HETATM 1 N PCA A 1 -5.075 2.169 7.724 1.00 1.33 N HETATM 2 CA PCA A 1 -3.946 1.500 8.344 1.00 0.22 C HETATM 3 CB PCA A 1 -4.213 1.565 9.860 1.00 1.37 C HETATM 4 CG PCA A 1 -5.700 1.923 9.967 1.00 1.98 C HETATM 5 CD PCA A 1 -6.047 2.442 8.585 1.00 1.81 C HETATM 6 OE PCA A 1 -7.088 3.034 8.317 1.00 2.75 O HETATM 7 C PCA A 1 -3.861 0.064 7.838 1.00 0.29 C HETATM 8 O PCA A 1 -4.732 -0.749 8.128 1.00 0.89 O HETATM 9 H PCA A 1 -5.092 2.461 6.759 1.00 2.20 H HETATM 10 HA PCA A 1 -3.022 2.027 8.104 1.00 1.09 H HETATM 11 HB2 PCA A 1 -3.616 2.367 10.296 1.00 1.66 H HETATM 12 HB3 PCA A 1 -3.994 0.621 10.361 1.00 2.08 H HETATM 13 HG2 PCA A 1 -5.862 2.690 10.726 1.00 2.24 H HETATM 14 HG3 PCA A 1 -6.292 1.034 10.184 1.00 2.89 H ATOM 15 N HIS A 2 -2.836 -0.234 7.042 1.00 0.25 N ATOM 16 CA HIS A 2 -2.537 -1.574 6.574 1.00 0.20 C ATOM 17 C HIS A 2 -1.081 -1.569 6.115 1.00 0.20 C ATOM 18 O HIS A 2 -0.199 -1.915 6.893 1.00 0.28 O ATOM 19 CB HIS A 2 -3.547 -2.035 5.502 1.00 0.23 C ATOM 20 CG HIS A 2 -3.981 -0.985 4.505 1.00 0.25 C ATOM 21 ND1 HIS A 2 -4.855 0.049 4.763 1.00 0.30 N ATOM 22 CD2 HIS A 2 -3.621 -0.903 3.188 1.00 0.26 C ATOM 23 CE1 HIS A 2 -4.982 0.760 3.628 1.00 0.34 C ATOM 24 NE2 HIS A 2 -4.251 0.216 2.642 1.00 0.31 N ATOM 25 H HIS A 2 -2.164 0.473 6.789 1.00 0.72 H ATOM 26 HA HIS A 2 -2.606 -2.268 7.412 1.00 0.20 H ATOM 27 HB2 HIS A 2 -3.148 -2.901 4.978 1.00 0.25 H ATOM 28 HB3 HIS A 2 -4.446 -2.374 6.018 1.00 0.27 H ATOM 29 HD1 HIS A 2 -5.340 0.203 5.636 1.00 0.33 H ATOM 30 HD2 HIS A 2 -2.956 -1.571 2.665 1.00 0.27 H ATOM 31 HE1 HIS A 2 -5.598 1.641 3.511 1.00 0.41 H ATOM 32 N TRP A 3 -0.827 -1.134 4.881 1.00 0.17 N ATOM 33 CA TRP A 3 0.479 -1.046 4.236 1.00 0.20 C ATOM 34 C TRP A 3 0.238 -0.466 2.834 1.00 0.17 C ATOM 35 O TRP A 3 -0.795 0.156 2.604 1.00 0.23 O ATOM 36 CB TRP A 3 1.174 -2.415 4.183 1.00 0.25 C ATOM 37 CG TRP A 3 0.634 -3.377 3.180 1.00 0.28 C ATOM 38 CD1 TRP A 3 -0.668 -3.662 2.987 1.00 0.27 C ATOM 39 CD2 TRP A 3 1.366 -4.150 2.192 1.00 0.42 C ATOM 40 NE1 TRP A 3 -0.794 -4.577 1.961 1.00 0.39 N ATOM 41 CE2 TRP A 3 0.439 -4.930 1.448 1.00 0.47 C ATOM 42 CE3 TRP A 3 2.730 -4.259 1.859 1.00 0.53 C ATOM 43 CZ2 TRP A 3 0.852 -5.813 0.439 1.00 0.62 C ATOM 44 CZ3 TRP A 3 3.158 -5.144 0.851 1.00 0.68 C ATOM 45 CH2 TRP A 3 2.221 -5.927 0.149 1.00 0.71 C ATOM 46 H TRP A 3 -1.579 -0.733 4.341 1.00 0.21 H ATOM 47 HA TRP A 3 1.124 -0.373 4.798 1.00 0.28 H ATOM 48 HB2 TRP A 3 2.225 -2.243 3.958 1.00 0.32 H ATOM 49 HB3 TRP A 3 1.157 -2.895 5.160 1.00 0.26 H ATOM 50 HD1 TRP A 3 -1.464 -3.217 3.562 1.00 0.23 H ATOM 51 HE1 TRP A 3 -1.684 -4.926 1.632 1.00 0.45 H ATOM 52 HE3 TRP A 3 3.436 -3.661 2.418 1.00 0.53 H ATOM 53 HZ2 TRP A 3 0.125 -6.400 -0.103 1.00 0.68 H ATOM 54 HZ3 TRP A 3 4.214 -5.234 0.644 1.00 0.77 H ATOM 55 HH2 TRP A 3 2.537 -6.627 -0.609 1.00 0.85 H ATOM 56 N SER A 4 1.149 -0.722 1.893 1.00 0.16 N ATOM 57 CA SER A 4 1.166 -0.253 0.509 1.00 0.12 C ATOM 58 C SER A 4 1.890 1.082 0.440 1.00 0.15 C ATOM 59 O SER A 4 1.373 2.110 0.858 1.00 0.24 O ATOM 60 CB SER A 4 -0.222 -0.103 -0.130 1.00 0.16 C ATOM 61 OG SER A 4 -1.027 -1.244 0.065 1.00 0.34 O ATOM 62 H SER A 4 1.872 -1.370 2.157 1.00 0.23 H ATOM 63 HA SER A 4 1.729 -0.975 -0.083 1.00 0.11 H ATOM 64 HB2 SER A 4 -0.730 0.773 0.274 1.00 0.23 H ATOM 65 HB3 SER A 4 -0.081 0.052 -1.199 1.00 0.16 H ATOM 66 HG SER A 4 -1.398 -1.133 0.951 1.00 0.53 H ATOM 67 N TYR A 5 3.074 1.092 -0.168 1.00 0.12 N ATOM 68 CA TYR A 5 3.887 2.296 -0.308 1.00 0.16 C ATOM 69 C TYR A 5 3.454 3.155 -1.507 1.00 0.14 C ATOM 70 O TYR A 5 4.248 3.897 -2.077 1.00 0.17 O ATOM 71 CB TYR A 5 5.347 1.856 -0.412 1.00 0.19 C ATOM 72 CG TYR A 5 6.257 2.424 0.646 1.00 0.25 C ATOM 73 CD1 TYR A 5 6.328 1.824 1.914 1.00 1.76 C ATOM 74 CD2 TYR A 5 7.059 3.536 0.339 1.00 1.61 C ATOM 75 CE1 TYR A 5 7.221 2.324 2.877 1.00 1.80 C ATOM 76 CE2 TYR A 5 7.955 4.037 1.295 1.00 1.62 C ATOM 77 CZ TYR A 5 8.048 3.430 2.567 1.00 0.45 C ATOM 78 OH TYR A 5 8.939 3.913 3.477 1.00 0.57 O ATOM 79 H TYR A 5 3.460 0.223 -0.506 1.00 0.13 H ATOM 80 HA TYR A 5 3.780 2.903 0.582 1.00 0.20 H ATOM 81 HB2 TYR A 5 5.405 0.769 -0.381 1.00 0.19 H ATOM 82 HB3 TYR A 5 5.736 2.161 -1.370 1.00 0.20 H ATOM 83 HD1 TYR A 5 5.705 0.974 2.149 1.00 3.02 H ATOM 84 HD2 TYR A 5 6.996 4.001 -0.635 1.00 2.87 H ATOM 85 HE1 TYR A 5 7.267 1.847 3.843 1.00 3.07 H ATOM 86 HE2 TYR A 5 8.575 4.883 1.046 1.00 2.88 H ATOM 87 HH TYR A 5 8.972 3.409 4.293 1.00 1.53 H HETATM 88 N DLE A 6 2.199 3.018 -1.936 1.00 0.15 N HETATM 89 CA DLE A 6 1.684 3.647 -3.153 1.00 0.19 C HETATM 90 CB DLE A 6 0.145 3.688 -3.145 1.00 0.22 C HETATM 91 CG DLE A 6 -0.542 2.420 -3.687 1.00 0.25 C HETATM 92 CD1 DLE A 6 -1.072 2.627 -5.110 1.00 0.45 C HETATM 93 CD2 DLE A 6 -1.736 2.048 -2.807 1.00 0.38 C HETATM 94 C DLE A 6 2.242 2.976 -4.409 1.00 0.18 C HETATM 95 O DLE A 6 2.102 3.498 -5.509 1.00 0.28 O HETATM 96 H DLE A 6 1.608 2.438 -1.372 1.00 0.16 H HETATM 97 HA DLE A 6 2.038 4.673 -3.162 1.00 0.24 H HETATM 98 HB2 DLE A 6 -0.177 4.538 -3.749 1.00 0.39 H HETATM 99 HB3 DLE A 6 -0.188 3.881 -2.124 1.00 0.32 H HETATM 100 HG DLE A 6 0.161 1.588 -3.678 1.00 0.28 H HETATM 101 HD11 DLE A 6 -1.490 1.696 -5.493 1.00 1.54 H HETATM 102 HD12 DLE A 6 -0.273 2.948 -5.776 1.00 1.78 H HETATM 103 HD13 DLE A 6 -1.849 3.391 -5.111 1.00 1.84 H HETATM 104 HD21 DLE A 6 -2.452 2.870 -2.781 1.00 1.41 H HETATM 105 HD22 DLE A 6 -1.402 1.841 -1.792 1.00 1.24 H HETATM 106 HD23 DLE A 6 -2.226 1.164 -3.208 1.00 1.49 H ATOM 107 N LEU A 7 2.861 1.804 -4.250 1.00 0.14 N ATOM 108 CA LEU A 7 3.462 1.064 -5.349 1.00 0.17 C ATOM 109 C LEU A 7 2.435 0.130 -5.984 1.00 0.24 C ATOM 110 O LEU A 7 2.553 -0.226 -7.153 1.00 0.39 O ATOM 111 CB LEU A 7 4.671 0.250 -4.859 1.00 0.19 C ATOM 112 CG LEU A 7 5.538 0.992 -3.833 1.00 0.16 C ATOM 113 CD1 LEU A 7 6.729 0.123 -3.425 1.00 0.22 C ATOM 114 CD2 LEU A 7 6.054 2.332 -4.365 1.00 0.18 C ATOM 115 H LEU A 7 3.004 1.474 -3.310 1.00 0.12 H ATOM 116 HA LEU A 7 3.800 1.774 -6.104 1.00 0.19 H ATOM 117 HB2 LEU A 7 4.315 -0.671 -4.395 1.00 0.22 H ATOM 118 HB3 LEU A 7 5.280 -0.020 -5.723 1.00 0.24 H ATOM 119 HG LEU A 7 4.926 1.159 -2.945 1.00 0.14 H ATOM 120 HD11 LEU A 7 7.300 -0.167 -4.307 1.00 1.21 H ATOM 121 HD12 LEU A 7 7.380 0.682 -2.751 1.00 1.10 H ATOM 122 HD13 LEU A 7 6.377 -0.770 -2.910 1.00 1.30 H ATOM 123 HD21 LEU A 7 6.648 2.829 -3.597 1.00 1.34 H ATOM 124 HD22 LEU A 7 6.670 2.176 -5.250 1.00 1.40 H ATOM 125 HD23 LEU A 7 5.223 2.990 -4.617 1.00 1.40 H ATOM 126 N ARG A 8 1.467 -0.336 -5.191 1.00 0.15 N ATOM 127 CA ARG A 8 0.467 -1.306 -5.587 1.00 0.25 C ATOM 128 C ARG A 8 -0.633 -1.335 -4.531 1.00 0.15 C ATOM 129 O ARG A 8 -0.363 -1.158 -3.339 1.00 0.10 O ATOM 130 CB ARG A 8 1.104 -2.695 -5.718 1.00 0.41 C ATOM 131 CG ARG A 8 1.805 -3.143 -4.424 1.00 0.44 C ATOM 132 CD ARG A 8 3.254 -3.591 -4.673 1.00 0.67 C ATOM 133 NE ARG A 8 3.385 -5.057 -4.678 1.00 0.62 N ATOM 134 CZ ARG A 8 3.771 -5.809 -3.637 1.00 1.16 C ATOM 135 NH1 ARG A 8 4.056 -5.243 -2.463 1.00 2.78 N ATOM 136 NH2 ARG A 8 3.873 -7.132 -3.766 1.00 1.13 N ATOM 137 H ARG A 8 1.360 0.008 -4.252 1.00 0.08 H ATOM 138 HA ARG A 8 0.065 -0.996 -6.550 1.00 0.38 H ATOM 139 HB2 ARG A 8 0.331 -3.421 -5.969 1.00 0.46 H ATOM 140 HB3 ARG A 8 1.807 -2.666 -6.548 1.00 0.57 H ATOM 141 HG2 ARG A 8 1.833 -2.325 -3.708 1.00 0.33 H ATOM 142 HG3 ARG A 8 1.221 -3.942 -3.963 1.00 0.56 H ATOM 143 HD2 ARG A 8 3.612 -3.194 -5.625 1.00 0.86 H ATOM 144 HD3 ARG A 8 3.894 -3.153 -3.908 1.00 0.93 H ATOM 145 HE ARG A 8 3.180 -5.501 -5.562 1.00 1.80 H ATOM 146 HH11 ARG A 8 3.924 -4.253 -2.334 1.00 2.96 H ATOM 147 HH12 ARG A 8 4.387 -5.775 -1.674 1.00 3.92 H ATOM 148 HH21 ARG A 8 3.656 -7.587 -4.641 1.00 0.94 H ATOM 149 HH22 ARG A 8 4.161 -7.722 -3.000 1.00 2.14 H ATOM 150 N PRO A 9 -1.872 -1.605 -4.928 1.00 0.22 N ATOM 151 CA PRO A 9 -2.983 -1.777 -4.015 1.00 0.23 C ATOM 152 C PRO A 9 -2.832 -3.124 -3.310 1.00 0.26 C ATOM 153 O PRO A 9 -3.408 -4.124 -3.729 1.00 0.56 O ATOM 154 CB PRO A 9 -4.212 -1.715 -4.913 1.00 0.37 C ATOM 155 CG PRO A 9 -3.699 -2.361 -6.198 1.00 0.35 C ATOM 156 CD PRO A 9 -2.278 -1.819 -6.299 1.00 0.38 C ATOM 157 HA PRO A 9 -3.022 -0.973 -3.280 1.00 0.34 H ATOM 158 HB2 PRO A 9 -5.059 -2.252 -4.488 1.00 0.42 H ATOM 159 HB3 PRO A 9 -4.456 -0.671 -5.104 1.00 0.52 H ATOM 160 HG2 PRO A 9 -3.650 -3.437 -6.053 1.00 0.29 H ATOM 161 HG3 PRO A 9 -4.305 -2.095 -7.062 1.00 0.49 H ATOM 162 HD2 PRO A 9 -1.631 -2.541 -6.797 1.00 0.44 H ATOM 163 HD3 PRO A 9 -2.265 -0.865 -6.826 1.00 0.50 H TER 164 PRO A 9 HETATM 165 N NEH A 10 -2.030 -3.147 -2.249 1.00 0.23 N HETATM 166 CA NEH A 10 -1.644 -4.366 -1.553 1.00 0.48 C HETATM 167 CB NEH A 10 -2.819 -4.929 -0.744 1.00 1.79 C HETATM 168 H NEH A 10 -1.532 -2.281 -2.049 1.00 0.25 H HETATM 169 HA2 NEH A 10 -1.304 -5.112 -2.274 1.00 1.82 H HETATM 170 HA3 NEH A 10 -0.825 -4.130 -0.879 1.00 1.93 H HETATM 171 HB1 NEH A 10 -3.204 -4.172 -0.062 1.00 3.29 H HETATM 172 HB2 NEH A 10 -3.617 -5.242 -1.419 1.00 2.44 H HETATM 173 HB3 NEH A 10 -2.490 -5.803 -0.182 1.00 2.58 H