HETATM 1 C ACE A 1 4.522 -4.297 -4.163 1.00 0.00 C HETATM 2 O ACE A 1 5.004 -3.285 -3.693 1.00 0.00 O HETATM 3 CH3 ACE A 1 4.493 -5.605 -3.369 1.00 0.00 C HETATM 4 H1 ACE A 1 4.493 -5.386 -2.311 1.00 0.00 H HETATM 5 H2 ACE A 1 5.364 -6.194 -3.616 1.00 0.00 H HETATM 6 H3 ACE A 1 3.602 -6.160 -3.621 1.00 0.00 H ATOM 7 N CYS A 2 4.010 -4.313 -5.364 1.00 0.00 N ATOM 8 CA CYS A 2 4.007 -3.072 -6.194 1.00 0.00 C ATOM 9 C CYS A 2 2.624 -2.413 -6.141 1.00 0.00 C ATOM 10 O CYS A 2 1.786 -2.639 -6.992 1.00 0.00 O ATOM 11 CB CYS A 2 4.324 -3.543 -7.620 1.00 0.00 C ATOM 12 SG CYS A 2 5.924 -4.398 -7.649 1.00 0.00 S ATOM 13 H CYS A 2 3.628 -5.141 -5.722 1.00 0.00 H ATOM 14 HA CYS A 2 4.766 -2.388 -5.852 1.00 0.00 H ATOM 15 HB2 CYS A 2 3.552 -4.221 -7.953 1.00 0.00 H ATOM 16 HB3 CYS A 2 4.361 -2.689 -8.279 1.00 0.00 H ATOM 17 N ARG A 3 2.376 -1.601 -5.144 1.00 0.00 N ATOM 18 CA ARG A 3 1.044 -0.935 -5.033 1.00 0.00 C ATOM 19 C ARG A 3 1.214 0.565 -4.753 1.00 0.00 C ATOM 20 O ARG A 3 0.343 1.205 -4.195 1.00 0.00 O ATOM 21 CB ARG A 3 0.355 -1.628 -3.854 1.00 0.00 C ATOM 22 CG ARG A 3 -0.183 -2.990 -4.302 1.00 0.00 C ATOM 23 CD ARG A 3 -0.905 -3.666 -3.133 1.00 0.00 C ATOM 24 NE ARG A 3 -2.192 -2.928 -2.999 1.00 0.00 N ATOM 25 CZ ARG A 3 -2.387 -2.136 -1.979 1.00 0.00 C ATOM 26 NH1 ARG A 3 -2.131 -2.555 -0.770 1.00 0.00 N ATOM 27 NH2 ARG A 3 -2.838 -0.927 -2.169 1.00 0.00 N ATOM 28 H ARG A 3 3.064 -1.437 -4.466 1.00 0.00 H ATOM 29 HA ARG A 3 0.473 -1.087 -5.935 1.00 0.00 H ATOM 30 HB2 ARG A 3 1.067 -1.768 -3.054 1.00 0.00 H ATOM 31 HB3 ARG A 3 -0.465 -1.018 -3.505 1.00 0.00 H ATOM 32 HG2 ARG A 3 -0.873 -2.852 -5.122 1.00 0.00 H ATOM 33 HG3 ARG A 3 0.638 -3.613 -4.624 1.00 0.00 H ATOM 34 HD2 ARG A 3 -1.088 -4.708 -3.357 1.00 0.00 H ATOM 35 HD3 ARG A 3 -0.328 -3.570 -2.227 1.00 0.00 H ATOM 36 HE ARG A 3 -2.891 -3.036 -3.676 1.00 0.00 H ATOM 37 HH11 ARG A 3 -1.785 -3.482 -0.625 1.00 0.00 H ATOM 38 HH12 ARG A 3 -2.280 -1.948 0.010 1.00 0.00 H ATOM 39 HH21 ARG A 3 -3.033 -0.606 -3.096 1.00 0.00 H ATOM 40 HH22 ARG A 3 -2.987 -0.321 -1.389 1.00 0.00 H ATOM 41 N VAL A 4 2.327 1.130 -5.139 1.00 0.00 N ATOM 42 CA VAL A 4 2.556 2.588 -4.900 1.00 0.00 C ATOM 43 C VAL A 4 2.990 3.265 -6.211 1.00 0.00 C ATOM 44 O VAL A 4 3.236 2.605 -7.201 1.00 0.00 O ATOM 45 CB VAL A 4 3.651 2.649 -3.822 1.00 0.00 C ATOM 46 CG1 VAL A 4 4.784 1.680 -4.165 1.00 0.00 C ATOM 47 CG2 VAL A 4 4.211 4.071 -3.723 1.00 0.00 C ATOM 48 H VAL A 4 3.014 0.596 -5.589 1.00 0.00 H ATOM 49 HA VAL A 4 1.653 3.045 -4.529 1.00 0.00 H ATOM 50 HB VAL A 4 3.223 2.368 -2.870 1.00 0.00 H ATOM 51 HG11 VAL A 4 5.730 2.144 -3.944 1.00 0.00 H ATOM 52 HG12 VAL A 4 4.741 1.432 -5.215 1.00 0.00 H ATOM 53 HG13 VAL A 4 4.680 0.780 -3.577 1.00 0.00 H ATOM 54 HG21 VAL A 4 4.888 4.134 -2.884 1.00 0.00 H ATOM 55 HG22 VAL A 4 3.399 4.770 -3.585 1.00 0.00 H ATOM 56 HG23 VAL A 4 4.741 4.312 -4.632 1.00 0.00 H ATOM 57 N VAL A 5 3.062 4.572 -6.235 1.00 0.00 N ATOM 58 CA VAL A 5 3.452 5.268 -7.497 1.00 0.00 C ATOM 59 C VAL A 5 4.647 6.212 -7.290 1.00 0.00 C ATOM 60 O VAL A 5 5.785 5.861 -7.543 1.00 0.00 O ATOM 61 CB VAL A 5 2.199 6.044 -7.910 1.00 0.00 C ATOM 62 CG1 VAL A 5 2.493 6.885 -9.155 1.00 0.00 C ATOM 63 CG2 VAL A 5 1.077 5.054 -8.226 1.00 0.00 C ATOM 64 H VAL A 5 2.843 5.092 -5.437 1.00 0.00 H ATOM 65 HA VAL A 5 3.685 4.549 -8.251 1.00 0.00 H ATOM 66 HB VAL A 5 1.891 6.690 -7.101 1.00 0.00 H ATOM 67 HG11 VAL A 5 2.856 6.245 -9.946 1.00 0.00 H ATOM 68 HG12 VAL A 5 3.243 7.626 -8.918 1.00 0.00 H ATOM 69 HG13 VAL A 5 1.589 7.380 -9.477 1.00 0.00 H ATOM 70 HG21 VAL A 5 0.137 5.583 -8.282 1.00 0.00 H ATOM 71 HG22 VAL A 5 1.025 4.308 -7.446 1.00 0.00 H ATOM 72 HG23 VAL A 5 1.277 4.572 -9.172 1.00 0.00 H ATOM 73 N ARG A 6 4.395 7.412 -6.849 1.00 0.00 N ATOM 74 CA ARG A 6 5.509 8.392 -6.667 1.00 0.00 C ATOM 75 C ARG A 6 6.332 8.047 -5.431 1.00 0.00 C ATOM 76 O ARG A 6 5.833 7.972 -4.325 1.00 0.00 O ATOM 77 CB ARG A 6 4.817 9.748 -6.501 1.00 0.00 C ATOM 78 CG ARG A 6 5.803 10.871 -6.824 1.00 0.00 C ATOM 79 CD ARG A 6 5.410 12.132 -6.059 1.00 0.00 C ATOM 80 NE ARG A 6 4.397 12.795 -6.920 1.00 0.00 N ATOM 81 CZ ARG A 6 4.508 14.062 -7.194 1.00 0.00 C ATOM 82 NH1 ARG A 6 5.673 14.561 -7.511 1.00 0.00 N ATOM 83 NH2 ARG A 6 3.456 14.831 -7.149 1.00 0.00 N ATOM 84 H ARG A 6 3.473 7.672 -6.668 1.00 0.00 H ATOM 85 HA ARG A 6 6.140 8.409 -7.538 1.00 0.00 H ATOM 86 HB2 ARG A 6 3.974 9.806 -7.173 1.00 0.00 H ATOM 87 HB3 ARG A 6 4.473 9.855 -5.485 1.00 0.00 H ATOM 88 HG2 ARG A 6 6.798 10.575 -6.533 1.00 0.00 H ATOM 89 HG3 ARG A 6 5.783 11.077 -7.883 1.00 0.00 H ATOM 90 HD2 ARG A 6 4.982 11.870 -5.099 1.00 0.00 H ATOM 91 HD3 ARG A 6 6.265 12.774 -5.930 1.00 0.00 H ATOM 92 HE ARG A 6 3.647 12.280 -7.283 1.00 0.00 H ATOM 93 HH11 ARG A 6 6.479 13.968 -7.544 1.00 0.00 H ATOM 94 HH12 ARG A 6 5.760 15.533 -7.721 1.00 0.00 H ATOM 95 HH21 ARG A 6 2.566 14.445 -6.905 1.00 0.00 H ATOM 96 HH22 ARG A 6 3.539 15.804 -7.358 1.00 0.00 H ATOM 97 N GLY A 7 7.598 7.796 -5.645 1.00 0.00 N ATOM 98 CA GLY A 7 8.507 7.403 -4.540 1.00 0.00 C ATOM 99 C GLY A 7 8.851 5.939 -4.766 1.00 0.00 C ATOM 100 O GLY A 7 9.967 5.498 -4.579 1.00 0.00 O ATOM 101 H GLY A 7 7.948 7.834 -6.559 1.00 0.00 H ATOM 102 HA2 GLY A 7 9.405 8.009 -4.570 1.00 0.00 H ATOM 103 HA3 GLY A 7 8.011 7.517 -3.590 1.00 0.00 H ATOM 104 N ASP A 8 7.880 5.200 -5.219 1.00 0.00 N ATOM 105 CA ASP A 8 8.074 3.772 -5.532 1.00 0.00 C ATOM 106 C ASP A 8 6.972 3.382 -6.504 1.00 0.00 C ATOM 107 O ASP A 8 5.867 3.081 -6.108 1.00 0.00 O ATOM 108 CB ASP A 8 7.951 3.025 -4.205 1.00 0.00 C ATOM 109 CG ASP A 8 9.325 2.970 -3.536 1.00 0.00 C ATOM 110 OD1 ASP A 8 10.173 2.243 -4.029 1.00 0.00 O ATOM 111 OD2 ASP A 8 9.511 3.660 -2.548 1.00 0.00 O ATOM 112 H ASP A 8 7.005 5.609 -5.403 1.00 0.00 H ATOM 113 HA ASP A 8 9.045 3.609 -5.971 1.00 0.00 H ATOM 114 HB2 ASP A 8 7.253 3.541 -3.562 1.00 0.00 H ATOM 115 HB3 ASP A 8 7.605 2.020 -4.389 1.00 0.00 H ATOM 116 N TYR A 9 7.243 3.431 -7.770 1.00 0.00 N ATOM 117 CA TYR A 9 6.178 3.112 -8.761 1.00 0.00 C ATOM 118 C TYR A 9 5.971 1.606 -8.860 1.00 0.00 C ATOM 119 O TYR A 9 6.870 0.825 -8.621 1.00 0.00 O ATOM 120 CB TYR A 9 6.690 3.673 -10.089 1.00 0.00 C ATOM 121 CG TYR A 9 6.499 5.168 -10.090 1.00 0.00 C ATOM 122 CD1 TYR A 9 5.299 5.720 -10.551 1.00 0.00 C ATOM 123 CD2 TYR A 9 7.516 6.001 -9.613 1.00 0.00 C ATOM 124 CE1 TYR A 9 5.116 7.108 -10.537 1.00 0.00 C ATOM 125 CE2 TYR A 9 7.334 7.388 -9.600 1.00 0.00 C ATOM 126 CZ TYR A 9 6.134 7.941 -10.061 1.00 0.00 C ATOM 127 OH TYR A 9 5.956 9.310 -10.048 1.00 0.00 O ATOM 128 H TYR A 9 8.126 3.718 -8.065 1.00 0.00 H ATOM 129 HA TYR A 9 5.258 3.604 -8.489 1.00 0.00 H ATOM 130 HB2 TYR A 9 7.739 3.440 -10.201 1.00 0.00 H ATOM 131 HB3 TYR A 9 6.134 3.238 -10.905 1.00 0.00 H ATOM 132 HD1 TYR A 9 4.515 5.076 -10.920 1.00 0.00 H ATOM 133 HD2 TYR A 9 8.442 5.574 -9.259 1.00 0.00 H ATOM 134 HE1 TYR A 9 4.188 7.534 -10.888 1.00 0.00 H ATOM 135 HE2 TYR A 9 8.120 8.032 -9.230 1.00 0.00 H ATOM 136 HH TYR A 9 6.270 9.660 -10.887 1.00 0.00 H ATOM 137 N LEU A 10 4.776 1.199 -9.188 1.00 0.00 N ATOM 138 CA LEU A 10 4.481 -0.255 -9.281 1.00 0.00 C ATOM 139 C LEU A 10 4.626 -0.738 -10.722 1.00 0.00 C ATOM 140 O LEU A 10 3.789 -1.456 -11.233 1.00 0.00 O ATOM 141 CB LEU A 10 3.029 -0.382 -8.815 1.00 0.00 C ATOM 142 CG LEU A 10 2.113 0.384 -9.777 1.00 0.00 C ATOM 143 CD1 LEU A 10 0.986 -0.534 -10.247 1.00 0.00 C ATOM 144 CD2 LEU A 10 1.519 1.597 -9.063 1.00 0.00 C ATOM 145 H LEU A 10 4.067 1.853 -9.362 1.00 0.00 H ATOM 146 HA LEU A 10 5.129 -0.811 -8.627 1.00 0.00 H ATOM 147 HB2 LEU A 10 2.748 -1.425 -8.798 1.00 0.00 H ATOM 148 HB3 LEU A 10 2.934 0.032 -7.823 1.00 0.00 H ATOM 149 HG LEU A 10 2.685 0.713 -10.633 1.00 0.00 H ATOM 150 HD11 LEU A 10 0.470 -0.939 -9.389 1.00 0.00 H ATOM 151 HD12 LEU A 10 1.399 -1.343 -10.832 1.00 0.00 H ATOM 152 HD13 LEU A 10 0.291 0.029 -10.850 1.00 0.00 H ATOM 153 HD21 LEU A 10 2.158 2.454 -9.217 1.00 0.00 H ATOM 154 HD22 LEU A 10 1.439 1.392 -8.007 1.00 0.00 H ATOM 155 HD23 LEU A 10 0.538 1.804 -9.465 1.00 0.00 H ATOM 156 N ASP A 11 5.690 -0.365 -11.375 1.00 0.00 N ATOM 157 CA ASP A 11 5.892 -0.820 -12.775 1.00 0.00 C ATOM 158 C ASP A 11 6.678 -2.126 -12.736 1.00 0.00 C ATOM 159 O ASP A 11 7.783 -2.227 -13.232 1.00 0.00 O ATOM 160 CB ASP A 11 6.689 0.296 -13.459 1.00 0.00 C ATOM 161 CG ASP A 11 6.992 -0.106 -14.902 1.00 0.00 C ATOM 162 OD1 ASP A 11 6.075 -0.546 -15.578 1.00 0.00 O ATOM 163 OD2 ASP A 11 8.134 0.032 -15.308 1.00 0.00 O ATOM 164 H ASP A 11 6.359 0.203 -10.939 1.00 0.00 H ATOM 165 HA ASP A 11 4.943 -0.963 -13.270 1.00 0.00 H ATOM 166 HB2 ASP A 11 6.106 1.206 -13.454 1.00 0.00 H ATOM 167 HB3 ASP A 11 7.616 0.459 -12.929 1.00 0.00 H ATOM 168 N CYS A 12 6.103 -3.120 -12.117 1.00 0.00 N ATOM 169 CA CYS A 12 6.782 -4.435 -11.992 1.00 0.00 C ATOM 170 C CYS A 12 6.303 -5.384 -13.095 1.00 0.00 C ATOM 171 O CYS A 12 6.192 -6.575 -12.886 1.00 0.00 O ATOM 172 CB CYS A 12 6.367 -4.952 -10.610 1.00 0.00 C ATOM 173 SG CYS A 12 6.825 -3.740 -9.337 1.00 0.00 S ATOM 174 H CYS A 12 5.218 -2.992 -11.713 1.00 0.00 H ATOM 175 HA CYS A 12 7.850 -4.312 -12.035 1.00 0.00 H ATOM 176 HB2 CYS A 12 5.297 -5.104 -10.591 1.00 0.00 H ATOM 177 HB3 CYS A 12 6.865 -5.889 -10.410 1.00 0.00 H HETATM 178 N NH2 A 13 6.012 -4.900 -14.271 1.00 0.00 N HETATM 179 HN1 NH2 A 13 6.100 -3.940 -14.441 1.00 0.00 H HETATM 180 HN2 NH2 A 13 5.703 -5.498 -14.984 1.00 0.00 H TER 181 NH2 A 13