EXPDTA SAM-T02_AL2-scwrl MODEL 1 REMARK 44 REMARK 44 model 1 is called SAM-T02_AL2-scwrl ATOM 1 C ALA 83 7.111 2.585 62.648 1.00 0.00 ATOM 2 N VAL A 84 6.097 3.497 62.770 1.00 0.00 ATOM 3 CA VAL A 84 4.920 3.389 61.957 1.00 0.00 ATOM 4 CB VAL A 84 3.649 3.260 62.818 1.00 0.00 ATOM 5 CG1 VAL A 84 3.724 2.021 63.696 1.00 0.00 ATOM 6 CG2 VAL A 84 3.489 4.477 63.716 1.00 0.00 ATOM 7 O VAL A 84 3.783 4.743 60.301 1.00 0.00 ATOM 8 C VAL A 84 4.742 4.636 61.049 1.00 0.00 ATOM 9 N ALA A 85 5.655 5.577 61.131 1.00 0.00 ATOM 10 CA ALA A 85 5.529 6.762 60.263 1.00 0.00 ATOM 11 CB ALA A 85 6.282 7.940 60.862 1.00 0.00 ATOM 12 O ALA A 85 7.029 5.612 58.753 1.00 0.00 ATOM 13 C ALA A 85 6.113 6.442 58.885 1.00 0.00 ATOM 14 N PRO A 86 5.658 7.131 57.848 1.00 0.00 ATOM 15 CA PRO A 86 6.266 6.959 56.509 1.00 0.00 ATOM 16 CB PRO A 86 5.366 7.782 55.585 1.00 0.00 ATOM 17 CG PRO A 86 4.784 8.833 56.471 1.00 0.00 ATOM 18 CD PRO A 86 4.590 8.186 57.813 1.00 0.00 ATOM 19 O PRO A 86 8.111 8.324 57.295 1.00 0.00 ATOM 20 C PRO A 86 7.736 7.478 56.474 1.00 0.00 ATOM 21 N VAL A 87 8.561 6.935 55.568 1.00 0.00 ATOM 22 CA VAL A 87 10.003 7.208 55.535 1.00 0.00 ATOM 23 CB VAL A 87 10.697 6.440 54.395 1.00 0.00 ATOM 24 CG1 VAL A 87 12.144 6.888 54.254 1.00 0.00 ATOM 25 CG2 VAL A 87 10.682 4.945 54.674 1.00 0.00 ATOM 26 O VAL A 87 11.247 9.218 55.876 1.00 0.00 ATOM 27 C VAL A 87 10.302 8.705 55.321 1.00 0.00 ATOM 28 N LYS A 88 9.469 9.372 54.533 1.00 0.00 ATOM 29 CA LYS A 88 9.532 10.846 54.384 1.00 0.00 ATOM 30 CB LYS A 88 8.423 11.338 53.451 1.00 0.00 ATOM 31 CG LYS A 88 8.626 10.960 51.993 1.00 0.00 ATOM 32 CD LYS A 88 7.492 11.481 51.125 1.00 0.00 ATOM 33 CE LYS A 88 7.682 11.082 49.671 1.00 0.00 ATOM 34 NZ LYS A 88 6.561 11.558 48.814 1.00 0.00 ATOM 35 O LYS A 88 9.990 12.630 55.934 1.00 0.00 ATOM 36 C LYS A 88 9.365 11.585 55.721 1.00 0.00 ATOM 37 N ALA A 89 8.529 11.078 56.641 1.00 0.00 ATOM 38 CA ALA A 89 8.443 11.715 57.926 1.00 0.00 ATOM 39 CB ALA A 89 7.297 11.126 58.734 1.00 0.00 ATOM 40 O ALA A 89 10.118 12.332 59.483 1.00 0.00 ATOM 41 C ALA A 89 9.743 11.510 58.699 1.00 0.00 ATOM 42 N ARG A 90 10.390 10.345 58.538 1.00 0.00 ATOM 43 CA ARG A 90 11.658 10.119 59.152 1.00 0.00 ATOM 44 CB ARG A 90 12.164 8.711 58.834 1.00 0.00 ATOM 45 CG ARG A 90 11.389 7.602 59.527 1.00 0.00 ATOM 46 CD ARG A 90 11.914 6.231 59.131 1.00 0.00 ATOM 47 NE ARG A 90 11.148 5.152 59.751 1.00 0.00 ATOM 48 CZ ARG A 90 11.364 3.860 59.528 1.00 0.00 ATOM 49 NH1 ARG A 90 10.617 2.948 60.136 1.00 0.00 ATOM 50 NH2 ARG A 90 12.325 3.481 58.696 1.00 0.00 ATOM 51 O ARG A 90 13.373 11.777 59.383 1.00 0.00 ATOM 52 C ARG A 90 12.659 11.161 58.606 1.00 0.00 ATOM 53 N GLU A 91 12.661 11.342 57.294 1.00 0.00 ATOM 54 CA GLU A 91 13.496 12.373 56.668 1.00 0.00 ATOM 55 CB GLU A 91 13.190 12.475 55.172 1.00 0.00 ATOM 56 CG GLU A 91 14.032 13.504 54.436 1.00 0.00 ATOM 57 CD GLU A 91 13.730 13.548 52.950 1.00 0.00 ATOM 58 OE1 GLU A 91 12.887 12.749 52.492 1.00 0.00 ATOM 59 OE2 GLU A 91 14.337 14.381 52.245 1.00 0.00 ATOM 60 O GLU A 91 14.186 14.438 57.656 1.00 0.00 ATOM 61 C GLU A 91 13.259 13.754 57.286 1.00 0.00 ATOM 62 N GLN A 92 11.991 14.177 57.381 1.00 0.00 ATOM 63 CA GLN A 92 11.689 15.440 58.045 1.00 0.00 ATOM 64 CB GLN A 92 10.176 15.641 58.151 1.00 0.00 ATOM 65 CG GLN A 92 9.768 16.958 58.791 1.00 0.00 ATOM 66 CD GLN A 92 8.264 17.132 58.859 1.00 0.00 ATOM 67 OE1 GLN A 92 7.508 16.229 58.501 1.00 0.00 ATOM 68 NE2 GLN A 92 7.824 18.297 59.321 1.00 0.00 ATOM 69 O GLN A 92 12.710 16.592 59.807 1.00 0.00 ATOM 70 C GLN A 92 12.219 15.560 59.426 1.00 0.00 ATOM 71 N LEU A 93 12.036 14.523 60.250 1.00 0.00 ATOM 72 CA LEU A 93 12.509 14.590 61.612 1.00 0.00 ATOM 73 CB LEU A 93 12.133 13.317 62.373 1.00 0.00 ATOM 74 CG LEU A 93 10.645 13.120 62.672 1.00 0.00 ATOM 75 CD1 LEU A 93 10.394 11.742 63.265 1.00 0.00 ATOM 76 CD2 LEU A 93 10.154 14.162 63.665 1.00 0.00 ATOM 77 O LEU A 93 14.512 15.521 62.487 1.00 0.00 ATOM 78 C LEU A 93 14.029 14.741 61.686 1.00 0.00 ATOM 79 N GLU A 94 14.720 14.051 60.814 1.00 0.00 ATOM 80 CA GLU A 94 16.184 14.139 60.683 1.00 0.00 ATOM 81 CB GLU A 94 16.683 13.187 59.594 1.00 0.00 ATOM 82 CG GLU A 94 16.589 11.716 59.964 1.00 0.00 ATOM 83 CD GLU A 94 16.974 10.801 58.818 1.00 0.00 ATOM 84 OE1 GLU A 94 17.244 11.316 57.712 1.00 0.00 ATOM 85 OE2 GLU A 94 17.007 9.570 59.026 1.00 0.00 ATOM 86 O GLU A 94 17.477 16.211 60.906 1.00 0.00 ATOM 87 C GLU A 94 16.582 15.595 60.305 1.00 0.00 ATOM 88 N ALA A 95 15.849 16.165 59.351 1.00 0.00 ATOM 89 CA ALA A 95 16.158 17.509 58.947 1.00 0.00 ATOM 90 CB ALA A 95 15.292 17.920 57.766 1.00 0.00 ATOM 91 O ALA A 95 16.611 19.433 60.198 1.00 0.00 ATOM 92 C ALA A 95 15.916 18.497 60.069 1.00 0.00 ATOM 93 N ILE A 96 14.854 18.347 60.858 1.00 0.00 ATOM 94 CA ILE A 96 14.615 19.229 61.950 1.00 0.00 ATOM 95 CB ILE A 96 13.305 18.880 62.681 1.00 0.00 ATOM 96 CG1 ILE A 96 12.100 19.165 61.782 1.00 0.00 ATOM 97 CG2 ILE A 96 13.167 19.708 63.950 1.00 0.00 ATOM 98 CD1 ILE A 96 10.798 18.607 62.313 1.00 0.00 ATOM 99 O ILE A 96 16.188 20.091 63.497 1.00 0.00 ATOM 100 C ILE A 96 15.793 19.118 62.958 1.00 0.00 ATOM 101 N VAL A 97 16.279 17.909 63.187 1.00 0.00 ATOM 102 CA VAL A 97 17.379 17.694 64.147 1.00 0.00 ATOM 103 CB VAL A 97 17.725 16.200 64.284 1.00 0.00 ATOM 104 CG1 VAL A 97 18.983 16.018 65.119 1.00 0.00 ATOM 105 CG2 VAL A 97 16.587 15.449 64.960 1.00 0.00 ATOM 106 O VAL A 97 19.375 18.996 64.448 1.00 0.00 ATOM 107 C VAL A 97 18.625 18.437 63.667 1.00 0.00 ATOM 108 N SER A 98 18.789 18.455 62.364 1.00 0.00 ATOM 109 CA SER A 98 19.985 19.093 61.733 1.00 0.00 ATOM 110 CB SER A 98 20.262 18.473 60.362 1.00 0.00 ATOM 111 OG SER A 98 19.213 18.756 59.453 1.00 0.00 ATOM 112 O SER A 98 20.861 21.294 61.346 1.00 0.00 ATOM 113 C SER A 98 19.861 20.593 61.503 1.00 0.00 ATOM 114 N SER A 99 18.631 21.110 61.471 1.00 0.00 ATOM 115 CA SER A 99 18.409 22.499 61.266 1.00 0.00 ATOM 116 CB SER A 99 19.580 23.316 61.815 1.00 0.00 ATOM 117 OG SER A 99 20.778 23.025 61.115 1.00 0.00 ATOM 118 O SER A 99 18.342 24.014 59.443 1.00 0.00 ATOM 119 C SER A 99 18.259 22.839 59.766 1.00 0.00 ATOM 120 N LYS A 100 18.006 21.855 58.922 1.00 0.00 ATOM 121 CA LYS A 100 17.830 22.063 57.493 1.00 0.00 ATOM 122 CB LYS A 100 18.131 23.516 57.122 1.00 0.00 ATOM 123 CG LYS A 100 19.584 23.919 57.319 1.00 0.00 ATOM 124 CD LYS A 100 19.808 25.376 56.948 1.00 0.00 ATOM 125 CE LYS A 100 21.263 25.774 57.131 1.00 0.00 ATOM 126 NZ LYS A 100 21.499 27.199 56.767 1.00 0.00 ATOM 127 O LYS A 100 19.503 20.404 57.343 1.00 0.00 ATOM 128 C LYS A 100 18.769 21.159 56.723 1.00 0.00 ATOM 129 N TRP A 101 18.794 21.223 55.393 1.00 0.00 ATOM 130 CA TRP A 101 17.983 22.155 54.582 1.00 0.00 ATOM 131 CB TRP A 101 18.610 22.348 53.200 1.00 0.00 ATOM 132 CG TRP A 101 19.918 23.078 53.231 1.00 0.00 ATOM 133 CD1 TRP A 101 21.165 22.529 53.171 1.00 0.00 ATOM 134 CD2 TRP A 101 20.107 24.495 53.330 1.00 0.00 ATOM 135 CE2 TRP A 101 21.496 24.732 53.324 1.00 0.00 ATOM 136 CE3 TRP A 101 19.238 25.587 53.423 1.00 0.00 ATOM 137 NE1 TRP A 101 22.121 23.514 53.226 1.00 0.00 ATOM 138 CZ2 TRP A 101 22.036 26.014 53.408 1.00 0.00 ATOM 139 CZ3 TRP A 101 19.778 26.857 53.506 1.00 0.00 ATOM 140 CH2 TRP A 101 21.162 27.063 53.498 1.00 0.00 ATOM 141 O TRP A 101 16.391 20.483 54.262 1.00 0.00 ATOM 142 C TRP A 101 16.580 21.690 54.358 1.00 0.00 ATOM 143 N PHE A 102 15.639 22.636 54.237 1.00 0.00 ATOM 144 CA PHE A 102 14.238 22.298 54.049 1.00 0.00 ATOM 145 CB PHE A 102 13.365 23.057 55.050 1.00 0.00 ATOM 146 CG PHE A 102 13.582 22.647 56.478 1.00 0.00 ATOM 147 CD1 PHE A 102 14.499 23.312 57.273 1.00 0.00 ATOM 148 CD2 PHE A 102 12.870 21.595 57.027 1.00 0.00 ATOM 149 CE1 PHE A 102 14.699 22.934 58.587 1.00 0.00 ATOM 150 CE2 PHE A 102 13.070 21.217 58.341 1.00 0.00 ATOM 151 CZ PHE A 102 13.980 21.882 59.120 1.00 0.00 ATOM 152 O PHE A 102 14.296 23.657 52.112 1.00 0.00 ATOM 153 C PHE A 102 13.821 22.668 52.656 1.00 0.00 ATOM 154 N PRO A 103 12.946 21.854 52.101 1.00 0.00 ATOM 155 CA PRO A 103 12.525 22.042 50.706 1.00 0.00 ATOM 156 CB PRO A 103 11.845 20.720 50.343 1.00 0.00 ATOM 157 CG PRO A 103 11.324 20.200 51.641 1.00 0.00 ATOM 158 CD PRO A 103 12.319 20.617 52.687 1.00 0.00 ATOM 159 O PRO A 103 11.582 23.728 49.283 1.00 0.00 ATOM 160 C PRO A 103 11.556 23.191 50.430 1.00 0.00 ATOM 161 N GLN A 104 10.801 23.642 51.427 1.00 0.00 ATOM 162 CA GLN A 104 9.774 24.649 51.224 1.00 0.00 ATOM 163 CB GLN A 104 8.392 24.078 51.548 1.00 0.00 ATOM 164 CG GLN A 104 7.974 22.922 50.654 1.00 0.00 ATOM 165 CD GLN A 104 6.600 22.384 51.002 1.00 0.00 ATOM 166 OE1 GLN A 104 5.976 22.826 51.967 1.00 0.00 ATOM 167 NE2 GLN A 104 6.124 21.425 50.215 1.00 0.00 ATOM 168 O GLN A 104 10.480 25.738 53.218 1.00 0.00 ATOM 169 C GLN A 104 9.981 25.839 52.087 1.00 0.00 ATOM 170 N ALA A 105 9.519 26.986 51.621 1.00 0.00 ATOM 171 CA ALA A 105 9.723 28.206 52.326 1.00 0.00 ATOM 172 CB ALA A 105 9.206 29.382 51.512 1.00 0.00 ATOM 173 O ALA A 105 9.434 28.865 54.565 1.00 0.00 ATOM 174 C ALA A 105 8.995 28.208 53.668 1.00 0.00 ATOM 175 N GLY A 106 7.865 27.507 53.759 1.00 0.00 ATOM 176 CA GLY A 106 7.103 27.518 54.990 1.00 0.00 ATOM 177 O GLY A 106 7.229 26.589 57.191 1.00 0.00 ATOM 178 C GLY A 106 7.686 26.597 56.045 1.00 0.00 ATOM 179 N ASP 107 8.680 25.828 55.695 1.00 0.00 ATOM 180 CA ASP 107 9.257 24.876 56.702 1.00 0.00 ENDMDL