HETATM 1 N PCA A 1 -4.599 6.367 -3.104 1.00 2.11 N HETATM 2 CA PCA A 1 -5.682 5.420 -2.886 1.00 0.71 C HETATM 3 CB PCA A 1 -6.811 5.868 -3.839 1.00 2.75 C HETATM 4 CG PCA A 1 -6.130 6.836 -4.812 1.00 3.74 C HETATM 5 CD PCA A 1 -4.834 7.195 -4.115 1.00 3.22 C HETATM 6 OE PCA A 1 -4.111 8.128 -4.452 1.00 4.94 O HETATM 7 C PCA A 1 -5.265 3.967 -3.138 1.00 0.65 C HETATM 8 O PCA A 1 -6.100 3.073 -3.045 1.00 0.74 O HETATM 9 H1 PCA A 1 -3.823 6.484 -2.471 1.00 3.50 H HETATM 10 HA PCA A 1 -6.030 5.500 -1.857 1.00 2.12 H HETATM 11 HB2 PCA A 1 -7.572 6.403 -3.269 1.00 3.29 H HETATM 12 HB3 PCA A 1 -7.265 5.031 -4.372 1.00 4.05 H HETATM 13 HG2 PCA A 1 -6.746 7.719 -4.979 1.00 4.42 H HETATM 14 HG3 PCA A 1 -5.908 6.334 -5.754 1.00 5.18 H ATOM 15 N HIS A 2 -3.993 3.715 -3.460 1.00 0.54 N ATOM 16 CA HIS A 2 -3.504 2.388 -3.799 1.00 0.56 C ATOM 17 C HIS A 2 -1.988 2.506 -3.879 1.00 0.46 C ATOM 18 O HIS A 2 -1.435 2.856 -4.916 1.00 0.46 O ATOM 19 CB HIS A 2 -4.105 1.906 -5.134 1.00 0.65 C ATOM 20 CG HIS A 2 -3.507 0.631 -5.686 1.00 0.74 C ATOM 21 ND1 HIS A 2 -3.574 0.218 -6.998 1.00 0.80 N ATOM 22 CD2 HIS A 2 -2.790 -0.312 -4.997 1.00 0.82 C ATOM 23 CE1 HIS A 2 -2.903 -0.944 -7.092 1.00 0.92 C ATOM 24 NE2 HIS A 2 -2.411 -1.310 -5.896 1.00 0.93 N ATOM 25 H HIS A 2 -3.295 4.446 -3.409 1.00 0.47 H ATOM 26 HA HIS A 2 -3.779 1.689 -3.008 1.00 0.63 H ATOM 27 HB2 HIS A 2 -5.173 1.736 -5.001 1.00 0.74 H ATOM 28 HB3 HIS A 2 -3.981 2.691 -5.880 1.00 0.57 H ATOM 29 HD1 HIS A 2 -4.031 0.707 -7.754 1.00 0.80 H ATOM 30 HD2 HIS A 2 -2.542 -0.282 -3.949 1.00 0.84 H ATOM 31 HE1 HIS A 2 -2.771 -1.506 -8.006 1.00 1.01 H ATOM 32 N TRP A 3 -1.313 2.266 -2.760 1.00 0.40 N ATOM 33 CA TRP A 3 0.128 2.367 -2.678 1.00 0.37 C ATOM 34 C TRP A 3 0.611 1.456 -1.559 1.00 0.36 C ATOM 35 O TRP A 3 -0.200 0.816 -0.886 1.00 0.37 O ATOM 36 CB TRP A 3 0.511 3.851 -2.527 1.00 0.29 C ATOM 37 CG TRP A 3 1.325 4.285 -1.351 1.00 0.28 C ATOM 38 CD1 TRP A 3 0.839 4.728 -0.173 1.00 0.27 C ATOM 39 CD2 TRP A 3 2.774 4.316 -1.219 1.00 0.39 C ATOM 40 NE1 TRP A 3 1.887 5.062 0.662 1.00 0.33 N ATOM 41 CE2 TRP A 3 3.108 4.818 0.068 1.00 0.40 C ATOM 42 CE3 TRP A 3 3.830 3.911 -2.055 1.00 0.52 C ATOM 43 CZ2 TRP A 3 4.437 4.917 0.507 1.00 0.52 C ATOM 44 CZ3 TRP A 3 5.167 3.993 -1.625 1.00 0.64 C ATOM 45 CH2 TRP A 3 5.471 4.493 -0.346 1.00 0.64 C ATOM 46 H TRP A 3 -1.782 2.013 -1.904 1.00 0.42 H ATOM 47 HA TRP A 3 0.569 1.986 -3.595 1.00 0.46 H ATOM 48 HB2 TRP A 3 1.046 4.134 -3.431 1.00 0.34 H ATOM 49 HB3 TRP A 3 -0.393 4.452 -2.521 1.00 0.26 H ATOM 50 HD1 TRP A 3 -0.211 4.812 0.062 1.00 0.29 H ATOM 51 HE1 TRP A 3 1.770 5.395 1.604 1.00 0.37 H ATOM 52 HE3 TRP A 3 3.575 3.510 -3.023 1.00 0.55 H ATOM 53 HZ2 TRP A 3 4.660 5.268 1.504 1.00 0.56 H ATOM 54 HZ3 TRP A 3 5.965 3.661 -2.273 1.00 0.76 H ATOM 55 HH2 TRP A 3 6.497 4.537 -0.010 1.00 0.75 H ATOM 56 N SER A 4 1.927 1.369 -1.386 1.00 0.39 N ATOM 57 CA SER A 4 2.515 0.686 -0.253 1.00 0.44 C ATOM 58 C SER A 4 2.296 1.535 0.985 1.00 0.35 C ATOM 59 O SER A 4 3.164 2.296 1.396 1.00 0.35 O ATOM 60 CB SER A 4 4.007 0.411 -0.487 1.00 0.55 C ATOM 61 OG SER A 4 4.383 -0.785 0.169 1.00 1.47 O ATOM 62 H SER A 4 2.515 1.966 -1.941 1.00 0.38 H ATOM 63 HA SER A 4 1.973 -0.245 -0.119 1.00 0.52 H ATOM 64 HB2 SER A 4 4.195 0.302 -1.552 1.00 1.24 H ATOM 65 HB3 SER A 4 4.619 1.242 -0.133 1.00 0.79 H ATOM 66 HG SER A 4 4.200 -0.706 1.115 1.00 2.07 H ATOM 67 N TYR A 5 1.103 1.414 1.554 1.00 0.33 N ATOM 68 CA TYR A 5 0.716 2.129 2.747 1.00 0.27 C ATOM 69 C TYR A 5 1.499 1.554 3.940 1.00 0.21 C ATOM 70 O TYR A 5 2.641 1.124 3.811 1.00 0.23 O ATOM 71 CB TYR A 5 -0.810 2.033 2.872 1.00 0.37 C ATOM 72 CG TYR A 5 -1.417 3.123 3.736 1.00 0.45 C ATOM 73 CD1 TYR A 5 -1.207 4.471 3.390 1.00 1.70 C ATOM 74 CD2 TYR A 5 -2.161 2.804 4.888 1.00 1.54 C ATOM 75 CE1 TYR A 5 -1.708 5.500 4.204 1.00 1.82 C ATOM 76 CE2 TYR A 5 -2.664 3.830 5.710 1.00 1.54 C ATOM 77 CZ TYR A 5 -2.431 5.184 5.372 1.00 0.76 C ATOM 78 OH TYR A 5 -2.896 6.194 6.161 1.00 0.97 O ATOM 79 H TYR A 5 0.427 0.814 1.107 1.00 0.40 H ATOM 80 HA TYR A 5 0.982 3.172 2.606 1.00 0.27 H ATOM 81 HB2 TYR A 5 -1.237 2.129 1.872 1.00 0.41 H ATOM 82 HB3 TYR A 5 -1.081 1.044 3.240 1.00 0.44 H ATOM 83 HD1 TYR A 5 -0.655 4.726 2.499 1.00 2.82 H ATOM 84 HD2 TYR A 5 -2.353 1.773 5.152 1.00 2.72 H ATOM 85 HE1 TYR A 5 -1.539 6.535 3.944 1.00 3.00 H ATOM 86 HE2 TYR A 5 -3.227 3.574 6.595 1.00 2.66 H ATOM 87 HH TYR A 5 -3.337 5.897 6.959 1.00 1.39 H ATOM 88 N GLY A 6 0.890 1.469 5.115 1.00 0.24 N ATOM 89 CA GLY A 6 1.521 0.820 6.262 1.00 0.23 C ATOM 90 C GLY A 6 1.459 -0.709 6.176 1.00 0.25 C ATOM 91 O GLY A 6 1.159 -1.357 7.173 1.00 0.55 O ATOM 92 H GLY A 6 -0.031 1.863 5.188 1.00 0.34 H ATOM 93 HA2 GLY A 6 2.566 1.127 6.328 1.00 0.25 H ATOM 94 HA3 GLY A 6 1.014 1.139 7.173 1.00 0.36 H ATOM 95 N LEU A 7 1.712 -1.292 4.998 1.00 0.28 N ATOM 96 CA LEU A 7 1.728 -2.715 4.722 1.00 0.30 C ATOM 97 C LEU A 7 2.323 -2.910 3.320 1.00 0.36 C ATOM 98 O LEU A 7 2.944 -2.006 2.756 1.00 0.45 O ATOM 99 CB LEU A 7 0.309 -3.312 4.849 1.00 0.44 C ATOM 100 CG LEU A 7 -0.687 -2.781 3.801 1.00 0.56 C ATOM 101 CD1 LEU A 7 -1.590 -3.915 3.309 1.00 0.75 C ATOM 102 CD2 LEU A 7 -1.577 -1.678 4.380 1.00 0.68 C ATOM 103 H LEU A 7 2.049 -0.747 4.215 1.00 0.47 H ATOM 104 HA LEU A 7 2.390 -3.207 5.436 1.00 0.38 H ATOM 105 HB2 LEU A 7 0.385 -4.396 4.769 1.00 0.50 H ATOM 106 HB3 LEU A 7 -0.082 -3.119 5.849 1.00 0.53 H ATOM 107 HG LEU A 7 -0.149 -2.374 2.946 1.00 0.56 H ATOM 108 HD11 LEU A 7 -2.188 -3.564 2.469 1.00 2.05 H ATOM 109 HD12 LEU A 7 -0.988 -4.757 2.978 1.00 1.82 H ATOM 110 HD13 LEU A 7 -2.249 -4.246 4.112 1.00 1.73 H ATOM 111 HD21 LEU A 7 -0.962 -0.861 4.750 1.00 1.51 H ATOM 112 HD22 LEU A 7 -2.242 -1.301 3.603 1.00 1.71 H ATOM 113 HD23 LEU A 7 -2.174 -2.073 5.202 1.00 1.17 H ATOM 114 N ARG A 8 2.131 -4.098 2.751 1.00 0.41 N ATOM 115 CA ARG A 8 2.618 -4.425 1.417 1.00 0.50 C ATOM 116 C ARG A 8 2.011 -3.512 0.351 1.00 0.43 C ATOM 117 O ARG A 8 0.858 -3.095 0.477 1.00 0.42 O ATOM 118 CB ARG A 8 2.316 -5.894 1.073 1.00 0.68 C ATOM 119 CG ARG A 8 0.843 -6.265 1.319 1.00 0.87 C ATOM 120 CD ARG A 8 0.352 -7.384 0.391 1.00 1.48 C ATOM 121 NE ARG A 8 -0.637 -6.895 -0.587 1.00 1.36 N ATOM 122 CZ ARG A 8 -1.332 -7.686 -1.416 1.00 1.97 C ATOM 123 NH1 ARG A 8 -1.043 -8.985 -1.494 1.00 2.55 N ATOM 124 NH2 ARG A 8 -2.321 -7.190 -2.156 1.00 2.38 N ATOM 125 H ARG A 8 1.594 -4.773 3.263 1.00 0.43 H ATOM 126 HA ARG A 8 3.693 -4.259 1.428 1.00 0.54 H ATOM 127 HB2 ARG A 8 2.559 -6.060 0.023 1.00 0.87 H ATOM 128 HB3 ARG A 8 2.950 -6.547 1.674 1.00 0.91 H ATOM 129 HG2 ARG A 8 0.735 -6.593 2.353 1.00 1.15 H ATOM 130 HG3 ARG A 8 0.207 -5.395 1.176 1.00 1.07 H ATOM 131 HD2 ARG A 8 1.198 -7.833 -0.129 1.00 2.38 H ATOM 132 HD3 ARG A 8 -0.122 -8.152 1.007 1.00 1.89 H ATOM 133 HE ARG A 8 -0.816 -5.896 -0.596 1.00 1.37 H ATOM 134 HH11 ARG A 8 -0.286 -9.363 -0.948 1.00 2.45 H ATOM 135 HH12 ARG A 8 -1.549 -9.609 -2.103 1.00 3.23 H ATOM 136 HH21 ARG A 8 -2.613 -6.224 -2.058 1.00 2.10 H ATOM 137 HH22 ARG A 8 -2.852 -7.754 -2.799 1.00 3.07 H ATOM 138 N PRO A 9 2.732 -3.271 -0.750 1.00 0.47 N ATOM 139 CA PRO A 9 2.157 -2.607 -1.896 1.00 0.53 C ATOM 140 C PRO A 9 1.091 -3.499 -2.520 1.00 0.76 C ATOM 141 O PRO A 9 1.388 -4.582 -3.018 1.00 1.49 O ATOM 142 CB PRO A 9 3.304 -2.324 -2.867 1.00 0.56 C ATOM 143 CG PRO A 9 4.481 -3.169 -2.379 1.00 0.65 C ATOM 144 CD PRO A 9 4.102 -3.681 -0.987 1.00 0.55 C ATOM 145 HA PRO A 9 1.707 -1.670 -1.582 1.00 0.48 H ATOM 146 HB2 PRO A 9 3.039 -2.578 -3.893 1.00 0.84 H ATOM 147 HB3 PRO A 9 3.567 -1.270 -2.818 1.00 0.43 H ATOM 148 HG2 PRO A 9 4.634 -4.012 -3.052 1.00 0.96 H ATOM 149 HG3 PRO A 9 5.380 -2.553 -2.326 1.00 0.72 H ATOM 150 HD2 PRO A 9 4.184 -4.768 -0.963 1.00 0.57 H ATOM 151 HD3 PRO A 9 4.762 -3.241 -0.240 1.00 0.59 H ATOM 152 N GLY A 10 -0.155 -3.033 -2.495 1.00 0.61 N ATOM 153 CA GLY A 10 -1.247 -3.652 -3.226 1.00 0.77 C ATOM 154 C GLY A 10 -2.553 -3.468 -2.470 1.00 0.92 C ATOM 155 O GLY A 10 -3.254 -4.440 -2.208 1.00 1.18 O ATOM 156 H GLY A 10 -0.334 -2.196 -1.960 1.00 0.98 H ATOM 157 HA2 GLY A 10 -1.330 -3.191 -4.212 1.00 0.79 H ATOM 158 HA3 GLY A 10 -1.054 -4.717 -3.356 1.00 0.90 H HETATM 159 N NH2 A 11 -2.869 -2.237 -2.078 1.00 0.93 N HETATM 160 HN1 NH2 A 11 -2.240 -1.475 -2.260 1.00 0.85 H HETATM 161 HN2 NH2 A 11 -3.737 -2.088 -1.587 1.00 1.14 H TER 162 NH2 A 11