HETATM 1 N PCA A 1 -6.701 5.075 -3.290 1.00 1.28 N HETATM 2 CA PCA A 1 -5.258 4.947 -3.200 1.00 0.65 C HETATM 3 CB PCA A 1 -4.886 5.445 -1.792 1.00 1.52 C HETATM 4 CG PCA A 1 -6.221 5.472 -1.038 1.00 2.02 C HETATM 5 CD PCA A 1 -7.264 5.401 -2.134 1.00 1.79 C HETATM 6 OE PCA A 1 -8.461 5.605 -1.954 1.00 2.71 O HETATM 7 C PCA A 1 -4.818 3.504 -3.443 1.00 0.59 C HETATM 8 O PCA A 1 -5.633 2.586 -3.453 1.00 0.71 O HETATM 9 H1 PCA A 1 -7.219 4.883 -4.134 1.00 2.02 H HETATM 10 HA PCA A 1 -4.793 5.589 -3.950 1.00 1.33 H HETATM 11 HB2 PCA A 1 -4.491 6.459 -1.865 1.00 1.84 H HETATM 12 HB3 PCA A 1 -4.164 4.793 -1.299 1.00 2.20 H HETATM 13 HG2 PCA A 1 -6.322 6.388 -0.454 1.00 2.36 H HETATM 14 HG3 PCA A 1 -6.310 4.593 -0.398 1.00 2.79 H ATOM 15 N HIS A 2 -3.515 3.311 -3.651 1.00 0.46 N ATOM 16 CA HIS A 2 -2.914 2.033 -3.990 1.00 0.48 C ATOM 17 C HIS A 2 -1.413 2.288 -3.972 1.00 0.36 C ATOM 18 O HIS A 2 -0.825 2.695 -4.968 1.00 0.37 O ATOM 19 CB HIS A 2 -3.401 1.551 -5.369 1.00 0.57 C ATOM 20 CG HIS A 2 -2.636 0.394 -5.970 1.00 0.66 C ATOM 21 ND1 HIS A 2 -2.597 0.082 -7.311 1.00 0.73 N ATOM 22 CD2 HIS A 2 -1.844 -0.513 -5.315 1.00 0.73 C ATOM 23 CE1 HIS A 2 -1.793 -0.986 -7.456 1.00 0.84 C ATOM 24 NE2 HIS A 2 -1.317 -1.387 -6.268 1.00 0.84 N ATOM 25 H HIS A 2 -2.867 4.081 -3.534 1.00 0.38 H ATOM 26 HA HIS A 2 -3.173 1.293 -3.232 1.00 0.54 H ATOM 27 HB2 HIS A 2 -4.445 1.248 -5.286 1.00 0.68 H ATOM 28 HB3 HIS A 2 -3.350 2.386 -6.069 1.00 0.52 H ATOM 29 HD1 HIS A 2 -3.071 0.576 -8.053 1.00 0.74 H ATOM 30 HD2 HIS A 2 -1.639 -0.545 -4.257 1.00 0.74 H ATOM 31 HE1 HIS A 2 -1.556 -1.455 -8.402 1.00 0.93 H ATOM 32 N TRP A 3 -0.803 2.117 -2.805 1.00 0.29 N ATOM 33 CA TRP A 3 0.610 2.353 -2.612 1.00 0.26 C ATOM 34 C TRP A 3 1.069 1.482 -1.457 1.00 0.27 C ATOM 35 O TRP A 3 0.257 0.799 -0.826 1.00 0.29 O ATOM 36 CB TRP A 3 0.850 3.860 -2.406 1.00 0.20 C ATOM 37 CG TRP A 3 1.526 4.322 -1.151 1.00 0.22 C ATOM 38 CD1 TRP A 3 0.906 4.639 0.005 1.00 0.23 C ATOM 39 CD2 TRP A 3 2.950 4.496 -0.899 1.00 0.35 C ATOM 40 NE1 TRP A 3 1.843 5.044 0.935 1.00 0.34 N ATOM 41 CE2 TRP A 3 3.125 4.966 0.433 1.00 0.40 C ATOM 42 CE3 TRP A 3 4.111 4.248 -1.654 1.00 0.49 C ATOM 43 CZ2 TRP A 3 4.394 5.194 0.986 1.00 0.53 C ATOM 44 CZ3 TRP A 3 5.392 4.466 -1.111 1.00 0.62 C ATOM 45 CH2 TRP A 3 5.534 4.937 0.206 1.00 0.63 C ATOM 46 H TRP A 3 -1.295 1.813 -1.979 1.00 0.30 H ATOM 47 HA TRP A 3 1.156 2.025 -3.495 1.00 0.35 H ATOM 48 HB2 TRP A 3 1.433 4.210 -3.254 1.00 0.28 H ATOM 49 HB3 TRP A 3 -0.101 4.382 -2.463 1.00 0.17 H ATOM 50 HD1 TRP A 3 -0.160 4.584 0.159 1.00 0.26 H ATOM 51 HE1 TRP A 3 1.619 5.322 1.878 1.00 0.40 H ATOM 52 HE3 TRP A 3 3.996 3.861 -2.653 1.00 0.51 H ATOM 53 HZ2 TRP A 3 4.495 5.519 2.011 1.00 0.59 H ATOM 54 HZ3 TRP A 3 6.271 4.259 -1.703 1.00 0.73 H ATOM 55 HH2 TRP A 3 6.519 5.083 0.628 1.00 0.74 H ATOM 56 N SER A 4 2.375 1.493 -1.216 1.00 0.32 N ATOM 57 CA SER A 4 3.019 0.835 -0.100 1.00 0.34 C ATOM 58 C SER A 4 2.662 1.565 1.183 1.00 0.24 C ATOM 59 O SER A 4 3.429 2.375 1.691 1.00 0.27 O ATOM 60 CB SER A 4 4.540 0.827 -0.303 1.00 0.51 C ATOM 61 OG SER A 4 4.865 0.511 -1.642 1.00 2.07 O ATOM 62 H SER A 4 2.938 2.098 -1.786 1.00 0.35 H ATOM 63 HA SER A 4 2.628 -0.177 -0.040 1.00 0.41 H ATOM 64 HB2 SER A 4 4.948 1.813 -0.083 1.00 1.93 H ATOM 65 HB3 SER A 4 4.990 0.097 0.371 1.00 1.32 H ATOM 66 HG SER A 4 5.818 0.567 -1.741 1.00 2.95 H ATOM 67 N TYR A 5 1.452 1.307 1.663 1.00 0.22 N ATOM 68 CA TYR A 5 0.887 1.945 2.829 1.00 0.22 C ATOM 69 C TYR A 5 1.601 1.417 4.083 1.00 0.19 C ATOM 70 O TYR A 5 2.780 1.084 4.065 1.00 0.18 O ATOM 71 CB TYR A 5 -0.625 1.676 2.799 1.00 0.37 C ATOM 72 CG TYR A 5 -1.455 2.628 3.642 1.00 0.48 C ATOM 73 CD1 TYR A 5 -1.368 4.015 3.418 1.00 1.46 C ATOM 74 CD2 TYR A 5 -2.316 2.135 4.642 1.00 1.80 C ATOM 75 CE1 TYR A 5 -2.124 4.913 4.191 1.00 1.49 C ATOM 76 CE2 TYR A 5 -3.074 3.027 5.422 1.00 1.90 C ATOM 77 CZ TYR A 5 -2.982 4.419 5.200 1.00 0.80 C ATOM 78 OH TYR A 5 -3.732 5.271 5.954 1.00 0.99 O ATOM 79 H TYR A 5 0.881 0.665 1.136 1.00 0.28 H ATOM 80 HA TYR A 5 1.049 3.015 2.741 1.00 0.25 H ATOM 81 HB2 TYR A 5 -0.962 1.780 1.765 1.00 0.40 H ATOM 82 HB3 TYR A 5 -0.808 0.640 3.088 1.00 0.42 H ATOM 83 HD1 TYR A 5 -0.725 4.402 2.643 1.00 2.61 H ATOM 84 HD2 TYR A 5 -2.412 1.071 4.814 1.00 2.94 H ATOM 85 HE1 TYR A 5 -2.044 5.974 4.006 1.00 2.60 H ATOM 86 HE2 TYR A 5 -3.737 2.656 6.189 1.00 3.06 H ATOM 87 HH TYR A 5 -3.636 6.194 5.714 1.00 1.30 H ATOM 88 N GLY A 6 0.877 1.229 5.180 1.00 0.26 N ATOM 89 CA GLY A 6 1.433 0.565 6.357 1.00 0.23 C ATOM 90 C GLY A 6 1.619 -0.946 6.159 1.00 0.27 C ATOM 91 O GLY A 6 1.852 -1.659 7.130 1.00 0.59 O ATOM 92 H GLY A 6 -0.088 1.507 5.160 1.00 0.38 H ATOM 93 HA2 GLY A 6 2.402 1.005 6.595 1.00 0.24 H ATOM 94 HA3 GLY A 6 0.766 0.725 7.204 1.00 0.37 H ATOM 95 N LEU A 7 1.494 -1.453 4.928 1.00 0.21 N ATOM 96 CA LEU A 7 1.702 -2.839 4.564 1.00 0.28 C ATOM 97 C LEU A 7 2.117 -2.870 3.090 1.00 0.24 C ATOM 98 O LEU A 7 2.507 -1.850 2.523 1.00 0.33 O ATOM 99 CB LEU A 7 0.435 -3.665 4.864 1.00 0.50 C ATOM 100 CG LEU A 7 -0.773 -3.323 3.971 1.00 0.61 C ATOM 101 CD1 LEU A 7 -1.513 -4.607 3.581 1.00 0.83 C ATOM 102 CD2 LEU A 7 -1.761 -2.401 4.687 1.00 0.73 C ATOM 103 H LEU A 7 1.441 -0.844 4.127 1.00 0.36 H ATOM 104 HA LEU A 7 2.528 -3.242 5.148 1.00 0.39 H ATOM 105 HB2 LEU A 7 0.687 -4.719 4.753 1.00 0.60 H ATOM 106 HB3 LEU A 7 0.160 -3.530 5.912 1.00 0.59 H ATOM 107 HG LEU A 7 -0.439 -2.826 3.062 1.00 0.54 H ATOM 108 HD11 LEU A 7 -1.982 -5.053 4.458 1.00 1.52 H ATOM 109 HD12 LEU A 7 -2.279 -4.378 2.840 1.00 1.34 H ATOM 110 HD13 LEU A 7 -0.818 -5.328 3.157 1.00 1.76 H ATOM 111 HD21 LEU A 7 -2.576 -2.143 4.010 1.00 1.63 H ATOM 112 HD22 LEU A 7 -2.173 -2.902 5.565 1.00 2.02 H ATOM 113 HD23 LEU A 7 -1.257 -1.488 5.002 1.00 1.33 H ATOM 114 N ARG A 8 2.029 -4.045 2.466 1.00 0.33 N ATOM 115 CA ARG A 8 2.422 -4.260 1.079 1.00 0.38 C ATOM 116 C ARG A 8 1.758 -3.257 0.130 1.00 0.30 C ATOM 117 O ARG A 8 0.634 -2.818 0.381 1.00 0.26 O ATOM 118 CB ARG A 8 2.077 -5.702 0.669 1.00 0.53 C ATOM 119 CG ARG A 8 0.571 -5.995 0.813 1.00 0.80 C ATOM 120 CD ARG A 8 -0.042 -6.641 -0.437 1.00 1.27 C ATOM 121 NE ARG A 8 -1.435 -6.205 -0.644 1.00 1.10 N ATOM 122 CZ ARG A 8 -2.352 -6.844 -1.383 1.00 1.68 C ATOM 123 NH1 ARG A 8 -2.067 -8.022 -1.938 1.00 2.52 N ATOM 124 NH2 ARG A 8 -3.554 -6.300 -1.576 1.00 1.86 N ATOM 125 H ARG A 8 1.677 -4.823 2.993 1.00 0.44 H ATOM 126 HA ARG A 8 3.499 -4.110 1.028 1.00 0.46 H ATOM 127 HB2 ARG A 8 2.390 -5.858 -0.364 1.00 0.80 H ATOM 128 HB3 ARG A 8 2.639 -6.400 1.292 1.00 0.71 H ATOM 129 HG2 ARG A 8 0.420 -6.656 1.669 1.00 0.96 H ATOM 130 HG3 ARG A 8 0.033 -5.074 1.026 1.00 1.09 H ATOM 131 HD2 ARG A 8 0.528 -6.354 -1.320 1.00 1.91 H ATOM 132 HD3 ARG A 8 0.007 -7.724 -0.319 1.00 1.68 H ATOM 133 HE ARG A 8 -1.676 -5.305 -0.247 1.00 1.18 H ATOM 134 HH11 ARG A 8 -1.155 -8.430 -1.810 1.00 2.63 H ATOM 135 HH12 ARG A 8 -2.735 -8.525 -2.502 1.00 3.19 H ATOM 136 HH21 ARG A 8 -3.780 -5.378 -1.211 1.00 1.67 H ATOM 137 HH22 ARG A 8 -4.264 -6.748 -2.135 1.00 2.46 H ATOM 138 N PRO A 9 2.395 -2.947 -1.007 1.00 0.36 N ATOM 139 CA PRO A 9 1.760 -2.147 -2.028 1.00 0.43 C ATOM 140 C PRO A 9 0.598 -2.926 -2.628 1.00 0.57 C ATOM 141 O PRO A 9 0.776 -3.799 -3.471 1.00 1.13 O ATOM 142 CB PRO A 9 2.837 -1.815 -3.059 1.00 0.54 C ATOM 143 CG PRO A 9 3.887 -2.909 -2.864 1.00 0.57 C ATOM 144 CD PRO A 9 3.731 -3.350 -1.406 1.00 0.48 C ATOM 145 HA PRO A 9 1.387 -1.233 -1.578 1.00 0.41 H ATOM 146 HB2 PRO A 9 2.447 -1.804 -4.077 1.00 0.72 H ATOM 147 HB3 PRO A 9 3.263 -0.844 -2.824 1.00 0.52 H ATOM 148 HG2 PRO A 9 3.661 -3.747 -3.524 1.00 0.72 H ATOM 149 HG3 PRO A 9 4.892 -2.532 -3.059 1.00 0.65 H ATOM 150 HD2 PRO A 9 3.857 -4.429 -1.333 1.00 0.48 H ATOM 151 HD3 PRO A 9 4.464 -2.838 -0.783 1.00 0.58 H ATOM 152 N GLY A 10 -0.604 -2.607 -2.162 1.00 0.70 N ATOM 153 CA GLY A 10 -1.831 -3.172 -2.679 1.00 0.81 C ATOM 154 C GLY A 10 -2.989 -2.655 -1.844 1.00 0.97 C ATOM 155 O GLY A 10 -3.803 -3.441 -1.366 1.00 1.22 O ATOM 156 H GLY A 10 -0.639 -2.004 -1.350 1.00 1.09 H ATOM 157 HA2 GLY A 10 -1.964 -2.880 -3.721 1.00 0.72 H ATOM 158 HA3 GLY A 10 -1.788 -4.258 -2.623 1.00 0.97 H HETATM 159 N NH2 A 11 -3.032 -1.341 -1.626 1.00 1.00 N HETATM 160 HN1 NH2 A 11 -2.291 -0.745 -1.967 1.00 0.93 H HETATM 161 HN2 NH2 A 11 -3.795 -0.960 -1.086 1.00 1.20 H TER 162 NH2 A 11