ATOM 1 N HIS A 1 5.884 21.631 6.248 1.00 0.00 N ATOM 2 CA HIS A 1 4.398 21.563 6.322 1.00 0.00 C ATOM 3 C HIS A 1 3.837 20.567 5.306 1.00 0.00 C ATOM 4 O HIS A 1 3.924 20.792 4.098 1.00 0.00 O ATOM 5 CB HIS A 1 3.832 22.962 6.053 1.00 0.00 C ATOM 6 CG HIS A 1 4.258 23.990 7.058 1.00 0.00 C ATOM 7 ND1 HIS A 1 3.874 23.955 8.382 1.00 0.00 N ATOM 8 CD2 HIS A 1 5.051 25.080 6.928 1.00 0.00 C ATOM 9 CE1 HIS A 1 4.412 24.978 9.021 1.00 0.00 C ATOM 10 NE2 HIS A 1 5.132 25.676 8.162 1.00 0.00 N ATOM 11 H1 HIS A 1 6.273 21.938 7.163 1.00 0.00 H ATOM 12 H2 HIS A 1 6.178 22.309 5.516 1.00 0.00 H ATOM 13 H3 HIS A 1 6.275 20.695 6.015 1.00 0.00 H ATOM 14 HA HIS A 1 4.116 21.250 7.317 1.00 0.00 H ATOM 15 HB2 HIS A 1 4.162 23.294 5.080 1.00 0.00 H ATOM 16 HB3 HIS A 1 2.753 22.913 6.064 1.00 0.00 H ATOM 17 HD1 HIS A 1 3.291 23.283 8.791 1.00 0.00 H ATOM 18 HD2 HIS A 1 5.532 25.418 6.021 1.00 0.00 H ATOM 19 HE1 HIS A 1 4.285 25.205 10.069 1.00 0.00 H ATOM 20 HE2 HIS A 1 5.761 26.387 8.406 1.00 0.00 H HETATM 21 C KCY A 2 1.204 18.732 4.610 1.00 0.00 C HETATM 22 N KCY A 2 3.256 19.470 5.817 1.00 0.00 N HETATM 23 O KCY A 2 0.442 17.828 4.248 1.00 0.00 O HETATM 24 CA KCY A 2 2.660 18.413 4.982 1.00 0.00 C HETATM 25 CB KCY A 2 3.494 18.166 3.716 1.00 0.00 C HETATM 26 SD KCY A 2 3.276 15.402 4.031 1.00 0.00 S HETATM 27 CG KCY A 2 3.126 16.886 2.980 1.00 0.00 C HETATM 28 HN KCY A 2 3.223 19.369 6.791 1.00 0.00 H HETATM 29 HA KCY A 2 2.661 17.508 5.571 1.00 0.00 H HETATM 30 HB KCY A 2 3.352 18.995 3.038 1.00 0.00 H HETATM 31 HBA KCY A 2 4.537 18.111 3.991 1.00 0.00 H HETATM 32 HG KCY A 2 3.784 16.767 2.132 1.00 0.00 H HETATM 33 HGA KCY A 2 2.104 16.956 2.641 1.00 0.00 H ATOM 34 N GLU A 3 0.819 20.012 4.703 1.00 0.00 N ATOM 35 CA GLU A 3 -0.544 20.431 4.384 1.00 0.00 C ATOM 36 C GLU A 3 -0.860 20.179 2.914 1.00 0.00 C ATOM 37 O GLU A 3 -0.497 20.970 2.041 1.00 0.00 O ATOM 38 CB GLU A 3 -0.744 21.914 4.722 1.00 0.00 C ATOM 39 CG GLU A 3 -0.514 22.244 6.190 1.00 0.00 C ATOM 40 CD GLU A 3 -0.697 23.720 6.496 1.00 0.00 C ATOM 41 OE1 GLU A 3 -1.822 24.232 6.311 1.00 0.00 O ATOM 42 OE2 GLU A 3 0.286 24.364 6.920 1.00 0.00 O ATOM 43 H GLU A 3 1.464 20.686 4.998 1.00 0.00 H ATOM 44 HA GLU A 3 -1.218 19.841 4.986 1.00 0.00 H ATOM 45 HB2 GLU A 3 -0.057 22.503 4.132 1.00 0.00 H ATOM 46 HB3 GLU A 3 -1.756 22.195 4.467 1.00 0.00 H ATOM 47 HG2 GLU A 3 -1.215 21.680 6.786 1.00 0.00 H ATOM 48 HG3 GLU A 3 0.493 21.959 6.455 1.00 0.00 H ATOM 49 N GLY A 4 -1.537 19.063 2.653 1.00 0.00 N ATOM 50 CA GLY A 4 -1.892 18.710 1.292 1.00 0.00 C ATOM 51 C GLY A 4 -2.176 17.229 1.126 1.00 0.00 C ATOM 52 O GLY A 4 -3.074 16.848 0.373 1.00 0.00 O ATOM 53 H GLY A 4 -1.793 18.472 3.393 1.00 0.00 H ATOM 54 HA2 GLY A 4 -2.773 19.267 1.007 1.00 0.00 H ATOM 55 HA3 GLY A 4 -1.079 18.984 0.636 1.00 0.00 H HETATM 56 N HCS A 5 -1.405 16.389 1.823 1.00 0.00 N HETATM 57 CA HCS A 5 -1.579 14.937 1.735 1.00 0.00 C HETATM 58 CB HCS A 5 -0.215 14.236 1.799 1.00 0.00 C HETATM 59 CG HCS A 5 0.550 14.487 3.090 1.00 0.00 C HETATM 60 SD HCS A 5 2.291 13.965 2.990 1.00 0.00 S HETATM 61 C HCS A 5 -2.516 14.405 2.828 1.00 0.00 C HETATM 62 O HCS A 5 -2.262 13.355 3.422 1.00 0.00 O HETATM 63 H HCS A 5 -0.701 16.755 2.406 1.00 0.00 H HETATM 64 HCA HCS A 5 -2.030 14.725 0.777 1.00 0.00 H HETATM 65 HB2 HCS A 5 -0.366 13.172 1.699 1.00 0.00 H HETATM 66 HB3 HCS A 5 0.391 14.582 0.974 1.00 0.00 H HETATM 67 HG2 HCS A 5 0.528 15.543 3.313 1.00 0.00 H HETATM 68 HG3 HCS A 5 0.077 13.937 3.890 1.00 0.00 H ATOM 69 N PHE A 6 -3.609 15.130 3.074 1.00 0.00 N ATOM 70 CA PHE A 6 -4.594 14.732 4.081 1.00 0.00 C ATOM 71 C PHE A 6 -5.196 13.365 3.747 1.00 0.00 C ATOM 72 O PHE A 6 -5.351 12.516 4.627 1.00 0.00 O ATOM 73 CB PHE A 6 -5.701 15.789 4.183 1.00 0.00 C ATOM 74 CG PHE A 6 -6.772 15.469 5.190 1.00 0.00 C ATOM 75 CD1 PHE A 6 -6.448 14.939 6.431 1.00 0.00 C ATOM 76 CD2 PHE A 6 -8.106 15.700 4.894 1.00 0.00 C ATOM 77 CE1 PHE A 6 -7.433 14.647 7.353 1.00 0.00 C ATOM 78 CE2 PHE A 6 -9.095 15.410 5.813 1.00 0.00 C ATOM 79 CZ PHE A 6 -8.758 14.883 7.044 1.00 0.00 C ATOM 80 H PHE A 6 -3.764 15.947 2.557 1.00 0.00 H ATOM 81 HA PHE A 6 -4.086 14.665 5.031 1.00 0.00 H ATOM 82 HB2 PHE A 6 -5.260 16.734 4.463 1.00 0.00 H ATOM 83 HB3 PHE A 6 -6.175 15.895 3.217 1.00 0.00 H ATOM 84 HD1 PHE A 6 -5.412 14.754 6.674 1.00 0.00 H ATOM 85 HD2 PHE A 6 -8.371 16.112 3.931 1.00 0.00 H ATOM 86 HE1 PHE A 6 -7.168 14.235 8.315 1.00 0.00 H ATOM 87 HE2 PHE A 6 -10.131 15.595 5.569 1.00 0.00 H ATOM 88 HZ PHE A 6 -9.530 14.655 7.764 1.00 0.00 H ATOM 89 N THR A 7 -5.527 13.161 2.471 1.00 0.00 N ATOM 90 CA THR A 7 -6.106 11.898 2.013 1.00 0.00 C ATOM 91 C THR A 7 -5.155 10.723 2.257 1.00 0.00 C ATOM 92 O THR A 7 -5.603 9.603 2.511 1.00 0.00 O ATOM 93 CB THR A 7 -6.466 11.955 0.513 1.00 0.00 C ATOM 94 OG1 THR A 7 -7.380 13.032 0.272 1.00 0.00 O ATOM 95 CG2 THR A 7 -7.093 10.648 0.045 1.00 0.00 C ATOM 96 H THR A 7 -5.375 13.877 1.819 1.00 0.00 H ATOM 97 HA THR A 7 -7.014 11.730 2.571 1.00 0.00 H ATOM 98 HB THR A 7 -5.561 12.127 -0.053 1.00 0.00 H ATOM 99 HG1 THR A 7 -6.927 13.737 -0.196 1.00 0.00 H ATOM 100 HG21 THR A 7 -7.249 10.686 -1.024 1.00 0.00 H ATOM 101 HG22 THR A 7 -8.042 10.505 0.543 1.00 0.00 H ATOM 102 HG23 THR A 7 -6.433 9.825 0.282 1.00 0.00 H ATOM 103 N SER A 8 -3.843 10.984 2.178 1.00 0.00 N ATOM 104 CA SER A 8 -2.831 9.945 2.388 1.00 0.00 C ATOM 105 C SER A 8 -3.079 9.183 3.691 1.00 0.00 C ATOM 106 O SER A 8 -2.933 7.961 3.736 1.00 0.00 O ATOM 107 CB SER A 8 -1.428 10.560 2.399 1.00 0.00 C ATOM 108 OG SER A 8 -0.431 9.559 2.511 1.00 0.00 O ATOM 109 H SER A 8 -3.549 11.899 1.974 1.00 0.00 H ATOM 110 HA SER A 8 -2.900 9.251 1.565 1.00 0.00 H ATOM 111 HB2 SER A 8 -1.270 11.106 1.481 1.00 0.00 H ATOM 112 HB3 SER A 8 -1.339 11.233 3.238 1.00 0.00 H ATOM 113 HG SER A 8 0.378 9.863 2.094 1.00 0.00 H ATOM 114 N ASP A 9 -3.463 9.910 4.741 1.00 0.00 N ATOM 115 CA ASP A 9 -3.746 9.303 6.040 1.00 0.00 C ATOM 116 C ASP A 9 -4.875 8.276 5.930 1.00 0.00 C ATOM 117 O ASP A 9 -4.768 7.165 6.455 1.00 0.00 O ATOM 118 CB ASP A 9 -4.119 10.386 7.060 1.00 0.00 C ATOM 119 CG ASP A 9 -4.535 9.811 8.402 1.00 0.00 C ATOM 120 OD1 ASP A 9 -3.695 9.157 9.057 1.00 0.00 O ATOM 121 OD2 ASP A 9 -5.703 10.012 8.796 1.00 0.00 O ATOM 122 H ASP A 9 -3.568 10.879 4.636 1.00 0.00 H ATOM 123 HA ASP A 9 -2.851 8.801 6.372 1.00 0.00 H ATOM 124 HB2 ASP A 9 -3.265 11.030 7.217 1.00 0.00 H ATOM 125 HB3 ASP A 9 -4.938 10.972 6.670 1.00 0.00 H ATOM 126 N PHE A 10 -5.951 8.655 5.237 1.00 0.00 N ATOM 127 CA PHE A 10 -7.103 7.773 5.049 1.00 0.00 C ATOM 128 C PHE A 10 -6.698 6.510 4.301 1.00 0.00 C ATOM 129 O PHE A 10 -7.059 5.400 4.690 1.00 0.00 O ATOM 130 CB PHE A 10 -8.213 8.497 4.279 1.00 0.00 C ATOM 131 CG PHE A 10 -8.727 9.736 4.963 1.00 0.00 C ATOM 132 CD1 PHE A 10 -8.643 9.878 6.341 1.00 0.00 C ATOM 133 CD2 PHE A 10 -9.303 10.756 4.223 1.00 0.00 C ATOM 134 CE1 PHE A 10 -9.122 11.013 6.964 1.00 0.00 C ATOM 135 CE2 PHE A 10 -9.785 11.892 4.842 1.00 0.00 C ATOM 136 CZ PHE A 10 -9.694 12.021 6.213 1.00 0.00 C ATOM 137 H PHE A 10 -5.968 9.551 4.838 1.00 0.00 H ATOM 138 HA PHE A 10 -7.473 7.496 6.024 1.00 0.00 H ATOM 139 HB2 PHE A 10 -7.836 8.787 3.310 1.00 0.00 H ATOM 140 HB3 PHE A 10 -9.046 7.822 4.147 1.00 0.00 H ATOM 141 HD1 PHE A 10 -8.196 9.090 6.929 1.00 0.00 H ATOM 142 HD2 PHE A 10 -9.374 10.656 3.150 1.00 0.00 H ATOM 143 HE1 PHE A 10 -9.050 11.113 8.037 1.00 0.00 H ATOM 144 HE2 PHE A 10 -10.230 12.680 4.253 1.00 0.00 H ATOM 145 HZ PHE A 10 -10.071 12.908 6.699 1.00 0.00 H HETATM 146 C PH8 A 11 -4.056 5.150 2.835 1.00 0.00 C HETATM 147 N PH8 A 11 -5.940 6.692 3.227 1.00 0.00 N HETATM 148 O PH8 A 11 -3.237 4.772 1.996 1.00 0.00 O HETATM 149 CA PH8 A 11 -5.474 5.572 2.419 1.00 0.00 C HETATM 150 CB PH8 A 11 -5.520 5.957 0.934 1.00 0.00 C HETATM 151 CG PH8 A 11 -6.852 4.704 -2.008 1.00 0.00 C HETATM 152 CI PH8 A 11 -5.278 4.797 -0.022 1.00 0.00 C HETATM 153 CJ PH8 A 11 -5.541 5.204 -1.466 1.00 0.00 C HETATM 154 CZ PH8 A 11 -9.276 3.776 -3.006 1.00 0.00 C HETATM 155 CD1 PH8 A 11 -6.884 3.749 -3.013 1.00 0.00 C HETATM 156 CD2 PH8 A 11 -8.053 5.186 -1.510 1.00 0.00 C HETATM 157 CE1 PH8 A 11 -8.087 3.286 -3.511 1.00 0.00 C HETATM 158 CE2 PH8 A 11 -9.258 4.727 -2.005 1.00 0.00 C HETATM 159 HN PH8 A 11 -5.684 7.604 2.975 1.00 0.00 H HETATM 160 HA PH8 A 11 -6.145 4.743 2.586 1.00 0.00 H HETATM 161 HZ PH8 A 11 -10.217 3.415 -3.393 1.00 0.00 H HETATM 162 HB PH8 A 11 -6.491 6.375 0.715 1.00 0.00 H HETATM 163 HBA PH8 A 11 -4.767 6.709 0.748 1.00 0.00 H HETATM 164 HD1 PH8 A 11 -5.955 3.365 -3.409 1.00 0.00 H HETATM 165 HD2 PH8 A 11 -8.041 5.931 -0.728 1.00 0.00 H HETATM 166 HE1 PH8 A 11 -8.098 2.543 -4.294 1.00 0.00 H HETATM 167 HE2 PH8 A 11 -10.186 5.111 -1.608 1.00 0.00 H HETATM 168 HI PH8 A 11 -4.252 4.476 0.068 1.00 0.00 H HETATM 169 HIA PH8 A 11 -5.937 3.983 0.240 1.00 0.00 H HETATM 170 HJ PH8 A 11 -4.749 4.811 -2.086 1.00 0.00 H HETATM 171 HJA PH8 A 11 -5.542 6.282 -1.528 1.00 0.00 H HETATM 172 N NH2 A 12 -3.764 5.205 4.135 1.00 0.00 N HETATM 173 HN1 NH2 A 12 -4.455 5.515 4.759 1.00 0.00 H HETATM 174 HN2 NH2 A 12 -2.866 4.932 4.417 1.00 0.00 H TER 175 NH2 A 12