EXPDTA THEORETICAL MODEL, MODELLER 9.19 2017/10/25 12:23:06 REMARK 6 MODELLER OBJECTIVE FUNCTION: 107.2190 REMARK 6 MODELLER BEST TEMPLATE % SEQ ID: 100.000 REMARK 6 SEQUENCE: model REMARK 6 ALIGNMENT: alignment.pir REMARK 6 DOPE score: -5068.43018 REMARK 6 GA341 score: 0.98834 REMARK 6 Normalized DOPE score: -1.71507 REMARK 6 TEMPLATE: 1n7sC00 19:C - 83:C MODELS 1: - 65: AT 100.0% ATOM 1 N ASP 19 -7.931 52.674 41.947 1.00 17.50 N ATOM 2 CA ASP 19 -7.866 51.213 42.176 1.00 17.50 C ATOM 3 CB ASP 19 -8.843 50.487 41.239 1.00 17.50 C ATOM 4 CG ASP 19 -10.259 50.901 41.617 1.00 17.50 C ATOM 5 OD1 ASP 19 -10.541 50.991 42.842 1.00 17.50 O ATOM 6 OD2 ASP 19 -11.071 51.145 40.687 1.00 17.50 O ATOM 7 C ASP 19 -6.490 50.717 41.884 1.00 17.50 C ATOM 8 O ASP 19 -5.698 51.402 41.238 1.00 17.50 O ATOM 9 N GLN 20 -6.165 49.503 42.369 1.00 59.58 N ATOM 10 CA GLN 20 -4.860 48.958 42.140 1.00 59.58 C ATOM 11 CB GLN 20 -4.642 47.580 42.789 1.00 59.58 C ATOM 12 CG GLN 20 -3.241 47.018 42.531 1.00 59.58 C ATOM 13 CD GLN 20 -3.160 45.639 43.166 1.00 59.58 C ATOM 14 OE1 GLN 20 -2.091 45.190 43.579 1.00 59.58 O ATOM 15 NE2 GLN 20 -4.322 44.939 43.244 1.00 59.58 N ATOM 16 C GLN 20 -4.709 48.754 40.673 1.00 59.58 C ATOM 17 O GLN 20 -3.662 49.041 40.096 1.00 59.58 O ATOM 18 N LEU 21 -5.784 48.272 40.028 1.00109.51 N ATOM 19 CA LEU 21 -5.741 47.980 38.630 1.00109.51 C ATOM 20 CB LEU 21 -7.073 47.416 38.106 1.00109.51 C ATOM 21 CG LEU 21 -7.063 47.079 36.605 1.00109.51 C ATOM 22 CD1 LEU 21 -6.039 45.975 36.292 1.00109.51 C ATOM 23 CD2 LEU 21 -8.476 46.735 36.105 1.00109.51 C ATOM 24 C LEU 21 -5.462 49.257 37.912 1.00109.51 C ATOM 25 O LEU 21 -4.694 49.288 36.952 1.00109.51 O ATOM 26 N ALA 22 -6.082 50.360 38.367 1.00 17.38 N ATOM 27 CA ALA 22 -5.865 51.616 37.717 1.00 17.38 C ATOM 28 CB ALA 22 -6.666 52.765 38.352 1.00 17.38 C ATOM 29 C ALA 22 -4.416 51.963 37.844 1.00 17.38 C ATOM 30 O ALA 22 -3.798 52.429 36.888 1.00 17.38 O ATOM 31 N ASP 23 -3.837 51.729 39.037 1.00 31.28 N ATOM 32 CA ASP 23 -2.465 52.050 39.304 1.00 31.28 C ATOM 33 CB ASP 23 -2.059 51.709 40.748 1.00 31.28 C ATOM 34 CG ASP 23 -0.653 52.232 40.995 1.00 31.28 C ATOM 35 OD1 ASP 23 -0.265 53.231 40.333 1.00 31.28 O ATOM 36 OD2 ASP 23 0.058 51.630 41.844 1.00 31.28 O ATOM 37 C ASP 23 -1.598 51.232 38.402 1.00 31.28 C ATOM 38 O ASP 23 -0.633 51.733 37.828 1.00 31.28 O ATOM 39 N GLU 24 -1.939 49.942 38.241 1.00 32.29 N ATOM 40 CA GLU 24 -1.135 49.070 37.439 1.00 32.29 C ATOM 41 CB GLU 24 -1.665 47.624 37.419 1.00 32.29 C ATOM 42 CG GLU 24 -1.579 46.926 38.781 1.00 32.29 C ATOM 43 CD GLU 24 -2.144 45.518 38.637 1.00 32.29 C ATOM 44 OE1 GLU 24 -3.101 45.337 37.843 1.00 32.29 O ATOM 45 OE2 GLU 24 -1.615 44.603 39.328 1.00 32.29 O ATOM 46 C GLU 24 -1.147 49.583 36.037 1.00 32.29 C ATOM 47 O GLU 24 -0.120 49.588 35.362 1.00 32.29 O ATOM 48 N SER 25 -2.319 50.042 35.566 1.00 62.33 N ATOM 49 CA SER 25 -2.437 50.501 34.214 1.00 62.33 C ATOM 50 CB SER 25 -3.865 50.962 33.879 1.00 62.33 C ATOM 51 OG SER 25 -3.939 51.407 32.535 1.00 62.33 O ATOM 52 C SER 25 -1.537 51.682 34.016 1.00 62.33 C ATOM 53 O SER 25 -0.827 51.770 33.016 1.00 62.33 O ATOM 54 N LEU 26 -1.531 52.617 34.983 1.00 37.27 N ATOM 55 CA LEU 26 -0.764 53.822 34.838 1.00 37.27 C ATOM 56 CB LEU 26 -0.951 54.787 36.018 1.00 37.27 C ATOM 57 CG LEU 26 -0.129 56.079 35.869 1.00 37.27 C ATOM 58 CD1 LEU 26 -0.570 56.866 34.622 1.00 37.27 C ATOM 59 CD2 LEU 26 -0.174 56.917 37.153 1.00 37.27 C ATOM 60 C LEU 26 0.688 53.479 34.767 1.00 37.27 C ATOM 61 O LEU 26 1.424 54.006 33.933 1.00 37.27 O ATOM 62 N GLU 27 1.135 52.561 35.641 1.00 34.70 N ATOM 63 CA GLU 27 2.519 52.207 35.687 1.00 34.70 C ATOM 64 CB GLU 27 2.854 51.233 36.833 1.00 34.70 C ATOM 65 CG GLU 27 2.711 51.887 38.212 1.00 34.70 C ATOM 66 CD GLU 27 3.074 50.873 39.290 1.00 34.70 C ATOM 67 OE1 GLU 27 3.783 49.885 38.968 1.00 34.70 O ATOM 68 OE2 GLU 27 2.654 51.084 40.463 1.00 34.70 O ATOM 69 C GLU 27 2.888 51.575 34.386 1.00 34.70 C ATOM 70 O GLU 27 3.988 51.786 33.879 1.00 34.70 O ATOM 71 N SER 28 1.968 50.789 33.800 1.00 25.48 N ATOM 72 CA SER 28 2.268 50.113 32.571 1.00 25.48 C ATOM 73 CB SER 28 1.113 49.231 32.073 1.00 25.48 C ATOM 74 OG SER 28 1.484 48.601 30.858 1.00 25.48 O ATOM 75 C SER 28 2.534 51.135 31.513 1.00 25.48 C ATOM 76 O SER 28 3.411 50.953 30.670 1.00 25.48 O ATOM 77 N THR 29 1.791 52.253 31.547 1.00 85.56 N ATOM 78 CA THR 29 1.936 53.273 30.554 1.00 85.56 C ATOM 79 CB THR 29 1.044 54.451 30.803 1.00 85.56 C ATOM 80 OG1 THR 29 -0.310 54.032 30.877 1.00 85.56 O ATOM 81 CG2 THR 29 1.225 55.443 29.645 1.00 85.56 C ATOM 82 C THR 29 3.333 53.780 30.638 1.00 85.56 C ATOM 83 O THR 29 3.973 54.046 29.622 1.00 85.56 O ATOM 84 N ARG 30 3.843 53.932 31.872 1.00 68.73 N ATOM 85 CA ARG 30 5.173 54.430 32.044 1.00 68.73 C ATOM 86 CB ARG 30 5.570 54.613 33.518 1.00 68.73 C ATOM 87 CG ARG 30 5.042 55.914 34.128 1.00 68.73 C ATOM 88 CD ARG 30 3.522 55.981 34.283 1.00 68.73 C ATOM 89 NE ARG 30 3.200 57.339 34.808 1.00 68.73 N ATOM 90 CZ ARG 30 3.298 57.609 36.143 1.00 68.73 C ATOM 91 NH1 ARG 30 3.653 56.624 37.019 1.00 68.73 N ATOM 92 NH2 ARG 30 3.037 58.868 36.602 1.00 68.73 N ATOM 93 C ARG 30 6.142 53.478 31.420 1.00 68.73 C ATOM 94 O ARG 30 7.080 53.900 30.747 1.00 68.73 O ATOM 95 N ARG 31 5.936 52.162 31.616 1.00 37.22 N ATOM 96 CA ARG 31 6.854 51.195 31.083 1.00 37.22 C ATOM 97 CB ARG 31 6.514 49.741 31.451 1.00 37.22 C ATOM 98 CG ARG 31 6.649 49.420 32.939 1.00 37.22 C ATOM 99 CD ARG 31 6.778 47.920 33.213 1.00 37.22 C ATOM 100 NE ARG 31 5.609 47.231 32.595 1.00 37.22 N ATOM 101 CZ ARG 31 4.491 46.985 33.332 1.00 37.22 C ATOM 102 NH1 ARG 31 4.452 47.360 34.648 1.00 37.22 N ATOM 103 NH2 ARG 31 3.421 46.355 32.767 1.00 37.22 N ATOM 104 C ARG 31 6.839 51.263 29.589 1.00 37.22 C ATOM 105 O ARG 31 7.885 51.165 28.950 1.00 37.22 O ATOM 106 N MET 32 5.646 51.439 28.990 1.00 52.02 N ATOM 107 CA MET 32 5.537 51.433 27.560 1.00 52.02 C ATOM 108 CB MET 32 4.089 51.590 27.061 1.00 52.02 C ATOM 109 CG MET 32 3.233 50.338 27.279 1.00 52.02 C ATOM 110 SD MET 32 1.473 50.523 26.857 1.00 52.02 S ATOM 111 CE MET 32 1.014 51.189 28.482 1.00 52.02 C ATOM 112 C MET 32 6.343 52.558 26.995 1.00 52.02 C ATOM 113 O MET 32 7.034 52.389 25.991 1.00 52.02 O ATOM 114 N LEU 33 6.293 53.734 27.636 1.00 77.36 N ATOM 115 CA LEU 33 7.001 54.857 27.106 1.00 77.36 C ATOM 116 CB LEU 33 6.772 56.131 27.948 1.00 77.36 C ATOM 117 CG LEU 33 7.263 57.457 27.328 1.00 77.36 C ATOM 118 CD1 LEU 33 6.979 58.630 28.278 1.00 77.36 C ATOM 119 CD2 LEU 33 8.738 57.414 26.894 1.00 77.36 C ATOM 120 C LEU 33 8.453 54.504 27.123 1.00 77.36 C ATOM 121 O LEU 33 9.181 54.786 26.174 1.00 77.36 O ATOM 122 N GLN 34 8.914 53.847 28.207 1.00 81.97 N ATOM 123 CA GLN 34 10.301 53.525 28.341 1.00 81.97 C ATOM 124 CB GLN 34 10.598 52.778 29.652 1.00 81.97 C ATOM 125 CG GLN 34 10.306 53.590 30.913 1.00 81.97 C ATOM 126 CD GLN 34 10.507 52.659 32.099 1.00 81.97 C ATOM 127 OE1 GLN 34 10.750 51.465 31.924 1.00 81.97 O ATOM 128 NE2 GLN 34 10.395 53.208 33.337 1.00 81.97 N ATOM 129 C GLN 34 10.709 52.597 27.240 1.00 81.97 C ATOM 130 O GLN 34 11.755 52.783 26.619 1.00 81.97 O ATOM 131 N LEU 35 9.875 51.581 26.957 1.00 40.44 N ATOM 132 CA LEU 35 10.215 50.576 25.989 1.00 40.44 C ATOM 133 CB LEU 35 9.134 49.479 25.892 1.00 40.44 C ATOM 134 CG LEU 35 8.916 48.691 27.204 1.00 40.44 C ATOM 135 CD1 LEU 35 7.830 47.612 27.046 1.00 40.44 C ATOM 136 CD2 LEU 35 10.236 48.120 27.746 1.00 40.44 C ATOM 137 C LEU 35 10.357 51.202 24.635 1.00 40.44 C ATOM 138 O LEU 35 11.340 50.961 23.934 1.00 40.44 O ATOM 139 N VAL 36 9.386 52.045 24.238 1.00 31.86 N ATOM 140 CA VAL 36 9.428 52.641 22.935 1.00 31.86 C ATOM 141 CB VAL 36 8.205 53.452 22.606 1.00 31.86 C ATOM 142 CG1 VAL 36 6.990 52.510 22.589 1.00 31.86 C ATOM 143 CG2 VAL 36 8.079 54.616 23.603 1.00 31.86 C ATOM 144 C VAL 36 10.615 53.541 22.856 1.00 31.86 C ATOM 145 O VAL 36 11.299 53.587 21.837 1.00 31.86 O ATOM 146 N GLU 37 10.899 54.271 23.948 1.00103.10 N ATOM 147 CA GLU 37 11.973 55.217 23.944 1.00103.10 C ATOM 148 CB GLU 37 12.077 55.993 25.268 1.00103.10 C ATOM 149 CG GLU 37 12.921 57.266 25.174 1.00103.10 C ATOM 150 CD GLU 37 12.096 58.326 24.454 1.00103.10 C ATOM 151 OE1 GLU 37 11.259 57.944 23.592 1.00103.10 O ATOM 152 OE2 GLU 37 12.290 59.533 24.760 1.00103.10 O ATOM 153 C GLU 37 13.267 54.492 23.718 1.00103.10 C ATOM 154 O GLU 37 14.120 54.961 22.967 1.00103.10 O ATOM 155 N GLU 38 13.445 53.322 24.360 1.00 89.83 N ATOM 156 CA GLU 38 14.662 52.570 24.226 1.00 89.83 C ATOM 157 CB GLU 38 14.642 51.285 25.079 1.00 89.83 C ATOM 158 CG GLU 38 14.685 51.532 26.589 1.00 89.83 C ATOM 159 CD GLU 38 16.134 51.798 26.968 1.00 89.83 C ATOM 160 OE1 GLU 38 17.006 51.661 26.068 1.00 89.83 O ATOM 161 OE2 GLU 38 16.390 52.134 28.154 1.00 89.83 O ATOM 162 C GLU 38 14.806 52.148 22.799 1.00 89.83 C ATOM 163 O GLU 38 15.874 52.280 22.202 1.00 89.83 O ATOM 164 N SER 39 13.707 51.651 22.205 1.00 25.26 N ATOM 165 CA SER 39 13.749 51.174 20.856 1.00 25.26 C ATOM 166 CB SER 39 12.397 50.606 20.396 1.00 25.26 C ATOM 167 OG SER 39 12.054 49.479 21.193 1.00 25.26 O ATOM 168 C SER 39 14.086 52.326 19.970 1.00 25.26 C ATOM 169 O SER 39 14.856 52.196 19.019 1.00 25.26 O ATOM 170 N LYS 40 13.523 53.501 20.297 1.00 70.33 N ATOM 171 CA LYS 40 13.691 54.709 19.546 1.00 70.33 C ATOM 172 CB LYS 40 12.934 55.867 20.217 1.00 70.33 C ATOM 173 CG LYS 40 13.099 57.231 19.550 1.00 70.33 C ATOM 174 CD LYS 40 12.128 58.280 20.094 1.00 70.33 C ATOM 175 CE LYS 40 12.529 59.717 19.763 1.00 70.33 C ATOM 176 NZ LYS 40 13.647 60.142 20.637 1.00 70.33 N ATOM 177 C LYS 40 15.139 55.072 19.520 1.00 70.33 C ATOM 178 O LYS 40 15.681 55.417 18.471 1.00 70.33 O ATOM 179 N ASP 41 15.818 54.973 20.676 1.00 28.70 N ATOM 180 CA ASP 41 17.192 55.370 20.741 1.00 28.70 C ATOM 181 CB ASP 41 17.805 55.172 22.139 1.00 28.70 C ATOM 182 CG ASP 41 17.228 56.220 23.078 1.00 28.70 C ATOM 183 OD1 ASP 41 16.737 57.267 22.574 1.00 28.70 O ATOM 184 OD2 ASP 41 17.271 55.987 24.315 1.00 28.70 O ATOM 185 C ASP 41 17.974 54.523 19.796 1.00 28.70 C ATOM 186 O ASP 41 18.815 55.024 19.052 1.00 28.70 O ATOM 187 N ALA 42 17.710 53.205 19.798 1.00 31.86 N ATOM 188 CA ALA 42 18.467 52.320 18.965 1.00 31.86 C ATOM 189 CB ALA 42 18.093 50.845 19.182 1.00 31.86 C ATOM 190 C ALA 42 18.228 52.638 17.524 1.00 31.86 C ATOM 191 O ALA 42 19.167 52.722 16.732 1.00 31.86 O ATOM 192 N GLY 43 16.956 52.849 17.152 1.00 17.87 N ATOM 193 CA GLY 43 16.632 53.076 15.776 1.00 17.87 C ATOM 194 C GLY 43 17.268 54.344 15.309 1.00 17.87 C ATOM 195 O GLY 43 17.775 54.417 14.190 1.00 17.87 O ATOM 196 N ILE 44 17.248 55.382 16.161 1.00 35.39 N ATOM 197 CA ILE 44 17.748 56.668 15.777 1.00 35.39 C ATOM 198 CB ILE 44 17.580 57.697 16.857 1.00 35.39 C ATOM 199 CG1 ILE 44 16.087 57.899 17.156 1.00 35.39 C ATOM 200 CG2 ILE 44 18.307 58.982 16.421 1.00 35.39 C ATOM 201 CD1 ILE 44 15.821 58.670 18.445 1.00 35.39 C ATOM 202 C ILE 44 19.206 56.574 15.491 1.00 35.39 C ATOM 203 O ILE 44 19.671 57.059 14.462 1.00 35.39 O ATOM 204 N ARG 45 19.968 55.918 16.380 1.00 37.71 N ATOM 205 CA ARG 45 21.384 55.889 16.182 1.00 37.71 C ATOM 206 CB ARG 45 22.152 55.192 17.318 1.00 37.71 C ATOM 207 CG ARG 45 22.137 55.988 18.627 1.00 37.71 C ATOM 208 CD ARG 45 23.110 55.462 19.685 1.00 37.71 C ATOM 209 NE ARG 45 22.659 54.099 20.085 1.00 37.71 N ATOM 210 CZ ARG 45 21.792 53.937 21.128 1.00 37.71 C ATOM 211 NH1 ARG 45 21.324 55.021 21.810 1.00 37.71 N ATOM 212 NH2 ARG 45 21.406 52.680 21.496 1.00 37.71 N ATOM 213 C ARG 45 21.682 55.178 14.909 1.00 37.71 C ATOM 214 O ARG 45 22.551 55.599 14.146 1.00 37.71 O ATOM 215 N THR 46 20.959 54.080 14.629 1.00109.90 N ATOM 216 CA THR 46 21.297 53.358 13.445 1.00109.90 C ATOM 217 CB THR 46 20.548 52.059 13.296 1.00109.90 C ATOM 218 OG1 THR 46 21.144 51.281 12.272 1.00109.90 O ATOM 219 CG2 THR 46 19.071 52.324 12.966 1.00109.90 C ATOM 220 C THR 46 21.061 54.217 12.240 1.00109.90 C ATOM 221 O THR 46 21.930 54.331 11.379 1.00109.90 O ATOM 222 N LEU 47 19.902 54.896 12.173 1.00 36.95 N ATOM 223 CA LEU 47 19.557 55.656 11.006 1.00 36.95 C ATOM 224 CB LEU 47 18.141 56.252 11.073 1.00 36.95 C ATOM 225 CG LEU 47 17.035 55.180 11.114 1.00 36.95 C ATOM 226 CD1 LEU 47 15.637 55.817 11.072 1.00 36.95 C ATOM 227 CD2 LEU 47 17.242 54.120 10.020 1.00 36.95 C ATOM 228 C LEU 47 20.528 56.774 10.835 1.00 36.95 C ATOM 229 O LEU 47 20.925 57.092 9.715 1.00 36.95 O ATOM 230 N VAL 48 20.944 57.404 11.944 1.00 25.29 N ATOM 231 CA VAL 48 21.845 58.510 11.836 1.00 25.29 C ATOM 232 CB VAL 48 22.231 59.077 13.170 1.00 25.29 C ATOM 233 CG1 VAL 48 23.246 60.211 12.943 1.00 25.29 C ATOM 234 CG2 VAL 48 20.955 59.503 13.914 1.00 25.29 C ATOM 235 C VAL 48 23.099 58.023 11.185 1.00 25.29 C ATOM 236 O VAL 48 23.634 58.677 10.292 1.00 25.29 O ATOM 237 N MET 49 23.603 56.850 11.616 1.00 37.42 N ATOM 238 CA MET 49 24.830 56.349 11.069 1.00 37.42 C ATOM 239 CB MET 49 25.315 55.053 11.738 1.00 37.42 C ATOM 240 CG MET 49 25.801 55.252 13.173 1.00 37.42 C ATOM 241 SD MET 49 26.367 53.727 13.978 1.00 37.42 S ATOM 242 CE MET 49 24.690 53.153 14.364 1.00 37.42 C ATOM 243 C MET 49 24.669 56.053 9.611 1.00 37.42 C ATOM 244 O MET 49 25.525 56.416 8.805 1.00 37.42 O ATOM 245 N LEU 50 23.558 55.410 9.215 1.00 89.26 N ATOM 246 CA LEU 50 23.439 55.074 7.826 1.00 89.26 C ATOM 247 CB LEU 50 22.179 54.266 7.467 1.00 89.26 C ATOM 248 CG LEU 50 22.249 52.773 7.836 1.00 89.26 C ATOM 249 CD1 LEU 50 22.336 52.541 9.350 1.00 89.26 C ATOM 250 CD2 LEU 50 21.099 52.001 7.175 1.00 89.26 C ATOM 251 C LEU 50 23.415 56.318 6.998 1.00 89.26 C ATOM 252 O LEU 50 24.026 56.369 5.933 1.00 89.26 O ATOM 253 N ASP 51 22.709 57.359 7.467 1.00 43.06 N ATOM 254 CA ASP 51 22.565 58.555 6.689 1.00 43.06 C ATOM 255 CB ASP 51 21.737 59.618 7.436 1.00 43.06 C ATOM 256 CG ASP 51 21.535 60.840 6.551 1.00 43.06 C ATOM 257 OD1 ASP 51 21.873 60.773 5.340 1.00 43.06 O ATOM 258 OD2 ASP 51 21.033 61.867 7.086 1.00 43.06 O ATOM 259 C ASP 51 23.904 59.159 6.427 1.00 43.06 C ATOM 260 O ASP 51 24.257 59.421 5.277 1.00 43.06 O ATOM 261 N GLU 52 24.704 59.369 7.488 1.00 47.65 N ATOM 262 CA GLU 52 25.949 60.047 7.291 1.00 47.65 C ATOM 263 CB GLU 52 26.717 60.351 8.587 1.00 47.65 C ATOM 264 CG GLU 52 27.927 61.246 8.307 1.00 47.65 C ATOM 265 CD GLU 52 28.743 61.428 9.576 1.00 47.65 C ATOM 266 OE1 GLU 52 28.533 60.646 10.542 1.00 47.65 O ATOM 267 OE2 GLU 52 29.598 62.352 9.591 1.00 47.65 O ATOM 268 C GLU 52 26.866 59.217 6.460 1.00 47.65 C ATOM 269 O GLU 52 27.489 59.710 5.522 1.00 47.65 O ATOM 270 N GLN 53 26.943 57.917 6.777 1.00 96.13 N ATOM 271 CA GLN 53 27.894 57.060 6.142 1.00 96.13 C ATOM 272 CB GLN 53 27.927 55.664 6.780 1.00 96.13 C ATOM 273 CG GLN 53 26.605 54.910 6.658 1.00 96.13 C ATOM 274 CD GLN 53 26.753 53.570 7.365 1.00 96.13 C ATOM 275 OE1 GLN 53 26.025 52.624 7.083 1.00 96.13 O ATOM 276 NE2 GLN 53 27.715 53.491 8.326 1.00 96.13 N ATOM 277 C GLN 53 27.622 56.935 4.676 1.00 96.13 C ATOM 278 O GLN 53 28.554 56.951 3.874 1.00 96.13 O ATOM 279 N GLY 54 26.345 56.825 4.270 1.00 21.96 N ATOM 280 CA GLY 54 26.056 56.624 2.878 1.00 21.96 C ATOM 281 C GLY 54 26.526 57.799 2.082 1.00 21.96 C ATOM 282 O GLY 54 27.097 57.642 1.003 1.00 21.96 O ATOM 283 N GLU 55 26.287 59.017 2.596 1.00 71.56 N ATOM 284 CA GLU 55 26.649 60.195 1.865 1.00 71.56 C ATOM 285 CB GLU 55 26.226 61.486 2.586 1.00 71.56 C ATOM 286 CG GLU 55 24.716 61.613 2.782 1.00 71.56 C ATOM 287 CD GLU 55 24.071 61.663 1.408 1.00 71.56 C ATOM 288 OE1 GLU 55 24.825 61.715 0.400 1.00 71.56 O ATOM 289 OE2 GLU 55 22.812 61.644 1.351 1.00 71.56 O ATOM 290 C GLU 55 28.133 60.224 1.730 1.00 71.56 C ATOM 291 O GLU 55 28.670 60.554 0.673 1.00 71.56 O ATOM 292 N GLN 56 28.835 59.858 2.816 1.00 43.51 N ATOM 293 CA GLN 56 30.264 59.890 2.843 1.00 43.51 C ATOM 294 CB GLN 56 30.833 59.518 4.221 1.00 43.51 C ATOM 295 CG GLN 56 30.507 60.552 5.298 1.00 43.51 C ATOM 296 CD GLN 56 31.105 60.067 6.608 1.00 43.51 C ATOM 297 OE1 GLN 56 30.817 58.961 7.063 1.00 43.51 O ATOM 298 NE2 GLN 56 31.964 60.918 7.232 1.00 43.51 N ATOM 299 C GLN 56 30.799 58.917 1.845 1.00 43.51 C ATOM 300 O GLN 56 31.782 59.199 1.165 1.00 43.51 O ATOM 301 N LEU 57 30.158 57.742 1.718 1.00115.67 N ATOM 302 CA LEU 57 30.657 56.729 0.835 1.00115.67 C ATOM 303 CB LEU 57 29.809 55.441 0.889 1.00115.67 C ATOM 304 CG LEU 57 30.370 54.255 0.077 1.00115.67 C ATOM 305 CD1 LEU 57 30.286 54.482 -1.442 1.00115.67 C ATOM 306 CD2 LEU 57 31.789 53.899 0.547 1.00115.67 C ATOM 307 C LEU 57 30.624 57.266 -0.558 1.00115.67 C ATOM 308 O LEU 57 31.544 57.045 -1.345 1.00115.67 O ATOM 309 N ASP 58 29.554 57.997 -0.909 1.00 37.84 N ATOM 310 CA ASP 58 29.461 58.486 -2.250 1.00 37.84 C ATOM 311 CB ASP 58 28.177 59.305 -2.488 1.00 37.84 C ATOM 312 CG ASP 58 26.974 58.374 -2.374 1.00 37.84 C ATOM 313 OD1 ASP 58 27.165 57.136 -2.514 1.00 37.84 O ATOM 314 OD2 ASP 58 25.847 58.889 -2.143 1.00 37.84 O ATOM 315 C ASP 58 30.624 59.398 -2.490 1.00 37.84 C ATOM 316 O ASP 58 31.304 59.308 -3.512 1.00 37.84 O ATOM 317 N ARG 59 30.896 60.287 -1.520 1.00118.19 N ATOM 318 CA ARG 59 31.938 61.257 -1.671 1.00118.19 C ATOM 319 CB ARG 59 32.053 62.194 -0.457 1.00118.19 C ATOM 320 CG ARG 59 30.770 62.951 -0.109 1.00118.19 C ATOM 321 CD ARG 59 30.971 63.946 1.036 1.00118.19 C ATOM 322 NE ARG 59 29.633 64.437 1.470 1.00118.19 N ATOM 323 CZ ARG 59 28.942 63.775 2.444 1.00118.19 C ATOM 324 NH1 ARG 59 29.454 62.638 3.003 1.00118.19 N ATOM 325 NH2 ARG 59 27.739 64.251 2.876 1.00118.19 N ATOM 326 C ARG 59 33.251 60.549 -1.782 1.00118.19 C ATOM 327 O ARG 59 34.076 60.892 -2.627 1.00118.19 O ATOM 328 N VAL 60 33.470 59.524 -0.936 1.00 92.53 N ATOM 329 CA VAL 60 34.747 58.871 -0.894 1.00 92.53 C ATOM 330 CB VAL 60 34.880 57.839 0.192 1.00 92.53 C ATOM 331 CG1 VAL 60 33.949 56.653 -0.096 1.00 92.53 C ATOM 332 CG2 VAL 60 36.361 57.438 0.276 1.00 92.53 C ATOM 333 C VAL 60 35.049 58.209 -2.197 1.00 92.53 C ATOM 334 O VAL 60 36.175 58.291 -2.684 1.00 92.53 O ATOM 335 N GLU 61 34.062 57.537 -2.816 1.00 34.74 N ATOM 336 CA GLU 61 34.376 56.838 -4.027 1.00 34.74 C ATOM 337 CB GLU 61 33.190 56.029 -4.585 1.00 34.74 C ATOM 338 CG GLU 61 33.561 55.110 -5.754 1.00 34.74 C ATOM 339 CD GLU 61 32.345 54.256 -6.086 1.00 34.74 C ATOM 340 OE1 GLU 61 31.795 53.622 -5.146 1.00 34.74 O ATOM 341 OE2 GLU 61 31.948 54.228 -7.282 1.00 34.74 O ATOM 342 C GLU 61 34.795 57.834 -5.055 1.00 34.74 C ATOM 343 O GLU 61 35.768 57.630 -5.781 1.00 34.74 O ATOM 344 N GLU 62 34.072 58.964 -5.124 1.00 35.52 N ATOM 345 CA GLU 62 34.375 59.961 -6.103 1.00 35.52 C ATOM 346 CB GLU 62 33.334 61.094 -6.123 1.00 35.52 C ATOM 347 CG GLU 62 31.988 60.623 -6.684 1.00 35.52 C ATOM 348 CD GLU 62 31.018 61.793 -6.685 1.00 35.52 C ATOM 349 OE1 GLU 62 30.432 62.073 -5.605 1.00 35.52 O ATOM 350 OE2 GLU 62 30.846 62.419 -7.766 1.00 35.52 O ATOM 351 C GLU 62 35.739 60.520 -5.826 1.00 35.52 C ATOM 352 O GLU 62 36.523 60.761 -6.744 1.00 35.52 O ATOM 353 N GLY 63 36.064 60.718 -4.537 1.00 19.29 N ATOM 354 CA GLY 63 37.335 61.263 -4.160 1.00 19.29 C ATOM 355 C GLY 63 38.416 60.328 -4.602 1.00 19.29 C ATOM 356 O GLY 63 39.491 60.762 -5.013 1.00 19.29 O ATOM 357 N MET 64 38.157 59.010 -4.515 1.00 33.59 N ATOM 358 CA MET 64 39.142 58.027 -4.861 1.00 33.59 C ATOM 359 CB MET 64 38.605 56.595 -4.701 1.00 33.59 C ATOM 360 CG MET 64 38.125 56.276 -3.281 1.00 33.59 C ATOM 361 SD MET 64 39.407 56.340 -1.991 1.00 33.59 S ATOM 362 CE MET 64 39.517 58.152 -1.917 1.00 33.59 C ATOM 363 C MET 64 39.472 58.220 -6.303 1.00 33.59 C ATOM 364 O MET 64 40.636 58.160 -6.700 1.00 33.59 O ATOM 365 N ASN 65 38.438 58.470 -7.123 1.00 26.55 N ATOM 366 CA ASN 65 38.643 58.666 -8.526 1.00 26.55 C ATOM 367 CB ASN 65 37.328 58.883 -9.298 1.00 26.55 C ATOM 368 CG ASN 65 36.582 57.557 -9.309 1.00 26.55 C ATOM 369 OD1 ASN 65 37.175 56.503 -9.080 1.00 26.55 O ATOM 370 ND2 ASN 65 35.251 57.595 -9.588 1.00 26.55 N ATOM 371 C ASN 65 39.483 59.891 -8.707 1.00 26.55 C ATOM 372 O ASN 65 40.382 59.924 -9.544 1.00 26.55 O ATOM 373 N HIS 66 39.216 60.934 -7.903 1.00 40.99 N ATOM 374 CA HIS 66 39.907 62.186 -8.027 1.00 40.99 C ATOM 375 ND1 HIS 66 41.073 65.041 -6.492 1.00 40.99 N ATOM 376 CG HIS 66 39.937 64.595 -7.134 1.00 40.99 C ATOM 377 CB HIS 66 39.376 63.213 -7.005 1.00 40.99 C ATOM 378 NE2 HIS 66 40.288 66.762 -7.659 1.00 40.99 N ATOM 379 CD2 HIS 66 39.474 65.662 -7.845 1.00 40.99 C ATOM 380 CE1 HIS 66 41.235 66.342 -6.839 1.00 40.99 C ATOM 381 C HIS 66 41.373 61.984 -7.776 1.00 40.99 C ATOM 382 O HIS 66 42.212 62.464 -8.538 1.00 40.99 O ATOM 383 N ILE 67 41.720 61.244 -6.708 1.00 31.15 N ATOM 384 CA ILE 67 43.095 61.059 -6.333 1.00 31.15 C ATOM 385 CB ILE 67 43.239 60.266 -5.063 1.00 31.15 C ATOM 386 CG1 ILE 67 42.606 61.022 -3.884 1.00 31.15 C ATOM 387 CG2 ILE 67 44.726 59.937 -4.853 1.00 31.15 C ATOM 388 CD1 ILE 67 42.470 60.174 -2.620 1.00 31.15 C ATOM 389 C ILE 67 43.816 60.317 -7.410 1.00 31.15 C ATOM 390 O ILE 67 44.920 60.691 -7.804 1.00 31.15 O ATOM 391 N ASN 68 43.193 59.249 -7.935 1.00 46.66 N ATOM 392 CA ASN 68 43.866 58.450 -8.914 1.00 46.66 C ATOM 393 CB ASN 68 43.002 57.295 -9.451 1.00 46.66 C ATOM 394 CG ASN 68 43.817 56.526 -10.481 1.00 46.66 C ATOM 395 OD1 ASN 68 44.973 56.168 -10.242 1.00 46.66 O ATOM 396 ND2 ASN 68 43.207 56.274 -11.669 1.00 46.66 N ATOM 397 C ASN 68 44.210 59.296 -10.089 1.00 46.66 C ATOM 398 O ASN 68 45.349 59.281 -10.558 1.00 46.66 O ATOM 399 N GLN 69 43.240 60.082 -10.586 1.00 87.81 N ATOM 400 CA GLN 69 43.519 60.815 -11.778 1.00 87.81 C ATOM 401 CB GLN 69 42.301 61.550 -12.372 1.00 87.81 C ATOM 402 CG GLN 69 41.746 62.689 -11.517 1.00 87.81 C ATOM 403 CD GLN 69 40.586 63.304 -12.286 1.00 87.81 C ATOM 404 OE1 GLN 69 40.633 64.464 -12.688 1.00 87.81 O ATOM 405 NE2 GLN 69 39.511 62.496 -12.510 1.00 87.81 N ATOM 406 C GLN 69 44.583 61.834 -11.520 1.00 87.81 C ATOM 407 O GLN 69 45.484 62.006 -12.337 1.00 87.81 O ATOM 408 N ASP 70 44.521 62.526 -10.369 1.00 41.41 N ATOM 409 CA ASP 70 45.457 63.584 -10.124 1.00 41.41 C ATOM 410 CB ASP 70 45.170 64.376 -8.838 1.00 41.41 C ATOM 411 CG ASP 70 43.962 65.265 -9.082 1.00 41.41 C ATOM 412 OD1 ASP 70 43.300 65.107 -10.141 1.00 41.41 O ATOM 413 OD2 ASP 70 43.694 66.128 -8.204 1.00 41.41 O ATOM 414 C ASP 70 46.855 63.063 -10.020 1.00 41.41 C ATOM 415 O ASP 70 47.782 63.669 -10.553 1.00 41.41 O ATOM 416 N MET 71 47.059 61.921 -9.347 1.00 65.19 N ATOM 417 CA MET 71 48.400 61.448 -9.156 1.00 65.19 C ATOM 418 CB MET 71 48.452 60.210 -8.252 1.00 65.19 C ATOM 419 CG MET 71 48.023 60.517 -6.816 1.00 65.19 C ATOM 420 SD MET 71 49.150 61.624 -5.913 1.00 65.19 S ATOM 421 CE MET 71 48.716 63.162 -6.781 1.00 65.19 C ATOM 422 C MET 71 49.013 61.102 -10.472 1.00 65.19 C ATOM 423 O MET 71 50.190 61.370 -10.708 1.00 65.19 O ATOM 424 N LYS 72 48.213 60.506 -11.364 1.00123.11 N ATOM 425 CA LYS 72 48.705 60.069 -12.636 1.00123.11 C ATOM 426 CB LYS 72 47.563 59.466 -13.470 1.00123.11 C ATOM 427 CG LYS 72 47.996 58.529 -14.594 1.00123.11 C ATOM 428 CD LYS 72 46.817 57.821 -15.270 1.00123.11 C ATOM 429 CE LYS 72 45.870 57.113 -14.297 1.00123.11 C ATOM 430 NZ LYS 72 46.521 55.904 -13.746 1.00123.11 N ATOM 431 C LYS 72 49.216 61.275 -13.361 1.00123.11 C ATOM 432 O LYS 72 50.300 61.260 -13.943 1.00123.11 O ATOM 433 N GLU 73 48.425 62.364 -13.329 1.00 76.30 N ATOM 434 CA GLU 73 48.749 63.576 -14.017 1.00 76.30 C ATOM 435 CB GLU 73 47.605 64.604 -13.974 1.00 76.30 C ATOM 436 CG GLU 73 47.788 65.748 -14.971 1.00 76.30 C ATOM 437 CD GLU 73 47.530 65.192 -16.366 1.00 76.30 C ATOM 438 OE1 GLU 73 48.130 64.138 -16.706 1.00 76.30 O ATOM 439 OE2 GLU 73 46.724 65.813 -17.109 1.00 76.30 O ATOM 440 C GLU 73 49.960 64.201 -13.395 1.00 76.30 C ATOM 441 O GLU 73 50.809 64.744 -14.099 1.00 76.30 O ATOM 442 N ALA 74 50.078 64.132 -12.055 1.00 26.59 N ATOM 443 CA ALA 74 51.168 64.768 -11.369 1.00 26.59 C ATOM 444 CB ALA 74 51.099 64.581 -9.844 1.00 26.59 C ATOM 445 C ALA 74 52.452 64.173 -11.842 1.00 26.59 C ATOM 446 O ALA 74 53.422 64.889 -12.095 1.00 26.59 O ATOM 447 N GLU 75 52.492 62.838 -11.996 1.00 74.96 N ATOM 448 CA GLU 75 53.714 62.230 -12.427 1.00 74.96 C ATOM 449 CB GLU 75 53.635 60.698 -12.545 1.00 74.96 C ATOM 450 CG GLU 75 54.846 60.087 -13.260 1.00 74.96 C ATOM 451 CD GLU 75 56.084 60.275 -12.394 1.00 74.96 C ATOM 452 OE1 GLU 75 55.927 60.361 -11.146 1.00 74.96 O ATOM 453 OE2 GLU 75 57.203 60.335 -12.971 1.00 74.96 O ATOM 454 C GLU 75 54.047 62.751 -13.784 1.00 74.96 C ATOM 455 O GLU 75 55.198 63.078 -14.071 1.00 74.96 O ATOM 456 N LYS 76 53.029 62.862 -14.653 1.00 56.37 N ATOM 457 CA LYS 76 53.267 63.287 -16.000 1.00 56.37 C ATOM 458 CB LYS 76 51.980 63.326 -16.840 1.00 56.37 C ATOM 459 CG LYS 76 52.205 63.679 -18.312 1.00 56.37 C ATOM 460 CD LYS 76 50.997 63.360 -19.198 1.00 56.37 C ATOM 461 CE LYS 76 51.166 63.786 -20.657 1.00 56.37 C ATOM 462 NZ LYS 76 51.122 65.261 -20.759 1.00 56.37 N ATOM 463 C LYS 76 53.837 64.668 -15.980 1.00 56.37 C ATOM 464 O LYS 76 54.782 64.962 -16.709 1.00 56.37 O ATOM 465 N ASN 77 53.283 65.552 -15.127 1.00 38.44 N ATOM 466 CA ASN 77 53.694 66.928 -15.077 1.00 38.44 C ATOM 467 CB ASN 77 52.866 67.755 -14.080 1.00 38.44 C ATOM 468 CG ASN 77 51.432 67.788 -14.582 1.00 38.44 C ATOM 469 OD1 ASN 77 51.177 68.055 -15.755 1.00 38.44 O ATOM 470 ND2 ASN 77 50.467 67.492 -13.670 1.00 38.44 N ATOM 471 C ASN 77 55.122 67.032 -14.644 1.00 38.44 C ATOM 472 O ASN 77 55.894 67.797 -15.220 1.00 38.44 O ATOM 473 N LEU 78 55.523 66.260 -13.618 1.00 34.85 N ATOM 474 CA LEU 78 56.864 66.388 -13.138 1.00 34.85 C ATOM 475 CB LEU 78 57.160 65.462 -11.944 1.00 34.85 C ATOM 476 CG LEU 78 56.357 65.810 -10.671 1.00 34.85 C ATOM 477 CD1 LEU 78 56.704 64.854 -9.520 1.00 34.85 C ATOM 478 CD2 LEU 78 56.536 67.284 -10.270 1.00 34.85 C ATOM 479 C LEU 78 57.780 66.013 -14.255 1.00 34.85 C ATOM 480 O LEU 78 58.771 66.691 -14.524 1.00 34.85 O ATOM 481 N LYS 79 57.434 64.922 -14.955 1.00104.89 N ATOM 482 CA LYS 79 58.219 64.396 -16.029 1.00104.89 C ATOM 483 CB LYS 79 57.575 63.113 -16.576 1.00104.89 C ATOM 484 CG LYS 79 58.514 62.170 -17.321 1.00104.89 C ATOM 485 CD LYS 79 57.860 60.816 -17.606 1.00104.89 C ATOM 486 CE LYS 79 57.279 60.139 -16.363 1.00104.89 C ATOM 487 NZ LYS 79 56.322 59.086 -16.770 1.00104.89 N ATOM 488 C LYS 79 58.264 65.415 -17.135 1.00104.89 C ATOM 489 O LYS 79 59.305 65.635 -17.751 1.00104.89 O ATOM 490 N ASP 80 57.117 66.071 -17.399 1.00 35.03 N ATOM 491 CA ASP 80 56.959 67.031 -18.458 1.00 35.03 C ATOM 492 CB ASP 80 55.511 67.551 -18.539 1.00 35.03 C ATOM 493 CG ASP 80 55.323 68.379 -19.803 1.00 35.03 C ATOM 494 OD1 ASP 80 56.001 68.077 -20.822 1.00 35.03 O ATOM 495 OD2 ASP 80 54.498 69.332 -19.761 1.00 35.03 O ATOM 496 C ASP 80 57.849 68.204 -18.197 1.00 35.03 C ATOM 497 O ASP 80 58.459 68.744 -19.118 1.00 35.03 O ATOM 498 N LEU 81 57.948 68.626 -16.924 1.00130.36 N ATOM 499 CA LEU 81 58.754 69.759 -16.570 1.00130.36 C ATOM 500 CB LEU 81 58.670 70.123 -15.078 1.00130.36 C ATOM 501 CG LEU 81 57.286 70.630 -14.640 1.00130.36 C ATOM 502 CD1 LEU 81 57.284 70.997 -13.149 1.00130.36 C ATOM 503 CD2 LEU 81 56.802 71.784 -15.534 1.00130.36 C ATOM 504 C LEU 81 60.184 69.449 -16.860 1.00130.36 C ATOM 505 O LEU 81 60.931 70.312 -17.319 1.00130.36 O ATOM 506 N GLY 82 60.598 68.192 -16.616 1.00 17.03 N ATOM 507 CA GLY 82 61.979 67.848 -16.764 1.00 17.03 C ATOM 508 C GLY 82 62.389 68.149 -18.166 1.00 17.03 C ATOM 509 O GLY 82 63.466 68.695 -18.400 1.00 17.03 O ATOM 510 N LYS 83 61.539 67.804 -19.148 1.00 68.25 N ATOM 511 CA LYS 83 61.914 68.087 -20.500 1.00 68.25 C ATOM 512 CB LYS 83 61.595 66.939 -21.474 1.00 68.25 C ATOM 513 CG LYS 83 62.485 65.714 -21.242 1.00 68.25 C ATOM 514 CD LYS 83 62.038 64.454 -21.984 1.00 68.25 C ATOM 515 CE LYS 83 62.943 63.243 -21.737 1.00 68.25 C ATOM 516 NZ LYS 83 62.680 62.675 -20.395 1.00 68.25 N ATOM 517 C LYS 83 61.169 69.339 -20.960 1.00 68.25 C ATOM 518 O LYS 83 60.448 69.948 -20.130 1.00 68.25 O ATOM 519 OXT LYS 83 61.330 69.711 -22.155 1.00 68.25 O