EXPDTA UNI-EID_sfst_AL2-scwrl MODEL 1 REMARK 44 REMARK 44 model 1 is called UNI-EID_sfst_AL2-scwrl ATOM 1 C ALA 58 -7.952 60.633 3.175 1.00 0.00 ATOM 2 N VAL A 59 -8.888 61.402 2.693 1.00 0.00 ATOM 3 CA VAL A 59 -9.822 60.943 1.679 1.00 0.00 ATOM 4 CB VAL A 59 -10.904 61.999 1.389 1.00 0.00 ATOM 5 CG1 VAL A 59 -11.746 61.585 0.192 1.00 0.00 ATOM 6 CG2 VAL A 59 -11.823 62.164 2.590 1.00 0.00 ATOM 7 O VAL A 59 -9.362 59.638 -0.260 1.00 0.00 ATOM 8 C VAL A 59 -9.094 60.650 0.375 1.00 0.00 ATOM 9 N LEU A 60 -8.160 61.523 -0.008 1.00 0.00 ATOM 10 CA LEU A 60 -7.390 61.339 -1.242 1.00 0.00 ATOM 11 CB LEU A 60 -6.456 62.528 -1.473 1.00 0.00 ATOM 12 CG LEU A 60 -7.126 63.861 -1.813 1.00 0.00 ATOM 13 CD1 LEU A 60 -6.101 64.984 -1.851 1.00 0.00 ATOM 14 CD2 LEU A 60 -7.805 63.790 -3.172 1.00 0.00 ATOM 15 O LEU A 60 -6.312 59.405 -2.207 1.00 0.00 ATOM 16 C LEU A 60 -6.537 60.072 -1.178 1.00 0.00 ATOM 17 N THR A 61 -6.062 59.753 0.030 1.00 0.00 ATOM 18 CA THR A 61 -5.236 58.574 0.238 1.00 0.00 ATOM 19 CB THR A 61 -4.556 58.598 1.619 1.00 0.00 ATOM 20 CG2 THR A 61 -3.730 57.338 1.829 1.00 0.00 ATOM 21 OG1 THR A 61 -3.693 59.738 1.710 1.00 0.00 ATOM 22 O THR A 61 -5.727 56.324 -0.413 1.00 0.00 ATOM 23 C THR A 61 -6.132 57.348 0.143 1.00 0.00 ATOM 24 N VAL A 62 -7.352 57.458 0.667 1.00 0.00 ATOM 25 CA VAL A 62 -8.288 56.351 0.570 1.00 0.00 ATOM 26 CB VAL A 62 -9.582 56.635 1.355 1.00 0.00 ATOM 27 CG1 VAL A 62 -10.616 55.553 1.088 1.00 0.00 ATOM 28 CG2 VAL A 62 -9.301 56.673 2.850 1.00 0.00 ATOM 29 O VAL A 62 -8.638 54.965 -1.345 1.00 0.00 ATOM 30 C VAL A 62 -8.660 56.109 -0.882 1.00 0.00 ATOM 31 N ALA A 63 -8.972 57.178 -1.608 1.00 0.00 ATOM 32 CA ALA A 63 -9.289 57.049 -3.017 1.00 0.00 ATOM 33 CB ALA A 63 -9.472 58.421 -3.647 1.00 0.00 ATOM 34 O ALA A 63 -8.338 55.343 -4.472 1.00 0.00 ATOM 35 C ALA A 63 -8.128 56.312 -3.722 1.00 0.00 ATOM 36 N ALA A 64 -6.905 56.772 -3.462 1.00 0.00 ATOM 37 CA ALA A 64 -5.712 56.227 -4.105 1.00 0.00 ATOM 38 CB ALA A 64 -4.467 56.946 -3.608 1.00 0.00 ATOM 39 O ALA A 64 -5.206 53.952 -4.671 1.00 0.00 ATOM 40 C ALA A 64 -5.554 54.733 -3.801 1.00 0.00 ATOM 41 N GLU A 65 -5.860 54.346 -2.568 1.00 0.00 ATOM 42 CA GLU A 65 -5.826 52.953 -2.154 1.00 0.00 ATOM 43 CB GLU A 65 -6.330 52.809 -0.717 1.00 0.00 ATOM 44 CG GLU A 65 -6.287 51.386 -0.183 1.00 0.00 ATOM 45 CD GLU A 65 -6.761 51.287 1.253 1.00 0.00 ATOM 46 OE1 GLU A 65 -7.112 52.335 1.836 1.00 0.00 ATOM 47 OE2 GLU A 65 -6.782 50.163 1.796 1.00 0.00 ATOM 48 O GLU A 65 -6.258 51.017 -3.467 1.00 0.00 ATOM 49 C GLU A 65 -6.700 52.073 -3.042 1.00 0.00 ATOM 50 N LEU A 66 -7.919 52.530 -3.331 1.00 0.00 ATOM 51 CA LEU A 66 -8.820 51.842 -4.247 1.00 0.00 ATOM 52 CB LEU A 66 -10.215 52.470 -4.199 1.00 0.00 ATOM 53 CG LEU A 66 -11.263 51.864 -5.135 1.00 0.00 ATOM 54 CD1 LEU A 66 -11.516 50.406 -4.787 1.00 0.00 ATOM 55 CD2 LEU A 66 -12.581 52.615 -5.024 1.00 0.00 ATOM 56 O LEU A 66 -8.126 50.863 -6.325 1.00 0.00 ATOM 57 C LEU A 66 -8.343 51.904 -5.695 1.00 0.00 ATOM 58 N GLY A 67 -8.184 53.124 -6.214 1.00 0.00 ATOM 59 CA GLY A 67 -7.840 53.360 -7.630 1.00 0.00 ATOM 60 O GLY A 67 -6.511 52.221 -9.227 1.00 0.00 ATOM 61 C GLY A 67 -6.578 52.659 -8.101 1.00 0.00 ATOM 62 N ASN A 68 -5.558 52.598 -7.256 1.00 0.00 ATOM 63 CA ASN A 68 -4.277 52.032 -7.674 1.00 0.00 ATOM 64 CB ASN A 68 -3.180 52.388 -6.668 1.00 0.00 ATOM 65 CG ASN A 68 -2.781 53.849 -6.735 1.00 0.00 ATOM 66 ND2 ASN A 68 -2.173 54.344 -5.663 1.00 0.00 ATOM 67 OD1 ASN A 68 -3.017 54.522 -7.738 1.00 0.00 ATOM 68 O ASN A 68 -3.524 49.908 -8.451 1.00 0.00 ATOM 69 C ASN A 68 -4.342 50.506 -7.777 1.00 0.00 ATOM 70 N ASN A 69 -5.298 49.885 -7.076 1.00 0.00 ATOM 71 CA ASN A 69 -5.374 48.439 -6.975 1.00 0.00 ATOM 72 CB ASN A 69 -4.795 47.783 -8.230 1.00 0.00 ATOM 73 CG ASN A 69 -5.626 48.058 -9.468 1.00 0.00 ATOM 74 ND2 ASN A 69 -4.970 48.106 -10.621 1.00 0.00 ATOM 75 OD1 ASN A 69 -6.843 48.225 -9.385 1.00 0.00 ATOM 76 O ASN A 69 -4.597 46.653 -5.562 1.00 0.00 ATOM 77 C ASN A 69 -4.607 47.868 -5.785 1.00 0.00 ATOM 78 N ALA A 70 -3.962 48.735 -5.010 1.00 0.00 ATOM 79 CA ALA A 70 -3.221 48.298 -3.829 1.00 0.00 ATOM 80 CB ALA A 70 -2.574 49.489 -3.138 1.00 0.00 ATOM 81 O ALA A 70 -3.727 46.687 -2.132 1.00 0.00 ATOM 82 C ALA A 70 -4.133 47.619 -2.843 1.00 0.00 ATOM 83 N LEU A 71 -5.378 48.075 -2.803 1.00 0.00 ATOM 84 CA LEU A 71 -6.382 47.478 -1.920 1.00 0.00 ATOM 85 CB LEU A 71 -7.770 48.044 -2.227 1.00 0.00 ATOM 86 CG LEU A 71 -8.909 47.576 -1.318 1.00 0.00 ATOM 87 CD1 LEU A 71 -8.652 47.991 0.122 1.00 0.00 ATOM 88 CD2 LEU A 71 -10.232 48.184 -1.759 1.00 0.00 ATOM 89 O LEU A 71 -6.693 45.219 -1.138 1.00 0.00 ATOM 90 C LEU A 71 -6.446 45.937 -2.093 1.00 0.00 ATOM 91 N PRO A 72 -6.172 45.446 -3.299 1.00 0.00 ATOM 92 CA PRO A 72 -6.304 44.020 -3.590 1.00 0.00 ATOM 93 CB PRO A 72 -6.058 43.925 -5.097 1.00 0.00 ATOM 94 CG PRO A 72 -6.305 45.307 -5.603 1.00 0.00 ATOM 95 CD PRO A 72 -5.897 46.236 -4.495 1.00 0.00 ATOM 96 O PRO A 72 -5.443 41.939 -2.764 1.00 0.00 ATOM 97 C PRO A 72 -5.295 43.155 -2.823 1.00 0.00 ATOM 98 N PRO A 73 -4.272 43.765 -2.239 1.00 0.00 ATOM 99 CA PRO A 73 -3.296 42.972 -1.489 1.00 0.00 ATOM 100 CB PRO A 73 -1.961 43.292 -2.165 1.00 0.00 ATOM 101 CG PRO A 73 -2.071 44.730 -2.547 1.00 0.00 ATOM 102 CD PRO A 73 -3.511 44.955 -2.915 1.00 0.00 ATOM 103 O PRO A 73 -2.299 42.861 0.702 1.00 0.00 ATOM 104 C PRO A 73 -3.215 43.303 0.009 1.00 0.00 ATOM 105 N THR A 74 -4.169 44.078 0.515 1.00 0.00 ATOM 106 CA THR A 74 -4.342 44.171 1.939 1.00 0.00 ATOM 107 CB THR A 74 -5.387 45.239 2.312 1.00 0.00 ATOM 108 CG2 THR A 74 -5.539 45.330 3.823 1.00 0.00 ATOM 109 OG1 THR A 74 -4.971 46.515 1.810 1.00 0.00 ATOM 110 O THR A 74 -5.706 42.175 1.858 1.00 0.00 ATOM 111 C THR A 74 -4.816 42.790 2.442 1.00 0.00 ATOM 112 N LYS A 75 -4.224 42.314 3.525 1.00 0.00 ATOM 113 CA LYS A 75 -4.641 41.056 4.113 1.00 0.00 ATOM 114 CB LYS A 75 -3.700 40.659 5.252 1.00 0.00 ATOM 115 CG LYS A 75 -2.304 40.267 4.796 1.00 0.00 ATOM 116 CD LYS A 75 -1.427 39.879 5.975 1.00 0.00 ATOM 117 CE LYS A 75 -0.031 39.486 5.519 1.00 0.00 ATOM 118 NZ LYS A 75 0.841 39.105 6.665 1.00 0.00 ATOM 119 O LYS A 75 -6.360 42.179 5.345 1.00 0.00 ATOM 120 C LYS A 75 -6.066 41.208 4.666 1.00 0.00 ATOM 121 N PRO 76 -6.935 40.235 4.386 1.00 0.00 ATOM 122 CA PRO 76 -8.368 40.344 4.703 1.00 0.00 ATOM 123 C ASP 88 -9.410 39.712 9.757 1.00 0.00 ATOM 124 N ASP A 89 -8.171 40.353 9.228 1.00 0.00 ATOM 125 CA ASP A 89 -7.199 40.206 10.321 1.00 0.00 ATOM 126 CB ASP A 89 -5.902 39.580 9.804 1.00 0.00 ATOM 127 CG ASP A 89 -6.098 38.161 9.308 1.00 0.00 ATOM 128 OD1 ASP A 89 -6.686 37.347 10.051 1.00 0.00 ATOM 129 OD2 ASP A 89 -5.662 37.862 8.176 1.00 0.00 ATOM 130 O ASP A 89 -7.181 42.621 10.348 1.00 0.00 ATOM 131 C ASP A 89 -6.864 41.566 10.935 1.00 0.00 ATOM 132 N MET A 90 -6.216 41.534 12.103 1.00 0.00 ATOM 133 CA MET A 90 -5.728 42.753 12.742 1.00 0.00 ATOM 134 CB MET A 90 -5.110 42.433 14.105 1.00 0.00 ATOM 135 CG MET A 90 -6.117 41.995 15.156 1.00 0.00 ATOM 136 SD MET A 90 -5.337 41.502 16.704 1.00 0.00 ATOM 137 CE MET A 90 -4.713 43.077 17.286 1.00 0.00 ATOM 138 O MET A 90 -4.737 44.632 11.705 1.00 0.00 ATOM 139 C MET A 90 -4.680 43.419 11.895 1.00 0.00 ATOM 140 N ALA A 91 -3.706 42.628 11.428 1.00 0.00 ATOM 141 CA ALA A 91 -2.630 43.172 10.593 1.00 0.00 ATOM 142 CB ALA A 91 -1.730 42.053 10.092 1.00 0.00 ATOM 143 O ALA A 91 -2.770 44.981 9.044 1.00 0.00 ATOM 144 C ALA A 91 -3.220 43.895 9.401 1.00 0.00 ATOM 145 N ILE A 92 -4.272 43.306 8.844 1.00 0.00 ATOM 146 CA ILE A 92 -4.951 43.858 7.698 1.00 0.00 ATOM 147 CB ILE A 92 -6.039 42.903 7.173 1.00 0.00 ATOM 148 CG1 ILE A 92 -5.404 41.641 6.587 1.00 0.00 ATOM 149 CG2 ILE A 92 -6.860 43.579 6.085 1.00 0.00 ATOM 150 CD1 ILE A 92 -6.397 40.539 6.290 1.00 0.00 ATOM 151 O ILE A 92 -5.625 46.080 7.191 1.00 0.00 ATOM 152 C ILE A 92 -5.626 45.163 8.012 1.00 0.00 ATOM 153 N LEU A 93 -6.209 45.239 9.202 1.00 0.00 ATOM 154 CA LEU A 93 -6.915 46.424 9.645 1.00 0.00 ATOM 155 CB LEU A 93 -7.651 46.150 10.958 1.00 0.00 ATOM 156 CG LEU A 93 -8.842 45.194 10.881 1.00 0.00 ATOM 157 CD1 LEU A 93 -9.365 44.872 12.272 1.00 0.00 ATOM 158 CD2 LEU A 93 -9.977 45.812 10.078 1.00 0.00 ATOM 159 O LEU A 93 -6.136 48.706 9.526 1.00 0.00 ATOM 160 C LEU A 93 -5.884 47.526 9.849 1.00 0.00 ATOM 161 N ASN A 94 -4.721 47.136 10.367 1.00 0.00 ATOM 162 CA ASN A 94 -3.623 48.066 10.531 1.00 0.00 ATOM 163 CB ASN A 94 -2.448 47.389 11.240 1.00 0.00 ATOM 164 CG ASN A 94 -2.713 47.158 12.715 1.00 0.00 ATOM 165 ND2 ASN A 94 -1.962 46.239 13.312 1.00 0.00 ATOM 166 OD1 ASN A 94 -3.581 47.798 13.307 1.00 0.00 ATOM 167 O ASN A 94 -2.876 49.784 9.039 1.00 0.00 ATOM 168 C ASN A 94 -3.123 48.585 9.178 1.00 0.00 ATOM 169 N ASP A 95 -2.986 47.706 8.184 1.00 0.00 ATOM 170 CA ASP A 95 -2.568 48.132 6.846 1.00 0.00 ATOM 171 CB ASP A 95 -2.627 46.958 5.867 1.00 0.00 ATOM 172 CG ASP A 95 -1.518 45.951 6.097 1.00 0.00 ATOM 173 OD1 ASP A 95 -0.575 46.268 6.852 1.00 0.00 ATOM 174 OD2 ASP A 95 -1.590 44.845 5.521 1.00 0.00 ATOM 175 O ASP A 95 -3.001 50.256 5.799 1.00 0.00 ATOM 176 C ASP A 95 -3.476 49.236 6.324 1.00 0.00 ATOM 177 N LEU A 96 -4.778 49.026 6.474 1.00 0.00 ATOM 178 CA LEU A 96 -5.762 49.983 6.038 1.00 0.00 ATOM 179 CB LEU A 96 -7.171 49.503 6.393 1.00 0.00 ATOM 180 CG LEU A 96 -8.322 50.432 6.003 1.00 0.00 ATOM 181 CD1 LEU A 96 -8.370 50.625 4.495 1.00 0.00 ATOM 182 CD2 LEU A 96 -9.655 49.852 6.450 1.00 0.00 ATOM 183 O LEU A 96 -5.424 52.369 6.041 1.00 0.00 ATOM 184 C LEU A 96 -5.523 51.321 6.711 1.00 0.00 ATOM 185 N HIS A 97 -5.401 51.271 8.031 1.00 0.00 ATOM 186 CA HIS A 97 -5.239 52.462 8.847 1.00 0.00 ATOM 187 CB HIS A 97 -5.186 52.092 10.331 1.00 0.00 ATOM 188 CG HIS A 97 -6.496 51.620 10.882 1.00 0.00 ATOM 189 CD2 HIS A 97 -7.881 51.650 10.437 1.00 0.00 ATOM 190 ND1 HIS A 97 -6.604 50.979 12.097 1.00 0.00 ATOM 191 CE1 HIS A 97 -7.896 50.678 12.320 1.00 0.00 ATOM 192 NE2 HIS A 97 -8.668 51.079 11.329 1.00 0.00 ATOM 193 O HIS A 97 -3.940 54.402 8.328 1.00 0.00 ATOM 194 C HIS A 97 -3.949 53.184 8.485 1.00 0.00 ATOM 195 N THR A 98 -2.870 52.423 8.339 1.00 0.00 ATOM 196 CA THR A 98 -1.588 52.977 8.015 1.00 0.00 ATOM 197 CB THR A 98 -0.523 51.877 7.850 1.00 0.00 ATOM 198 CG2 THR A 98 0.817 52.486 7.466 1.00 0.00 ATOM 199 OG1 THR A 98 -0.372 51.165 9.084 1.00 0.00 ATOM 200 O THR A 98 -1.309 54.854 6.592 1.00 0.00 ATOM 201 C THR A 98 -1.760 53.726 6.719 1.00 0.00 ATOM 202 N LEU A 99 -2.442 53.101 5.763 1.00 0.00 ATOM 203 CA LEU A 99 -2.551 53.668 4.463 1.00 0.00 ATOM 204 CB LEU A 99 -3.246 52.694 3.510 1.00 0.00 ATOM 205 CG LEU A 99 -2.463 51.432 3.140 1.00 0.00 ATOM 206 CD1 LEU A 99 -3.333 50.475 2.340 1.00 0.00 ATOM 207 CD2 LEU A 99 -1.244 51.782 2.301 1.00 0.00 ATOM 208 O LEU A 99 -2.945 55.947 3.797 1.00 0.00 ATOM 209 C LEU A 99 -3.359 54.965 4.468 1.00 0.00 ATOM 210 N LEU A 100 -4.486 54.993 5.198 1.00 0.00 ATOM 211 CA LEU A 100 -5.321 56.201 5.251 1.00 0.00 ATOM 212 CB LEU A 100 -6.663 55.896 5.920 1.00 0.00 ATOM 213 CG LEU A 100 -7.595 54.945 5.167 1.00 0.00 ATOM 214 CD1 LEU A 100 -8.832 54.637 5.997 1.00 0.00 ATOM 215 CD2 LEU A 100 -8.046 55.563 3.853 1.00 0.00 ATOM 216 O LEU A 100 -5.070 58.510 5.826 1.00 0.00 ATOM 217 C LEU A 100 -4.694 57.357 6.035 1.00 0.00 ATOM 218 N LEU A 101 -3.758 57.068 6.943 1.00 0.00 ATOM 219 CA LEU A 101 -3.343 58.106 7.904 1.00 0.00 ATOM 220 CB LEU A 101 -3.763 57.720 9.324 1.00 0.00 ATOM 221 CG LEU A 101 -5.266 57.585 9.573 1.00 0.00 ATOM 222 CD1 LEU A 101 -5.532 56.984 10.945 1.00 0.00 ATOM 223 CD2 LEU A 101 -5.946 58.944 9.510 1.00 0.00 ATOM 224 O LEU A 101 -1.402 59.252 8.710 1.00 0.00 ATOM 225 C LEU A 101 -1.847 58.384 7.983 1.00 0.00 ATOM 226 N GLN 102 -1.097 57.638 7.208 1.00 0.00 ATOM 227 CA GLN 102 0.339 57.780 7.088 1.00 0.00 ATOM 228 C SER 104 1.142 61.701 8.604 1.00 0.00 ATOM 229 N ILE A 105 -0.156 61.709 8.406 1.00 0.00 ATOM 230 CA ILE A 105 -1.146 62.548 9.067 1.00 0.00 ATOM 231 CB ILE A 105 -2.564 62.277 8.531 1.00 0.00 ATOM 232 CG1 ILE A 105 -2.636 62.587 7.034 1.00 0.00 ATOM 233 CG2 ILE A 105 -3.582 63.147 9.253 1.00 0.00 ATOM 234 CD1 ILE A 105 -3.943 62.182 6.389 1.00 0.00 ATOM 235 O ILE A 105 -0.790 63.144 11.346 1.00 0.00 ATOM 236 C ILE A 105 -1.131 62.261 10.562 1.00 0.00 ATOM 237 N ALA A 106 -1.485 61.039 10.963 1.00 0.00 ATOM 238 CA ALA A 106 -1.422 60.687 12.376 1.00 0.00 ATOM 239 CB ALA A 106 -2.517 59.690 12.723 1.00 0.00 ATOM 240 O ALA A 106 0.363 59.162 11.970 1.00 0.00 ATOM 241 C ALA A 106 -0.074 60.066 12.684 1.00 0.00 ATOM 242 N GLU A 107 0.569 60.526 13.757 1.00 0.00 ATOM 243 CA GLU A 107 1.845 59.954 14.183 1.00 0.00 ATOM 244 CB GLU A 107 2.316 60.606 15.485 1.00 0.00 ATOM 245 CG GLU A 107 2.603 62.094 15.365 1.00 0.00 ATOM 246 CD GLU A 107 2.979 62.723 16.693 1.00 0.00 ATOM 247 OE1 GLU A 107 2.994 61.998 17.710 1.00 0.00 ATOM 248 OE2 GLU A 107 3.257 63.940 16.715 1.00 0.00 ATOM 249 O GLU A 107 2.565 57.676 14.162 1.00 0.00 ATOM 250 C GLU A 107 1.655 58.460 14.404 1.00 0.00 ATOM 251 N GLY A 108 -1.574 53.223 11.824 1.00 0.00 ATOM 252 CA GLY A 108 -1.344 51.778 11.749 1.00 0.00 ATOM 253 O GLY A 108 -0.854 49.918 13.147 1.00 0.00 ATOM 254 C GLY A 108 -1.015 51.129 13.087 1.00 0.00 ATOM 255 N GLU A 109 -0.930 51.919 14.163 1.00 0.00 ATOM 256 CA GLU A 109 -0.515 51.386 15.468 1.00 0.00 ATOM 257 CB GLU A 109 0.516 52.309 16.121 1.00 0.00 ATOM 258 CG GLU A 109 1.839 52.387 15.376 1.00 0.00 ATOM 259 CD GLU A 109 2.860 53.250 16.091 1.00 0.00 ATOM 260 OE1 GLU A 109 2.513 53.836 17.138 1.00 0.00 ATOM 261 OE2 GLU A 109 4.006 53.341 15.603 1.00 0.00 ATOM 262 O GLU A 109 -2.555 52.124 16.486 1.00 0.00 ATOM 263 C GLU A 109 -1.677 51.249 16.433 1.00 0.00 ATOM 264 N MET 110 -1.686 50.149 17.180 1.00 0.00 ATOM 265 CA MET 110 -2.627 49.929 18.267 1.00 0.00 ENDMDL