ATOM 1 C13 THI A 1 8.583 21.179 -0.121 1.00 8.13 ATOM 2 1H13 THI A 1 7.641 21.434 -0.029 1.00 12.23 ATOM 3 2H13 THI A 1 8.674 20.515 -0.838 1.00 12.23 ATOM 4 3H13 THI A 1 9.117 21.971 -0.342 1.00 12.23 ATOM 5 C12 THI A 1 9.088 20.571 1.207 1.00 7.02 ATOM 6 H12 THI A 1 8.551 19.749 1.394 1.00 8.44 ATOM 7 C14 THI A 1 10.535 20.175 1.134 1.00 9.79 ATOM 8 1H14 THI A 1 10.670 19.561 0.384 1.00 14.68 ATOM 9 2H14 THI A 1 10.796 19.732 1.965 1.00 14.68 ATOM 10 3H14 THI A 1 11.087 20.976 1.000 1.00 14.68 ATOM 11 O11 THI A 1 8.838 21.602 2.378 1.00 13.50 ATOM 12 C9 THI A 1 9.155 20.973 3.744 1.00 5.52 ATOM 13 O10 THI A 1 10.306 21.094 4.178 1.00 8.36 ATOM 14 C2 THI A 1 8.213 20.325 4.548 1.00 5.92 ATOM 15 N3 THI A 1 6.925 20.181 4.271 1.00 4.42 ATOM 16 N1 THI A 1 8.565 19.814 5.777 1.00 3.47 ATOM 17 C5 THI A 1 7.421 19.350 6.333 1.00 5.29 ATOM 18 O8 THI A 1 7.391 18.854 7.456 1.00 6.71 ATOM 19 C4 THI A 1 6.399 19.570 5.371 1.00 5.05 ATOM 20 C6 THI A 1 4.993 19.277 5.532 1.00 4.50 ATOM 21 S7 THI A 1 3.911 19.660 4.265 1.00 4.61 ATOM 22 N GLY A 2 4.573 18.766 6.678 1.00 4.26 ATOM 23 H GLY A 2 5.187 18.522 7.264 1.00 5.13 ATOM 24 CA GLY A 2 3.211 18.584 7.038 1.00 4.42 ATOM 25 1HA GLY A 2 2.721 19.435 6.909 1.00 5.36 ATOM 26 2HA GLY A 2 3.153 18.337 7.992 1.00 5.36 ATOM 27 C GLY A 2 2.560 17.501 6.202 1.00 3.71 ATOM 28 O GLY A 2 3.106 16.632 5.577 1.00 4.26 ATOM 29 N SER A 3 1.174 17.645 6.190 1.00 4.34 ATOM 30 H SER A 3 0.801 18.349 6.556 1.00 5.21 ATOM 31 CA SER A 3 0.373 16.661 5.588 1.00 3.94 ATOM 32 HA SER A 3 0.810 15.781 5.757 1.00 4.73 ATOM 33 CB SER A 3 -0.972 16.603 6.207 1.00 4.89 ATOM 34 1HB SER A 3 -1.456 15.795 5.898 1.00 5.84 ATOM 35 2HB SER A 3 -0.889 16.561 7.191 1.00 5.84 ATOM 36 OG SER A 3 -1.673 17.768 5.823 1.00 6.47 ATOM 37 HG SER A 3 -2.249 17.953 6.401 1.00 7.81 ATOM 38 C SER A 3 0.249 16.796 4.096 1.00 6.07 ATOM 39 O SER A 3 -0.508 16.039 3.484 1.00 9.08 ATOM 40 N CYS A 4 1.004 17.656 3.444 1.00 5.13 ATOM 41 H CYS A 4 1.441 18.243 3.936 1.00 6.15 ATOM 42 CA CYS A 4 1.180 17.727 2.026 1.00 4.34 ATOM 43 HA CYS A 4 0.669 16.958 1.637 1.00 5.21 ATOM 44 CB CYS A 4 0.684 18.945 1.356 1.00 5.76 ATOM 45 1HB CYS A 4 -0.258 19.107 1.613 1.00 6.86 ATOM 46 2HB CYS A 4 0.710 18.813 0.369 1.00 6.86 ATOM 47 SG CYS A 4 1.695 20.381 1.803 1.00 5.14 ATOM 48 C CYS A 4 2.618 17.515 1.649 1.00 5.21 ATOM 49 O CYS A 4 3.106 17.929 0.609 1.00 5.21 ATOM 50 N TYR A 5 3.364 16.796 2.528 1.00 4.73 ATOM 51 H TYR A 5 2.974 16.403 3.214 1.00 5.68 ATOM 52 CA TYR A 5 4.808 16.667 2.359 1.00 4.50 ATOM 53 HA TYR A 5 5.202 17.583 2.261 1.00 5.36 ATOM 54 CB TYR A 5 5.445 16.004 3.444 1.00 4.57 ATOM 55 HB TYR A 5 4.970 15.149 3.605 1.00 5.44 ATOM 56 HB TYR A 5 5.334 16.561 4.258 1.00 5.44 ATOM 57 CG TYR A 5 6.913 15.696 3.289 1.00 6.00 ATOM 58 CD1 TYR A 5 7.905 16.773 3.517 1.00 5.13 ATOM 59 HD1 TYR A 5 7.626 17.624 3.833 1.00 6.15 ATOM 60 CE1 TYR A 5 9.191 16.535 3.264 1.00 6.94 ATOM 61 HE1 TYR A 5 9.831 17.222 3.425 1.00 8.29 ATOM 62 CZ TYR A 5 9.587 15.387 2.816 1.00 7.10 ATOM 63 CE2 TYR A 5 8.762 14.313 2.609 1.00 6.71 ATOM 64 HE2 TYR A 5 9.106 13.473 2.329 1.00 8.05 ATOM 65 CD2 TYR A 5 7.471 14.489 2.828 1.00 5.05 ATOM 66 HD2 TYR A 5 6.883 13.761 2.652 1.00 6.07 ATOM 67 OH TYR A 5 10.978 15.197 2.645 1.00 10.42 ATOM 68 HH TYR A 5 11.119 14.433 2.329 1.00 12.47 ATOM 69 C TYR A 5 5.072 15.860 1.028 1.00 4.57 ATOM 70 O TYR A 5 4.567 14.756 0.833 1.00 5.76 ATOM 71 N13 HTI A 6 5.985 16.403 0.226 1.00 4.97 ATOM 72 C12 HTI A 6 6.443 15.646 -0.925 1.00 5.13 ATOM 73 1H12 HTI A 6 6.543 14.686 -0.707 1.00 6.23 ATOM 74 2H12 HTI A 6 5.809 15.740 -1.681 1.00 6.23 ATOM 75 C11 HTI A 6 7.723 16.244 -1.246 1.00 12.47 ATOM 76 1H11 HTI A 6 7.823 16.309 -2.230 1.00 15.00 ATOM 77 2H11 HTI A 6 8.451 15.666 -0.901 1.00 15.00 ATOM 78 C10 HTI A 6 7.840 17.583 -0.656 1.00 5.92 ATOM 79 1H10 HTI A 6 7.773 18.279 -1.356 1.00 7.10 ATOM 80 2H10 HTI A 6 8.709 17.683 -0.192 1.00 7.10 ATOM 81 C9 HTI A 6 6.669 17.712 0.344 1.00 5.05 ATOM 82 H9 HTI A 6 7.039 17.806 1.275 1.00 6.07 ATOM 83 C2 HTI A 6 5.821 18.878 0.041 1.00 4.42 ATOM 84 N1 HTI A 6 5.577 19.861 0.843 1.00 4.50 ATOM 85 N3 HTI A 6 5.284 18.916 -1.161 1.00 3.86 ATOM 86 C4 HTI A 6 4.509 20.081 -1.192 1.00 6.47 ATOM 87 O8 HTI A 6 3.869 20.463 -2.169 1.00 6.86 ATOM 88 C5 HTI A 6 4.779 20.686 0.053 1.00 4.97 ATOM 89 C6 HTI A 6 4.427 21.954 0.498 1.00 5.44 ATOM 90 S7 HTI A 6 4.855 22.609 1.991 1.00 5.77 ATOM 91 N SER A 7 3.728 22.723 -0.332 1.00 6.63 ATOM 92 H SER A 7 3.358 22.306 -1.015 1.00 7.97 ATOM 93 CA SER A 7 3.505 24.147 -0.279 1.00 7.57 ATOM 94 HA SER A 7 4.262 24.514 0.260 1.00 9.08 ATOM 95 CB SER A 7 3.587 24.816 -1.560 1.00 9.86 ATOM 96 1HB SER A 7 4.500 24.722 -1.926 1.00 11.84 ATOM 97 2HB SER A 7 3.393 25.779 -1.448 1.00 11.84 ATOM 98 OG SER A 7 2.610 24.214 -2.488 1.00 11.44 ATOM 99 HG SER A 7 2.063 24.798 -2.733 1.00 13.73 ATOM 100 C SER A 7 2.266 24.458 0.498 1.00 7.65 ATOM 101 O SER A 7 1.993 25.673 0.634 1.00 7.50 ATOM 102 N CYS A 8 1.526 23.530 1.059 1.00 5.84 ATOM 103 H CYS A 8 1.723 22.685 0.916 1.00 6.94 ATOM 104 CA CYS A 8 0.390 23.862 1.907 1.00 6.23 ATOM 105 HA CYS A 8 -0.232 24.455 1.394 1.00 7.50 ATOM 106 CB CYS A 8 -0.311 22.626 2.244 1.00 5.76 ATOM 107 1HB CYS A 8 -0.610 22.203 1.401 1.00 6.94 ATOM 108 2HB CYS A 8 -1.124 22.870 2.760 1.00 6.94 ATOM 109 SG CYS A 8 0.597 21.368 3.215 1.00 5.59 ATOM 110 C CYS A 8 0.763 24.555 3.189 1.00 8.21 ATOM 111 O CYS A 8 -0.132 25.127 3.826 1.00 10.10 ATOM 112 N 8 MET A 9 2.008 24.522 3.605 1.00 6.39 ATOM 113 H 8 MET A 9 2.615 24.050 3.172 1.00 7.65 ATOM 114 CA9 MET A 9 2.334 25.218 4.703 1.00 8.84 ATOM 115 HA9 MET A 9 1.635 25.101 5.405 1.00 10.58 ATOM 116 CB0 MET A 9 3.807 24.537 5.216 1.00 11.21 ATOM 117 1HB0 MET A 9 4.518 24.789 4.569 1.00 13.42 ATOM 118 2HB0 MET A 9 4.048 24.919 6.095 1.00 13.42 ATOM 123 CG1 MET A 9 3.766 23.043 5.325 1.00 11.13 ATOM 124 HG1 MET A 9 4.647 22.711 5.633 1.00 13.34 ATOM 125 HG1 MET A 9 3.578 22.647 4.440 1.00 13.34 ATOM 126 SD2 MET A 9 2.474 22.547 6.513 1.00 10.89 ATOM 127 CE3 MET A 9 3.381 22.456 8.084 1.00 10.81 ATOM 128 1HE3 MET A 9 2.844 22.852 8.796 1.00 16.26 ATOM 129 2HE3 MET A 9 4.233 22.920 8.004 1.00 16.26 ATOM 130 3HE3 MET A 9 3.552 21.505 8.306 1.00 16.26 ATOM 147 C MET A 9 2.727 26.721 4.581 1.00 9.63 ATOM 148 O MET A 9 2.592 27.176 3.393 1.00 9.86 ATOM 149 OXT MET A 9 2.959 27.408 5.572 1.00 9.39 TER 150 MET A 9 HETATM 151 CU CU A 10 5.590 20.531 2.782 1.00 4.94 19 15 17 20 CONECT 20 21 22 19 CONECT 180 176 178 181 CONECT 181 182 183 180 CONECT 47 44 109 CONECT 109 106 47 CONECT 214 211 281 CONECT 281 278 214 CONECT 15 14 19 151 CONECT 21 20 151 CONECT 90 89 151 CONECT 84 83 88 151 CONECT 176 180 175 311 CONECT 182 181 311 CONECT 257 256 311 CONECT 251 250 255 311 CONECT 88 89 84 86 CONECT 89 88 91 90 CONECT 255 256 251 253 CONECT 256 255 258 257 END