USER MOD reduce.3.24.130724 H: found=0, std=0, add=384, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 384 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 139 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 140 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 110 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 111 GLN : amide:sc= -0.688 X(o=-0.69,f=-0.72) USER MOD Single : A 112 THR OG1 : rot 180:sc= 0 USER MOD Single : A 113 GLN : amide:sc= -0.0045 X(o=-0.0045,f=-0.33) USER MOD Single : A 114 SER OG : rot 180:sc= 0 USER MOD Single : A 115 THR OG1 : rot -107:sc= 0.36 USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 THR OG1 : rot 180:sc= 0 USER MOD Single : A 124 SER OG : rot 180:sc= 0 USER MOD Single : A 127 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 128 SER OG : rot 180:sc= 0 USER MOD Single : A 133 THR OG1 : rot 180:sc= 0 USER MOD Single : A 136 SER OG : rot 180:sc= 0 USER MOD Single : A 141 SER OG : rot 180:sc= -0.65 USER MOD Single : A 142 SER OG : rot 180:sc= 0 USER MOD Single : A 146 THR OG1 : rot 169:sc= -0.247 USER MOD Single : A 153 ASN : amide:sc= -0.286 X(o=-0.29,f=-0.2) USER MOD Single : A 155 SER OG : rot 180:sc= 0 USER MOD Single : A 157 LYS NZ :NH3+ -172:sc= -0.339 (180deg=-0.412) USER MOD Single : A 158 THR OG1 : rot -2:sc= -3.14! USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 110 4.874 4.303 0.851 1.00 2.43 N ATOM 2 CA MET A 110 4.733 3.500 -0.357 1.00 63.53 C ATOM 3 C MET A 110 5.891 2.516 -0.494 1.00 43.01 C ATOM 4 O MET A 110 6.920 2.660 0.166 1.00 32.21 O ATOM 5 CB MET A 110 4.667 4.402 -1.591 1.00 31.01 C ATOM 6 CG MET A 110 5.900 5.272 -1.775 1.00 32.15 C ATOM 7 SD MET A 110 6.030 5.949 -3.441 1.00 25.43 S ATOM 8 CE MET A 110 5.127 7.484 -3.254 1.00 71.24 C ATOM 0 HA MET A 110 3.805 2.934 -0.280 1.00 63.53 H new ATOM 0 HB2 MET A 110 4.535 3.782 -2.478 1.00 31.01 H new ATOM 0 HB3 MET A 110 3.788 5.043 -1.516 1.00 31.01 H new ATOM 0 HG2 MET A 110 5.873 6.090 -1.056 1.00 32.15 H new ATOM 0 HG3 MET A 110 6.791 4.684 -1.555 1.00 32.15 H new ATOM 0 HE1 MET A 110 5.119 8.019 -4.203 1.00 71.24 H new ATOM 0 HE2 MET A 110 4.103 7.269 -2.950 1.00 71.24 H new ATOM 0 HE3 MET A 110 5.609 8.100 -2.495 1.00 71.24 H new ATOM 18 N GLN A 111 5.716 1.518 -1.354 1.00 52.13 N ATOM 19 CA GLN A 111 6.747 0.511 -1.576 1.00 33.03 C ATOM 20 C GLN A 111 7.585 0.851 -2.804 1.00 31.24 C ATOM 21 O GLN A 111 7.351 1.861 -3.469 1.00 21.42 O ATOM 22 CB GLN A 111 6.112 -0.871 -1.743 1.00 50.33 C ATOM 23 CG GLN A 111 5.697 -1.513 -0.429 1.00 53.25 C ATOM 24 CD GLN A 111 4.693 -0.675 0.338 1.00 1.00 C ATOM 25 OE1 GLN A 111 3.638 -0.315 -0.185 1.00 62.03 O ATOM 26 NE2 GLN A 111 5.017 -0.360 1.587 1.00 54.33 N ATOM 0 H GLN A 111 4.870 1.385 -1.908 1.00 52.13 H new ATOM 0 HA GLN A 111 7.402 0.499 -0.705 1.00 33.03 H new ATOM 0 HB2 GLN A 111 5.237 -0.784 -2.388 1.00 50.33 H new ATOM 0 HB3 GLN A 111 6.819 -1.527 -2.251 1.00 50.33 H new ATOM 0 HG2 GLN A 111 5.268 -2.495 -0.628 1.00 53.25 H new ATOM 0 HG3 GLN A 111 6.581 -1.671 0.189 1.00 53.25 H new ATOM 0 HE21 GLN A 111 5.902 -0.680 1.980 1.00 54.33 H new ATOM 0 HE22 GLN A 111 4.381 0.202 2.153 1.00 54.33 H new ATOM 35 N THR A 112 8.564 0.001 -3.100 1.00 13.23 N ATOM 36 CA THR A 112 9.438 0.212 -4.246 1.00 40.05 C ATOM 37 C THR A 112 10.023 -1.106 -4.741 1.00 43.32 C ATOM 38 O THR A 112 9.994 -2.112 -4.034 1.00 30.13 O ATOM 39 CB THR A 112 10.590 1.176 -3.905 1.00 53.21 C ATOM 40 OG1 THR A 112 11.101 0.886 -2.599 1.00 52.23 O ATOM 41 CG2 THR A 112 10.120 2.622 -3.962 1.00 31.02 C ATOM 0 H THR A 112 8.771 -0.840 -2.561 1.00 13.23 H new ATOM 0 HA THR A 112 8.826 0.653 -5.033 1.00 40.05 H new ATOM 0 HB THR A 112 11.381 1.038 -4.643 1.00 53.21 H new ATOM 0 HG1 THR A 112 11.834 1.502 -2.390 1.00 52.23 H new ATOM 0 HG21 THR A 112 10.950 3.284 -3.718 1.00 31.02 H new ATOM 0 HG22 THR A 112 9.759 2.848 -4.965 1.00 31.02 H new ATOM 0 HG23 THR A 112 9.314 2.771 -3.244 1.00 31.02 H new ATOM 49 N GLN A 113 10.555 -1.091 -5.959 1.00 73.54 N ATOM 50 CA GLN A 113 11.147 -2.287 -6.548 1.00 1.12 C ATOM 51 C GLN A 113 12.458 -2.642 -5.855 1.00 23.32 C ATOM 52 O GLN A 113 13.234 -1.762 -5.483 1.00 14.44 O ATOM 53 CB GLN A 113 11.387 -2.079 -8.044 1.00 44.01 C ATOM 54 CG GLN A 113 12.329 -0.927 -8.355 1.00 24.02 C ATOM 55 CD GLN A 113 12.178 -0.416 -9.774 1.00 1.21 C ATOM 56 OE1 GLN A 113 11.067 -0.163 -10.240 1.00 33.41 O ATOM 57 NE2 GLN A 113 13.298 -0.260 -10.470 1.00 2.11 N ATOM 0 H GLN A 113 10.588 -0.265 -6.557 1.00 73.54 H new ATOM 0 HA GLN A 113 10.449 -3.113 -6.411 1.00 1.12 H new ATOM 0 HB2 GLN A 113 11.795 -2.996 -8.469 1.00 44.01 H new ATOM 0 HB3 GLN A 113 10.431 -1.898 -8.535 1.00 44.01 H new ATOM 0 HG2 GLN A 113 12.141 -0.111 -7.657 1.00 24.02 H new ATOM 0 HG3 GLN A 113 13.358 -1.251 -8.197 1.00 24.02 H new ATOM 0 HE21 GLN A 113 14.198 -0.482 -10.044 1.00 2.11 H new ATOM 0 HE22 GLN A 113 13.258 0.082 -11.430 1.00 2.11 H new ATOM 66 N SER A 114 12.700 -3.938 -5.684 1.00 73.24 N ATOM 67 CA SER A 114 13.915 -4.410 -5.032 1.00 64.10 C ATOM 68 C SER A 114 14.738 -5.278 -5.979 1.00 61.40 C ATOM 69 O SER A 114 14.294 -5.613 -7.078 1.00 45.22 O ATOM 70 CB SER A 114 13.568 -5.201 -3.769 1.00 51.32 C ATOM 71 OG SER A 114 13.411 -4.339 -2.655 1.00 53.02 O ATOM 0 H SER A 114 12.070 -4.680 -5.988 1.00 73.24 H new ATOM 0 HA SER A 114 14.510 -3.540 -4.755 1.00 64.10 H new ATOM 0 HB2 SER A 114 12.649 -5.764 -3.930 1.00 51.32 H new ATOM 0 HB3 SER A 114 14.354 -5.927 -3.563 1.00 51.32 H new ATOM 0 HG SER A 114 13.188 -4.868 -1.861 1.00 53.02 H new ATOM 77 N THR A 115 15.941 -5.641 -5.545 1.00 22.13 N ATOM 78 CA THR A 115 16.828 -6.469 -6.352 1.00 73.24 C ATOM 79 C THR A 115 16.840 -7.910 -5.854 1.00 3.31 C ATOM 80 O THR A 115 16.811 -8.161 -4.649 1.00 11.33 O ATOM 81 CB THR A 115 18.268 -5.923 -6.345 1.00 51.04 C ATOM 82 OG1 THR A 115 19.065 -6.630 -7.303 1.00 13.34 O ATOM 83 CG2 THR A 115 18.890 -6.055 -4.964 1.00 22.45 C ATOM 0 H THR A 115 16.323 -5.374 -4.638 1.00 22.13 H new ATOM 0 HA THR A 115 16.443 -6.443 -7.371 1.00 73.24 H new ATOM 0 HB THR A 115 18.234 -4.866 -6.611 1.00 51.04 H new ATOM 0 HG1 THR A 115 19.682 -7.230 -6.835 1.00 13.34 H new ATOM 0 HG21 THR A 115 19.907 -5.663 -4.984 1.00 22.45 H new ATOM 0 HG22 THR A 115 18.298 -5.492 -4.243 1.00 22.45 H new ATOM 0 HG23 THR A 115 18.912 -7.105 -4.674 1.00 22.45 H new ATOM 91 N CYS A 116 16.885 -8.854 -6.788 1.00 12.20 N ATOM 92 CA CYS A 116 16.902 -10.270 -6.444 1.00 34.40 C ATOM 93 C CYS A 116 17.263 -11.121 -7.658 1.00 41.24 C ATOM 94 O CYS A 116 17.098 -10.709 -8.807 1.00 30.30 O ATOM 95 CB CYS A 116 15.540 -10.699 -5.894 1.00 72.43 C ATOM 96 SG CYS A 116 14.121 -10.055 -6.838 1.00 32.14 S ATOM 0 H CYS A 116 16.910 -8.663 -7.790 1.00 12.20 H new ATOM 0 HA CYS A 116 17.661 -10.422 -5.677 1.00 34.40 H new ATOM 0 HB2 CYS A 116 15.491 -11.788 -5.883 1.00 72.43 H new ATOM 0 HB3 CYS A 116 15.456 -10.365 -4.860 1.00 72.43 H new ATOM 101 N PRO A 117 17.768 -12.336 -7.400 1.00 61.33 N ATOM 102 CA PRO A 117 18.163 -13.271 -8.459 1.00 13.44 C ATOM 103 C PRO A 117 16.963 -13.823 -9.221 1.00 22.21 C ATOM 104 O PRO A 117 16.153 -14.566 -8.667 1.00 3.41 O ATOM 105 CB PRO A 117 18.874 -14.391 -7.696 1.00 32.03 C ATOM 106 CG PRO A 117 18.297 -14.340 -6.323 1.00 73.32 C ATOM 107 CD PRO A 117 17.992 -12.892 -6.055 1.00 63.33 C ATOM 0 HA PRO A 117 18.784 -12.792 -9.216 1.00 13.44 H new ATOM 0 HB2 PRO A 117 18.700 -15.360 -8.163 1.00 32.03 H new ATOM 0 HB3 PRO A 117 19.953 -14.235 -7.678 1.00 32.03 H new ATOM 0 HG2 PRO A 117 17.395 -14.948 -6.256 1.00 73.32 H new ATOM 0 HG3 PRO A 117 19.001 -14.733 -5.589 1.00 73.32 H new ATOM 0 HD2 PRO A 117 17.113 -12.777 -5.421 1.00 63.33 H new ATOM 0 HD3 PRO A 117 18.818 -12.395 -5.547 1.00 63.33 H new ATOM 115 N GLU A 118 16.857 -13.456 -10.494 1.00 73.22 N ATOM 116 CA GLU A 118 15.755 -13.916 -11.331 1.00 71.14 C ATOM 117 C GLU A 118 15.611 -15.433 -11.257 1.00 24.53 C ATOM 118 O GLU A 118 16.585 -16.148 -11.015 1.00 74.24 O ATOM 119 CB GLU A 118 15.973 -13.484 -12.783 1.00 65.40 C ATOM 120 CG GLU A 118 14.861 -13.921 -13.722 1.00 2.42 C ATOM 121 CD GLU A 118 13.504 -13.388 -13.305 1.00 51.14 C ATOM 122 OE1 GLU A 118 13.464 -12.400 -12.542 1.00 73.12 O ATOM 123 OE2 GLU A 118 12.483 -13.958 -13.742 1.00 74.31 O ATOM 0 H GLU A 118 17.520 -12.842 -10.968 1.00 73.22 H new ATOM 0 HA GLU A 118 14.837 -13.463 -10.958 1.00 71.14 H new ATOM 0 HB2 GLU A 118 16.063 -12.398 -12.821 1.00 65.40 H new ATOM 0 HB3 GLU A 118 16.918 -13.895 -13.137 1.00 65.40 H new ATOM 0 HG2 GLU A 118 15.087 -13.579 -14.732 1.00 2.42 H new ATOM 0 HG3 GLU A 118 14.825 -15.010 -13.755 1.00 2.42 H new ATOM 130 N ILE A 119 14.391 -15.917 -11.465 1.00 25.34 N ATOM 131 CA ILE A 119 14.120 -17.349 -11.421 1.00 44.24 C ATOM 132 C ILE A 119 14.599 -18.038 -12.695 1.00 11.40 C ATOM 133 O ILE A 119 14.195 -17.693 -13.806 1.00 22.11 O ATOM 134 CB ILE A 119 12.619 -17.632 -11.231 1.00 55.13 C ATOM 135 CG1 ILE A 119 12.068 -16.815 -10.060 1.00 74.53 C ATOM 136 CG2 ILE A 119 12.384 -19.118 -11.005 1.00 2.14 C ATOM 137 CD1 ILE A 119 10.587 -17.017 -9.827 1.00 32.21 C ATOM 0 H ILE A 119 13.575 -15.339 -11.666 1.00 25.34 H new ATOM 0 HA ILE A 119 14.667 -17.748 -10.567 1.00 44.24 H new ATOM 0 HB ILE A 119 12.091 -17.335 -12.137 1.00 55.13 H new ATOM 0 HG12 ILE A 119 12.610 -17.083 -9.153 1.00 74.53 H new ATOM 0 HG13 ILE A 119 12.258 -15.758 -10.244 1.00 74.53 H new ATOM 0 HG21 ILE A 119 11.318 -19.302 -10.872 1.00 2.14 H new ATOM 0 HG22 ILE A 119 12.744 -19.679 -11.868 1.00 2.14 H new ATOM 0 HG23 ILE A 119 12.921 -19.440 -10.113 1.00 2.14 H new ATOM 0 HD11 ILE A 119 10.265 -16.408 -8.982 1.00 32.21 H new ATOM 0 HD12 ILE A 119 10.035 -16.721 -10.719 1.00 32.21 H new ATOM 0 HD13 ILE A 119 10.393 -18.068 -9.611 1.00 32.21 H new ATOM 149 N PRO A 120 15.479 -19.036 -12.532 1.00 62.45 N ATOM 150 CA PRO A 120 16.030 -19.797 -13.658 1.00 42.11 C ATOM 151 C PRO A 120 14.988 -20.692 -14.319 1.00 35.35 C ATOM 152 O PRO A 120 14.014 -21.100 -13.684 1.00 42.13 O ATOM 153 CB PRO A 120 17.129 -20.643 -13.010 1.00 72.43 C ATOM 154 CG PRO A 120 16.711 -20.781 -11.587 1.00 4.22 C ATOM 155 CD PRO A 120 16.004 -19.501 -11.237 1.00 40.33 C ATOM 0 HA PRO A 120 16.389 -19.145 -14.454 1.00 42.11 H new ATOM 0 HB2 PRO A 120 17.216 -21.616 -13.493 1.00 72.43 H new ATOM 0 HB3 PRO A 120 18.102 -20.158 -13.092 1.00 72.43 H new ATOM 0 HG2 PRO A 120 16.052 -21.639 -11.455 1.00 4.22 H new ATOM 0 HG3 PRO A 120 17.574 -20.940 -10.940 1.00 4.22 H new ATOM 0 HD2 PRO A 120 15.204 -19.668 -10.516 1.00 40.33 H new ATOM 0 HD3 PRO A 120 16.685 -18.774 -10.795 1.00 40.33 H new ATOM 163 N ASP A 121 15.198 -20.995 -15.595 1.00 14.02 N ATOM 164 CA ASP A 121 14.276 -21.844 -16.341 1.00 2.00 C ATOM 165 C ASP A 121 15.036 -22.885 -17.157 1.00 21.11 C ATOM 166 O ASP A 121 16.161 -22.646 -17.596 1.00 41.40 O ATOM 167 CB ASP A 121 13.400 -20.995 -17.264 1.00 2.14 C ATOM 168 CG ASP A 121 12.562 -19.988 -16.501 1.00 31.11 C ATOM 169 OD1 ASP A 121 11.860 -20.398 -15.553 1.00 54.04 O ATOM 170 OD2 ASP A 121 12.607 -18.790 -16.852 1.00 24.30 O ATOM 0 H ASP A 121 15.998 -20.666 -16.135 1.00 14.02 H new ATOM 0 HA ASP A 121 13.639 -22.363 -15.625 1.00 2.00 H new ATOM 0 HB2 ASP A 121 14.033 -20.469 -17.979 1.00 2.14 H new ATOM 0 HB3 ASP A 121 12.744 -21.648 -17.839 1.00 2.14 H new ATOM 175 N LYS A 122 14.415 -24.043 -17.355 1.00 55.44 N ATOM 176 CA LYS A 122 15.031 -25.122 -18.118 1.00 52.54 C ATOM 177 C LYS A 122 15.350 -24.669 -19.540 1.00 24.24 C ATOM 178 O LYS A 122 16.170 -25.279 -20.227 1.00 61.03 O ATOM 179 CB LYS A 122 14.106 -26.340 -18.155 1.00 61.45 C ATOM 180 CG LYS A 122 14.023 -27.081 -16.832 1.00 70.32 C ATOM 181 CD LYS A 122 13.500 -28.496 -17.017 1.00 54.20 C ATOM 182 CE LYS A 122 11.979 -28.535 -16.995 1.00 43.12 C ATOM 183 NZ LYS A 122 11.456 -29.905 -17.251 1.00 30.41 N ATOM 0 H LYS A 122 13.484 -24.258 -16.997 1.00 55.44 H new ATOM 0 HA LYS A 122 15.964 -25.396 -17.625 1.00 52.54 H new ATOM 0 HB2 LYS A 122 13.106 -26.018 -18.445 1.00 61.45 H new ATOM 0 HB3 LYS A 122 14.455 -27.027 -18.926 1.00 61.45 H new ATOM 0 HG2 LYS A 122 15.010 -27.114 -16.370 1.00 70.32 H new ATOM 0 HG3 LYS A 122 13.370 -26.537 -16.150 1.00 70.32 H new ATOM 0 HD2 LYS A 122 13.862 -28.898 -17.963 1.00 54.20 H new ATOM 0 HD3 LYS A 122 13.893 -29.137 -16.227 1.00 54.20 H new ATOM 0 HE2 LYS A 122 11.621 -28.184 -16.027 1.00 43.12 H new ATOM 0 HE3 LYS A 122 11.587 -27.850 -17.747 1.00 43.12 H new ATOM 0 HZ1 LYS A 122 10.416 -29.890 -17.228 1.00 30.41 H new ATOM 0 HZ2 LYS A 122 11.777 -30.230 -18.185 1.00 30.41 H new ATOM 0 HZ3 LYS A 122 11.809 -30.554 -16.519 1.00 30.41 H new ATOM 197 N THR A 123 14.699 -23.595 -19.975 1.00 1.03 N ATOM 198 CA THR A 123 14.914 -23.061 -21.314 1.00 2.15 C ATOM 199 C THR A 123 15.598 -21.700 -21.259 1.00 42.31 C ATOM 200 O THR A 123 16.231 -21.273 -22.225 1.00 61.30 O ATOM 201 CB THR A 123 13.587 -22.926 -22.084 1.00 44.42 C ATOM 202 OG1 THR A 123 12.943 -24.201 -22.178 1.00 12.24 O ATOM 203 CG2 THR A 123 13.826 -22.369 -23.480 1.00 25.13 C ATOM 0 H THR A 123 14.018 -23.078 -19.419 1.00 1.03 H new ATOM 0 HA THR A 123 15.559 -23.767 -21.837 1.00 2.15 H new ATOM 0 HB THR A 123 12.945 -22.235 -21.539 1.00 44.42 H new ATOM 0 HG1 THR A 123 12.099 -24.106 -22.667 1.00 12.24 H new ATOM 0 HG21 THR A 123 12.875 -22.282 -24.005 1.00 25.13 H new ATOM 0 HG22 THR A 123 14.290 -21.385 -23.405 1.00 25.13 H new ATOM 0 HG23 THR A 123 14.485 -23.040 -24.031 1.00 25.13 H new ATOM 211 N SER A 124 15.467 -21.022 -20.123 1.00 44.23 N ATOM 212 CA SER A 124 16.071 -19.706 -19.944 1.00 71.43 C ATOM 213 C SER A 124 17.145 -19.744 -18.861 1.00 74.21 C ATOM 214 O SER A 124 16.842 -19.896 -17.677 1.00 51.31 O ATOM 215 CB SER A 124 15.000 -18.676 -19.581 1.00 41.23 C ATOM 216 OG SER A 124 15.376 -17.378 -20.009 1.00 12.14 O ATOM 0 H SER A 124 14.948 -21.362 -19.313 1.00 44.23 H new ATOM 0 HA SER A 124 16.539 -19.417 -20.885 1.00 71.43 H new ATOM 0 HB2 SER A 124 14.052 -18.954 -20.042 1.00 41.23 H new ATOM 0 HB3 SER A 124 14.842 -18.675 -18.503 1.00 41.23 H new ATOM 0 HG SER A 124 14.675 -16.738 -19.767 1.00 12.14 H new ATOM 222 N ILE A 125 18.399 -19.605 -19.276 1.00 23.44 N ATOM 223 CA ILE A 125 19.518 -19.622 -18.342 1.00 22.55 C ATOM 224 C ILE A 125 20.375 -18.369 -18.487 1.00 32.32 C ATOM 225 O ILE A 125 20.358 -17.710 -19.526 1.00 42.45 O ATOM 226 CB ILE A 125 20.406 -20.864 -18.549 1.00 34.13 C ATOM 227 CG1 ILE A 125 19.543 -22.125 -18.639 1.00 44.21 C ATOM 228 CG2 ILE A 125 21.417 -20.987 -17.418 1.00 74.14 C ATOM 229 CD1 ILE A 125 19.059 -22.426 -20.040 1.00 61.40 C ATOM 0 H ILE A 125 18.666 -19.479 -20.252 1.00 23.44 H new ATOM 0 HA ILE A 125 19.091 -19.653 -17.340 1.00 22.55 H new ATOM 0 HB ILE A 125 20.951 -20.751 -19.486 1.00 34.13 H new ATOM 0 HG12 ILE A 125 20.117 -22.975 -18.271 1.00 44.21 H new ATOM 0 HG13 ILE A 125 18.681 -22.013 -17.981 1.00 44.21 H new ATOM 0 HG21 ILE A 125 22.037 -21.869 -17.578 1.00 74.14 H new ATOM 0 HG22 ILE A 125 22.048 -20.099 -17.396 1.00 74.14 H new ATOM 0 HG23 ILE A 125 20.891 -21.081 -16.468 1.00 74.14 H new ATOM 0 HD11 ILE A 125 18.454 -23.333 -20.029 1.00 61.40 H new ATOM 0 HD12 ILE A 125 18.458 -21.593 -20.404 1.00 61.40 H new ATOM 0 HD13 ILE A 125 19.916 -22.570 -20.698 1.00 61.40 H new ATOM 241 N CYS A 126 21.124 -18.047 -17.438 1.00 44.11 N ATOM 242 CA CYS A 126 21.990 -16.874 -17.448 1.00 12.32 C ATOM 243 C CYS A 126 23.457 -17.281 -17.544 1.00 43.10 C ATOM 244 O CYS A 126 23.848 -18.347 -17.071 1.00 62.34 O ATOM 245 CB CYS A 126 21.763 -16.036 -16.188 1.00 21.44 C ATOM 246 SG CYS A 126 22.518 -14.380 -16.250 1.00 3.23 S ATOM 0 H CYS A 126 21.149 -18.582 -16.570 1.00 44.11 H new ATOM 0 HA CYS A 126 21.739 -16.276 -18.324 1.00 12.32 H new ATOM 0 HB2 CYS A 126 20.691 -15.929 -16.024 1.00 21.44 H new ATOM 0 HB3 CYS A 126 22.164 -16.574 -15.329 1.00 21.44 H new ATOM 251 N ASN A 127 24.265 -16.423 -18.159 1.00 74.04 N ATOM 252 CA ASN A 127 25.689 -16.693 -18.318 1.00 70.21 C ATOM 253 C ASN A 127 26.505 -15.940 -17.272 1.00 44.13 C ATOM 254 O ASN A 127 25.954 -15.222 -16.438 1.00 73.22 O ATOM 255 CB ASN A 127 26.151 -16.299 -19.723 1.00 34.14 C ATOM 256 CG ASN A 127 25.276 -16.897 -20.808 1.00 11.23 C ATOM 257 OD1 ASN A 127 25.531 -18.001 -21.289 1.00 5.24 O ATOM 258 ND2 ASN A 127 24.237 -16.168 -21.199 1.00 1.45 N ATOM 0 H ASN A 127 23.957 -15.535 -18.555 1.00 74.04 H new ATOM 0 HA ASN A 127 25.849 -17.762 -18.177 1.00 70.21 H new ATOM 0 HB2 ASN A 127 26.145 -15.213 -19.813 1.00 34.14 H new ATOM 0 HB3 ASN A 127 27.181 -16.626 -19.869 1.00 34.14 H new ATOM 0 HD21 ASN A 127 23.613 -16.518 -21.926 1.00 1.45 H new ATOM 0 HD22 ASN A 127 24.063 -15.258 -20.773 1.00 1.45 H new ATOM 265 N SER A 128 27.823 -16.108 -17.324 1.00 32.40 N ATOM 266 CA SER A 128 28.716 -15.447 -16.379 1.00 73.35 C ATOM 267 C SER A 128 28.598 -13.930 -16.491 1.00 73.32 C ATOM 268 O SER A 128 27.966 -13.412 -17.412 1.00 15.14 O ATOM 269 CB SER A 128 30.163 -15.877 -16.627 1.00 31.33 C ATOM 270 OG SER A 128 30.443 -17.114 -15.995 1.00 35.34 O ATOM 0 H SER A 128 28.296 -16.696 -18.010 1.00 32.40 H new ATOM 0 HA SER A 128 28.424 -15.744 -15.372 1.00 73.35 H new ATOM 0 HB2 SER A 128 30.341 -15.964 -17.699 1.00 31.33 H new ATOM 0 HB3 SER A 128 30.842 -15.112 -16.252 1.00 31.33 H new ATOM 0 HG SER A 128 31.373 -17.368 -16.170 1.00 35.34 H new ATOM 276 N ASP A 129 29.211 -13.225 -15.547 1.00 52.33 N ATOM 277 CA ASP A 129 29.176 -11.767 -15.539 1.00 4.23 C ATOM 278 C ASP A 129 29.750 -11.202 -16.835 1.00 34.12 C ATOM 279 O ASP A 129 29.393 -10.102 -17.255 1.00 5.31 O ATOM 280 CB ASP A 129 29.958 -11.224 -14.342 1.00 3.14 C ATOM 281 CG ASP A 129 30.183 -9.727 -14.428 1.00 24.24 C ATOM 282 OD1 ASP A 129 29.187 -8.974 -14.394 1.00 25.12 O ATOM 283 OD2 ASP A 129 31.356 -9.309 -14.528 1.00 15.31 O ATOM 0 H ASP A 129 29.738 -13.639 -14.778 1.00 52.33 H new ATOM 0 HA ASP A 129 28.135 -11.454 -15.457 1.00 4.23 H new ATOM 0 HB2 ASP A 129 29.418 -11.455 -13.424 1.00 3.14 H new ATOM 0 HB3 ASP A 129 30.921 -11.730 -14.281 1.00 3.14 H new ATOM 288 N ALA A 130 30.640 -11.963 -17.463 1.00 0.10 N ATOM 289 CA ALA A 130 31.262 -11.539 -18.711 1.00 52.13 C ATOM 290 C ALA A 130 30.376 -11.872 -19.907 1.00 31.42 C ATOM 291 O ALA A 130 30.711 -11.553 -21.048 1.00 32.32 O ATOM 292 CB ALA A 130 32.629 -12.189 -18.867 1.00 52.33 C ATOM 0 H ALA A 130 30.946 -12.876 -17.128 1.00 0.10 H new ATOM 0 HA ALA A 130 31.388 -10.457 -18.676 1.00 52.13 H new ATOM 0 HB1 ALA A 130 33.082 -11.863 -19.803 1.00 52.33 H new ATOM 0 HB2 ALA A 130 33.268 -11.897 -18.034 1.00 52.33 H new ATOM 0 HB3 ALA A 130 32.517 -13.273 -18.876 1.00 52.33 H new ATOM 298 N ASP A 131 29.245 -12.516 -19.638 1.00 64.11 N ATOM 299 CA ASP A 131 28.311 -12.893 -20.692 1.00 52.43 C ATOM 300 C ASP A 131 26.888 -12.477 -20.331 1.00 42.54 C ATOM 301 O ASP A 131 25.935 -12.807 -21.038 1.00 21.35 O ATOM 302 CB ASP A 131 28.367 -14.401 -20.938 1.00 63.15 C ATOM 303 CG ASP A 131 29.567 -14.807 -21.772 1.00 20.24 C ATOM 304 OD1 ASP A 131 29.556 -14.548 -22.993 1.00 1.42 O ATOM 305 OD2 ASP A 131 30.517 -15.385 -21.202 1.00 73.54 O ATOM 0 H ASP A 131 28.953 -12.788 -18.699 1.00 64.11 H new ATOM 0 HA ASP A 131 28.603 -12.373 -21.605 1.00 52.43 H new ATOM 0 HB2 ASP A 131 28.400 -14.921 -19.981 1.00 63.15 H new ATOM 0 HB3 ASP A 131 27.454 -14.718 -21.442 1.00 63.15 H new ATOM 310 N CYS A 132 26.752 -11.750 -19.227 1.00 72.11 N ATOM 311 CA CYS A 132 25.446 -11.290 -18.770 1.00 41.45 C ATOM 312 C CYS A 132 25.388 -9.765 -18.738 1.00 73.12 C ATOM 313 O CYS A 132 26.252 -9.111 -18.153 1.00 72.20 O ATOM 314 CB CYS A 132 25.141 -11.852 -17.381 1.00 20.22 C ATOM 315 SG CYS A 132 23.411 -11.634 -16.854 1.00 10.13 S ATOM 0 H CYS A 132 27.531 -11.467 -18.632 1.00 72.11 H new ATOM 0 HA CYS A 132 24.695 -11.651 -19.473 1.00 41.45 H new ATOM 0 HB2 CYS A 132 25.382 -12.915 -17.370 1.00 20.22 H new ATOM 0 HB3 CYS A 132 25.795 -11.370 -16.654 1.00 20.22 H new ATOM 320 N THR A 133 24.362 -9.204 -19.371 1.00 60.12 N ATOM 321 CA THR A 133 24.190 -7.758 -19.416 1.00 44.52 C ATOM 322 C THR A 133 22.929 -7.330 -18.675 1.00 30.14 C ATOM 323 O THR A 133 21.932 -8.051 -18.631 1.00 14.43 O ATOM 324 CB THR A 133 24.118 -7.245 -20.867 1.00 73.31 C ATOM 325 OG1 THR A 133 23.257 -8.088 -21.641 1.00 53.34 O ATOM 326 CG2 THR A 133 25.501 -7.209 -21.498 1.00 44.11 C ATOM 0 H THR A 133 23.638 -9.730 -19.860 1.00 60.12 H new ATOM 0 HA THR A 133 25.061 -7.322 -18.927 1.00 44.52 H new ATOM 0 HB THR A 133 23.717 -6.231 -20.852 1.00 73.31 H new ATOM 0 HG1 THR A 133 23.215 -7.755 -22.562 1.00 53.34 H new ATOM 0 HG21 THR A 133 25.424 -6.844 -22.522 1.00 44.11 H new ATOM 0 HG22 THR A 133 26.146 -6.545 -20.923 1.00 44.11 H new ATOM 0 HG23 THR A 133 25.925 -8.213 -21.502 1.00 44.11 H new ATOM 334 N PRO A 134 22.971 -6.130 -18.078 1.00 14.24 N ATOM 335 CA PRO A 134 21.838 -5.579 -17.328 1.00 11.13 C ATOM 336 C PRO A 134 20.673 -5.196 -18.235 1.00 23.53 C ATOM 337 O PRO A 134 20.671 -5.511 -19.424 1.00 33.00 O ATOM 338 CB PRO A 134 22.427 -4.334 -16.660 1.00 14.14 C ATOM 339 CG PRO A 134 23.566 -3.938 -17.534 1.00 13.40 C ATOM 340 CD PRO A 134 24.127 -5.218 -18.089 1.00 54.40 C ATOM 0 HA PRO A 134 21.425 -6.302 -16.625 1.00 11.13 H new ATOM 0 HB2 PRO A 134 21.688 -3.536 -16.588 1.00 14.14 H new ATOM 0 HB3 PRO A 134 22.763 -4.550 -15.646 1.00 14.14 H new ATOM 0 HG2 PRO A 134 23.232 -3.279 -18.335 1.00 13.40 H new ATOM 0 HG3 PRO A 134 24.322 -3.394 -16.967 1.00 13.40 H new ATOM 0 HD2 PRO A 134 24.521 -5.081 -19.096 1.00 54.40 H new ATOM 0 HD3 PRO A 134 24.944 -5.598 -17.476 1.00 54.40 H new ATOM 348 N GLY A 135 19.684 -4.515 -17.665 1.00 10.14 N ATOM 349 CA GLY A 135 18.527 -4.101 -18.437 1.00 4.50 C ATOM 350 C GLY A 135 17.748 -5.277 -18.990 1.00 51.13 C ATOM 351 O GLY A 135 17.256 -6.115 -18.235 1.00 12.23 O ATOM 0 H GLY A 135 19.663 -4.243 -16.682 1.00 10.14 H new ATOM 0 HA2 GLY A 135 17.871 -3.498 -17.808 1.00 4.50 H new ATOM 0 HA3 GLY A 135 18.852 -3.465 -19.260 1.00 4.50 H new ATOM 355 N SER A 136 17.634 -5.340 -20.313 1.00 54.51 N ATOM 356 CA SER A 136 16.903 -6.419 -20.967 1.00 64.10 C ATOM 357 C SER A 136 15.508 -6.571 -20.369 1.00 21.41 C ATOM 358 O SER A 136 15.167 -7.618 -19.818 1.00 21.03 O ATOM 359 CB SER A 136 17.673 -7.735 -20.837 1.00 74.24 C ATOM 360 OG SER A 136 18.849 -7.718 -21.627 1.00 23.13 O ATOM 0 H SER A 136 18.039 -4.656 -20.953 1.00 54.51 H new ATOM 0 HA SER A 136 16.800 -6.168 -22.023 1.00 64.10 H new ATOM 0 HB2 SER A 136 17.935 -7.905 -19.793 1.00 74.24 H new ATOM 0 HB3 SER A 136 17.036 -8.564 -21.145 1.00 74.24 H new ATOM 0 HG SER A 136 19.324 -8.569 -21.525 1.00 23.13 H new ATOM 366 N VAL A 137 14.704 -5.519 -20.482 1.00 45.40 N ATOM 367 CA VAL A 137 13.346 -5.534 -19.954 1.00 55.11 C ATOM 368 C VAL A 137 12.581 -6.759 -20.441 1.00 34.50 C ATOM 369 O VAL A 137 12.409 -6.959 -21.644 1.00 32.45 O ATOM 370 CB VAL A 137 12.572 -4.265 -20.359 1.00 72.20 C ATOM 371 CG1 VAL A 137 12.594 -4.085 -21.869 1.00 72.32 C ATOM 372 CG2 VAL A 137 11.142 -4.325 -19.842 1.00 24.52 C ATOM 0 H VAL A 137 14.970 -4.645 -20.935 1.00 45.40 H new ATOM 0 HA VAL A 137 13.429 -5.569 -18.868 1.00 55.11 H new ATOM 0 HB VAL A 137 13.062 -3.402 -19.907 1.00 72.20 H new ATOM 0 HG11 VAL A 137 12.042 -3.184 -22.136 1.00 72.32 H new ATOM 0 HG12 VAL A 137 13.625 -3.993 -22.210 1.00 72.32 H new ATOM 0 HG13 VAL A 137 12.130 -4.949 -22.345 1.00 72.32 H new ATOM 0 HG21 VAL A 137 10.610 -3.421 -20.137 1.00 24.52 H new ATOM 0 HG22 VAL A 137 10.639 -5.196 -20.263 1.00 24.52 H new ATOM 0 HG23 VAL A 137 11.151 -4.402 -18.755 1.00 24.52 H new ATOM 382 N ASP A 138 12.123 -7.577 -19.499 1.00 51.11 N ATOM 383 CA ASP A 138 11.374 -8.783 -19.832 1.00 21.34 C ATOM 384 C ASP A 138 9.917 -8.656 -19.397 1.00 43.44 C ATOM 385 O ASP A 138 9.611 -8.009 -18.395 1.00 33.20 O ATOM 386 CB ASP A 138 12.012 -10.004 -19.167 1.00 60.44 C ATOM 387 CG ASP A 138 12.803 -10.849 -20.147 1.00 31.22 C ATOM 388 OD1 ASP A 138 12.175 -11.541 -20.975 1.00 52.44 O ATOM 389 OD2 ASP A 138 14.050 -10.820 -20.084 1.00 41.43 O ATOM 0 H ASP A 138 12.257 -7.427 -18.499 1.00 51.11 H new ATOM 0 HA ASP A 138 11.402 -8.911 -20.914 1.00 21.34 H new ATOM 0 HB2 ASP A 138 12.670 -9.674 -18.363 1.00 60.44 H new ATOM 0 HB3 ASP A 138 11.233 -10.615 -18.711 1.00 60.44 H new ATOM 394 N THR A 139 9.021 -9.275 -20.159 1.00 63.44 N ATOM 395 CA THR A 139 7.597 -9.229 -19.855 1.00 72.43 C ATOM 396 C THR A 139 7.261 -10.114 -18.660 1.00 71.01 C ATOM 397 O THR A 139 6.440 -9.751 -17.817 1.00 55.25 O ATOM 398 CB THR A 139 6.750 -9.674 -21.063 1.00 31.13 C ATOM 399 OG1 THR A 139 7.124 -10.997 -21.463 1.00 31.12 O ATOM 400 CG2 THR A 139 6.928 -8.716 -22.231 1.00 23.11 C ATOM 0 H THR A 139 9.257 -9.814 -20.992 1.00 63.44 H new ATOM 0 HA THR A 139 7.358 -8.193 -19.615 1.00 72.43 H new ATOM 0 HB THR A 139 5.701 -9.668 -20.765 1.00 31.13 H new ATOM 0 HG1 THR A 139 6.580 -11.273 -22.230 1.00 31.12 H new ATOM 0 HG21 THR A 139 6.321 -9.051 -23.072 1.00 23.11 H new ATOM 0 HG22 THR A 139 6.614 -7.716 -21.932 1.00 23.11 H new ATOM 0 HG23 THR A 139 7.977 -8.694 -22.527 1.00 23.11 H new ATOM 408 N HIS A 140 7.901 -11.277 -18.592 1.00 4.22 N ATOM 409 CA HIS A 140 7.671 -12.213 -17.498 1.00 31.44 C ATOM 410 C HIS A 140 8.580 -11.900 -16.313 1.00 44.24 C ATOM 411 O HIS A 140 8.601 -12.631 -15.323 1.00 54.22 O ATOM 412 CB HIS A 140 7.905 -13.649 -17.969 1.00 51.11 C ATOM 413 CG HIS A 140 7.189 -13.986 -19.241 1.00 10.22 C ATOM 414 ND1 HIS A 140 7.798 -13.957 -20.478 1.00 11.13 N ATOM 415 CD2 HIS A 140 5.908 -14.362 -19.463 1.00 32.35 C ATOM 416 CE1 HIS A 140 6.922 -14.299 -21.405 1.00 71.33 C ATOM 417 NE2 HIS A 140 5.767 -14.551 -20.815 1.00 42.24 N ATOM 0 H HIS A 140 8.583 -11.593 -19.282 1.00 4.22 H new ATOM 0 HA HIS A 140 6.635 -12.108 -17.176 1.00 31.44 H new ATOM 0 HB2 HIS A 140 8.974 -13.807 -18.111 1.00 51.11 H new ATOM 0 HB3 HIS A 140 7.582 -14.336 -17.187 1.00 51.11 H new ATOM 0 HD2 HIS A 140 5.139 -14.490 -18.715 1.00 32.35 H new ATOM 0 HE1 HIS A 140 7.117 -14.362 -22.465 1.00 71.33 H new ATOM 0 HE2 HIS A 140 4.910 -14.839 -21.287 1.00 42.24 H new ATOM 425 N SER A 141 9.332 -10.809 -16.423 1.00 51.11 N ATOM 426 CA SER A 141 10.247 -10.401 -15.363 1.00 71.34 C ATOM 427 C SER A 141 9.837 -9.052 -14.781 1.00 33.34 C ATOM 428 O SER A 141 9.835 -8.864 -13.564 1.00 44.22 O ATOM 429 CB SER A 141 11.678 -10.325 -15.898 1.00 43.41 C ATOM 430 OG SER A 141 12.004 -11.481 -16.650 1.00 43.52 O ATOM 0 H SER A 141 9.326 -10.192 -17.235 1.00 51.11 H new ATOM 0 HA SER A 141 10.202 -11.148 -14.570 1.00 71.34 H new ATOM 0 HB2 SER A 141 11.790 -9.438 -16.522 1.00 43.41 H new ATOM 0 HB3 SER A 141 12.375 -10.220 -15.067 1.00 43.41 H new ATOM 0 HG SER A 141 12.923 -11.407 -16.982 1.00 43.52 H new ATOM 436 N SER A 142 9.489 -8.117 -15.658 1.00 50.33 N ATOM 437 CA SER A 142 9.080 -6.783 -15.233 1.00 22.25 C ATOM 438 C SER A 142 10.158 -6.134 -14.370 1.00 21.35 C ATOM 439 O SER A 142 9.872 -5.263 -13.550 1.00 13.03 O ATOM 440 CB SER A 142 7.764 -6.854 -14.457 1.00 14.14 C ATOM 441 OG SER A 142 6.799 -7.619 -15.158 1.00 54.41 O ATOM 0 H SER A 142 9.482 -8.258 -16.668 1.00 50.33 H new ATOM 0 HA SER A 142 8.936 -6.172 -16.124 1.00 22.25 H new ATOM 0 HB2 SER A 142 7.940 -7.296 -13.476 1.00 14.14 H new ATOM 0 HB3 SER A 142 7.382 -5.847 -14.289 1.00 14.14 H new ATOM 0 HG SER A 142 5.968 -7.651 -14.640 1.00 54.41 H new ATOM 447 N GLY A 143 11.401 -6.567 -14.561 1.00 52.31 N ATOM 448 CA GLY A 143 12.504 -6.018 -13.794 1.00 33.22 C ATOM 449 C GLY A 143 13.678 -5.623 -14.667 1.00 54.44 C ATOM 450 O GLY A 143 13.718 -5.953 -15.853 1.00 1.04 O ATOM 0 H GLY A 143 11.663 -7.288 -15.233 1.00 52.31 H new ATOM 0 HA2 GLY A 143 12.158 -5.146 -13.239 1.00 33.22 H new ATOM 0 HA3 GLY A 143 12.833 -6.753 -13.059 1.00 33.22 H new ATOM 454 N VAL A 144 14.636 -4.911 -14.082 1.00 13.01 N ATOM 455 CA VAL A 144 15.816 -4.469 -14.815 1.00 0.01 C ATOM 456 C VAL A 144 17.050 -5.261 -14.398 1.00 62.24 C ATOM 457 O VAL A 144 17.489 -5.188 -13.251 1.00 31.41 O ATOM 458 CB VAL A 144 16.084 -2.968 -14.595 1.00 22.44 C ATOM 459 CG1 VAL A 144 17.194 -2.483 -15.515 1.00 74.21 C ATOM 460 CG2 VAL A 144 14.812 -2.163 -14.809 1.00 53.02 C ATOM 0 H VAL A 144 14.618 -4.628 -13.102 1.00 13.01 H new ATOM 0 HA VAL A 144 15.616 -4.643 -15.872 1.00 0.01 H new ATOM 0 HB VAL A 144 16.410 -2.822 -13.565 1.00 22.44 H new ATOM 0 HG11 VAL A 144 17.369 -1.421 -15.345 1.00 74.21 H new ATOM 0 HG12 VAL A 144 18.108 -3.039 -15.307 1.00 74.21 H new ATOM 0 HG13 VAL A 144 16.901 -2.641 -16.553 1.00 74.21 H new ATOM 0 HG21 VAL A 144 15.020 -1.105 -14.649 1.00 53.02 H new ATOM 0 HG22 VAL A 144 14.454 -2.313 -15.827 1.00 53.02 H new ATOM 0 HG23 VAL A 144 14.049 -2.493 -14.104 1.00 53.02 H new ATOM 470 N ALA A 145 17.606 -6.018 -15.339 1.00 43.50 N ATOM 471 CA ALA A 145 18.792 -6.822 -15.071 1.00 11.24 C ATOM 472 C ALA A 145 19.925 -5.962 -14.521 1.00 64.41 C ATOM 473 O ALA A 145 20.133 -4.832 -14.964 1.00 13.15 O ATOM 474 CB ALA A 145 19.238 -7.542 -16.334 1.00 62.23 C ATOM 0 H ALA A 145 17.254 -6.091 -16.293 1.00 43.50 H new ATOM 0 HA ALA A 145 18.535 -7.564 -14.315 1.00 11.24 H new ATOM 0 HB1 ALA A 145 20.125 -8.138 -16.119 1.00 62.23 H new ATOM 0 HB2 ALA A 145 18.438 -8.194 -16.683 1.00 62.23 H new ATOM 0 HB3 ALA A 145 19.472 -6.810 -17.107 1.00 62.23 H new ATOM 480 N THR A 146 20.657 -6.505 -13.553 1.00 4.22 N ATOM 481 CA THR A 146 21.769 -5.787 -12.941 1.00 73.04 C ATOM 482 C THR A 146 23.072 -6.055 -13.685 1.00 50.34 C ATOM 483 O THR A 146 23.954 -5.199 -13.741 1.00 14.51 O ATOM 484 CB THR A 146 21.945 -6.180 -11.462 1.00 42.54 C ATOM 485 OG1 THR A 146 22.098 -7.599 -11.347 1.00 15.41 O ATOM 486 CG2 THR A 146 20.753 -5.723 -10.635 1.00 75.55 C ATOM 0 H THR A 146 20.500 -7.440 -13.176 1.00 4.22 H new ATOM 0 HA THR A 146 21.531 -4.725 -13.001 1.00 73.04 H new ATOM 0 HB THR A 146 22.840 -5.687 -11.082 1.00 42.54 H new ATOM 0 HG1 THR A 146 22.387 -7.824 -10.438 1.00 15.41 H new ATOM 0 HG21 THR A 146 20.900 -6.012 -9.594 1.00 75.55 H new ATOM 0 HG22 THR A 146 20.658 -4.639 -10.701 1.00 75.55 H new ATOM 0 HG23 THR A 146 19.845 -6.190 -11.016 1.00 75.55 H new ATOM 494 N GLY A 147 23.187 -7.250 -14.258 1.00 0.55 N ATOM 495 CA GLY A 147 24.387 -7.608 -14.991 1.00 75.15 C ATOM 496 C GLY A 147 25.095 -8.807 -14.394 1.00 24.15 C ATOM 497 O GLY A 147 25.601 -9.663 -15.119 1.00 60.34 O ATOM 0 H GLY A 147 22.471 -7.976 -14.227 1.00 0.55 H new ATOM 0 HA2 GLY A 147 24.125 -7.823 -16.027 1.00 75.15 H new ATOM 0 HA3 GLY A 147 25.068 -6.757 -15.004 1.00 75.15 H new ATOM 501 N ARG A 148 25.134 -8.868 -13.066 1.00 64.45 N ATOM 502 CA ARG A 148 25.789 -9.970 -12.371 1.00 44.14 C ATOM 503 C ARG A 148 24.890 -11.202 -12.336 1.00 62.25 C ATOM 504 O ARG A 148 23.690 -11.101 -12.082 1.00 32.04 O ATOM 505 CB ARG A 148 26.159 -9.554 -10.946 1.00 75.12 C ATOM 506 CG ARG A 148 27.522 -8.891 -10.839 1.00 61.20 C ATOM 507 CD ARG A 148 27.636 -8.052 -9.576 1.00 30.53 C ATOM 508 NE ARG A 148 28.518 -6.903 -9.759 1.00 71.04 N ATOM 509 CZ ARG A 148 28.886 -6.094 -8.772 1.00 64.23 C ATOM 510 NH1 ARG A 148 28.452 -6.308 -7.538 1.00 73.21 N ATOM 511 NH2 ARG A 148 29.692 -5.069 -9.019 1.00 12.24 N ATOM 0 H ARG A 148 24.720 -8.168 -12.451 1.00 64.45 H new ATOM 0 HA ARG A 148 26.699 -10.221 -12.917 1.00 44.14 H new ATOM 0 HB2 ARG A 148 25.400 -8.868 -10.568 1.00 75.12 H new ATOM 0 HB3 ARG A 148 26.141 -10.434 -10.304 1.00 75.12 H new ATOM 0 HG2 ARG A 148 28.300 -9.654 -10.842 1.00 61.20 H new ATOM 0 HG3 ARG A 148 27.691 -8.261 -11.712 1.00 61.20 H new ATOM 0 HD2 ARG A 148 26.646 -7.705 -9.281 1.00 30.53 H new ATOM 0 HD3 ARG A 148 28.012 -8.672 -8.762 1.00 30.53 H new ATOM 0 HE ARG A 148 28.871 -6.711 -10.696 1.00 71.04 H new ATOM 0 HH11 ARG A 148 27.834 -7.096 -7.344 1.00 73.21 H new ATOM 0 HH12 ARG A 148 28.736 -5.685 -6.782 1.00 73.21 H new ATOM 0 HH21 ARG A 148 30.029 -4.902 -9.967 1.00 12.24 H new ATOM 0 HH22 ARG A 148 29.974 -4.448 -8.261 1.00 12.24 H new ATOM 525 N CYS A 149 25.479 -12.365 -12.595 1.00 32.22 N ATOM 526 CA CYS A 149 24.732 -13.617 -12.594 1.00 63.43 C ATOM 527 C CYS A 149 25.267 -14.569 -11.528 1.00 11.11 C ATOM 528 O CYS A 149 26.469 -14.612 -11.264 1.00 52.54 O ATOM 529 CB CYS A 149 24.809 -14.281 -13.970 1.00 75.55 C ATOM 530 SG CYS A 149 23.719 -13.528 -15.221 1.00 34.31 S ATOM 0 H CYS A 149 26.471 -12.466 -12.808 1.00 32.22 H new ATOM 0 HA CYS A 149 23.691 -13.390 -12.364 1.00 63.43 H new ATOM 0 HB2 CYS A 149 25.838 -14.236 -14.326 1.00 75.55 H new ATOM 0 HB3 CYS A 149 24.553 -15.335 -13.868 1.00 75.55 H new ATOM 535 N VAL A 150 24.365 -15.331 -10.917 1.00 64.43 N ATOM 536 CA VAL A 150 24.746 -16.284 -9.881 1.00 15.44 C ATOM 537 C VAL A 150 23.993 -17.600 -10.041 1.00 10.23 C ATOM 538 O VAL A 150 22.898 -17.653 -10.600 1.00 73.24 O ATOM 539 CB VAL A 150 24.476 -15.719 -8.473 1.00 51.44 C ATOM 540 CG1 VAL A 150 25.478 -14.625 -8.136 1.00 21.43 C ATOM 541 CG2 VAL A 150 23.051 -15.196 -8.374 1.00 33.14 C ATOM 0 H VAL A 150 23.366 -15.307 -11.121 1.00 64.43 H new ATOM 0 HA VAL A 150 25.815 -16.464 -9.994 1.00 15.44 H new ATOM 0 HB VAL A 150 24.595 -16.524 -7.748 1.00 51.44 H new ATOM 0 HG11 VAL A 150 25.272 -14.238 -7.138 1.00 21.43 H new ATOM 0 HG12 VAL A 150 26.488 -15.035 -8.165 1.00 21.43 H new ATOM 0 HG13 VAL A 150 25.393 -13.817 -8.863 1.00 21.43 H new ATOM 0 HG21 VAL A 150 22.877 -14.801 -7.373 1.00 33.14 H new ATOM 0 HG22 VAL A 150 22.902 -14.404 -9.108 1.00 33.14 H new ATOM 0 HG23 VAL A 150 22.351 -16.008 -8.570 1.00 33.14 H new ATOM 551 N PRO A 151 24.592 -18.689 -9.537 1.00 64.05 N ATOM 552 CA PRO A 151 23.996 -20.026 -9.611 1.00 61.14 C ATOM 553 C PRO A 151 22.771 -20.165 -8.713 1.00 65.15 C ATOM 554 O PRO A 151 22.857 -20.702 -7.609 1.00 10.23 O ATOM 555 CB PRO A 151 25.121 -20.944 -9.127 1.00 4.33 C ATOM 556 CG PRO A 151 25.970 -20.078 -8.261 1.00 11.21 C ATOM 557 CD PRO A 151 25.898 -18.699 -8.857 1.00 64.22 C ATOM 0 HA PRO A 151 23.640 -20.258 -10.615 1.00 61.14 H new ATOM 0 HB2 PRO A 151 24.726 -21.795 -8.571 1.00 4.33 H new ATOM 0 HB3 PRO A 151 25.691 -21.347 -9.964 1.00 4.33 H new ATOM 0 HG2 PRO A 151 25.607 -20.078 -7.233 1.00 11.21 H new ATOM 0 HG3 PRO A 151 26.998 -20.439 -8.236 1.00 11.21 H new ATOM 0 HD2 PRO A 151 25.958 -17.926 -8.090 1.00 64.22 H new ATOM 0 HD3 PRO A 151 26.716 -18.520 -9.555 1.00 64.22 H new ATOM 565 N PHE A 152 21.632 -19.679 -9.195 1.00 3.32 N ATOM 566 CA PHE A 152 20.390 -19.748 -8.435 1.00 34.41 C ATOM 567 C PHE A 152 20.127 -21.171 -7.950 1.00 65.44 C ATOM 568 O PHE A 152 19.990 -21.415 -6.753 1.00 14.05 O ATOM 569 CB PHE A 152 19.217 -19.264 -9.290 1.00 35.43 C ATOM 570 CG PHE A 152 17.901 -19.278 -8.565 1.00 1.42 C ATOM 571 CD1 PHE A 152 17.178 -20.452 -8.436 1.00 71.51 C ATOM 572 CD2 PHE A 152 17.388 -18.115 -8.012 1.00 30.52 C ATOM 573 CE1 PHE A 152 15.967 -20.467 -7.770 1.00 72.13 C ATOM 574 CE2 PHE A 152 16.178 -18.124 -7.344 1.00 75.15 C ATOM 575 CZ PHE A 152 15.467 -19.302 -7.223 1.00 14.13 C ATOM 0 H PHE A 152 21.544 -19.233 -10.108 1.00 3.32 H new ATOM 0 HA PHE A 152 20.489 -19.099 -7.565 1.00 34.41 H new ATOM 0 HB2 PHE A 152 19.422 -18.250 -9.634 1.00 35.43 H new ATOM 0 HB3 PHE A 152 19.141 -19.893 -10.177 1.00 35.43 H new ATOM 0 HD1 PHE A 152 17.565 -21.367 -8.861 1.00 71.51 H new ATOM 0 HD2 PHE A 152 17.940 -17.191 -8.104 1.00 30.52 H new ATOM 0 HE1 PHE A 152 15.412 -21.389 -7.678 1.00 72.13 H new ATOM 0 HE2 PHE A 152 15.789 -17.211 -6.917 1.00 75.15 H new ATOM 0 HZ PHE A 152 14.521 -19.312 -6.701 1.00 14.13 H new ATOM 585 N ASN A 153 20.060 -22.107 -8.892 1.00 35.44 N ATOM 586 CA ASN A 153 19.813 -23.506 -8.562 1.00 33.42 C ATOM 587 C ASN A 153 21.125 -24.274 -8.431 1.00 74.22 C ATOM 588 O ASN A 153 22.202 -23.681 -8.410 1.00 4.20 O ATOM 589 CB ASN A 153 18.933 -24.157 -9.631 1.00 54.53 C ATOM 590 CG ASN A 153 17.887 -25.080 -9.037 1.00 20.14 C ATOM 591 OD1 ASN A 153 17.793 -26.250 -9.407 1.00 63.24 O ATOM 592 ND2 ASN A 153 17.094 -24.556 -8.109 1.00 23.42 N ATOM 0 H ASN A 153 20.173 -21.922 -9.889 1.00 35.44 H new ATOM 0 HA ASN A 153 19.295 -23.541 -7.604 1.00 33.42 H new ATOM 0 HB2 ASN A 153 18.439 -23.379 -10.213 1.00 54.53 H new ATOM 0 HB3 ASN A 153 19.561 -24.721 -10.321 1.00 54.53 H new ATOM 0 HD21 ASN A 153 16.372 -25.129 -7.673 1.00 23.42 H new ATOM 0 HD22 ASN A 153 17.208 -23.581 -7.833 1.00 23.42 H new ATOM 599 N GLU A 154 21.024 -25.597 -8.345 1.00 11.12 N ATOM 600 CA GLU A 154 22.203 -26.445 -8.216 1.00 71.32 C ATOM 601 C GLU A 154 22.887 -26.634 -9.567 1.00 23.01 C ATOM 602 O GLU A 154 24.098 -26.449 -9.693 1.00 32.13 O ATOM 603 CB GLU A 154 21.818 -27.806 -7.633 1.00 30.44 C ATOM 604 CG GLU A 154 22.997 -28.584 -7.072 1.00 40.21 C ATOM 605 CD GLU A 154 23.816 -27.772 -6.087 1.00 41.15 C ATOM 606 OE1 GLU A 154 23.211 -27.096 -5.229 1.00 21.33 O ATOM 607 OE2 GLU A 154 25.061 -27.812 -6.176 1.00 11.24 O ATOM 0 H GLU A 154 20.139 -26.104 -8.362 1.00 11.12 H new ATOM 0 HA GLU A 154 22.901 -25.952 -7.540 1.00 71.32 H new ATOM 0 HB2 GLU A 154 21.082 -27.658 -6.843 1.00 30.44 H new ATOM 0 HB3 GLU A 154 21.337 -28.401 -8.409 1.00 30.44 H new ATOM 0 HG2 GLU A 154 22.632 -29.485 -6.579 1.00 40.21 H new ATOM 0 HG3 GLU A 154 23.638 -28.907 -7.892 1.00 40.21 H new ATOM 614 N SER A 155 22.103 -27.004 -10.574 1.00 43.05 N ATOM 615 CA SER A 155 22.633 -27.222 -11.915 1.00 64.42 C ATOM 616 C SER A 155 22.158 -26.133 -12.872 1.00 11.25 C ATOM 617 O SER A 155 22.134 -26.325 -14.087 1.00 54.03 O ATOM 618 CB SER A 155 22.208 -28.596 -12.437 1.00 71.12 C ATOM 619 OG SER A 155 22.884 -29.635 -11.750 1.00 1.31 O ATOM 0 H SER A 155 21.099 -27.159 -10.487 1.00 43.05 H new ATOM 0 HA SER A 155 23.721 -27.182 -11.859 1.00 64.42 H new ATOM 0 HB2 SER A 155 21.131 -28.717 -12.317 1.00 71.12 H new ATOM 0 HB3 SER A 155 22.419 -28.664 -13.504 1.00 71.12 H new ATOM 0 HG SER A 155 22.593 -30.503 -12.101 1.00 1.31 H new ATOM 625 N VAL A 156 21.780 -24.987 -12.313 1.00 23.33 N ATOM 626 CA VAL A 156 21.306 -23.865 -13.114 1.00 62.53 C ATOM 627 C VAL A 156 21.748 -22.536 -12.514 1.00 2.40 C ATOM 628 O VAL A 156 21.953 -22.425 -11.305 1.00 43.31 O ATOM 629 CB VAL A 156 19.771 -23.875 -13.240 1.00 41.50 C ATOM 630 CG1 VAL A 156 19.314 -22.860 -14.277 1.00 62.01 C ATOM 631 CG2 VAL A 156 19.274 -25.269 -13.591 1.00 10.22 C ATOM 0 H VAL A 156 21.793 -24.812 -11.308 1.00 23.33 H new ATOM 0 HA VAL A 156 21.745 -23.976 -14.106 1.00 62.53 H new ATOM 0 HB VAL A 156 19.343 -23.594 -12.278 1.00 41.50 H new ATOM 0 HG11 VAL A 156 18.227 -22.881 -14.352 1.00 62.01 H new ATOM 0 HG12 VAL A 156 19.638 -21.863 -13.978 1.00 62.01 H new ATOM 0 HG13 VAL A 156 19.750 -23.107 -15.245 1.00 62.01 H new ATOM 0 HG21 VAL A 156 18.187 -25.257 -13.676 1.00 10.22 H new ATOM 0 HG22 VAL A 156 19.709 -25.582 -14.540 1.00 10.22 H new ATOM 0 HG23 VAL A 156 19.569 -25.968 -12.809 1.00 10.22 H new ATOM 641 N LYS A 157 21.893 -21.527 -13.367 1.00 11.13 N ATOM 642 CA LYS A 157 22.309 -20.202 -12.922 1.00 31.11 C ATOM 643 C LYS A 157 21.464 -19.117 -13.581 1.00 14.34 C ATOM 644 O LYS A 157 21.174 -19.180 -14.776 1.00 32.11 O ATOM 645 CB LYS A 157 23.788 -19.976 -13.241 1.00 43.54 C ATOM 646 CG LYS A 157 24.656 -21.199 -13.004 1.00 22.13 C ATOM 647 CD LYS A 157 26.112 -20.924 -13.342 1.00 31.42 C ATOM 648 CE LYS A 157 26.876 -20.405 -12.134 1.00 24.34 C ATOM 649 NZ LYS A 157 27.689 -21.475 -11.490 1.00 51.41 N ATOM 0 H LYS A 157 21.728 -21.602 -14.371 1.00 11.13 H new ATOM 0 HA LYS A 157 22.164 -20.146 -11.843 1.00 31.11 H new ATOM 0 HB2 LYS A 157 23.883 -19.670 -14.283 1.00 43.54 H new ATOM 0 HB3 LYS A 157 24.161 -19.153 -12.631 1.00 43.54 H new ATOM 0 HG2 LYS A 157 24.576 -21.507 -11.961 1.00 22.13 H new ATOM 0 HG3 LYS A 157 24.291 -22.028 -13.610 1.00 22.13 H new ATOM 0 HD2 LYS A 157 26.581 -21.838 -13.705 1.00 31.42 H new ATOM 0 HD3 LYS A 157 26.168 -20.194 -14.150 1.00 31.42 H new ATOM 0 HE2 LYS A 157 27.529 -19.588 -12.441 1.00 24.34 H new ATOM 0 HE3 LYS A 157 26.173 -19.996 -11.408 1.00 24.34 H new ATOM 0 HZ1 LYS A 157 28.086 -21.119 -10.597 1.00 51.41 H new ATOM 0 HZ2 LYS A 157 27.086 -22.300 -11.297 1.00 51.41 H new ATOM 0 HZ3 LYS A 157 28.463 -21.753 -12.126 1.00 51.41 H new ATOM 663 N THR A 158 21.071 -18.119 -12.794 1.00 22.30 N ATOM 664 CA THR A 158 20.260 -17.020 -13.301 1.00 12.11 C ATOM 665 C THR A 158 20.966 -15.682 -13.112 1.00 65.53 C ATOM 666 O THR A 158 22.055 -15.619 -12.540 1.00 50.00 O ATOM 667 CB THR A 158 18.888 -16.966 -12.602 1.00 50.34 C ATOM 668 OG1 THR A 158 18.619 -18.214 -11.954 1.00 10.55 O ATOM 669 CG2 THR A 158 17.783 -16.660 -13.603 1.00 2.15 C ATOM 0 H THR A 158 21.302 -18.050 -11.803 1.00 22.30 H new ATOM 0 HA THR A 158 20.111 -17.202 -14.365 1.00 12.11 H new ATOM 0 HB THR A 158 18.914 -16.169 -11.858 1.00 50.34 H new ATOM 0 HG1 THR A 158 19.354 -18.838 -12.128 1.00 10.55 H new ATOM 0 HG21 THR A 158 16.823 -16.627 -13.087 1.00 2.15 H new ATOM 0 HG22 THR A 158 17.975 -15.696 -14.074 1.00 2.15 H new ATOM 0 HG23 THR A 158 17.758 -17.438 -14.366 1.00 2.15 H new ATOM 677 N CYS A 159 20.341 -14.615 -13.596 1.00 40.34 N ATOM 678 CA CYS A 159 20.910 -13.277 -13.481 1.00 74.22 C ATOM 679 C CYS A 159 20.071 -12.408 -12.548 1.00 60.24 C ATOM 680 O CYS A 159 18.843 -12.492 -12.543 1.00 25.32 O ATOM 681 CB CYS A 159 21.005 -12.620 -14.860 1.00 32.43 C ATOM 682 SG CYS A 159 22.581 -12.925 -15.721 1.00 75.35 S ATOM 0 H CYS A 159 19.440 -14.650 -14.072 1.00 40.34 H new ATOM 0 HA CYS A 159 21.911 -13.370 -13.061 1.00 74.22 H new ATOM 0 HB2 CYS A 159 20.187 -12.984 -15.482 1.00 32.43 H new ATOM 0 HB3 CYS A 159 20.866 -11.545 -14.749 1.00 32.43 H new ATOM 687 N GLU A 160 20.744 -11.574 -11.762 1.00 32.14 N ATOM 688 CA GLU A 160 20.060 -10.690 -10.825 1.00 23.35 C ATOM 689 C GLU A 160 19.368 -9.547 -11.561 1.00 42.00 C ATOM 690 O GLU A 160 19.911 -8.990 -12.515 1.00 53.24 O ATOM 691 CB GLU A 160 21.052 -10.128 -9.804 1.00 13.13 C ATOM 692 CG GLU A 160 20.437 -9.115 -8.852 1.00 61.04 C ATOM 693 CD GLU A 160 21.469 -8.449 -7.963 1.00 31.43 C ATOM 694 OE1 GLU A 160 22.512 -8.008 -8.490 1.00 35.55 O ATOM 695 OE2 GLU A 160 21.233 -8.369 -6.739 1.00 32.31 O ATOM 0 H GLU A 160 21.761 -11.492 -11.755 1.00 32.14 H new ATOM 0 HA GLU A 160 19.302 -11.273 -10.302 1.00 23.35 H new ATOM 0 HB2 GLU A 160 21.470 -10.951 -9.225 1.00 13.13 H new ATOM 0 HB3 GLU A 160 21.880 -9.659 -10.335 1.00 13.13 H new ATOM 0 HG2 GLU A 160 19.913 -8.352 -9.428 1.00 61.04 H new ATOM 0 HG3 GLU A 160 19.693 -9.612 -8.229 1.00 61.04 H new ATOM 702 N VAL A 161 18.166 -9.203 -11.111 1.00 12.32 N ATOM 703 CA VAL A 161 17.399 -8.126 -11.726 1.00 33.04 C ATOM 704 C VAL A 161 16.727 -7.256 -10.668 1.00 65.54 C ATOM 705 O VAL A 161 16.761 -7.570 -9.479 1.00 64.30 O ATOM 706 CB VAL A 161 16.323 -8.677 -12.680 1.00 33.42 C ATOM 707 CG1 VAL A 161 16.953 -9.573 -13.735 1.00 20.40 C ATOM 708 CG2 VAL A 161 15.254 -9.428 -11.900 1.00 21.50 C ATOM 0 H VAL A 161 17.702 -9.654 -10.323 1.00 12.32 H new ATOM 0 HA VAL A 161 18.104 -7.521 -12.296 1.00 33.04 H new ATOM 0 HB VAL A 161 15.848 -7.838 -13.188 1.00 33.42 H new ATOM 0 HG11 VAL A 161 16.177 -9.953 -14.400 1.00 20.40 H new ATOM 0 HG12 VAL A 161 17.678 -9.000 -14.313 1.00 20.40 H new ATOM 0 HG13 VAL A 161 17.456 -10.409 -13.249 1.00 20.40 H new ATOM 0 HG21 VAL A 161 14.502 -9.811 -12.590 1.00 21.50 H new ATOM 0 HG22 VAL A 161 15.711 -10.260 -11.364 1.00 21.50 H new ATOM 0 HG23 VAL A 161 14.782 -8.752 -11.187 1.00 21.50 H new ATOM 718 N ALA A 162 16.117 -6.162 -11.111 1.00 2.12 N ATOM 719 CA ALA A 162 15.435 -5.248 -10.203 1.00 44.31 C ATOM 720 C ALA A 162 13.931 -5.248 -10.451 1.00 72.22 C ATOM 721 O ALA A 162 13.452 -4.660 -11.420 1.00 51.02 O ATOM 722 CB ALA A 162 15.996 -3.841 -10.351 1.00 62.01 C ATOM 0 H ALA A 162 16.081 -5.887 -12.093 1.00 2.12 H new ATOM 0 HA ALA A 162 15.609 -5.592 -9.183 1.00 44.31 H new ATOM 0 HB1 ALA A 162 15.478 -3.169 -9.667 1.00 62.01 H new ATOM 0 HB2 ALA A 162 17.060 -3.847 -10.116 1.00 62.01 H new ATOM 0 HB3 ALA A 162 15.852 -3.498 -11.376 1.00 62.01 H new ATOM 728 N ALA A 163 13.191 -5.913 -9.570 1.00 14.42 N ATOM 729 CA ALA A 163 11.740 -5.988 -9.693 1.00 62.31 C ATOM 730 C ALA A 163 11.082 -6.164 -8.329 1.00 12.31 C ATOM 731 O ALA A 163 11.747 -6.100 -7.295 1.00 44.23 O ATOM 732 CB ALA A 163 11.348 -7.129 -10.621 1.00 41.40 C ATOM 0 H ALA A 163 13.572 -6.408 -8.763 1.00 14.42 H new ATOM 0 HA ALA A 163 11.387 -5.049 -10.119 1.00 62.31 H new ATOM 0 HB1 ALA A 163 10.262 -7.174 -10.704 1.00 41.40 H new ATOM 0 HB2 ALA A 163 11.781 -6.961 -11.607 1.00 41.40 H new ATOM 0 HB3 ALA A 163 11.720 -8.071 -10.217 1.00 41.40 H new ATOM 738 N TRP A 164 9.772 -6.384 -8.333 1.00 42.15 N ATOM 739 CA TRP A 164 9.024 -6.568 -7.095 1.00 51.31 C ATOM 740 C TRP A 164 9.231 -7.971 -6.537 1.00 60.41 C ATOM 741 O TRP A 164 8.678 -8.943 -7.053 1.00 33.13 O ATOM 742 CB TRP A 164 7.534 -6.315 -7.333 1.00 3.31 C ATOM 743 CG TRP A 164 6.859 -5.622 -6.188 1.00 43.41 C ATOM 744 CD1 TRP A 164 6.298 -6.209 -5.091 1.00 34.04 C ATOM 745 CD2 TRP A 164 6.674 -4.211 -6.030 1.00 11.24 C ATOM 746 NE1 TRP A 164 5.774 -5.248 -4.259 1.00 61.24 N ATOM 747 CE2 TRP A 164 5.993 -4.014 -4.812 1.00 72.33 C ATOM 748 CE3 TRP A 164 7.019 -3.094 -6.796 1.00 72.41 C ATOM 749 CZ2 TRP A 164 5.650 -2.747 -4.347 1.00 63.35 C ATOM 750 CZ3 TRP A 164 6.678 -1.838 -6.334 1.00 11.35 C ATOM 751 CH2 TRP A 164 6.000 -1.672 -5.118 1.00 61.23 C ATOM 0 H TRP A 164 9.206 -6.439 -9.180 1.00 42.15 H new ATOM 0 HA TRP A 164 9.396 -5.849 -6.365 1.00 51.31 H new ATOM 0 HB2 TRP A 164 7.414 -5.713 -8.234 1.00 3.31 H new ATOM 0 HB3 TRP A 164 7.036 -7.267 -7.517 1.00 3.31 H new ATOM 0 HD1 TRP A 164 6.270 -7.272 -4.904 1.00 34.04 H new ATOM 0 HE1 TRP A 164 5.299 -5.425 -3.374 1.00 61.24 H new ATOM 0 HE3 TRP A 164 7.543 -3.211 -7.733 1.00 72.41 H new ATOM 0 HZ2 TRP A 164 5.126 -2.617 -3.411 1.00 63.35 H new ATOM 0 HZ3 TRP A 164 6.938 -0.969 -6.920 1.00 11.35 H new ATOM 0 HH2 TRP A 164 5.749 -0.676 -4.783 1.00 61.23 H new ATOM 762 N CYS A 165 10.031 -8.071 -5.481 1.00 32.54 N ATOM 763 CA CYS A 165 10.311 -9.357 -4.852 1.00 43.33 C ATOM 764 C CYS A 165 9.722 -9.415 -3.446 1.00 54.01 C ATOM 765 O CYS A 165 9.420 -8.393 -2.830 1.00 1.14 O ATOM 766 CB CYS A 165 11.821 -9.601 -4.795 1.00 35.32 C ATOM 767 SG CYS A 165 12.433 -10.769 -6.052 1.00 0.30 S ATOM 0 H CYS A 165 10.497 -7.277 -5.042 1.00 32.54 H new ATOM 0 HA CYS A 165 9.845 -10.137 -5.454 1.00 43.33 H new ATOM 0 HB2 CYS A 165 12.337 -8.649 -4.917 1.00 35.32 H new ATOM 0 HB3 CYS A 165 12.080 -9.979 -3.806 1.00 35.32 H new ATOM 772 N PRO A 166 9.553 -10.640 -2.926 1.00 11.33 N ATOM 773 CA PRO A 166 8.999 -10.861 -1.587 1.00 21.34 C ATOM 774 C PRO A 166 9.954 -10.417 -0.484 1.00 33.24 C ATOM 775 O PRO A 166 9.543 -10.200 0.657 1.00 62.35 O ATOM 776 CB PRO A 166 8.791 -12.377 -1.535 1.00 52.14 C ATOM 777 CG PRO A 166 9.773 -12.928 -2.510 1.00 44.54 C ATOM 778 CD PRO A 166 9.890 -11.902 -3.604 1.00 64.32 C ATOM 0 HA PRO A 166 8.088 -10.286 -1.423 1.00 21.34 H new ATOM 0 HB2 PRO A 166 8.967 -12.767 -0.532 1.00 52.14 H new ATOM 0 HB3 PRO A 166 7.770 -12.646 -1.806 1.00 52.14 H new ATOM 0 HG2 PRO A 166 10.738 -13.104 -2.035 1.00 44.54 H new ATOM 0 HG3 PRO A 166 9.434 -13.885 -2.907 1.00 44.54 H new ATOM 0 HD2 PRO A 166 10.895 -11.876 -4.025 1.00 64.32 H new ATOM 0 HD3 PRO A 166 9.206 -12.112 -4.426 1.00 64.32 H new ATOM 786 N VAL A 167 11.230 -10.283 -0.830 1.00 70.14 N ATOM 787 CA VAL A 167 12.243 -9.863 0.130 1.00 21.03 C ATOM 788 C VAL A 167 12.470 -8.357 0.067 1.00 54.21 C ATOM 789 O VAL A 167 12.899 -7.826 -0.957 1.00 41.22 O ATOM 790 CB VAL A 167 13.582 -10.583 -0.115 1.00 63.23 C ATOM 791 CG1 VAL A 167 14.602 -10.189 0.942 1.00 24.31 C ATOM 792 CG2 VAL A 167 13.380 -12.091 -0.137 1.00 52.20 C ATOM 0 H VAL A 167 11.587 -10.459 -1.769 1.00 70.14 H new ATOM 0 HA VAL A 167 11.871 -10.130 1.119 1.00 21.03 H new ATOM 0 HB VAL A 167 13.966 -10.277 -1.088 1.00 63.23 H new ATOM 0 HG11 VAL A 167 15.542 -10.708 0.752 1.00 24.31 H new ATOM 0 HG12 VAL A 167 14.768 -9.112 0.904 1.00 24.31 H new ATOM 0 HG13 VAL A 167 14.229 -10.464 1.928 1.00 24.31 H new ATOM 0 HG21 VAL A 167 14.337 -12.584 -0.311 1.00 52.20 H new ATOM 0 HG22 VAL A 167 12.973 -12.418 0.820 1.00 52.20 H new ATOM 0 HG23 VAL A 167 12.686 -12.354 -0.935 1.00 52.20 H new TER 802 VAL A 167