HETATM 1 N PCA A 1 -6.706 5.500 -2.908 1.00 1.21 N HETATM 2 CA PCA A 1 -5.272 5.307 -3.020 1.00 0.57 C HETATM 3 CB PCA A 1 -4.678 5.862 -1.713 1.00 1.66 C HETATM 4 CG PCA A 1 -5.886 6.002 -0.779 1.00 2.16 C HETATM 5 CD PCA A 1 -7.080 5.921 -1.707 1.00 1.81 C HETATM 6 OE PCA A 1 -8.228 6.196 -1.371 1.00 2.73 O HETATM 7 C PCA A 1 -4.929 3.833 -3.246 1.00 0.49 C HETATM 8 O PCA A 1 -5.792 2.964 -3.170 1.00 0.60 O HETATM 9 H1 PCA A 1 -7.350 5.282 -3.655 1.00 1.95 H HETATM 10 HA PCA A 1 -4.898 5.887 -3.864 1.00 1.28 H HETATM 11 HB2 PCA A 1 -4.253 6.848 -1.904 1.00 2.01 H HETATM 12 HB3 PCA A 1 -3.922 5.201 -1.286 1.00 2.36 H HETATM 13 HG2 PCA A 1 -5.861 6.954 -0.248 1.00 2.54 H HETATM 14 HG3 PCA A 1 -5.918 5.169 -0.077 1.00 2.97 H ATOM 15 N HIS A 2 -3.658 3.561 -3.542 1.00 0.37 N ATOM 16 CA HIS A 2 -3.152 2.240 -3.875 1.00 0.36 C ATOM 17 C HIS A 2 -1.639 2.399 -3.932 1.00 0.26 C ATOM 18 O HIS A 2 -1.081 2.771 -4.958 1.00 0.26 O ATOM 19 CB HIS A 2 -3.732 1.761 -5.219 1.00 0.44 C ATOM 20 CG HIS A 2 -3.081 0.531 -5.815 1.00 0.50 C ATOM 21 ND1 HIS A 2 -3.149 0.158 -7.138 1.00 0.56 N ATOM 22 CD2 HIS A 2 -2.303 -0.391 -5.169 1.00 0.56 C ATOM 23 CE1 HIS A 2 -2.420 -0.964 -7.280 1.00 0.64 C ATOM 24 NE2 HIS A 2 -1.892 -1.342 -6.106 1.00 0.65 N ATOM 25 H HIS A 2 -2.962 4.295 -3.494 1.00 0.31 H ATOM 26 HA HIS A 2 -3.423 1.534 -3.089 1.00 0.43 H ATOM 27 HB2 HIS A 2 -4.792 1.543 -5.086 1.00 0.52 H ATOM 28 HB3 HIS A 2 -3.647 2.571 -5.945 1.00 0.40 H ATOM 29 HD1 HIS A 2 -3.638 0.647 -7.873 1.00 0.58 H ATOM 30 HD2 HIS A 2 -2.028 -0.381 -4.129 1.00 0.59 H ATOM 31 HE1 HIS A 2 -2.273 -1.491 -8.214 1.00 0.72 H ATOM 32 N TRP A 3 -0.977 2.184 -2.799 1.00 0.22 N ATOM 33 CA TRP A 3 0.456 2.343 -2.683 1.00 0.20 C ATOM 34 C TRP A 3 0.937 1.439 -1.560 1.00 0.22 C ATOM 35 O TRP A 3 0.131 0.765 -0.914 1.00 0.26 O ATOM 36 CB TRP A 3 0.781 3.839 -2.507 1.00 0.17 C ATOM 37 CG TRP A 3 1.560 4.288 -1.309 1.00 0.21 C ATOM 38 CD1 TRP A 3 1.030 4.700 -0.138 1.00 0.23 C ATOM 39 CD2 TRP A 3 3.005 4.371 -1.142 1.00 0.31 C ATOM 40 NE1 TRP A 3 2.045 5.063 0.724 1.00 0.30 N ATOM 41 CE2 TRP A 3 3.287 4.870 0.160 1.00 0.34 C ATOM 42 CE3 TRP A 3 4.102 4.018 -1.951 1.00 0.40 C ATOM 43 CZ2 TRP A 3 4.598 5.015 0.638 1.00 0.44 C ATOM 44 CZ3 TRP A 3 5.422 4.148 -1.482 1.00 0.51 C ATOM 45 CH2 TRP A 3 5.671 4.643 -0.189 1.00 0.52 C ATOM 46 H TRP A 3 -1.448 1.909 -1.952 1.00 0.24 H ATOM 47 HA TRP A 3 0.936 1.987 -3.590 1.00 0.27 H ATOM 48 HB2 TRP A 3 1.320 4.156 -3.396 1.00 0.22 H ATOM 49 HB3 TRP A 3 -0.145 4.406 -2.507 1.00 0.15 H ATOM 50 HD1 TRP A 3 -0.028 4.742 0.073 1.00 0.24 H ATOM 51 HE1 TRP A 3 1.893 5.382 1.668 1.00 0.34 H ATOM 52 HE3 TRP A 3 3.905 3.623 -2.934 1.00 0.41 H ATOM 53 HZ2 TRP A 3 4.779 5.361 1.645 1.00 0.48 H ATOM 54 HZ3 TRP A 3 6.251 3.860 -2.112 1.00 0.59 H ATOM 55 HH2 TRP A 3 6.686 4.723 0.176 1.00 0.61 H ATOM 56 N SER A 4 2.251 1.400 -1.359 1.00 0.25 N ATOM 57 CA SER A 4 2.865 0.739 -0.228 1.00 0.27 C ATOM 58 C SER A 4 2.590 1.557 1.025 1.00 0.20 C ATOM 59 O SER A 4 3.421 2.332 1.484 1.00 0.22 O ATOM 60 CB SER A 4 4.366 0.539 -0.489 1.00 0.38 C ATOM 61 OG SER A 4 4.732 -0.791 -0.200 1.00 1.37 O ATOM 62 H SER A 4 2.826 2.014 -1.912 1.00 0.27 H ATOM 63 HA SER A 4 2.371 -0.219 -0.106 1.00 0.31 H ATOM 64 HB2 SER A 4 4.587 0.735 -1.538 1.00 1.12 H ATOM 65 HB3 SER A 4 4.964 1.222 0.114 1.00 0.79 H ATOM 66 HG SER A 4 5.685 -0.824 -0.083 1.00 2.02 H ATOM 67 N TYR A 5 1.372 1.413 1.540 1.00 0.20 N ATOM 68 CA TYR A 5 0.903 2.108 2.717 1.00 0.20 C ATOM 69 C TYR A 5 1.595 1.497 3.944 1.00 0.16 C ATOM 70 O TYR A 5 2.731 1.039 3.877 1.00 0.15 O ATOM 71 CB TYR A 5 -0.628 2.005 2.730 1.00 0.31 C ATOM 72 CG TYR A 5 -1.329 3.042 3.590 1.00 0.40 C ATOM 73 CD1 TYR A 5 -1.120 4.412 3.340 1.00 1.70 C ATOM 74 CD2 TYR A 5 -2.197 2.648 4.628 1.00 1.51 C ATOM 75 CE1 TYR A 5 -1.762 5.389 4.121 1.00 1.76 C ATOM 76 CE2 TYR A 5 -2.841 3.620 5.416 1.00 1.52 C ATOM 77 CZ TYR A 5 -2.629 4.993 5.165 1.00 0.63 C ATOM 78 OH TYR A 5 -3.271 5.923 5.927 1.00 0.76 O ATOM 79 H TYR A 5 0.738 0.787 1.069 1.00 0.24 H ATOM 80 HA TYR A 5 1.178 3.153 2.623 1.00 0.22 H ATOM 81 HB2 TYR A 5 -0.981 2.142 1.706 1.00 0.33 H ATOM 82 HB3 TYR A 5 -0.915 0.995 3.029 1.00 0.35 H ATOM 83 HD1 TYR A 5 -0.471 4.725 2.538 1.00 2.85 H ATOM 84 HD2 TYR A 5 -2.387 1.602 4.822 1.00 2.67 H ATOM 85 HE1 TYR A 5 -1.592 6.435 3.913 1.00 2.93 H ATOM 86 HE2 TYR A 5 -3.510 3.325 6.211 1.00 2.66 H ATOM 87 HH TYR A 5 -3.100 6.830 5.666 1.00 1.52 H ATOM 88 N GLY A 6 0.912 1.408 5.080 1.00 0.22 N ATOM 89 CA GLY A 6 1.466 0.735 6.252 1.00 0.19 C ATOM 90 C GLY A 6 1.384 -0.793 6.152 1.00 0.25 C ATOM 91 O GLY A 6 1.123 -1.449 7.155 1.00 0.55 O ATOM 92 H GLY A 6 -0.008 1.814 5.108 1.00 0.31 H ATOM 93 HA2 GLY A 6 2.511 1.020 6.378 1.00 0.18 H ATOM 94 HA3 GLY A 6 0.916 1.055 7.138 1.00 0.29 H ATOM 95 N LEU A 7 1.575 -1.369 4.959 1.00 0.20 N ATOM 96 CA LEU A 7 1.576 -2.795 4.682 1.00 0.26 C ATOM 97 C LEU A 7 2.131 -2.984 3.267 1.00 0.27 C ATOM 98 O LEU A 7 2.789 -2.098 2.727 1.00 0.38 O ATOM 99 CB LEU A 7 0.162 -3.385 4.852 1.00 0.43 C ATOM 100 CG LEU A 7 -0.864 -2.846 3.835 1.00 0.51 C ATOM 101 CD1 LEU A 7 -1.813 -3.969 3.408 1.00 0.71 C ATOM 102 CD2 LEU A 7 -1.700 -1.708 4.425 1.00 0.63 C ATOM 103 H LEU A 7 1.885 -0.823 4.166 1.00 0.35 H ATOM 104 HA LEU A 7 2.256 -3.294 5.370 1.00 0.37 H ATOM 105 HB2 LEU A 7 0.233 -4.468 4.764 1.00 0.51 H ATOM 106 HB3 LEU A 7 -0.197 -3.195 5.863 1.00 0.52 H ATOM 107 HG LEU A 7 -0.350 -2.468 2.953 1.00 0.47 H ATOM 108 HD11 LEU A 7 -2.448 -4.259 4.244 1.00 1.51 H ATOM 109 HD12 LEU A 7 -2.435 -3.625 2.582 1.00 1.62 H ATOM 110 HD13 LEU A 7 -1.246 -4.838 3.081 1.00 1.39 H ATOM 111 HD21 LEU A 7 -1.055 -0.873 4.690 1.00 1.45 H ATOM 112 HD22 LEU A 7 -2.430 -1.373 3.689 1.00 1.66 H ATOM 113 HD23 LEU A 7 -2.222 -2.051 5.318 1.00 1.20 H ATOM 114 N ARG A 8 1.867 -4.137 2.656 1.00 0.31 N ATOM 115 CA ARG A 8 2.325 -4.443 1.308 1.00 0.37 C ATOM 116 C ARG A 8 1.817 -3.422 0.284 1.00 0.30 C ATOM 117 O ARG A 8 0.713 -2.892 0.431 1.00 0.27 O ATOM 118 CB ARG A 8 1.879 -5.865 0.920 1.00 0.50 C ATOM 119 CG ARG A 8 0.349 -6.031 1.013 1.00 0.78 C ATOM 120 CD ARG A 8 -0.253 -6.769 -0.191 1.00 1.20 C ATOM 121 NE ARG A 8 -1.641 -6.337 -0.439 1.00 1.07 N ATOM 122 CZ ARG A 8 -2.590 -7.039 -1.073 1.00 1.54 C ATOM 123 NH1 ARG A 8 -2.349 -8.284 -1.483 1.00 2.24 N ATOM 124 NH2 ARG A 8 -3.781 -6.492 -1.304 1.00 1.77 N ATOM 125 H ARG A 8 1.309 -4.809 3.153 1.00 0.39 H ATOM 126 HA ARG A 8 3.411 -4.382 1.325 1.00 0.44 H ATOM 127 HB2 ARG A 8 2.214 -6.070 -0.095 1.00 0.73 H ATOM 128 HB3 ARG A 8 2.359 -6.589 1.582 1.00 0.74 H ATOM 129 HG2 ARG A 8 0.100 -6.570 1.928 1.00 1.02 H ATOM 130 HG3 ARG A 8 -0.123 -5.055 1.077 1.00 1.11 H ATOM 131 HD2 ARG A 8 0.330 -6.544 -1.085 1.00 1.80 H ATOM 132 HD3 ARG A 8 -0.207 -7.840 0.005 1.00 1.62 H ATOM 133 HE ARG A 8 -1.861 -5.394 -0.144 1.00 1.22 H ATOM 134 HH11 ARG A 8 -1.444 -8.698 -1.330 1.00 2.33 H ATOM 135 HH12 ARG A 8 -3.045 -8.828 -1.969 1.00 2.86 H ATOM 136 HH21 ARG A 8 -3.937 -5.505 -1.119 1.00 1.66 H ATOM 137 HH22 ARG A 8 -4.522 -6.982 -1.779 1.00 2.31 H ATOM 138 N PRO A 9 2.557 -3.201 -0.810 1.00 0.34 N ATOM 139 CA PRO A 9 2.056 -2.420 -1.918 1.00 0.39 C ATOM 140 C PRO A 9 0.955 -3.198 -2.629 1.00 0.56 C ATOM 141 O PRO A 9 1.216 -4.055 -3.468 1.00 1.19 O ATOM 142 CB PRO A 9 3.253 -2.125 -2.820 1.00 0.46 C ATOM 143 CG PRO A 9 4.279 -3.201 -2.466 1.00 0.52 C ATOM 144 CD PRO A 9 3.893 -3.703 -1.071 1.00 0.43 C ATOM 145 HA PRO A 9 1.644 -1.487 -1.547 1.00 0.36 H ATOM 146 HB2 PRO A 9 2.992 -2.154 -3.879 1.00 0.62 H ATOM 147 HB3 PRO A 9 3.655 -1.145 -2.574 1.00 0.41 H ATOM 148 HG2 PRO A 9 4.210 -4.020 -3.181 1.00 0.68 H ATOM 149 HG3 PRO A 9 5.283 -2.774 -2.464 1.00 0.60 H ATOM 150 HD2 PRO A 9 3.908 -4.792 -1.053 1.00 0.43 H ATOM 151 HD3 PRO A 9 4.586 -3.309 -0.328 1.00 0.51 H ATOM 152 N GLY A 10 -0.289 -2.888 -2.277 1.00 0.56 N ATOM 153 CA GLY A 10 -1.463 -3.423 -2.938 1.00 0.64 C ATOM 154 C GLY A 10 -2.708 -2.946 -2.204 1.00 0.79 C ATOM 155 O GLY A 10 -3.558 -3.749 -1.831 1.00 1.02 O ATOM 156 H GLY A 10 -0.407 -2.279 -1.476 1.00 0.96 H ATOM 157 HA2 GLY A 10 -1.489 -3.079 -3.974 1.00 0.66 H ATOM 158 HA3 GLY A 10 -1.427 -4.513 -2.930 1.00 0.75 H HETATM 159 N NH2 A 11 -2.799 -1.644 -1.938 1.00 0.87 N HETATM 160 HN1 NH2 A 11 -2.050 -1.018 -2.189 1.00 0.84 H HETATM 161 HN2 NH2 A 11 -3.618 -1.303 -1.458 1.00 1.07 H TER 162 NH2 A 11