HETATM 1 N PCA A 1 -4.453 6.389 -2.959 1.00 2.25 N HETATM 2 CA PCA A 1 -5.563 5.500 -2.650 1.00 0.76 C HETATM 3 CB PCA A 1 -6.717 5.952 -3.568 1.00 2.53 C HETATM 4 CG PCA A 1 -6.048 6.858 -4.607 1.00 3.58 C HETATM 5 CD PCA A 1 -4.703 7.186 -3.992 1.00 3.24 C HETATM 6 OE PCA A 1 -3.959 8.069 -4.404 1.00 5.01 O HETATM 7 C PCA A 1 -5.217 4.022 -2.854 1.00 0.75 C HETATM 8 O PCA A 1 -6.073 3.166 -2.651 1.00 0.94 O HETATM 9 H1 PCA A 1 -3.641 6.496 -2.369 1.00 3.68 H HETATM 10 HA PCA A 1 -5.853 5.637 -1.609 1.00 2.20 H HETATM 11 HB2 PCA A 1 -7.433 6.535 -2.987 1.00 3.06 H HETATM 12 HB3 PCA A 1 -7.222 5.111 -4.048 1.00 3.82 H HETATM 13 HG2 PCA A 1 -6.636 7.762 -4.775 1.00 4.25 H HETATM 14 HG3 PCA A 1 -5.897 6.318 -5.543 1.00 4.99 H ATOM 15 N HIS A 2 -3.986 3.709 -3.262 1.00 0.60 N ATOM 16 CA HIS A 2 -3.575 2.353 -3.592 1.00 0.67 C ATOM 17 C HIS A 2 -2.061 2.398 -3.748 1.00 0.54 C ATOM 18 O HIS A 2 -1.542 2.709 -4.817 1.00 0.57 O ATOM 19 CB HIS A 2 -4.276 1.886 -4.881 1.00 0.85 C ATOM 20 CG HIS A 2 -3.765 0.595 -5.475 1.00 0.99 C ATOM 21 ND1 HIS A 2 -3.931 0.207 -6.786 1.00 1.14 N ATOM 22 CD2 HIS A 2 -3.048 -0.388 -4.843 1.00 1.06 C ATOM 23 CE1 HIS A 2 -3.315 -0.976 -6.941 1.00 1.28 C ATOM 24 NE2 HIS A 2 -2.760 -1.376 -5.786 1.00 1.23 N ATOM 25 H HIS A 2 -3.271 4.422 -3.319 1.00 0.47 H ATOM 26 HA HIS A 2 -3.841 1.683 -2.774 1.00 0.74 H ATOM 27 HB2 HIS A 2 -5.339 1.757 -4.675 1.00 0.97 H ATOM 28 HB3 HIS A 2 -4.175 2.668 -5.636 1.00 0.79 H ATOM 29 HD1 HIS A 2 -4.425 0.721 -7.502 1.00 1.18 H ATOM 30 HD2 HIS A 2 -2.743 -0.399 -3.808 1.00 1.02 H ATOM 31 HE1 HIS A 2 -3.269 -1.533 -7.866 1.00 1.43 H ATOM 32 N TRP A 3 -1.345 2.147 -2.658 1.00 0.44 N ATOM 33 CA TRP A 3 0.103 2.202 -2.626 1.00 0.42 C ATOM 34 C TRP A 3 0.578 1.333 -1.471 1.00 0.41 C ATOM 35 O TRP A 3 -0.239 0.795 -0.723 1.00 0.42 O ATOM 36 CB TRP A 3 0.542 3.676 -2.553 1.00 0.33 C ATOM 37 CG TRP A 3 1.449 4.119 -1.450 1.00 0.34 C ATOM 38 CD1 TRP A 3 1.058 4.655 -0.275 1.00 0.31 C ATOM 39 CD2 TRP A 3 2.902 4.070 -1.400 1.00 0.57 C ATOM 40 NE1 TRP A 3 2.171 4.968 0.481 1.00 0.50 N ATOM 41 CE2 TRP A 3 3.340 4.622 -0.165 1.00 0.62 C ATOM 42 CE3 TRP A 3 3.884 3.560 -2.268 1.00 0.79 C ATOM 43 CZ2 TRP A 3 4.696 4.673 0.192 1.00 0.83 C ATOM 44 CZ3 TRP A 3 5.248 3.597 -1.923 1.00 1.00 C ATOM 45 CH2 TRP A 3 5.654 4.152 -0.695 1.00 1.00 C ATOM 46 H TRP A 3 -1.786 1.917 -1.781 1.00 0.44 H ATOM 47 HA TRP A 3 0.501 1.762 -3.536 1.00 0.57 H ATOM 48 HB2 TRP A 3 1.019 3.912 -3.501 1.00 0.47 H ATOM 49 HB3 TRP A 3 -0.340 4.305 -2.500 1.00 0.23 H ATOM 50 HD1 TRP A 3 0.029 4.817 0.009 1.00 0.31 H ATOM 51 HE1 TRP A 3 2.129 5.361 1.407 1.00 0.59 H ATOM 52 HE3 TRP A 3 3.550 3.117 -3.194 1.00 0.84 H ATOM 53 HZ2 TRP A 3 4.995 5.067 1.151 1.00 0.91 H ATOM 54 HZ3 TRP A 3 5.989 3.190 -2.597 1.00 1.18 H ATOM 55 HH2 TRP A 3 6.700 4.163 -0.424 1.00 1.17 H ATOM 56 N SER A 4 1.893 1.170 -1.341 1.00 0.48 N ATOM 57 CA SER A 4 2.471 0.507 -0.191 1.00 0.53 C ATOM 58 C SER A 4 2.361 1.441 1.002 1.00 0.32 C ATOM 59 O SER A 4 3.294 2.164 1.331 1.00 0.36 O ATOM 60 CB SER A 4 3.928 0.104 -0.443 1.00 0.76 C ATOM 61 OG SER A 4 4.272 -1.000 0.371 1.00 1.67 O ATOM 62 H SER A 4 2.487 1.716 -1.941 1.00 0.50 H ATOM 63 HA SER A 4 1.869 -0.377 0.001 1.00 0.63 H ATOM 64 HB2 SER A 4 4.051 -0.183 -1.485 1.00 1.49 H ATOM 65 HB3 SER A 4 4.601 0.940 -0.247 1.00 0.79 H ATOM 66 HG SER A 4 3.979 -0.841 1.281 1.00 2.27 H ATOM 67 N TYR A 5 1.186 1.442 1.618 1.00 0.26 N ATOM 68 CA TYR A 5 0.878 2.268 2.762 1.00 0.28 C ATOM 69 C TYR A 5 1.646 1.730 3.979 1.00 0.29 C ATOM 70 O TYR A 5 2.752 1.212 3.864 1.00 0.20 O ATOM 71 CB TYR A 5 -0.649 2.269 2.922 1.00 0.49 C ATOM 72 CG TYR A 5 -1.172 3.425 3.750 1.00 0.68 C ATOM 73 CD1 TYR A 5 -0.879 4.742 3.351 1.00 1.97 C ATOM 74 CD2 TYR A 5 -1.906 3.195 4.929 1.00 1.47 C ATOM 75 CE1 TYR A 5 -1.284 5.828 4.142 1.00 2.19 C ATOM 76 CE2 TYR A 5 -2.309 4.279 5.731 1.00 1.51 C ATOM 77 CZ TYR A 5 -1.992 5.602 5.342 1.00 1.22 C ATOM 78 OH TYR A 5 -2.354 6.665 6.112 1.00 1.54 O ATOM 79 H TYR A 5 0.460 0.862 1.225 1.00 0.39 H ATOM 80 HA TYR A 5 1.206 3.280 2.550 1.00 0.31 H ATOM 81 HB2 TYR A 5 -1.094 2.347 1.928 1.00 0.48 H ATOM 82 HB3 TYR A 5 -0.969 1.312 3.338 1.00 0.60 H ATOM 83 HD1 TYR A 5 -0.334 4.928 2.439 1.00 3.04 H ATOM 84 HD2 TYR A 5 -2.158 2.189 5.234 1.00 2.60 H ATOM 85 HE1 TYR A 5 -1.051 6.840 3.843 1.00 3.37 H ATOM 86 HE2 TYR A 5 -2.860 4.091 6.640 1.00 2.53 H ATOM 87 HH TYR A 5 -2.776 6.423 6.939 1.00 1.54 H ATOM 88 N GLY A 6 1.030 1.717 5.154 1.00 0.43 N ATOM 89 CA GLY A 6 1.556 0.962 6.288 1.00 0.34 C ATOM 90 C GLY A 6 1.398 -0.557 6.114 1.00 0.37 C ATOM 91 O GLY A 6 1.331 -1.274 7.108 1.00 0.50 O ATOM 92 H GLY A 6 0.146 2.189 5.223 1.00 0.59 H ATOM 93 HA2 GLY A 6 2.614 1.193 6.417 1.00 0.27 H ATOM 94 HA3 GLY A 6 1.027 1.264 7.191 1.00 0.45 H ATOM 95 N LEU A 7 1.323 -1.064 4.879 1.00 0.42 N ATOM 96 CA LEU A 7 1.286 -2.473 4.554 1.00 0.52 C ATOM 97 C LEU A 7 1.931 -2.659 3.177 1.00 0.37 C ATOM 98 O LEU A 7 2.577 -1.759 2.638 1.00 0.34 O ATOM 99 CB LEU A 7 -0.159 -3.006 4.604 1.00 0.79 C ATOM 100 CG LEU A 7 -1.058 -2.462 3.476 1.00 0.87 C ATOM 101 CD1 LEU A 7 -1.726 -3.612 2.714 1.00 1.19 C ATOM 102 CD2 LEU A 7 -2.149 -1.563 4.062 1.00 0.96 C ATOM 103 H LEU A 7 1.532 -0.489 4.077 1.00 0.43 H ATOM 104 HA LEU A 7 1.883 -3.011 5.293 1.00 0.62 H ATOM 105 HB2 LEU A 7 -0.133 -4.094 4.559 1.00 0.87 H ATOM 106 HB3 LEU A 7 -0.591 -2.754 5.575 1.00 0.98 H ATOM 107 HG LEU A 7 -0.464 -1.884 2.767 1.00 0.85 H ATOM 108 HD11 LEU A 7 -0.973 -4.145 2.139 1.00 2.21 H ATOM 109 HD12 LEU A 7 -2.229 -4.279 3.416 1.00 1.24 H ATOM 110 HD13 LEU A 7 -2.459 -3.203 2.018 1.00 2.31 H ATOM 111 HD21 LEU A 7 -1.693 -0.771 4.657 1.00 1.30 H ATOM 112 HD22 LEU A 7 -2.730 -1.112 3.257 1.00 2.07 H ATOM 113 HD23 LEU A 7 -2.814 -2.148 4.699 1.00 1.49 H ATOM 114 N ARG A 8 1.754 -3.850 2.613 1.00 0.39 N ATOM 115 CA ARG A 8 2.425 -4.270 1.394 1.00 0.40 C ATOM 116 C ARG A 8 1.889 -3.471 0.206 1.00 0.33 C ATOM 117 O ARG A 8 0.724 -3.062 0.227 1.00 0.38 O ATOM 118 CB ARG A 8 2.231 -5.781 1.155 1.00 0.66 C ATOM 119 CG ARG A 8 2.335 -6.678 2.410 1.00 2.48 C ATOM 120 CD ARG A 8 1.185 -7.694 2.498 1.00 3.23 C ATOM 121 NE ARG A 8 -0.139 -7.056 2.385 1.00 3.23 N ATOM 122 CZ ARG A 8 -1.315 -7.694 2.416 1.00 3.39 C ATOM 123 NH1 ARG A 8 -1.361 -8.997 2.694 1.00 3.65 N ATOM 124 NH2 ARG A 8 -2.442 -7.026 2.160 1.00 3.53 N ATOM 125 H ARG A 8 1.145 -4.488 3.086 1.00 0.55 H ATOM 126 HA ARG A 8 3.478 -4.032 1.517 1.00 0.56 H ATOM 127 HB2 ARG A 8 1.265 -5.925 0.673 1.00 1.40 H ATOM 128 HB3 ARG A 8 2.974 -6.125 0.438 1.00 1.30 H ATOM 129 HG2 ARG A 8 3.279 -7.223 2.378 1.00 3.19 H ATOM 130 HG3 ARG A 8 2.346 -6.094 3.329 1.00 3.37 H ATOM 131 HD2 ARG A 8 1.299 -8.419 1.691 1.00 3.61 H ATOM 132 HD3 ARG A 8 1.256 -8.216 3.453 1.00 3.99 H ATOM 133 HE ARG A 8 -0.134 -6.077 2.148 1.00 3.27 H ATOM 134 HH11 ARG A 8 -0.509 -9.496 2.891 1.00 3.69 H ATOM 135 HH12 ARG A 8 -2.228 -9.513 2.716 1.00 3.97 H ATOM 136 HH21 ARG A 8 -2.427 -6.044 1.921 1.00 3.48 H ATOM 137 HH22 ARG A 8 -3.340 -7.484 2.161 1.00 3.80 H ATOM 138 N PRO A 9 2.687 -3.291 -0.855 1.00 0.43 N ATOM 139 CA PRO A 9 2.197 -2.673 -2.066 1.00 0.59 C ATOM 140 C PRO A 9 1.087 -3.546 -2.640 1.00 0.78 C ATOM 141 O PRO A 9 1.194 -4.771 -2.639 1.00 1.68 O ATOM 142 CB PRO A 9 3.384 -2.559 -3.024 1.00 0.75 C ATOM 143 CG PRO A 9 4.528 -3.350 -2.385 1.00 0.72 C ATOM 144 CD PRO A 9 4.038 -3.796 -1.007 1.00 0.55 C ATOM 145 HA PRO A 9 1.810 -1.683 -1.833 1.00 0.59 H ATOM 146 HB2 PRO A 9 3.139 -2.966 -4.006 1.00 1.16 H ATOM 147 HB3 PRO A 9 3.673 -1.515 -3.135 1.00 0.74 H ATOM 148 HG2 PRO A 9 4.762 -4.225 -2.994 1.00 1.12 H ATOM 149 HG3 PRO A 9 5.412 -2.718 -2.283 1.00 0.74 H ATOM 150 HD2 PRO A 9 4.038 -4.883 -0.969 1.00 0.53 H ATOM 151 HD3 PRO A 9 4.691 -3.394 -0.232 1.00 0.62 H ATOM 152 N GLY A 10 0.014 -2.913 -3.106 1.00 1.00 N ATOM 153 CA GLY A 10 -1.134 -3.620 -3.656 1.00 1.05 C ATOM 154 C GLY A 10 -2.280 -3.690 -2.649 1.00 1.18 C ATOM 155 O GLY A 10 -3.358 -4.175 -2.975 1.00 1.67 O ATOM 156 H GLY A 10 -0.042 -1.910 -3.022 1.00 1.74 H ATOM 157 HA2 GLY A 10 -1.477 -3.100 -4.548 1.00 0.93 H ATOM 158 HA3 GLY A 10 -0.853 -4.632 -3.944 1.00 1.32 H HETATM 159 N NH2 A 11 -2.079 -3.217 -1.418 1.00 1.75 N HETATM 160 HN1 NH2 A 11 -1.179 -2.854 -1.130 1.00 2.27 H HETATM 161 HN2 NH2 A 11 -2.850 -3.247 -0.771 1.00 2.04 H TER 162 NH2 A 11