REMARK SCORE 0.762 CONFIDENCE NONE REMARK LOOPP v3.0 with LOOPP driver v3.1 [ALI] (08/24/04 12:18 EST) (compiled Sep 20 2004 17:13:12) REMARK prediction finished on Mon Oct 11 09:03:25 2004 EST REMARK MODEL 3 REMARK PARENT 1C2N ATOM 1 N ASP 20 -14.116 12.660 -4.656 1.00 22.87 1SG 2 ATOM 2 CA ASP 20 -14.786 13.748 -3.905 1.00 22.87 1SG 3 ATOM 3 CB ASP 20 -16.280 13.434 -3.701 1.00 22.87 1SG 4 ATOM 4 CG ASP 20 -16.438 12.225 -2.787 1.00 22.87 1SG 5 ATOM 5 OD1 ASP 20 -15.504 11.382 -2.728 1.00 22.87 1SG 6 ATOM 6 OD2 ASP 20 -17.511 12.131 -2.135 1.00 22.87 1SG 7 ATOM 7 C ASP 20 -14.151 13.920 -2.567 1.00 22.87 1SG 8 ATOM 8 O ASP 20 -14.382 14.914 -1.880 1.00 22.87 1SG 9 ATOM 9 N GLY 21 -13.307 12.950 -2.172 1.00 7.94 1SG 10 ATOM 10 CA GLY 21 -12.643 13.050 -0.908 1.00 7.94 1SG 11 ATOM 11 C GLY 21 -13.516 12.423 0.128 1.00 7.94 1SG 12 ATOM 12 O GLY 21 -13.216 12.474 1.319 1.00 7.94 1SG 13 ATOM 13 N ARG 22 -14.631 11.807 -0.300 1.00 79.18 1SG 14 ATOM 14 CA ARG 22 -15.487 11.180 0.659 1.00 79.18 1SG 15 ATOM 15 CB ARG 22 -16.811 10.659 0.073 1.00 79.18 1SG 16 ATOM 16 CG ARG 22 -17.708 9.989 1.116 1.00 79.18 1SG 17 ATOM 17 CD ARG 22 -19.030 9.468 0.548 1.00 79.18 1SG 18 ATOM 18 NE ARG 22 -19.786 8.848 1.673 1.00 79.18 1SG 19 ATOM 19 CZ ARG 22 -21.103 8.528 1.513 1.00 79.18 1SG 20 ATOM 20 NH1 ARG 22 -21.723 8.777 0.323 1.00 79.18 1SG 21 ATOM 21 NH2 ARG 22 -21.799 7.963 2.542 1.00 79.18 1SG 22 ATOM 22 C ARG 22 -14.740 10.006 1.187 1.00 79.18 1SG 23 ATOM 23 O ARG 22 -13.988 9.355 0.461 1.00 79.18 1SG 24 ATOM 24 N LYS 23 -14.912 9.716 2.489 1.00 37.35 1SG 25 ATOM 25 CA LYS 23 -14.205 8.610 3.051 1.00 37.35 1SG 26 ATOM 26 CB LYS 23 -13.958 8.768 4.559 1.00 37.35 1SG 27 ATOM 27 CG LYS 23 -13.096 9.983 4.906 1.00 37.35 1SG 28 ATOM 28 CD LYS 23 -13.179 10.389 6.379 1.00 37.35 1SG 29 ATOM 29 CE LYS 23 -12.321 11.607 6.728 1.00 37.35 1SG 30 ATOM 30 NZ LYS 23 -12.653 12.089 8.087 1.00 37.35 1SG 31 ATOM 31 C LYS 23 -15.077 7.416 2.873 1.00 37.35 1SG 32 ATOM 32 O LYS 23 -15.944 7.139 3.701 1.00 37.35 1SG 33 ATOM 33 N VAL 24 -14.871 6.675 1.770 1.00 76.86 1SG 34 ATOM 34 CA VAL 24 -15.667 5.506 1.560 1.00 76.86 1SG 35 ATOM 35 CB VAL 24 -15.424 4.848 0.229 1.00 76.86 1SG 36 ATOM 36 CG1 VAL 24 -13.950 4.421 0.122 1.00 76.86 1SG 37 ATOM 37 CG2 VAL 24 -16.419 3.684 0.084 1.00 76.86 1SG 38 ATOM 38 C VAL 24 -15.330 4.547 2.651 1.00 76.86 1SG 39 ATOM 39 O VAL 24 -16.212 3.946 3.262 1.00 76.86 1SG 40 ATOM 40 N TRP 25 -14.024 4.403 2.943 1.00 80.78 1SG 41 ATOM 41 CA TRP 25 -13.631 3.495 3.973 1.00 80.78 1SG 42 ATOM 42 CB TRP 25 -12.462 2.587 3.554 1.00 80.78 1SG 43 ATOM 43 CG TRP 25 -12.023 1.609 4.614 1.00 80.78 1SG 44 ATOM 44 CD2 TRP 25 -12.595 0.305 4.782 1.00 80.78 1SG 45 ATOM 45 CD1 TRP 25 -11.056 1.734 5.569 1.00 80.78 1SG 46 ATOM 46 NE1 TRP 25 -10.990 0.585 6.321 1.00 80.78 1SG 47 ATOM 47 CE2 TRP 25 -11.932 -0.303 5.847 1.00 80.78 1SG 48 ATOM 48 CE3 TRP 25 -13.593 -0.336 4.102 1.00 80.78 1SG 49 ATOM 49 CZ2 TRP 25 -12.258 -1.566 6.251 1.00 80.78 1SG 50 ATOM 50 CZ3 TRP 25 -13.919 -1.609 4.513 1.00 80.78 1SG 51 ATOM 51 CH2 TRP 25 -13.264 -2.212 5.566 1.00 80.78 1SG 52 ATOM 52 C TRP 25 -13.164 4.328 5.116 1.00 80.78 1SG 53 ATOM 53 O TRP 25 -12.221 5.108 4.988 1.00 80.78 1SG 54 ATOM 54 N GLU 26 -13.823 4.191 6.280 1.00 30.36 1SG 55 ATOM 55 CA GLU 26 -13.377 4.965 7.394 1.00 30.36 1SG 56 ATOM 56 CB GLU 26 -14.490 5.320 8.395 1.00 30.36 1SG 57 ATOM 57 CG GLU 26 -15.535 6.286 7.833 1.00 30.36 1SG 58 ATOM 58 CD GLU 26 -16.564 6.550 8.924 1.00 30.36 1SG 59 ATOM 59 OE1 GLU 26 -16.432 5.946 10.021 1.00 30.36 1SG 60 ATOM 60 OE2 GLU 26 -17.496 7.360 8.673 1.00 30.36 1SG 61 ATOM 61 C GLU 26 -12.386 4.120 8.114 1.00 30.36 1SG 62 ATOM 62 O GLU 26 -12.743 3.147 8.777 1.00 30.36 1SG 63 ATOM 63 N ILE 27 -11.096 4.472 7.983 1.00 76.12 1SG 64 ATOM 64 CA ILE 27 -10.082 3.712 8.643 1.00 76.12 1SG 65 ATOM 65 CB ILE 27 -9.345 2.765 7.741 1.00 76.12 1SG 66 ATOM 66 CG2 ILE 27 -8.546 3.595 6.722 1.00 76.12 1SG 67 ATOM 67 CG1 ILE 27 -8.488 1.796 8.572 1.00 76.12 1SG 68 ATOM 68 CD1 ILE 27 -7.949 0.614 7.768 1.00 76.12 1SG 69 ATOM 69 C ILE 27 -9.082 4.675 9.184 1.00 76.12 1SG 70 ATOM 70 O ILE 27 -9.065 5.846 8.812 1.00 76.12 1SG 71 ATOM 71 N ARG 28 -8.234 4.193 10.111 1.00127.65 1SG 72 ATOM 72 CA ARG 28 -7.207 5.013 10.680 1.00127.65 1SG 73 ATOM 73 CB ARG 28 -6.426 4.302 11.800 1.00127.65 1SG 74 ATOM 74 CG ARG 28 -5.254 5.105 12.367 1.00127.65 1SG 75 ATOM 75 CD ARG 28 -4.377 4.287 13.320 1.00127.65 1SG 76 ATOM 76 NE ARG 28 -3.242 5.149 13.756 1.00127.65 1SG 77 ATOM 77 CZ ARG 28 -2.173 4.591 14.397 1.00127.65 1SG 78 ATOM 78 NH1 ARG 28 -2.143 3.247 14.632 1.00127.65 1SG 79 ATOM 79 NH2 ARG 28 -1.132 5.376 14.800 1.00127.65 1SG 80 ATOM 80 C ARG 28 -6.242 5.307 9.584 1.00127.65 1SG 81 ATOM 81 O ARG 28 -6.046 4.487 8.688 1.00127.65 1SG 82 ATOM 82 N ARG 29 -5.637 6.510 9.601 1.00132.62 1SG 83 ATOM 83 CA ARG 29 -4.699 6.800 8.563 1.00132.62 1SG 84 ATOM 84 CB ARG 29 -4.889 8.202 7.966 1.00132.62 1SG 85 ATOM 85 CG ARG 29 -6.246 8.372 7.281 1.00132.62 1SG 86 ATOM 86 CD ARG 29 -6.460 9.763 6.683 1.00132.62 1SG 87 ATOM 87 NE ARG 29 -7.811 9.778 6.056 1.00132.62 1SG 88 ATOM 88 CZ ARG 29 -8.468 10.962 5.888 1.00132.62 1SG 89 ATOM 89 NH1 ARG 29 -7.883 12.128 6.289 1.00132.62 1SG 90 ATOM 90 NH2 ARG 29 -9.709 10.981 5.321 1.00132.62 1SG 91 ATOM 91 C ARG 29 -3.339 6.746 9.170 1.00132.62 1SG 92 ATOM 92 O ARG 29 -2.579 7.711 9.110 1.00132.62 1SG 93 ATOM 93 N ARG 30 -3.004 5.595 9.777 1.00100.79 1SG 94 ATOM 94 CA ARG 30 -1.698 5.407 10.328 1.00100.79 1SG 95 ATOM 95 CB ARG 30 -1.570 4.067 11.068 1.00100.79 1SG 96 ATOM 96 CG ARG 30 -0.190 3.816 11.677 1.00100.79 1SG 97 ATOM 97 CD ARG 30 -0.095 2.474 12.403 1.00100.79 1SG 98 ATOM 98 NE ARG 30 1.286 2.347 12.946 1.00100.79 1SG 99 ATOM 99 CZ ARG 30 1.543 1.439 13.932 1.00100.79 1SG 100 ATOM 100 NH1 ARG 30 0.533 0.661 14.420 1.00100.79 1SG 101 ATOM 101 NH2 ARG 30 2.806 1.310 14.430 1.00100.79 1SG 102 ATOM 102 C ARG 30 -0.779 5.371 9.156 1.00100.79 1SG 103 ATOM 103 O ARG 30 0.301 5.959 9.159 1.00100.79 1SG 104 ATOM 104 N LYS 31 -1.237 4.676 8.101 1.00 74.44 1SG 105 ATOM 105 CA LYS 31 -0.498 4.514 6.891 1.00 74.44 1SG 106 ATOM 106 CB LYS 31 -0.623 3.092 6.331 1.00 74.44 1SG 107 ATOM 107 CG LYS 31 0.175 2.819 5.061 1.00 74.44 1SG 108 ATOM 108 CD LYS 31 0.193 1.326 4.727 1.00 74.44 1SG 109 ATOM 109 CE LYS 31 0.973 0.966 3.463 1.00 74.44 1SG 110 ATOM 110 NZ LYS 31 0.898 -0.494 3.234 1.00 74.44 1SG 111 ATOM 111 C LYS 31 -1.124 5.433 5.902 1.00 74.44 1SG 112 ATOM 112 O LYS 31 -2.207 5.966 6.134 1.00 74.44 1SG 113 ATOM 113 N THR 32 -0.447 5.658 4.764 1.00101.89 1SG 114 ATOM 114 CA THR 32 -1.023 6.540 3.801 1.00101.89 1SG 115 ATOM 115 CB THR 32 -0.100 6.894 2.671 1.00101.89 1SG 116 ATOM 116 OG1 THR 32 -0.678 7.914 1.870 1.00101.89 1SG 117 ATOM 117 CG2 THR 32 0.157 5.634 1.828 1.00101.89 1SG 118 ATOM 118 C THR 32 -2.201 5.836 3.225 1.00101.89 1SG 119 ATOM 119 O THR 32 -2.364 4.629 3.395 1.00101.89 1SG 120 ATOM 120 N ARG 33 -3.073 6.591 2.536 1.00133.14 1SG 121 ATOM 121 CA ARG 33 -4.255 5.997 1.995 1.00133.14 1SG 122 ATOM 122 CB ARG 33 -5.193 7.039 1.361 1.00133.14 1SG 123 ATOM 123 CG ARG 33 -6.621 6.552 1.121 1.00133.14 1SG 124 ATOM 124 CD ARG 33 -7.540 7.666 0.617 1.00133.14 1SG 125 ATOM 125 NE ARG 33 -8.928 7.129 0.574 1.00133.14 1SG 126 ATOM 126 CZ ARG 33 -9.979 7.963 0.826 1.00133.14 1SG 127 ATOM 127 NH1 ARG 33 -9.751 9.275 1.123 1.00133.14 1SG 128 ATOM 128 NH2 ARG 33 -11.256 7.484 0.782 1.00133.14 1SG 129 ATOM 129 C ARG 33 -3.820 5.026 0.945 1.00133.14 1SG 130 ATOM 130 O ARG 33 -2.960 5.328 0.118 1.00133.14 1SG 131 ATOM 131 N HIS 34 -4.394 3.808 0.982 1.00 69.61 1SG 132 ATOM 132 CA HIS 34 -4.050 2.776 0.047 1.00 69.61 1SG 133 ATOM 133 ND1 HIS 34 -4.544 0.926 2.881 1.00 69.61 1SG 134 ATOM 134 CG HIS 34 -4.104 0.743 1.588 1.00 69.61 1SG 135 ATOM 135 CB HIS 34 -4.695 1.416 0.381 1.00 69.61 1SG 136 ATOM 136 NE2 HIS 34 -2.855 -0.519 2.984 1.00 69.61 1SG 137 ATOM 137 CD2 HIS 34 -3.072 -0.142 1.671 1.00 69.61 1SG 138 ATOM 138 CE1 HIS 34 -3.763 0.148 3.674 1.00 69.61 1SG 139 ATOM 139 C HIS 34 -4.504 3.169 -1.323 1.00 69.61 1SG 140 ATOM 140 O HIS 34 -3.786 2.981 -2.305 1.00 69.61 1SG 141 ATOM 141 N ARG 35 -5.714 3.747 -1.415 1.00141.07 1SG 142 ATOM 142 CA ARG 35 -6.302 4.097 -2.674 1.00141.07 1SG 143 ATOM 143 CB ARG 35 -7.759 4.572 -2.535 1.00141.07 1SG 144 ATOM 144 CG ARG 35 -8.323 5.231 -3.796 1.00141.07 1SG 145 ATOM 145 CD ARG 35 -9.619 6.008 -3.543 1.00141.07 1SG 146 ATOM 146 NE ARG 35 -9.866 6.880 -4.728 1.00141.07 1SG 147 ATOM 147 CZ ARG 35 -10.612 6.433 -5.780 1.00141.07 1SG 148 ATOM 148 NH1 ARG 35 -11.187 5.197 -5.732 1.00141.07 1SG 149 ATOM 149 NH2 ARG 35 -10.787 7.224 -6.879 1.00141.07 1SG 150 ATOM 150 C ARG 35 -5.537 5.211 -3.312 1.00141.07 1SG 151 ATOM 151 O ARG 35 -4.971 6.070 -2.637 1.00141.07 1SG 152 ATOM 152 N GLY 36 -5.493 5.183 -4.662 1.00 80.58 1SG 153 ATOM 153 CA GLY 36 -4.898 6.221 -5.452 1.00 80.58 1SG 154 ATOM 154 C GLY 36 -3.475 5.896 -5.766 1.00 80.58 1SG 155 ATOM 155 O GLY 36 -2.832 5.046 -5.148 1.00 80.58 1SG 156 ATOM 156 N PRO 37 -3.020 6.585 -6.784 1.00105.29 1SG 157 ATOM 157 CA PRO 37 -1.642 6.571 -7.197 1.00105.29 1SG 158 ATOM 158 CD PRO 37 -3.902 7.021 -7.852 1.00105.29 1SG 159 ATOM 159 CB PRO 37 -1.616 7.106 -8.629 1.00105.29 1SG 160 ATOM 160 CG PRO 37 -2.982 7.790 -8.813 1.00105.29 1SG 161 ATOM 161 C PRO 37 -0.989 7.478 -6.214 1.00105.29 1SG 162 ATOM 162 O PRO 37 -1.716 8.259 -5.601 1.00105.29 1SG 163 ATOM 163 N LEU 38 0.349 7.423 -6.037 1.00331.76 1SG 164 ATOM 164 CA LEU 38 0.805 8.230 -4.951 1.00331.76 1SG 165 ATOM 165 CB LEU 38 0.145 7.584 -3.724 1.00331.76 1SG 166 ATOM 166 CG LEU 38 -0.270 8.497 -2.563 1.00331.76 1SG 167 ATOM 167 CD2 LEU 38 -0.737 7.611 -1.392 1.00331.76 1SG 168 ATOM 168 CD1 LEU 38 -1.311 9.541 -3.000 1.00331.76 1SG 169 ATOM 169 C LEU 38 2.324 8.148 -5.029 1.00331.76 1SG 170 ATOM 170 O LEU 38 2.822 7.628 -6.026 1.00331.76 1SG 171 ATOM 171 N GLY 39 3.153 8.625 -4.053 1.00146.87 1SG 172 ATOM 172 CA GLY 39 4.557 8.499 -4.418 1.00146.87 1SG 173 ATOM 173 C GLY 39 5.561 8.132 -3.327 1.00146.87 1SG 174 ATOM 174 O GLY 39 6.101 8.996 -2.641 1.00146.87 1SG 175 ATOM 175 N ILE 40 5.872 6.816 -3.217 1.00119.92 1SG 176 ATOM 176 CA ILE 40 6.864 6.061 -2.487 1.00119.92 1SG 177 ATOM 177 CB ILE 40 6.747 5.977 -0.978 1.00119.92 1SG 178 ATOM 178 CG2 ILE 40 7.716 4.950 -0.379 1.00119.92 1SG 179 ATOM 179 CG1 ILE 40 7.059 7.349 -0.382 1.00119.92 1SG 180 ATOM 180 CD1 ILE 40 6.934 7.340 1.139 1.00119.92 1SG 181 ATOM 181 C ILE 40 6.837 4.714 -3.162 1.00119.92 1SG 182 ATOM 182 O ILE 40 7.171 4.636 -4.345 1.00119.92 1SG 183 ATOM 183 N VAL 41 6.473 3.607 -2.473 1.00140.07 1SG 184 ATOM 184 CA VAL 41 6.505 2.331 -3.132 1.00140.07 1SG 185 ATOM 185 CB VAL 41 7.641 1.496 -2.665 1.00140.07 1SG 186 ATOM 186 CG1 VAL 41 8.927 2.123 -3.204 1.00140.07 1SG 187 ATOM 187 CG2 VAL 41 7.594 1.487 -1.131 1.00140.07 1SG 188 ATOM 188 C VAL 41 5.254 1.546 -2.891 1.00140.07 1SG 189 ATOM 189 O VAL 41 4.905 1.255 -1.745 1.00140.07 1SG 190 ATOM 190 N SER 42 4.553 1.208 -3.997 1.00264.83 1SG 191 ATOM 191 CA SER 42 3.390 0.364 -4.070 1.00264.83 1SG 192 ATOM 192 CB SER 42 2.962 -0.358 -2.776 1.00264.83 1SG 193 ATOM 193 OG SER 42 2.327 0.550 -1.888 1.00264.83 1SG 194 ATOM 194 C SER 42 2.232 1.176 -4.544 1.00264.83 1SG 195 ATOM 195 O SER 42 2.326 2.392 -4.699 1.00264.83 1SG 196 ATOM 196 N GLY 43 1.102 0.497 -4.817 1.00151.86 1SG 197 ATOM 197 CA GLY 43 -0.099 1.167 -5.222 1.00151.86 1SG 198 ATOM 198 C GLY 43 -0.121 1.314 -6.710 1.00151.86 1SG 199 ATOM 199 O GLY 43 -1.115 1.762 -7.281 1.00151.86 1SG 200 ATOM 200 N GLY 44 0.976 0.945 -7.388 1.00 43.67 1SG 201 ATOM 201 CA GLY 44 0.992 1.071 -8.815 1.00 43.67 1SG 202 ATOM 202 C GLY 44 1.718 2.333 -9.139 1.00 43.67 1SG 203 ATOM 203 O GLY 44 2.456 2.398 -10.120 1.00 43.67 1SG 204 ATOM 204 N ARG 45 1.540 3.377 -8.308 1.00119.47 1SG 205 ATOM 205 CA ARG 45 2.304 4.570 -8.518 1.00119.47 1SG 206 ATOM 206 CB ARG 45 1.557 5.904 -8.323 1.00119.47 1SG 207 ATOM 207 CG ARG 45 2.412 7.076 -8.821 1.00119.47 1SG 208 ATOM 208 CD ARG 45 1.677 8.405 -9.001 1.00119.47 1SG 209 ATOM 209 NE ARG 45 2.122 9.340 -7.931 1.00119.47 1SG 210 ATOM 210 CZ ARG 45 1.171 10.085 -7.299 1.00119.47 1SG 211 ATOM 211 NH1 ARG 45 -0.141 9.871 -7.612 1.00119.47 1SG 212 ATOM 212 NH2 ARG 45 1.508 11.019 -6.362 1.00119.47 1SG 213 ATOM 213 C ARG 45 3.374 4.450 -7.498 1.00119.47 1SG 214 ATOM 214 O ARG 45 3.551 3.354 -6.966 1.00119.47 1SG 215 ATOM 215 N LEU 46 4.160 5.514 -7.228 1.00 88.62 1SG 216 ATOM 216 CA LEU 46 5.178 5.289 -6.243 1.00 88.62 1SG 217 ATOM 217 CB LEU 46 6.065 6.524 -5.997 1.00 88.62 1SG 218 ATOM 218 CG LEU 46 6.780 7.084 -7.235 1.00 88.62 1SG 219 ATOM 219 CD2 LEU 46 7.972 7.969 -6.836 1.00 88.62 1SG 220 ATOM 220 CD1 LEU 46 5.788 7.783 -8.177 1.00 88.62 1SG 221 ATOM 221 C LEU 46 4.492 4.905 -4.951 1.00 88.62 1SG 222 ATOM 222 O LEU 46 4.636 3.778 -4.495 1.00 88.62 1SG 223 ATOM 223 N ILE 47 3.691 5.807 -4.354 1.00204.55 1SG 224 ATOM 224 CA ILE 47 2.841 5.563 -3.216 1.00204.55 1SG 225 ATOM 225 CB ILE 47 2.648 4.175 -2.654 1.00204.55 1SG 226 ATOM 226 CG2 ILE 47 3.763 3.759 -1.676 1.00204.55 1SG 227 ATOM 227 CG1 ILE 47 1.270 4.198 -1.965 1.00204.55 1SG 228 ATOM 228 CD1 ILE 47 0.726 2.826 -1.578 1.00204.55 1SG 229 ATOM 229 C ILE 47 2.975 6.573 -2.104 1.00204.55 1SG 230 ATOM 230 O ILE 47 2.095 7.382 -1.878 1.00204.55 1SG 231 ATOM 231 N GLY 48 4.027 6.510 -1.280 1.00101.27 1SG 232 ATOM 232 CA GLY 48 4.130 7.379 -0.144 1.00101.27 1SG 233 ATOM 233 C GLY 48 4.405 8.815 -0.505 1.00101.27 1SG 234 ATOM 234 O GLY 48 5.336 9.430 0.014 1.00101.27 1SG 235 ATOM 235 N GLN 49 3.599 9.424 -1.385 1.00186.94 1SG 236 ATOM 236 CA GLN 49 3.750 10.824 -1.615 1.00186.94 1SG 237 ATOM 237 CB GLN 49 4.446 11.162 -2.940 1.00186.94 1SG 238 ATOM 238 CG GLN 49 4.648 12.665 -3.130 1.00186.94 1SG 239 ATOM 239 CD GLN 49 5.128 12.899 -4.549 1.00186.94 1SG 240 ATOM 240 OE1 GLN 49 5.321 14.047 -4.945 1.00186.94 1SG 241 ATOM 241 NE2 GLN 49 5.317 11.804 -5.334 1.00186.94 1SG 242 ATOM 242 C GLN 49 2.352 11.332 -1.707 1.00186.94 1SG 243 ATOM 243 O GLN 49 2.020 12.174 -2.540 1.00186.94 1SG 244 ATOM 244 N ALA 50 1.490 10.820 -0.816 1.00 53.91 1SG 245 ATOM 245 CA ALA 50 0.113 11.189 -0.853 1.00 53.91 1SG 246 ATOM 246 CB ALA 50 -0.810 10.235 -0.082 1.00 53.91 1SG 247 ATOM 247 C ALA 50 -0.026 12.512 -0.206 1.00 53.91 1SG 248 ATOM 248 O ALA 50 0.826 12.936 0.574 1.00 53.91 1SG 249 ATOM 249 N ASP 51 -1.110 13.219 -0.556 1.00141.51 1SG 250 ATOM 250 CA ASP 51 -1.350 14.440 0.126 1.00141.51 1SG 251 ATOM 251 CB ASP 51 -2.123 15.480 -0.716 1.00141.51 1SG 252 ATOM 252 CG ASP 51 -3.465 14.930 -1.184 1.00141.51 1SG 253 ATOM 253 OD1 ASP 51 -3.546 13.709 -1.484 1.00141.51 1SG 254 ATOM 254 OD2 ASP 51 -4.427 15.740 -1.267 1.00141.51 1SG 255 ATOM 255 C ASP 51 -2.115 14.043 1.339 1.00141.51 1SG 256 ATOM 256 O ASP 51 -3.297 14.355 1.494 1.00141.51 1SG 257 ATOM 257 N LEU 52 -1.422 13.324 2.244 1.00262.18 1SG 258 ATOM 258 CA LEU 52 -2.049 12.892 3.451 1.00262.18 1SG 259 ATOM 259 CB LEU 52 -1.134 12.016 4.339 1.00262.18 1SG 260 ATOM 260 CG LEU 52 -1.810 11.430 5.598 1.00262.18 1SG 261 ATOM 261 CD2 LEU 52 -0.789 10.717 6.503 1.00262.18 1SG 262 ATOM 262 CD1 LEU 52 -2.988 10.515 5.227 1.00262.18 1SG 263 ATOM 263 C LEU 52 -2.371 14.170 4.136 1.00262.18 1SG 264 ATOM 264 O LEU 52 -1.666 15.164 3.964 1.00262.18 1SG 265 ATOM 265 N VAL 53 -3.471 14.207 4.900 1.00124.35 1SG 266 ATOM 266 CA VAL 53 -3.843 15.484 5.416 1.00124.35 1SG 267 ATOM 267 CB VAL 53 -5.259 15.867 5.109 1.00124.35 1SG 268 ATOM 268 CG1 VAL 53 -5.351 16.185 3.604 1.00124.35 1SG 269 ATOM 269 CG2 VAL 53 -6.173 14.702 5.516 1.00124.35 1SG 270 ATOM 270 C VAL 53 -3.581 15.584 6.876 1.00124.35 1SG 271 ATOM 271 O VAL 53 -3.443 14.600 7.599 1.00124.35 1SG 272 ATOM 272 N GLY 54 -3.486 16.845 7.318 1.00 62.20 1SG 273 ATOM 273 CA GLY 54 -3.127 17.227 8.643 1.00 62.20 1SG 274 ATOM 274 C GLY 54 -2.209 18.351 8.351 1.00 62.20 1SG 275 ATOM 275 O GLY 54 -2.505 19.167 7.480 1.00 62.20 1SG 276 ATOM 276 N VAL 55 -1.082 18.447 9.070 1.00189.40 1SG 277 ATOM 277 CA VAL 55 -0.148 19.425 8.622 1.00189.40 1SG 278 ATOM 278 CB VAL 55 1.070 19.504 9.511 1.00189.40 1SG 279 ATOM 279 CG1 VAL 55 0.600 19.956 10.905 1.00189.40 1SG 280 ATOM 280 CG2 VAL 55 1.801 18.149 9.538 1.00189.40 1SG 281 ATOM 281 C VAL 55 0.211 18.939 7.249 1.00189.40 1SG 282 ATOM 282 O VAL 55 0.260 19.704 6.286 1.00189.40 1SG 283 ATOM 283 N GLU 56 0.422 17.612 7.146 1.00285.18 1SG 284 ATOM 284 CA GLU 56 0.688 16.878 5.941 1.00285.18 1SG 285 ATOM 285 CB GLU 56 1.971 17.261 5.184 1.00285.18 1SG 286 ATOM 286 CG GLU 56 1.875 18.562 4.388 1.00285.18 1SG 287 ATOM 287 CD GLU 56 0.652 18.471 3.485 1.00285.18 1SG 288 ATOM 288 OE1 GLU 56 -0.460 18.814 3.969 1.00285.18 1SG 289 ATOM 289 OE2 GLU 56 0.807 18.058 2.306 1.00285.18 1SG 290 ATOM 290 C GLU 56 0.881 15.469 6.381 1.00285.18 1SG 291 ATOM 291 O GLU 56 0.878 15.183 7.577 1.00285.18 1SG 292 ATOM 292 N GLY 57 1.041 14.541 5.419 1.00 58.33 1SG 293 ATOM 293 CA GLY 57 1.283 13.180 5.796 1.00 58.33 1SG 294 ATOM 294 C GLY 57 2.721 12.910 5.494 1.00 58.33 1SG 295 ATOM 295 O GLY 57 3.168 12.992 4.352 1.00 58.33 1SG 296 ATOM 296 N PRO 58 3.449 12.583 6.526 1.00119.70 1SG 297 ATOM 297 CA PRO 58 4.846 12.295 6.356 1.00119.70 1SG 298 ATOM 298 CD PRO 58 3.192 13.233 7.801 1.00119.70 1SG 299 ATOM 299 CB PRO 58 5.483 12.438 7.734 1.00119.70 1SG 300 ATOM 300 CG PRO 58 4.572 13.453 8.443 1.00119.70 1SG 301 ATOM 301 C PRO 58 5.031 10.953 5.740 1.00119.70 1SG 302 ATOM 302 O PRO 58 4.099 10.151 5.764 1.00119.70 1SG 303 ATOM 303 N PHE 59 6.224 10.690 5.173 1.00 55.98 1SG 304 ATOM 304 CA PHE 59 6.408 9.432 4.519 1.00 55.98 1SG 305 ATOM 305 CB PHE 59 6.258 9.512 2.997 1.00 55.98 1SG 306 ATOM 306 CG PHE 59 4.797 9.550 2.710 1.00 55.98 1SG 307 ATOM 307 CD1 PHE 59 4.065 8.386 2.764 1.00 55.98 1SG 308 ATOM 308 CD2 PHE 59 4.159 10.724 2.388 1.00 55.98 1SG 309 ATOM 309 CE1 PHE 59 2.715 8.388 2.503 1.00 55.98 1SG 310 ATOM 310 CE2 PHE 59 2.809 10.731 2.125 1.00 55.98 1SG 311 ATOM 311 CZ PHE 59 2.083 9.565 2.183 1.00 55.98 1SG 312 ATOM 312 C PHE 59 7.745 8.839 4.824 1.00 55.98 1SG 313 ATOM 313 O PHE 59 8.634 9.475 5.390 1.00 55.98 1SG 314 ATOM 314 N SER 60 7.879 7.554 4.438 1.00 96.99 1SG 315 ATOM 315 CA SER 60 9.035 6.742 4.667 1.00 96.99 1SG 316 ATOM 316 CB SER 60 8.687 5.261 4.902 1.00 96.99 1SG 317 ATOM 317 OG SER 60 9.827 4.554 5.366 1.00 96.99 1SG 318 ATOM 318 C SER 60 9.936 6.845 3.475 1.00 96.99 1SG 319 ATOM 319 O SER 60 10.113 7.921 2.905 1.00 96.99 1SG 320 ATOM 320 N VAL 61 10.554 5.712 3.084 1.00209.75 1SG 321 ATOM 321 CA VAL 61 11.506 5.711 2.010 1.00209.75 1SG 322 ATOM 322 CB VAL 61 12.172 4.377 1.823 1.00209.75 1SG 323 ATOM 323 CG1 VAL 61 13.074 4.142 3.026 1.00209.75 1SG 324 ATOM 324 CG2 VAL 61 11.108 3.270 1.736 1.00209.75 1SG 325 ATOM 325 C VAL 61 10.849 6.079 0.723 1.00209.75 1SG 326 ATOM 326 O VAL 61 10.401 5.227 -0.037 1.00209.75 1SG 327 ATOM 327 N GLU 62 10.858 7.390 0.433 1.00107.71 1SG 328 ATOM 328 CA GLU 62 10.305 8.020 -0.733 1.00107.71 1SG 329 ATOM 329 CB GLU 62 10.466 9.549 -0.632 1.00107.71 1SG 330 ATOM 330 CG GLU 62 9.921 10.366 -1.805 1.00107.71 1SG 331 ATOM 331 CD GLU 62 10.290 11.822 -1.534 1.00107.71 1SG 332 ATOM 332 OE1 GLU 62 10.895 12.082 -0.459 1.00107.71 1SG 333 ATOM 333 OE2 GLU 62 9.981 12.690 -2.394 1.00107.71 1SG 334 ATOM 334 C GLU 62 11.102 7.576 -1.917 1.00107.71 1SG 335 ATOM 335 O GLU 62 10.601 7.481 -3.037 1.00107.71 1SG 336 ATOM 336 N GLU 63 12.379 7.265 -1.646 1.00 97.35 1SG 337 ATOM 337 CA GLU 63 13.446 7.021 -2.573 1.00 97.35 1SG 338 ATOM 338 CB GLU 63 14.763 6.682 -1.858 1.00 97.35 1SG 339 ATOM 339 CG GLU 63 15.932 6.475 -2.822 1.00 97.35 1SG 340 ATOM 340 CD GLU 63 17.200 6.326 -1.997 1.00 97.35 1SG 341 ATOM 341 OE1 GLU 63 17.086 6.240 -0.746 1.00 97.35 1SG 342 ATOM 342 OE2 GLU 63 18.302 6.305 -2.608 1.00 97.35 1SG 343 ATOM 343 C GLU 63 13.211 5.899 -3.535 1.00 97.35 1SG 344 ATOM 344 O GLU 63 13.686 5.972 -4.668 1.00 97.35 1SG 345 ATOM 345 N LEU 64 12.510 4.823 -3.134 1.00130.18 1SG 346 ATOM 346 CA LEU 64 12.477 3.706 -4.030 1.00130.18 1SG 347 ATOM 347 CB LEU 64 11.834 2.430 -3.467 1.00130.18 1SG 348 ATOM 348 CG LEU 64 11.887 1.268 -4.478 1.00130.18 1SG 349 ATOM 349 CD2 LEU 64 11.222 0.002 -3.915 1.00130.18 1SG 350 ATOM 350 CD1 LEU 64 13.335 1.014 -4.931 1.00130.18 1SG 351 ATOM 351 C LEU 64 11.825 4.069 -5.324 1.00130.18 1SG 352 ATOM 352 O LEU 64 12.307 3.642 -6.374 1.00130.18 1SG 353 ATOM 353 N LEU 65 10.722 4.853 -5.282 1.00310.29 1SG 354 ATOM 354 CA LEU 65 10.092 5.291 -6.501 1.00310.29 1SG 355 ATOM 355 CB LEU 65 11.105 5.757 -7.586 1.00310.29 1SG 356 ATOM 356 CG LEU 65 10.595 6.098 -9.010 1.00310.29 1SG 357 ATOM 357 CD2 LEU 65 11.752 6.023 -10.025 1.00310.29 1SG 358 ATOM 358 CD1 LEU 65 9.802 7.408 -9.076 1.00310.29 1SG 359 ATOM 359 C LEU 65 9.257 4.178 -7.048 1.00310.29 1SG 360 ATOM 360 O LEU 65 8.206 3.827 -6.513 1.00310.29 1SG 361 ATOM 361 N ALA 66 9.748 3.584 -8.148 1.00244.27 1SG 362 ATOM 362 CA ALA 66 9.036 2.637 -8.938 1.00244.27 1SG 363 ATOM 363 CB ALA 66 9.883 2.053 -10.079 1.00244.27 1SG 364 ATOM 364 C ALA 66 8.572 1.509 -8.100 1.00244.27 1SG 365 ATOM 365 O ALA 66 9.270 1.031 -7.206 1.00244.27 1SG 366 ATOM 366 N HIS 67 7.324 1.085 -8.374 1.00142.46 1SG 367 ATOM 367 CA HIS 67 6.776 -0.044 -7.703 1.00142.46 1SG 368 ATOM 368 ND1 HIS 67 7.269 -1.436 -4.737 1.00142.46 1SG 369 ATOM 369 CG HIS 67 6.199 -0.957 -5.459 1.00142.46 1SG 370 ATOM 370 CB HIS 67 6.261 0.278 -6.296 1.00142.46 1SG 371 ATOM 371 NE2 HIS 67 5.591 -2.856 -4.411 1.00142.46 1SG 372 ATOM 372 CD2 HIS 67 5.183 -1.835 -5.250 1.00142.46 1SG 373 ATOM 373 CE1 HIS 67 6.850 -2.574 -4.129 1.00142.46 1SG 374 ATOM 374 C HIS 67 5.622 -0.488 -8.542 1.00142.46 1SG 375 ATOM 375 O HIS 67 5.099 0.287 -9.343 1.00142.46 1SG 376 ATOM 376 N GLN 68 5.204 -1.761 -8.406 1.00 85.87 1SG 377 ATOM 377 CA GLN 68 4.091 -2.202 -9.195 1.00 85.87 1SG 378 ATOM 378 CB GLN 68 4.470 -3.120 -10.372 1.00 85.87 1SG 379 ATOM 379 CG GLN 68 3.294 -3.452 -11.294 1.00 85.87 1SG 380 ATOM 380 CD GLN 68 3.817 -4.278 -12.456 1.00 85.87 1SG 381 ATOM 381 OE1 GLN 68 3.056 -4.676 -13.336 1.00 85.87 1SG 382 ATOM 382 NE2 GLN 68 5.151 -4.538 -12.465 1.00 85.87 1SG 383 ATOM 383 C GLN 68 3.132 -2.924 -8.299 1.00 85.87 1SG 384 ATOM 384 O GLN 68 3.431 -3.208 -7.139 1.00 85.87 1SG 385 ATOM 385 N GLU 69 1.930 -3.213 -8.836 1.00 73.17 1SG 386 ATOM 386 CA GLU 69 0.844 -3.827 -8.128 1.00 73.17 1SG 387 ATOM 387 CB GLU 69 -0.398 -3.985 -9.021 1.00 73.17 1SG 388 ATOM 388 CG GLU 69 -1.596 -4.624 -8.320 1.00 73.17 1SG 389 ATOM 389 CD GLU 69 -2.722 -4.703 -9.340 1.00 73.17 1SG 390 ATOM 390 OE1 GLU 69 -2.476 -4.316 -10.514 1.00 73.17 1SG 391 ATOM 391 OE2 GLU 69 -3.839 -5.148 -8.963 1.00 73.17 1SG 392 ATOM 392 C GLU 69 1.223 -5.197 -7.664 1.00 73.17 1SG 393 ATOM 393 O GLU 69 0.989 -5.552 -6.509 1.00 73.17 1SG 394 ATOM 394 N LYS 70 1.839 -6.001 -8.546 1.00 78.64 1SG 395 ATOM 395 CA LYS 70 2.188 -7.344 -8.182 1.00 78.64 1SG 396 ATOM 396 CB LYS 70 2.872 -8.110 -9.328 1.00 78.64 1SG 397 ATOM 397 CG LYS 70 1.971 -8.374 -10.538 1.00 78.64 1SG 398 ATOM 398 CD LYS 70 0.775 -9.285 -10.248 1.00 78.64 1SG 399 ATOM 399 CE LYS 70 -0.073 -9.588 -11.487 1.00 78.64 1SG 400 ATOM 400 NZ LYS 70 -1.128 -10.572 -11.155 1.00 78.64 1SG 401 ATOM 401 C LYS 70 3.164 -7.245 -7.060 1.00 78.64 1SG 402 ATOM 402 O LYS 70 3.175 -8.058 -6.137 1.00 78.64 1SG 403 ATOM 403 N HIS 71 4.007 -6.206 -7.135 1.00 79.38 1SG 404 ATOM 404 CA HIS 71 5.049 -5.908 -6.202 1.00 79.38 1SG 405 ATOM 405 ND1 HIS 71 6.071 -5.185 -9.208 1.00 79.38 1SG 406 ATOM 406 CG HIS 71 6.672 -5.152 -7.970 1.00 79.38 1SG 407 ATOM 407 CB HIS 71 5.955 -4.772 -6.704 1.00 79.38 1SG 408 ATOM 408 NE2 HIS 71 8.183 -5.802 -9.516 1.00 79.38 1SG 409 ATOM 409 CD2 HIS 71 7.962 -5.533 -8.177 1.00 79.38 1SG 410 ATOM 410 CE1 HIS 71 7.018 -5.579 -10.096 1.00 79.38 1SG 411 ATOM 411 C HIS 71 4.457 -5.533 -4.873 1.00 79.38 1SG 412 ATOM 412 O HIS 71 5.121 -5.658 -3.846 1.00 79.38 1SG 413 ATOM 413 N LEU 72 3.193 -5.064 -4.846 1.00129.16 1SG 414 ATOM 414 CA LEU 72 2.598 -4.581 -3.625 1.00129.16 1SG 415 ATOM 415 CB LEU 72 1.112 -4.212 -3.780 1.00129.16 1SG 416 ATOM 416 CG LEU 72 0.453 -3.761 -2.459 1.00129.16 1SG 417 ATOM 417 CD2 LEU 72 -1.076 -3.652 -2.596 1.00129.16 1SG 418 ATOM 418 CD1 LEU 72 1.099 -2.477 -1.919 1.00129.16 1SG 419 ATOM 419 C LEU 72 2.657 -5.629 -2.557 1.00129.16 1SG 420 ATOM 420 O LEU 72 3.029 -5.332 -1.423 1.00129.16 1SG 421 ATOM 421 N ALA 73 2.315 -6.887 -2.879 1.00 34.97 1SG 422 ATOM 422 CA ALA 73 2.344 -7.906 -1.869 1.00 34.97 1SG 423 ATOM 423 CB ALA 73 1.944 -9.292 -2.404 1.00 34.97 1SG 424 ATOM 424 C ALA 73 3.756 -7.990 -1.386 1.00 34.97 1SG 425 ATOM 425 O ALA 73 4.028 -8.219 -0.208 1.00 34.97 1SG 426 ATOM 426 N GLU 74 4.679 -7.772 -2.332 1.00115.94 1SG 427 ATOM 427 CA GLU 74 6.106 -7.810 -2.218 1.00115.94 1SG 428 ATOM 428 CB GLU 74 6.819 -7.797 -3.581 1.00115.94 1SG 429 ATOM 429 CG GLU 74 8.250 -8.335 -3.513 1.00115.94 1SG 430 ATOM 430 CD GLU 74 8.642 -8.763 -4.919 1.00115.94 1SG 431 ATOM 431 OE1 GLU 74 7.836 -8.520 -5.857 1.00115.94 1SG 432 ATOM 432 OE2 GLU 74 9.747 -9.349 -5.074 1.00115.94 1SG 433 ATOM 433 C GLU 74 6.571 -6.656 -1.378 1.00115.94 1SG 434 ATOM 434 O GLU 74 7.771 -6.482 -1.179 1.00115.94 1SG 435 ATOM 435 N GLU 75 5.623 -5.855 -0.848 1.00 84.07 1SG 436 ATOM 436 CA GLU 75 5.803 -4.589 -0.175 1.00 84.07 1SG 437 ATOM 437 CB GLU 75 4.538 -4.095 0.538 1.00 84.07 1SG 438 ATOM 438 CG GLU 75 4.714 -2.682 1.094 1.00 84.07 1SG 439 ATOM 439 CD GLU 75 3.404 -2.246 1.726 1.00 84.07 1SG 440 ATOM 440 OE1 GLU 75 2.437 -3.052 1.687 1.00 84.07 1SG 441 ATOM 441 OE2 GLU 75 3.353 -1.102 2.253 1.00 84.07 1SG 442 ATOM 442 C GLU 75 6.913 -4.620 0.843 1.00 84.07 1SG 443 ATOM 443 O GLU 75 7.441 -3.567 1.199 1.00 84.07 1SG 444 ATOM 444 N ALA 76 7.323 -5.815 1.318 1.00 79.90 1SG 445 ATOM 445 CA ALA 76 8.423 -6.073 2.231 1.00 79.90 1SG 446 ATOM 446 CB ALA 76 8.636 -7.574 2.498 1.00 79.90 1SG 447 ATOM 447 C ALA 76 9.685 -5.536 1.597 1.00 79.90 1SG 448 ATOM 448 O ALA 76 10.720 -5.352 2.236 1.00 79.90 1SG 449 ATOM 449 N PHE 77 9.555 -5.264 0.293 1.00165.65 1SG 450 ATOM 450 CA PHE 77 10.367 -4.824 -0.794 1.00165.65 1SG 451 ATOM 451 CB PHE 77 9.343 -4.342 -1.849 1.00165.65 1SG 452 ATOM 452 CG PHE 77 9.777 -4.137 -3.256 1.00165.65 1SG 453 ATOM 453 CD1 PHE 77 10.336 -2.955 -3.678 1.00165.65 1SG 454 ATOM 454 CD2 PHE 77 9.556 -5.136 -4.176 1.00165.65 1SG 455 ATOM 455 CE1 PHE 77 10.699 -2.784 -4.995 1.00165.65 1SG 456 ATOM 456 CE2 PHE 77 9.917 -4.975 -5.493 1.00165.65 1SG 457 ATOM 457 CZ PHE 77 10.495 -3.797 -5.904 1.00165.65 1SG 458 ATOM 458 C PHE 77 11.157 -3.634 -0.329 1.00165.65 1SG 459 ATOM 459 O PHE 77 12.280 -3.428 -0.782 1.00165.65 1SG 460 ATOM 460 N LEU 78 10.603 -2.816 0.585 1.00 88.43 1SG 461 ATOM 461 CA LEU 78 11.241 -1.576 0.926 1.00 88.43 1SG 462 ATOM 462 CB LEU 78 10.504 -0.841 2.055 1.00 88.43 1SG 463 ATOM 463 CG LEU 78 8.982 -0.818 1.829 1.00 88.43 1SG 464 ATOM 464 CD2 LEU 78 8.625 -0.829 0.339 1.00 88.43 1SG 465 ATOM 465 CD1 LEU 78 8.296 0.281 2.653 1.00 88.43 1SG 466 ATOM 466 C LEU 78 12.651 -1.799 1.391 1.00 88.43 1SG 467 ATOM 467 O LEU 78 13.576 -1.240 0.806 1.00 88.43 1SG 468 ATOM 468 N ARG 79 12.889 -2.647 2.411 1.00107.34 1SG 469 ATOM 469 CA ARG 79 14.251 -2.761 2.857 1.00107.34 1SG 470 ATOM 470 CB ARG 79 14.476 -3.744 4.018 1.00107.34 1SG 471 ATOM 471 CG ARG 79 14.274 -3.211 5.436 1.00107.34 1SG 472 ATOM 472 CD ARG 79 14.834 -4.201 6.463 1.00107.34 1SG 473 ATOM 473 NE ARG 79 14.744 -3.605 7.824 1.00107.34 1SG 474 ATOM 474 CZ ARG 79 14.911 -4.414 8.911 1.00107.34 1SG 475 ATOM 475 NH1 ARG 79 15.125 -5.752 8.740 1.00107.34 1SG 476 ATOM 476 NH2 ARG 79 14.864 -3.888 10.170 1.00107.34 1SG 477 ATOM 477 C ARG 79 15.120 -3.301 1.765 1.00107.34 1SG 478 ATOM 478 O ARG 79 16.166 -2.730 1.459 1.00107.34 1SG 479 ATOM 479 N ALA 80 14.705 -4.419 1.140 1.00 39.57 1SG 480 ATOM 480 CA ALA 80 15.581 -5.057 0.200 1.00 39.57 1SG 481 ATOM 481 CB ALA 80 15.013 -6.382 -0.341 1.00 39.57 1SG 482 ATOM 482 C ALA 80 15.837 -4.181 -0.979 1.00 39.57 1SG 483 ATOM 483 O ALA 80 16.984 -3.954 -1.359 1.00 39.57 1SG 484 ATOM 484 N TYR 81 14.760 -3.650 -1.581 1.00101.35 1SG 485 ATOM 485 CA TYR 81 14.886 -2.840 -2.753 1.00101.35 1SG 486 ATOM 486 CB TYR 81 13.553 -2.649 -3.490 1.00101.35 1SG 487 ATOM 487 CG TYR 81 13.246 -3.968 -4.129 1.00101.35 1SG 488 ATOM 488 CD1 TYR 81 12.722 -5.016 -3.405 1.00101.35 1SG 489 ATOM 489 CD2 TYR 81 13.475 -4.154 -5.475 1.00101.35 1SG 490 ATOM 490 CE1 TYR 81 12.440 -6.220 -4.012 1.00101.35 1SG 491 ATOM 491 CE2 TYR 81 13.196 -5.354 -6.088 1.00101.35 1SG 492 ATOM 492 CZ TYR 81 12.675 -6.393 -5.355 1.00101.35 1SG 493 ATOM 493 OH TYR 81 12.387 -7.627 -5.978 1.00101.35 1SG 494 ATOM 494 C TYR 81 15.522 -1.531 -2.420 1.00101.35 1SG 495 ATOM 495 O TYR 81 16.364 -1.042 -3.171 1.00101.35 1SG 496 ATOM 496 N ALA 82 15.150 -0.929 -1.275 1.00 35.08 1SG 497 ATOM 497 CA ALA 82 15.740 0.330 -0.921 1.00 35.08 1SG 498 ATOM 498 CB ALA 82 15.256 0.887 0.427 1.00 35.08 1SG 499 ATOM 499 C ALA 82 17.199 0.069 -0.801 1.00 35.08 1SG 500 ATOM 500 O ALA 82 18.029 0.884 -1.200 1.00 35.08 1SG 501 ATOM 501 N LYS 83 17.539 -1.113 -0.262 1.00 82.63 1SG 502 ATOM 502 CA LYS 83 18.908 -1.478 -0.094 1.00 82.63 1SG 503 ATOM 503 CB LYS 83 19.713 -1.319 -1.397 1.00 82.63 1SG 504 ATOM 504 CG LYS 83 21.057 -2.048 -1.407 1.00 82.63 1SG 505 ATOM 505 CD LYS 83 21.637 -2.211 -2.816 1.00 82.63 1SG 506 ATOM 506 CE LYS 83 22.980 -2.942 -2.855 1.00 82.63 1SG 507 ATOM 507 NZ LYS 83 23.446 -3.070 -4.255 1.00 82.63 1SG 508 ATOM 508 C LYS 83 19.472 -0.593 0.964 1.00 82.63 1SG 509 ATOM 509 O LYS 83 20.686 -0.485 1.127 1.00 82.63 1SG 510 ATOM 510 N ASP 84 18.570 0.059 1.724 1.00 77.74 1SG 511 ATOM 511 CA ASP 84 18.958 0.814 2.877 1.00 77.74 1SG 512 ATOM 512 CB ASP 84 18.048 2.030 3.128 1.00 77.74 1SG 513 ATOM 513 CG ASP 84 18.676 2.909 4.200 1.00 77.74 1SG 514 ATOM 514 OD1 ASP 84 19.599 2.423 4.907 1.00 77.74 1SG 515 ATOM 515 OD2 ASP 84 18.236 4.083 4.325 1.00 77.74 1SG 516 ATOM 516 C ASP 84 18.731 -0.180 3.960 1.00 77.74 1SG 517 ATOM 517 O ASP 84 17.631 -0.278 4.503 1.00 77.74 1SG 518 ATOM 518 N GLU 85 19.784 -0.955 4.287 1.00126.49 1SG 519 ATOM 519 CA GLU 85 19.578 -2.098 5.121 1.00126.49 1SG 520 ATOM 520 CB GLU 85 20.913 -2.863 5.289 1.00126.49 1SG 521 ATOM 521 CG GLU 85 20.823 -4.226 5.973 1.00126.49 1SG 522 ATOM 522 CD GLU 85 21.024 -5.293 4.907 1.00126.49 1SG 523 ATOM 523 OE1 GLU 85 21.253 -4.914 3.728 1.00126.49 1SG 524 ATOM 524 OE2 GLU 85 20.970 -6.501 5.261 1.00126.49 1SG 525 ATOM 525 C GLU 85 18.953 -1.700 6.439 1.00126.49 1SG 526 ATOM 526 O GLU 85 17.756 -1.949 6.575 1.00126.49 1SG 527 ATOM 527 N PRO 86 19.565 -1.086 7.431 1.00111.22 1SG 528 ATOM 528 CA PRO 86 18.672 -0.687 8.484 1.00111.22 1SG 529 ATOM 529 CD PRO 86 20.776 -1.661 8.014 1.00111.22 1SG 530 ATOM 530 CB PRO 86 19.212 -1.267 9.788 1.00111.22 1SG 531 ATOM 531 CG PRO 86 20.712 -1.390 9.522 1.00111.22 1SG 532 ATOM 532 C PRO 86 18.626 0.799 8.517 1.00111.22 1SG 533 ATOM 533 O PRO 86 19.517 1.430 7.950 1.00111.22 1SG 534 ATOM 534 N LEU 87 17.604 1.388 9.159 1.00294.45 1SG 535 ATOM 535 CA LEU 87 17.712 2.786 9.430 1.00294.45 1SG 536 ATOM 536 CB LEU 87 17.622 3.725 8.215 1.00294.45 1SG 537 ATOM 537 CG LEU 87 17.836 5.193 8.638 1.00294.45 1SG 538 ATOM 538 CD2 LEU 87 17.632 6.166 7.467 1.00294.45 1SG 539 ATOM 539 CD1 LEU 87 19.207 5.372 9.312 1.00294.45 1SG 540 ATOM 540 C LEU 87 16.618 3.145 10.372 1.00294.45 1SG 541 ATOM 541 O LEU 87 15.482 3.375 9.965 1.00294.45 1SG 542 ATOM 542 N TYR 88 16.942 3.186 11.676 1.00342.29 1SG 543 ATOM 543 CA TYR 88 15.978 3.595 12.649 1.00342.29 1SG 544 ATOM 544 CB TYR 88 15.476 2.483 13.585 1.00342.29 1SG 545 ATOM 545 CG TYR 88 14.680 3.181 14.635 1.00342.29 1SG 546 ATOM 546 CD1 TYR 88 13.376 3.554 14.403 1.00342.29 1SG 547 ATOM 547 CD2 TYR 88 15.244 3.470 15.857 1.00342.29 1SG 548 ATOM 548 CE1 TYR 88 12.647 4.204 15.370 1.00342.29 1SG 549 ATOM 549 CE2 TYR 88 14.520 4.122 16.831 1.00342.29 1SG 550 ATOM 550 CZ TYR 88 13.217 4.490 16.586 1.00342.29 1SG 551 ATOM 551 OH TYR 88 12.462 5.160 17.571 1.00342.29 1SG 552 ATOM 552 C TYR 88 16.656 4.592 13.517 1.00342.29 1SG 553 ATOM 553 O TYR 88 17.835 4.451 13.832 1.00342.29 1SG 554 ATOM 554 N ALA 89 15.928 5.651 13.912 1.00300.54 1SG 555 ATOM 555 CA ALA 89 16.548 6.593 14.785 1.00300.54 1SG 556 ATOM 556 CB ALA 89 17.349 7.677 14.054 1.00300.54 1SG 557 ATOM 557 C ALA 89 15.469 7.270 15.553 1.00300.54 1SG 558 ATOM 558 O ALA 89 14.333 7.386 15.097 1.00300.54 1SG 559 ATOM 559 N TRP 90 15.812 7.711 16.773 1.00344.26 1SG 560 ATOM 560 CA TRP 90 14.886 8.408 17.607 1.00344.26 1SG 561 ATOM 561 CB TRP 90 14.203 7.477 18.621 1.00344.26 1SG 562 ATOM 562 CG TRP 90 13.222 8.128 19.564 1.00344.26 1SG 563 ATOM 563 CD2 TRP 90 11.805 8.214 19.341 1.00344.26 1SG 564 ATOM 564 CD1 TRP 90 13.455 8.682 20.788 1.00344.26 1SG 565 ATOM 565 NE1 TRP 90 12.270 9.091 21.352 1.00344.26 1SG 566 ATOM 566 CE2 TRP 90 11.247 8.809 20.472 1.00344.26 1SG 567 ATOM 567 CE3 TRP 90 11.028 7.804 18.296 1.00344.26 1SG 568 ATOM 568 CZ2 TRP 90 9.899 8.998 20.575 1.00344.26 1SG 569 ATOM 569 CZ3 TRP 90 9.673 8.032 18.387 1.00344.26 1SG 570 ATOM 570 CH2 TRP 90 9.118 8.617 19.507 1.00344.26 1SG 571 ATOM 571 C TRP 90 15.698 9.397 18.367 1.00344.26 1SG 572 ATOM 572 O TRP 90 16.855 9.135 18.693 1.00344.26 1SG 573 ATOM 573 N VAL 91 15.129 10.583 18.646 1.00 70.15 1SG 574 ATOM 574 CA VAL 91 15.879 11.524 19.420 1.00 70.15 1SG 575 ATOM 575 CB VAL 91 16.163 12.815 18.713 1.00 70.15 1SG 576 ATOM 576 CG1 VAL 91 16.944 13.723 19.678 1.00 70.15 1SG 577 ATOM 577 CG2 VAL 91 16.899 12.511 17.398 1.00 70.15 1SG 578 ATOM 578 C VAL 91 15.036 11.866 20.597 1.00 70.15 1SG 579 ATOM 579 O VAL 91 13.848 12.151 20.457 1.00 70.15 1SG 580 ATOM 580 N LEU 92 15.629 11.847 21.803 1.00248.91 1SG 581 ATOM 581 CA LEU 92 14.818 12.174 22.932 1.00248.91 1SG 582 ATOM 582 CB LEU 92 15.185 11.383 24.199 1.00248.91 1SG 583 ATOM 583 CG LEU 92 14.276 11.695 25.401 1.00248.91 1SG 584 ATOM 584 CD2 LEU 92 14.835 11.076 26.694 1.00248.91 1SG 585 ATOM 585 CD1 LEU 92 12.821 11.282 25.116 1.00248.91 1SG 586 ATOM 586 C LEU 92 15.045 13.620 23.202 1.00248.91 1SG 587 ATOM 587 O LEU 92 16.014 14.009 23.853 1.00248.91 1SG 588 ATOM 588 N GLU 93 14.140 14.457 22.675 1.00321.41 1SG 589 ATOM 589 CA GLU 93 14.214 15.875 22.832 1.00321.41 1SG 590 ATOM 590 CB GLU 93 15.572 16.465 22.399 1.00321.41 1SG 591 ATOM 591 CG GLU 93 16.015 17.686 23.219 1.00321.41 1SG 592 ATOM 592 CD GLU 93 15.485 18.979 22.616 1.00321.41 1SG 593 ATOM 593 OE1 GLU 93 15.300 19.033 21.372 1.00321.41 1SG 594 ATOM 594 OE2 GLU 93 15.285 19.945 23.401 1.00321.41 1SG 595 ATOM 595 C GLU 93 13.148 16.325 21.892 1.00321.41 1SG 596 ATOM 596 O GLU 93 12.308 15.514 21.504 1.00321.41 1SG 597 ATOM 597 N ASN 94 13.108 17.606 21.497 1.00189.15 1SG 598 ATOM 598 CA ASN 94 12.065 17.924 20.567 1.00189.15 1SG 599 ATOM 599 CB ASN 94 11.824 19.440 20.407 1.00189.15 1SG 600 ATOM 600 CG ASN 94 11.260 19.995 21.711 1.00189.15 1SG 601 ATOM 601 OD1 ASN 94 10.946 19.250 22.638 1.00189.15 1SG 602 ATOM 602 ND2 ASN 94 11.118 21.347 21.784 1.00189.15 1SG 603 ATOM 603 C ASN 94 12.499 17.390 19.234 1.00189.15 1SG 604 ATOM 604 O ASN 94 13.113 18.107 18.444 1.00189.15 1SG 605 ATOM 605 N ALA 95 12.201 16.101 18.951 1.00304.12 1SG 606 ATOM 606 CA ALA 95 12.571 15.541 17.678 1.00304.12 1SG 607 ATOM 607 CB ALA 95 14.062 15.722 17.350 1.00304.12 1SG 608 ATOM 608 C ALA 95 12.281 14.065 17.679 1.00304.12 1SG 609 ATOM 609 O ALA 95 12.123 13.456 18.737 1.00304.12 1SG 610 ATOM 610 N PHE 96 12.196 13.460 16.468 1.00331.78 1SG 611 ATOM 611 CA PHE 96 11.953 12.048 16.297 1.00331.78 1SG 612 ATOM 612 CB PHE 96 10.457 11.683 16.339 1.00331.78 1SG 613 ATOM 613 CG PHE 96 9.957 12.155 17.669 1.00331.78 1SG 614 ATOM 614 CD1 PHE 96 10.105 11.398 18.808 1.00331.78 1SG 615 ATOM 615 CD2 PHE 96 9.358 13.389 17.786 1.00331.78 1SG 616 ATOM 616 CE1 PHE 96 9.645 11.864 20.021 1.00331.78 1SG 617 ATOM 617 CE2 PHE 96 8.897 13.856 18.997 1.00331.78 1SG 618 ATOM 618 CZ PHE 96 9.036 13.089 20.126 1.00331.78 1SG 619 ATOM 619 C PHE 96 12.536 11.681 14.953 1.00331.78 1SG 620 ATOM 620 O PHE 96 13.042 12.562 14.260 1.00331.78 1SG 621 ATOM 621 N ARG 97 12.504 10.386 14.532 1.00380.62 1SG 622 ATOM 622 CA ARG 97 13.186 10.090 13.294 1.00380.62 1SG 623 ATOM 623 CB ARG 97 14.631 9.620 13.519 1.00380.62 1SG 624 ATOM 624 CG ARG 97 15.544 10.000 12.355 1.00380.62 1SG 625 ATOM 625 CD ARG 97 16.973 10.314 12.800 1.00380.62 1SG 626 ATOM 626 NE ARG 97 17.731 10.783 11.612 1.00380.62 1SG 627 ATOM 627 CZ ARG 97 18.297 9.867 10.776 1.00380.62 1SG 628 ATOM 628 NH1 ARG 97 18.099 8.535 10.999 1.00380.62 1SG 629 ATOM 629 NH2 ARG 97 19.058 10.283 9.724 1.00380.62 1SG 630 ATOM 630 C ARG 97 12.427 9.108 12.431 1.00380.62 1SG 631 ATOM 631 O ARG 97 11.250 8.834 12.666 1.00380.62 1SG 632 ATOM 632 N TYR 98 13.102 8.575 11.380 1.00243.52 1SG 633 ATOM 633 CA TYR 98 12.507 7.772 10.333 1.00243.52 1SG 634 ATOM 634 CB TYR 98 12.776 8.380 8.946 1.00243.52 1SG 635 ATOM 635 CG TYR 98 13.070 7.261 8.026 1.00243.52 1SG 636 ATOM 636 CD1 TYR 98 12.094 6.467 7.470 1.00243.52 1SG 637 ATOM 637 CD2 TYR 98 14.390 7.045 7.721 1.00243.52 1SG 638 ATOM 638 CE1 TYR 98 12.456 5.435 6.635 1.00243.52 1SG 639 ATOM 639 CE2 TYR 98 14.753 6.024 6.893 1.00243.52 1SG 640 ATOM 640 CZ TYR 98 13.789 5.223 6.356 1.00243.52 1SG 641 ATOM 641 OH TYR 98 14.220 4.181 5.520 1.00243.52 1SG 642 ATOM 642 C TYR 98 12.905 6.336 10.325 1.00243.52 1SG 643 ATOM 643 O TYR 98 14.076 5.963 10.255 1.00243.52 1SG 644 ATOM 644 N GLU 99 11.863 5.491 10.384 1.00122.50 1SG 645 ATOM 645 CA GLU 99 11.940 4.072 10.264 1.00122.50 1SG 646 ATOM 646 CB GLU 99 11.973 3.325 11.611 1.00122.50 1SG 647 ATOM 647 CG GLU 99 12.117 1.810 11.445 1.00122.50 1SG 648 ATOM 648 CD GLU 99 12.513 1.197 12.783 1.00122.50 1SG 649 ATOM 649 OE1 GLU 99 11.777 1.408 13.783 1.00122.50 1SG 650 ATOM 650 OE2 GLU 99 13.562 0.498 12.816 1.00122.50 1SG 651 ATOM 651 C GLU 99 10.681 3.722 9.542 1.00122.50 1SG 652 ATOM 652 O GLU 99 9.857 4.598 9.284 1.00122.50 1SG 653 ATOM 653 N LYS 100 10.500 2.447 9.161 1.00 83.05 1SG 654 ATOM 654 CA LYS 100 9.315 2.103 8.430 1.00 83.05 1SG 655 ATOM 655 CB LYS 100 9.408 0.710 7.789 1.00 83.05 1SG 656 ATOM 656 CG LYS 100 8.273 0.360 6.827 1.00 83.05 1SG 657 ATOM 657 CD LYS 100 8.605 -0.870 5.979 1.00 83.05 1SG 658 ATOM 658 CE LYS 100 7.499 -1.295 5.014 1.00 83.05 1SG 659 ATOM 659 NZ LYS 100 8.002 -2.370 4.128 1.00 83.05 1SG 660 ATOM 660 C LYS 100 8.160 2.106 9.380 1.00 83.05 1SG 661 ATOM 661 O LYS 100 8.215 1.514 10.457 1.00 83.05 1SG 662 ATOM 662 N PRO 101 7.119 2.803 9.013 1.00 93.55 1SG 663 ATOM 663 CA PRO 101 5.932 2.832 9.819 1.00 93.55 1SG 664 ATOM 664 CD PRO 101 7.251 4.001 8.203 1.00 93.55 1SG 665 ATOM 665 CB PRO 101 5.122 4.046 9.350 1.00 93.55 1SG 666 ATOM 666 CG PRO 101 5.806 4.498 8.046 1.00 93.55 1SG 667 ATOM 667 C PRO 101 5.200 1.532 9.734 1.00 93.55 1SG 668 ATOM 668 O PRO 101 4.352 1.269 10.586 1.00 93.55 1SG 669 ATOM 669 N LEU 102 5.500 0.709 8.713 1.00 66.17 1SG 670 ATOM 670 CA LEU 102 4.788 -0.522 8.546 1.00 66.17 1SG 671 ATOM 671 CB LEU 102 4.822 -1.038 7.099 1.00 66.17 1SG 672 ATOM 672 CG LEU 102 4.086 -2.374 6.904 1.00 66.17 1SG 673 ATOM 673 CD2 LEU 102 4.427 -2.998 5.542 1.00 66.17 1SG 674 ATOM 674 CD1 LEU 102 2.575 -2.225 7.143 1.00 66.17 1SG 675 ATOM 675 C LEU 102 5.427 -1.575 9.385 1.00 66.17 1SG 676 ATOM 676 O LEU 102 6.557 -1.989 9.135 1.00 66.17 1SG 677 ATOM 677 N HIS 103 4.710 -2.048 10.418 1.00135.55 1SG 678 ATOM 678 CA HIS 103 5.279 -3.101 11.199 1.00135.55 1SG 679 ATOM 679 ND1 HIS 103 7.528 -3.933 13.500 1.00135.55 1SG 680 ATOM 680 CG HIS 103 6.162 -3.761 13.501 1.00135.55 1SG 681 ATOM 681 CB HIS 103 5.439 -2.726 12.686 1.00135.55 1SG 682 ATOM 682 NE2 HIS 103 6.699 -5.450 14.900 1.00135.55 1SG 683 ATOM 683 CD2 HIS 103 5.672 -4.696 14.362 1.00135.55 1SG 684 ATOM 684 CE1 HIS 103 7.795 -4.955 14.353 1.00135.55 1SG 685 ATOM 685 C HIS 103 4.340 -4.260 11.115 1.00135.55 1SG 686 ATOM 686 O HIS 103 4.027 -4.891 12.124 1.00135.55 1SG 687 ATOM 687 N VAL 104 3.841 -4.584 9.906 1.00 63.33 1SG 688 ATOM 688 CA VAL 104 2.979 -5.729 9.884 1.00 63.33 1SG 689 ATOM 689 CB VAL 104 1.532 -5.379 10.056 1.00 63.33 1SG 690 ATOM 690 CG1 VAL 104 0.696 -6.661 9.901 1.00 63.33 1SG 691 ATOM 691 CG2 VAL 104 1.357 -4.681 11.416 1.00 63.33 1SG 692 ATOM 692 C VAL 104 3.102 -6.427 8.569 1.00 63.33 1SG 693 ATOM 693 O VAL 104 2.686 -5.915 7.531 1.00 63.33 1SG 694 ATOM 694 N PRO 105 3.695 -7.587 8.602 1.00129.35 1SG 695 ATOM 695 CA PRO 105 3.744 -8.379 7.401 1.00129.35 1SG 696 ATOM 696 CD PRO 105 4.932 -7.695 9.362 1.00129.35 1SG 697 ATOM 697 CB PRO 105 5.017 -9.218 7.486 1.00129.35 1SG 698 ATOM 698 CG PRO 105 5.921 -8.426 8.443 1.00129.35 1SG 699 ATOM 699 C PRO 105 2.521 -9.240 7.330 1.00129.35 1SG 700 ATOM 700 O PRO 105 1.904 -9.474 8.368 1.00129.35 1SG 701 ATOM 701 N ARG 106 2.137 -9.708 6.125 1.00 65.97 1SG 702 ATOM 702 CA ARG 106 1.068 -10.661 6.039 1.00 65.97 1SG 703 ATOM 703 CB ARG 106 -0.329 -10.049 5.829 1.00 65.97 1SG 704 ATOM 704 CG ARG 106 -1.436 -11.106 5.764 1.00 65.97 1SG 705 ATOM 705 CD ARG 106 -2.842 -10.537 5.554 1.00 65.97 1SG 706 ATOM 706 NE ARG 106 -3.789 -11.687 5.515 1.00 65.97 1SG 707 ATOM 707 CZ ARG 106 -5.133 -11.468 5.415 1.00 65.97 1SG 708 ATOM 708 NH1 ARG 106 -5.614 -10.194 5.329 1.00 65.97 1SG 709 ATOM 709 NH2 ARG 106 -5.998 -12.525 5.399 1.00 65.97 1SG 710 ATOM 710 C ARG 106 1.362 -11.503 4.841 1.00 65.97 1SG 711 ATOM 711 O ARG 106 1.497 -10.986 3.733 1.00 65.97 1SG 712 ATOM 712 N ARG 107 1.490 -12.830 5.027 1.00 91.60 1SG 713 ATOM 713 CA ARG 107 1.760 -13.644 3.881 1.00 91.60 1SG 714 ATOM 714 CB ARG 107 2.100 -15.112 4.206 1.00 91.60 1SG 715 ATOM 715 CG ARG 107 2.616 -15.876 2.982 1.00 91.60 1SG 716 ATOM 716 CD ARG 107 3.114 -17.293 3.280 1.00 91.60 1SG 717 ATOM 717 NE ARG 107 3.576 -17.876 1.988 1.00 91.60 1SG 718 ATOM 718 CZ ARG 107 4.536 -18.847 1.975 1.00 91.60 1SG 719 ATOM 719 NH1 ARG 107 5.065 -19.301 3.148 1.00 91.60 1SG 720 ATOM 720 NH2 ARG 107 4.971 -19.361 0.787 1.00 91.60 1SG 721 ATOM 721 C ARG 107 0.556 -13.602 2.995 1.00 91.60 1SG 722 ATOM 722 O ARG 107 0.679 -13.492 1.776 1.00 91.60 1SG 723 ATOM 723 N PRO 108 -0.616 -13.674 3.569 1.00110.39 1SG 724 ATOM 724 CA PRO 108 -1.786 -13.604 2.742 1.00110.39 1SG 725 ATOM 725 CD PRO 108 -0.829 -14.551 4.713 1.00110.39 1SG 726 ATOM 726 CB PRO 108 -2.937 -14.154 3.581 1.00110.39 1SG 727 ATOM 727 CG PRO 108 -2.242 -15.133 4.541 1.00110.39 1SG 728 ATOM 728 C PRO 108 -1.998 -12.206 2.274 1.00110.39 1SG 729 ATOM 729 O PRO 108 -1.496 -11.279 2.908 1.00110.39 1SG 730 ATOM 730 N GLY 109 -2.726 -12.035 1.156 1.00 4.90 1SG 731 ATOM 731 CA GLY 109 -2.978 -10.720 0.655 1.00 4.90 1SG 732 ATOM 732 C GLY 109 -3.894 -10.873 -0.551 1.00 4.90 1SG 733 ATOM 733 O GLY 109 -4.040 -12.023 -1.044 1.00 4.90 1SG 734 ATOM 734 OXT GLY 109 -4.461 -9.839 -0.995 1.00 4.90 1SG 735 TER END