE A 418 9.050 -4.641 24.498 1.00 41.69 C ATOM 2314 CD2 PHE A 418 10.617 -6.028 23.335 1.00 42.54 C ATOM 2315 CE1 PHE A 418 9.747 -3.496 24.087 1.00 39.81 C ATOM 2316 CE2 PHE A 418 11.324 -4.896 22.919 1.00 42.09 C ATOM 2317 CZ PHE A 418 10.886 -3.623 23.295 1.00 42.31 C ATOM 2318 H PHE A 418 7.626 -7.448 22.246 1.00 0.00 H ATOM 2319 N GLY A 419 7.116 -9.988 23.960 1.00 62.78 N ATOM 2320 CA GLY A 419 6.457 -11.133 24.569 1.00 68.81 C ATOM 2321 C GLY A 419 4.967 -10.923 24.783 1.00 73.72 C ATOM 2322 O GLY A 419 4.535 -9.848 25.218 1.00 74.02 O ATOM 2323 H GLY A 419 6.658 -9.483 23.175 1.00 0.00 H ATOM 2324 N ASN A 420 4.179 -11.951 24.472 1.00 77.21 N ATOM 2325 CA ASN A 420 2.723 -11.891 24.620 1.00 80.19 C ATOM 2326 C ASN A 420 2.210 -13.029 25.504 1.00 81.45 C ATOM 2327 O ASN A 420 1.563 -13.959 24.971 1.00 81.59 O ATOM 2328 CB ASN A 420 2.048 -11.954 23.242 1.00 82.28 C ATOM 2329 CG ASN A 420 0.528 -11.914 23.328 1.00 89.27 C ATOM 2330 OD1 ASN A 420 -0.057 -10.936 23.803 1.00 89.10 O ATOM 2331 ND2 ASN A 420 -0.120 -12.982 22.867 1.00 91.02 N ATOM 2332 HD22 ASN A 420 0.413 -13.784 22.475 1.00 0.00 H ATOM 2333 HD21 ASN A 420 -1.159 -13.014 22.899 1.00 0.00 H ATOM 2334 H ASN A 420 4.612 -12.825 24.112 1.00 0.00 H TER 2335 ASN A 420 HETATM 2336 O HOH 1 20.817 7.053 15.838 1.00 39.24 O HETATM 2337 O HOH 2 18.374 1.573 13.727 1.00 37.02 O HETATM 2338 O HOH 3 1.612 -2.077 17.042 1.00 34.84 O HETATM 2339 O HOH 4 2.916 12.699 21.490 1.00 42.04 O HETATM 2340 O HOH 5 18.187 3.766 11.910 1.00 40.09 O HETATM 2341 O HOH 6 27.186 -8.967 28.614 1.00 43.37 O HETATM 2342 O HOH 7 26.857 6.538 18.586 1.00 45.37 O HETATM 2343 O HOH 8 25.317 -2.532 30.949 1.00 47.33 O HETATM 2344 O HOH 9 -0.566 3.299 20.258 1.00 42.74 O HETATM 2345 O HOH 10 14.449 -6.616 22.034 1.00 41.07 O HETATM 2346 O HOH 11 3.716 0.492 16.151 1.00 41.51 O HETATM 2347 O HOH 12 33.609 5.160 4.048 1.00 63.82 O HETATM 2348 O HOH 13 21.693 9.332 2.580 1.00 56.96 O HETATM 2349 O HOH 14 11.453 4.681 7.163 1.00 50.95 O HETATM 2350 O HOH 15 13.575 7.022 14.353 1.00 40.10 O HETATM 2351 O HOH 16 12.371 8.281 12.015 1.00 42.80 O HETATM 2352 O HOH 17 -0.523 13.402 20.434 1.00 62.25 O HETATM 2353 O HOH 18 7.861 2.708 9.776 1.00 46.45 O HETATM 2354 O HOH 19 10.751 -2.207 4.896 1.00 54.07 O HETATM 2355 O HOH 20 18.858 -18.094 8.600 1.00 61.95 O HETATM 2356 O HOH 21 12.314 -19.712 7.890 1.00 55.03 O HETATM 2357 O HOH 22 18.077 12.104 33.138 1.00 48.75 O HETATM 2358 O HOH 23 18.316 15.649 19.570 1.00 70.16 O HETATM 2359 O HOH 24 36.603 7.497 20.569 1.00 46.84 O HETATM 2360 O HOH 25 29.456 7.999 19.998 1.00 49.52 O HETATM 2361 O HOH 26 28.853 10.480 19.386 1.00 46.12 O HETATM 2362 O HOH 27 17.175 -14.970 22.017 1.00 57.03 O HETATM 2363 O HOH 28 43.322 3.854 13.718 1.00 63.52 O HETATM 2364 O HOH 29 27.374 -3.900 32.213 1.00 57.06 O HETATM 2365 O HOH 30 23.337 -12.478 25.655 1.00 55.84 O HETATM 2366 O HOH 31 20.266 -11.780 23.870 1.00 43.48 O HETATM 2367 O HOH 32 21.401 -13.867 24.509 1.00 45.21 O HETATM 2368 O HOH 33 24.645 -6.664 21.872 1.00 48.84 O HETATM 2369 O HOH 34 25.441 -8.241 20.033 1.00 53.45 O HETATM 2370 O HOH 35 14.887 -8.406 24.195 1.00 42.97 O HETATM 2371 O HOH 36 15.235 -11.149 23.796 1.00 53.15 O HETATM 2372 O HOH 37 9.101 -1.600 9.658 1.00 56.07 O HETATM 2373 O HOH 38 9.485 -2.865 7.351 1.00 44.21 O HETATM 2374 C29 TKA A 39 9.772 -1.062 27.809 1.00 0.01 C HETATM 2375 C30 TKA A 39 8.792 -2.297 27.599 1.00 -0.04 C HETATM 2376 C31 TKA A 39 7.301 -1.788 27.379 1.00 -0.04 C HETATM 2377 C32 TKA A 39 6.840 -1.003 28.670 1.00 -0.05 C HETATM 2378 C33 TKA A 39 7.788 0.266 28.913 1.00 -0.04 C HETATM 2379 C34 TKA A 39 9.276 -0.235 29.137 1.00 -0.04 C HETATM 2380 H TKA A 39 9.935 0.630 29.299 1.00 0.03 H HETATM 2381 H TKA A 39 9.314 -0.894 30.017 1.00 0.03 H HETATM 2382 C38 TKA A 39 7.729 1.226 27.638 1.00 -0.05 C HETATM 2383 C35 TKA A 39 8.190 0.420 26.330 1.00 -0.04 C HETATM 2384 C37 TKA A 39 9.670 -0.105 26.528 1.00 -0.04 C HETATM 2385 H TKA A 39 9.975 -0.667 25.633 1.00 0.03 H HETATM 2386 H TKA A 39 10.341 0.755 26.667 1.00 0.03 H HETATM 2387 C36 TKA A 39 7.227 -0.833 26.103 1.00 -0.05 C HETATM 2388 H TKA A 39 6.194 -0.483 25.965 1.00 0.03 H HETATM 2389 H TKA A 39 7.549 -1.387 25.209 1.00 0.03 H HETATM 2390 H TKA A 39 8.146 1.084 25.454 1.00 0.03 H HETATM 2391 H TKA A 39 8.401 2.083 27.795 1.00 0.03 H HETATM 2392 H TKA A 39 6.699 1.587 27.500 1.00 0.03 H HETATM 2393 H TKA A 39 7.447 0.816 29.802 1.00 0.03 H HETATM 2394 H TKA A 39 6.897 -1.671 29.542 1.00 0.03 H HETATM 2395 H TKA A 39 5.803 -0.662 28.537 1.00 0.03 H HETATM 2396 H TKA A 39 6.639 -2.652 27.221 1.00 0.03 H HETATM 2397 H TKA A 39 8.827 -2.943 28.488 1.00 0.03 H HETATM 2398 H TKA A 39 9.114 -2.870 26.717 1.00 0.03 H HETATM 2399 C25 TKA A 39 11.189 -1.695 27.948 1.00 0.12 C HETATM 2400 C24 TKA A 39 12.183 -0.662 28.147 1.00 -0.07 C HETATM 2401 C23 TKA A 39 12.931 0.240 28.290 1.00 -0.10 C HETATM 2402 C22 TKA A 39 13.761 1.400 28.443 1.00 0.01 C HETATM 2403 C20 TKA A 39 13.041 2.541 27.680 1.00 -0.03 C HETATM 2404 C21 TKA A 39 11.908 3.098 28.624 1.00 -0.06 C HETATM 2405 H TKA A 39 11.373 3.913 28.114 1.00 0.02 H HETATM 2406 H TKA A 39 12.359 3.480 29.552 1.00 0.02 H HETATM 2407 H TKA A 39 11.201 2.290 28.865 1.00 0.02 H HETATM 2408 C17 TKA A 39 14.131 3.606 27.242 1.00 -0.03 C HETATM 2409 C13 TKA A 39 13.665 4.833 26.398 1.00 -0.02 C HETATM 2410 C14 TKA A 39 15.109 5.382 26.048 1.00 -0.01 C HETATM 2411 C15 TKA A 39 15.842 4.132 25.482 1.00 -0.04 C HETATM 2412 C16 TKA A 39 15.309 3.008 26.361 1.00 -0.05 C HETATM 2413 H TKA A 39 14.929 2.189 25.733 1.00 0.03 H HETATM 2414 H TKA A 39 16.110 2.629 27.013 1.00 0.03 H HETATM 2415 H TKA A 39 16.933 4.232 25.583 1.00 0.03 H HETATM 2416 H TKA A 39 15.585 3.966 24.425 1.00 0.03 H HETATM 2417 C08 TKA A 39 14.879 6.610 25.095 1.00 -0.07 C HETATM 2418 C09 TKA A 39 14.200 7.759 25.904 1.00 -0.02 C HETATM 2419 C11 TKA A 39 12.786 7.287 26.345 1.00 -0.04 C HETATM 2420 C12 TKA A 39 12.904 5.972 27.212 1.00 -0.04 C HETATM 2421 H TKA A 39 13.464 6.194 28.133 1.00 0.03 H HETATM 2422 H TKA A 39 11.895 5.619 27.472 1.00 0.03 H HETATM 2423 H TKA A 39 12.308 8.077 26.943 1.00 0.03 H HETATM 2424 H TKA A 39 12.175 7.082 25.453 1.00 0.03 H HETATM 2425 H TKA A 39 14.805 7.995 26.792 1.00 0.04 H HETATM 2426 H TKA A 39 14.111 8.655 25.272 1.00 0.04 H HETATM 2427 C07 TKA A 39 15.200 6.625 23.793 1.00 -0.11 C HETATM 2428 C06 TKA A 39 14.996 7.719 22.859 1.00 -0.11 C HETATM 2429 C05 TKA A 39 14.680 7.657 21.577 1.00 -0.07 C HETATM 2430 C04 TKA A 39 14.542 8.994 20.817 1.00 0.01 C HETATM 2431 C03 TKA A 39 15.168 8.961 19.386 1.00 0.10 C HETATM 2432 C02 TKA A 39 14.677 7.729 18.570 1.00 -0.01 C HETATM 2433 C01 TKA A 39 15.044 6.400 19.252 1.00 0.10 C HETATM 2434 C10 TKA A 39 14.438 6.389 20.703 1.00 0.01 C HETATM 2435 H TKA A 39 13.351 6.253 20.608 1.00 0.05 H HETATM 2436 H TKA A 39 14.870 5.530 21.237 1.00 0.05 H HETATM 2437 O01 TKA A 39 14.482 5.310 18.463 1.00 -0.37 O HETATM 2438 H TKA A 39 13.539 5.414 18.408 1.00 0.21 H HETATM 2439 H TKA A 39 16.137 6.294 19.307 1.00 0.08 H HETATM 2440 C28 TKA A 39 13.955 7.799 17.412 1.00 -0.12 C HETATM 2441 H TKA A 39 13.723 8.768 16.972 1.00 0.01 H HETATM 2442 H TKA A 39 13.611 6.886 16.929 1.00 0.01 H HETATM 2443 O02 TKA A 39 16.611 8.894 19.486 1.00 -0.37 O HETATM 2444 H TKA A 39 16.989 8.908 18.614 1.00 0.21 H HETATM 2445 H TKA A 39 14.881 9.880 18.854 1.00 0.08 H HETATM 2446 H TKA A 39 15.045 9.780 21.400 1.00 0.05 H HETATM 2447 H TKA A 39 13.473 9.234 20.724 1.00 0.05 H HETATM 2448 H TKA A 39 15.120 8.720 23.268 1.00 0.02 H HETATM 2449 H TKA A 39 15.662 5.723 23.394 1.00 0.02 H HETATM 2450 H TKA A 39 15.639 5.731 26.947 1.00 0.05 H HETATM 2451 C18 TKA A 39 12.746 4.361 25.145 1.00 -0.06 C HETATM 2452 H TKA A 39 13.270 3.575 24.582 1.00 0.02 H HETATM 2453 H TKA A 39 12.557 5.220 24.485 1.00 0.02 H HETATM 2454 H TKA A 39 11.789 3.968 25.519 1.00 0.02 H HETATM 2455 H TKA A 39 14.558 3.990 28.180 1.00 0.03 H HETATM 2456 H TKA A 39 12.568 2.140 26.771 1.00 0.03 H HETATM 2457 H TKA A 39 14.756 1.218 28.010 1.00 0.04 H HETATM 2458 H TKA A 39 13.866 1.658 29.507 1.00 0.04 H HETATM 2459 O03 TKA A 39 11.248 -2.581 29.077 1.00 -0.38 O HETATM 2460 H TKA A 39 12.116 -2.963 29.133 1.00 0.21 H HETATM 2461 H TKA A 39 11.420 -2.256 27.031 1.00 0.07 H CONECT 1 2 13 14 15 CONECT 13 1 CONECT 14 1 CONECT 15 1 CONECT 382 383 389 390 391 CONECT 389 382 CONECT 390 382 CONECT 391 382 CONECT 2374 2375 2379 2384 2399 CONECT 2375 2374 2376 2397 2398 CONECT 2376 2375 2377 2387 2396 CONECT 2377 2376 2378 2394 2395 CONECT 2378 2377 2379 2382 2393 CONECT 2379 2374 2378 2380 2381 CONECT 2380 2379 CONECT 2381 2379 CONECT 2382 2378 2383 2391 2392 CONECT 2383 2382 2384 2387 2390 CONECT 2384 2374 2383 2385 2386 CONECT 2385 2384 CONECT 2386 2384 CONECT 2387 2376 2383 2388 2389 CONECT 2388 2387 CONECT 2389 2387 CONECT 2390 2383 CONECT 2391 2382 CONECT 2392 2382 CONECT 2393 2378 CONECT 2394 2377 CONECT 2395 2377 CONECT 2396 2376 CONECT 2397 2375 CONECT 2398 2375 CONECT 2399 2374 2400 2459 2461 CONECT 2400 2399 2401 CONECT 2401 2400 2402 CONECT 2402 2401 2403 2457 2458 CONECT 2403 2402 2404 2408 2456 CONECT 2404 2403 2405 2406 2407 CONECT 2405 2404 CONECT 2406 2404 CONECT 2407 2404 CONECT 2408 2403 2409 2412 2455 CONECT 2409 2408 2410 2420 2451 CONECT 2410 2409 2411 2417 2450 CONECT 2411 2410 2412 2415 2416 CONECT 2412 2408 2411 2413 2414 CONECT 2413 2412 CONECT 2414 2412 CONECT 2415 2411 CONECT 2416 2411 CONECT 2417 2410 2418 2427 CONECT 2418 2417 2419 2425 2426 CONECT 2419 2418 2420 2423 2424 CONECT 2420 2409 2419 2421 2422 CONECT 2421 2420 CONECT 2422 2420 CONECT 2423 2419 CONECT 2424 2419 CONECT 2425 2418 CONECT 2426 2418 CONECT 2427 2417 2428 2449 CONECT 2428 2427 2429 2448 CONECT 2429 2428 2430 2434 CONECT 2430 2429 2431 2446 2447 CONECT 2431 2430 2432 2443 2445 CONECT 2432 2431 2433 2440 CONECT 2433 2432 2434 2437 2439 CONECT 2434 2429 2433 2435 2436 CONECT 2435 2434 CONECT 2436 2434 CONECT 2437 2433 2438 CONECT 2438 2437 CONECT 2439 2433 CONECT 2440 2432 2441 2442 CONECT 2441 2440 CONECT 2442 2440 CONECT 2443 2431 2444 CONECT 2444 2443 CONECT 2445 2431 CONECT 2446 2430 CONECT 2447 2430 CONECT 2448 2428 CONECT 2449 2427 CONECT 2450 2410 CONECT 2451 2409 2452 2453 2454 CONECT 2452 2451 CONECT 2453 2451 CONECT 2454 2451 CONECT 2455 2408 CONECT 2456 2403 CONECT 2457 2402 CONECT 2458 2402 CONECT 2459 2399 2460 CONECT 2460 2459 CONECT 2461 2399 MASTER 0 0 0 0 0 0 0 0 2459 2 96 19 END
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Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
3vtb
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
rat vitamin D receptor
Ligand Name
TKA
EC.Number
E.C.-.-.-.-
Resolution
2(Å)
Affinity (Kd/Ki/IC50)
IC50=0.5nM
Release Year
2013
Protein/NA Sequence
Check fasta file
Primary Reference
(2014) J. Med. Chem. Vol. 57, pp: 4073-4087
Ligand Properties
Formula
C
3
5
H
5
0
O
3
Molecular Weight
518.770
Exact Mass
518.376
No. of atoms
88
No. of bonds
93
Polar Surface Area
60.69
LOGP Value
6.40 (
Computed with XLOGP3
)
6.73 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 3
No. of Hydrogen Bond Acceptors: 3
No. of Rotatable Bonds: 8
No. of Nitrogen and Oxygen Atoms: 3
No. of Rings: 6
Canonical SMILES
C[C@@H]([C@H]1CC[C@@H]2[C@]1(C)CCC/C/2=C\C=C\1/C[C@@H](O)C(=C)[C@@H](C1)O)CC#C[C@H]([C@]12C[C@H]3C[C@@H](C2)C[C@@H](C1)C3)O
InChI String
InChI=1S/C35H50O3/c1-22(6-4-8-33(38)35-19-25-14-26(20-35)16-27(15-25)21-35)29-11-12-30-28(7-5-13-34(29,30)3)10-9-24-17-31(36)23(2)32(37)18-24/h9-10,22,25-27,29-33,36-38H,2,5-7,11-21H2,1,3H3/b28-10+/t22-,25-,26+,27-,29-,30+,31-,32-,33-,34-,35-/m1/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
P13053
Entrez Gene ID
NCBI Entrez Gene ID:
24873
ASD
Information of known allosteric effects of PDB entries
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