HETATM 1 N PCA A 1 -5.495 1.544 7.966 1.00 1.07 N HETATM 2 CA PCA A 1 -4.137 1.219 8.363 1.00 0.36 C HETATM 3 CB PCA A 1 -4.093 1.435 9.890 1.00 1.34 C HETATM 4 CG PCA A 1 -5.566 1.523 10.305 1.00 1.90 C HETATM 5 CD PCA A 1 -6.296 1.761 8.999 1.00 1.65 C HETATM 6 OE PCA A 1 -7.470 2.114 8.924 1.00 2.39 O HETATM 7 C PCA A 1 -3.801 -0.215 7.959 1.00 0.31 C HETATM 8 O PCA A 1 -4.301 -1.165 8.552 1.00 0.55 O HETATM 9 H PCA A 1 -5.789 1.664 7.010 1.00 1.62 H HETATM 10 HA PCA A 1 -3.439 1.904 7.881 1.00 0.73 H HETATM 11 HB2 PCA A 1 -3.602 2.386 10.102 1.00 1.53 H HETATM 12 HB3 PCA A 1 -3.580 0.625 10.410 1.00 1.82 H HETATM 13 HG2 PCA A 1 -5.728 2.347 11.001 1.00 2.21 H HETATM 14 HG3 PCA A 1 -5.897 0.579 10.739 1.00 2.53 H ATOM 15 N HIS A 2 -2.966 -0.364 6.932 1.00 0.21 N ATOM 16 CA HIS A 2 -2.478 -1.646 6.463 1.00 0.21 C ATOM 17 C HIS A 2 -1.021 -1.441 6.057 1.00 0.17 C ATOM 18 O HIS A 2 -0.131 -1.594 6.887 1.00 0.23 O ATOM 19 CB HIS A 2 -3.392 -2.212 5.356 1.00 0.31 C ATOM 20 CG HIS A 2 -3.902 -1.212 4.341 1.00 0.33 C ATOM 21 ND1 HIS A 2 -4.864 -0.254 4.573 1.00 0.36 N ATOM 22 CD2 HIS A 2 -3.537 -1.116 3.024 1.00 0.35 C ATOM 23 CE1 HIS A 2 -5.046 0.426 3.427 1.00 0.40 C ATOM 24 NE2 HIS A 2 -4.259 -0.064 2.457 1.00 0.39 N ATOM 25 H HIS A 2 -2.590 0.437 6.449 1.00 0.36 H ATOM 26 HA HIS A 2 -2.476 -2.361 7.285 1.00 0.25 H ATOM 27 HB2 HIS A 2 -2.880 -3.026 4.845 1.00 0.35 H ATOM 28 HB3 HIS A 2 -4.267 -2.645 5.844 1.00 0.36 H ATOM 29 HD1 HIS A 2 -5.371 -0.126 5.436 1.00 0.37 H ATOM 30 HD2 HIS A 2 -2.809 -1.728 2.514 1.00 0.36 H ATOM 31 HE1 HIS A 2 -5.739 1.245 3.294 1.00 0.45 H ATOM 32 N TRP A 3 -0.777 -1.060 4.806 1.00 0.16 N ATOM 33 CA TRP A 3 0.532 -0.807 4.221 1.00 0.19 C ATOM 34 C TRP A 3 0.277 -0.306 2.793 1.00 0.15 C ATOM 35 O TRP A 3 -0.817 0.176 2.509 1.00 0.19 O ATOM 36 CB TRP A 3 1.400 -2.076 4.245 1.00 0.31 C ATOM 37 CG TRP A 3 1.056 -3.114 3.230 1.00 0.36 C ATOM 38 CD1 TRP A 3 -0.181 -3.586 2.974 1.00 0.37 C ATOM 39 CD2 TRP A 3 1.943 -3.766 2.280 1.00 0.46 C ATOM 40 NE1 TRP A 3 -0.117 -4.506 1.944 1.00 0.47 N ATOM 41 CE2 TRP A 3 1.178 -4.667 1.488 1.00 0.52 C ATOM 42 CE3 TRP A 3 3.323 -3.670 2.016 1.00 0.53 C ATOM 43 CZ2 TRP A 3 1.768 -5.474 0.503 1.00 0.63 C ATOM 44 CZ3 TRP A 3 3.926 -4.471 1.028 1.00 0.63 C ATOM 45 CH2 TRP A 3 3.153 -5.379 0.281 1.00 0.68 C ATOM 46 H TRP A 3 -1.552 -0.812 4.209 1.00 0.16 H ATOM 47 HA TRP A 3 1.046 -0.036 4.791 1.00 0.23 H ATOM 48 HB2 TRP A 3 2.435 -1.773 4.084 1.00 0.36 H ATOM 49 HB3 TRP A 3 1.378 -2.539 5.230 1.00 0.33 H ATOM 50 HD1 TRP A 3 -1.062 -3.261 3.508 1.00 0.33 H ATOM 51 HE1 TRP A 3 -0.931 -4.980 1.574 1.00 0.51 H ATOM 52 HE3 TRP A 3 3.912 -2.985 2.607 1.00 0.52 H ATOM 53 HZ2 TRP A 3 1.169 -6.173 -0.061 1.00 0.69 H ATOM 54 HZ3 TRP A 3 4.992 -4.403 0.859 1.00 0.69 H ATOM 55 HH2 TRP A 3 3.633 -6.014 -0.448 1.00 0.78 H ATOM 56 N SER A 4 1.249 -0.477 1.897 1.00 0.22 N ATOM 57 CA SER A 4 1.264 -0.110 0.484 1.00 0.15 C ATOM 58 C SER A 4 1.982 1.219 0.342 1.00 0.16 C ATOM 59 O SER A 4 1.450 2.266 0.691 1.00 0.22 O ATOM 60 CB SER A 4 -0.120 0.012 -0.166 1.00 0.21 C ATOM 61 OG SER A 4 -0.904 -1.150 -0.006 1.00 0.31 O ATOM 62 H SER A 4 2.044 -1.002 2.222 1.00 0.33 H ATOM 63 HA SER A 4 1.835 -0.862 -0.062 1.00 0.12 H ATOM 64 HB2 SER A 4 -0.655 0.868 0.247 1.00 0.30 H ATOM 65 HB3 SER A 4 0.033 0.188 -1.228 1.00 0.17 H ATOM 66 HG SER A 4 -1.305 -1.055 0.870 1.00 0.52 H ATOM 67 N TYR A 5 3.173 1.199 -0.249 1.00 0.14 N ATOM 68 CA TYR A 5 3.975 2.402 -0.444 1.00 0.18 C ATOM 69 C TYR A 5 3.527 3.209 -1.674 1.00 0.17 C ATOM 70 O TYR A 5 4.305 3.961 -2.252 1.00 0.20 O ATOM 71 CB TYR A 5 5.441 1.975 -0.527 1.00 0.21 C ATOM 72 CG TYR A 5 6.344 2.598 0.512 1.00 0.28 C ATOM 73 CD1 TYR A 5 6.678 3.959 0.403 1.00 2.01 C ATOM 74 CD2 TYR A 5 6.878 1.818 1.554 1.00 1.81 C ATOM 75 CE1 TYR A 5 7.555 4.543 1.332 1.00 2.06 C ATOM 76 CE2 TYR A 5 7.758 2.395 2.486 1.00 1.80 C ATOM 77 CZ TYR A 5 8.103 3.764 2.375 1.00 0.45 C ATOM 78 OH TYR A 5 8.966 4.338 3.259 1.00 0.56 O ATOM 79 H TYR A 5 3.569 0.316 -0.528 1.00 0.13 H ATOM 80 HA TYR A 5 3.862 3.045 0.417 1.00 0.22 H ATOM 81 HB2 TYR A 5 5.508 0.891 -0.462 1.00 0.19 H ATOM 82 HB3 TYR A 5 5.827 2.255 -1.494 1.00 0.21 H ATOM 83 HD1 TYR A 5 6.271 4.552 -0.405 1.00 3.43 H ATOM 84 HD2 TYR A 5 6.628 0.771 1.635 1.00 3.26 H ATOM 85 HE1 TYR A 5 7.818 5.585 1.244 1.00 3.51 H ATOM 86 HE2 TYR A 5 8.168 1.783 3.274 1.00 3.23 H ATOM 87 HH TYR A 5 9.315 3.728 3.911 1.00 1.29 H HETATM 88 N DLE A 6 2.282 3.020 -2.116 1.00 0.13 N HETATM 89 CA DLE A 6 1.770 3.569 -3.370 1.00 0.13 C HETATM 90 CB DLE A 6 0.238 3.643 -3.369 1.00 0.13 C HETATM 91 CG DLE A 6 -0.454 2.267 -3.452 1.00 0.37 C HETATM 92 CD1 DLE A 6 -1.193 2.084 -4.779 1.00 0.64 C HETATM 93 CD2 DLE A 6 -1.465 2.151 -2.309 1.00 0.61 C HETATM 94 C DLE A 6 2.262 2.788 -4.583 1.00 0.14 C HETATM 95 O DLE A 6 1.975 3.151 -5.718 1.00 0.27 O HETATM 96 H DLE A 6 1.696 2.445 -1.542 1.00 0.12 H HETATM 97 HA DLE A 6 2.158 4.575 -3.466 1.00 0.18 H HETATM 98 HB2 DLE A 6 -0.072 4.246 -4.223 1.00 0.37 H HETATM 99 HB3 DLE A 6 -0.080 4.174 -2.473 1.00 0.33 H HETATM 100 HG DLE A 6 0.282 1.463 -3.368 1.00 0.42 H HETATM 101 HD11 DLE A 6 -1.863 2.926 -4.955 1.00 1.48 H HETATM 102 HD12 DLE A 6 -1.785 1.171 -4.753 1.00 1.84 H HETATM 103 HD13 DLE A 6 -0.475 2.021 -5.598 1.00 1.29 H HETATM 104 HD21 DLE A 6 -0.980 2.375 -1.359 1.00 1.90 H HETATM 105 HD22 DLE A 6 -1.878 1.143 -2.274 1.00 1.29 H HETATM 106 HD23 DLE A 6 -2.277 2.863 -2.458 1.00 1.57 H ATOM 107 N LEU A 7 2.982 1.693 -4.347 1.00 0.10 N ATOM 108 CA LEU A 7 3.570 0.898 -5.408 1.00 0.13 C ATOM 109 C LEU A 7 2.538 -0.096 -5.934 1.00 0.15 C ATOM 110 O LEU A 7 2.683 -0.618 -7.035 1.00 0.25 O ATOM 111 CB LEU A 7 4.824 0.158 -4.909 1.00 0.15 C ATOM 112 CG LEU A 7 5.666 0.937 -3.885 1.00 0.18 C ATOM 113 CD1 LEU A 7 6.906 0.129 -3.482 1.00 0.22 C ATOM 114 CD2 LEU A 7 6.106 2.310 -4.410 1.00 0.20 C ATOM 115 H LEU A 7 3.163 1.442 -3.393 1.00 0.11 H ATOM 116 HA LEU A 7 3.858 1.566 -6.221 1.00 0.17 H ATOM 117 HB2 LEU A 7 4.515 -0.779 -4.444 1.00 0.16 H ATOM 118 HB3 LEU A 7 5.443 -0.085 -5.775 1.00 0.19 H ATOM 119 HG LEU A 7 5.055 1.072 -2.989 1.00 0.17 H ATOM 120 HD11 LEU A 7 6.879 -0.866 -3.923 1.00 1.15 H ATOM 121 HD12 LEU A 7 7.814 0.633 -3.813 1.00 1.12 H ATOM 122 HD13 LEU A 7 6.944 0.032 -2.397 1.00 1.06 H ATOM 123 HD21 LEU A 7 6.700 2.822 -3.652 1.00 1.32 H ATOM 124 HD22 LEU A 7 6.699 2.196 -5.316 1.00 1.44 H ATOM 125 HD23 LEU A 7 5.242 2.936 -4.630 1.00 1.39 H ATOM 126 N ARG A 8 1.530 -0.426 -5.115 1.00 0.12 N ATOM 127 CA ARG A 8 0.540 -1.438 -5.415 1.00 0.20 C ATOM 128 C ARG A 8 -0.609 -1.358 -4.418 1.00 0.17 C ATOM 129 O ARG A 8 -0.394 -1.067 -3.241 1.00 0.16 O ATOM 130 CB ARG A 8 1.193 -2.823 -5.348 1.00 0.28 C ATOM 131 CG ARG A 8 1.754 -3.113 -3.946 1.00 0.29 C ATOM 132 CD ARG A 8 3.119 -3.808 -3.981 1.00 0.44 C ATOM 133 NE ARG A 8 3.015 -5.264 -3.788 1.00 0.79 N ATOM 134 CZ ARG A 8 2.687 -6.181 -4.707 1.00 1.35 C ATOM 135 NH1 ARG A 8 2.427 -5.820 -5.963 1.00 3.04 N ATOM 136 NH2 ARG A 8 2.619 -7.468 -4.363 1.00 1.32 N ATOM 137 H ARG A 8 1.402 0.040 -4.233 1.00 0.08 H ATOM 138 HA ARG A 8 0.178 -1.231 -6.417 1.00 0.26 H ATOM 139 HB2 ARG A 8 0.457 -3.585 -5.603 1.00 0.31 H ATOM 140 HB3 ARG A 8 1.989 -2.855 -6.087 1.00 0.36 H ATOM 141 HG2 ARG A 8 1.893 -2.181 -3.399 1.00 0.22 H ATOM 142 HG3 ARG A 8 1.029 -3.705 -3.389 1.00 0.35 H ATOM 143 HD2 ARG A 8 3.649 -3.567 -4.904 1.00 0.58 H ATOM 144 HD3 ARG A 8 3.713 -3.399 -3.163 1.00 0.49 H ATOM 145 HE ARG A 8 3.218 -5.569 -2.847 1.00 2.02 H ATOM 146 HH11 ARG A 8 2.511 -4.853 -6.234 1.00 3.28 H ATOM 147 HH12 ARG A 8 2.167 -6.487 -6.674 1.00 4.21 H ATOM 148 HH21 ARG A 8 2.820 -7.769 -3.421 1.00 1.45 H ATOM 149 HH22 ARG A 8 2.372 -8.183 -5.031 1.00 2.19 H ATOM 150 N PRO A 9 -1.829 -1.656 -4.852 1.00 0.21 N ATOM 151 CA PRO A 9 -3.013 -1.617 -4.015 1.00 0.25 C ATOM 152 C PRO A 9 -3.042 -2.851 -3.108 1.00 0.29 C ATOM 153 O PRO A 9 -3.814 -3.775 -3.347 1.00 0.33 O ATOM 154 CB PRO A 9 -4.162 -1.605 -5.025 1.00 0.31 C ATOM 155 CG PRO A 9 -3.610 -2.481 -6.147 1.00 0.31 C ATOM 156 CD PRO A 9 -2.154 -2.036 -6.210 1.00 0.28 C ATOM 157 HA PRO A 9 -3.043 -0.710 -3.412 1.00 0.29 H ATOM 158 HB2 PRO A 9 -5.091 -1.996 -4.613 1.00 0.35 H ATOM 159 HB3 PRO A 9 -4.297 -0.590 -5.397 1.00 0.36 H ATOM 160 HG2 PRO A 9 -3.644 -3.524 -5.836 1.00 0.31 H ATOM 161 HG3 PRO A 9 -4.129 -2.324 -7.091 1.00 0.38 H ATOM 162 HD2 PRO A 9 -1.520 -2.852 -6.555 1.00 0.31 H ATOM 163 HD3 PRO A 9 -2.046 -1.166 -6.858 1.00 0.32 H TER 164 PRO A 9 HETATM 165 N NEH A 10 -2.185 -2.885 -2.084 1.00 0.37 N HETATM 166 CA NEH A 10 -2.102 -4.004 -1.151 1.00 0.46 C HETATM 167 CB NEH A 10 -1.074 -5.025 -1.639 1.00 1.45 C HETATM 168 H NEH A 10 -1.566 -2.084 -1.949 1.00 0.36 H HETATM 169 HA2 NEH A 10 -1.810 -3.636 -0.169 1.00 1.41 H HETATM 170 HA3 NEH A 10 -3.076 -4.487 -1.060 1.00 1.15 H HETATM 171 HB1 NEH A 10 -1.303 -5.323 -2.664 1.00 1.90 H HETATM 172 HB2 NEH A 10 -0.077 -4.591 -1.595 1.00 2.69 H HETATM 173 HB3 NEH A 10 -1.110 -5.909 -1.001 1.00 2.36 H