EXPDTA UNI-EID_bnmx_TS3-scwrl MODEL 1 REMARK 44 REMARK 44 model 1 is called UNI-EID_bnmx_TS3-scwrl ATOM 1 N SER A 1 10.186 10.671 -13.922 1.00 0.00 ATOM 2 CA SER A 1 9.531 9.747 -14.833 1.00 0.00 ATOM 3 CB SER A 1 10.521 9.238 -15.883 1.00 0.00 ATOM 4 OG SER A 1 9.914 8.280 -16.733 1.00 0.00 ATOM 5 O SER A 1 9.596 8.092 -13.095 1.00 0.00 ATOM 6 C SER A 1 8.980 8.549 -14.057 1.00 0.00 ATOM 7 N MET A 2 7.827 8.076 -14.504 1.00 0.00 ATOM 8 CA MET A 2 7.186 6.940 -13.863 1.00 0.00 ATOM 9 CB MET A 2 5.750 6.781 -14.367 1.00 0.00 ATOM 10 CG MET A 2 4.798 7.860 -13.878 1.00 0.00 ATOM 11 SD MET A 2 3.171 7.754 -14.650 1.00 0.00 ATOM 12 CE MET A 2 3.552 8.288 -16.316 1.00 0.00 ATOM 13 O MET A 2 8.909 5.676 -14.957 1.00 0.00 ATOM 14 C MET A 2 7.960 5.658 -14.175 1.00 0.00 ATOM 15 N SER A 3 7.527 4.575 -13.547 1.00 0.00 ATOM 16 CA SER A 3 8.167 3.286 -13.748 1.00 0.00 ATOM 17 CB SER A 3 8.896 2.845 -12.477 1.00 0.00 ATOM 18 OG SER A 3 9.952 3.735 -12.160 1.00 0.00 ATOM 19 O SER A 3 6.404 2.350 -15.081 1.00 0.00 ATOM 20 C SER A 3 7.138 2.211 -14.104 1.00 0.00 ATOM 21 N GLU A 4 7.118 1.165 -13.292 1.00 0.00 ATOM 22 CA GLU A 4 6.191 0.067 -13.509 1.00 0.00 ATOM 23 CB GLU A 4 6.953 -1.241 -13.735 1.00 0.00 ATOM 24 CG GLU A 4 7.799 -1.256 -14.997 1.00 0.00 ATOM 25 CD GLU A 4 8.498 -2.584 -15.214 1.00 0.00 ATOM 26 OE1 GLU A 4 8.355 -3.478 -14.353 1.00 0.00 ATOM 27 OE2 GLU A 4 9.189 -2.730 -16.244 1.00 0.00 ATOM 28 O GLU A 4 5.633 0.228 -11.179 1.00 0.00 ATOM 29 C GLU A 4 5.270 -0.120 -12.302 1.00 0.00 ATOM 30 N THR A 5 4.094 -0.668 -12.573 1.00 0.00 ATOM 31 CA THR A 5 3.119 -0.905 -11.523 1.00 0.00 ATOM 32 CB THR A 5 1.711 -0.446 -11.946 1.00 0.00 ATOM 33 CG2 THR A 5 1.715 1.035 -12.291 1.00 0.00 ATOM 34 OG1 THR A 5 1.289 -1.189 -13.096 1.00 0.00 ATOM 35 O THR A 5 3.390 -3.230 -12.058 1.00 0.00 ATOM 36 C THR A 5 3.069 -2.401 -11.208 1.00 0.00 ATOM 37 N PHE A 6 2.664 -2.702 -9.982 1.00 0.00 ATOM 38 CA PHE A 6 2.569 -4.084 -9.544 1.00 0.00 ATOM 39 CB PHE A 6 3.789 -4.464 -8.702 1.00 0.00 ATOM 40 CG PHE A 6 5.092 -4.362 -9.442 1.00 0.00 ATOM 41 CD1 PHE A 6 5.843 -3.201 -9.391 1.00 0.00 ATOM 42 CD2 PHE A 6 5.566 -5.426 -10.188 1.00 0.00 ATOM 43 CE1 PHE A 6 7.042 -3.106 -10.072 1.00 0.00 ATOM 44 CE2 PHE A 6 6.765 -5.332 -10.869 1.00 0.00 ATOM 45 CZ PHE A 6 7.503 -4.178 -10.813 1.00 0.00 ATOM 46 O PHE A 6 0.971 -3.468 -7.861 1.00 0.00 ATOM 47 C PHE A 6 1.315 -4.304 -8.695 1.00 0.00 ATOM 48 N ASP A 7 0.667 -5.434 -8.936 1.00 0.00 ATOM 49 CA ASP A 7 -0.541 -5.775 -8.204 1.00 0.00 ATOM 50 CB ASP A 7 -1.392 -6.762 -9.005 1.00 0.00 ATOM 51 CG ASP A 7 -2.057 -6.118 -10.205 1.00 0.00 ATOM 52 OD1 ASP A 7 -2.066 -4.871 -10.282 1.00 0.00 ATOM 53 OD2 ASP A 7 -2.569 -6.860 -11.070 1.00 0.00 ATOM 54 O ASP A 7 0.937 -6.875 -6.665 1.00 0.00 ATOM 55 C ASP A 7 -0.188 -6.418 -6.861 1.00 0.00 ATOM 56 N VAL A 8 -1.170 -6.433 -5.972 1.00 0.00 ATOM 57 CA VAL A 8 -0.976 -7.012 -4.654 1.00 0.00 ATOM 58 CB VAL A 8 -0.693 -5.928 -3.597 1.00 0.00 ATOM 59 CG1 VAL A 8 -0.504 -6.558 -2.226 1.00 0.00 ATOM 60 CG2 VAL A 8 0.569 -5.156 -3.950 1.00 0.00 ATOM 61 O VAL A 8 -3.283 -7.167 -4.004 1.00 0.00 ATOM 62 C VAL A 8 -2.240 -7.773 -4.245 1.00 0.00 ATOM 63 N GLU A 9 -2.105 -9.089 -4.180 1.00 0.00 ATOM 64 CA GLU A 9 -3.222 -9.939 -3.806 1.00 0.00 ATOM 65 CB GLU A 9 -3.337 -11.126 -4.765 1.00 0.00 ATOM 66 CG GLU A 9 -4.508 -12.049 -4.472 1.00 0.00 ATOM 67 CD GLU A 9 -4.642 -13.161 -5.493 1.00 0.00 ATOM 68 OE1 GLU A 9 -3.812 -13.216 -6.425 1.00 0.00 ATOM 69 OE2 GLU A 9 -5.578 -13.978 -5.363 1.00 0.00 ATOM 70 O GLU A 9 -2.133 -11.286 -2.144 1.00 0.00 ATOM 71 C GLU A 9 -3.027 -10.477 -2.387 1.00 0.00 ATOM 72 N LEU A 10 -3.879 -10.007 -1.487 1.00 0.00 ATOM 73 CA LEU A 10 -3.811 -10.432 -0.099 1.00 0.00 ATOM 74 CB LEU A 10 -3.420 -9.259 0.802 1.00 0.00 ATOM 75 CG LEU A 10 -2.062 -8.613 0.524 1.00 0.00 ATOM 76 CD1 LEU A 10 -1.889 -7.346 1.348 1.00 0.00 ATOM 77 CD2 LEU A 10 -0.931 -9.567 0.876 1.00 0.00 ATOM 78 O LEU A 10 -6.161 -10.826 -0.394 1.00 0.00 ATOM 79 C LEU A 10 -5.179 -10.961 0.335 1.00 0.00 ATOM 80 N THR A 11 -5.201 -11.552 1.521 1.00 0.00 ATOM 81 CA THR A 11 -6.432 -12.102 2.061 1.00 0.00 ATOM 82 CB THR A 11 -6.287 -13.601 2.382 1.00 0.00 ATOM 83 CG2 THR A 11 -7.586 -14.152 2.950 1.00 0.00 ATOM 84 OG1 THR A 11 -5.962 -14.320 1.186 1.00 0.00 ATOM 85 O THR A 11 -6.100 -11.455 4.349 1.00 0.00 ATOM 86 C THR A 11 -6.816 -11.377 3.352 1.00 0.00 ATOM 87 N LYS A 12 -7.946 -10.687 3.293 1.00 0.00 ATOM 88 CA LYS A 12 -8.434 -9.949 4.445 1.00 0.00 ATOM 89 CB LYS A 12 -9.937 -9.694 4.320 1.00 0.00 ATOM 90 CG LYS A 12 -10.509 -8.805 5.413 1.00 0.00 ATOM 91 CD LYS A 12 -11.966 -8.466 5.143 1.00 0.00 ATOM 92 CE LYS A 12 -12.518 -7.524 6.200 1.00 0.00 ATOM 93 NZ LYS A 12 -13.907 -7.088 5.885 1.00 0.00 ATOM 94 O LYS A 12 -8.866 -11.725 6.001 1.00 0.00 ATOM 95 C LYS A 12 -8.180 -10.741 5.729 1.00 0.00 ATOM 96 N ASN A 13 -7.193 -10.282 6.485 1.00 0.00 ATOM 97 CA ASN A 13 -6.841 -10.935 7.734 1.00 0.00 ATOM 98 CB ASN A 13 -5.532 -10.367 8.285 1.00 0.00 ATOM 99 CG ASN A 13 -4.862 -11.301 9.273 1.00 0.00 ATOM 100 ND2 ASN A 13 -3.619 -11.673 8.986 1.00 0.00 ATOM 101 OD1 ASN A 13 -5.455 -11.683 10.282 1.00 0.00 ATOM 102 O ASN A 13 -8.988 -10.174 8.492 1.00 0.00 ATOM 103 C ASN A 13 -7.931 -10.728 8.787 1.00 0.00 ATOM 104 N VAL A 14 -7.628 -11.198 10.027 1.00 0.00 ATOM 105 CA VAL A 14 -8.570 -11.069 11.127 1.00 0.00 ATOM 106 CB VAL A 14 -8.186 -11.978 12.309 1.00 0.00 ATOM 107 CG1 VAL A 14 -8.184 -13.438 11.879 1.00 0.00 ATOM 108 CG2 VAL A 14 -6.798 -11.627 12.822 1.00 0.00 ATOM 109 O VAL A 14 -9.472 -9.287 12.458 1.00 0.00 ATOM 110 C VAL A 14 -8.615 -9.631 11.645 1.00 0.00 ATOM 111 N GLN A 15 -7.683 -8.828 11.152 1.00 0.00 ATOM 112 CA GLN A 15 -7.606 -7.434 11.555 1.00 0.00 ATOM 113 CB GLN A 15 -6.175 -7.071 11.958 1.00 0.00 ATOM 114 CG GLN A 15 -5.665 -7.821 13.178 1.00 0.00 ATOM 115 CD GLN A 15 -4.247 -7.434 13.549 1.00 0.00 ATOM 116 OE1 GLN A 15 -3.684 -6.493 12.991 1.00 0.00 ATOM 117 NE2 GLN A 15 -3.665 -8.162 14.495 1.00 0.00 ATOM 118 O GLN A 15 -8.088 -5.311 10.544 1.00 0.00 ATOM 119 C GLN A 15 -8.033 -6.531 10.396 1.00 0.00 ATOM 120 N GLY A 16 -8.325 -7.164 9.270 1.00 0.00 ATOM 121 CA GLY A 16 -8.746 -6.433 8.087 1.00 0.00 ATOM 122 O GLY A 16 -7.525 -4.690 6.975 1.00 0.00 ATOM 123 C GLY A 16 -7.540 -5.866 7.335 1.00 0.00 ATOM 124 N LEU A 17 -6.557 -6.729 7.120 1.00 0.00 ATOM 125 CA LEU A 17 -5.350 -6.329 6.418 1.00 0.00 ATOM 126 CB LEU A 17 -5.689 -5.379 5.268 1.00 0.00 ATOM 127 CG LEU A 17 -6.555 -5.955 4.146 1.00 0.00 ATOM 128 CD1 LEU A 17 -6.911 -4.876 3.134 1.00 0.00 ATOM 129 CD2 LEU A 17 -5.819 -7.067 3.415 1.00 0.00 ATOM 130 O LEU A 17 -4.239 -6.057 8.529 1.00 0.00 ATOM 131 C LEU A 17 -4.410 -5.617 7.393 1.00 0.00 ATOM 132 N GLY A 18 -3.826 -4.529 6.913 1.00 0.00 ATOM 133 CA GLY A 18 -2.908 -3.751 7.728 1.00 0.00 ATOM 134 O GLY A 18 -0.888 -2.902 6.748 1.00 0.00 ATOM 135 C GLY A 18 -2.105 -2.773 6.868 1.00 0.00 ATOM 136 N ILE A 19 -2.820 -1.817 6.292 1.00 0.00 ATOM 137 CA ILE A 19 -2.189 -0.818 5.447 1.00 0.00 ATOM 138 CB ILE A 19 -2.571 -1.008 3.967 1.00 0.00 ATOM 139 CG1 ILE A 19 -2.163 -2.402 3.486 1.00 0.00 ATOM 140 CG2 ILE A 19 -1.869 0.026 3.099 1.00 0.00 ATOM 141 CD1 ILE A 19 -2.658 -2.737 2.096 1.00 0.00 ATOM 142 O ILE A 19 -3.705 1.042 5.515 1.00 0.00 ATOM 143 C ILE A 19 -2.613 0.594 5.858 1.00 0.00 ATOM 144 N THR A 20 -1.725 1.255 6.587 1.00 0.00 ATOM 145 CA THR A 20 -1.993 2.606 7.048 1.00 0.00 ATOM 146 CB THR A 20 -0.962 3.059 8.099 1.00 0.00 ATOM 147 CG2 THR A 20 -1.344 4.416 8.670 1.00 0.00 ATOM 148 OG1 THR A 20 -0.913 2.104 9.166 1.00 0.00 ATOM 149 O THR A 20 -0.991 4.376 5.772 1.00 0.00 ATOM 150 C THR A 20 -1.940 3.602 5.887 1.00 0.00 ATOM 151 N ILE A 21 -2.971 3.550 5.057 1.00 0.00 ATOM 152 CA ILE A 21 -3.054 4.438 3.910 1.00 0.00 ATOM 153 CB ILE A 21 -4.029 3.898 2.847 1.00 0.00 ATOM 154 CG1 ILE A 21 -3.523 2.567 2.287 1.00 0.00 ATOM 155 CG2 ILE A 21 -4.164 4.884 1.698 1.00 0.00 ATOM 156 CD1 ILE A 21 -4.536 1.841 1.430 1.00 0.00 ATOM 157 O ILE A 21 -4.408 5.907 5.242 1.00 0.00 ATOM 158 C ILE A 21 -3.547 5.812 4.368 1.00 0.00 ATOM 159 N ALA A 22 -2.980 6.843 3.758 1.00 0.00 ATOM 160 CA ALA A 22 -3.352 8.207 4.093 1.00 0.00 ATOM 161 CB ALA A 22 -2.298 8.839 4.989 1.00 0.00 ATOM 162 O ALA A 22 -2.837 8.713 1.803 1.00 0.00 ATOM 163 C ALA A 22 -3.474 9.028 2.807 1.00 0.00 ATOM 164 N GLY A 23 -4.296 10.064 2.881 1.00 0.00 ATOM 165 CA GLY A 23 -4.510 10.932 1.735 1.00 0.00 ATOM 166 O GLY A 23 -2.794 12.485 2.376 1.00 0.00 ATOM 167 C GLY A 23 -3.249 11.764 1.489 1.00 0.00 ATOM 168 N TYR A 24 -2.721 11.636 0.281 1.00 0.00 ATOM 169 CA TYR A 24 -1.522 12.366 -0.093 1.00 0.00 ATOM 170 CB TYR A 24 -1.324 12.329 -1.610 1.00 0.00 ATOM 171 CG TYR A 24 -0.990 10.958 -2.151 1.00 0.00 ATOM 172 CD1 TYR A 24 -0.609 9.930 -1.298 1.00 0.00 ATOM 173 CD2 TYR A 24 -1.057 10.695 -3.513 1.00 0.00 ATOM 174 CE1 TYR A 24 -0.302 8.673 -1.784 1.00 0.00 ATOM 175 CE2 TYR A 24 -0.754 9.444 -4.017 1.00 0.00 ATOM 176 CZ TYR A 24 -0.374 8.430 -3.138 1.00 0.00 ATOM 177 OH TYR A 24 -0.070 7.180 -3.624 1.00 0.00 ATOM 178 O TYR A 24 -0.597 14.468 0.609 1.00 0.00 ATOM 179 C TYR A 24 -1.614 13.831 0.341 1.00 0.00 ATOM 180 N ILE A 25 -2.844 14.322 0.397 1.00 0.00 ATOM 181 CA ILE A 25 -3.082 15.699 0.794 1.00 0.00 ATOM 182 CB ILE A 25 -4.568 16.078 0.655 1.00 0.00 ATOM 183 CG1 ILE A 25 -4.975 16.111 -0.819 1.00 0.00 ATOM 184 CG2 ILE A 25 -4.827 17.450 1.258 1.00 0.00 ATOM 185 CD1 ILE A 25 -6.468 16.217 -1.039 1.00 0.00 ATOM 186 O ILE A 25 -2.218 17.008 2.611 1.00 0.00 ATOM 187 C ILE A 25 -2.680 15.926 2.252 1.00 0.00 ATOM 188 N GLY 26 -2.871 14.889 3.054 1.00 0.00 ATOM 189 CA GLY 26 -2.534 14.962 4.466 1.00 0.00 ATOM 190 C LYS 28 1.598 15.446 3.568 1.00 0.00 ATOM 191 N LYS A 29 2.978 15.389 3.476 1.00 0.00 ATOM 192 CA LYS A 29 3.741 16.462 2.860 1.00 0.00 ATOM 193 CB LYS A 29 5.234 16.291 3.146 1.00 0.00 ATOM 194 CG LYS A 29 5.857 15.072 2.485 1.00 0.00 ATOM 195 CD LYS A 29 7.315 14.912 2.884 1.00 0.00 ATOM 196 CE LYS A 29 7.944 13.706 2.205 1.00 0.00 ATOM 197 NZ LYS A 29 9.370 13.529 2.598 1.00 0.00 ATOM 198 O LYS A 29 3.487 17.494 0.708 1.00 0.00 ATOM 199 C LYS A 29 3.522 16.444 1.346 1.00 0.00 ATOM 200 N LEU A 30 3.379 15.238 0.815 1.00 0.00 ATOM 201 CA LEU A 30 3.165 15.069 -0.612 1.00 0.00 ATOM 202 CB LEU A 30 2.560 13.694 -0.904 1.00 0.00 ATOM 203 CG LEU A 30 3.506 12.498 -0.788 1.00 0.00 ATOM 204 CD1 LEU A 30 2.748 11.193 -0.972 1.00 0.00 ATOM 205 CD2 LEU A 30 4.596 12.570 -1.847 1.00 0.00 ATOM 206 O LEU A 30 2.371 16.671 -2.215 1.00 0.00 ATOM 207 C LEU A 30 2.207 16.153 -1.111 1.00 0.00 ATOM 208 N GLU A 31 1.229 16.465 -0.274 1.00 0.00 ATOM 209 CA GLU A 31 0.245 17.478 -0.616 1.00 0.00 ATOM 210 CB GLU A 31 0.897 18.861 -0.671 1.00 0.00 ATOM 211 CG GLU A 31 1.330 19.398 0.683 1.00 0.00 ATOM 212 CD GLU A 31 1.949 20.779 0.592 1.00 0.00 ATOM 213 OE1 GLU A 31 1.257 21.710 0.129 1.00 0.00 ATOM 214 OE2 GLU A 31 3.125 20.930 0.983 1.00 0.00 ATOM 215 O GLU A 31 -0.938 18.090 -2.614 1.00 0.00 ATOM 216 C GLU A 31 -0.384 17.192 -1.981 1.00 0.00 ATOM 217 N PRO A 32 -0.278 15.938 -2.395 1.00 0.00 ATOM 218 CA PRO A 32 -0.830 15.522 -3.673 1.00 0.00 ATOM 219 CB PRO A 32 0.321 14.774 -4.347 1.00 0.00 ATOM 220 CG PRO A 32 1.108 14.200 -3.216 1.00 0.00 ATOM 221 CD PRO A 32 0.941 15.154 -2.067 1.00 0.00 ATOM 222 O PRO A 32 -2.144 13.977 -2.389 1.00 0.00 ATOM 223 C PRO A 32 -2.042 14.621 -3.432 1.00 0.00 ATOM 224 N SER A 33 -2.956 14.604 -4.439 1.00 0.00 ATOM 225 CA SER A 33 -4.157 13.793 -4.346 1.00 0.00 ATOM 226 CB SER A 33 -5.176 14.222 -5.403 1.00 0.00 ATOM 227 OG SER A 33 -4.708 13.933 -6.709 1.00 0.00 ATOM 228 O SER A 33 -2.923 11.975 -5.314 1.00 0.00 ATOM 229 C SER A 33 -3.838 12.313 -4.564 1.00 0.00 ATOM 230 N GLY A 34 -4.610 11.469 -3.896 1.00 0.00 ATOM 231 CA GLY A 34 -4.421 10.033 -4.007 1.00 0.00 ATOM 232 O GLY A 34 -3.639 10.139 -1.740 1.00 0.00 ATOM 233 C GLY A 34 -4.039 9.424 -2.657 1.00 0.00 ATOM 234 N ILE A 35 -4.175 8.108 -2.577 1.00 0.00 ATOM 235 CA ILE A 35 -3.850 7.395 -1.354 1.00 0.00 ATOM 236 CB ILE A 35 -4.769 6.176 -1.150 1.00 0.00 ATOM 237 CG1 ILE A 35 -6.219 6.628 -0.964 1.00 0.00 ATOM 238 CG2 ILE A 35 -4.347 5.391 0.083 1.00 0.00 ATOM 239 CD1 ILE A 35 -7.227 5.503 -1.068 1.00 0.00 ATOM 240 O ILE A 35 -1.862 6.706 -2.512 1.00 0.00 ATOM 241 C ILE A 35 -2.402 6.906 -1.424 1.00 0.00 ATOM 242 N PHE A 36 -1.813 6.726 -0.251 1.00 0.00 ATOM 243 CA PHE A 36 -0.438 6.264 -0.166 1.00 0.00 ATOM 244 CB PHE A 36 0.528 7.450 -0.192 1.00 0.00 ATOM 245 CG PHE A 36 0.381 8.378 0.979 1.00 0.00 ATOM 246 CD1 PHE A 36 1.145 8.203 2.120 1.00 0.00 ATOM 247 CD2 PHE A 36 -0.522 9.427 0.941 1.00 0.00 ATOM 248 CE1 PHE A 36 1.009 9.057 3.198 1.00 0.00 ATOM 249 CE2 PHE A 36 -0.657 10.281 2.019 1.00 0.00 ATOM 250 CZ PHE A 36 0.103 10.099 3.144 1.00 0.00 ATOM 251 O PHE A 36 -0.825 5.766 2.151 1.00 0.00 ATOM 252 C PHE A 36 -0.201 5.484 1.129 1.00 0.00 ATOM 253 N VAL A 37 0.701 4.517 1.043 1.00 0.00 ATOM 254 CA VAL A 37 1.028 3.695 2.195 1.00 0.00 ATOM 255 CB VAL A 37 1.913 2.498 1.801 1.00 0.00 ATOM 256 CG1 VAL A 37 2.335 1.718 3.037 1.00 0.00 ATOM 257 CG2 VAL A 37 1.157 1.558 0.875 1.00 0.00 ATOM 258 O VAL A 37 2.743 5.229 2.880 1.00 0.00 ATOM 259 C VAL A 37 1.783 4.540 3.223 1.00 0.00 ATOM 260 N LYS A 38 1.321 4.460 4.462 1.00 0.00 ATOM 261 CA LYS A 38 1.941 5.209 5.541 1.00 0.00 ATOM 262 CB LYS A 38 0.889 6.011 6.310 1.00 0.00 ATOM 263 CG LYS A 38 1.460 6.882 7.417 1.00 0.00 ATOM 264 CD LYS A 38 0.361 7.632 8.152 1.00 0.00 ATOM 265 CE LYS A 38 0.935 8.533 9.234 1.00 0.00 ATOM 266 NZ LYS A 38 -0.132 9.267 9.969 1.00 0.00 ATOM 267 O LYS A 38 3.746 4.531 6.972 1.00 0.00 ATOM 268 C LYS A 38 2.636 4.258 6.517 1.00 0.00 ATOM 269 N SER A 39 1.954 3.160 6.811 1.00 0.00 ATOM 270 CA SER A 39 2.492 2.167 7.724 1.00 0.00 ATOM 271 CB SER A 39 1.891 2.342 9.120 1.00 0.00 ATOM 272 OG SER A 39 2.138 3.643 9.623 1.00 0.00 ATOM 273 O SER A 39 1.441 0.589 6.251 1.00 0.00 ATOM 274 C SER A 39 2.167 0.756 7.229 1.00 0.00 ATOM 275 N ILE A 40 2.721 -0.224 7.928 1.00 0.00 ATOM 276 CA ILE A 40 2.500 -1.615 7.572 1.00 0.00 ATOM 277 CB ILE A 40 3.635 -2.157 6.683 1.00 0.00 ATOM 278 CG1 ILE A 40 3.797 -1.287 5.435 1.00 0.00 ATOM 279 CG2 ILE A 40 3.331 -3.581 6.241 1.00 0.00 ATOM 280 CD1 ILE A 40 4.950 -1.701 4.548 1.00 0.00 ATOM 281 O ILE A 40 3.464 -2.901 9.356 1.00 0.00 ATOM 282 C ILE A 40 2.435 -2.459 8.846 1.00 0.00 ATOM 283 N THR A 41 1.216 -2.658 9.325 1.00 0.00 ATOM 284 CA THR A 41 1.003 -3.441 10.530 1.00 0.00 ATOM 285 CB THR A 41 -0.455 -3.926 10.637 1.00 0.00 ATOM 286 CG2 THR A 41 -0.659 -4.720 11.919 1.00 0.00 ATOM 287 OG1 THR A 41 -1.338 -2.798 10.645 1.00 0.00 ATOM 288 O THR A 41 2.272 -5.163 9.438 1.00 0.00 ATOM 289 C THR A 41 1.923 -4.664 10.507 1.00 0.00 ATOM 290 N LYS A 42 2.298 -5.124 11.731 1.00 0.00 ATOM 291 CA LYS A 42 3.170 -6.279 11.861 1.00 0.00 ATOM 292 CB LYS A 42 3.734 -6.367 13.280 1.00 0.00 ATOM 293 CG LYS A 42 4.682 -7.536 13.500 1.00 0.00 ATOM 294 CD LYS A 42 5.235 -7.539 14.916 1.00 0.00 ATOM 295 CE LYS A 42 6.190 -8.701 15.132 1.00 0.00 ATOM 296 NZ LYS A 42 6.759 -8.703 16.508 1.00 0.00 ATOM 297 O LYS A 42 2.784 -8.328 10.670 1.00 0.00 ATOM 298 C LYS A 42 2.411 -7.575 11.568 1.00 0.00 ATOM 299 N SER A 43 1.359 -7.795 12.343 1.00 0.00 ATOM 300 CA SER A 43 0.544 -8.987 12.179 1.00 0.00 ATOM 301 CB SER A 43 -0.147 -9.349 13.495 1.00 0.00 ATOM 302 OG SER A 43 0.801 -9.659 14.501 1.00 0.00 ATOM 303 O SER A 43 -1.713 -9.029 11.362 1.00 0.00 ATOM 304 C SER A 43 -0.535 -8.770 11.117 1.00 0.00 ATOM 305 N SER A 44 -0.096 -8.298 9.960 1.00 0.00 ATOM 306 CA SER A 44 -1.010 -8.043 8.859 1.00 0.00 ATOM 307 CB SER A 44 -1.135 -6.540 8.604 1.00 0.00 ATOM 308 OG SER A 44 0.102 -5.988 8.188 1.00 0.00 ATOM 309 O SER A 44 0.693 -9.011 7.472 1.00 0.00 ATOM 310 C SER A 44 -0.495 -8.715 7.585 1.00 0.00 ATOM 311 N ALA A 45 -1.439 -8.941 6.632 1.00 0.00 ATOM 312 CA ALA A 45 -1.092 -9.571 5.370 1.00 0.00 ATOM 313 CB ALA A 45 -2.346 -10.040 4.649 1.00 0.00 ATOM 314 O ALA A 45 0.548 -8.992 3.715 1.00 0.00 ATOM 315 C ALA A 45 -0.352 -8.595 4.454 1.00 0.00 ATOM 316 N VAL A 46 -0.758 -7.336 4.533 1.00 0.00 ATOM 317 CA VAL A 46 -0.144 -6.300 3.720 1.00 0.00 ATOM 318 CB VAL A 46 -0.729 -4.912 4.039 1.00 0.00 ATOM 319 CG1 VAL A 46 0.061 -3.824 3.327 1.00 0.00 ATOM 320 CG2 VAL A 46 -2.178 -4.827 3.586 1.00 0.00 ATOM 321 O VAL A 46 2.160 -6.111 3.070 1.00 0.00 ATOM 322 C VAL A 46 1.361 -6.268 3.993 1.00 0.00 ATOM 323 N GLU A 47 1.703 -6.420 5.264 1.00 0.00 ATOM 324 CA GLU A 47 3.098 -6.411 5.670 1.00 0.00 ATOM 325 CB GLU A 47 3.216 -6.168 7.176 1.00 0.00 ATOM 326 CG GLU A 47 4.647 -6.093 7.682 1.00 0.00 ATOM 327 CD GLU A 47 4.725 -5.842 9.175 1.00 0.00 ATOM 328 OE1 GLU A 47 4.102 -6.608 9.939 1.00 0.00 ATOM 329 OE2 GLU A 47 5.409 -4.879 9.581 1.00 0.00 ATOM 330 O GLU A 47 4.818 -7.814 4.754 1.00 0.00 ATOM 331 C GLU A 47 3.732 -7.761 5.331 1.00 0.00 ATOM 332 N HIS A 48 3.028 -8.820 5.703 1.00 0.00 ATOM 333 CA HIS A 48 3.508 -10.167 5.446 1.00 0.00 ATOM 334 CB HIS A 48 2.420 -11.194 5.767 1.00 0.00 ATOM 335 CG HIS A 48 2.878 -12.615 5.655 1.00 0.00 ATOM 336 CD2 HIS A 48 2.569 -13.740 4.785 1.00 0.00 ATOM 337 ND1 HIS A 48 3.819 -13.162 6.500 1.00 0.00 ATOM 338 CE1 HIS A 48 4.024 -14.446 6.155 1.00 0.00 ATOM 339 NE2 HIS A 48 3.277 -14.799 5.127 1.00 0.00 ATOM 340 O HIS A 48 4.714 -11.135 3.610 1.00 0.00 ATOM 341 C HIS A 48 3.894 -10.293 3.971 1.00 0.00 ATOM 342 N ASP A 49 3.283 -9.443 3.158 1.00 0.00 ATOM 343 CA ASP A 49 3.552 -9.449 1.730 1.00 0.00 ATOM 344 CB ASP A 49 2.657 -8.437 1.012 1.00 0.00 ATOM 345 CG ASP A 49 2.787 -8.512 -0.497 1.00 0.00 ATOM 346 OD1 ASP A 49 3.531 -9.387 -0.986 1.00 0.00 ATOM 347 OD2 ASP A 49 2.145 -7.695 -1.189 1.00 0.00 ATOM 348 O ASP A 49 5.752 -9.826 0.845 1.00 0.00 ATOM 349 C ASP A 49 5.017 -9.079 1.489 1.00 0.00 ATOM 350 N GLY A 50 5.397 -7.926 2.020 1.00 0.00 ATOM 351 CA GLY A 50 6.761 -7.447 1.871 1.00 0.00 ATOM 352 O GLY A 50 7.277 -5.219 1.141 1.00 0.00 ATOM 353 C GLY A 50 6.838 -6.326 0.833 1.00 0.00 ATOM 354 N ARG A 51 6.405 -6.652 -0.376 1.00 0.00 ATOM 355 CA ARG A 51 6.420 -5.686 -1.462 1.00 0.00 ATOM 356 CB ARG A 51 5.512 -6.148 -2.603 1.00 0.00 ATOM 357 CG ARG A 51 5.690 -5.366 -3.894 1.00 0.00 ATOM 358 CD ARG A 51 4.867 -5.967 -5.022 1.00 0.00 ATOM 359 NE ARG A 51 5.461 -7.198 -5.537 1.00 0.00 ATOM 360 CZ ARG A 51 4.909 -7.957 -6.479 1.00 0.00 ATOM 361 NH1 ARG A 51 5.522 -9.060 -6.886 1.00 0.00 ATOM 362 NH2 ARG A 51 3.745 -7.610 -7.012 1.00 0.00 ATOM 363 O ARG A 51 6.639 -3.328 -1.068 1.00 0.00 ATOM 364 C ARG A 51 5.926 -4.325 -0.968 1.00 0.00 ATOM 365 N ILE A 52 4.708 -4.327 -0.445 1.00 0.00 ATOM 366 CA ILE A 52 4.111 -3.105 0.065 1.00 0.00 ATOM 367 CB ILE A 52 2.900 -3.403 0.968 1.00 0.00 ATOM 368 CG1 ILE A 52 1.828 -4.167 0.189 1.00 0.00 ATOM 369 CG2 ILE A 52 2.290 -2.109 1.485 1.00 0.00 ATOM 370 CD1 ILE A 52 1.276 -3.405 -0.996 1.00 0.00 ATOM 371 O ILE A 52 5.571 -2.794 1.945 1.00 0.00 ATOM 372 C ILE A 52 5.150 -2.337 0.883 1.00 0.00 ATOM 373 N GLN A 53 5.534 -1.182 0.359 1.00 0.00 ATOM 374 CA GLN A 53 6.517 -0.346 1.028 1.00 0.00 ATOM 375 CB GLN A 53 7.674 -0.017 0.082 1.00 0.00 ATOM 376 CG GLN A 53 8.394 -1.239 -0.466 1.00 0.00 ATOM 377 CD GLN A 53 9.083 -2.044 0.619 1.00 0.00 ATOM 378 OE1 GLN A 53 9.832 -1.498 1.429 1.00 0.00 ATOM 379 NE2 GLN A 53 8.832 -3.347 0.636 1.00 0.00 ATOM 380 O GLN A 53 4.866 1.393 0.912 1.00 0.00 ATOM 381 C GLN A 53 5.868 0.963 1.482 1.00 0.00 ATOM 382 N ILE A 54 6.465 1.560 2.503 1.00 0.00 ATOM 383 CA ILE A 54 5.958 2.811 3.039 1.00 0.00 ATOM 384 CB ILE A 54 6.737 3.244 4.295 1.00 0.00 ATOM 385 CG1 ILE A 54 6.547 2.223 5.419 1.00 0.00 ATOM 386 CG2 ILE A 54 6.247 4.598 4.785 1.00 0.00 ATOM 387 CD1 ILE A 54 7.460 2.443 6.604 1.00 0.00 ATOM 388 O ILE A 54 7.162 4.082 1.396 1.00 0.00 ATOM 389 C ILE A 54 6.094 3.907 1.981 1.00 0.00 ATOM 390 N GLY A 55 4.996 4.618 1.766 1.00 0.00 ATOM 391 CA GLY A 55 4.980 5.692 0.788 1.00 0.00 ATOM 392 O GLY A 55 3.761 6.087 -1.243 1.00 0.00 ATOM 393 C GLY A 55 4.273 5.254 -0.496 1.00 0.00 ATOM 394 N ASP A 56 4.268 3.947 -0.715 1.00 0.00 ATOM 395 CA ASP A 56 3.632 3.388 -1.896 1.00 0.00 ATOM 396 CB ASP A 56 3.334 1.901 -1.691 1.00 0.00 ATOM 397 CG ASP A 56 2.939 1.204 -2.978 1.00 0.00 ATOM 398 OD1 ASP A 56 1.932 1.614 -3.592 1.00 0.00 ATOM 399 OD2 ASP A 56 3.637 0.246 -3.372 1.00 0.00 ATOM 400 O ASP A 56 1.730 4.702 -1.247 1.00 0.00 ATOM 401 C ASP A 56 2.320 4.128 -2.162 1.00 0.00 ATOM 402 N GLN A 57 1.901 4.090 -3.418 1.00 0.00 ATOM 403 CA GLN A 57 0.669 4.750 -3.816 1.00 0.00 ATOM 404 CB GLN A 57 0.958 5.855 -4.834 1.00 0.00 ATOM 405 CG GLN A 57 1.799 6.997 -4.289 1.00 0.00 ATOM 406 CD GLN A 57 2.042 8.084 -5.317 1.00 0.00 ATOM 407 OE1 GLN A 57 1.160 8.896 -5.597 1.00 0.00 ATOM 408 NE2 GLN A 57 3.243 8.103 -5.884 1.00 0.00 ATOM 409 O GLN A 57 0.065 3.059 -5.409 1.00 0.00 ATOM 410 C GLN A 57 -0.292 3.743 -4.451 1.00 0.00 ATOM 411 N ILE A 58 -1.491 3.684 -3.892 1.00 0.00 ATOM 412 CA ILE A 58 -2.506 2.771 -4.392 1.00 0.00 ATOM 413 CB ILE A 58 -3.612 2.531 -3.348 1.00 0.00 ATOM 414 CG1 ILE A 58 -4.446 1.304 -3.727 1.00 0.00 ATOM 415 CG2 ILE A 58 -4.538 3.735 -3.266 1.00 0.00 ATOM 416 CD1 ILE A 58 -5.406 0.861 -2.645 1.00 0.00 ATOM 417 O ILE A 58 -3.150 4.581 -5.833 1.00 0.00 ATOM 418 C ILE A 58 -3.144 3.365 -5.650 1.00 0.00 ATOM 419 N ILE A 59 -3.664 2.478 -6.486 1.00 0.00 ATOM 420 CA ILE A 59 -4.303 2.898 -7.721 1.00 0.00 ATOM 421 CB ILE A 59 -3.484 2.472 -8.954 1.00 0.00 ATOM 422 CG1 ILE A 59 -2.101 3.127 -8.927 1.00 0.00 ATOM 423 CG2 ILE A 59 -4.191 2.890 -10.234 1.00 0.00 ATOM 424 CD1 ILE A 59 -1.165 2.620 -10.003 1.00 0.00 ATOM 425 O ILE A 59 -6.667 2.936 -8.135 1.00 0.00 ATOM 426 C ILE A 59 -5.690 2.261 -7.816 1.00 0.00 ATOM 427 N ALA A 60 -5.733 0.967 -7.532 1.00 0.00 ATOM 428 CA ALA A 60 -6.985 0.231 -7.580 1.00 0.00 ATOM 429 CB ALA A 60 -6.987 -0.735 -8.755 1.00 0.00 ATOM 430 O ALA A 60 -6.223 -0.819 -5.560 1.00 0.00 ATOM 431 C ALA A 60 -7.181 -0.569 -6.291 1.00 0.00 ATOM 432 N VAL A 61 -8.427 -0.948 -6.051 1.00 0.00 ATOM 433 CA VAL A 61 -8.761 -1.715 -4.863 1.00 0.00 ATOM 434 CB VAL A 61 -9.251 -0.804 -3.722 1.00 0.00 ATOM 435 CG1 VAL A 61 -9.603 -1.630 -2.495 1.00 0.00 ATOM 436 CG2 VAL A 61 -8.171 0.194 -3.336 1.00 0.00 ATOM 437 O VAL A 61 -11.021 -2.322 -5.399 1.00 0.00 ATOM 438 C VAL A 61 -9.871 -2.712 -5.200 1.00 0.00 ATOM 439 N ASP A 62 -9.489 -3.979 -5.253 1.00 0.00 ATOM 440 CA ASP A 62 -10.438 -5.035 -5.562 1.00 0.00 ATOM 441 CB ASP A 62 -11.547 -5.084 -4.509 1.00 0.00 ATOM 442 CG ASP A 62 -11.028 -5.456 -3.134 1.00 0.00 ATOM 443 OD1 ASP A 62 -10.307 -6.471 -3.026 1.00 0.00 ATOM 444 OD2 ASP A 62 -11.343 -4.734 -2.165 1.00 0.00 ATOM 445 O ASP A 62 -12.248 -5.027 -7.140 1.00 0.00 ATOM 446 C ASP A 62 -11.063 -4.768 -6.933 1.00 0.00 ATOM 447 N GLY A 63 -10.238 -4.254 -7.833 1.00 0.00 ATOM 448 CA GLY A 63 -10.695 -3.949 -9.178 1.00 0.00 ATOM 449 O GLY A 63 -12.482 -2.588 -10.026 1.00 0.00 ATOM 450 C GLY A 63 -11.592 -2.710 -9.185 1.00 0.00 ATOM 451 N THR A 64 -11.328 -1.822 -8.237 1.00 0.00 ATOM 452 CA THR A 64 -12.101 -0.597 -8.124 1.00 0.00 ATOM 453 CB THR A 64 -12.772 -0.479 -6.743 1.00 0.00 ATOM 454 CG2 THR A 64 -13.577 0.809 -6.650 1.00 0.00 ATOM 455 OG1 THR A 64 -13.653 -1.591 -6.540 1.00 0.00 ATOM 456 O THR A 64 -10.403 0.954 -7.433 1.00 0.00 ATOM 457 C THR A 64 -11.189 0.616 -8.317 1.00 0.00 ATOM 458 N ASN A 65 -11.325 1.239 -9.479 1.00 0.00 ATOM 459 CA ASN A 65 -10.523 2.408 -9.799 1.00 0.00 ATOM 460 CB ASN A 65 -11.005 3.048 -11.102 1.00 0.00 ATOM 461 CG ASN A 65 -10.664 2.214 -12.322 1.00 0.00 ATOM 462 ND2 ASN A 65 -11.391 2.436 -13.411 1.00 0.00 ATOM 463 OD1 ASN A 65 -9.758 1.382 -12.283 1.00 0.00 ATOM 464 O ASN A 65 -11.733 3.845 -8.305 1.00 0.00 ATOM 465 C ASN A 65 -10.632 3.441 -8.677 1.00 0.00 ATOM 466 N LEU A 66 -9.475 3.840 -8.168 1.00 0.00 ATOM 467 CA LEU A 66 -9.427 4.818 -7.095 1.00 0.00 ATOM 468 CB LEU A 66 -8.436 4.380 -6.015 1.00 0.00 ATOM 469 CG LEU A 66 -8.736 3.050 -5.319 1.00 0.00 ATOM 470 CD1 LEU A 66 -7.631 2.697 -4.335 1.00 0.00 ATOM 471 CD2 LEU A 66 -10.048 3.128 -4.553 1.00 0.00 ATOM 472 O LEU A 66 -8.111 6.826 -7.097 1.00 0.00 ATOM 473 C LEU A 66 -8.983 6.169 -7.662 1.00 0.00 ATOM 474 N GLN A 67 -9.604 6.542 -8.771 1.00 0.00 ATOM 475 CA GLN A 67 -9.284 7.801 -9.421 1.00 0.00 ATOM 476 CB GLN A 67 -9.081 7.592 -10.923 1.00 0.00 ATOM 477 CG GLN A 67 -7.904 6.695 -11.271 1.00 0.00 ATOM 478 CD GLN A 67 -7.762 6.474 -12.764 1.00 0.00 ATOM 479 OE1 GLN A 67 -8.479 7.078 -13.562 1.00 0.00 ATOM 480 NE2 GLN A 67 -6.833 5.605 -13.147 1.00 0.00 ATOM 481 O GLN A 67 -11.323 8.904 -10.047 1.00 0.00 ATOM 482 C GLN A 67 -10.434 8.788 -9.205 1.00 0.00 ATOM 483 N GLY A 68 -10.379 9.473 -8.072 1.00 0.00 ATOM 484 CA GLY A 68 -11.405 10.445 -7.736 1.00 0.00 ATOM 485 O GLY A 68 -12.844 10.809 -5.849 1.00 0.00 ATOM 486 C GLY A 68 -12.209 9.993 -6.515 1.00 0.00 ATOM 487 N PHE A 69 -12.157 8.694 -6.260 1.00 0.00 ATOM 488 CA PHE A 69 -12.873 8.124 -5.131 1.00 0.00 ATOM 489 CB PHE A 69 -12.644 6.613 -5.059 1.00 0.00 ATOM 490 CG PHE A 69 -13.345 5.841 -6.140 1.00 0.00 ATOM 491 CD1 PHE A 69 -12.647 5.371 -7.239 1.00 0.00 ATOM 492 CD2 PHE A 69 -14.703 5.586 -6.059 1.00 0.00 ATOM 493 CE1 PHE A 69 -13.292 4.661 -8.234 1.00 0.00 ATOM 494 CE2 PHE A 69 -15.348 4.876 -7.054 1.00 0.00 ATOM 495 CZ PHE A 69 -14.649 4.414 -8.138 1.00 0.00 ATOM 496 O PHE A 69 -11.199 8.636 -3.488 1.00 0.00 ATOM 497 C PHE A 69 -12.371 8.767 -3.837 1.00 0.00 ATOM 498 N THR A 70 -13.284 9.449 -3.160 1.00 0.00 ATOM 499 CA THR A 70 -12.949 10.113 -1.912 1.00 0.00 ATOM 500 CB THR A 70 -14.206 10.649 -1.202 1.00 0.00 ATOM 501 CG2 THR A 70 -13.826 11.375 0.079 1.00 0.00 ATOM 502 OG1 THR A 70 -14.894 11.562 -2.067 1.00 0.00 ATOM 503 O THR A 70 -12.592 7.972 -0.886 1.00 0.00 ATOM 504 C THR A 70 -12.248 9.151 -0.950 1.00 0.00 ATOM 505 N ASN A 71 -11.278 9.690 -0.227 1.00 0.00 ATOM 506 CA ASN A 71 -10.525 8.895 0.728 1.00 0.00 ATOM 507 CB ASN A 71 -9.843 9.798 1.757 1.00 0.00 ATOM 508 CG ASN A 71 -8.630 10.512 1.193 1.00 0.00 ATOM 509 ND2 ASN A 71 -8.162 11.532 1.904 1.00 0.00 ATOM 510 OD1 ASN A 71 -8.123 10.150 0.132 1.00 0.00 ATOM 511 O ASN A 71 -11.127 6.744 1.609 1.00 0.00 ATOM 512 C ASN A 71 -11.442 7.925 1.477 1.00 0.00 ATOM 513 N GLN A 72 -12.559 8.461 1.947 1.00 0.00 ATOM 514 CA GLN A 72 -13.523 7.659 2.680 1.00 0.00 ATOM 515 CB GLN A 72 -14.729 8.509 3.085 1.00 0.00 ATOM 516 CG GLN A 72 -14.432 9.531 4.170 1.00 0.00 ATOM 517 CD GLN A 72 -15.611 10.442 4.451 1.00 0.00 ATOM 518 OE1 GLN A 72 -16.640 10.366 3.779 1.00 0.00 ATOM 519 NE2 GLN A 72 -15.464 11.307 5.448 1.00 0.00 ATOM 520 O GLN A 72 -13.921 5.343 2.186 1.00 0.00 ATOM 521 C GLN A 72 -13.999 6.506 1.793 1.00 0.00 ATOM 522 N GLN A 73 -14.481 6.869 0.613 1.00 0.00 ATOM 523 CA GLN A 73 -14.969 5.880 -0.332 1.00 0.00 ATOM 524 CB GLN A 73 -15.233 6.525 -1.694 1.00 0.00 ATOM 525 CG GLN A 73 -15.798 5.571 -2.733 1.00 0.00 ATOM 526 CD GLN A 73 -17.211 5.126 -2.409 1.00 0.00 ATOM 527 OE1 GLN A 73 -18.048 5.932 -2.003 1.00 0.00 ATOM 528 NE2 GLN A 73 -17.480 3.838 -2.588 1.00 0.00 ATOM 529 O GLN A 73 -14.277 3.584 -0.455 1.00 0.00 ATOM 530 C GLN A 73 -13.937 4.765 -0.514 1.00 0.00 ATOM 531 N ALA A 74 -12.698 5.179 -0.731 1.00 0.00 ATOM 532 CA ALA A 74 -11.614 4.230 -0.921 1.00 0.00 ATOM 533 CB ALA A 74 -10.303 4.963 -1.161 1.00 0.00 ATOM 534 O ALA A 74 -11.484 2.133 0.240 1.00 0.00 ATOM 535 C ALA A 74 -11.478 3.359 0.330 1.00 0.00 ATOM 536 N VAL A 75 -11.360 4.028 1.467 1.00 0.00 ATOM 537 CA VAL A 75 -11.223 3.331 2.735 1.00 0.00 ATOM 538 CB VAL A 75 -11.265 4.309 3.924 1.00 0.00 ATOM 539 CG1 VAL A 75 -11.333 3.547 5.238 1.00 0.00 ATOM 540 CG2 VAL A 75 -10.020 5.183 3.939 1.00 0.00 ATOM 541 O VAL A 75 -12.159 1.201 3.329 1.00 0.00 ATOM 542 C VAL A 75 -12.370 2.330 2.887 1.00 0.00 ATOM 543 N GLU A 76 -13.559 2.778 2.513 1.00 0.00 ATOM 544 CA GLU A 76 -14.739 1.936 2.602 1.00 0.00 ATOM 545 CB GLU A 76 -15.969 2.680 2.079 1.00 0.00 ATOM 546 CG GLU A 76 -17.262 1.888 2.177 1.00 0.00 ATOM 547 CD GLU A 76 -18.464 2.669 1.682 1.00 0.00 ATOM 548 OE1 GLU A 76 -18.286 3.836 1.274 1.00 0.00 ATOM 549 OE2 GLU A 76 -19.582 2.114 1.702 1.00 0.00 ATOM 550 O GLU A 76 -14.724 -0.438 2.246 1.00 0.00 ATOM 551 C GLU A 76 -14.525 0.675 1.763 1.00 0.00 ATOM 552 N VAL A 77 -14.124 0.892 0.519 1.00 0.00 ATOM 553 CA VAL A 77 -13.881 -0.213 -0.393 1.00 0.00 ATOM 554 CB VAL A 77 -13.111 0.247 -1.645 1.00 0.00 ATOM 555 CG1 VAL A 77 -12.691 -0.951 -2.482 1.00 0.00 ATOM 556 CG2 VAL A 77 -13.982 1.152 -2.503 1.00 0.00 ATOM 557 O VAL A 77 -13.491 -2.427 0.450 1.00 0.00 ATOM 558 C VAL A 77 -13.054 -1.285 0.320 1.00 0.00 ATOM 559 N LEU A 78 -11.873 -0.878 0.764 1.00 0.00 ATOM 560 CA LEU A 78 -10.982 -1.790 1.461 1.00 0.00 ATOM 561 CB LEU A 78 -9.700 -1.069 1.883 1.00 0.00 ATOM 562 CG LEU A 78 -8.750 -0.660 0.756 1.00 0.00 ATOM 563 CD1 LEU A 78 -7.617 0.200 1.294 1.00 0.00 ATOM 564 CD2 LEU A 78 -8.142 -1.887 0.093 1.00 0.00 ATOM 565 O LEU A 78 -11.606 -3.522 3.002 1.00 0.00 ATOM 566 C LEU A 78 -11.684 -2.330 2.708 1.00 0.00 ATOM 567 N ARG A 79 -12.354 -1.427 3.408 1.00 0.00 ATOM 568 CA ARG A 79 -13.070 -1.798 4.617 1.00 0.00 ATOM 569 CB ARG A 79 -13.855 -0.604 5.163 1.00 0.00 ATOM 570 CG ARG A 79 -14.612 -0.894 6.448 1.00 0.00 ATOM 571 CD ARG A 79 -15.364 0.335 6.935 1.00 0.00 ATOM 572 NE ARG A 79 -16.092 0.075 8.175 1.00 0.00 ATOM 573 CZ ARG A 79 -16.932 0.934 8.742 1.00 0.00 ATOM 574 NH1 ARG A 79 -17.550 0.611 9.870 1.00 0.00 ATOM 575 NH2 ARG A 79 -17.153 2.114 8.180 1.00 0.00 ATOM 576 O ARG A 79 -13.993 -3.988 4.955 1.00 0.00 ATOM 577 C ARG A 79 -14.053 -2.933 4.325 1.00 0.00 ATOM 578 N HIS A 80 -14.935 -2.678 3.370 1.00 0.00 ATOM 579 CA HIS A 80 -15.929 -3.666 2.986 1.00 0.00 ATOM 580 CB HIS A 80 -17.214 -2.980 2.518 1.00 0.00 ATOM 581 CG HIS A 80 -17.912 -2.206 3.593 1.00 0.00 ATOM 582 CD2 HIS A 80 -18.147 -0.797 3.872 1.00 0.00 ATOM 583 ND1 HIS A 80 -18.541 -2.813 4.658 1.00 0.00 ATOM 584 CE1 HIS A 80 -19.073 -1.865 5.450 1.00 0.00 ATOM 585 NE2 HIS A 80 -18.840 -0.653 4.985 1.00 0.00 ATOM 586 O HIS A 80 -16.130 -4.930 0.955 1.00 0.00 ATOM 587 C HIS A 80 -15.384 -4.527 1.845 1.00 0.00 ATOM 588 N THR A 81 -14.086 -4.785 1.909 1.00 0.00 ATOM 589 CA THR A 81 -13.431 -5.591 0.893 1.00 0.00 ATOM 590 CB THR A 81 -11.918 -5.711 1.156 1.00 0.00 ATOM 591 CG2 THR A 81 -11.660 -6.508 2.426 1.00 0.00 ATOM 592 OG1 THR A 81 -11.290 -6.377 0.054 1.00 0.00 ATOM 593 O THR A 81 -15.208 -7.197 1.064 1.00 0.00 ATOM 594 C THR A 81 -14.010 -7.007 0.860 1.00 0.00 ATOM 595 N GLY A 82 -13.131 -7.965 0.601 1.00 0.00 ATOM 596 CA GLY A 82 -13.540 -9.358 0.539 1.00 0.00 ATOM 597 O GLY A 82 -11.287 -9.823 1.227 1.00 0.00 ATOM 598 C GLY A 82 -12.390 -10.284 0.940 1.00 0.00 ATOM 599 N GLN A 83 -12.689 -11.575 0.948 1.00 0.00 ATOM 600 CA GLN A 83 -11.694 -12.571 1.309 1.00 0.00 ATOM 601 CB GLN A 83 -12.209 -13.979 1.002 1.00 0.00 ATOM 602 CG GLN A 83 -11.253 -15.090 1.402 1.00 0.00 ATOM 603 CD GLN A 83 -11.806 -16.470 1.103 1.00 0.00 ATOM 604 OE1 GLN A 83 -12.869 -16.605 0.498 1.00 0.00 ATOM 605 NE2 GLN A 83 -11.083 -17.500 1.527 1.00 0.00 ATOM 606 O GLN A 83 -9.312 -12.518 1.016 1.00 0.00 ATOM 607 C GLN A 83 -10.415 -12.322 0.508 1.00 0.00 ATOM 608 N THR A 84 -10.605 -11.895 -0.732 1.00 0.00 ATOM 609 CA THR A 84 -9.480 -11.617 -1.609 1.00 0.00 ATOM 610 CB THR A 84 -9.612 -12.362 -2.950 1.00 0.00 ATOM 611 CG2 THR A 84 -8.432 -12.044 -3.855 1.00 0.00 ATOM 612 OG1 THR A 84 -9.648 -13.775 -2.714 1.00 0.00 ATOM 613 O THR A 84 -10.284 -9.571 -2.574 1.00 0.00 ATOM 614 C THR A 84 -9.418 -10.115 -1.891 1.00 0.00 ATOM 615 N VAL A 85 -8.384 -9.486 -1.351 1.00 0.00 ATOM 616 CA VAL A 85 -8.197 -8.057 -1.536 1.00 0.00 ATOM 617 CB VAL A 85 -7.786 -7.367 -0.222 1.00 0.00 ATOM 618 CG1 VAL A 85 -7.558 -5.880 -0.450 1.00 0.00 ATOM 619 CG2 VAL A 85 -8.873 -7.531 0.829 1.00 0.00 ATOM 620 O VAL A 85 -5.967 -8.218 -2.411 1.00 0.00 ATOM 621 C VAL A 85 -7.104 -7.776 -2.569 1.00 0.00 ATOM 622 N LEU A 86 -7.487 -7.043 -3.604 1.00 0.00 ATOM 623 CA LEU A 86 -6.554 -6.698 -4.663 1.00 0.00 ATOM 624 CB LEU A 86 -7.138 -7.059 -6.030 1.00 0.00 ATOM 625 CG LEU A 86 -7.480 -8.534 -6.253 1.00 0.00 ATOM 626 CD1 LEU A 86 -8.130 -8.735 -7.614 1.00 0.00 ATOM 627 CD2 LEU A 86 -6.225 -9.391 -6.195 1.00 0.00 ATOM 628 O LEU A 86 -7.163 -4.386 -4.451 1.00 0.00 ATOM 629 C LEU A 86 -6.258 -5.197 -4.642 1.00 0.00 ATOM 630 N LEU A 87 -4.989 -4.874 -4.841 1.00 0.00 ATOM 631 CA LEU A 87 -4.563 -3.485 -4.848 1.00 0.00 ATOM 632 CB LEU A 87 -3.919 -3.115 -3.510 1.00 0.00 ATOM 633 CG LEU A 87 -4.839 -3.130 -2.288 1.00 0.00 ATOM 634 CD1 LEU A 87 -4.035 -2.956 -1.008 1.00 0.00 ATOM 635 CD2 LEU A 87 -5.856 -2.002 -2.367 1.00 0.00 ATOM 636 O LEU A 87 -2.639 -4.040 -6.173 1.00 0.00 ATOM 637 C LEU A 87 -3.540 -3.230 -5.956 1.00 0.00 ATOM 638 N THR A 88 -3.712 -2.102 -6.629 1.00 0.00 ATOM 639 CA THR A 88 -2.815 -1.730 -7.710 1.00 0.00 ATOM 640 CB THR A 88 -3.594 -1.315 -8.972 1.00 0.00 ATOM 641 CG2 THR A 88 -2.635 -1.002 -10.111 1.00 0.00 ATOM 642 OG1 THR A 88 -4.460 -2.383 -9.376 1.00 0.00 ATOM 643 O THR A 88 -2.341 0.605 -7.413 1.00 0.00 ATOM 644 C THR A 88 -1.947 -0.551 -7.265 1.00 0.00 ATOM 645 N LEU A 89 -0.783 -0.884 -6.727 1.00 0.00 ATOM 646 CA LEU A 89 0.143 0.132 -6.259 1.00 0.00 ATOM 647 CB LEU A 89 0.731 -0.263 -4.903 1.00 0.00 ATOM 648 CG LEU A 89 -0.274 -0.525 -3.779 1.00 0.00 ATOM 649 CD1 LEU A 89 0.440 -0.977 -2.514 1.00 0.00 ATOM 650 CD2 LEU A 89 -1.061 0.736 -3.456 1.00 0.00 ATOM 651 O LEU A 89 1.572 -0.642 -8.026 1.00 0.00 ATOM 652 C LEU A 89 1.281 0.284 -7.271 1.00 0.00 ATOM 653 N MET A 90 1.894 1.458 -7.252 1.00 0.00 ATOM 654 CA MET A 90 2.994 1.743 -8.158 1.00 0.00 ATOM 655 CB MET A 90 2.734 3.041 -8.925 1.00 0.00 ATOM 656 CG MET A 90 3.779 3.357 -9.983 1.00 0.00 ATOM 657 SD MET A 90 3.426 4.883 -10.875 1.00 0.00 ATOM 658 CE MET A 90 2.036 4.373 -11.884 1.00 0.00 ATOM 659 O MET A 90 4.297 2.520 -6.298 1.00 0.00 ATOM 660 C MET A 90 4.287 1.890 -7.354 1.00 0.00 ATOM 661 N ARG A 91 5.347 1.296 -7.884 1.00 0.00 ATOM 662 CA ARG A 91 6.642 1.353 -7.229 1.00 0.00 ATOM 663 CB ARG A 91 7.649 0.457 -7.953 1.00 0.00 ATOM 664 CG ARG A 91 9.006 0.372 -7.274 1.00 0.00 ATOM 665 CD ARG A 91 9.965 -0.503 -8.063 1.00 0.00 ATOM 666 NE ARG A 91 9.562 -1.907 -8.050 1.00 0.00 ATOM 667 CZ ARG A 91 9.865 -2.762 -7.079 1.00 0.00 ATOM 668 NH1 ARG A 91 9.455 -4.021 -7.153 1.00 0.00 ATOM 669 NH2 ARG A 91 10.577 -2.356 -6.037 1.00 0.00 ATOM 670 O ARG A 91 7.728 3.241 -8.239 1.00 0.00 ATOM 671 C ARG A 91 7.155 2.794 -7.246 1.00 0.00 ATOM 672 N ARG 92 6.931 3.481 -6.136 1.00 0.00 ATOM 673 CA ARG 92 7.364 4.863 -6.011 1.00 0.00 ENDMDL