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 Single : A 110 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 111 GLN : amide:sc= 0 X(o=0,f=-0.2) USER MOD Single : A 112 THR OG1 : rot 180:sc= 0 USER MOD Single : A 113 GLN : amide:sc= -0.881 X(o=-0.88,f=-0.71) USER MOD Single : A 114 SER OG : rot 180:sc= -0.147 USER MOD Single : A 115 THR OG1 : rot -172:sc= 0.288 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= -0.0514 X(o=-0.051,f=0) USER MOD Single : A 128 SER OG : rot 180:sc= -0.518 USER MOD Single : A 133 THR OG1 : rot 180:sc= 0 USER MOD Single : A 136 SER OG : rot -18:sc= 0.631 USER MOD Single : A 139 THR OG1 : rot 180:sc= 0 USER MOD Single : A 140 HIS : no HD1:sc= 0 X(o=0,f=-0.01) USER MOD Single : A 141 SER OG : rot 180:sc= 0 USER MOD Single : A 142 SER OG : rot -44:sc= 0.998 USER MOD Single : A 146 THR OG1 : rot -129:sc= -1.07 USER MOD Single : A 153 ASN : amide:sc= -0.583 K(o=-0.58,f=-2.1!) USER MOD Single : A 155 SER OG : rot 180:sc= 0 USER MOD Single : A 157 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.0702) USER MOD Single : A 158 THR OG1 : rot 166:sc= -0.611 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 110 2.121 1.787 -0.090 1.00 1.45 N ATOM 2 CA MET A 110 2.949 1.925 -1.282 1.00 51.51 C ATOM 3 C MET A 110 4.049 0.869 -1.306 1.00 31.04 C ATOM 4 O MET A 110 4.404 0.307 -0.270 1.00 14.33 O ATOM 5 CB MET A 110 3.567 3.324 -1.341 1.00 22.33 C ATOM 6 CG MET A 110 4.480 3.634 -0.165 1.00 53.33 C ATOM 7 SD MET A 110 3.600 4.385 1.218 1.00 75.21 S ATOM 8 CE MET A 110 4.949 4.681 2.358 1.00 62.44 C ATOM 0 HA MET A 110 2.312 1.780 -2.155 1.00 51.51 H new ATOM 0 HB2 MET A 110 4.134 3.423 -2.267 1.00 22.33 H new ATOM 0 HB3 MET A 110 2.768 4.064 -1.375 1.00 22.33 H new ATOM 0 HG2 MET A 110 4.959 2.714 0.171 1.00 53.33 H new ATOM 0 HG3 MET A 110 5.274 4.305 -0.493 1.00 53.33 H new ATOM 0 HE1 MET A 110 4.563 5.144 3.266 1.00 62.44 H new ATOM 0 HE2 MET A 110 5.428 3.734 2.609 1.00 62.44 H new ATOM 0 HE3 MET A 110 5.678 5.345 1.894 1.00 62.44 H new ATOM 18 N GLN A 111 4.584 0.604 -2.493 1.00 54.03 N ATOM 19 CA GLN A 111 5.642 -0.386 -2.650 1.00 64.11 C ATOM 20 C GLN A 111 6.688 0.090 -3.653 1.00 23.41 C ATOM 21 O GLN A 111 6.442 1.009 -4.435 1.00 23.31 O ATOM 22 CB GLN A 111 5.055 -1.724 -3.103 1.00 65.02 C ATOM 23 CG GLN A 111 5.962 -2.912 -2.824 1.00 10.12 C ATOM 24 CD GLN A 111 5.204 -4.223 -2.765 1.00 71.42 C ATOM 25 OE1 GLN A 111 4.211 -4.412 -3.469 1.00 11.24 O ATOM 26 NE2 GLN A 111 5.669 -5.139 -1.924 1.00 21.33 N ATOM 0 H GLN A 111 4.302 1.061 -3.360 1.00 54.03 H new ATOM 0 HA GLN A 111 6.127 -0.519 -1.683 1.00 64.11 H new ATOM 0 HB2 GLN A 111 4.100 -1.881 -2.601 1.00 65.02 H new ATOM 0 HB3 GLN A 111 4.849 -1.678 -4.172 1.00 65.02 H new ATOM 0 HG2 GLN A 111 6.725 -2.972 -3.600 1.00 10.12 H new ATOM 0 HG3 GLN A 111 6.481 -2.754 -1.879 1.00 10.12 H new ATOM 0 HE21 GLN A 111 6.495 -4.941 -1.359 1.00 21.33 H new ATOM 0 HE22 GLN A 111 5.200 -6.041 -1.842 1.00 21.33 H new ATOM 35 N THR A 112 7.858 -0.542 -3.625 1.00 50.13 N ATOM 36 CA THR A 112 8.942 -0.182 -4.530 1.00 62.54 C ATOM 37 C THR A 112 9.654 -1.424 -5.055 1.00 44.25 C ATOM 38 O THR A 112 9.683 -2.460 -4.392 1.00 64.14 O ATOM 39 CB THR A 112 9.971 0.732 -3.839 1.00 41.14 C ATOM 40 OG1 THR A 112 9.302 1.653 -2.970 1.00 23.41 O ATOM 41 CG2 THR A 112 10.789 1.500 -4.867 1.00 13.10 C ATOM 0 H THR A 112 8.078 -1.305 -2.985 1.00 50.13 H new ATOM 0 HA THR A 112 8.492 0.356 -5.364 1.00 62.54 H new ATOM 0 HB THR A 112 10.646 0.106 -3.255 1.00 41.14 H new ATOM 0 HG1 THR A 112 9.963 2.230 -2.533 1.00 23.41 H new ATOM 0 HG21 THR A 112 11.509 2.139 -4.355 1.00 13.10 H new ATOM 0 HG22 THR A 112 11.320 0.797 -5.509 1.00 13.10 H new ATOM 0 HG23 THR A 112 10.125 2.115 -5.474 1.00 13.10 H new ATOM 49 N GLN A 113 10.228 -1.311 -6.249 1.00 40.11 N ATOM 50 CA GLN A 113 10.941 -2.426 -6.862 1.00 55.42 C ATOM 51 C GLN A 113 12.252 -2.701 -6.133 1.00 54.42 C ATOM 52 O GLN A 113 12.938 -1.775 -5.700 1.00 64.42 O ATOM 53 CB GLN A 113 11.216 -2.133 -8.338 1.00 53.51 C ATOM 54 CG GLN A 113 11.909 -0.801 -8.575 1.00 0.41 C ATOM 55 CD GLN A 113 10.943 0.298 -8.973 1.00 32.31 C ATOM 56 OE1 GLN A 113 10.895 1.356 -8.345 1.00 43.14 O ATOM 57 NE2 GLN A 113 10.166 0.052 -10.021 1.00 75.41 N ATOM 0 H GLN A 113 10.213 -0.460 -6.810 1.00 40.11 H new ATOM 0 HA GLN A 113 10.312 -3.313 -6.786 1.00 55.42 H new ATOM 0 HB2 GLN A 113 11.832 -2.932 -8.750 1.00 53.51 H new ATOM 0 HB3 GLN A 113 10.273 -2.145 -8.884 1.00 53.51 H new ATOM 0 HG2 GLN A 113 12.437 -0.504 -7.669 1.00 0.41 H new ATOM 0 HG3 GLN A 113 12.659 -0.920 -9.357 1.00 0.41 H new ATOM 0 HE21 GLN A 113 10.239 -0.839 -10.512 1.00 75.41 H new ATOM 0 HE22 GLN A 113 9.496 0.754 -10.335 1.00 75.41 H new ATOM 66 N SER A 114 12.592 -3.979 -6.001 1.00 5.53 N ATOM 67 CA SER A 114 13.819 -4.376 -5.320 1.00 45.31 C ATOM 68 C SER A 114 14.741 -5.142 -6.264 1.00 73.23 C ATOM 69 O SER A 114 14.363 -5.472 -7.389 1.00 54.41 O ATOM 70 CB SER A 114 13.494 -5.236 -4.097 1.00 50.43 C ATOM 71 OG SER A 114 14.666 -5.539 -3.361 1.00 11.04 O ATOM 0 H SER A 114 12.036 -4.757 -6.356 1.00 5.53 H new ATOM 0 HA SER A 114 14.332 -3.472 -4.993 1.00 45.31 H new ATOM 0 HB2 SER A 114 12.785 -4.711 -3.457 1.00 50.43 H new ATOM 0 HB3 SER A 114 13.012 -6.160 -4.416 1.00 50.43 H new ATOM 0 HG SER A 114 14.431 -6.088 -2.584 1.00 11.04 H new ATOM 77 N THR A 115 15.954 -5.423 -5.799 1.00 32.54 N ATOM 78 CA THR A 115 16.931 -6.150 -6.600 1.00 53.31 C ATOM 79 C THR A 115 17.044 -7.601 -6.147 1.00 4.44 C ATOM 80 O THR A 115 16.995 -7.894 -4.952 1.00 23.03 O ATOM 81 CB THR A 115 18.321 -5.490 -6.525 1.00 54.13 C ATOM 82 OG1 THR A 115 19.205 -6.102 -7.470 1.00 62.51 O ATOM 83 CG2 THR A 115 18.903 -5.612 -5.125 1.00 53.41 C ATOM 0 H THR A 115 16.284 -5.158 -4.871 1.00 32.54 H new ATOM 0 HA THR A 115 16.578 -6.121 -7.631 1.00 53.31 H new ATOM 0 HB THR A 115 18.210 -4.432 -6.764 1.00 54.13 H new ATOM 0 HG1 THR A 115 20.115 -5.765 -7.332 1.00 62.51 H new ATOM 0 HG21 THR A 115 19.885 -5.139 -5.097 1.00 53.41 H new ATOM 0 HG22 THR A 115 18.242 -5.119 -4.412 1.00 53.41 H new ATOM 0 HG23 THR A 115 19.000 -6.665 -4.862 1.00 53.41 H new ATOM 91 N CYS A 116 17.197 -8.506 -7.107 1.00 43.45 N ATOM 92 CA CYS A 116 17.318 -9.927 -6.807 1.00 65.15 C ATOM 93 C CYS A 116 17.551 -10.734 -8.082 1.00 22.04 C ATOM 94 O CYS A 116 17.201 -10.314 -9.185 1.00 5.02 O ATOM 95 CB CYS A 116 16.060 -10.429 -6.096 1.00 4.43 C ATOM 96 SG CYS A 116 14.503 -9.896 -6.876 1.00 34.22 S ATOM 0 H CYS A 116 17.240 -8.280 -8.101 1.00 43.45 H new ATOM 0 HA CYS A 116 18.177 -10.062 -6.150 1.00 65.15 H new ATOM 0 HB2 CYS A 116 16.084 -11.518 -6.064 1.00 4.43 H new ATOM 0 HB3 CYS A 116 16.075 -10.080 -5.064 1.00 4.43 H new ATOM 101 N PRO A 117 18.156 -11.921 -7.928 1.00 32.43 N ATOM 102 CA PRO A 117 18.448 -12.813 -9.054 1.00 42.21 C ATOM 103 C PRO A 117 17.186 -13.423 -9.653 1.00 73.03 C ATOM 104 O PRO A 117 16.274 -13.821 -8.929 1.00 2.32 O ATOM 105 CB PRO A 117 19.323 -13.901 -8.427 1.00 72.43 C ATOM 106 CG PRO A 117 18.945 -13.908 -6.986 1.00 74.13 C ATOM 107 CD PRO A 117 18.600 -12.485 -6.642 1.00 60.50 C ATOM 0 HA PRO A 117 18.927 -12.285 -9.879 1.00 42.21 H new ATOM 0 HB2 PRO A 117 19.140 -14.871 -8.889 1.00 72.43 H new ATOM 0 HB3 PRO A 117 20.383 -13.681 -8.557 1.00 72.43 H new ATOM 0 HG2 PRO A 117 18.097 -14.569 -6.808 1.00 74.13 H new ATOM 0 HG3 PRO A 117 19.767 -14.271 -6.369 1.00 74.13 H new ATOM 0 HD2 PRO A 117 17.815 -12.433 -5.888 1.00 60.50 H new ATOM 0 HD3 PRO A 117 19.461 -11.948 -6.243 1.00 60.50 H new ATOM 115 N GLU A 118 17.140 -13.494 -10.980 1.00 43.11 N ATOM 116 CA GLU A 118 15.988 -14.056 -11.675 1.00 44.13 C ATOM 117 C GLU A 118 15.700 -15.475 -11.192 1.00 44.45 C ATOM 118 O GLU A 118 16.427 -16.018 -10.360 1.00 44.32 O ATOM 119 CB GLU A 118 16.228 -14.059 -13.187 1.00 2.35 C ATOM 120 CG GLU A 118 15.260 -13.177 -13.958 1.00 64.30 C ATOM 121 CD GLU A 118 13.814 -13.429 -13.580 1.00 73.20 C ATOM 122 OE1 GLU A 118 13.223 -14.394 -14.108 1.00 73.43 O ATOM 123 OE2 GLU A 118 13.273 -12.662 -12.757 1.00 13.11 O ATOM 0 H GLU A 118 17.887 -13.170 -11.595 1.00 43.11 H new ATOM 0 HA GLU A 118 15.122 -13.432 -11.453 1.00 44.13 H new ATOM 0 HB2 GLU A 118 17.247 -13.726 -13.385 1.00 2.35 H new ATOM 0 HB3 GLU A 118 16.149 -15.081 -13.557 1.00 2.35 H new ATOM 0 HG2 GLU A 118 15.503 -12.130 -13.774 1.00 64.30 H new ATOM 0 HG3 GLU A 118 15.388 -13.351 -15.026 1.00 64.30 H new ATOM 130 N ILE A 119 14.635 -16.068 -11.720 1.00 41.12 N ATOM 131 CA ILE A 119 14.251 -17.423 -11.344 1.00 1.32 C ATOM 132 C ILE A 119 14.817 -18.446 -12.322 1.00 61.42 C ATOM 133 O ILE A 119 14.722 -18.296 -13.540 1.00 63.05 O ATOM 134 CB ILE A 119 12.720 -17.578 -11.285 1.00 11.05 C ATOM 135 CG1 ILE A 119 12.119 -16.554 -10.320 1.00 54.52 C ATOM 136 CG2 ILE A 119 12.347 -18.992 -10.864 1.00 52.33 C ATOM 137 CD1 ILE A 119 12.557 -16.745 -8.885 1.00 51.41 C ATOM 0 H ILE A 119 14.023 -15.632 -12.409 1.00 41.12 H new ATOM 0 HA ILE A 119 14.665 -17.605 -10.352 1.00 1.32 H new ATOM 0 HB ILE A 119 12.312 -17.396 -12.279 1.00 11.05 H new ATOM 0 HG12 ILE A 119 12.398 -15.552 -10.646 1.00 54.52 H new ATOM 0 HG13 ILE A 119 11.032 -16.614 -10.370 1.00 54.52 H new ATOM 0 HG21 ILE A 119 11.262 -19.086 -10.827 1.00 52.33 H new ATOM 0 HG22 ILE A 119 12.749 -19.704 -11.585 1.00 52.33 H new ATOM 0 HG23 ILE A 119 12.763 -19.200 -9.878 1.00 52.33 H new ATOM 0 HD11 ILE A 119 12.092 -15.984 -8.258 1.00 51.41 H new ATOM 0 HD12 ILE A 119 12.254 -17.734 -8.541 1.00 51.41 H new ATOM 0 HD13 ILE A 119 13.641 -16.655 -8.821 1.00 51.41 H new ATOM 149 N PRO A 120 15.419 -19.515 -11.778 1.00 41.45 N ATOM 150 CA PRO A 120 16.010 -20.586 -12.585 1.00 63.15 C ATOM 151 C PRO A 120 14.955 -21.422 -13.301 1.00 61.51 C ATOM 152 O PRO A 120 14.120 -22.063 -12.663 1.00 74.30 O ATOM 153 CB PRO A 120 16.757 -21.436 -11.554 1.00 42.23 C ATOM 154 CG PRO A 120 16.047 -21.183 -10.269 1.00 42.23 C ATOM 155 CD PRO A 120 15.568 -19.759 -10.334 1.00 44.10 C ATOM 0 HA PRO A 120 16.648 -20.195 -13.377 1.00 63.15 H new ATOM 0 HB2 PRO A 120 16.731 -22.493 -11.819 1.00 42.23 H new ATOM 0 HB3 PRO A 120 17.807 -21.149 -11.490 1.00 42.23 H new ATOM 0 HG2 PRO A 120 15.211 -21.871 -10.143 1.00 42.23 H new ATOM 0 HG3 PRO A 120 16.713 -21.332 -9.419 1.00 42.23 H new ATOM 0 HD2 PRO A 120 14.624 -19.628 -9.805 1.00 44.10 H new ATOM 0 HD3 PRO A 120 16.285 -19.073 -9.882 1.00 44.10 H new ATOM 163 N ASP A 121 14.999 -21.412 -14.629 1.00 22.13 N ATOM 164 CA ASP A 121 14.047 -22.171 -15.431 1.00 64.53 C ATOM 165 C ASP A 121 14.758 -22.918 -16.555 1.00 65.35 C ATOM 166 O ASP A 121 15.942 -22.696 -16.812 1.00 21.12 O ATOM 167 CB ASP A 121 12.983 -21.241 -16.014 1.00 74.01 C ATOM 168 CG ASP A 121 11.896 -20.905 -15.012 1.00 3.54 C ATOM 169 OD1 ASP A 121 11.634 -21.738 -14.120 1.00 33.02 O ATOM 170 OD2 ASP A 121 11.308 -19.808 -15.119 1.00 50.12 O ATOM 0 H ASP A 121 15.684 -20.887 -15.172 1.00 22.13 H new ATOM 0 HA ASP A 121 13.564 -22.901 -14.782 1.00 64.53 H new ATOM 0 HB2 ASP A 121 13.457 -20.320 -16.354 1.00 74.01 H new ATOM 0 HB3 ASP A 121 12.534 -21.711 -16.889 1.00 74.01 H new ATOM 175 N LYS A 122 14.029 -23.806 -17.223 1.00 41.21 N ATOM 176 CA LYS A 122 14.589 -24.586 -18.320 1.00 74.43 C ATOM 177 C LYS A 122 14.600 -23.777 -19.613 1.00 61.12 C ATOM 178 O LYS A 122 15.138 -24.218 -20.629 1.00 42.25 O ATOM 179 CB LYS A 122 13.785 -25.874 -18.519 1.00 43.30 C ATOM 180 CG LYS A 122 14.153 -26.977 -17.542 1.00 15.24 C ATOM 181 CD LYS A 122 13.880 -28.353 -18.125 1.00 53.25 C ATOM 182 CE LYS A 122 12.487 -28.846 -17.764 1.00 11.42 C ATOM 183 NZ LYS A 122 11.478 -28.460 -18.790 1.00 25.33 N ATOM 0 H LYS A 122 13.048 -24.003 -17.023 1.00 41.21 H new ATOM 0 HA LYS A 122 15.617 -24.842 -18.063 1.00 74.43 H new ATOM 0 HB2 LYS A 122 12.723 -25.649 -18.417 1.00 43.30 H new ATOM 0 HB3 LYS A 122 13.938 -26.235 -19.536 1.00 43.30 H new ATOM 0 HG2 LYS A 122 15.208 -26.895 -17.280 1.00 15.24 H new ATOM 0 HG3 LYS A 122 13.585 -26.852 -16.620 1.00 15.24 H new ATOM 0 HD2 LYS A 122 13.984 -28.317 -19.209 1.00 53.25 H new ATOM 0 HD3 LYS A 122 14.624 -29.059 -17.756 1.00 53.25 H new ATOM 0 HE2 LYS A 122 12.502 -29.931 -17.659 1.00 11.42 H new ATOM 0 HE3 LYS A 122 12.196 -28.436 -16.797 1.00 11.42 H new ATOM 0 HZ1 LYS A 122 10.542 -28.815 -18.507 1.00 25.33 H new ATOM 0 HZ2 LYS A 122 11.445 -27.424 -18.872 1.00 25.33 H new ATOM 0 HZ3 LYS A 122 11.741 -28.872 -19.708 1.00 25.33 H new ATOM 197 N THR A 123 14.004 -22.590 -19.568 1.00 51.42 N ATOM 198 CA THR A 123 13.946 -21.719 -20.735 1.00 50.24 C ATOM 199 C THR A 123 14.721 -20.428 -20.497 1.00 53.32 C ATOM 200 O THR A 123 15.189 -19.791 -21.441 1.00 5.15 O ATOM 201 CB THR A 123 12.492 -21.371 -21.105 1.00 13.30 C ATOM 202 OG1 THR A 123 12.472 -20.437 -22.190 1.00 41.32 O ATOM 203 CG2 THR A 123 11.756 -20.783 -19.910 1.00 75.33 C ATOM 0 H THR A 123 13.554 -22.210 -18.735 1.00 51.42 H new ATOM 0 HA THR A 123 14.402 -22.266 -21.560 1.00 50.24 H new ATOM 0 HB THR A 123 11.988 -22.289 -21.407 1.00 13.30 H new ATOM 0 HG1 THR A 123 11.544 -20.222 -22.420 1.00 41.32 H new ATOM 0 HG21 THR A 123 10.731 -20.545 -20.195 1.00 75.33 H new ATOM 0 HG22 THR A 123 11.747 -21.507 -19.096 1.00 75.33 H new ATOM 0 HG23 THR A 123 12.262 -19.875 -19.582 1.00 75.33 H new ATOM 211 N SER A 124 14.852 -20.047 -19.230 1.00 62.05 N ATOM 212 CA SER A 124 15.568 -18.829 -18.869 1.00 21.33 C ATOM 213 C SER A 124 16.836 -19.157 -18.086 1.00 1.20 C ATOM 214 O SER A 124 16.773 -19.615 -16.945 1.00 21.22 O ATOM 215 CB SER A 124 14.668 -17.910 -18.041 1.00 53.23 C ATOM 216 OG SER A 124 13.462 -17.623 -18.729 1.00 22.12 O ATOM 0 H SER A 124 14.472 -20.564 -18.437 1.00 62.05 H new ATOM 0 HA SER A 124 15.851 -18.317 -19.789 1.00 21.33 H new ATOM 0 HB2 SER A 124 14.442 -18.382 -17.085 1.00 53.23 H new ATOM 0 HB3 SER A 124 15.195 -16.981 -17.821 1.00 53.23 H new ATOM 0 HG SER A 124 12.903 -17.035 -18.179 1.00 22.12 H new ATOM 222 N ILE A 125 17.986 -18.918 -18.708 1.00 32.40 N ATOM 223 CA ILE A 125 19.269 -19.187 -18.070 1.00 53.42 C ATOM 224 C ILE A 125 20.139 -17.935 -18.038 1.00 11.23 C ATOM 225 O ILE A 125 19.912 -16.988 -18.792 1.00 24.02 O ATOM 226 CB ILE A 125 20.033 -20.311 -18.794 1.00 1.10 C ATOM 227 CG1 ILE A 125 19.054 -21.249 -19.503 1.00 13.14 C ATOM 228 CG2 ILE A 125 20.896 -21.084 -17.808 1.00 64.03 C ATOM 229 CD1 ILE A 125 18.088 -21.936 -18.563 1.00 12.11 C ATOM 0 H ILE A 125 18.055 -18.539 -19.652 1.00 32.40 H new ATOM 0 HA ILE A 125 19.054 -19.504 -17.050 1.00 53.42 H new ATOM 0 HB ILE A 125 20.685 -19.863 -19.544 1.00 1.10 H new ATOM 0 HG12 ILE A 125 18.488 -20.680 -20.241 1.00 13.14 H new ATOM 0 HG13 ILE A 125 19.618 -22.006 -20.048 1.00 13.14 H new ATOM 0 HG21 ILE A 125 21.430 -21.875 -18.334 1.00 64.03 H new ATOM 0 HG22 ILE A 125 21.614 -20.407 -17.345 1.00 64.03 H new ATOM 0 HG23 ILE A 125 20.263 -21.524 -17.037 1.00 64.03 H new ATOM 0 HD11 ILE A 125 17.424 -22.585 -19.134 1.00 12.11 H new ATOM 0 HD12 ILE A 125 18.645 -22.532 -17.840 1.00 12.11 H new ATOM 0 HD13 ILE A 125 17.498 -21.186 -18.036 1.00 12.11 H new ATOM 241 N CYS A 126 21.137 -17.937 -17.160 1.00 71.34 N ATOM 242 CA CYS A 126 22.043 -16.803 -17.029 1.00 65.15 C ATOM 243 C CYS A 126 23.423 -17.143 -17.586 1.00 4.45 C ATOM 244 O CYS A 126 23.885 -18.278 -17.478 1.00 0.22 O ATOM 245 CB CYS A 126 22.161 -16.384 -15.563 1.00 25.54 C ATOM 246 SG CYS A 126 23.425 -15.110 -15.253 1.00 4.34 S ATOM 0 H CYS A 126 21.338 -18.712 -16.528 1.00 71.34 H new ATOM 0 HA CYS A 126 21.633 -15.973 -17.604 1.00 65.15 H new ATOM 0 HB2 CYS A 126 21.194 -16.012 -15.224 1.00 25.54 H new ATOM 0 HB3 CYS A 126 22.392 -17.264 -14.962 1.00 25.54 H new ATOM 251 N ASN A 127 24.076 -16.149 -18.180 1.00 63.43 N ATOM 252 CA ASN A 127 25.403 -16.342 -18.754 1.00 23.43 C ATOM 253 C ASN A 127 26.485 -15.834 -17.805 1.00 51.03 C ATOM 254 O ASN A 127 26.188 -15.329 -16.723 1.00 23.25 O ATOM 255 CB ASN A 127 25.510 -15.622 -20.100 1.00 32.45 C ATOM 256 CG ASN A 127 24.209 -15.657 -20.878 1.00 71.12 C ATOM 257 OD1 ASN A 127 23.959 -16.584 -21.649 1.00 54.43 O ATOM 258 ND2 ASN A 127 23.373 -14.644 -20.679 1.00 65.25 N ATOM 0 H ASN A 127 23.708 -15.203 -18.276 1.00 63.43 H new ATOM 0 HA ASN A 127 25.552 -17.411 -18.909 1.00 23.43 H new ATOM 0 HB2 ASN A 127 25.802 -14.585 -19.932 1.00 32.45 H new ATOM 0 HB3 ASN A 127 26.298 -16.084 -20.694 1.00 32.45 H new ATOM 0 HD21 ASN A 127 22.482 -14.613 -21.175 1.00 65.25 H new ATOM 0 HD22 ASN A 127 23.622 -13.897 -20.030 1.00 65.25 H new ATOM 265 N SER A 128 27.740 -15.970 -18.221 1.00 22.44 N ATOM 266 CA SER A 128 28.867 -15.528 -17.407 1.00 52.02 C ATOM 267 C SER A 128 28.796 -14.025 -17.152 1.00 72.44 C ATOM 268 O SER A 128 28.047 -13.307 -17.815 1.00 10.12 O ATOM 269 CB SER A 128 30.188 -15.878 -18.094 1.00 71.44 C ATOM 270 OG SER A 128 30.297 -15.230 -19.350 1.00 62.50 O ATOM 0 H SER A 128 28.002 -16.382 -19.116 1.00 22.44 H new ATOM 0 HA SER A 128 28.816 -16.045 -16.449 1.00 52.02 H new ATOM 0 HB2 SER A 128 31.022 -15.585 -17.456 1.00 71.44 H new ATOM 0 HB3 SER A 128 30.256 -16.957 -18.231 1.00 71.44 H new ATOM 0 HG SER A 128 31.151 -15.469 -19.768 1.00 62.50 H new ATOM 276 N ASP A 129 29.581 -13.558 -16.188 1.00 14.21 N ATOM 277 CA ASP A 129 29.609 -12.141 -15.845 1.00 12.32 C ATOM 278 C ASP A 129 29.837 -11.285 -17.087 1.00 63.31 C ATOM 279 O ASP A 129 29.297 -10.186 -17.204 1.00 11.25 O ATOM 280 CB ASP A 129 30.703 -11.866 -14.813 1.00 4.34 C ATOM 281 CG ASP A 129 30.611 -10.470 -14.229 1.00 11.25 C ATOM 282 OD1 ASP A 129 31.051 -9.514 -14.902 1.00 34.11 O ATOM 283 OD2 ASP A 129 30.098 -10.333 -13.098 1.00 50.24 O ATOM 0 H ASP A 129 30.206 -14.140 -15.630 1.00 14.21 H new ATOM 0 HA ASP A 129 28.642 -11.877 -15.417 1.00 12.32 H new ATOM 0 HB2 ASP A 129 30.632 -12.598 -14.009 1.00 4.34 H new ATOM 0 HB3 ASP A 129 31.679 -11.998 -15.279 1.00 4.34 H new ATOM 288 N ALA A 130 30.642 -11.797 -18.012 1.00 63.52 N ATOM 289 CA ALA A 130 30.942 -11.081 -19.246 1.00 34.12 C ATOM 290 C ALA A 130 29.891 -11.365 -20.314 1.00 40.11 C ATOM 291 O ALA A 130 29.728 -10.593 -21.259 1.00 4.40 O ATOM 292 CB ALA A 130 32.326 -11.457 -19.752 1.00 4.03 C ATOM 0 H ALA A 130 31.098 -12.706 -17.930 1.00 63.52 H new ATOM 0 HA ALA A 130 30.925 -10.013 -19.030 1.00 34.12 H new ATOM 0 HB1 ALA A 130 32.536 -10.915 -20.674 1.00 4.03 H new ATOM 0 HB2 ALA A 130 33.071 -11.197 -19.000 1.00 4.03 H new ATOM 0 HB3 ALA A 130 32.364 -12.529 -19.945 1.00 4.03 H new ATOM 298 N ASP A 131 29.181 -12.477 -20.158 1.00 43.04 N ATOM 299 CA ASP A 131 28.146 -12.863 -21.110 1.00 14.41 C ATOM 300 C ASP A 131 26.771 -12.406 -20.632 1.00 11.33 C ATOM 301 O ASP A 131 25.752 -12.720 -21.247 1.00 53.31 O ATOM 302 CB ASP A 131 28.150 -14.378 -21.315 1.00 22.21 C ATOM 303 CG ASP A 131 29.318 -14.844 -22.162 1.00 71.32 C ATOM 304 OD1 ASP A 131 30.107 -13.986 -22.609 1.00 3.41 O ATOM 305 OD2 ASP A 131 29.443 -16.068 -22.378 1.00 12.31 O ATOM 0 H ASP A 131 29.303 -13.127 -19.381 1.00 43.04 H new ATOM 0 HA ASP A 131 28.362 -12.375 -22.061 1.00 14.41 H new ATOM 0 HB2 ASP A 131 28.188 -14.873 -20.345 1.00 22.21 H new ATOM 0 HB3 ASP A 131 27.217 -14.680 -21.790 1.00 22.21 H new ATOM 310 N CYS A 132 26.750 -11.663 -19.530 1.00 21.32 N ATOM 311 CA CYS A 132 25.501 -11.164 -18.967 1.00 63.01 C ATOM 312 C CYS A 132 25.482 -9.638 -18.955 1.00 73.22 C ATOM 313 O CYS A 132 26.409 -8.997 -18.459 1.00 61.42 O ATOM 314 CB CYS A 132 25.308 -11.698 -17.547 1.00 30.54 C ATOM 315 SG CYS A 132 23.565 -11.829 -17.032 1.00 63.52 S ATOM 0 H CYS A 132 27.584 -11.393 -19.009 1.00 21.32 H new ATOM 0 HA CYS A 132 24.682 -11.516 -19.595 1.00 63.01 H new ATOM 0 HB2 CYS A 132 25.772 -12.682 -17.474 1.00 30.54 H new ATOM 0 HB3 CYS A 132 25.833 -11.045 -16.850 1.00 30.54 H new ATOM 320 N THR A 133 24.418 -9.061 -19.505 1.00 74.21 N ATOM 321 CA THR A 133 24.277 -7.612 -19.559 1.00 54.31 C ATOM 322 C THR A 133 23.001 -7.157 -18.860 1.00 55.01 C ATOM 323 O THR A 133 21.987 -7.857 -18.848 1.00 44.54 O ATOM 324 CB THR A 133 24.262 -7.102 -21.013 1.00 35.52 C ATOM 325 OG1 THR A 133 23.120 -7.624 -21.703 1.00 0.44 O ATOM 326 CG2 THR A 133 25.532 -7.512 -21.743 1.00 11.43 C ATOM 0 H THR A 133 23.641 -9.576 -19.919 1.00 74.21 H new ATOM 0 HA THR A 133 25.140 -7.192 -19.043 1.00 54.31 H new ATOM 0 HB THR A 133 24.208 -6.014 -20.993 1.00 35.52 H new ATOM 0 HG1 THR A 133 23.116 -7.294 -22.626 1.00 0.44 H new ATOM 0 HG21 THR A 133 25.499 -7.141 -22.767 1.00 11.43 H new ATOM 0 HG22 THR A 133 26.398 -7.090 -21.232 1.00 11.43 H new ATOM 0 HG23 THR A 133 25.611 -8.599 -21.753 1.00 11.43 H new ATOM 334 N PRO A 134 23.047 -5.957 -18.263 1.00 43.32 N ATOM 335 CA PRO A 134 21.902 -5.381 -17.552 1.00 20.32 C ATOM 336 C PRO A 134 20.776 -4.976 -18.497 1.00 63.33 C ATOM 337 O PRO A 134 20.806 -5.294 -19.685 1.00 40.45 O ATOM 338 CB PRO A 134 22.494 -4.148 -16.866 1.00 1.51 C ATOM 339 CG PRO A 134 23.669 -3.776 -17.703 1.00 25.45 C ATOM 340 CD PRO A 134 24.222 -5.069 -18.237 1.00 53.34 C ATOM 0 HA PRO A 134 21.451 -6.094 -16.862 1.00 20.32 H new ATOM 0 HB2 PRO A 134 21.769 -3.335 -16.818 1.00 1.51 H new ATOM 0 HB3 PRO A 134 22.792 -4.370 -15.841 1.00 1.51 H new ATOM 0 HG2 PRO A 134 23.375 -3.112 -18.516 1.00 25.45 H new ATOM 0 HG3 PRO A 134 24.417 -3.246 -17.113 1.00 25.45 H new ATOM 0 HD2 PRO A 134 24.652 -4.942 -19.230 1.00 53.34 H new ATOM 0 HD3 PRO A 134 25.010 -5.464 -17.596 1.00 53.34 H new ATOM 348 N GLY A 135 19.784 -4.272 -17.961 1.00 74.52 N ATOM 349 CA GLY A 135 18.662 -3.835 -18.772 1.00 20.41 C ATOM 350 C GLY A 135 17.829 -4.994 -19.283 1.00 25.52 C ATOM 351 O GLY A 135 17.373 -5.831 -18.504 1.00 25.15 O ATOM 0 H GLY A 135 19.737 -3.996 -16.980 1.00 74.52 H new ATOM 0 HA2 GLY A 135 18.030 -3.169 -18.184 1.00 20.41 H new ATOM 0 HA3 GLY A 135 19.033 -3.257 -19.619 1.00 20.41 H new ATOM 355 N SER A 136 17.629 -5.044 -20.596 1.00 1.41 N ATOM 356 CA SER A 136 16.841 -6.106 -21.210 1.00 12.23 C ATOM 357 C SER A 136 15.514 -6.289 -20.479 1.00 22.32 C ATOM 358 O SER A 136 15.166 -7.397 -20.069 1.00 53.23 O ATOM 359 CB SER A 136 17.625 -7.420 -21.205 1.00 12.52 C ATOM 360 OG SER A 136 17.682 -7.974 -19.902 1.00 61.41 O ATOM 0 H SER A 136 18.002 -4.361 -21.255 1.00 1.41 H new ATOM 0 HA SER A 136 16.632 -5.820 -22.241 1.00 12.23 H new ATOM 0 HB2 SER A 136 17.155 -8.130 -21.885 1.00 12.52 H new ATOM 0 HB3 SER A 136 18.636 -7.246 -21.574 1.00 12.52 H new ATOM 0 HG SER A 136 17.467 -7.282 -19.243 1.00 61.41 H new ATOM 366 N VAL A 137 14.778 -5.194 -20.319 1.00 34.53 N ATOM 367 CA VAL A 137 13.489 -5.233 -19.638 1.00 74.04 C ATOM 368 C VAL A 137 12.594 -6.322 -20.218 1.00 75.44 C ATOM 369 O VAL A 137 12.127 -6.218 -21.353 1.00 62.30 O ATOM 370 CB VAL A 137 12.761 -3.879 -19.738 1.00 31.24 C ATOM 371 CG1 VAL A 137 12.702 -3.409 -21.183 1.00 72.11 C ATOM 372 CG2 VAL A 137 11.364 -3.981 -19.144 1.00 10.20 C ATOM 0 H VAL A 137 15.052 -4.269 -20.651 1.00 34.53 H new ATOM 0 HA VAL A 137 13.691 -5.453 -18.590 1.00 74.04 H new ATOM 0 HB VAL A 137 13.322 -3.141 -19.165 1.00 31.24 H new ATOM 0 HG11 VAL A 137 12.184 -2.451 -21.233 1.00 72.11 H new ATOM 0 HG12 VAL A 137 13.715 -3.295 -21.570 1.00 72.11 H new ATOM 0 HG13 VAL A 137 12.165 -4.144 -21.783 1.00 72.11 H new ATOM 0 HG21 VAL A 137 10.864 -3.016 -19.223 1.00 10.20 H new ATOM 0 HG22 VAL A 137 10.791 -4.732 -19.688 1.00 10.20 H new ATOM 0 HG23 VAL A 137 11.435 -4.268 -18.095 1.00 10.20 H new ATOM 382 N ASP A 138 12.357 -7.367 -19.432 1.00 42.22 N ATOM 383 CA ASP A 138 11.516 -8.476 -19.867 1.00 0.03 C ATOM 384 C ASP A 138 10.041 -8.164 -19.632 1.00 23.00 C ATOM 385 O ASP A 138 9.688 -7.449 -18.694 1.00 11.13 O ATOM 386 CB ASP A 138 11.903 -9.758 -19.127 1.00 50.40 C ATOM 387 CG ASP A 138 12.788 -10.663 -19.961 1.00 52.23 C ATOM 388 OD1 ASP A 138 12.246 -11.412 -20.801 1.00 64.40 O ATOM 389 OD2 ASP A 138 14.022 -10.621 -19.775 1.00 73.21 O ATOM 0 H ASP A 138 12.736 -7.469 -18.490 1.00 42.22 H new ATOM 0 HA ASP A 138 11.672 -8.621 -20.936 1.00 0.03 H new ATOM 0 HB2 ASP A 138 12.421 -9.499 -18.204 1.00 50.40 H new ATOM 0 HB3 ASP A 138 10.999 -10.298 -18.845 1.00 50.40 H new ATOM 394 N THR A 139 9.183 -8.704 -20.492 1.00 21.43 N ATOM 395 CA THR A 139 7.747 -8.482 -20.380 1.00 21.22 C ATOM 396 C THR A 139 7.154 -9.287 -19.229 1.00 62.31 C ATOM 397 O THR A 139 6.262 -8.816 -18.523 1.00 53.05 O ATOM 398 CB THR A 139 7.017 -8.857 -21.683 1.00 63.54 C ATOM 399 OG1 THR A 139 7.525 -8.077 -22.771 1.00 51.32 O ATOM 400 CG2 THR A 139 5.519 -8.634 -21.548 1.00 73.21 C ATOM 0 H THR A 139 9.458 -9.298 -21.274 1.00 21.43 H new ATOM 0 HA THR A 139 7.606 -7.419 -20.187 1.00 21.22 H new ATOM 0 HB THR A 139 7.194 -9.914 -21.881 1.00 63.54 H new ATOM 0 HG1 THR A 139 7.057 -8.323 -23.596 1.00 51.32 H new ATOM 0 HG21 THR A 139 5.025 -8.906 -22.481 1.00 73.21 H new ATOM 0 HG22 THR A 139 5.131 -9.252 -20.738 1.00 73.21 H new ATOM 0 HG23 THR A 139 5.326 -7.584 -21.328 1.00 73.21 H new ATOM 408 N HIS A 140 7.656 -10.504 -19.044 1.00 20.20 N ATOM 409 CA HIS A 140 7.176 -11.375 -17.977 1.00 1.24 C ATOM 410 C HIS A 140 7.931 -11.109 -16.678 1.00 23.01 C ATOM 411 O HIS A 140 7.445 -11.421 -15.591 1.00 24.31 O ATOM 412 CB HIS A 140 7.330 -12.842 -18.379 1.00 12.05 C ATOM 413 CG HIS A 140 6.655 -13.183 -19.672 1.00 4.43 C ATOM 414 ND1 HIS A 140 7.284 -13.865 -20.691 1.00 62.44 N ATOM 415 CD2 HIS A 140 5.399 -12.932 -20.108 1.00 32.03 C ATOM 416 CE1 HIS A 140 6.444 -14.019 -21.699 1.00 41.43 C ATOM 417 NE2 HIS A 140 5.293 -13.461 -21.370 1.00 74.43 N ATOM 0 H HIS A 140 8.395 -10.909 -19.619 1.00 20.20 H new ATOM 0 HA HIS A 140 6.120 -11.160 -17.814 1.00 1.24 H new ATOM 0 HB2 HIS A 140 8.391 -13.079 -18.459 1.00 12.05 H new ATOM 0 HB3 HIS A 140 6.922 -13.472 -17.588 1.00 12.05 H new ATOM 0 HD2 HIS A 140 4.624 -12.412 -19.564 1.00 32.03 H new ATOM 0 HE1 HIS A 140 6.661 -14.516 -22.633 1.00 41.43 H new ATOM 0 HE2 HIS A 140 4.460 -13.428 -21.958 1.00 74.43 H new ATOM 425 N SER A 141 9.122 -10.531 -16.799 1.00 63.40 N ATOM 426 CA SER A 141 9.947 -10.228 -15.635 1.00 53.11 C ATOM 427 C SER A 141 9.651 -8.826 -15.111 1.00 21.03 C ATOM 428 O SER A 141 9.700 -8.579 -13.906 1.00 10.12 O ATOM 429 CB SER A 141 11.430 -10.350 -15.989 1.00 21.35 C ATOM 430 OG SER A 141 12.180 -10.826 -14.884 1.00 71.22 O ATOM 0 H SER A 141 9.537 -10.263 -17.691 1.00 63.40 H new ATOM 0 HA SER A 141 9.708 -10.948 -14.853 1.00 53.11 H new ATOM 0 HB2 SER A 141 11.551 -11.028 -16.834 1.00 21.35 H new ATOM 0 HB3 SER A 141 11.814 -9.379 -16.302 1.00 21.35 H new ATOM 0 HG SER A 141 13.124 -10.897 -15.136 1.00 71.22 H new ATOM 436 N SER A 142 9.344 -7.911 -16.025 1.00 64.42 N ATOM 437 CA SER A 142 9.044 -6.533 -15.657 1.00 4.22 C ATOM 438 C SER A 142 10.151 -5.951 -14.782 1.00 71.21 C ATOM 439 O SER A 142 9.906 -5.079 -13.949 1.00 72.53 O ATOM 440 CB SER A 142 7.705 -6.459 -14.921 1.00 22.11 C ATOM 441 OG SER A 142 7.361 -5.117 -14.621 1.00 60.43 O ATOM 0 H SER A 142 9.297 -8.100 -17.026 1.00 64.42 H new ATOM 0 HA SER A 142 8.980 -5.944 -16.572 1.00 4.22 H new ATOM 0 HB2 SER A 142 6.924 -6.909 -15.534 1.00 22.11 H new ATOM 0 HB3 SER A 142 7.761 -7.038 -13.999 1.00 22.11 H new ATOM 0 HG SER A 142 8.149 -4.646 -14.278 1.00 60.43 H new ATOM 447 N GLY A 143 11.371 -6.441 -14.978 1.00 63.43 N ATOM 448 CA GLY A 143 12.498 -5.960 -14.201 1.00 0.22 C ATOM 449 C GLY A 143 13.649 -5.499 -15.073 1.00 3.05 C ATOM 450 O GLY A 143 13.546 -5.494 -16.299 1.00 73.22 O ATOM 0 H GLY A 143 11.599 -7.163 -15.661 1.00 63.43 H new ATOM 0 HA2 GLY A 143 12.173 -5.135 -13.568 1.00 0.22 H new ATOM 0 HA3 GLY A 143 12.843 -6.753 -13.538 1.00 0.22 H new ATOM 454 N VAL A 144 14.750 -5.109 -14.438 1.00 44.53 N ATOM 455 CA VAL A 144 15.926 -4.643 -15.164 1.00 2.11 C ATOM 456 C VAL A 144 17.181 -5.378 -14.707 1.00 20.14 C ATOM 457 O VAL A 144 17.600 -5.256 -13.556 1.00 13.21 O ATOM 458 CB VAL A 144 16.136 -3.128 -14.980 1.00 20.23 C ATOM 459 CG1 VAL A 144 17.385 -2.669 -15.716 1.00 3.42 C ATOM 460 CG2 VAL A 144 14.913 -2.359 -15.457 1.00 21.54 C ATOM 0 H VAL A 144 14.852 -5.106 -13.423 1.00 44.53 H new ATOM 0 HA VAL A 144 15.750 -4.852 -16.219 1.00 2.11 H new ATOM 0 HB VAL A 144 16.274 -2.924 -13.918 1.00 20.23 H new ATOM 0 HG11 VAL A 144 17.517 -1.596 -15.575 1.00 3.42 H new ATOM 0 HG12 VAL A 144 18.254 -3.197 -15.322 1.00 3.42 H new ATOM 0 HG13 VAL A 144 17.281 -2.885 -16.779 1.00 3.42 H new ATOM 0 HG21 VAL A 144 15.079 -1.290 -15.320 1.00 21.54 H new ATOM 0 HG22 VAL A 144 14.742 -2.567 -16.513 1.00 21.54 H new ATOM 0 HG23 VAL A 144 14.041 -2.668 -14.880 1.00 21.54 H new ATOM 470 N ALA A 145 17.777 -6.142 -15.616 1.00 43.12 N ATOM 471 CA ALA A 145 18.986 -6.895 -15.307 1.00 63.22 C ATOM 472 C ALA A 145 20.083 -5.979 -14.775 1.00 31.11 C ATOM 473 O ALA A 145 20.154 -4.803 -15.135 1.00 21.52 O ATOM 474 CB ALA A 145 19.472 -7.642 -16.540 1.00 63.25 C ATOM 0 H ALA A 145 17.442 -6.256 -16.573 1.00 43.12 H new ATOM 0 HA ALA A 145 18.744 -7.619 -14.529 1.00 63.22 H new ATOM 0 HB1 ALA A 145 20.376 -8.200 -16.295 1.00 63.25 H new ATOM 0 HB2 ALA A 145 18.699 -8.333 -16.875 1.00 63.25 H new ATOM 0 HB3 ALA A 145 19.691 -6.929 -17.335 1.00 63.25 H new ATOM 480 N THR A 146 20.937 -6.524 -13.914 1.00 63.23 N ATOM 481 CA THR A 146 22.029 -5.756 -13.331 1.00 3.42 C ATOM 482 C THR A 146 23.350 -6.062 -14.027 1.00 5.40 C ATOM 483 O THR A 146 24.186 -5.177 -14.211 1.00 74.34 O ATOM 484 CB THR A 146 22.177 -6.043 -11.825 1.00 30.52 C ATOM 485 OG1 THR A 146 20.896 -6.329 -11.253 1.00 32.52 O ATOM 486 CG2 THR A 146 22.806 -4.859 -11.107 1.00 33.05 C ATOM 0 H THR A 146 20.893 -7.495 -13.605 1.00 63.23 H new ATOM 0 HA THR A 146 21.784 -4.703 -13.470 1.00 3.42 H new ATOM 0 HB THR A 146 22.829 -6.908 -11.705 1.00 30.52 H new ATOM 0 HG1 THR A 146 20.760 -5.771 -10.459 1.00 32.52 H new ATOM 0 HG21 THR A 146 22.900 -5.086 -10.045 1.00 33.05 H new ATOM 0 HG22 THR A 146 23.793 -4.663 -11.525 1.00 33.05 H new ATOM 0 HG23 THR A 146 22.176 -3.979 -11.236 1.00 33.05 H new ATOM 494 N GLY A 147 23.533 -7.321 -14.413 1.00 2.12 N ATOM 495 CA GLY A 147 24.755 -7.721 -15.085 1.00 45.34 C ATOM 496 C GLY A 147 25.467 -8.853 -14.371 1.00 13.21 C ATOM 497 O GLY A 147 26.107 -9.691 -15.006 1.00 35.43 O ATOM 0 H GLY A 147 22.856 -8.071 -14.272 1.00 2.12 H new ATOM 0 HA2 GLY A 147 24.521 -8.029 -16.104 1.00 45.34 H new ATOM 0 HA3 GLY A 147 25.424 -6.863 -15.157 1.00 45.34 H new ATOM 501 N ARG A 148 25.357 -8.876 -13.047 1.00 35.53 N ATOM 502 CA ARG A 148 25.997 -9.912 -12.245 1.00 71.42 C ATOM 503 C ARG A 148 25.238 -11.232 -12.356 1.00 3.24 C ATOM 504 O ARG A 148 24.023 -11.247 -12.553 1.00 50.03 O ATOM 505 CB ARG A 148 26.076 -9.478 -10.781 1.00 33.15 C ATOM 506 CG ARG A 148 27.140 -10.214 -9.983 1.00 71.34 C ATOM 507 CD ARG A 148 27.188 -9.734 -8.541 1.00 74.13 C ATOM 508 NE ARG A 148 27.558 -8.325 -8.446 1.00 15.52 N ATOM 509 CZ ARG A 148 27.581 -7.647 -7.304 1.00 1.34 C ATOM 510 NH1 ARG A 148 27.258 -8.246 -6.166 1.00 62.51 N ATOM 511 NH2 ARG A 148 27.929 -6.366 -7.298 1.00 34.13 N ATOM 0 H ARG A 148 24.831 -8.189 -12.507 1.00 35.53 H new ATOM 0 HA ARG A 148 27.007 -10.060 -12.627 1.00 71.42 H new ATOM 0 HB2 ARG A 148 26.278 -8.408 -10.739 1.00 33.15 H new ATOM 0 HB3 ARG A 148 25.106 -9.638 -10.311 1.00 33.15 H new ATOM 0 HG2 ARG A 148 26.936 -11.285 -10.004 1.00 71.34 H new ATOM 0 HG3 ARG A 148 28.114 -10.065 -10.450 1.00 71.34 H new ATOM 0 HD2 ARG A 148 26.214 -9.885 -8.076 1.00 74.13 H new ATOM 0 HD3 ARG A 148 27.905 -10.336 -7.982 1.00 74.13 H new ATOM 0 HE ARG A 148 27.813 -7.834 -9.303 1.00 15.52 H new ATOM 0 HH11 ARG A 148 26.991 -9.230 -6.166 1.00 62.51 H new ATOM 0 HH12 ARG A 148 27.277 -7.722 -5.291 1.00 62.51 H new ATOM 0 HH21 ARG A 148 28.179 -5.901 -8.171 1.00 34.13 H new ATOM 0 HH22 ARG A 148 27.946 -5.846 -6.420 1.00 34.13 H new ATOM 525 N CYS A 149 25.964 -12.338 -12.227 1.00 54.21 N ATOM 526 CA CYS A 149 25.361 -13.662 -12.313 1.00 72.41 C ATOM 527 C CYS A 149 25.743 -14.513 -11.105 1.00 70.45 C ATOM 528 O CYS A 149 26.862 -14.426 -10.600 1.00 10.03 O ATOM 529 CB CYS A 149 25.797 -14.361 -13.602 1.00 62.52 C ATOM 530 SG CYS A 149 24.816 -15.840 -14.015 1.00 2.10 S ATOM 0 H CYS A 149 26.971 -12.343 -12.063 1.00 54.21 H new ATOM 0 HA CYS A 149 24.278 -13.541 -12.322 1.00 72.41 H new ATOM 0 HB2 CYS A 149 25.731 -13.652 -14.427 1.00 62.52 H new ATOM 0 HB3 CYS A 149 26.845 -14.647 -13.511 1.00 62.52 H new ATOM 535 N VAL A 150 24.805 -15.337 -10.648 1.00 61.03 N ATOM 536 CA VAL A 150 25.043 -16.205 -9.501 1.00 61.23 C ATOM 537 C VAL A 150 24.233 -17.492 -9.609 1.00 32.14 C ATOM 538 O VAL A 150 23.139 -17.521 -10.173 1.00 11.01 O ATOM 539 CB VAL A 150 24.690 -15.498 -8.179 1.00 42.03 C ATOM 540 CG1 VAL A 150 25.517 -14.232 -8.014 1.00 11.04 C ATOM 541 CG2 VAL A 150 23.203 -15.184 -8.124 1.00 33.41 C ATOM 0 H VAL A 150 23.873 -15.421 -11.055 1.00 61.03 H new ATOM 0 HA VAL A 150 26.106 -16.447 -9.502 1.00 61.23 H new ATOM 0 HB VAL A 150 24.927 -16.169 -7.353 1.00 42.03 H new ATOM 0 HG11 VAL A 150 25.254 -13.746 -7.075 1.00 11.04 H new ATOM 0 HG12 VAL A 150 26.576 -14.488 -8.006 1.00 11.04 H new ATOM 0 HG13 VAL A 150 25.314 -13.554 -8.843 1.00 11.04 H new ATOM 0 HG21 VAL A 150 22.971 -14.685 -7.183 1.00 33.41 H new ATOM 0 HG22 VAL A 150 22.938 -14.532 -8.956 1.00 33.41 H new ATOM 0 HG23 VAL A 150 22.633 -16.110 -8.193 1.00 33.41 H new ATOM 551 N PRO A 151 24.780 -18.584 -9.054 1.00 41.11 N ATOM 552 CA PRO A 151 24.124 -19.895 -9.073 1.00 44.24 C ATOM 553 C PRO A 151 22.890 -19.939 -8.179 1.00 25.04 C ATOM 554 O PRO A 151 22.962 -20.366 -7.026 1.00 41.10 O ATOM 555 CB PRO A 151 25.205 -20.840 -8.541 1.00 51.43 C ATOM 556 CG PRO A 151 26.087 -19.975 -7.709 1.00 23.34 C ATOM 557 CD PRO A 151 26.081 -18.622 -8.365 1.00 71.51 C ATOM 0 HA PRO A 151 23.763 -20.156 -10.068 1.00 44.24 H new ATOM 0 HB2 PRO A 151 24.770 -21.647 -7.951 1.00 51.43 H new ATOM 0 HB3 PRO A 151 25.760 -21.305 -9.356 1.00 51.43 H new ATOM 0 HG2 PRO A 151 25.719 -19.913 -6.685 1.00 23.34 H new ATOM 0 HG3 PRO A 151 27.098 -20.380 -7.661 1.00 23.34 H new ATOM 0 HD2 PRO A 151 26.172 -17.820 -7.633 1.00 71.51 H new ATOM 0 HD3 PRO A 151 26.910 -18.511 -9.064 1.00 71.51 H new ATOM 565 N PHE A 152 21.759 -19.496 -8.717 1.00 0.25 N ATOM 566 CA PHE A 152 20.509 -19.484 -7.966 1.00 72.40 C ATOM 567 C PHE A 152 20.226 -20.856 -7.360 1.00 54.02 C ATOM 568 O PHE A 152 20.073 -20.991 -6.147 1.00 4.20 O ATOM 569 CB PHE A 152 19.349 -19.065 -8.872 1.00 62.41 C ATOM 570 CG PHE A 152 18.109 -18.678 -8.118 1.00 60.44 C ATOM 571 CD1 PHE A 152 17.386 -19.628 -7.414 1.00 51.32 C ATOM 572 CD2 PHE A 152 17.667 -17.365 -8.113 1.00 74.44 C ATOM 573 CE1 PHE A 152 16.244 -19.274 -6.720 1.00 70.35 C ATOM 574 CE2 PHE A 152 16.526 -17.006 -7.421 1.00 54.01 C ATOM 575 CZ PHE A 152 15.814 -17.962 -6.723 1.00 10.31 C ATOM 0 H PHE A 152 21.682 -19.141 -9.670 1.00 0.25 H new ATOM 0 HA PHE A 152 20.607 -18.761 -7.156 1.00 72.40 H new ATOM 0 HB2 PHE A 152 19.666 -18.225 -9.490 1.00 62.41 H new ATOM 0 HB3 PHE A 152 19.112 -19.886 -9.548 1.00 62.41 H new ATOM 0 HD1 PHE A 152 17.718 -20.656 -7.408 1.00 51.32 H new ATOM 0 HD2 PHE A 152 18.221 -16.613 -8.656 1.00 74.44 H new ATOM 0 HE1 PHE A 152 15.688 -20.023 -6.176 1.00 70.35 H new ATOM 0 HE2 PHE A 152 16.191 -15.979 -7.426 1.00 54.01 H new ATOM 0 HZ PHE A 152 14.923 -17.684 -6.181 1.00 10.31 H new ATOM 585 N ASN A 153 20.156 -21.871 -8.215 1.00 60.04 N ATOM 586 CA ASN A 153 19.890 -23.233 -7.765 1.00 50.55 C ATOM 587 C ASN A 153 21.173 -24.057 -7.738 1.00 44.02 C ATOM 588 O ASN A 153 22.271 -23.519 -7.882 1.00 73.23 O ATOM 589 CB ASN A 153 18.860 -23.901 -8.678 1.00 62.43 C ATOM 590 CG ASN A 153 17.886 -24.773 -7.910 1.00 11.15 C ATOM 591 OD1 ASN A 153 17.605 -24.524 -6.737 1.00 54.32 O ATOM 592 ND2 ASN A 153 17.366 -25.802 -8.568 1.00 52.14 N ATOM 0 H ASN A 153 20.280 -21.776 -9.223 1.00 60.04 H new ATOM 0 HA ASN A 153 19.490 -23.184 -6.752 1.00 50.55 H new ATOM 0 HB2 ASN A 153 18.307 -23.134 -9.220 1.00 62.43 H new ATOM 0 HB3 ASN A 153 19.377 -24.507 -9.422 1.00 62.43 H new ATOM 0 HD21 ASN A 153 16.705 -26.424 -8.102 1.00 52.14 H new ATOM 0 HD22 ASN A 153 17.627 -25.971 -9.539 1.00 52.14 H new ATOM 599 N GLU A 154 21.026 -25.365 -7.553 1.00 23.21 N ATOM 600 CA GLU A 154 22.174 -26.263 -7.507 1.00 21.33 C ATOM 601 C GLU A 154 22.699 -26.548 -8.911 1.00 4.41 C ATOM 602 O GLU A 154 23.885 -26.369 -9.190 1.00 20.14 O ATOM 603 CB GLU A 154 21.796 -27.575 -6.817 1.00 35.54 C ATOM 604 CG GLU A 154 22.048 -27.570 -5.318 1.00 65.23 C ATOM 605 CD GLU A 154 22.033 -28.963 -4.719 1.00 72.12 C ATOM 606 OE1 GLU A 154 21.187 -29.780 -5.138 1.00 70.43 O ATOM 607 OE2 GLU A 154 22.867 -29.235 -3.831 1.00 24.51 O ATOM 0 H GLU A 154 20.124 -25.826 -7.433 1.00 23.21 H new ATOM 0 HA GLU A 154 22.962 -25.774 -6.935 1.00 21.33 H new ATOM 0 HB2 GLU A 154 20.741 -27.780 -6.999 1.00 35.54 H new ATOM 0 HB3 GLU A 154 22.362 -28.390 -7.269 1.00 35.54 H new ATOM 0 HG2 GLU A 154 23.012 -27.103 -5.117 1.00 65.23 H new ATOM 0 HG3 GLU A 154 21.289 -26.960 -4.828 1.00 65.23 H new ATOM 614 N SER A 155 21.808 -26.992 -9.791 1.00 51.42 N ATOM 615 CA SER A 155 22.181 -27.305 -11.165 1.00 64.15 C ATOM 616 C SER A 155 21.702 -26.216 -12.121 1.00 24.14 C ATOM 617 O SER A 155 21.595 -26.436 -13.327 1.00 43.52 O ATOM 618 CB SER A 155 21.596 -28.656 -11.580 1.00 32.42 C ATOM 619 OG SER A 155 21.759 -29.619 -10.553 1.00 34.21 O ATOM 0 H SER A 155 20.822 -27.143 -9.577 1.00 51.42 H new ATOM 0 HA SER A 155 23.269 -27.356 -11.216 1.00 64.15 H new ATOM 0 HB2 SER A 155 20.537 -28.542 -11.811 1.00 32.42 H new ATOM 0 HB3 SER A 155 22.085 -29.004 -12.490 1.00 32.42 H new ATOM 0 HG SER A 155 21.376 -30.473 -10.842 1.00 34.21 H new ATOM 625 N VAL A 156 21.415 -25.040 -11.571 1.00 61.31 N ATOM 626 CA VAL A 156 20.948 -23.915 -12.373 1.00 23.43 C ATOM 627 C VAL A 156 21.481 -22.595 -11.829 1.00 12.52 C ATOM 628 O VAL A 156 21.734 -22.460 -10.631 1.00 54.24 O ATOM 629 CB VAL A 156 19.410 -23.857 -12.416 1.00 72.20 C ATOM 630 CG1 VAL A 156 18.943 -22.823 -13.429 1.00 34.11 C ATOM 631 CG2 VAL A 156 18.834 -25.228 -12.737 1.00 70.12 C ATOM 0 H VAL A 156 21.498 -24.842 -10.574 1.00 61.31 H new ATOM 0 HA VAL A 156 21.326 -24.067 -13.384 1.00 23.43 H new ATOM 0 HB VAL A 156 19.047 -23.557 -11.433 1.00 72.20 H new ATOM 0 HG11 VAL A 156 17.853 -22.796 -13.446 1.00 34.11 H new ATOM 0 HG12 VAL A 156 19.326 -21.841 -13.150 1.00 34.11 H new ATOM 0 HG13 VAL A 156 19.314 -23.089 -14.419 1.00 34.11 H new ATOM 0 HG21 VAL A 156 17.746 -25.168 -12.763 1.00 70.12 H new ATOM 0 HG22 VAL A 156 19.203 -25.559 -13.708 1.00 70.12 H new ATOM 0 HG23 VAL A 156 19.140 -25.940 -11.970 1.00 70.12 H new ATOM 641 N LYS A 157 21.649 -21.620 -12.717 1.00 21.44 N ATOM 642 CA LYS A 157 22.150 -20.308 -12.327 1.00 40.41 C ATOM 643 C LYS A 157 21.367 -19.198 -13.022 1.00 61.31 C ATOM 644 O LYS A 157 20.935 -19.351 -14.165 1.00 51.11 O ATOM 645 CB LYS A 157 23.638 -20.186 -12.665 1.00 55.44 C ATOM 646 CG LYS A 157 24.450 -21.411 -12.286 1.00 61.51 C ATOM 647 CD LYS A 157 25.934 -21.095 -12.209 1.00 43.30 C ATOM 648 CE LYS A 157 26.754 -22.337 -11.894 1.00 14.23 C ATOM 649 NZ LYS A 157 26.780 -23.289 -13.038 1.00 35.40 N ATOM 0 H LYS A 157 21.445 -21.715 -13.712 1.00 21.44 H new ATOM 0 HA LYS A 157 22.019 -20.202 -11.250 1.00 40.41 H new ATOM 0 HB2 LYS A 157 23.745 -20.006 -13.735 1.00 55.44 H new ATOM 0 HB3 LYS A 157 24.048 -19.316 -12.153 1.00 55.44 H new ATOM 0 HG2 LYS A 157 24.108 -21.792 -11.324 1.00 61.51 H new ATOM 0 HG3 LYS A 157 24.283 -22.200 -13.019 1.00 61.51 H new ATOM 0 HD2 LYS A 157 26.266 -20.669 -13.156 1.00 43.30 H new ATOM 0 HD3 LYS A 157 26.107 -20.340 -11.442 1.00 43.30 H new ATOM 0 HE2 LYS A 157 27.773 -22.045 -11.641 1.00 14.23 H new ATOM 0 HE3 LYS A 157 26.338 -22.834 -11.017 1.00 14.23 H new ATOM 0 HZ1 LYS A 157 27.467 -24.045 -12.845 1.00 35.40 H new ATOM 0 HZ2 LYS A 157 25.835 -23.704 -13.166 1.00 35.40 H new ATOM 0 HZ3 LYS A 157 27.056 -22.784 -13.904 1.00 35.40 H new ATOM 663 N THR A 158 21.189 -18.080 -12.325 1.00 74.14 N ATOM 664 CA THR A 158 20.458 -16.945 -12.876 1.00 23.24 C ATOM 665 C THR A 158 21.268 -15.659 -12.753 1.00 75.11 C ATOM 666 O THR A 158 22.353 -15.649 -12.172 1.00 21.40 O ATOM 667 CB THR A 158 19.102 -16.754 -12.170 1.00 64.31 C ATOM 668 OG1 THR A 158 19.310 -16.381 -10.803 1.00 75.12 O ATOM 669 CG2 THR A 158 18.275 -18.029 -12.233 1.00 63.42 C ATOM 0 H THR A 158 21.541 -17.936 -11.378 1.00 74.14 H new ATOM 0 HA THR A 158 20.283 -17.162 -13.930 1.00 23.24 H new ATOM 0 HB THR A 158 18.558 -15.961 -12.684 1.00 64.31 H new ATOM 0 HG1 THR A 158 18.469 -16.051 -10.422 1.00 75.12 H new ATOM 0 HG21 THR A 158 17.322 -17.870 -11.728 1.00 63.42 H new ATOM 0 HG22 THR A 158 18.094 -18.294 -13.275 1.00 63.42 H new ATOM 0 HG23 THR A 158 18.815 -18.838 -11.741 1.00 63.42 H new ATOM 677 N CYS A 159 20.733 -14.574 -13.303 1.00 74.45 N ATOM 678 CA CYS A 159 21.405 -13.282 -13.256 1.00 14.50 C ATOM 679 C CYS A 159 20.641 -12.304 -12.368 1.00 13.42 C ATOM 680 O CYS A 159 19.459 -12.499 -12.087 1.00 53.11 O ATOM 681 CB CYS A 159 21.545 -12.704 -14.666 1.00 21.22 C ATOM 682 SG CYS A 159 23.266 -12.575 -15.248 1.00 63.34 S ATOM 0 H CYS A 159 19.835 -14.565 -13.787 1.00 74.45 H new ATOM 0 HA CYS A 159 22.398 -13.432 -12.832 1.00 14.50 H new ATOM 0 HB2 CYS A 159 20.983 -13.329 -15.361 1.00 21.22 H new ATOM 0 HB3 CYS A 159 21.090 -11.714 -14.688 1.00 21.22 H new ATOM 687 N GLU A 160 21.325 -11.252 -11.930 1.00 3.32 N ATOM 688 CA GLU A 160 20.711 -10.244 -11.073 1.00 60.03 C ATOM 689 C GLU A 160 19.741 -9.374 -11.867 1.00 13.32 C ATOM 690 O GLU A 160 20.041 -8.948 -12.982 1.00 74.45 O ATOM 691 CB GLU A 160 21.786 -9.369 -10.426 1.00 42.41 C ATOM 692 CG GLU A 160 21.255 -8.465 -9.326 1.00 55.25 C ATOM 693 CD GLU A 160 22.251 -7.398 -8.915 1.00 71.23 C ATOM 694 OE1 GLU A 160 23.468 -7.632 -9.068 1.00 31.15 O ATOM 695 OE2 GLU A 160 21.813 -6.329 -8.441 1.00 54.04 O ATOM 0 H GLU A 160 22.304 -11.075 -12.154 1.00 3.32 H new ATOM 0 HA GLU A 160 20.154 -10.759 -10.291 1.00 60.03 H new ATOM 0 HB2 GLU A 160 22.565 -10.010 -10.013 1.00 42.41 H new ATOM 0 HB3 GLU A 160 22.254 -8.755 -11.195 1.00 42.41 H new ATOM 0 HG2 GLU A 160 20.336 -7.987 -9.666 1.00 55.25 H new ATOM 0 HG3 GLU A 160 20.997 -9.070 -8.457 1.00 55.25 H new ATOM 702 N VAL A 161 18.575 -9.113 -11.283 1.00 22.41 N ATOM 703 CA VAL A 161 17.560 -8.294 -11.934 1.00 2.21 C ATOM 704 C VAL A 161 16.804 -7.446 -10.918 1.00 12.33 C ATOM 705 O VAL A 161 16.620 -7.851 -9.770 1.00 54.23 O ATOM 706 CB VAL A 161 16.554 -9.161 -12.713 1.00 54.12 C ATOM 707 CG1 VAL A 161 17.189 -9.705 -13.984 1.00 15.30 C ATOM 708 CG2 VAL A 161 16.037 -10.293 -11.838 1.00 65.55 C ATOM 0 H VAL A 161 18.311 -9.457 -10.360 1.00 22.41 H new ATOM 0 HA VAL A 161 18.081 -7.640 -12.633 1.00 2.21 H new ATOM 0 HB VAL A 161 15.707 -8.537 -12.998 1.00 54.12 H new ATOM 0 HG11 VAL A 161 16.463 -10.315 -14.521 1.00 15.30 H new ATOM 0 HG12 VAL A 161 17.505 -8.876 -14.617 1.00 15.30 H new ATOM 0 HG13 VAL A 161 18.055 -10.315 -13.726 1.00 15.30 H new ATOM 0 HG21 VAL A 161 15.327 -10.896 -12.405 1.00 65.55 H new ATOM 0 HG22 VAL A 161 16.872 -10.918 -11.521 1.00 65.55 H new ATOM 0 HG23 VAL A 161 15.541 -9.877 -10.961 1.00 65.55 H new ATOM 718 N ALA A 162 16.367 -6.266 -11.347 1.00 60.45 N ATOM 719 CA ALA A 162 15.628 -5.362 -10.476 1.00 11.41 C ATOM 720 C ALA A 162 14.132 -5.418 -10.768 1.00 3.14 C ATOM 721 O ALA A 162 13.668 -4.896 -11.780 1.00 52.54 O ATOM 722 CB ALA A 162 16.145 -3.939 -10.632 1.00 32.13 C ATOM 0 H ALA A 162 16.513 -5.914 -12.293 1.00 60.45 H new ATOM 0 HA ALA A 162 15.783 -5.683 -9.446 1.00 11.41 H new ATOM 0 HB1 ALA A 162 15.584 -3.274 -9.975 1.00 32.13 H new ATOM 0 HB2 ALA A 162 17.202 -3.905 -10.366 1.00 32.13 H new ATOM 0 HB3 ALA A 162 16.020 -3.618 -11.666 1.00 32.13 H new ATOM 728 N ALA A 163 13.383 -6.056 -9.874 1.00 4.30 N ATOM 729 CA ALA A 163 11.940 -6.179 -10.035 1.00 50.14 C ATOM 730 C ALA A 163 11.245 -6.305 -8.684 1.00 1.51 C ATOM 731 O ALA A 163 11.878 -6.173 -7.636 1.00 35.41 O ATOM 732 CB ALA A 163 11.608 -7.375 -10.915 1.00 55.12 C ATOM 0 H ALA A 163 13.752 -6.496 -9.031 1.00 4.30 H new ATOM 0 HA ALA A 163 11.575 -5.273 -10.518 1.00 50.14 H new ATOM 0 HB1 ALA A 163 10.527 -7.455 -11.027 1.00 55.12 H new ATOM 0 HB2 ALA A 163 12.066 -7.243 -11.895 1.00 55.12 H new ATOM 0 HB3 ALA A 163 11.993 -8.284 -10.454 1.00 55.12 H new ATOM 738 N TRP A 164 9.942 -6.558 -8.716 1.00 30.45 N ATOM 739 CA TRP A 164 9.161 -6.701 -7.492 1.00 3.13 C ATOM 740 C TRP A 164 9.384 -8.071 -6.860 1.00 51.34 C ATOM 741 O TRP A 164 8.868 -9.079 -7.344 1.00 24.23 O ATOM 742 CB TRP A 164 7.674 -6.496 -7.784 1.00 41.04 C ATOM 743 CG TRP A 164 7.395 -5.285 -8.623 1.00 31.52 C ATOM 744 CD1 TRP A 164 7.239 -5.246 -9.979 1.00 62.00 C ATOM 745 CD2 TRP A 164 7.240 -3.939 -8.160 1.00 25.51 C ATOM 746 NE1 TRP A 164 6.997 -3.956 -10.387 1.00 63.42 N ATOM 747 CE2 TRP A 164 6.992 -3.136 -9.290 1.00 62.22 C ATOM 748 CE3 TRP A 164 7.286 -3.335 -6.901 1.00 14.11 C ATOM 749 CZ2 TRP A 164 6.792 -1.762 -9.196 1.00 54.45 C ATOM 750 CZ3 TRP A 164 7.087 -1.971 -6.810 1.00 13.54 C ATOM 751 CH2 TRP A 164 6.841 -1.196 -7.951 1.00 64.13 C ATOM 0 H TRP A 164 9.404 -6.668 -9.575 1.00 30.45 H new ATOM 0 HA TRP A 164 9.494 -5.939 -6.788 1.00 3.13 H new ATOM 0 HB2 TRP A 164 7.286 -7.379 -8.292 1.00 41.04 H new ATOM 0 HB3 TRP A 164 7.135 -6.408 -6.841 1.00 41.04 H new ATOM 0 HD1 TRP A 164 7.297 -6.103 -10.634 1.00 62.00 H new ATOM 0 HE1 TRP A 164 6.846 -3.658 -11.351 1.00 63.42 H new ATOM 0 HE3 TRP A 164 7.474 -3.924 -6.015 1.00 14.11 H new ATOM 0 HZ2 TRP A 164 6.605 -1.163 -10.075 1.00 54.45 H new ATOM 0 HZ3 TRP A 164 7.122 -1.493 -5.842 1.00 13.54 H new ATOM 0 HH2 TRP A 164 6.687 -0.132 -7.846 1.00 64.13 H new ATOM 762 N CYS A 165 10.154 -8.101 -5.778 1.00 43.41 N ATOM 763 CA CYS A 165 10.445 -9.347 -5.080 1.00 64.13 C ATOM 764 C CYS A 165 10.766 -9.086 -3.611 1.00 71.04 C ATOM 765 O CYS A 165 11.227 -8.009 -3.233 1.00 14.14 O ATOM 766 CB CYS A 165 11.617 -10.069 -5.749 1.00 3.51 C ATOM 767 SG CYS A 165 13.236 -9.284 -5.460 1.00 52.23 S ATOM 0 H CYS A 165 10.588 -7.276 -5.365 1.00 43.41 H new ATOM 0 HA CYS A 165 9.559 -9.979 -5.133 1.00 64.13 H new ATOM 0 HB2 CYS A 165 11.653 -11.096 -5.385 1.00 3.51 H new ATOM 0 HB3 CYS A 165 11.435 -10.117 -6.823 1.00 3.51 H new ATOM 772 N PRO A 166 10.517 -10.095 -2.763 1.00 40.12 N ATOM 773 CA PRO A 166 10.772 -9.999 -1.323 1.00 22.41 C ATOM 774 C PRO A 166 12.262 -9.965 -0.999 1.00 52.10 C ATOM 775 O PRO A 166 12.710 -9.166 -0.177 1.00 44.41 O ATOM 776 CB PRO A 166 10.133 -11.273 -0.764 1.00 71.12 C ATOM 777 CG PRO A 166 10.146 -12.234 -1.902 1.00 62.34 C ATOM 778 CD PRO A 166 9.968 -11.407 -3.145 1.00 50.22 C ATOM 0 HA PRO A 166 10.367 -9.080 -0.898 1.00 22.41 H new ATOM 0 HB2 PRO A 166 10.696 -11.658 0.086 1.00 71.12 H new ATOM 0 HB3 PRO A 166 9.117 -11.086 -0.415 1.00 71.12 H new ATOM 0 HG2 PRO A 166 11.084 -12.789 -1.933 1.00 62.34 H new ATOM 0 HG3 PRO A 166 9.345 -12.967 -1.803 1.00 62.34 H new ATOM 0 HD2 PRO A 166 10.503 -11.835 -3.993 1.00 50.22 H new ATOM 0 HD3 PRO A 166 8.919 -11.335 -3.433 1.00 50.22 H new ATOM 786 N VAL A 167 13.025 -10.837 -1.651 1.00 11.23 N ATOM 787 CA VAL A 167 14.465 -10.905 -1.433 1.00 51.20 C ATOM 788 C VAL A 167 15.191 -11.351 -2.697 1.00 23.11 C ATOM 789 O VAL A 167 14.563 -11.742 -3.681 1.00 4.11 O ATOM 790 CB VAL A 167 14.814 -11.871 -0.285 1.00 41.42 C ATOM 791 CG1 VAL A 167 14.405 -13.292 -0.640 1.00 65.13 C ATOM 792 CG2 VAL A 167 16.299 -11.799 0.038 1.00 51.11 C ATOM 0 H VAL A 167 12.670 -11.506 -2.334 1.00 11.23 H new ATOM 0 HA VAL A 167 14.793 -9.901 -1.164 1.00 51.20 H new ATOM 0 HB VAL A 167 14.257 -11.570 0.603 1.00 41.42 H new ATOM 0 HG11 VAL A 167 14.659 -13.960 0.183 1.00 65.13 H new ATOM 0 HG12 VAL A 167 13.330 -13.328 -0.817 1.00 65.13 H new ATOM 0 HG13 VAL A 167 14.932 -13.608 -1.540 1.00 65.13 H new ATOM 0 HG21 VAL A 167 16.528 -12.488 0.851 1.00 51.11 H new ATOM 0 HG22 VAL A 167 16.877 -12.074 -0.844 1.00 51.11 H new ATOM 0 HG23 VAL A 167 16.557 -10.784 0.339 1.00 51.11 H new TER 802 VAL A 167