USER MOD reduce.3.24.130724 H: found=0, std=0, add=949, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 946 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 115 THR OG1 : rot 180:sc= 0 USER MOD Single : A 116 TYR OH : rot 180:sc= 0 USER MOD Single : A 119 ASN : amide:sc= -0.402 X(o=-0.4,f=-0.86) USER MOD Single : A 120 ASN : amide:sc= -0.448 K(o=-0.45,f=-1.4) USER MOD Single : A 121 TYR OH : rot 180:sc= 0 USER MOD Single : A 122 THR OG1 : rot 180:sc= -0.847 USER MOD Single : A 125 MET CE :methyl -160:sc= -1 (180deg=-1.85!) USER MOD Single : A 126 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 132 TYR OH : rot 180:sc= 0 USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 139 GLN : amide:sc= -0.156 K(o=-0.16,f=-2.1!) USER MOD Single : A 142 SER OG : rot 180:sc= 0 USER MOD Single : A 143 ASN : amide:sc= -0.162 K(o=-0.16,f=-0.76) USER MOD Single : A 145 THR OG1 : rot 60:sc= 1.16 USER MOD Single : A 148 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 150 SER OG : rot 180:sc= 0 USER MOD Single : A 151 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 168 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 172 HIS : no HD1:sc= -0.614 X(o=-0.61,f=-1.1) USER MOD Single : A 183 HIS : no HD1:sc= -0.257 X(o=-0.26,f=-0.075) USER MOD Single : A 196 HIS : no HD1:sc= -0.42 X(o=-0.42,f=-0.021) USER MOD Single : A 204 THR OG1 : rot 180:sc= 0 USER MOD Single : A 205 THR OG1 : rot 54:sc= 0.509 USER MOD Single : A 206 HIS : no HD1:sc= -0.528 K(o=-0.53,f=-1.7) USER MOD Single : A 207 SER OG : rot -161:sc= -0.72 USER MOD Single : A 210 THR OG1 : rot -140:sc= -0.442 USER MOD Single : A 211 ASN : amide:sc= -1.61 K(o=-1.6,f=-7.5!) USER MOD Single : A 215 THR OG1 : rot -166:sc= 0.148 USER MOD Single : A 218 HIS : no HE2:sc= -1.07 K(o=-1.1,f=-4.8!) USER MOD Single : A 222 HIS : no HE2:sc= -3.9! C(o=-3.9!,f=-8.2!) USER MOD Single : A 223 SER OG : rot 180:sc= 0 USER MOD Single : A 228 HIS : no HD1:sc= -0.0255 X(o=-0.026,f=-0.39) USER MOD Single : A 233 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 236 MET CE :methyl 155:sc= -1.79 (180deg=-2.67!) USER MOD Single : A 239 THR OG1 : rot 180:sc= 0.00871 USER MOD Single : A 240 TYR OH : rot 180:sc= 0 USER MOD Single : A 241 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 242 TYR OH : rot 180:sc= 0 USER MOD Single : A 246 ASN : amide:sc= -0.0744 X(o=-0.074,f=-0.18) USER MOD Single : A 247 THR OG1 : rot 180:sc= 0.0848 USER MOD Single : A 251 SER OG : rot 180:sc= -0.289 USER MOD ----------------------------------------------------------------- ATOM 39 N ILE A 114 -5.313 12.014 9.449 1.00 3.29 N ATOM 40 CA ILE A 114 -5.638 11.791 8.046 1.00 2.93 C ATOM 41 C ILE A 114 -6.866 10.899 7.900 1.00 2.37 C ATOM 42 O ILE A 114 -7.518 10.555 8.887 1.00 2.55 O ATOM 43 CB ILE A 114 -4.459 11.149 7.290 1.00 3.31 C ATOM 44 CG1 ILE A 114 -4.209 9.729 7.802 1.00 4.11 C ATOM 45 CG2 ILE A 114 -3.207 12.000 7.441 1.00 3.57 C ATOM 46 CD1 ILE A 114 -4.495 8.657 6.774 1.00 5.70 C ATOM 0 HA ILE A 114 -5.849 12.769 7.613 1.00 2.93 H new ATOM 0 HB ILE A 114 -4.712 11.094 6.231 1.00 3.31 H new ATOM 0 HG12 ILE A 114 -3.171 9.645 8.124 1.00 4.11 H new ATOM 0 HG13 ILE A 114 -4.830 9.554 8.680 1.00 4.11 H new ATOM 0 HG21 ILE A 114 -2.383 11.534 6.902 1.00 3.57 H new ATOM 0 HG22 ILE A 114 -3.391 12.994 7.033 1.00 3.57 H new ATOM 0 HG23 ILE A 114 -2.949 12.083 8.497 1.00 3.57 H new ATOM 0 HD11 ILE A 114 -4.296 7.676 7.206 1.00 5.70 H new ATOM 0 HD12 ILE A 114 -5.540 8.714 6.470 1.00 5.70 H new ATOM 0 HD13 ILE A 114 -3.855 8.807 5.904 1.00 5.70 H new ATOM 58 N THR A 115 -7.177 10.526 6.663 1.00 2.27 N ATOM 59 CA THR A 115 -8.326 9.674 6.387 1.00 1.99 C ATOM 60 C THR A 115 -7.924 8.460 5.558 1.00 1.96 C ATOM 61 O THR A 115 -6.952 8.506 4.804 1.00 2.57 O ATOM 62 CB THR A 115 -9.433 10.446 5.644 1.00 2.73 C ATOM 63 OG1 THR A 115 -9.039 10.682 4.288 1.00 3.64 O ATOM 64 CG2 THR A 115 -9.724 11.771 6.332 1.00 3.50 C ATOM 0 H THR A 115 -6.648 10.801 5.835 1.00 2.27 H new ATOM 0 HA THR A 115 -8.711 9.341 7.351 1.00 1.99 H new ATOM 0 HB THR A 115 -10.340 9.842 5.658 1.00 2.73 H new ATOM 0 HG1 THR A 115 -9.748 11.172 3.822 1.00 3.64 H new ATOM 0 HG21 THR A 115 -10.509 12.298 5.789 1.00 3.50 H new ATOM 0 HG22 THR A 115 -10.052 11.586 7.355 1.00 3.50 H new ATOM 0 HG23 THR A 115 -8.820 12.380 6.345 1.00 3.50 H new ATOM 72 N TYR A 116 -8.678 7.376 5.700 1.00 2.14 N ATOM 73 CA TYR A 116 -8.399 6.148 4.965 1.00 2.66 C ATOM 74 C TYR A 116 -9.606 5.724 4.134 1.00 2.49 C ATOM 75 O TYR A 116 -10.727 5.650 4.640 1.00 2.97 O ATOM 76 CB TYR A 116 -8.011 5.027 5.930 1.00 3.97 C ATOM 77 CG TYR A 116 -9.148 4.570 6.816 1.00 4.95 C ATOM 78 CD1 TYR A 116 -9.464 5.253 7.983 1.00 5.79 C ATOM 79 CD2 TYR A 116 -9.907 3.455 6.483 1.00 5.83 C ATOM 80 CE1 TYR A 116 -10.501 4.838 8.795 1.00 7.20 C ATOM 81 CE2 TYR A 116 -10.948 3.033 7.289 1.00 7.09 C ATOM 82 CZ TYR A 116 -11.240 3.728 8.444 1.00 7.69 C ATOM 83 OH TYR A 116 -12.276 3.312 9.249 1.00 9.23 O ATOM 0 H TYR A 116 -9.488 7.323 6.318 1.00 2.14 H new ATOM 0 HA TYR A 116 -7.565 6.341 4.290 1.00 2.66 H new ATOM 0 HB2 TYR A 116 -7.644 4.176 5.356 1.00 3.97 H new ATOM 0 HB3 TYR A 116 -7.187 5.368 6.557 1.00 3.97 H new ATOM 0 HD1 TYR A 116 -8.889 6.124 8.260 1.00 5.79 H new ATOM 0 HD2 TYR A 116 -9.680 2.909 5.579 1.00 5.83 H new ATOM 0 HE1 TYR A 116 -10.732 5.380 9.700 1.00 7.20 H new ATOM 0 HE2 TYR A 116 -11.529 2.164 7.016 1.00 7.09 H new ATOM 0 HH TYR A 116 -12.695 2.517 8.858 1.00 9.23 H new ATOM 93 N ARG A 117 -9.369 5.446 2.857 1.00 2.39 N ATOM 94 CA ARG A 117 -10.436 5.029 1.955 1.00 2.34 C ATOM 95 C ARG A 117 -9.868 4.300 0.740 1.00 2.62 C ATOM 96 O ARG A 117 -8.788 4.635 0.253 1.00 3.08 O ATOM 97 CB ARG A 117 -11.251 6.241 1.500 1.00 2.23 C ATOM 98 CG ARG A 117 -12.743 5.970 1.402 1.00 3.03 C ATOM 99 CD ARG A 117 -13.239 6.095 -0.030 1.00 3.65 C ATOM 100 NE ARG A 117 -14.692 6.224 -0.097 1.00 4.67 N ATOM 101 CZ ARG A 117 -15.526 5.193 -0.016 1.00 5.47 C ATOM 102 NH1 ARG A 117 -15.053 3.964 0.135 1.00 5.73 N ATOM 103 NH2 ARG A 117 -16.837 5.391 -0.084 1.00 6.58 N ATOM 0 H ARG A 117 -8.448 5.502 2.423 1.00 2.39 H new ATOM 0 HA ARG A 117 -11.088 4.344 2.497 1.00 2.34 H new ATOM 0 HB2 ARG A 117 -11.085 7.062 2.197 1.00 2.23 H new ATOM 0 HB3 ARG A 117 -10.885 6.569 0.527 1.00 2.23 H new ATOM 0 HG2 ARG A 117 -12.957 4.969 1.776 1.00 3.03 H new ATOM 0 HG3 ARG A 117 -13.284 6.671 2.038 1.00 3.03 H new ATOM 0 HD2 ARG A 117 -12.776 6.963 -0.499 1.00 3.65 H new ATOM 0 HD3 ARG A 117 -12.926 5.220 -0.600 1.00 3.65 H new ATOM 0 HE ARG A 117 -15.088 7.157 -0.212 1.00 4.67 H new ATOM 0 HH11 ARG A 117 -14.046 3.808 0.189 1.00 5.73 H new ATOM 0 HH12 ARG A 117 -15.696 3.174 0.197 1.00 5.73 H new ATOM 0 HH21 ARG A 117 -17.205 6.335 -0.199 1.00 6.58 H new ATOM 0 HH22 ARG A 117 -17.476 4.599 -0.022 1.00 6.58 H new ATOM 117 N ILE A 118 -10.602 3.303 0.258 1.00 3.04 N ATOM 118 CA ILE A 118 -10.172 2.528 -0.899 1.00 3.52 C ATOM 119 C ILE A 118 -11.299 2.387 -1.916 1.00 3.25 C ATOM 120 O ILE A 118 -12.176 1.536 -1.771 1.00 3.99 O ATOM 121 CB ILE A 118 -9.687 1.126 -0.488 1.00 4.99 C ATOM 122 CG1 ILE A 118 -10.686 0.478 0.474 1.00 6.07 C ATOM 123 CG2 ILE A 118 -8.307 1.207 0.149 1.00 5.77 C ATOM 124 CD1 ILE A 118 -11.064 -0.935 0.090 1.00 7.23 C ATOM 0 H ILE A 118 -11.497 3.013 0.651 1.00 3.04 H new ATOM 0 HA ILE A 118 -9.343 3.071 -1.353 1.00 3.52 H new ATOM 0 HB ILE A 118 -9.617 0.506 -1.382 1.00 4.99 H new ATOM 0 HG12 ILE A 118 -10.260 0.472 1.477 1.00 6.07 H new ATOM 0 HG13 ILE A 118 -11.588 1.089 0.514 1.00 6.07 H new ATOM 0 HG21 ILE A 118 -7.979 0.207 0.434 1.00 5.77 H new ATOM 0 HG22 ILE A 118 -7.601 1.631 -0.565 1.00 5.77 H new ATOM 0 HG23 ILE A 118 -8.352 1.840 1.035 1.00 5.77 H new ATOM 0 HD11 ILE A 118 -11.774 -1.331 0.815 1.00 7.23 H new ATOM 0 HD12 ILE A 118 -11.519 -0.933 -0.900 1.00 7.23 H new ATOM 0 HD13 ILE A 118 -10.171 -1.560 0.078 1.00 7.23 H new ATOM 136 N ASN A 119 -11.268 3.226 -2.947 1.00 3.22 N ATOM 137 CA ASN A 119 -12.287 3.193 -3.990 1.00 3.80 C ATOM 138 C ASN A 119 -11.669 2.851 -5.342 1.00 3.37 C ATOM 139 O ASN A 119 -12.200 3.220 -6.389 1.00 4.12 O ATOM 140 CB ASN A 119 -13.006 4.541 -4.071 1.00 4.96 C ATOM 141 CG ASN A 119 -14.305 4.457 -4.849 1.00 6.21 C ATOM 142 OD1 ASN A 119 -14.349 4.763 -6.041 1.00 6.85 O ATOM 143 ND2 ASN A 119 -15.371 4.041 -4.176 1.00 7.14 N ATOM 0 H ASN A 119 -10.549 3.936 -3.082 1.00 3.22 H new ATOM 0 HA ASN A 119 -13.010 2.418 -3.734 1.00 3.80 H new ATOM 0 HB2 ASN A 119 -13.212 4.901 -3.063 1.00 4.96 H new ATOM 0 HB3 ASN A 119 -12.350 5.272 -4.543 1.00 4.96 H new ATOM 0 HD21 ASN A 119 -16.273 3.964 -4.646 1.00 7.14 H new ATOM 0 HD22 ASN A 119 -15.288 3.798 -3.189 1.00 7.14 H new ATOM 150 N ASN A 120 -10.546 2.142 -5.311 1.00 2.67 N ATOM 151 CA ASN A 120 -9.856 1.749 -6.535 1.00 2.50 C ATOM 152 C ASN A 120 -10.309 0.366 -6.995 1.00 2.25 C ATOM 153 O ASN A 120 -9.490 -0.529 -7.204 1.00 2.92 O ATOM 154 CB ASN A 120 -8.342 1.755 -6.316 1.00 3.23 C ATOM 155 CG ASN A 120 -7.569 1.628 -7.614 1.00 4.24 C ATOM 156 OD1 ASN A 120 -8.092 1.916 -8.691 1.00 4.64 O ATOM 157 ND2 ASN A 120 -6.317 1.195 -7.518 1.00 5.34 N ATOM 0 H ASN A 120 -10.094 1.828 -4.452 1.00 2.67 H new ATOM 0 HA ASN A 120 -10.107 2.471 -7.312 1.00 2.50 H new ATOM 0 HB2 ASN A 120 -8.054 2.679 -5.814 1.00 3.23 H new ATOM 0 HB3 ASN A 120 -8.070 0.934 -5.653 1.00 3.23 H new ATOM 0 HD21 ASN A 120 -5.748 1.090 -8.358 1.00 5.34 H new ATOM 0 HD22 ASN A 120 -5.925 0.968 -6.604 1.00 5.34 H new ATOM 164 N TYR A 121 -11.618 0.200 -7.150 1.00 2.04 N ATOM 165 CA TYR A 121 -12.180 -1.073 -7.583 1.00 2.59 C ATOM 166 C TYR A 121 -11.692 -1.437 -8.982 1.00 2.58 C ATOM 167 O TYR A 121 -12.056 -0.794 -9.968 1.00 2.71 O ATOM 168 CB TYR A 121 -13.708 -1.013 -7.565 1.00 3.43 C ATOM 169 CG TYR A 121 -14.291 -0.856 -6.178 1.00 2.57 C ATOM 170 CD1 TYR A 121 -14.063 -1.811 -5.195 1.00 2.81 C ATOM 171 CD2 TYR A 121 -15.069 0.247 -5.851 1.00 3.53 C ATOM 172 CE1 TYR A 121 -14.594 -1.673 -3.928 1.00 3.79 C ATOM 173 CE2 TYR A 121 -15.604 0.395 -4.586 1.00 4.12 C ATOM 174 CZ TYR A 121 -15.364 -0.568 -3.628 1.00 4.18 C ATOM 175 OH TYR A 121 -15.893 -0.426 -2.366 1.00 5.72 O ATOM 0 H TYR A 121 -12.309 0.931 -6.982 1.00 2.04 H new ATOM 0 HA TYR A 121 -11.845 -1.843 -6.888 1.00 2.59 H new ATOM 0 HB2 TYR A 121 -14.038 -0.180 -8.185 1.00 3.43 H new ATOM 0 HB3 TYR A 121 -14.104 -1.923 -8.016 1.00 3.43 H new ATOM 0 HD1 TYR A 121 -13.460 -2.677 -5.426 1.00 2.81 H new ATOM 0 HD2 TYR A 121 -15.259 1.002 -6.599 1.00 3.53 H new ATOM 0 HE1 TYR A 121 -14.408 -2.426 -3.176 1.00 3.79 H new ATOM 0 HE2 TYR A 121 -16.206 1.259 -4.349 1.00 4.12 H new ATOM 0 HH TYR A 121 -16.408 0.406 -2.319 1.00 5.72 H new ATOM 185 N THR A 122 -10.863 -2.474 -9.062 1.00 2.67 N ATOM 186 CA THR A 122 -10.323 -2.924 -10.338 1.00 2.78 C ATOM 187 C THR A 122 -10.739 -4.360 -10.635 1.00 2.73 C ATOM 188 O THR A 122 -10.899 -5.184 -9.735 1.00 2.76 O ATOM 189 CB THR A 122 -8.785 -2.832 -10.362 1.00 3.14 C ATOM 190 OG1 THR A 122 -8.260 -3.677 -11.391 1.00 3.58 O ATOM 191 CG2 THR A 122 -8.198 -3.235 -9.018 1.00 3.14 C ATOM 0 H THR A 122 -10.551 -3.018 -8.257 1.00 2.67 H new ATOM 0 HA THR A 122 -10.731 -2.264 -11.104 1.00 2.78 H new ATOM 0 HB THR A 122 -8.508 -1.798 -10.566 1.00 3.14 H new ATOM 0 HG1 THR A 122 -7.282 -3.612 -11.401 1.00 3.58 H new ATOM 0 HG21 THR A 122 -7.111 -3.162 -9.059 1.00 3.14 H new ATOM 0 HG22 THR A 122 -8.577 -2.571 -8.241 1.00 3.14 H new ATOM 0 HG23 THR A 122 -8.484 -4.261 -8.789 1.00 3.14 H new ATOM 199 N PRO A 123 -10.918 -4.670 -11.928 1.00 2.85 N ATOM 200 CA PRO A 123 -11.316 -6.009 -12.373 1.00 3.08 C ATOM 201 C PRO A 123 -10.209 -7.038 -12.179 1.00 3.35 C ATOM 202 O PRO A 123 -9.518 -7.409 -13.129 1.00 4.37 O ATOM 203 CB PRO A 123 -11.610 -5.814 -13.863 1.00 3.22 C ATOM 204 CG PRO A 123 -10.790 -4.636 -14.260 1.00 3.16 C ATOM 205 CD PRO A 123 -10.744 -3.738 -13.054 1.00 2.97 C ATOM 0 HA PRO A 123 -12.162 -6.393 -11.803 1.00 3.08 H new ATOM 0 HB2 PRO A 123 -11.338 -6.698 -14.439 1.00 3.22 H new ATOM 0 HB3 PRO A 123 -12.671 -5.635 -14.037 1.00 3.22 H new ATOM 0 HG2 PRO A 123 -9.787 -4.941 -14.558 1.00 3.16 H new ATOM 0 HG3 PRO A 123 -11.233 -4.122 -15.113 1.00 3.16 H new ATOM 0 HD2 PRO A 123 -9.798 -3.201 -12.989 1.00 2.97 H new ATOM 0 HD3 PRO A 123 -11.535 -2.988 -13.081 1.00 2.97 H new ATOM 213 N ASP A 124 -10.044 -7.497 -10.943 1.00 2.96 N ATOM 214 CA ASP A 124 -9.020 -8.485 -10.624 1.00 3.43 C ATOM 215 C ASP A 124 -9.567 -9.547 -9.675 1.00 3.45 C ATOM 216 O ASP A 124 -9.285 -10.735 -9.829 1.00 4.22 O ATOM 217 CB ASP A 124 -7.801 -7.805 -10.000 1.00 3.68 C ATOM 218 CG ASP A 124 -8.095 -7.236 -8.626 1.00 3.97 C ATOM 219 OD1 ASP A 124 -9.177 -6.637 -8.451 1.00 4.66 O ATOM 220 OD2 ASP A 124 -7.245 -7.392 -7.725 1.00 4.68 O ATOM 0 H ASP A 124 -10.607 -7.200 -10.145 1.00 2.96 H new ATOM 0 HA ASP A 124 -8.719 -8.972 -11.551 1.00 3.43 H new ATOM 0 HB2 ASP A 124 -6.986 -8.525 -9.925 1.00 3.68 H new ATOM 0 HB3 ASP A 124 -7.460 -7.004 -10.656 1.00 3.68 H new ATOM 225 N MET A 125 -10.350 -9.110 -8.694 1.00 3.05 N ATOM 226 CA MET A 125 -10.936 -10.024 -7.720 1.00 3.09 C ATOM 227 C MET A 125 -12.332 -9.563 -7.314 1.00 2.95 C ATOM 228 O MET A 125 -12.827 -8.548 -7.803 1.00 2.89 O ATOM 229 CB MET A 125 -10.041 -10.128 -6.483 1.00 3.21 C ATOM 230 CG MET A 125 -9.208 -11.398 -6.442 1.00 3.85 C ATOM 231 SD MET A 125 -9.933 -12.670 -5.388 1.00 3.32 S ATOM 232 CE MET A 125 -9.937 -11.835 -3.804 1.00 3.90 C ATOM 0 H MET A 125 -10.593 -8.130 -8.552 1.00 3.05 H new ATOM 0 HA MET A 125 -11.017 -11.007 -8.184 1.00 3.09 H new ATOM 0 HB2 MET A 125 -9.375 -9.265 -6.452 1.00 3.21 H new ATOM 0 HB3 MET A 125 -10.663 -10.082 -5.589 1.00 3.21 H new ATOM 0 HG2 MET A 125 -9.098 -11.789 -7.454 1.00 3.85 H new ATOM 0 HG3 MET A 125 -8.207 -11.160 -6.082 1.00 3.85 H new ATOM 0 HE1 MET A 125 -10.012 -12.572 -3.004 1.00 3.90 H new ATOM 0 HE2 MET A 125 -9.013 -11.268 -3.689 1.00 3.90 H new ATOM 0 HE3 MET A 125 -10.788 -11.156 -3.753 1.00 3.90 H new ATOM 242 N ASN A 126 -12.962 -10.316 -6.418 1.00 3.06 N ATOM 243 CA ASN A 126 -14.302 -9.984 -5.948 1.00 3.08 C ATOM 244 C ASN A 126 -14.302 -8.657 -5.195 1.00 2.74 C ATOM 245 O ASN A 126 -13.455 -8.422 -4.333 1.00 2.52 O ATOM 246 CB ASN A 126 -14.838 -11.096 -5.044 1.00 3.37 C ATOM 247 CG ASN A 126 -16.006 -11.835 -5.667 1.00 3.86 C ATOM 248 OD1 ASN A 126 -17.103 -11.869 -5.108 1.00 3.66 O ATOM 249 ND2 ASN A 126 -15.776 -12.432 -6.830 1.00 5.12 N ATOM 0 H ASN A 126 -12.566 -11.160 -6.003 1.00 3.06 H new ATOM 0 HA ASN A 126 -14.951 -9.887 -6.818 1.00 3.08 H new ATOM 0 HB2 ASN A 126 -14.037 -11.803 -4.829 1.00 3.37 H new ATOM 0 HB3 ASN A 126 -15.149 -10.668 -4.091 1.00 3.37 H new ATOM 0 HD21 ASN A 126 -16.524 -12.945 -7.297 1.00 5.12 H new ATOM 0 HD22 ASN A 126 -14.851 -12.378 -7.257 1.00 5.12 H new ATOM 256 N ARG A 127 -15.257 -7.795 -5.526 1.00 2.80 N ATOM 257 CA ARG A 127 -15.366 -6.492 -4.881 1.00 2.65 C ATOM 258 C ARG A 127 -15.719 -6.643 -3.404 1.00 2.58 C ATOM 259 O ARG A 127 -15.329 -5.821 -2.576 1.00 2.41 O ATOM 260 CB ARG A 127 -16.425 -5.639 -5.584 1.00 3.02 C ATOM 261 CG ARG A 127 -16.206 -5.510 -7.083 1.00 4.41 C ATOM 262 CD ARG A 127 -17.398 -4.857 -7.765 1.00 4.75 C ATOM 263 NE ARG A 127 -17.414 -5.114 -9.203 1.00 6.49 N ATOM 264 CZ ARG A 127 -18.495 -4.975 -9.962 1.00 6.87 C ATOM 265 NH1 ARG A 127 -19.642 -4.583 -9.423 1.00 5.81 N ATOM 266 NH2 ARG A 127 -18.430 -5.228 -11.263 1.00 8.66 N ATOM 0 H ARG A 127 -15.966 -7.975 -6.237 1.00 2.80 H new ATOM 0 HA ARG A 127 -14.399 -5.995 -4.956 1.00 2.65 H new ATOM 0 HB2 ARG A 127 -17.408 -6.075 -5.405 1.00 3.02 H new ATOM 0 HB3 ARG A 127 -16.432 -4.644 -5.139 1.00 3.02 H new ATOM 0 HG2 ARG A 127 -15.309 -4.920 -7.271 1.00 4.41 H new ATOM 0 HG3 ARG A 127 -16.035 -6.497 -7.513 1.00 4.41 H new ATOM 0 HD2 ARG A 127 -18.320 -5.231 -7.320 1.00 4.75 H new ATOM 0 HD3 ARG A 127 -17.372 -3.782 -7.589 1.00 4.75 H new ATOM 0 HE ARG A 127 -16.548 -5.417 -9.648 1.00 6.49 H new ATOM 0 HH11 ARG A 127 -19.695 -4.388 -8.423 1.00 5.81 H new ATOM 0 HH12 ARG A 127 -20.471 -4.477 -10.008 1.00 5.81 H new ATOM 0 HH21 ARG A 127 -17.550 -5.529 -11.681 1.00 8.66 H new ATOM 0 HH22 ARG A 127 -19.260 -5.121 -11.845 1.00 8.66 H new ATOM 280 N GLU A 128 -16.459 -7.700 -3.083 1.00 2.86 N ATOM 281 CA GLU A 128 -16.864 -7.958 -1.706 1.00 2.90 C ATOM 282 C GLU A 128 -15.722 -8.584 -0.911 1.00 2.60 C ATOM 283 O GLU A 128 -15.600 -8.368 0.295 1.00 2.56 O ATOM 284 CB GLU A 128 -18.086 -8.877 -1.675 1.00 3.31 C ATOM 285 CG GLU A 128 -18.818 -8.871 -0.343 1.00 3.36 C ATOM 286 CD GLU A 128 -20.158 -9.579 -0.411 1.00 4.05 C ATOM 287 OE1 GLU A 128 -20.562 -9.980 -1.522 1.00 4.92 O ATOM 288 OE2 GLU A 128 -20.802 -9.732 0.649 1.00 4.21 O ATOM 0 H GLU A 128 -16.790 -8.391 -3.757 1.00 2.86 H new ATOM 0 HA GLU A 128 -17.124 -7.005 -1.246 1.00 2.90 H new ATOM 0 HB2 GLU A 128 -18.778 -8.575 -2.461 1.00 3.31 H new ATOM 0 HB3 GLU A 128 -17.770 -9.895 -1.902 1.00 3.31 H new ATOM 0 HG2 GLU A 128 -18.195 -9.351 0.412 1.00 3.36 H new ATOM 0 HG3 GLU A 128 -18.971 -7.841 -0.021 1.00 3.36 H new ATOM 295 N ASP A 129 -14.889 -9.360 -1.595 1.00 2.51 N ATOM 296 CA ASP A 129 -13.756 -10.018 -0.954 1.00 2.31 C ATOM 297 C ASP A 129 -12.589 -9.050 -0.787 1.00 2.05 C ATOM 298 O ASP A 129 -12.057 -8.886 0.311 1.00 1.87 O ATOM 299 CB ASP A 129 -13.315 -11.233 -1.772 1.00 2.48 C ATOM 300 CG ASP A 129 -14.121 -12.474 -1.445 1.00 2.96 C ATOM 301 OD1 ASP A 129 -15.323 -12.508 -1.783 1.00 3.92 O ATOM 302 OD2 ASP A 129 -13.550 -13.413 -0.853 1.00 3.43 O ATOM 0 H ASP A 129 -14.977 -9.549 -2.593 1.00 2.51 H new ATOM 0 HA ASP A 129 -14.072 -10.351 0.035 1.00 2.31 H new ATOM 0 HB2 ASP A 129 -13.414 -11.008 -2.834 1.00 2.48 H new ATOM 0 HB3 ASP A 129 -12.259 -11.429 -1.585 1.00 2.48 H new ATOM 307 N VAL A 130 -12.194 -8.412 -1.884 1.00 2.16 N ATOM 308 CA VAL A 130 -11.090 -7.460 -1.860 1.00 2.01 C ATOM 309 C VAL A 130 -11.324 -6.374 -0.815 1.00 1.93 C ATOM 310 O VAL A 130 -10.413 -6.004 -0.075 1.00 1.82 O ATOM 311 CB VAL A 130 -10.888 -6.799 -3.236 1.00 2.15 C ATOM 312 CG1 VAL A 130 -9.760 -5.780 -3.179 1.00 2.26 C ATOM 313 CG2 VAL A 130 -10.614 -7.853 -4.298 1.00 2.70 C ATOM 0 H VAL A 130 -12.622 -8.537 -2.801 1.00 2.16 H new ATOM 0 HA VAL A 130 -10.193 -8.022 -1.601 1.00 2.01 H new ATOM 0 HB VAL A 130 -11.805 -6.275 -3.506 1.00 2.15 H new ATOM 0 HG11 VAL A 130 -9.632 -5.323 -4.161 1.00 2.26 H new ATOM 0 HG12 VAL A 130 -10.003 -5.008 -2.449 1.00 2.26 H new ATOM 0 HG13 VAL A 130 -8.835 -6.277 -2.887 1.00 2.26 H new ATOM 0 HG21 VAL A 130 -10.474 -7.368 -5.264 1.00 2.70 H new ATOM 0 HG22 VAL A 130 -9.713 -8.408 -4.036 1.00 2.70 H new ATOM 0 HG23 VAL A 130 -11.459 -8.539 -4.356 1.00 2.70 H new ATOM 323 N ASP A 131 -12.551 -5.867 -0.761 1.00 2.09 N ATOM 324 CA ASP A 131 -12.906 -4.824 0.194 1.00 2.15 C ATOM 325 C ASP A 131 -12.498 -5.221 1.609 1.00 2.10 C ATOM 326 O ASP A 131 -12.185 -4.367 2.439 1.00 2.20 O ATOM 327 CB ASP A 131 -14.409 -4.545 0.142 1.00 2.42 C ATOM 328 CG ASP A 131 -14.892 -3.752 1.340 1.00 2.56 C ATOM 329 OD1 ASP A 131 -14.698 -2.518 1.351 1.00 2.74 O ATOM 330 OD2 ASP A 131 -15.463 -4.365 2.266 1.00 3.75 O ATOM 0 H ASP A 131 -13.316 -6.162 -1.368 1.00 2.09 H new ATOM 0 HA ASP A 131 -12.367 -3.917 -0.079 1.00 2.15 H new ATOM 0 HB2 ASP A 131 -14.643 -3.997 -0.771 1.00 2.42 H new ATOM 0 HB3 ASP A 131 -14.950 -5.490 0.094 1.00 2.42 H new ATOM 335 N TYR A 132 -12.505 -6.522 1.878 1.00 2.08 N ATOM 336 CA TYR A 132 -12.139 -7.032 3.194 1.00 2.10 C ATOM 337 C TYR A 132 -10.623 -7.108 3.347 1.00 1.95 C ATOM 338 O TYR A 132 -10.059 -6.589 4.310 1.00 1.97 O ATOM 339 CB TYR A 132 -12.755 -8.415 3.417 1.00 2.26 C ATOM 340 CG TYR A 132 -13.223 -8.647 4.836 1.00 2.45 C ATOM 341 CD1 TYR A 132 -14.344 -7.994 5.334 1.00 3.02 C ATOM 342 CD2 TYR A 132 -12.545 -9.521 5.677 1.00 3.28 C ATOM 343 CE1 TYR A 132 -14.775 -8.203 6.630 1.00 3.32 C ATOM 344 CE2 TYR A 132 -12.970 -9.737 6.974 1.00 3.70 C ATOM 345 CZ TYR A 132 -14.084 -9.075 7.446 1.00 3.29 C ATOM 346 OH TYR A 132 -14.511 -9.287 8.737 1.00 3.82 O ATOM 0 H TYR A 132 -12.760 -7.242 1.202 1.00 2.08 H new ATOM 0 HA TYR A 132 -12.527 -6.343 3.944 1.00 2.10 H new ATOM 0 HB2 TYR A 132 -13.600 -8.541 2.739 1.00 2.26 H new ATOM 0 HB3 TYR A 132 -12.021 -9.177 3.156 1.00 2.26 H new ATOM 0 HD1 TYR A 132 -14.887 -7.312 4.697 1.00 3.02 H new ATOM 0 HD2 TYR A 132 -11.671 -10.040 5.311 1.00 3.28 H new ATOM 0 HE1 TYR A 132 -15.648 -7.687 7.002 1.00 3.32 H new ATOM 0 HE2 TYR A 132 -12.433 -10.421 7.615 1.00 3.70 H new ATOM 0 HH TYR A 132 -13.916 -9.930 9.177 1.00 3.82 H new ATOM 356 N ALA A 133 -9.970 -7.758 2.389 1.00 1.90 N ATOM 357 CA ALA A 133 -8.520 -7.900 2.415 1.00 1.86 C ATOM 358 C ALA A 133 -7.836 -6.538 2.465 1.00 1.79 C ATOM 359 O ALA A 133 -6.971 -6.298 3.308 1.00 1.86 O ATOM 360 CB ALA A 133 -8.045 -8.687 1.202 1.00 1.92 C ATOM 0 H ALA A 133 -10.422 -8.194 1.586 1.00 1.90 H new ATOM 0 HA ALA A 133 -8.249 -8.447 3.318 1.00 1.86 H new ATOM 0 HB1 ALA A 133 -6.960 -8.785 1.234 1.00 1.92 H new ATOM 0 HB2 ALA A 133 -8.500 -9.678 1.210 1.00 1.92 H new ATOM 0 HB3 ALA A 133 -8.335 -8.162 0.292 1.00 1.92 H new ATOM 366 N ILE A 134 -8.227 -5.650 1.557 1.00 1.78 N ATOM 367 CA ILE A 134 -7.652 -4.312 1.499 1.00 1.84 C ATOM 368 C ILE A 134 -7.746 -3.614 2.851 1.00 1.90 C ATOM 369 O ILE A 134 -6.879 -2.818 3.211 1.00 1.96 O ATOM 370 CB ILE A 134 -8.350 -3.445 0.435 1.00 1.92 C ATOM 371 CG1 ILE A 134 -8.159 -4.052 -0.956 1.00 2.36 C ATOM 372 CG2 ILE A 134 -7.814 -2.022 0.477 1.00 2.25 C ATOM 373 CD1 ILE A 134 -6.719 -4.060 -1.419 1.00 2.43 C ATOM 0 H ILE A 134 -8.940 -5.833 0.851 1.00 1.78 H new ATOM 0 HA ILE A 134 -6.603 -4.431 1.227 1.00 1.84 H new ATOM 0 HB ILE A 134 -9.417 -3.417 0.654 1.00 1.92 H new ATOM 0 HG12 ILE A 134 -8.537 -5.074 -0.952 1.00 2.36 H new ATOM 0 HG13 ILE A 134 -8.760 -3.493 -1.673 1.00 2.36 H new ATOM 0 HG21 ILE A 134 -8.317 -1.421 -0.281 1.00 2.25 H new ATOM 0 HG22 ILE A 134 -7.998 -1.593 1.462 1.00 2.25 H new ATOM 0 HG23 ILE A 134 -6.742 -2.031 0.280 1.00 2.25 H new ATOM 0 HD11 ILE A 134 -6.659 -4.504 -2.413 1.00 2.43 H new ATOM 0 HD12 ILE A 134 -6.343 -3.038 -1.455 1.00 2.43 H new ATOM 0 HD13 ILE A 134 -6.116 -4.644 -0.723 1.00 2.43 H new ATOM 385 N ARG A 135 -8.804 -3.919 3.596 1.00 1.95 N ATOM 386 CA ARG A 135 -9.011 -3.321 4.909 1.00 2.07 C ATOM 387 C ARG A 135 -7.935 -3.777 5.890 1.00 2.05 C ATOM 388 O ARG A 135 -7.514 -3.018 6.763 1.00 2.12 O ATOM 389 CB ARG A 135 -10.395 -3.688 5.447 1.00 2.25 C ATOM 390 CG ARG A 135 -11.172 -2.500 5.992 1.00 2.47 C ATOM 391 CD ARG A 135 -12.483 -2.936 6.627 1.00 2.86 C ATOM 392 NE ARG A 135 -13.638 -2.347 5.955 1.00 3.72 N ATOM 393 CZ ARG A 135 -14.030 -1.091 6.133 1.00 4.12 C ATOM 394 NH1 ARG A 135 -13.363 -0.294 6.956 1.00 4.14 N ATOM 395 NH2 ARG A 135 -15.092 -0.628 5.485 1.00 5.35 N ATOM 0 H ARG A 135 -9.530 -4.576 3.312 1.00 1.95 H new ATOM 0 HA ARG A 135 -8.945 -2.238 4.802 1.00 2.07 H new ATOM 0 HB2 ARG A 135 -10.973 -4.155 4.650 1.00 2.25 H new ATOM 0 HB3 ARG A 135 -10.283 -4.431 6.236 1.00 2.25 H new ATOM 0 HG2 ARG A 135 -10.566 -1.975 6.730 1.00 2.47 H new ATOM 0 HG3 ARG A 135 -11.374 -1.795 5.186 1.00 2.47 H new ATOM 0 HD2 ARG A 135 -12.559 -4.023 6.593 1.00 2.86 H new ATOM 0 HD3 ARG A 135 -12.490 -2.649 7.679 1.00 2.86 H new ATOM 0 HE ARG A 135 -14.173 -2.933 5.314 1.00 3.72 H new ATOM 0 HH11 ARG A 135 -12.546 -0.645 7.455 1.00 4.14 H new ATOM 0 HH12 ARG A 135 -13.667 0.670 7.090 1.00 4.14 H new ATOM 0 HH21 ARG A 135 -15.608 -1.237 4.850 1.00 5.35 H new ATOM 0 HH22 ARG A 135 -15.393 0.337 5.622 1.00 5.35 H new ATOM 409 N LYS A 136 -7.495 -5.022 5.741 1.00 2.03 N ATOM 410 CA LYS A 136 -6.468 -5.580 6.612 1.00 2.09 C ATOM 411 C LYS A 136 -5.119 -4.913 6.361 1.00 1.95 C ATOM 412 O LYS A 136 -4.265 -4.866 7.245 1.00 1.98 O ATOM 413 CB LYS A 136 -6.350 -7.090 6.394 1.00 2.22 C ATOM 414 CG LYS A 136 -7.679 -7.821 6.473 1.00 2.72 C ATOM 415 CD LYS A 136 -7.687 -8.843 7.597 1.00 2.82 C ATOM 416 CE LYS A 136 -9.091 -9.359 7.871 1.00 3.44 C ATOM 417 NZ LYS A 136 -9.313 -10.706 7.274 1.00 4.34 N ATOM 0 H LYS A 136 -7.834 -5.664 5.025 1.00 2.03 H new ATOM 0 HA LYS A 136 -6.761 -5.390 7.644 1.00 2.09 H new ATOM 0 HB2 LYS A 136 -5.901 -7.274 5.418 1.00 2.22 H new ATOM 0 HB3 LYS A 136 -5.672 -7.505 7.140 1.00 2.22 H new ATOM 0 HG2 LYS A 136 -8.483 -7.101 6.629 1.00 2.72 H new ATOM 0 HG3 LYS A 136 -7.878 -8.320 5.525 1.00 2.72 H new ATOM 0 HD2 LYS A 136 -7.036 -9.677 7.336 1.00 2.82 H new ATOM 0 HD3 LYS A 136 -7.281 -8.393 8.503 1.00 2.82 H new ATOM 0 HE2 LYS A 136 -9.257 -9.407 8.947 1.00 3.44 H new ATOM 0 HE3 LYS A 136 -9.821 -8.658 7.467 1.00 3.44 H new ATOM 0 HZ1 LYS A 136 -10.281 -11.023 7.483 1.00 4.34 H new ATOM 0 HZ2 LYS A 136 -9.180 -10.655 6.244 1.00 4.34 H new ATOM 0 HZ3 LYS A 136 -8.633 -11.381 7.678 1.00 4.34 H new ATOM 431 N ALA A 137 -4.936 -4.396 5.150 1.00 1.88 N ATOM 432 CA ALA A 137 -3.693 -3.728 4.784 1.00 1.84 C ATOM 433 C ALA A 137 -3.327 -2.654 5.803 1.00 1.78 C ATOM 434 O ALA A 137 -2.233 -2.667 6.367 1.00 1.84 O ATOM 435 CB ALA A 137 -3.810 -3.122 3.393 1.00 1.97 C ATOM 0 H ALA A 137 -5.633 -4.427 4.406 1.00 1.88 H new ATOM 0 HA ALA A 137 -2.897 -4.472 4.778 1.00 1.84 H new ATOM 0 HB1 ALA A 137 -2.875 -2.626 3.132 1.00 1.97 H new ATOM 0 HB2 ALA A 137 -4.017 -3.910 2.669 1.00 1.97 H new ATOM 0 HB3 ALA A 137 -4.622 -2.395 3.380 1.00 1.97 H new ATOM 441 N PHE A 138 -4.248 -1.725 6.033 1.00 1.85 N ATOM 442 CA PHE A 138 -4.021 -0.642 6.983 1.00 2.04 C ATOM 443 C PHE A 138 -3.862 -1.185 8.399 1.00 2.20 C ATOM 444 O PHE A 138 -3.091 -0.652 9.197 1.00 2.42 O ATOM 445 CB PHE A 138 -5.178 0.358 6.935 1.00 2.39 C ATOM 446 CG PHE A 138 -4.821 1.714 7.475 1.00 3.03 C ATOM 447 CD1 PHE A 138 -4.070 2.600 6.720 1.00 3.46 C ATOM 448 CD2 PHE A 138 -5.237 2.102 8.738 1.00 4.29 C ATOM 449 CE1 PHE A 138 -3.740 3.848 7.214 1.00 4.72 C ATOM 450 CE2 PHE A 138 -4.911 3.348 9.238 1.00 5.45 C ATOM 451 CZ PHE A 138 -4.161 4.222 8.475 1.00 5.56 C ATOM 0 H PHE A 138 -5.159 -1.700 5.575 1.00 1.85 H new ATOM 0 HA PHE A 138 -3.099 -0.134 6.702 1.00 2.04 H new ATOM 0 HB2 PHE A 138 -5.514 0.463 5.903 1.00 2.39 H new ATOM 0 HB3 PHE A 138 -6.017 -0.042 7.504 1.00 2.39 H new ATOM 0 HD1 PHE A 138 -3.738 2.312 5.733 1.00 3.46 H new ATOM 0 HD2 PHE A 138 -5.823 1.422 9.339 1.00 4.29 H new ATOM 0 HE1 PHE A 138 -3.154 4.529 6.615 1.00 4.72 H new ATOM 0 HE2 PHE A 138 -5.242 3.638 10.224 1.00 5.45 H new ATOM 0 HZ PHE A 138 -3.904 5.196 8.864 1.00 5.56 H new ATOM 461 N GLN A 139 -4.598 -2.250 8.704 1.00 2.24 N ATOM 462 CA GLN A 139 -4.540 -2.865 10.025 1.00 2.54 C ATOM 463 C GLN A 139 -3.144 -3.411 10.310 1.00 2.56 C ATOM 464 O GLN A 139 -2.756 -3.578 11.467 1.00 3.00 O ATOM 465 CB GLN A 139 -5.572 -3.988 10.133 1.00 2.84 C ATOM 466 CG GLN A 139 -6.303 -4.016 11.466 1.00 3.11 C ATOM 467 CD GLN A 139 -7.702 -4.589 11.352 1.00 3.86 C ATOM 468 OE1 GLN A 139 -8.307 -4.573 10.280 1.00 4.96 O ATOM 469 NE2 GLN A 139 -8.224 -5.101 12.461 1.00 4.01 N ATOM 0 H GLN A 139 -5.241 -2.704 8.055 1.00 2.24 H new ATOM 0 HA GLN A 139 -4.769 -2.099 10.766 1.00 2.54 H new ATOM 0 HB2 GLN A 139 -6.301 -3.879 9.330 1.00 2.84 H new ATOM 0 HB3 GLN A 139 -5.073 -4.945 9.982 1.00 2.84 H new ATOM 0 HG2 GLN A 139 -5.729 -4.608 12.179 1.00 3.11 H new ATOM 0 HG3 GLN A 139 -6.360 -3.004 11.866 1.00 3.11 H new ATOM 0 HE21 GLN A 139 -7.687 -5.093 13.328 1.00 4.01 H new ATOM 0 HE22 GLN A 139 -9.162 -5.502 12.445 1.00 4.01 H new ATOM 478 N VAL A 140 -2.395 -3.689 9.248 1.00 2.25 N ATOM 479 CA VAL A 140 -1.042 -4.216 9.385 1.00 2.42 C ATOM 480 C VAL A 140 -0.140 -3.232 10.121 1.00 2.41 C ATOM 481 O VAL A 140 0.489 -3.579 11.120 1.00 2.82 O ATOM 482 CB VAL A 140 -0.423 -4.534 8.011 1.00 2.26 C ATOM 483 CG1 VAL A 140 0.960 -5.145 8.177 1.00 2.79 C ATOM 484 CG2 VAL A 140 -1.332 -5.461 7.219 1.00 3.70 C ATOM 0 H VAL A 140 -2.702 -3.558 8.284 1.00 2.25 H new ATOM 0 HA VAL A 140 -1.118 -5.137 9.964 1.00 2.42 H new ATOM 0 HB VAL A 140 -0.318 -3.602 7.455 1.00 2.26 H new ATOM 0 HG11 VAL A 140 1.382 -5.363 7.196 1.00 2.79 H new ATOM 0 HG12 VAL A 140 1.607 -4.443 8.702 1.00 2.79 H new ATOM 0 HG13 VAL A 140 0.883 -6.068 8.752 1.00 2.79 H new ATOM 0 HG21 VAL A 140 -0.879 -5.675 6.251 1.00 3.70 H new ATOM 0 HG22 VAL A 140 -1.470 -6.392 7.769 1.00 3.70 H new ATOM 0 HG23 VAL A 140 -2.299 -4.981 7.069 1.00 3.70 H new ATOM 494 N TRP A 141 -0.083 -2.003 9.620 1.00 2.12 N ATOM 495 CA TRP A 141 0.742 -0.967 10.231 1.00 2.38 C ATOM 496 C TRP A 141 -0.003 -0.277 11.368 1.00 2.59 C ATOM 497 O TRP A 141 0.607 0.190 12.330 1.00 3.05 O ATOM 498 CB TRP A 141 1.164 0.063 9.182 1.00 2.33 C ATOM 499 CG TRP A 141 1.854 -0.544 7.998 1.00 2.81 C ATOM 500 CD1 TRP A 141 1.502 -0.406 6.685 1.00 2.97 C ATOM 501 CD2 TRP A 141 3.012 -1.384 8.019 1.00 4.07 C ATOM 502 NE1 TRP A 141 2.372 -1.111 5.889 1.00 4.05 N ATOM 503 CE2 TRP A 141 3.308 -1.719 6.683 1.00 4.64 C ATOM 504 CE3 TRP A 141 3.830 -1.885 9.036 1.00 5.15 C ATOM 505 CZ2 TRP A 141 4.386 -2.532 6.341 1.00 5.97 C ATOM 506 CZ3 TRP A 141 4.898 -2.692 8.695 1.00 6.46 C ATOM 507 CH2 TRP A 141 5.169 -3.009 7.357 1.00 6.78 C ATOM 0 H TRP A 141 -0.598 -1.700 8.793 1.00 2.12 H new ATOM 0 HA TRP A 141 1.633 -1.443 10.642 1.00 2.38 H new ATOM 0 HB2 TRP A 141 0.282 0.606 8.841 1.00 2.33 H new ATOM 0 HB3 TRP A 141 1.828 0.793 9.646 1.00 2.33 H new ATOM 0 HD1 TRP A 141 0.663 0.172 6.326 1.00 2.97 H new ATOM 0 HE1 TRP A 141 2.328 -1.172 4.872 1.00 4.05 H new ATOM 0 HE3 TRP A 141 3.630 -1.645 10.070 1.00 5.15 H new ATOM 0 HZ2 TRP A 141 4.597 -2.777 5.311 1.00 5.97 H new ATOM 0 HZ3 TRP A 141 5.535 -3.086 9.473 1.00 6.46 H new ATOM 0 HH2 TRP A 141 6.012 -3.642 7.123 1.00 6.78 H new ATOM 518 N SER A 142 -1.326 -0.216 11.251 1.00 2.37 N ATOM 519 CA SER A 142 -2.155 0.421 12.268 1.00 2.58 C ATOM 520 C SER A 142 -1.829 -0.125 13.655 1.00 2.86 C ATOM 521 O SER A 142 -1.910 0.591 14.651 1.00 3.07 O ATOM 522 CB SER A 142 -3.637 0.204 11.958 1.00 2.66 C ATOM 523 OG SER A 142 -4.458 0.881 12.894 1.00 2.73 O ATOM 0 H SER A 142 -1.847 -0.600 10.462 1.00 2.37 H new ATOM 0 HA SER A 142 -1.942 1.490 12.258 1.00 2.58 H new ATOM 0 HB2 SER A 142 -3.857 0.560 10.952 1.00 2.66 H new ATOM 0 HB3 SER A 142 -3.863 -0.862 11.975 1.00 2.66 H new ATOM 0 HG SER A 142 -5.400 0.728 12.673 1.00 2.73 H new ATOM 529 N ASN A 143 -1.459 -1.401 13.710 1.00 2.95 N ATOM 530 CA ASN A 143 -1.121 -2.045 14.973 1.00 3.31 C ATOM 531 C ASN A 143 -0.048 -1.255 15.717 1.00 3.19 C ATOM 532 O ASN A 143 0.035 -1.303 16.944 1.00 3.52 O ATOM 533 CB ASN A 143 -0.638 -3.476 14.727 1.00 3.56 C ATOM 534 CG ASN A 143 -1.626 -4.514 15.225 1.00 3.89 C ATOM 535 OD1 ASN A 143 -2.265 -4.331 16.261 1.00 3.93 O ATOM 536 ND2 ASN A 143 -1.754 -5.610 14.487 1.00 4.75 N ATOM 0 H ASN A 143 -1.386 -2.009 12.894 1.00 2.95 H new ATOM 0 HA ASN A 143 -2.020 -2.073 15.589 1.00 3.31 H new ATOM 0 HB2 ASN A 143 -0.470 -3.621 13.660 1.00 3.56 H new ATOM 0 HB3 ASN A 143 0.321 -3.623 15.224 1.00 3.56 H new ATOM 0 HD21 ASN A 143 -2.403 -6.344 14.772 1.00 4.75 H new ATOM 0 HD22 ASN A 143 -1.203 -5.719 13.635 1.00 4.75 H new ATOM 543 N VAL A 144 0.771 -0.528 14.965 1.00 2.85 N ATOM 544 CA VAL A 144 1.838 0.274 15.552 1.00 2.93 C ATOM 545 C VAL A 144 1.850 1.683 14.969 1.00 2.65 C ATOM 546 O VAL A 144 2.827 2.419 15.113 1.00 2.82 O ATOM 547 CB VAL A 144 3.217 -0.374 15.326 1.00 3.60 C ATOM 548 CG1 VAL A 144 3.284 -1.735 16.003 1.00 5.02 C ATOM 549 CG2 VAL A 144 3.512 -0.494 13.839 1.00 2.83 C ATOM 0 H VAL A 144 0.716 -0.478 13.948 1.00 2.85 H new ATOM 0 HA VAL A 144 1.641 0.328 16.623 1.00 2.93 H new ATOM 0 HB VAL A 144 3.978 0.266 15.773 1.00 3.60 H new ATOM 0 HG11 VAL A 144 4.265 -2.178 15.833 1.00 5.02 H new ATOM 0 HG12 VAL A 144 3.120 -1.617 17.074 1.00 5.02 H new ATOM 0 HG13 VAL A 144 2.515 -2.386 15.588 1.00 5.02 H new ATOM 0 HG21 VAL A 144 4.490 -0.954 13.698 1.00 2.83 H new ATOM 0 HG22 VAL A 144 2.749 -1.112 13.365 1.00 2.83 H new ATOM 0 HG23 VAL A 144 3.509 0.498 13.386 1.00 2.83 H new ATOM 559 N THR A 145 0.757 2.055 14.311 1.00 2.70 N ATOM 560 CA THR A 145 0.641 3.376 13.706 1.00 2.73 C ATOM 561 C THR A 145 -0.558 4.134 14.265 1.00 2.54 C ATOM 562 O THR A 145 -1.690 3.979 13.806 1.00 2.56 O ATOM 563 CB THR A 145 0.505 3.282 12.174 1.00 3.29 C ATOM 564 OG1 THR A 145 1.566 2.485 11.636 1.00 4.80 O ATOM 565 CG2 THR A 145 0.533 4.666 11.543 1.00 2.18 C ATOM 0 H THR A 145 -0.061 1.460 14.183 1.00 2.70 H new ATOM 0 HA THR A 145 1.555 3.917 13.950 1.00 2.73 H new ATOM 0 HB THR A 145 -0.452 2.814 11.944 1.00 3.29 H new ATOM 0 HG1 THR A 145 1.523 1.583 12.017 1.00 4.80 H new ATOM 0 HG21 THR A 145 0.436 4.575 10.461 1.00 2.18 H new ATOM 0 HG22 THR A 145 -0.293 5.260 11.933 1.00 2.18 H new ATOM 0 HG23 THR A 145 1.477 5.156 11.782 1.00 2.18 H new ATOM 573 N PRO A 146 -0.307 4.974 15.280 1.00 2.69 N ATOM 574 CA PRO A 146 -1.353 5.774 15.923 1.00 2.71 C ATOM 575 C PRO A 146 -1.882 6.876 15.012 1.00 2.66 C ATOM 576 O PRO A 146 -1.527 8.046 15.165 1.00 3.16 O ATOM 577 CB PRO A 146 -0.643 6.378 17.137 1.00 3.24 C ATOM 578 CG PRO A 146 0.797 6.408 16.756 1.00 3.52 C ATOM 579 CD PRO A 146 1.019 5.208 15.877 1.00 3.18 C ATOM 0 HA PRO A 146 -2.226 5.173 16.179 1.00 2.71 H new ATOM 0 HB2 PRO A 146 -1.016 7.379 17.356 1.00 3.24 H new ATOM 0 HB3 PRO A 146 -0.804 5.775 18.031 1.00 3.24 H new ATOM 0 HG2 PRO A 146 1.041 7.329 16.227 1.00 3.52 H new ATOM 0 HG3 PRO A 146 1.435 6.368 17.639 1.00 3.52 H new ATOM 0 HD2 PRO A 146 1.774 5.402 15.115 1.00 3.18 H new ATOM 0 HD3 PRO A 146 1.359 4.346 16.451 1.00 3.18 H new ATOM 587 N LEU A 147 -2.733 6.497 14.065 1.00 2.95 N ATOM 588 CA LEU A 147 -3.312 7.454 13.129 1.00 3.27 C ATOM 589 C LEU A 147 -4.756 7.775 13.501 1.00 3.08 C ATOM 590 O LEU A 147 -5.253 7.337 14.539 1.00 3.76 O ATOM 591 CB LEU A 147 -3.251 6.904 11.703 1.00 4.12 C ATOM 592 CG LEU A 147 -2.339 7.654 10.732 1.00 4.82 C ATOM 593 CD1 LEU A 147 -2.748 9.116 10.637 1.00 4.84 C ATOM 594 CD2 LEU A 147 -0.885 7.533 11.163 1.00 5.49 C ATOM 0 H LEU A 147 -3.037 5.534 13.925 1.00 2.95 H new ATOM 0 HA LEU A 147 -2.730 8.374 13.182 1.00 3.27 H new ATOM 0 HB2 LEU A 147 -2.923 5.866 11.749 1.00 4.12 H new ATOM 0 HB3 LEU A 147 -4.261 6.901 11.293 1.00 4.12 H new ATOM 0 HG LEU A 147 -2.443 7.203 9.745 1.00 4.82 H new ATOM 0 HD11 LEU A 147 -2.088 9.634 9.941 1.00 4.84 H new ATOM 0 HD12 LEU A 147 -3.776 9.184 10.281 1.00 4.84 H new ATOM 0 HD13 LEU A 147 -2.674 9.579 11.621 1.00 4.84 H new ATOM 0 HD21 LEU A 147 -0.251 8.073 10.460 1.00 5.49 H new ATOM 0 HD22 LEU A 147 -0.765 7.957 12.160 1.00 5.49 H new ATOM 0 HD23 LEU A 147 -0.596 6.482 11.178 1.00 5.49 H new ATOM 606 N LYS A 148 -5.426 8.541 12.647 1.00 2.64 N ATOM 607 CA LYS A 148 -6.815 8.918 12.883 1.00 2.75 C ATOM 608 C LYS A 148 -7.744 8.215 11.899 1.00 2.68 C ATOM 609 O LYS A 148 -7.525 8.252 10.688 1.00 2.65 O ATOM 610 CB LYS A 148 -6.980 10.435 12.763 1.00 3.08 C ATOM 611 CG LYS A 148 -7.559 11.084 14.008 1.00 3.66 C ATOM 612 CD LYS A 148 -6.706 10.801 15.233 1.00 4.16 C ATOM 613 CE LYS A 148 -6.978 11.801 16.345 1.00 5.37 C ATOM 614 NZ LYS A 148 -6.270 11.438 17.604 1.00 6.27 N ATOM 0 H LYS A 148 -5.029 8.913 11.784 1.00 2.64 H new ATOM 0 HA LYS A 148 -7.083 8.608 13.893 1.00 2.75 H new ATOM 0 HB2 LYS A 148 -6.009 10.882 12.549 1.00 3.08 H new ATOM 0 HB3 LYS A 148 -7.627 10.656 11.914 1.00 3.08 H new ATOM 0 HG2 LYS A 148 -7.634 12.161 13.857 1.00 3.66 H new ATOM 0 HG3 LYS A 148 -8.571 10.714 14.175 1.00 3.66 H new ATOM 0 HD2 LYS A 148 -6.907 9.792 15.593 1.00 4.16 H new ATOM 0 HD3 LYS A 148 -5.651 10.837 14.960 1.00 4.16 H new ATOM 0 HE2 LYS A 148 -6.663 12.794 16.025 1.00 5.37 H new ATOM 0 HE3 LYS A 148 -8.050 11.852 16.533 1.00 5.37 H new ATOM 0 HZ1 LYS A 148 -6.481 12.145 18.337 1.00 6.27 H new ATOM 0 HZ2 LYS A 148 -6.589 10.501 17.924 1.00 6.27 H new ATOM 0 HZ3 LYS A 148 -5.245 11.414 17.431 1.00 6.27 H new ATOM 628 N PHE A 149 -8.783 7.576 12.426 1.00 3.09 N ATOM 629 CA PHE A 149 -9.747 6.865 11.594 1.00 3.25 C ATOM 630 C PHE A 149 -11.002 7.705 11.376 1.00 3.34 C ATOM 631 O PHE A 149 -11.566 8.254 12.322 1.00 3.94 O ATOM 632 CB PHE A 149 -10.120 5.528 12.237 1.00 4.19 C ATOM 633 CG PHE A 149 -10.545 5.651 13.673 1.00 4.58 C ATOM 634 CD1 PHE A 149 -11.867 5.908 13.998 1.00 5.25 C ATOM 635 CD2 PHE A 149 -9.622 5.511 14.697 1.00 5.02 C ATOM 636 CE1 PHE A 149 -12.261 6.022 15.317 1.00 5.99 C ATOM 637 CE2 PHE A 149 -10.010 5.624 16.019 1.00 5.87 C ATOM 638 CZ PHE A 149 -11.331 5.879 16.329 1.00 6.22 C ATOM 0 H PHE A 149 -8.979 7.536 13.426 1.00 3.09 H new ATOM 0 HA PHE A 149 -9.284 6.678 10.625 1.00 3.25 H new ATOM 0 HB2 PHE A 149 -10.928 5.072 11.665 1.00 4.19 H new ATOM 0 HB3 PHE A 149 -9.266 4.854 12.176 1.00 4.19 H new ATOM 0 HD1 PHE A 149 -12.598 6.021 13.211 1.00 5.25 H new ATOM 0 HD2 PHE A 149 -8.588 5.311 14.460 1.00 5.02 H new ATOM 0 HE1 PHE A 149 -13.295 6.223 15.557 1.00 5.99 H new ATOM 0 HE2 PHE A 149 -9.281 5.513 16.808 1.00 5.87 H new ATOM 0 HZ PHE A 149 -11.637 5.967 17.361 1.00 6.22 H new ATOM 648 N SER A 150 -11.432 7.802 10.122 1.00 3.06 N ATOM 649 CA SER A 150 -12.617 8.578 9.778 1.00 3.43 C ATOM 650 C SER A 150 -13.136 8.194 8.396 1.00 3.36 C ATOM 651 O SER A 150 -12.377 8.133 7.429 1.00 3.19 O ATOM 652 CB SER A 150 -12.302 10.075 9.819 1.00 3.46 C ATOM 653 OG SER A 150 -13.478 10.849 9.656 1.00 4.02 O ATOM 0 H SER A 150 -10.977 7.353 9.327 1.00 3.06 H new ATOM 0 HA SER A 150 -13.392 8.356 10.512 1.00 3.43 H new ATOM 0 HB2 SER A 150 -11.828 10.324 10.768 1.00 3.46 H new ATOM 0 HB3 SER A 150 -11.589 10.321 9.032 1.00 3.46 H new ATOM 0 HG SER A 150 -13.250 11.802 9.688 1.00 4.02 H new ATOM 659 N LYS A 151 -14.436 7.934 8.311 1.00 3.77 N ATOM 660 CA LYS A 151 -15.060 7.556 7.048 1.00 3.85 C ATOM 661 C LYS A 151 -15.094 8.737 6.083 1.00 3.32 C ATOM 662 O LYS A 151 -16.095 9.450 5.994 1.00 4.00 O ATOM 663 CB LYS A 151 -16.481 7.042 7.291 1.00 4.95 C ATOM 664 CG LYS A 151 -16.953 6.042 6.250 1.00 5.22 C ATOM 665 CD LYS A 151 -16.265 4.697 6.418 1.00 4.74 C ATOM 666 CE LYS A 151 -16.469 3.811 5.198 1.00 4.70 C ATOM 667 NZ LYS A 151 -17.706 2.989 5.310 1.00 5.53 N ATOM 0 H LYS A 151 -15.079 7.978 9.102 1.00 3.77 H new ATOM 0 HA LYS A 151 -14.464 6.761 6.601 1.00 3.85 H new ATOM 0 HB2 LYS A 151 -16.527 6.577 8.276 1.00 4.95 H new ATOM 0 HB3 LYS A 151 -17.167 7.889 7.306 1.00 4.95 H new ATOM 0 HG2 LYS A 151 -18.032 5.913 6.331 1.00 5.22 H new ATOM 0 HG3 LYS A 151 -16.753 6.432 5.252 1.00 5.22 H new ATOM 0 HD2 LYS A 151 -15.199 4.851 6.583 1.00 4.74 H new ATOM 0 HD3 LYS A 151 -16.656 4.195 7.303 1.00 4.74 H new ATOM 0 HE2 LYS A 151 -16.525 4.432 4.304 1.00 4.70 H new ATOM 0 HE3 LYS A 151 -15.607 3.155 5.077 1.00 4.70 H new ATOM 0 HZ1 LYS A 151 -17.809 2.399 4.460 1.00 5.53 H new ATOM 0 HZ2 LYS A 151 -17.642 2.378 6.149 1.00 5.53 H new ATOM 0 HZ3 LYS A 151 -18.532 3.615 5.400 1.00 5.53 H new ATOM 681 N ILE A 152 -13.997 8.938 5.362 1.00 2.74 N ATOM 682 CA ILE A 152 -13.903 10.030 4.402 1.00 2.97 C ATOM 683 C ILE A 152 -13.417 9.531 3.046 1.00 3.16 C ATOM 684 O ILE A 152 -12.557 8.654 2.968 1.00 3.32 O ATOM 685 CB ILE A 152 -12.954 11.137 4.899 1.00 3.34 C ATOM 686 CG1 ILE A 152 -13.294 11.521 6.340 1.00 3.52 C ATOM 687 CG2 ILE A 152 -13.035 12.353 3.988 1.00 4.55 C ATOM 688 CD1 ILE A 152 -14.697 12.062 6.507 1.00 3.79 C ATOM 0 H ILE A 152 -13.160 8.358 5.424 1.00 2.74 H new ATOM 0 HA ILE A 152 -14.906 10.443 4.296 1.00 2.97 H new ATOM 0 HB ILE A 152 -11.933 10.757 4.875 1.00 3.34 H new ATOM 0 HG12 ILE A 152 -13.172 10.646 6.979 1.00 3.52 H new ATOM 0 HG13 ILE A 152 -12.581 12.270 6.686 1.00 3.52 H new ATOM 0 HG21 ILE A 152 -12.359 13.126 4.352 1.00 4.55 H new ATOM 0 HG22 ILE A 152 -12.749 12.069 2.975 1.00 4.55 H new ATOM 0 HG23 ILE A 152 -14.055 12.736 3.983 1.00 4.55 H new ATOM 0 HD11 ILE A 152 -14.868 12.313 7.554 1.00 3.79 H new ATOM 0 HD12 ILE A 152 -14.818 12.956 5.895 1.00 3.79 H new ATOM 0 HD13 ILE A 152 -15.418 11.307 6.193 1.00 3.79 H new ATOM 752 N ALA A 157 -6.685 14.139 1.827 1.00 4.73 N ATOM 753 CA ALA A 157 -5.485 13.691 2.522 1.00 4.80 C ATOM 754 C ALA A 157 -4.357 13.400 1.537 1.00 4.52 C ATOM 755 O ALA A 157 -4.509 13.590 0.331 1.00 4.96 O ATOM 756 CB ALA A 157 -5.789 12.456 3.358 1.00 5.11 C ATOM 0 HA ALA A 157 -5.157 14.493 3.184 1.00 4.80 H new ATOM 0 HB1 ALA A 157 -4.884 12.132 3.872 1.00 5.11 H new ATOM 0 HB2 ALA A 157 -6.558 12.694 4.093 1.00 5.11 H new ATOM 0 HB3 ALA A 157 -6.144 11.655 2.709 1.00 5.11 H new ATOM 762 N ASP A 158 -3.226 12.940 2.060 1.00 4.62 N ATOM 763 CA ASP A 158 -2.072 12.622 1.227 1.00 4.72 C ATOM 764 C ASP A 158 -2.040 11.136 0.886 1.00 3.64 C ATOM 765 O ASP A 158 -0.980 10.577 0.600 1.00 4.00 O ATOM 766 CB ASP A 158 -0.778 13.024 1.937 1.00 6.01 C ATOM 767 CG ASP A 158 -0.755 12.587 3.388 1.00 6.16 C ATOM 768 OD1 ASP A 158 -0.956 11.382 3.649 1.00 6.23 O ATOM 769 OD2 ASP A 158 -0.534 13.449 4.264 1.00 6.79 O ATOM 0 H ASP A 158 -3.083 12.779 3.057 1.00 4.62 H new ATOM 0 HA ASP A 158 -2.158 13.187 0.299 1.00 4.72 H new ATOM 0 HB2 ASP A 158 0.072 12.584 1.415 1.00 6.01 H new ATOM 0 HB3 ASP A 158 -0.659 14.106 1.884 1.00 6.01 H new ATOM 774 N ILE A 159 -3.207 10.501 0.919 1.00 2.67 N ATOM 775 CA ILE A 159 -3.312 9.080 0.614 1.00 1.84 C ATOM 776 C ILE A 159 -4.386 8.821 -0.437 1.00 1.67 C ATOM 777 O ILE A 159 -5.516 8.455 -0.109 1.00 1.80 O ATOM 778 CB ILE A 159 -3.633 8.255 1.874 1.00 1.42 C ATOM 779 CG1 ILE A 159 -2.696 8.646 3.019 1.00 2.04 C ATOM 780 CG2 ILE A 159 -3.523 6.768 1.577 1.00 2.58 C ATOM 781 CD1 ILE A 159 -3.283 9.679 3.955 1.00 3.01 C ATOM 0 H ILE A 159 -4.093 10.949 1.154 1.00 2.67 H new ATOM 0 HA ILE A 159 -2.343 8.769 0.224 1.00 1.84 H new ATOM 0 HB ILE A 159 -4.657 8.469 2.178 1.00 1.42 H new ATOM 0 HG12 ILE A 159 -2.441 7.753 3.590 1.00 2.04 H new ATOM 0 HG13 ILE A 159 -1.767 9.033 2.601 1.00 2.04 H new ATOM 0 HG21 ILE A 159 -3.753 6.199 2.478 1.00 2.58 H new ATOM 0 HG22 ILE A 159 -4.228 6.501 0.790 1.00 2.58 H new ATOM 0 HG23 ILE A 159 -2.509 6.536 1.250 1.00 2.58 H new ATOM 0 HD11 ILE A 159 -2.564 9.908 4.742 1.00 3.01 H new ATOM 0 HD12 ILE A 159 -3.512 10.587 3.397 1.00 3.01 H new ATOM 0 HD13 ILE A 159 -4.197 9.288 4.402 1.00 3.01 H new ATOM 793 N LEU A 160 -4.027 9.012 -1.701 1.00 1.71 N ATOM 794 CA LEU A 160 -4.960 8.798 -2.802 1.00 1.72 C ATOM 795 C LEU A 160 -4.595 7.543 -3.589 1.00 1.65 C ATOM 796 O LEU A 160 -3.453 7.377 -4.018 1.00 1.72 O ATOM 797 CB LEU A 160 -4.970 10.012 -3.732 1.00 2.02 C ATOM 798 CG LEU A 160 -6.315 10.357 -4.372 1.00 2.38 C ATOM 799 CD1 LEU A 160 -6.876 9.155 -5.116 1.00 4.21 C ATOM 800 CD2 LEU A 160 -7.299 10.840 -3.317 1.00 3.32 C ATOM 0 H LEU A 160 -3.097 9.315 -1.990 1.00 1.71 H new ATOM 0 HA LEU A 160 -5.956 8.663 -2.380 1.00 1.72 H new ATOM 0 HB2 LEU A 160 -4.626 10.879 -3.168 1.00 2.02 H new ATOM 0 HB3 LEU A 160 -4.245 9.841 -4.528 1.00 2.02 H new ATOM 0 HG LEU A 160 -6.158 11.162 -5.090 1.00 2.38 H new ATOM 0 HD11 LEU A 160 -7.833 9.419 -5.565 1.00 4.21 H new ATOM 0 HD12 LEU A 160 -6.179 8.854 -5.898 1.00 4.21 H new ATOM 0 HD13 LEU A 160 -7.018 8.329 -4.419 1.00 4.21 H new ATOM 0 HD21 LEU A 160 -8.251 11.081 -3.790 1.00 3.32 H new ATOM 0 HD22 LEU A 160 -7.451 10.056 -2.575 1.00 3.32 H new ATOM 0 HD23 LEU A 160 -6.901 11.730 -2.829 1.00 3.32 H new ATOM 812 N VAL A 161 -5.573 6.662 -3.776 1.00 1.76 N ATOM 813 CA VAL A 161 -5.356 5.424 -4.514 1.00 1.84 C ATOM 814 C VAL A 161 -5.185 5.695 -6.004 1.00 1.96 C ATOM 815 O VAL A 161 -6.156 5.953 -6.715 1.00 2.33 O ATOM 816 CB VAL A 161 -6.523 4.439 -4.313 1.00 2.10 C ATOM 817 CG1 VAL A 161 -6.485 3.843 -2.914 1.00 3.43 C ATOM 818 CG2 VAL A 161 -7.854 5.130 -4.571 1.00 2.34 C ATOM 0 H VAL A 161 -6.523 6.783 -3.426 1.00 1.76 H new ATOM 0 HA VAL A 161 -4.442 4.978 -4.122 1.00 1.84 H new ATOM 0 HB VAL A 161 -6.416 3.626 -5.031 1.00 2.10 H new ATOM 0 HG11 VAL A 161 -7.317 3.150 -2.791 1.00 3.43 H new ATOM 0 HG12 VAL A 161 -5.545 3.310 -2.771 1.00 3.43 H new ATOM 0 HG13 VAL A 161 -6.566 4.641 -2.176 1.00 3.43 H new ATOM 0 HG21 VAL A 161 -8.667 4.419 -4.424 1.00 2.34 H new ATOM 0 HG22 VAL A 161 -7.971 5.964 -3.879 1.00 2.34 H new ATOM 0 HG23 VAL A 161 -7.878 5.503 -5.595 1.00 2.34 H new ATOM 828 N VAL A 162 -3.942 5.634 -6.472 1.00 1.72 N ATOM 829 CA VAL A 162 -3.643 5.872 -7.879 1.00 1.91 C ATOM 830 C VAL A 162 -3.269 4.575 -8.588 1.00 1.94 C ATOM 831 O VAL A 162 -2.726 3.655 -7.977 1.00 2.13 O ATOM 832 CB VAL A 162 -2.494 6.884 -8.046 1.00 1.89 C ATOM 833 CG1 VAL A 162 -2.326 7.267 -9.508 1.00 2.18 C ATOM 834 CG2 VAL A 162 -2.741 8.116 -7.188 1.00 2.06 C ATOM 0 H VAL A 162 -3.126 5.422 -5.897 1.00 1.72 H new ATOM 0 HA VAL A 162 -4.547 6.282 -8.329 1.00 1.91 H new ATOM 0 HB VAL A 162 -1.569 6.415 -7.711 1.00 1.89 H new ATOM 0 HG11 VAL A 162 -1.510 7.983 -9.605 1.00 2.18 H new ATOM 0 HG12 VAL A 162 -2.099 6.376 -10.094 1.00 2.18 H new ATOM 0 HG13 VAL A 162 -3.249 7.717 -9.875 1.00 2.18 H new ATOM 0 HG21 VAL A 162 -1.920 8.821 -7.318 1.00 2.06 H new ATOM 0 HG22 VAL A 162 -3.676 8.588 -7.490 1.00 2.06 H new ATOM 0 HG23 VAL A 162 -2.805 7.823 -6.140 1.00 2.06 H new ATOM 844 N PHE A 163 -3.565 4.508 -9.882 1.00 2.05 N ATOM 845 CA PHE A 163 -3.261 3.323 -10.676 1.00 2.17 C ATOM 846 C PHE A 163 -2.827 3.709 -12.086 1.00 2.23 C ATOM 847 O PHE A 163 -3.497 4.490 -12.762 1.00 2.54 O ATOM 848 CB PHE A 163 -4.479 2.399 -10.740 1.00 2.66 C ATOM 849 CG PHE A 163 -5.629 2.977 -11.514 1.00 2.76 C ATOM 850 CD1 PHE A 163 -6.359 4.040 -11.007 1.00 3.37 C ATOM 851 CD2 PHE A 163 -5.980 2.458 -12.750 1.00 3.47 C ATOM 852 CE1 PHE A 163 -7.418 4.573 -11.717 1.00 4.25 C ATOM 853 CE2 PHE A 163 -7.038 2.987 -13.465 1.00 4.05 C ATOM 854 CZ PHE A 163 -7.757 4.047 -12.948 1.00 4.33 C ATOM 0 H PHE A 163 -4.015 5.261 -10.403 1.00 2.05 H new ATOM 0 HA PHE A 163 -2.438 2.795 -10.194 1.00 2.17 H new ATOM 0 HB2 PHE A 163 -4.184 1.453 -11.195 1.00 2.66 H new ATOM 0 HB3 PHE A 163 -4.810 2.176 -9.726 1.00 2.66 H new ATOM 0 HD1 PHE A 163 -6.097 4.457 -10.046 1.00 3.37 H new ATOM 0 HD2 PHE A 163 -5.420 1.630 -13.160 1.00 3.47 H new ATOM 0 HE1 PHE A 163 -7.980 5.400 -11.309 1.00 4.25 H new ATOM 0 HE2 PHE A 163 -7.302 2.572 -14.427 1.00 4.05 H new ATOM 0 HZ PHE A 163 -8.583 4.464 -13.505 1.00 4.33 H new ATOM 864 N ALA A 164 -1.700 3.157 -12.525 1.00 2.07 N ATOM 865 CA ALA A 164 -1.177 3.443 -13.855 1.00 2.17 C ATOM 866 C ALA A 164 -1.487 2.305 -14.822 1.00 2.22 C ATOM 867 O ALA A 164 -0.885 1.234 -14.748 1.00 2.51 O ATOM 868 CB ALA A 164 0.323 3.689 -13.790 1.00 2.62 C ATOM 0 H ALA A 164 -1.132 2.509 -11.979 1.00 2.07 H new ATOM 0 HA ALA A 164 -1.666 4.344 -14.226 1.00 2.17 H new ATOM 0 HB1 ALA A 164 0.701 3.901 -14.790 1.00 2.62 H new ATOM 0 HB2 ALA A 164 0.524 4.539 -13.138 1.00 2.62 H new ATOM 0 HB3 ALA A 164 0.820 2.803 -13.395 1.00 2.62 H new ATOM 874 N ARG A 165 -2.429 2.546 -15.728 1.00 2.28 N ATOM 875 CA ARG A 165 -2.820 1.540 -16.709 1.00 2.67 C ATOM 876 C ARG A 165 -2.947 2.157 -18.099 1.00 2.96 C ATOM 877 O ARG A 165 -2.809 3.368 -18.267 1.00 2.85 O ATOM 878 CB ARG A 165 -4.145 0.891 -16.305 1.00 2.98 C ATOM 879 CG ARG A 165 -5.317 1.858 -16.288 1.00 4.16 C ATOM 880 CD ARG A 165 -6.639 1.136 -16.497 1.00 5.20 C ATOM 881 NE ARG A 165 -6.745 0.566 -17.837 1.00 5.32 N ATOM 882 CZ ARG A 165 -7.837 -0.034 -18.296 1.00 6.15 C ATOM 883 NH1 ARG A 165 -8.912 -0.142 -17.527 1.00 6.91 N ATOM 884 NH2 ARG A 165 -7.857 -0.528 -19.528 1.00 6.64 N ATOM 0 H ARG A 165 -2.935 3.428 -15.803 1.00 2.28 H new ATOM 0 HA ARG A 165 -2.043 0.776 -16.739 1.00 2.67 H new ATOM 0 HB2 ARG A 165 -4.367 0.077 -16.995 1.00 2.98 H new ATOM 0 HB3 ARG A 165 -4.036 0.448 -15.315 1.00 2.98 H new ATOM 0 HG2 ARG A 165 -5.338 2.389 -15.336 1.00 4.16 H new ATOM 0 HG3 ARG A 165 -5.183 2.607 -17.068 1.00 4.16 H new ATOM 0 HD2 ARG A 165 -6.740 0.343 -15.756 1.00 5.20 H new ATOM 0 HD3 ARG A 165 -7.462 1.832 -16.333 1.00 5.20 H new ATOM 0 HE ARG A 165 -5.936 0.632 -18.454 1.00 5.32 H new ATOM 0 HH11 ARG A 165 -8.902 0.236 -16.580 1.00 6.91 H new ATOM 0 HH12 ARG A 165 -9.749 -0.603 -17.883 1.00 6.91 H new ATOM 0 HH21 ARG A 165 -7.033 -0.447 -20.123 1.00 6.64 H new ATOM 0 HH22 ARG A 165 -8.697 -0.989 -19.879 1.00 6.64 H new ATOM 898 N GLY A 166 -3.210 1.314 -19.093 1.00 3.52 N ATOM 899 CA GLY A 166 -3.350 1.795 -20.455 1.00 3.94 C ATOM 900 C GLY A 166 -2.200 2.689 -20.876 1.00 3.58 C ATOM 901 O GLY A 166 -1.113 2.206 -21.193 1.00 3.69 O ATOM 0 H GLY A 166 -3.329 0.307 -18.979 1.00 3.52 H new ATOM 0 HA2 GLY A 166 -3.411 0.944 -21.133 1.00 3.94 H new ATOM 0 HA3 GLY A 166 -4.286 2.345 -20.548 1.00 3.94 H new ATOM 905 N ALA A 167 -2.440 3.996 -20.880 1.00 3.41 N ATOM 906 CA ALA A 167 -1.416 4.959 -21.265 1.00 3.29 C ATOM 907 C ALA A 167 -0.404 5.163 -20.142 1.00 2.94 C ATOM 908 O ALA A 167 -0.763 5.174 -18.964 1.00 2.73 O ATOM 909 CB ALA A 167 -2.056 6.285 -21.648 1.00 3.70 C ATOM 0 H ALA A 167 -3.335 4.412 -20.621 1.00 3.41 H new ATOM 0 HA ALA A 167 -0.885 4.561 -22.130 1.00 3.29 H new ATOM 0 HB1 ALA A 167 -1.280 6.995 -21.933 1.00 3.70 H new ATOM 0 HB2 ALA A 167 -2.734 6.133 -22.487 1.00 3.70 H new ATOM 0 HB3 ALA A 167 -2.613 6.679 -20.798 1.00 3.70 H new ATOM 915 N HIS A 168 0.862 5.324 -20.514 1.00 3.17 N ATOM 916 CA HIS A 168 1.926 5.527 -19.537 1.00 3.39 C ATOM 917 C HIS A 168 1.539 6.606 -18.529 1.00 3.39 C ATOM 918 O HIS A 168 1.604 7.798 -18.826 1.00 3.84 O ATOM 919 CB HIS A 168 3.226 5.914 -20.242 1.00 4.05 C ATOM 920 CG HIS A 168 3.875 4.776 -20.969 1.00 5.26 C ATOM 921 ND1 HIS A 168 4.259 4.850 -22.291 1.00 5.97 N ATOM 922 CD2 HIS A 168 4.208 3.533 -20.551 1.00 6.52 C ATOM 923 CE1 HIS A 168 4.798 3.700 -22.655 1.00 7.24 C ATOM 924 NE2 HIS A 168 4.780 2.884 -21.617 1.00 7.61 N ATOM 0 H HIS A 168 1.176 5.318 -21.484 1.00 3.17 H new ATOM 0 HA HIS A 168 2.077 4.591 -19.000 1.00 3.39 H new ATOM 0 HB2 HIS A 168 3.021 6.717 -20.950 1.00 4.05 H new ATOM 0 HB3 HIS A 168 3.925 6.310 -19.505 1.00 4.05 H new ATOM 0 HD2 HIS A 168 4.053 3.127 -19.562 1.00 6.52 H new ATOM 0 HE1 HIS A 168 5.187 3.467 -23.635 1.00 7.24 H new ATOM 0 HE2 HIS A 168 5.134 1.927 -21.609 1.00 7.61 H new ATOM 932 N GLY A 169 1.136 6.178 -17.337 1.00 3.20 N ATOM 933 CA GLY A 169 0.744 7.119 -16.304 1.00 3.55 C ATOM 934 C GLY A 169 -0.257 8.143 -16.803 1.00 3.72 C ATOM 935 O GLY A 169 -0.291 9.274 -16.318 1.00 4.30 O ATOM 0 H GLY A 169 1.074 5.196 -17.068 1.00 3.20 H new ATOM 0 HA2 GLY A 169 0.313 6.574 -15.464 1.00 3.55 H new ATOM 0 HA3 GLY A 169 1.629 7.633 -15.930 1.00 3.55 H new ATOM 939 N ASP A 170 -1.071 7.747 -17.775 1.00 4.33 N ATOM 940 CA ASP A 170 -2.077 8.639 -18.340 1.00 5.37 C ATOM 941 C ASP A 170 -1.449 9.961 -18.773 1.00 5.32 C ATOM 942 O ASP A 170 -1.395 10.917 -17.999 1.00 5.75 O ATOM 943 CB ASP A 170 -3.190 8.898 -17.323 1.00 6.31 C ATOM 944 CG ASP A 170 -4.369 7.963 -17.505 1.00 7.55 C ATOM 945 OD1 ASP A 170 -4.259 6.785 -17.106 1.00 8.24 O ATOM 946 OD2 ASP A 170 -5.402 8.409 -18.048 1.00 8.24 O ATOM 0 H ASP A 170 -1.054 6.815 -18.188 1.00 4.33 H new ATOM 0 HA ASP A 170 -2.504 8.155 -19.218 1.00 5.37 H new ATOM 0 HB2 ASP A 170 -2.791 8.783 -16.315 1.00 6.31 H new ATOM 0 HB3 ASP A 170 -3.530 9.929 -17.416 1.00 6.31 H new ATOM 951 N ASP A 171 -0.975 10.006 -20.013 1.00 5.41 N ATOM 952 CA ASP A 171 -0.351 11.210 -20.549 1.00 5.70 C ATOM 953 C ASP A 171 0.992 11.472 -19.876 1.00 5.32 C ATOM 954 O ASP A 171 2.049 11.235 -20.463 1.00 5.30 O ATOM 955 CB ASP A 171 -1.274 12.416 -20.361 1.00 6.89 C ATOM 956 CG ASP A 171 -1.749 12.993 -21.679 1.00 7.71 C ATOM 957 OD1 ASP A 171 -0.916 13.572 -22.409 1.00 7.76 O ATOM 958 OD2 ASP A 171 -2.953 12.866 -21.982 1.00 8.75 O ATOM 0 H ASP A 171 -1.011 9.223 -20.666 1.00 5.41 H new ATOM 0 HA ASP A 171 -0.179 11.057 -21.614 1.00 5.70 H new ATOM 0 HB2 ASP A 171 -2.137 12.119 -19.765 1.00 6.89 H new ATOM 0 HB3 ASP A 171 -0.749 13.188 -19.798 1.00 6.89 H new ATOM 963 N HIS A 172 0.945 11.963 -18.642 1.00 5.57 N ATOM 964 CA HIS A 172 2.159 12.257 -17.889 1.00 5.73 C ATOM 965 C HIS A 172 2.428 11.175 -16.848 1.00 5.26 C ATOM 966 O HIS A 172 1.746 11.098 -15.827 1.00 6.06 O ATOM 967 CB HIS A 172 2.042 13.620 -17.206 1.00 6.94 C ATOM 968 CG HIS A 172 0.773 13.795 -16.431 1.00 8.25 C ATOM 969 ND1 HIS A 172 -0.413 14.197 -17.010 1.00 9.29 N ATOM 970 CD2 HIS A 172 0.507 13.620 -15.116 1.00 9.26 C ATOM 971 CE1 HIS A 172 -1.352 14.262 -16.084 1.00 10.77 C ATOM 972 NE2 HIS A 172 -0.821 13.916 -14.925 1.00 10.80 N ATOM 0 H HIS A 172 0.079 12.166 -18.142 1.00 5.57 H new ATOM 0 HA HIS A 172 2.995 12.279 -18.588 1.00 5.73 H new ATOM 0 HB2 HIS A 172 2.890 13.754 -16.534 1.00 6.94 H new ATOM 0 HB3 HIS A 172 2.107 14.403 -17.962 1.00 6.94 H new ATOM 0 HD2 HIS A 172 1.208 13.306 -14.357 1.00 9.26 H new ATOM 0 HE1 HIS A 172 -2.380 14.549 -16.247 1.00 10.77 H new ATOM 0 HE2 HIS A 172 -1.316 13.875 -14.034 1.00 10.80 H new ATOM 980 N ALA A 173 3.427 10.340 -17.115 1.00 4.50 N ATOM 981 CA ALA A 173 3.788 9.263 -16.201 1.00 4.27 C ATOM 982 C ALA A 173 4.994 9.645 -15.351 1.00 4.76 C ATOM 983 O ALA A 173 5.578 10.714 -15.528 1.00 5.84 O ATOM 984 CB ALA A 173 4.070 7.985 -16.977 1.00 4.07 C ATOM 0 H ALA A 173 4.001 10.389 -17.957 1.00 4.50 H new ATOM 0 HA ALA A 173 2.945 9.090 -15.532 1.00 4.27 H new ATOM 0 HB1 ALA A 173 4.338 7.189 -16.282 1.00 4.07 H new ATOM 0 HB2 ALA A 173 3.180 7.695 -17.535 1.00 4.07 H new ATOM 0 HB3 ALA A 173 4.894 8.155 -17.670 1.00 4.07 H new ATOM 990 N PHE A 174 5.363 8.764 -14.427 1.00 4.49 N ATOM 991 CA PHE A 174 6.500 9.011 -13.547 1.00 5.39 C ATOM 992 C PHE A 174 6.911 7.734 -12.819 1.00 5.16 C ATOM 993 O PHE A 174 8.099 7.464 -12.640 1.00 5.74 O ATOM 994 CB PHE A 174 6.159 10.103 -12.531 1.00 6.47 C ATOM 995 CG PHE A 174 7.360 10.856 -12.035 1.00 7.45 C ATOM 996 CD1 PHE A 174 8.060 11.704 -12.878 1.00 8.29 C ATOM 997 CD2 PHE A 174 7.790 10.715 -10.725 1.00 8.11 C ATOM 998 CE1 PHE A 174 9.166 12.398 -12.424 1.00 9.49 C ATOM 999 CE2 PHE A 174 8.894 11.408 -10.265 1.00 9.35 C ATOM 1000 CZ PHE A 174 9.584 12.249 -11.116 1.00 9.93 C ATOM 0 H PHE A 174 4.892 7.873 -14.268 1.00 4.49 H new ATOM 0 HA PHE A 174 7.337 9.345 -14.161 1.00 5.39 H new ATOM 0 HB2 PHE A 174 5.461 10.806 -12.986 1.00 6.47 H new ATOM 0 HB3 PHE A 174 5.647 9.651 -11.681 1.00 6.47 H new ATOM 0 HD1 PHE A 174 7.738 11.824 -13.902 1.00 8.29 H new ATOM 0 HD2 PHE A 174 7.256 10.056 -10.056 1.00 8.11 H new ATOM 0 HE1 PHE A 174 9.703 13.056 -13.091 1.00 9.49 H new ATOM 0 HE2 PHE A 174 9.217 11.292 -9.241 1.00 9.35 H new ATOM 0 HZ PHE A 174 10.449 12.789 -10.759 1.00 9.93 H new ATOM 1084 N LEU A 181 8.930 -0.191 -9.050 1.00 4.10 N ATOM 1085 CA LEU A 181 7.562 -0.451 -8.616 1.00 4.00 C ATOM 1086 C LEU A 181 7.337 0.054 -7.194 1.00 3.82 C ATOM 1087 O LEU A 181 6.408 0.819 -6.937 1.00 3.73 O ATOM 1088 CB LEU A 181 7.258 -1.948 -8.691 1.00 4.53 C ATOM 1089 CG LEU A 181 5.958 -2.334 -9.397 1.00 5.29 C ATOM 1090 CD1 LEU A 181 5.956 -3.816 -9.741 1.00 6.27 C ATOM 1091 CD2 LEU A 181 4.756 -1.985 -8.531 1.00 5.73 C ATOM 0 HA LEU A 181 6.887 0.085 -9.284 1.00 4.00 H new ATOM 0 HB2 LEU A 181 8.085 -2.441 -9.201 1.00 4.53 H new ATOM 0 HB3 LEU A 181 7.228 -2.344 -7.676 1.00 4.53 H new ATOM 0 HG LEU A 181 5.890 -1.766 -10.325 1.00 5.29 H new ATOM 0 HD11 LEU A 181 5.023 -4.072 -10.243 1.00 6.27 H new ATOM 0 HD12 LEU A 181 6.795 -4.038 -10.400 1.00 6.27 H new ATOM 0 HD13 LEU A 181 6.049 -4.402 -8.827 1.00 6.27 H new ATOM 0 HD21 LEU A 181 3.840 -2.267 -9.050 1.00 5.73 H new ATOM 0 HD22 LEU A 181 4.819 -2.525 -7.586 1.00 5.73 H new ATOM 0 HD23 LEU A 181 4.747 -0.913 -8.336 1.00 5.73 H new ATOM 1103 N ALA A 182 8.194 -0.377 -6.275 1.00 4.31 N ATOM 1104 CA ALA A 182 8.092 0.034 -4.881 1.00 4.57 C ATOM 1105 C ALA A 182 9.236 0.967 -4.498 1.00 5.43 C ATOM 1106 O ALA A 182 10.384 0.749 -4.887 1.00 6.08 O ATOM 1107 CB ALA A 182 8.074 -1.184 -3.970 1.00 4.95 C ATOM 0 H ALA A 182 8.968 -1.012 -6.471 1.00 4.31 H new ATOM 0 HA ALA A 182 7.156 0.579 -4.757 1.00 4.57 H new ATOM 0 HB1 ALA A 182 7.998 -0.861 -2.932 1.00 4.95 H new ATOM 0 HB2 ALA A 182 7.218 -1.812 -4.219 1.00 4.95 H new ATOM 0 HB3 ALA A 182 8.993 -1.754 -4.106 1.00 4.95 H new ATOM 1113 N HIS A 183 8.916 2.006 -3.734 1.00 5.64 N ATOM 1114 CA HIS A 183 9.919 2.972 -3.298 1.00 6.65 C ATOM 1115 C HIS A 183 9.376 3.849 -2.174 1.00 6.49 C ATOM 1116 O HIS A 183 8.173 4.101 -2.096 1.00 6.02 O ATOM 1117 CB HIS A 183 10.361 3.844 -4.473 1.00 7.43 C ATOM 1118 CG HIS A 183 11.822 3.736 -4.783 1.00 8.84 C ATOM 1119 ND1 HIS A 183 12.332 3.850 -6.060 1.00 9.58 N ATOM 1120 CD2 HIS A 183 12.886 3.523 -3.973 1.00 10.02 C ATOM 1121 CE1 HIS A 183 13.645 3.711 -6.021 1.00 10.90 C ATOM 1122 NE2 HIS A 183 14.006 3.512 -4.767 1.00 11.19 N ATOM 0 H HIS A 183 7.971 2.201 -3.404 1.00 5.64 H new ATOM 0 HA HIS A 183 10.780 2.420 -2.920 1.00 6.65 H new ATOM 0 HB2 HIS A 183 9.789 3.564 -5.358 1.00 7.43 H new ATOM 0 HB3 HIS A 183 10.121 4.884 -4.253 1.00 7.43 H new ATOM 0 HD2 HIS A 183 12.859 3.387 -2.902 1.00 10.02 H new ATOM 0 HE1 HIS A 183 14.310 3.753 -6.871 1.00 10.90 H new ATOM 0 HE2 HIS A 183 14.962 3.373 -4.441 1.00 11.19 H new ATOM 1130 N ALA A 184 10.269 4.311 -1.306 1.00 7.21 N ATOM 1131 CA ALA A 184 9.880 5.161 -0.187 1.00 7.28 C ATOM 1132 C ALA A 184 9.020 6.329 -0.659 1.00 6.41 C ATOM 1133 O ALA A 184 9.186 6.825 -1.773 1.00 6.17 O ATOM 1134 CB ALA A 184 11.114 5.671 0.542 1.00 8.29 C ATOM 0 H ALA A 184 11.268 4.111 -1.356 1.00 7.21 H new ATOM 0 HA ALA A 184 9.286 4.562 0.504 1.00 7.28 H new ATOM 0 HB1 ALA A 184 10.809 6.304 1.375 1.00 8.29 H new ATOM 0 HB2 ALA A 184 11.688 4.825 0.920 1.00 8.29 H new ATOM 0 HB3 ALA A 184 11.730 6.249 -0.146 1.00 8.29 H new ATOM 1140 N PHE A 185 8.100 6.763 0.196 1.00 6.34 N ATOM 1141 CA PHE A 185 7.213 7.872 -0.134 1.00 5.82 C ATOM 1142 C PHE A 185 7.254 8.943 0.953 1.00 5.04 C ATOM 1143 O PHE A 185 7.856 10.001 0.774 1.00 5.35 O ATOM 1144 CB PHE A 185 5.779 7.369 -0.316 1.00 6.60 C ATOM 1145 CG PHE A 185 5.432 7.054 -1.743 1.00 7.61 C ATOM 1146 CD1 PHE A 185 5.596 8.006 -2.736 1.00 7.70 C ATOM 1147 CD2 PHE A 185 4.941 5.806 -2.091 1.00 8.98 C ATOM 1148 CE1 PHE A 185 5.277 7.718 -4.050 1.00 8.96 C ATOM 1149 CE2 PHE A 185 4.620 5.513 -3.403 1.00 10.26 C ATOM 1150 CZ PHE A 185 4.789 6.470 -4.384 1.00 10.18 C ATOM 0 H PHE A 185 7.949 6.364 1.122 1.00 6.34 H new ATOM 0 HA PHE A 185 7.557 8.314 -1.069 1.00 5.82 H new ATOM 0 HB2 PHE A 185 5.636 6.475 0.290 1.00 6.60 H new ATOM 0 HB3 PHE A 185 5.087 8.123 0.060 1.00 6.60 H new ATOM 0 HD1 PHE A 185 5.977 8.984 -2.481 1.00 7.70 H new ATOM 0 HD2 PHE A 185 4.808 5.053 -1.328 1.00 8.98 H new ATOM 0 HE1 PHE A 185 5.409 8.469 -4.815 1.00 8.96 H new ATOM 0 HE2 PHE A 185 4.237 4.536 -3.661 1.00 10.26 H new ATOM 0 HZ PHE A 185 4.540 6.243 -5.410 1.00 10.18 H new ATOM 1160 N GLY A 186 6.607 8.660 2.079 1.00 4.84 N ATOM 1161 CA GLY A 186 6.580 9.608 3.178 1.00 4.44 C ATOM 1162 C GLY A 186 5.437 10.596 3.064 1.00 4.12 C ATOM 1163 O GLY A 186 5.622 11.752 2.684 1.00 4.76 O ATOM 0 H GLY A 186 6.101 7.791 2.250 1.00 4.84 H new ATOM 0 HA2 GLY A 186 6.494 9.065 4.120 1.00 4.44 H new ATOM 0 HA3 GLY A 186 7.524 10.152 3.208 1.00 4.44 H new ATOM 1167 N PRO A 187 4.220 10.139 3.397 1.00 3.56 N ATOM 1168 CA PRO A 187 3.017 10.975 3.337 1.00 3.86 C ATOM 1169 C PRO A 187 3.011 12.060 4.408 1.00 4.01 C ATOM 1170 O PRO A 187 3.393 11.818 5.552 1.00 4.30 O ATOM 1171 CB PRO A 187 1.880 9.979 3.578 1.00 4.01 C ATOM 1172 CG PRO A 187 2.507 8.869 4.349 1.00 3.54 C ATOM 1173 CD PRO A 187 3.925 8.772 3.858 1.00 3.27 C ATOM 0 HA PRO A 187 2.940 11.510 2.390 1.00 3.86 H new ATOM 0 HB2 PRO A 187 1.064 10.437 4.136 1.00 4.01 H new ATOM 0 HB3 PRO A 187 1.461 9.621 2.638 1.00 4.01 H new ATOM 0 HG2 PRO A 187 2.478 9.073 5.419 1.00 3.54 H new ATOM 0 HG3 PRO A 187 1.973 7.932 4.188 1.00 3.54 H new ATOM 0 HD2 PRO A 187 4.604 8.460 4.651 1.00 3.27 H new ATOM 0 HD3 PRO A 187 4.022 8.046 3.051 1.00 3.27 H new ATOM 1251 N ALA A 195 0.256 5.309 -3.075 1.00 1.50 N ATOM 1252 CA ALA A 195 0.324 3.857 -3.185 1.00 2.00 C ATOM 1253 C ALA A 195 -0.465 3.361 -4.392 1.00 1.61 C ATOM 1254 O ALA A 195 -1.691 3.474 -4.435 1.00 2.09 O ATOM 1255 CB ALA A 195 -0.193 3.207 -1.911 1.00 3.11 C ATOM 0 HA ALA A 195 1.368 3.576 -3.325 1.00 2.00 H new ATOM 0 HB1 ALA A 195 -0.137 2.123 -2.007 1.00 3.11 H new ATOM 0 HB2 ALA A 195 0.415 3.529 -1.066 1.00 3.11 H new ATOM 0 HB3 ALA A 195 -1.229 3.503 -1.746 1.00 3.11 H new ATOM 1261 N HIS A 196 0.245 2.811 -5.372 1.00 1.20 N ATOM 1262 CA HIS A 196 -0.390 2.297 -6.581 1.00 1.12 C ATOM 1263 C HIS A 196 -0.120 0.804 -6.743 1.00 1.14 C ATOM 1264 O HIS A 196 0.481 0.173 -5.874 1.00 1.64 O ATOM 1265 CB HIS A 196 0.115 3.055 -7.809 1.00 1.09 C ATOM 1266 CG HIS A 196 1.604 3.019 -7.965 1.00 1.44 C ATOM 1267 ND1 HIS A 196 2.400 4.140 -7.853 1.00 2.58 N ATOM 1268 CD2 HIS A 196 2.442 1.989 -8.224 1.00 2.31 C ATOM 1269 CE1 HIS A 196 3.663 3.800 -8.038 1.00 3.11 C ATOM 1270 NE2 HIS A 196 3.716 2.500 -8.265 1.00 2.81 N ATOM 0 H HIS A 196 1.260 2.710 -5.353 1.00 1.20 H new ATOM 0 HA HIS A 196 -1.466 2.446 -6.489 1.00 1.12 H new ATOM 0 HB2 HIS A 196 -0.346 2.632 -8.702 1.00 1.09 H new ATOM 0 HB3 HIS A 196 -0.210 4.093 -7.744 1.00 1.09 H new ATOM 0 HD2 HIS A 196 2.161 0.957 -8.371 1.00 2.31 H new ATOM 0 HE1 HIS A 196 4.509 4.471 -8.009 1.00 3.11 H new ATOM 0 HE2 HIS A 196 4.565 1.963 -8.442 1.00 2.81 H new ATOM 1278 N PHE A 197 -0.570 0.245 -7.862 1.00 1.15 N ATOM 1279 CA PHE A 197 -0.379 -1.174 -8.138 1.00 1.31 C ATOM 1280 C PHE A 197 0.235 -1.382 -9.519 1.00 1.84 C ATOM 1281 O PHE A 197 -0.116 -0.691 -10.476 1.00 2.37 O ATOM 1282 CB PHE A 197 -1.712 -1.918 -8.042 1.00 1.71 C ATOM 1283 CG PHE A 197 -2.254 -2.001 -6.644 1.00 1.94 C ATOM 1284 CD1 PHE A 197 -3.047 -0.986 -6.133 1.00 3.14 C ATOM 1285 CD2 PHE A 197 -1.970 -3.093 -5.840 1.00 2.66 C ATOM 1286 CE1 PHE A 197 -3.547 -1.059 -4.846 1.00 3.90 C ATOM 1287 CE2 PHE A 197 -2.468 -3.172 -4.553 1.00 3.48 C ATOM 1288 CZ PHE A 197 -3.256 -2.153 -4.055 1.00 3.76 C ATOM 0 H PHE A 197 -1.069 0.753 -8.592 1.00 1.15 H new ATOM 0 HA PHE A 197 0.307 -1.575 -7.391 1.00 1.31 H new ATOM 0 HB2 PHE A 197 -2.444 -1.419 -8.678 1.00 1.71 H new ATOM 0 HB3 PHE A 197 -1.585 -2.927 -8.434 1.00 1.71 H new ATOM 0 HD1 PHE A 197 -3.277 -0.128 -6.747 1.00 3.14 H new ATOM 0 HD2 PHE A 197 -1.352 -3.892 -6.223 1.00 2.66 H new ATOM 0 HE1 PHE A 197 -4.164 -0.261 -4.460 1.00 3.90 H new ATOM 0 HE2 PHE A 197 -2.241 -4.030 -3.937 1.00 3.48 H new ATOM 0 HZ PHE A 197 -3.644 -2.212 -3.049 1.00 3.76 H new ATOM 1298 N ASP A 198 1.153 -2.337 -9.614 1.00 2.24 N ATOM 1299 CA ASP A 198 1.816 -2.637 -10.878 1.00 2.94 C ATOM 1300 C ASP A 198 0.794 -2.867 -11.987 1.00 2.94 C ATOM 1301 O ASP A 198 0.173 -3.927 -12.061 1.00 3.46 O ATOM 1302 CB ASP A 198 2.711 -3.868 -10.729 1.00 4.32 C ATOM 1303 CG ASP A 198 3.577 -4.106 -11.951 1.00 5.45 C ATOM 1304 OD1 ASP A 198 3.590 -3.237 -12.848 1.00 6.11 O ATOM 1305 OD2 ASP A 198 4.242 -5.161 -12.010 1.00 6.42 O ATOM 0 H ASP A 198 1.455 -2.917 -8.831 1.00 2.24 H new ATOM 0 HA ASP A 198 2.432 -1.780 -11.149 1.00 2.94 H new ATOM 0 HB2 ASP A 198 3.349 -3.746 -9.854 1.00 4.32 H new ATOM 0 HB3 ASP A 198 2.090 -4.746 -10.551 1.00 4.32 H new ATOM 1310 N GLU A 199 0.624 -1.867 -12.846 1.00 3.61 N ATOM 1311 CA GLU A 199 -0.324 -1.961 -13.949 1.00 4.41 C ATOM 1312 C GLU A 199 -1.704 -2.376 -13.446 1.00 4.84 C ATOM 1313 O GLU A 199 -1.953 -2.410 -12.241 1.00 5.36 O ATOM 1314 CB GLU A 199 0.172 -2.962 -14.994 1.00 5.17 C ATOM 1315 CG GLU A 199 0.267 -2.382 -16.395 1.00 6.41 C ATOM 1316 CD GLU A 199 -0.318 -3.303 -17.448 1.00 7.87 C ATOM 1317 OE1 GLU A 199 -1.515 -3.643 -17.339 1.00 9.00 O ATOM 1318 OE2 GLU A 199 0.420 -3.683 -18.381 1.00 8.29 O ATOM 0 H GLU A 199 1.130 -0.983 -12.799 1.00 3.61 H new ATOM 0 HA GLU A 199 -0.405 -0.976 -14.410 1.00 4.41 H new ATOM 0 HB2 GLU A 199 1.153 -3.330 -14.695 1.00 5.17 H new ATOM 0 HB3 GLU A 199 -0.499 -3.821 -15.010 1.00 5.17 H new ATOM 0 HG2 GLU A 199 -0.254 -1.425 -16.424 1.00 6.41 H new ATOM 0 HG3 GLU A 199 1.312 -2.183 -16.632 1.00 6.41 H new ATOM 1325 N ASP A 200 -2.597 -2.690 -14.379 1.00 5.59 N ATOM 1326 CA ASP A 200 -3.952 -3.104 -14.031 1.00 6.66 C ATOM 1327 C ASP A 200 -4.033 -4.619 -13.871 1.00 6.12 C ATOM 1328 O ASP A 200 -4.099 -5.353 -14.856 1.00 6.44 O ATOM 1329 CB ASP A 200 -4.940 -2.638 -15.102 1.00 8.58 C ATOM 1330 CG ASP A 200 -4.508 -3.033 -16.500 1.00 9.16 C ATOM 1331 OD1 ASP A 200 -3.728 -2.276 -17.115 1.00 9.22 O ATOM 1332 OD2 ASP A 200 -4.950 -4.098 -16.980 1.00 9.95 O ATOM 0 H ASP A 200 -2.407 -2.666 -15.381 1.00 5.59 H new ATOM 0 HA ASP A 200 -4.214 -2.642 -13.079 1.00 6.66 H new ATOM 0 HB2 ASP A 200 -5.922 -3.062 -14.895 1.00 8.58 H new ATOM 0 HB3 ASP A 200 -5.044 -1.554 -15.050 1.00 8.58 H new ATOM 1337 N GLU A 201 -4.027 -5.078 -12.623 1.00 5.88 N ATOM 1338 CA GLU A 201 -4.099 -6.506 -12.335 1.00 5.60 C ATOM 1339 C GLU A 201 -2.913 -7.244 -12.949 1.00 3.82 C ATOM 1340 O GLU A 201 -3.065 -7.989 -13.918 1.00 4.54 O ATOM 1341 CB GLU A 201 -5.409 -7.091 -12.867 1.00 7.44 C ATOM 1342 CG GLU A 201 -5.611 -8.554 -12.510 1.00 8.61 C ATOM 1343 CD GLU A 201 -6.834 -9.153 -13.176 1.00 10.35 C ATOM 1344 OE1 GLU A 201 -7.377 -8.518 -14.104 1.00 11.10 O ATOM 1345 OE2 GLU A 201 -7.249 -10.259 -12.768 1.00 11.28 O ATOM 0 H GLU A 201 -3.973 -4.483 -11.797 1.00 5.88 H new ATOM 0 HA GLU A 201 -4.065 -6.635 -11.253 1.00 5.60 H new ATOM 0 HB2 GLU A 201 -6.243 -6.511 -12.472 1.00 7.44 H new ATOM 0 HB3 GLU A 201 -5.431 -6.984 -13.951 1.00 7.44 H new ATOM 0 HG2 GLU A 201 -4.728 -9.121 -12.803 1.00 8.61 H new ATOM 0 HG3 GLU A 201 -5.707 -8.650 -11.429 1.00 8.61 H new ATOM 1352 N PHE A 202 -1.732 -7.032 -12.378 1.00 2.67 N ATOM 1353 CA PHE A 202 -0.519 -7.676 -12.869 1.00 3.05 C ATOM 1354 C PHE A 202 0.145 -8.497 -11.767 1.00 3.51 C ATOM 1355 O PHE A 202 1.371 -8.576 -11.691 1.00 5.01 O ATOM 1356 CB PHE A 202 0.461 -6.628 -13.400 1.00 4.33 C ATOM 1357 CG PHE A 202 1.370 -7.148 -14.477 1.00 5.64 C ATOM 1358 CD1 PHE A 202 0.915 -7.290 -15.778 1.00 6.52 C ATOM 1359 CD2 PHE A 202 2.680 -7.496 -14.188 1.00 6.61 C ATOM 1360 CE1 PHE A 202 1.749 -7.769 -16.770 1.00 7.96 C ATOM 1361 CE2 PHE A 202 3.519 -7.975 -15.176 1.00 8.11 C ATOM 1362 CZ PHE A 202 3.053 -8.111 -16.469 1.00 8.64 C ATOM 0 H PHE A 202 -1.589 -6.419 -11.575 1.00 2.67 H new ATOM 0 HA PHE A 202 -0.797 -8.348 -13.681 1.00 3.05 H new ATOM 0 HB2 PHE A 202 -0.102 -5.780 -13.789 1.00 4.33 H new ATOM 0 HB3 PHE A 202 1.066 -6.256 -12.573 1.00 4.33 H new ATOM 0 HD1 PHE A 202 -0.103 -7.023 -16.019 1.00 6.52 H new ATOM 0 HD2 PHE A 202 3.050 -7.392 -13.179 1.00 6.61 H new ATOM 0 HE1 PHE A 202 1.382 -7.876 -17.780 1.00 7.96 H new ATOM 0 HE2 PHE A 202 4.538 -8.243 -14.937 1.00 8.11 H new ATOM 0 HZ PHE A 202 3.707 -8.484 -17.243 1.00 8.64 H new ATOM 1372 N TRP A 203 -0.673 -9.105 -10.917 1.00 3.01 N ATOM 1373 CA TRP A 203 -0.166 -9.920 -9.819 1.00 4.24 C ATOM 1374 C TRP A 203 -0.746 -11.329 -9.873 1.00 3.96 C ATOM 1375 O TRP A 203 -1.378 -11.714 -10.858 1.00 4.28 O ATOM 1376 CB TRP A 203 -0.502 -9.269 -8.476 1.00 5.21 C ATOM 1377 CG TRP A 203 0.704 -9.006 -7.625 1.00 7.30 C ATOM 1378 CD1 TRP A 203 1.317 -9.885 -6.778 1.00 8.80 C ATOM 1379 CD2 TRP A 203 1.442 -7.782 -7.539 1.00 8.57 C ATOM 1380 NE1 TRP A 203 2.391 -9.281 -6.170 1.00 10.69 N ATOM 1381 CE2 TRP A 203 2.489 -7.991 -6.620 1.00 10.58 C ATOM 1382 CE3 TRP A 203 1.321 -6.531 -8.149 1.00 8.61 C ATOM 1383 CZ2 TRP A 203 3.407 -6.994 -6.299 1.00 12.34 C ATOM 1384 CZ3 TRP A 203 2.232 -5.543 -7.828 1.00 10.51 C ATOM 1385 CH2 TRP A 203 3.264 -5.779 -6.911 1.00 12.23 C ATOM 0 H TRP A 203 -1.690 -9.049 -10.966 1.00 3.01 H new ATOM 0 HA TRP A 203 0.917 -9.989 -9.921 1.00 4.24 H new ATOM 0 HB2 TRP A 203 -1.023 -8.329 -8.656 1.00 5.21 H new ATOM 0 HB3 TRP A 203 -1.190 -9.914 -7.929 1.00 5.21 H new ATOM 0 HD1 TRP A 203 1.004 -10.905 -6.611 1.00 8.80 H new ATOM 0 HE1 TRP A 203 3.014 -9.722 -5.493 1.00 10.69 H new ATOM 0 HE3 TRP A 203 0.530 -6.340 -8.859 1.00 8.61 H new ATOM 0 HZ2 TRP A 203 4.203 -7.174 -5.592 1.00 12.34 H new ATOM 0 HZ3 TRP A 203 2.147 -4.572 -8.292 1.00 10.51 H new ATOM 0 HH2 TRP A 203 3.961 -4.986 -6.683 1.00 12.23 H new ATOM 1396 N THR A 204 -0.529 -12.096 -8.809 1.00 3.93 N ATOM 1397 CA THR A 204 -1.030 -13.462 -8.736 1.00 3.83 C ATOM 1398 C THR A 204 -1.826 -13.689 -7.456 1.00 2.84 C ATOM 1399 O THR A 204 -1.991 -12.777 -6.645 1.00 2.90 O ATOM 1400 CB THR A 204 0.120 -14.486 -8.800 1.00 5.22 C ATOM 1401 OG1 THR A 204 1.373 -13.807 -8.939 1.00 6.02 O ATOM 1402 CG2 THR A 204 -0.074 -15.446 -9.964 1.00 5.70 C ATOM 0 H THR A 204 -0.009 -11.793 -7.985 1.00 3.93 H new ATOM 0 HA THR A 204 -1.683 -13.605 -9.597 1.00 3.83 H new ATOM 0 HB THR A 204 0.118 -15.059 -7.873 1.00 5.22 H new ATOM 0 HG1 THR A 204 2.099 -14.464 -8.977 1.00 6.02 H new ATOM 0 HG21 THR A 204 0.750 -16.159 -9.989 1.00 5.70 H new ATOM 0 HG22 THR A 204 -1.015 -15.982 -9.840 1.00 5.70 H new ATOM 0 HG23 THR A 204 -0.096 -14.885 -10.898 1.00 5.70 H new ATOM 1410 N THR A 205 -2.319 -14.911 -7.280 1.00 2.70 N ATOM 1411 CA THR A 205 -3.098 -15.258 -6.098 1.00 2.30 C ATOM 1412 C THR A 205 -2.291 -16.128 -5.142 1.00 2.37 C ATOM 1413 O THR A 205 -2.414 -17.353 -5.147 1.00 3.62 O ATOM 1414 CB THR A 205 -4.394 -15.998 -6.478 1.00 3.16 C ATOM 1415 OG1 THR A 205 -4.088 -17.135 -7.293 1.00 3.77 O ATOM 1416 CG2 THR A 205 -5.347 -15.075 -7.222 1.00 4.29 C ATOM 0 H THR A 205 -2.192 -15.677 -7.941 1.00 2.70 H new ATOM 0 HA THR A 205 -3.354 -14.322 -5.603 1.00 2.30 H new ATOM 0 HB THR A 205 -4.879 -16.330 -5.560 1.00 3.16 H new ATOM 0 HG1 THR A 205 -3.426 -17.696 -6.837 1.00 3.77 H new ATOM 0 HG21 THR A 205 -6.255 -15.620 -7.480 1.00 4.29 H new ATOM 0 HG22 THR A 205 -5.601 -14.226 -6.587 1.00 4.29 H new ATOM 0 HG23 THR A 205 -4.869 -14.716 -8.133 1.00 4.29 H new ATOM 1424 N HIS A 206 -1.464 -15.487 -4.322 1.00 2.21 N ATOM 1425 CA HIS A 206 -0.636 -16.204 -3.358 1.00 2.49 C ATOM 1426 C HIS A 206 -1.468 -16.671 -2.168 1.00 2.67 C ATOM 1427 O HIS A 206 -1.134 -17.658 -1.513 1.00 3.63 O ATOM 1428 CB HIS A 206 0.510 -15.313 -2.876 1.00 3.68 C ATOM 1429 CG HIS A 206 1.866 -15.824 -3.255 1.00 5.18 C ATOM 1430 ND1 HIS A 206 2.335 -17.065 -2.878 1.00 5.45 N ATOM 1431 CD2 HIS A 206 2.854 -15.256 -3.984 1.00 7.05 C ATOM 1432 CE1 HIS A 206 3.554 -17.236 -3.356 1.00 7.16 C ATOM 1433 NE2 HIS A 206 3.893 -16.153 -4.032 1.00 8.18 N ATOM 0 H HIS A 206 -1.349 -14.474 -4.306 1.00 2.21 H new ATOM 0 HA HIS A 206 -0.221 -17.081 -3.854 1.00 2.49 H new ATOM 0 HB2 HIS A 206 0.380 -14.312 -3.288 1.00 3.68 H new ATOM 0 HB3 HIS A 206 0.456 -15.220 -1.791 1.00 3.68 H new ATOM 0 HD2 HIS A 206 2.830 -14.279 -4.443 1.00 7.05 H new ATOM 0 HE1 HIS A 206 4.169 -18.113 -3.218 1.00 7.16 H new ATOM 0 HE2 HIS A 206 4.781 -16.007 -4.511 1.00 8.18 H new ATOM 1441 N SER A 207 -2.553 -15.953 -1.893 1.00 3.47 N ATOM 1442 CA SER A 207 -3.431 -16.291 -0.778 1.00 5.48 C ATOM 1443 C SER A 207 -4.866 -16.485 -1.257 1.00 7.04 C ATOM 1444 O SER A 207 -5.605 -17.309 -0.721 1.00 8.63 O ATOM 1445 CB SER A 207 -3.380 -15.196 0.289 1.00 6.95 C ATOM 1446 OG SER A 207 -4.443 -15.337 1.215 1.00 8.32 O ATOM 0 H SER A 207 -2.845 -15.134 -2.427 1.00 3.47 H new ATOM 0 HA SER A 207 -3.082 -17.228 -0.343 1.00 5.48 H new ATOM 0 HB2 SER A 207 -2.427 -15.241 0.815 1.00 6.95 H new ATOM 0 HB3 SER A 207 -3.436 -14.217 -0.187 1.00 6.95 H new ATOM 0 HG SER A 207 -4.577 -14.491 1.691 1.00 8.32 H new ATOM 1452 N GLY A 208 -5.254 -15.718 -2.271 1.00 6.85 N ATOM 1453 CA GLY A 208 -6.599 -15.819 -2.806 1.00 8.57 C ATOM 1454 C GLY A 208 -7.029 -14.563 -3.537 1.00 8.89 C ATOM 1455 O GLY A 208 -8.109 -14.029 -3.286 1.00 9.96 O ATOM 0 H GLY A 208 -4.661 -15.028 -2.732 1.00 6.85 H new ATOM 0 HA2 GLY A 208 -6.653 -16.668 -3.487 1.00 8.57 H new ATOM 0 HA3 GLY A 208 -7.296 -16.019 -1.992 1.00 8.57 H new ATOM 1459 N GLY A 209 -6.180 -14.087 -4.443 1.00 8.21 N ATOM 1460 CA GLY A 209 -6.495 -12.888 -5.197 1.00 8.56 C ATOM 1461 C GLY A 209 -5.254 -12.174 -5.696 1.00 7.02 C ATOM 1462 O GLY A 209 -4.175 -12.311 -5.119 1.00 6.71 O ATOM 0 H GLY A 209 -5.280 -14.511 -4.668 1.00 8.21 H new ATOM 0 HA2 GLY A 209 -7.125 -13.152 -6.047 1.00 8.56 H new ATOM 0 HA3 GLY A 209 -7.073 -12.210 -4.570 1.00 8.56 H new ATOM 1466 N THR A 210 -5.406 -11.410 -6.773 1.00 6.30 N ATOM 1467 CA THR A 210 -4.289 -10.674 -7.351 1.00 5.19 C ATOM 1468 C THR A 210 -3.705 -9.684 -6.350 1.00 3.96 C ATOM 1469 O THR A 210 -4.345 -8.696 -5.994 1.00 4.11 O ATOM 1470 CB THR A 210 -4.715 -9.911 -8.620 1.00 5.41 C ATOM 1471 OG1 THR A 210 -5.949 -10.440 -9.118 1.00 7.23 O ATOM 1472 CG2 THR A 210 -3.644 -10.010 -9.696 1.00 5.57 C ATOM 0 H THR A 210 -6.292 -11.285 -7.263 1.00 6.30 H new ATOM 0 HA THR A 210 -3.530 -11.410 -7.615 1.00 5.19 H new ATOM 0 HB THR A 210 -4.849 -8.861 -8.359 1.00 5.41 H new ATOM 0 HG1 THR A 210 -5.917 -10.479 -10.097 1.00 7.23 H new ATOM 0 HG21 THR A 210 -3.967 -9.464 -10.582 1.00 5.57 H new ATOM 0 HG22 THR A 210 -2.714 -9.580 -9.324 1.00 5.57 H new ATOM 0 HG23 THR A 210 -3.483 -11.057 -9.954 1.00 5.57 H new ATOM 1480 N ASN A 211 -2.484 -9.957 -5.899 1.00 3.54 N ATOM 1481 CA ASN A 211 -1.814 -9.089 -4.937 1.00 3.13 C ATOM 1482 C ASN A 211 -2.416 -9.252 -3.545 1.00 2.44 C ATOM 1483 O ASN A 211 -1.698 -9.461 -2.566 1.00 2.99 O ATOM 1484 CB ASN A 211 -1.914 -7.628 -5.380 1.00 4.80 C ATOM 1485 CG ASN A 211 -2.542 -6.744 -4.320 1.00 6.37 C ATOM 1486 OD1 ASN A 211 -1.872 -6.306 -3.385 1.00 6.75 O ATOM 1487 ND2 ASN A 211 -3.835 -6.479 -4.462 1.00 7.94 N ATOM 0 H ASN A 211 -1.940 -10.771 -6.184 1.00 3.54 H new ATOM 0 HA ASN A 211 -0.764 -9.378 -4.895 1.00 3.13 H new ATOM 0 HB2 ASN A 211 -0.918 -7.254 -5.617 1.00 4.80 H new ATOM 0 HB3 ASN A 211 -2.503 -7.568 -6.295 1.00 4.80 H new ATOM 0 HD21 ASN A 211 -4.313 -5.890 -3.780 1.00 7.94 H new ATOM 0 HD22 ASN A 211 -4.351 -6.864 -5.253 1.00 7.94 H new ATOM 1494 N LEU A 212 -3.738 -9.156 -3.463 1.00 2.64 N ATOM 1495 CA LEU A 212 -4.438 -9.294 -2.191 1.00 2.72 C ATOM 1496 C LEU A 212 -3.846 -8.361 -1.140 1.00 2.13 C ATOM 1497 O LEU A 212 -2.987 -7.533 -1.443 1.00 1.92 O ATOM 1498 CB LEU A 212 -4.369 -10.742 -1.702 1.00 3.22 C ATOM 1499 CG LEU A 212 -5.694 -11.505 -1.674 1.00 4.55 C ATOM 1500 CD1 LEU A 212 -5.486 -12.915 -1.145 1.00 5.52 C ATOM 1501 CD2 LEU A 212 -6.720 -10.762 -0.830 1.00 5.64 C ATOM 0 H LEU A 212 -4.347 -8.983 -4.263 1.00 2.64 H new ATOM 0 HA LEU A 212 -5.481 -9.020 -2.347 1.00 2.72 H new ATOM 0 HB2 LEU A 212 -3.672 -11.287 -2.339 1.00 3.22 H new ATOM 0 HB3 LEU A 212 -3.950 -10.745 -0.696 1.00 3.22 H new ATOM 0 HG LEU A 212 -6.074 -11.574 -2.693 1.00 4.55 H new ATOM 0 HD11 LEU A 212 -6.439 -13.443 -1.132 1.00 5.52 H new ATOM 0 HD12 LEU A 212 -4.786 -13.446 -1.790 1.00 5.52 H new ATOM 0 HD13 LEU A 212 -5.083 -12.868 -0.133 1.00 5.52 H new ATOM 0 HD21 LEU A 212 -7.657 -11.320 -0.821 1.00 5.64 H new ATOM 0 HD22 LEU A 212 -6.348 -10.662 0.190 1.00 5.64 H new ATOM 0 HD23 LEU A 212 -6.891 -9.772 -1.253 1.00 5.64 H new ATOM 1513 N PHE A 213 -4.309 -8.503 0.098 1.00 2.16 N ATOM 1514 CA PHE A 213 -3.824 -7.674 1.195 1.00 1.99 C ATOM 1515 C PHE A 213 -2.377 -8.016 1.537 1.00 1.70 C ATOM 1516 O PHE A 213 -1.715 -7.292 2.282 1.00 1.76 O ATOM 1517 CB PHE A 213 -4.708 -7.856 2.430 1.00 2.55 C ATOM 1518 CG PHE A 213 -4.381 -9.089 3.225 1.00 3.05 C ATOM 1519 CD1 PHE A 213 -4.666 -10.348 2.722 1.00 3.64 C ATOM 1520 CD2 PHE A 213 -3.789 -8.987 4.473 1.00 4.22 C ATOM 1521 CE1 PHE A 213 -4.367 -11.484 3.452 1.00 4.85 C ATOM 1522 CE2 PHE A 213 -3.487 -10.119 5.207 1.00 5.33 C ATOM 1523 CZ PHE A 213 -3.776 -11.369 4.695 1.00 5.50 C ATOM 0 H PHE A 213 -5.019 -9.184 0.366 1.00 2.16 H new ATOM 0 HA PHE A 213 -3.867 -6.633 0.876 1.00 1.99 H new ATOM 0 HB2 PHE A 213 -4.606 -6.981 3.072 1.00 2.55 H new ATOM 0 HB3 PHE A 213 -5.751 -7.901 2.117 1.00 2.55 H new ATOM 0 HD1 PHE A 213 -5.126 -10.443 1.750 1.00 3.64 H new ATOM 0 HD2 PHE A 213 -3.561 -8.012 4.877 1.00 4.22 H new ATOM 0 HE1 PHE A 213 -4.595 -12.460 3.050 1.00 4.85 H new ATOM 0 HE2 PHE A 213 -3.026 -10.026 6.179 1.00 5.33 H new ATOM 0 HZ PHE A 213 -3.540 -12.255 5.266 1.00 5.50 H new ATOM 1533 N LEU A 214 -1.892 -9.124 0.987 1.00 1.73 N ATOM 1534 CA LEU A 214 -0.523 -9.564 1.233 1.00 1.87 C ATOM 1535 C LEU A 214 0.478 -8.500 0.795 1.00 1.71 C ATOM 1536 O LEU A 214 1.255 -7.991 1.605 1.00 1.75 O ATOM 1537 CB LEU A 214 -0.247 -10.875 0.494 1.00 2.24 C ATOM 1538 CG LEU A 214 1.050 -11.595 0.865 1.00 2.36 C ATOM 1539 CD1 LEU A 214 0.773 -13.050 1.210 1.00 3.21 C ATOM 1540 CD2 LEU A 214 2.058 -11.496 -0.270 1.00 3.40 C ATOM 0 H LEU A 214 -2.426 -9.734 0.368 1.00 1.73 H new ATOM 0 HA LEU A 214 -0.407 -9.727 2.305 1.00 1.87 H new ATOM 0 HB2 LEU A 214 -1.080 -11.554 0.676 1.00 2.24 H new ATOM 0 HB3 LEU A 214 -0.231 -10.669 -0.576 1.00 2.24 H new ATOM 0 HG LEU A 214 1.474 -11.110 1.744 1.00 2.36 H new ATOM 0 HD11 LEU A 214 1.708 -13.546 1.471 1.00 3.21 H new ATOM 0 HD12 LEU A 214 0.087 -13.099 2.056 1.00 3.21 H new ATOM 0 HD13 LEU A 214 0.325 -13.549 0.350 1.00 3.21 H new ATOM 0 HD21 LEU A 214 2.975 -12.014 0.011 1.00 3.40 H new ATOM 0 HD22 LEU A 214 1.642 -11.955 -1.167 1.00 3.40 H new ATOM 0 HD23 LEU A 214 2.280 -10.448 -0.469 1.00 3.40 H new ATOM 1552 N THR A 215 0.454 -8.166 -0.491 1.00 1.63 N ATOM 1553 CA THR A 215 1.358 -7.161 -1.037 1.00 1.53 C ATOM 1554 C THR A 215 1.040 -5.777 -0.485 1.00 1.34 C ATOM 1555 O THR A 215 1.900 -4.897 -0.456 1.00 1.32 O ATOM 1556 CB THR A 215 1.287 -7.117 -2.575 1.00 1.57 C ATOM 1557 OG1 THR A 215 1.690 -8.379 -3.120 1.00 1.66 O ATOM 1558 CG2 THR A 215 2.176 -6.013 -3.127 1.00 1.53 C ATOM 0 H THR A 215 -0.182 -8.577 -1.175 1.00 1.63 H new ATOM 0 HA THR A 215 2.366 -7.446 -0.736 1.00 1.53 H new ATOM 0 HB THR A 215 0.257 -6.909 -2.863 1.00 1.57 H new ATOM 0 HG1 THR A 215 1.863 -8.281 -4.080 1.00 1.66 H new ATOM 0 HG21 THR A 215 2.109 -6.002 -4.215 1.00 1.53 H new ATOM 0 HG22 THR A 215 1.848 -5.051 -2.733 1.00 1.53 H new ATOM 0 HG23 THR A 215 3.209 -6.194 -2.829 1.00 1.53 H new ATOM 1566 N ALA A 216 -0.201 -5.590 -0.047 1.00 1.30 N ATOM 1567 CA ALA A 216 -0.632 -4.313 0.506 1.00 1.22 C ATOM 1568 C ALA A 216 0.334 -3.826 1.581 1.00 1.14 C ATOM 1569 O ALA A 216 0.658 -2.641 1.649 1.00 1.13 O ATOM 1570 CB ALA A 216 -2.039 -4.431 1.073 1.00 1.36 C ATOM 0 H ALA A 216 -0.926 -6.308 -0.065 1.00 1.30 H new ATOM 0 HA ALA A 216 -0.637 -3.580 -0.300 1.00 1.22 H new ATOM 0 HB1 ALA A 216 -2.348 -3.469 1.483 1.00 1.36 H new ATOM 0 HB2 ALA A 216 -2.727 -4.726 0.281 1.00 1.36 H new ATOM 0 HB3 ALA A 216 -2.051 -5.183 1.862 1.00 1.36 H new ATOM 1576 N VAL A 217 0.791 -4.750 2.422 1.00 1.20 N ATOM 1577 CA VAL A 217 1.720 -4.415 3.494 1.00 1.22 C ATOM 1578 C VAL A 217 2.953 -3.701 2.950 1.00 1.20 C ATOM 1579 O VAL A 217 3.327 -2.631 3.432 1.00 1.21 O ATOM 1580 CB VAL A 217 2.167 -5.673 4.262 1.00 1.35 C ATOM 1581 CG1 VAL A 217 3.176 -5.309 5.342 1.00 1.47 C ATOM 1582 CG2 VAL A 217 0.964 -6.385 4.863 1.00 1.43 C ATOM 0 H VAL A 217 0.532 -5.736 2.381 1.00 1.20 H new ATOM 0 HA VAL A 217 1.190 -3.750 4.176 1.00 1.22 H new ATOM 0 HB VAL A 217 2.651 -6.353 3.561 1.00 1.35 H new ATOM 0 HG11 VAL A 217 3.480 -6.210 5.874 1.00 1.47 H new ATOM 0 HG12 VAL A 217 4.050 -4.846 4.883 1.00 1.47 H new ATOM 0 HG13 VAL A 217 2.722 -4.609 6.044 1.00 1.47 H new ATOM 0 HG21 VAL A 217 1.298 -7.272 5.402 1.00 1.43 H new ATOM 0 HG22 VAL A 217 0.450 -5.714 5.551 1.00 1.43 H new ATOM 0 HG23 VAL A 217 0.281 -6.680 4.067 1.00 1.43 H new ATOM 1592 N HIS A 218 3.580 -4.299 1.942 1.00 1.27 N ATOM 1593 CA HIS A 218 4.770 -3.720 1.330 1.00 1.36 C ATOM 1594 C HIS A 218 4.413 -2.483 0.510 1.00 1.30 C ATOM 1595 O HIS A 218 4.991 -1.414 0.701 1.00 1.28 O ATOM 1596 CB HIS A 218 5.467 -4.751 0.442 1.00 1.55 C ATOM 1597 CG HIS A 218 6.566 -4.175 -0.396 1.00 2.37 C ATOM 1598 ND1 HIS A 218 7.466 -3.245 0.079 1.00 3.24 N ATOM 1599 CD2 HIS A 218 6.909 -4.403 -1.686 1.00 3.66 C ATOM 1600 CE1 HIS A 218 8.314 -2.925 -0.882 1.00 4.46 C ATOM 1601 NE2 HIS A 218 7.998 -3.614 -1.964 1.00 4.71 N ATOM 0 H HIS A 218 3.283 -5.185 1.532 1.00 1.27 H new ATOM 0 HA HIS A 218 5.449 -3.421 2.128 1.00 1.36 H new ATOM 0 HB2 HIS A 218 5.877 -5.542 1.070 1.00 1.55 H new ATOM 0 HB3 HIS A 218 4.728 -5.214 -0.212 1.00 1.55 H new ATOM 0 HD1 HIS A 218 7.476 -2.864 1.025 1.00 3.24 H new ATOM 0 HD2 HIS A 218 6.417 -5.080 -2.369 1.00 3.66 H new ATOM 0 HE1 HIS A 218 9.128 -2.220 -0.797 1.00 4.46 H new ATOM 1609 N GLU A 219 3.458 -2.639 -0.401 1.00 1.35 N ATOM 1610 CA GLU A 219 3.026 -1.535 -1.250 1.00 1.38 C ATOM 1611 C GLU A 219 2.710 -0.298 -0.415 1.00 1.34 C ATOM 1612 O GLU A 219 3.355 0.741 -0.556 1.00 1.41 O ATOM 1613 CB GLU A 219 1.798 -1.941 -2.067 1.00 1.45 C ATOM 1614 CG GLU A 219 1.142 -0.781 -2.797 1.00 1.74 C ATOM 1615 CD GLU A 219 2.149 0.119 -3.486 1.00 1.97 C ATOM 1616 OE1 GLU A 219 2.886 -0.377 -4.364 1.00 2.46 O ATOM 1617 OE2 GLU A 219 2.200 1.320 -3.147 1.00 3.17 O ATOM 0 H GLU A 219 2.969 -3.518 -0.570 1.00 1.35 H new ATOM 0 HA GLU A 219 3.842 -1.293 -1.931 1.00 1.38 H new ATOM 0 HB2 GLU A 219 2.090 -2.698 -2.794 1.00 1.45 H new ATOM 0 HB3 GLU A 219 1.067 -2.402 -1.403 1.00 1.45 H new ATOM 0 HG2 GLU A 219 0.443 -1.171 -3.537 1.00 1.74 H new ATOM 0 HG3 GLU A 219 0.560 -0.193 -2.088 1.00 1.74 H new ATOM 1624 N ILE A 220 1.712 -0.418 0.454 1.00 1.30 N ATOM 1625 CA ILE A 220 1.310 0.690 1.312 1.00 1.31 C ATOM 1626 C ILE A 220 2.350 0.951 2.396 1.00 1.46 C ATOM 1627 O ILE A 220 2.279 1.949 3.112 1.00 1.62 O ATOM 1628 CB ILE A 220 -0.052 0.420 1.978 1.00 1.34 C ATOM 1629 CG1 ILE A 220 -0.787 1.737 2.239 1.00 1.56 C ATOM 1630 CG2 ILE A 220 0.136 -0.353 3.275 1.00 1.99 C ATOM 1631 CD1 ILE A 220 -2.137 1.556 2.897 1.00 2.19 C ATOM 0 H ILE A 220 1.167 -1.271 0.583 1.00 1.30 H new ATOM 0 HA ILE A 220 1.226 1.569 0.673 1.00 1.31 H new ATOM 0 HB ILE A 220 -0.657 -0.184 1.302 1.00 1.34 H new ATOM 0 HG12 ILE A 220 -0.166 2.371 2.872 1.00 1.56 H new ATOM 0 HG13 ILE A 220 -0.920 2.263 1.294 1.00 1.56 H new ATOM 0 HG21 ILE A 220 -0.836 -0.536 3.734 1.00 1.99 H new ATOM 0 HG22 ILE A 220 0.623 -1.305 3.064 1.00 1.99 H new ATOM 0 HG23 ILE A 220 0.756 0.228 3.958 1.00 1.99 H new ATOM 0 HD11 ILE A 220 -2.600 2.531 3.052 1.00 2.19 H new ATOM 0 HD12 ILE A 220 -2.776 0.948 2.256 1.00 2.19 H new ATOM 0 HD13 ILE A 220 -2.009 1.058 3.858 1.00 2.19 H new ATOM 1643 N GLY A 221 3.318 0.047 2.510 1.00 1.48 N ATOM 1644 CA GLY A 221 4.361 0.198 3.508 1.00 1.65 C ATOM 1645 C GLY A 221 5.063 1.539 3.414 1.00 1.55 C ATOM 1646 O GLY A 221 5.286 2.203 4.427 1.00 1.90 O ATOM 0 H GLY A 221 3.399 -0.787 1.929 1.00 1.48 H new ATOM 0 HA2 GLY A 221 3.928 0.087 4.502 1.00 1.65 H new ATOM 0 HA3 GLY A 221 5.093 -0.601 3.388 1.00 1.65 H new ATOM 1650 N HIS A 222 5.412 1.939 2.196 1.00 1.33 N ATOM 1651 CA HIS A 222 6.094 3.209 1.974 1.00 1.60 C ATOM 1652 C HIS A 222 5.311 4.362 2.596 1.00 2.11 C ATOM 1653 O HIS A 222 5.872 5.414 2.899 1.00 2.40 O ATOM 1654 CB HIS A 222 6.284 3.455 0.477 1.00 1.79 C ATOM 1655 CG HIS A 222 6.879 2.289 -0.251 1.00 2.31 C ATOM 1656 ND1 HIS A 222 8.177 1.866 -0.061 1.00 2.87 N ATOM 1657 CD2 HIS A 222 6.343 1.454 -1.172 1.00 3.73 C ATOM 1658 CE1 HIS A 222 8.415 0.822 -0.836 1.00 3.99 C ATOM 1659 NE2 HIS A 222 7.318 0.552 -1.520 1.00 4.52 N ATOM 0 H HIS A 222 5.234 1.402 1.347 1.00 1.33 H new ATOM 0 HA HIS A 222 7.072 3.157 2.453 1.00 1.60 H new ATOM 0 HB2 HIS A 222 5.319 3.697 0.032 1.00 1.79 H new ATOM 0 HB3 HIS A 222 6.926 4.325 0.339 1.00 1.79 H new ATOM 0 HD1 HIS A 222 8.849 2.292 0.578 1.00 2.87 H new ATOM 0 HD2 HIS A 222 5.336 1.491 -1.561 1.00 3.73 H new ATOM 0 HE1 HIS A 222 9.348 0.282 -0.899 1.00 3.99 H new ATOM 1667 N SER A 223 4.011 4.155 2.782 1.00 2.35 N ATOM 1668 CA SER A 223 3.150 5.178 3.363 1.00 3.00 C ATOM 1669 C SER A 223 3.034 4.997 4.873 1.00 3.32 C ATOM 1670 O SER A 223 3.304 5.919 5.644 1.00 3.84 O ATOM 1671 CB SER A 223 1.761 5.129 2.723 1.00 3.07 C ATOM 1672 OG SER A 223 1.851 5.069 1.311 1.00 2.63 O ATOM 0 H SER A 223 3.531 3.288 2.539 1.00 2.35 H new ATOM 0 HA SER A 223 3.599 6.151 3.165 1.00 3.00 H new ATOM 0 HB2 SER A 223 1.217 4.260 3.093 1.00 3.07 H new ATOM 0 HB3 SER A 223 1.191 6.010 3.017 1.00 3.07 H new ATOM 0 HG SER A 223 0.950 5.037 0.927 1.00 2.63 H new ATOM 1678 N LEU A 224 2.630 3.802 5.290 1.00 3.18 N ATOM 1679 CA LEU A 224 2.477 3.498 6.708 1.00 3.68 C ATOM 1680 C LEU A 224 3.414 2.369 7.127 1.00 4.65 C ATOM 1681 O LEU A 224 3.693 1.459 6.348 1.00 5.72 O ATOM 1682 CB LEU A 224 1.029 3.113 7.015 1.00 3.19 C ATOM 1683 CG LEU A 224 -0.043 4.080 6.510 1.00 2.40 C ATOM 1684 CD1 LEU A 224 0.414 5.520 6.680 1.00 2.21 C ATOM 1685 CD2 LEU A 224 -0.376 3.793 5.053 1.00 2.98 C ATOM 0 H LEU A 224 2.403 3.028 4.666 1.00 3.18 H new ATOM 0 HA LEU A 224 2.737 4.392 7.275 1.00 3.68 H new ATOM 0 HB2 LEU A 224 0.836 2.131 6.584 1.00 3.19 H new ATOM 0 HB3 LEU A 224 0.921 3.014 8.095 1.00 3.19 H new ATOM 0 HG LEU A 224 -0.945 3.934 7.104 1.00 2.40 H new ATOM 0 HD11 LEU A 224 -0.362 6.193 6.315 1.00 2.21 H new ATOM 0 HD12 LEU A 224 0.602 5.720 7.735 1.00 2.21 H new ATOM 0 HD13 LEU A 224 1.330 5.680 6.112 1.00 2.21 H new ATOM 0 HD21 LEU A 224 -1.140 4.490 4.710 1.00 2.98 H new ATOM 0 HD22 LEU A 224 0.521 3.910 4.445 1.00 2.98 H new ATOM 0 HD23 LEU A 224 -0.747 2.773 4.959 1.00 2.98 H new ATOM 1697 N GLY A 225 3.895 2.435 8.365 1.00 5.24 N ATOM 1698 CA GLY A 225 4.794 1.411 8.866 1.00 6.09 C ATOM 1699 C GLY A 225 6.242 1.859 8.863 1.00 5.37 C ATOM 1700 O GLY A 225 6.760 2.317 9.883 1.00 5.93 O ATOM 0 H GLY A 225 3.679 3.178 9.029 1.00 5.24 H new ATOM 0 HA2 GLY A 225 4.503 1.141 9.881 1.00 6.09 H new ATOM 0 HA3 GLY A 225 4.693 0.513 8.256 1.00 6.09 H new ATOM 1704 N LEU A 226 6.898 1.726 7.716 1.00 4.85 N ATOM 1705 CA LEU A 226 8.297 2.120 7.584 1.00 4.27 C ATOM 1706 C LEU A 226 8.719 2.147 6.119 1.00 2.81 C ATOM 1707 O LEU A 226 8.436 1.219 5.363 1.00 3.64 O ATOM 1708 CB LEU A 226 9.193 1.158 8.367 1.00 6.11 C ATOM 1709 CG LEU A 226 9.522 -0.165 7.677 1.00 7.43 C ATOM 1710 CD1 LEU A 226 10.531 -0.958 8.494 1.00 8.98 C ATOM 1711 CD2 LEU A 226 8.256 -0.980 7.453 1.00 8.89 C ATOM 0 H LEU A 226 6.484 1.348 6.864 1.00 4.85 H new ATOM 0 HA LEU A 226 8.407 3.124 7.993 1.00 4.27 H new ATOM 0 HB2 LEU A 226 10.129 1.669 8.594 1.00 6.11 H new ATOM 0 HB3 LEU A 226 8.711 0.938 9.319 1.00 6.11 H new ATOM 0 HG LEU A 226 9.965 0.055 6.706 1.00 7.43 H new ATOM 0 HD11 LEU A 226 10.753 -1.897 7.987 1.00 8.98 H new ATOM 0 HD12 LEU A 226 11.448 -0.378 8.602 1.00 8.98 H new ATOM 0 HD13 LEU A 226 10.116 -1.168 9.480 1.00 8.98 H new ATOM 0 HD21 LEU A 226 8.510 -1.919 6.961 1.00 8.89 H new ATOM 0 HD22 LEU A 226 7.784 -1.190 8.413 1.00 8.89 H new ATOM 0 HD23 LEU A 226 7.566 -0.416 6.825 1.00 8.89 H new ATOM 1723 N GLY A 227 9.401 3.219 5.725 1.00 2.18 N ATOM 1724 CA GLY A 227 9.853 3.346 4.352 1.00 3.28 C ATOM 1725 C GLY A 227 11.285 2.883 4.168 1.00 3.25 C ATOM 1726 O GLY A 227 11.726 2.638 3.044 1.00 4.44 O ATOM 0 H GLY A 227 9.648 4.001 6.332 1.00 2.18 H new ATOM 0 HA2 GLY A 227 9.200 2.764 3.702 1.00 3.28 H new ATOM 0 HA3 GLY A 227 9.768 4.387 4.039 1.00 3.28 H new ATOM 1730 N HIS A 228 12.013 2.763 5.273 1.00 3.00 N ATOM 1731 CA HIS A 228 13.405 2.327 5.228 1.00 3.70 C ATOM 1732 C HIS A 228 13.818 1.694 6.554 1.00 3.47 C ATOM 1733 O HIS A 228 13.468 2.189 7.625 1.00 4.70 O ATOM 1734 CB HIS A 228 14.321 3.508 4.905 1.00 4.84 C ATOM 1735 CG HIS A 228 14.055 4.720 5.744 1.00 6.36 C ATOM 1736 ND1 HIS A 228 13.029 5.604 5.484 1.00 7.09 N ATOM 1737 CD2 HIS A 228 14.686 5.192 6.844 1.00 7.87 C ATOM 1738 CE1 HIS A 228 13.042 6.568 6.387 1.00 8.85 C ATOM 1739 NE2 HIS A 228 14.038 6.341 7.224 1.00 9.37 N ATOM 0 H HIS A 228 11.663 2.961 6.210 1.00 3.00 H new ATOM 0 HA HIS A 228 13.501 1.578 4.442 1.00 3.70 H new ATOM 0 HB2 HIS A 228 15.358 3.201 5.043 1.00 4.84 H new ATOM 0 HB3 HIS A 228 14.204 3.771 3.854 1.00 4.84 H new ATOM 0 HD2 HIS A 228 15.541 4.747 7.332 1.00 7.87 H new ATOM 0 HE1 HIS A 228 12.355 7.400 6.433 1.00 8.85 H new ATOM 0 HE2 HIS A 228 14.286 6.925 8.023 1.00 9.37 H new ATOM 1795 N LYS A 233 12.799 -10.221 7.581 1.00 3.30 N ATOM 1796 CA LYS A 233 11.466 -10.658 7.976 1.00 3.63 C ATOM 1797 C LYS A 233 10.429 -10.252 6.933 1.00 3.41 C ATOM 1798 O LYS A 233 9.969 -11.078 6.147 1.00 4.27 O ATOM 1799 CB LYS A 233 11.095 -10.066 9.337 1.00 4.56 C ATOM 1800 CG LYS A 233 11.979 -10.552 10.473 1.00 4.85 C ATOM 1801 CD LYS A 233 12.337 -9.422 11.424 1.00 5.41 C ATOM 1802 CE LYS A 233 12.441 -9.913 12.859 1.00 6.28 C ATOM 1803 NZ LYS A 233 13.725 -10.625 13.110 1.00 6.02 N ATOM 0 HA LYS A 233 11.475 -11.745 8.050 1.00 3.63 H new ATOM 0 HB2 LYS A 233 11.156 -8.979 9.280 1.00 4.56 H new ATOM 0 HB3 LYS A 233 10.058 -10.316 9.562 1.00 4.56 H new ATOM 0 HG2 LYS A 233 11.466 -11.342 11.022 1.00 4.85 H new ATOM 0 HG3 LYS A 233 12.891 -10.988 10.065 1.00 4.85 H new ATOM 0 HD2 LYS A 233 13.285 -8.977 11.121 1.00 5.41 H new ATOM 0 HD3 LYS A 233 11.582 -8.638 11.360 1.00 5.41 H new ATOM 0 HE2 LYS A 233 12.356 -9.066 13.540 1.00 6.28 H new ATOM 0 HE3 LYS A 233 11.607 -10.581 13.076 1.00 6.28 H new ATOM 0 HZ1 LYS A 233 13.757 -10.944 14.099 1.00 6.02 H new ATOM 0 HZ2 LYS A 233 13.795 -11.448 12.478 1.00 6.02 H new ATOM 0 HZ3 LYS A 233 14.521 -9.981 12.928 1.00 6.02 H new ATOM 1817 N ALA A 234 10.067 -8.973 6.933 1.00 3.10 N ATOM 1818 CA ALA A 234 9.087 -8.456 5.986 1.00 3.19 C ATOM 1819 C ALA A 234 9.636 -8.478 4.563 1.00 2.65 C ATOM 1820 O ALA A 234 10.689 -9.059 4.301 1.00 2.26 O ATOM 1821 CB ALA A 234 8.672 -7.044 6.372 1.00 3.81 C ATOM 0 H ALA A 234 10.438 -8.276 7.579 1.00 3.10 H new ATOM 0 HA ALA A 234 8.210 -9.102 6.020 1.00 3.19 H new ATOM 0 HB1 ALA A 234 7.940 -6.671 5.656 1.00 3.81 H new ATOM 0 HB2 ALA A 234 8.232 -7.054 7.369 1.00 3.81 H new ATOM 0 HB3 ALA A 234 9.547 -6.394 6.368 1.00 3.81 H new ATOM 1827 N VAL A 235 8.915 -7.840 3.646 1.00 3.17 N ATOM 1828 CA VAL A 235 9.330 -7.786 2.249 1.00 3.35 C ATOM 1829 C VAL A 235 10.514 -6.844 2.064 1.00 3.17 C ATOM 1830 O VAL A 235 11.547 -7.230 1.517 1.00 3.57 O ATOM 1831 CB VAL A 235 8.176 -7.327 1.338 1.00 4.40 C ATOM 1832 CG1 VAL A 235 8.623 -7.295 -0.115 1.00 6.37 C ATOM 1833 CG2 VAL A 235 6.967 -8.233 1.513 1.00 5.39 C ATOM 0 H VAL A 235 8.041 -7.354 3.845 1.00 3.17 H new ATOM 0 HA VAL A 235 9.626 -8.797 1.967 1.00 3.35 H new ATOM 0 HB VAL A 235 7.888 -6.316 1.627 1.00 4.40 H new ATOM 0 HG11 VAL A 235 7.794 -6.968 -0.743 1.00 6.37 H new ATOM 0 HG12 VAL A 235 9.457 -6.601 -0.224 1.00 6.37 H new ATOM 0 HG13 VAL A 235 8.939 -8.292 -0.421 1.00 6.37 H new ATOM 0 HG21 VAL A 235 6.161 -7.894 0.862 1.00 5.39 H new ATOM 0 HG22 VAL A 235 7.238 -9.256 1.252 1.00 5.39 H new ATOM 0 HG23 VAL A 235 6.634 -8.199 2.550 1.00 5.39 H new ATOM 1843 N MET A 236 10.357 -5.607 2.524 1.00 3.35 N ATOM 1844 CA MET A 236 11.416 -4.610 2.411 1.00 3.36 C ATOM 1845 C MET A 236 11.701 -4.284 0.948 1.00 3.45 C ATOM 1846 O MET A 236 11.241 -3.269 0.427 1.00 4.27 O ATOM 1847 CB MET A 236 12.691 -5.109 3.093 1.00 3.72 C ATOM 1848 CG MET A 236 13.886 -4.191 2.892 1.00 4.93 C ATOM 1849 SD MET A 236 13.535 -2.483 3.348 1.00 6.20 S ATOM 1850 CE MET A 236 12.594 -2.721 4.853 1.00 6.71 C ATOM 0 H MET A 236 9.508 -5.271 2.978 1.00 3.35 H new ATOM 0 HA MET A 236 11.080 -3.700 2.909 1.00 3.36 H new ATOM 0 HB2 MET A 236 12.503 -5.219 4.161 1.00 3.72 H new ATOM 0 HB3 MET A 236 12.935 -6.099 2.709 1.00 3.72 H new ATOM 0 HG2 MET A 236 14.724 -4.557 3.486 1.00 4.93 H new ATOM 0 HG3 MET A 236 14.196 -4.228 1.848 1.00 4.93 H new ATOM 0 HE1 MET A 236 12.679 -1.833 5.480 1.00 6.71 H new ATOM 0 HE2 MET A 236 11.546 -2.890 4.604 1.00 6.71 H new ATOM 0 HE3 MET A 236 12.983 -3.585 5.392 1.00 6.71 H new ATOM 1860 N PHE A 237 12.463 -5.152 0.291 1.00 3.46 N ATOM 1861 CA PHE A 237 12.811 -4.956 -1.111 1.00 3.50 C ATOM 1862 C PHE A 237 11.581 -4.572 -1.928 1.00 3.26 C ATOM 1863 O PHE A 237 10.447 -4.906 -1.584 1.00 3.05 O ATOM 1864 CB PHE A 237 13.442 -6.226 -1.685 1.00 3.71 C ATOM 1865 CG PHE A 237 14.695 -6.649 -0.971 1.00 3.57 C ATOM 1866 CD1 PHE A 237 15.908 -6.043 -1.255 1.00 4.19 C ATOM 1867 CD2 PHE A 237 14.659 -7.652 -0.016 1.00 3.91 C ATOM 1868 CE1 PHE A 237 17.062 -6.429 -0.600 1.00 4.48 C ATOM 1869 CE2 PHE A 237 15.810 -8.042 0.643 1.00 4.48 C ATOM 1870 CZ PHE A 237 17.013 -7.430 0.349 1.00 4.48 C ATOM 0 H PHE A 237 12.851 -5.998 0.707 1.00 3.46 H new ATOM 0 HA PHE A 237 13.533 -4.142 -1.169 1.00 3.50 H new ATOM 0 HB2 PHE A 237 12.715 -7.037 -1.637 1.00 3.71 H new ATOM 0 HB3 PHE A 237 13.671 -6.064 -2.738 1.00 3.71 H new ATOM 0 HD1 PHE A 237 15.952 -5.260 -1.997 1.00 4.19 H new ATOM 0 HD2 PHE A 237 13.721 -8.135 0.216 1.00 3.91 H new ATOM 0 HE1 PHE A 237 18.001 -5.948 -0.830 1.00 4.48 H new ATOM 0 HE2 PHE A 237 15.769 -8.824 1.387 1.00 4.48 H new ATOM 0 HZ PHE A 237 17.914 -7.734 0.861 1.00 4.48 H new ATOM 1880 N PRO A 238 11.809 -3.852 -3.037 1.00 3.45 N ATOM 1881 CA PRO A 238 10.732 -3.407 -3.926 1.00 3.45 C ATOM 1882 C PRO A 238 10.095 -4.563 -4.689 1.00 3.36 C ATOM 1883 O PRO A 238 9.084 -4.389 -5.371 1.00 3.68 O ATOM 1884 CB PRO A 238 11.441 -2.455 -4.892 1.00 3.84 C ATOM 1885 CG PRO A 238 12.861 -2.906 -4.895 1.00 4.01 C ATOM 1886 CD PRO A 238 13.135 -3.419 -3.508 1.00 3.84 C ATOM 0 HA PRO A 238 9.913 -2.945 -3.375 1.00 3.45 H new ATOM 0 HB2 PRO A 238 11.007 -2.508 -5.890 1.00 3.84 H new ATOM 0 HB3 PRO A 238 11.355 -1.420 -4.562 1.00 3.84 H new ATOM 0 HG2 PRO A 238 13.021 -3.687 -5.639 1.00 4.01 H new ATOM 0 HG3 PRO A 238 13.531 -2.084 -5.147 1.00 4.01 H new ATOM 0 HD2 PRO A 238 13.847 -4.244 -3.518 1.00 3.84 H new ATOM 0 HD3 PRO A 238 13.555 -2.643 -2.868 1.00 3.84 H new ATOM 1894 N THR A 239 10.691 -5.745 -4.571 1.00 3.22 N ATOM 1895 CA THR A 239 10.183 -6.930 -5.250 1.00 3.22 C ATOM 1896 C THR A 239 9.113 -7.625 -4.415 1.00 3.11 C ATOM 1897 O THR A 239 9.070 -7.475 -3.194 1.00 3.16 O ATOM 1898 CB THR A 239 11.312 -7.932 -5.554 1.00 3.30 C ATOM 1899 OG1 THR A 239 12.578 -7.263 -5.537 1.00 3.53 O ATOM 1900 CG2 THR A 239 11.100 -8.592 -6.908 1.00 4.13 C ATOM 0 H THR A 239 11.528 -5.907 -4.010 1.00 3.22 H new ATOM 0 HA THR A 239 9.745 -6.592 -6.189 1.00 3.22 H new ATOM 0 HB THR A 239 11.299 -8.704 -4.785 1.00 3.30 H new ATOM 0 HG1 THR A 239 13.291 -7.907 -5.729 1.00 3.53 H new ATOM 0 HG21 THR A 239 11.910 -9.296 -7.101 1.00 4.13 H new ATOM 0 HG22 THR A 239 10.149 -9.125 -6.908 1.00 4.13 H new ATOM 0 HG23 THR A 239 11.089 -7.829 -7.687 1.00 4.13 H new ATOM 1908 N TYR A 240 8.253 -8.387 -5.081 1.00 3.16 N ATOM 1909 CA TYR A 240 7.182 -9.105 -4.400 1.00 3.20 C ATOM 1910 C TYR A 240 7.744 -10.217 -3.519 1.00 2.63 C ATOM 1911 O TYR A 240 8.504 -11.068 -3.983 1.00 2.48 O ATOM 1912 CB TYR A 240 6.204 -9.692 -5.419 1.00 3.76 C ATOM 1913 CG TYR A 240 6.815 -10.761 -6.297 1.00 4.31 C ATOM 1914 CD1 TYR A 240 7.518 -10.424 -7.448 1.00 4.93 C ATOM 1915 CD2 TYR A 240 6.688 -12.107 -5.978 1.00 4.99 C ATOM 1916 CE1 TYR A 240 8.077 -11.397 -8.254 1.00 5.67 C ATOM 1917 CE2 TYR A 240 7.245 -13.087 -6.777 1.00 5.84 C ATOM 1918 CZ TYR A 240 7.938 -12.727 -7.914 1.00 5.97 C ATOM 1919 OH TYR A 240 8.493 -13.700 -8.713 1.00 6.96 O ATOM 0 H TYR A 240 8.276 -8.524 -6.092 1.00 3.16 H new ATOM 0 HA TYR A 240 6.652 -8.396 -3.764 1.00 3.20 H new ATOM 0 HB2 TYR A 240 5.349 -10.113 -4.889 1.00 3.76 H new ATOM 0 HB3 TYR A 240 5.824 -8.889 -6.050 1.00 3.76 H new ATOM 0 HD1 TYR A 240 7.629 -9.384 -7.717 1.00 4.93 H new ATOM 0 HD2 TYR A 240 6.144 -12.393 -5.090 1.00 4.99 H new ATOM 0 HE1 TYR A 240 8.620 -11.118 -9.145 1.00 5.67 H new ATOM 0 HE2 TYR A 240 7.138 -14.129 -6.513 1.00 5.84 H new ATOM 0 HH TYR A 240 8.305 -14.583 -8.332 1.00 6.96 H new ATOM 1929 N LYS A 241 7.366 -10.202 -2.246 1.00 2.65 N ATOM 1930 CA LYS A 241 7.830 -11.209 -1.298 1.00 2.42 C ATOM 1931 C LYS A 241 6.663 -11.785 -0.503 1.00 2.20 C ATOM 1932 O LYS A 241 6.136 -11.138 0.403 1.00 2.51 O ATOM 1933 CB LYS A 241 8.862 -10.604 -0.344 1.00 2.98 C ATOM 1934 CG LYS A 241 10.004 -11.546 -0.006 1.00 2.93 C ATOM 1935 CD LYS A 241 10.252 -11.606 1.492 1.00 3.23 C ATOM 1936 CE LYS A 241 11.196 -12.742 1.856 1.00 3.28 C ATOM 1937 NZ LYS A 241 11.953 -12.456 3.105 1.00 3.85 N ATOM 0 H LYS A 241 6.739 -9.504 -1.846 1.00 2.65 H new ATOM 0 HA LYS A 241 8.296 -12.016 -1.862 1.00 2.42 H new ATOM 0 HB2 LYS A 241 9.270 -9.698 -0.791 1.00 2.98 H new ATOM 0 HB3 LYS A 241 8.362 -10.307 0.578 1.00 2.98 H new ATOM 0 HG2 LYS A 241 9.775 -12.545 -0.378 1.00 2.93 H new ATOM 0 HG3 LYS A 241 10.911 -11.217 -0.513 1.00 2.93 H new ATOM 0 HD2 LYS A 241 10.673 -10.659 1.830 1.00 3.23 H new ATOM 0 HD3 LYS A 241 9.304 -11.738 2.014 1.00 3.23 H new ATOM 0 HE2 LYS A 241 10.625 -13.662 1.980 1.00 3.28 H new ATOM 0 HE3 LYS A 241 11.896 -12.909 1.037 1.00 3.28 H new ATOM 0 HZ1 LYS A 241 12.585 -13.254 3.318 1.00 3.85 H new ATOM 0 HZ2 LYS A 241 12.517 -11.592 2.979 1.00 3.85 H new ATOM 0 HZ3 LYS A 241 11.286 -12.322 3.892 1.00 3.85 H new ATOM 1951 N TYR A 242 6.265 -13.006 -0.845 1.00 2.10 N ATOM 1952 CA TYR A 242 5.159 -13.669 -0.163 1.00 2.12 C ATOM 1953 C TYR A 242 5.356 -13.638 1.349 1.00 2.10 C ATOM 1954 O TYR A 242 6.166 -14.386 1.897 1.00 2.42 O ATOM 1955 CB TYR A 242 5.031 -15.115 -0.643 1.00 2.74 C ATOM 1956 CG TYR A 242 4.030 -15.928 0.146 1.00 3.73 C ATOM 1957 CD1 TYR A 242 2.664 -15.756 -0.041 1.00 4.83 C ATOM 1958 CD2 TYR A 242 4.450 -16.868 1.079 1.00 4.86 C ATOM 1959 CE1 TYR A 242 1.746 -16.496 0.678 1.00 6.60 C ATOM 1960 CE2 TYR A 242 3.539 -17.614 1.802 1.00 6.59 C ATOM 1961 CZ TYR A 242 2.188 -17.424 1.598 1.00 7.35 C ATOM 1962 OH TYR A 242 1.277 -18.164 2.317 1.00 9.36 O ATOM 0 H TYR A 242 6.692 -13.557 -1.590 1.00 2.10 H new ATOM 0 HA TYR A 242 4.242 -13.131 -0.403 1.00 2.12 H new ATOM 0 HB2 TYR A 242 4.740 -15.116 -1.693 1.00 2.74 H new ATOM 0 HB3 TYR A 242 6.007 -15.597 -0.582 1.00 2.74 H new ATOM 0 HD1 TYR A 242 2.314 -15.031 -0.761 1.00 4.83 H new ATOM 0 HD2 TYR A 242 5.507 -17.018 1.242 1.00 4.86 H new ATOM 0 HE1 TYR A 242 0.688 -16.349 0.521 1.00 6.60 H new ATOM 0 HE2 TYR A 242 3.883 -18.341 2.523 1.00 6.59 H new ATOM 0 HH TYR A 242 1.753 -18.772 2.920 1.00 9.36 H new ATOM 1972 N VAL A 243 4.607 -12.767 2.019 1.00 2.35 N ATOM 1973 CA VAL A 243 4.696 -12.639 3.469 1.00 2.94 C ATOM 1974 C VAL A 243 3.499 -13.289 4.152 1.00 2.84 C ATOM 1975 O VAL A 243 2.443 -13.464 3.544 1.00 2.38 O ATOM 1976 CB VAL A 243 4.779 -11.162 3.897 1.00 3.46 C ATOM 1977 CG1 VAL A 243 3.444 -10.466 3.675 1.00 3.92 C ATOM 1978 CG2 VAL A 243 5.210 -11.053 5.352 1.00 3.96 C ATOM 0 H VAL A 243 3.932 -12.140 1.581 1.00 2.35 H new ATOM 0 HA VAL A 243 5.608 -13.151 3.777 1.00 2.94 H new ATOM 0 HB VAL A 243 5.528 -10.665 3.281 1.00 3.46 H new ATOM 0 HG11 VAL A 243 3.522 -9.423 3.983 1.00 3.92 H new ATOM 0 HG12 VAL A 243 3.180 -10.514 2.618 1.00 3.92 H new ATOM 0 HG13 VAL A 243 2.673 -10.962 4.264 1.00 3.92 H new ATOM 0 HG21 VAL A 243 5.264 -10.003 5.638 1.00 3.96 H new ATOM 0 HG22 VAL A 243 4.486 -11.565 5.985 1.00 3.96 H new ATOM 0 HG23 VAL A 243 6.190 -11.513 5.477 1.00 3.96 H new ATOM 1988 N ASP A 244 3.670 -13.645 5.421 1.00 3.53 N ATOM 1989 CA ASP A 244 2.603 -14.276 6.189 1.00 3.68 C ATOM 1990 C ASP A 244 1.305 -13.484 6.066 1.00 3.14 C ATOM 1991 O ASP A 244 1.211 -12.350 6.537 1.00 3.45 O ATOM 1992 CB ASP A 244 3.006 -14.394 7.660 1.00 4.79 C ATOM 1993 CG ASP A 244 4.067 -15.452 7.886 1.00 5.68 C ATOM 1994 OD1 ASP A 244 4.251 -16.309 6.996 1.00 5.61 O ATOM 1995 OD2 ASP A 244 4.716 -15.422 8.953 1.00 6.90 O ATOM 0 H ASP A 244 4.538 -13.507 5.939 1.00 3.53 H new ATOM 0 HA ASP A 244 2.438 -15.275 5.785 1.00 3.68 H new ATOM 0 HB2 ASP A 244 3.377 -13.431 8.010 1.00 4.79 H new ATOM 0 HB3 ASP A 244 2.126 -14.633 8.257 1.00 4.79 H new ATOM 2000 N ILE A 245 0.307 -14.088 5.430 1.00 2.70 N ATOM 2001 CA ILE A 245 -0.985 -13.440 5.246 1.00 2.43 C ATOM 2002 C ILE A 245 -1.463 -12.790 6.539 1.00 3.12 C ATOM 2003 O ILE A 245 -1.406 -11.570 6.691 1.00 4.08 O ATOM 2004 CB ILE A 245 -2.052 -14.438 4.761 1.00 2.50 C ATOM 2005 CG1 ILE A 245 -1.690 -15.859 5.200 1.00 3.43 C ATOM 2006 CG2 ILE A 245 -2.197 -14.366 3.248 1.00 2.99 C ATOM 2007 CD1 ILE A 245 -2.891 -16.761 5.379 1.00 3.91 C ATOM 0 H ILE A 245 0.369 -15.026 5.033 1.00 2.70 H new ATOM 0 HA ILE A 245 -0.847 -12.671 4.486 1.00 2.43 H new ATOM 0 HB ILE A 245 -3.008 -14.171 5.211 1.00 2.50 H new ATOM 0 HG12 ILE A 245 -1.022 -16.300 4.460 1.00 3.43 H new ATOM 0 HG13 ILE A 245 -1.139 -15.811 6.139 1.00 3.43 H new ATOM 0 HG21 ILE A 245 -2.955 -15.078 2.921 1.00 2.99 H new ATOM 0 HG22 ILE A 245 -2.496 -13.359 2.959 1.00 2.99 H new ATOM 0 HG23 ILE A 245 -1.244 -14.610 2.779 1.00 2.99 H new ATOM 0 HD11 ILE A 245 -2.559 -17.751 5.690 1.00 3.91 H new ATOM 0 HD12 ILE A 245 -3.550 -16.343 6.140 1.00 3.91 H new ATOM 0 HD13 ILE A 245 -3.431 -16.839 4.435 1.00 3.91 H new ATOM 2019 N ASN A 246 -1.934 -13.614 7.470 1.00 3.18 N ATOM 2020 CA ASN A 246 -2.422 -13.119 8.753 1.00 4.19 C ATOM 2021 C ASN A 246 -1.369 -13.301 9.842 1.00 3.84 C ATOM 2022 O ASN A 246 -1.453 -12.695 10.910 1.00 4.56 O ATOM 2023 CB ASN A 246 -3.710 -13.845 9.146 1.00 5.02 C ATOM 2024 CG ASN A 246 -4.303 -13.312 10.436 1.00 6.49 C ATOM 2025 OD1 ASN A 246 -4.427 -12.102 10.622 1.00 7.42 O ATOM 2026 ND2 ASN A 246 -4.672 -14.217 11.336 1.00 7.14 N ATOM 0 H ASN A 246 -1.988 -14.627 7.360 1.00 3.18 H new ATOM 0 HA ASN A 246 -2.630 -12.054 8.649 1.00 4.19 H new ATOM 0 HB2 ASN A 246 -4.441 -13.743 8.344 1.00 5.02 H new ATOM 0 HB3 ASN A 246 -3.505 -14.910 9.256 1.00 5.02 H new ATOM 0 HD21 ASN A 246 -5.077 -13.918 12.223 1.00 7.14 H new ATOM 0 HD22 ASN A 246 -4.551 -15.211 11.140 1.00 7.14 H new ATOM 2033 N THR A 247 -0.376 -14.140 9.563 1.00 3.09 N ATOM 2034 CA THR A 247 0.693 -14.403 10.518 1.00 3.29 C ATOM 2035 C THR A 247 1.830 -13.399 10.360 1.00 3.34 C ATOM 2036 O THR A 247 2.946 -13.631 10.826 1.00 4.05 O ATOM 2037 CB THR A 247 1.255 -15.827 10.354 1.00 3.52 C ATOM 2038 OG1 THR A 247 0.630 -16.476 9.241 1.00 3.74 O ATOM 2039 CG2 THR A 247 1.031 -16.646 11.616 1.00 3.87 C ATOM 0 H THR A 247 -0.290 -14.649 8.683 1.00 3.09 H new ATOM 0 HA THR A 247 0.259 -14.304 11.513 1.00 3.29 H new ATOM 0 HB THR A 247 2.327 -15.752 10.174 1.00 3.52 H new ATOM 0 HG1 THR A 247 0.994 -17.380 9.143 1.00 3.74 H new ATOM 0 HG21 THR A 247 1.436 -17.648 11.476 1.00 3.87 H new ATOM 0 HG22 THR A 247 1.533 -16.165 12.456 1.00 3.87 H new ATOM 0 HG23 THR A 247 -0.037 -16.712 11.822 1.00 3.87 H new ATOM 2047 N PHE A 248 1.540 -12.282 9.701 1.00 3.05 N ATOM 2048 CA PHE A 248 2.538 -11.242 9.482 1.00 3.33 C ATOM 2049 C PHE A 248 3.207 -10.845 10.795 1.00 3.42 C ATOM 2050 O PHE A 248 2.774 -11.252 11.873 1.00 3.71 O ATOM 2051 CB PHE A 248 1.894 -10.015 8.834 1.00 3.85 C ATOM 2052 CG PHE A 248 0.786 -9.417 9.652 1.00 4.24 C ATOM 2053 CD1 PHE A 248 1.068 -8.564 10.707 1.00 5.45 C ATOM 2054 CD2 PHE A 248 -0.539 -9.709 9.368 1.00 4.26 C ATOM 2055 CE1 PHE A 248 0.051 -8.011 11.462 1.00 6.50 C ATOM 2056 CE2 PHE A 248 -1.560 -9.159 10.119 1.00 5.43 C ATOM 2057 CZ PHE A 248 -1.265 -8.310 11.168 1.00 6.47 C ATOM 0 H PHE A 248 0.621 -12.074 9.309 1.00 3.05 H new ATOM 0 HA PHE A 248 3.300 -11.640 8.812 1.00 3.33 H new ATOM 0 HB2 PHE A 248 2.660 -9.258 8.667 1.00 3.85 H new ATOM 0 HB3 PHE A 248 1.503 -10.294 7.856 1.00 3.85 H new ATOM 0 HD1 PHE A 248 2.095 -8.328 10.942 1.00 5.45 H new ATOM 0 HD2 PHE A 248 -0.776 -10.374 8.551 1.00 4.26 H new ATOM 0 HE1 PHE A 248 0.285 -7.346 12.280 1.00 6.50 H new ATOM 0 HE2 PHE A 248 -2.588 -9.393 9.886 1.00 5.43 H new ATOM 0 HZ PHE A 248 -2.062 -7.881 11.757 1.00 6.47 H new ATOM 2067 N ARG A 249 4.266 -10.048 10.695 1.00 3.43 N ATOM 2068 CA ARG A 249 4.997 -9.597 11.874 1.00 3.65 C ATOM 2069 C ARG A 249 5.539 -8.186 11.670 1.00 3.27 C ATOM 2070 O ARG A 249 5.703 -7.730 10.538 1.00 3.21 O ATOM 2071 CB ARG A 249 6.147 -10.557 12.185 1.00 4.51 C ATOM 2072 CG ARG A 249 6.621 -10.491 13.628 1.00 5.24 C ATOM 2073 CD ARG A 249 7.611 -11.602 13.940 1.00 5.48 C ATOM 2074 NE ARG A 249 7.585 -11.978 15.351 1.00 5.91 N ATOM 2075 CZ ARG A 249 6.601 -12.676 15.907 1.00 5.45 C ATOM 2076 NH1 ARG A 249 5.569 -13.072 15.176 1.00 4.83 N ATOM 2077 NH2 ARG A 249 6.649 -12.979 17.198 1.00 6.31 N ATOM 0 H ARG A 249 4.637 -9.701 9.810 1.00 3.43 H new ATOM 0 HA ARG A 249 4.306 -9.584 12.717 1.00 3.65 H new ATOM 0 HB2 ARG A 249 5.829 -11.576 11.962 1.00 4.51 H new ATOM 0 HB3 ARG A 249 6.985 -10.333 11.525 1.00 4.51 H new ATOM 0 HG2 ARG A 249 7.087 -9.524 13.815 1.00 5.24 H new ATOM 0 HG3 ARG A 249 5.764 -10.567 14.297 1.00 5.24 H new ATOM 0 HD2 ARG A 249 7.382 -12.474 13.328 1.00 5.48 H new ATOM 0 HD3 ARG A 249 8.616 -11.278 13.670 1.00 5.48 H new ATOM 0 HE ARG A 249 8.365 -11.689 15.942 1.00 5.91 H new ATOM 0 HH11 ARG A 249 5.529 -12.841 14.183 1.00 4.83 H new ATOM 0 HH12 ARG A 249 4.815 -13.608 15.606 1.00 4.83 H new ATOM 0 HH21 ARG A 249 7.442 -12.676 17.764 1.00 6.31 H new ATOM 0 HH22 ARG A 249 5.893 -13.515 17.625 1.00 6.31 H new ATOM 2091 N LEU A 250 5.814 -7.498 12.773 1.00 3.47 N ATOM 2092 CA LEU A 250 6.337 -6.138 12.716 1.00 3.27 C ATOM 2093 C LEU A 250 7.827 -6.114 13.041 1.00 3.25 C ATOM 2094 O LEU A 250 8.332 -6.984 13.751 1.00 3.50 O ATOM 2095 CB LEU A 250 5.577 -5.237 13.691 1.00 3.61 C ATOM 2096 CG LEU A 250 4.070 -5.115 13.456 1.00 3.68 C ATOM 2097 CD1 LEU A 250 3.328 -5.037 14.781 1.00 5.17 C ATOM 2098 CD2 LEU A 250 3.761 -3.898 12.597 1.00 3.84 C ATOM 0 H LEU A 250 5.683 -7.860 13.718 1.00 3.47 H new ATOM 0 HA LEU A 250 6.199 -5.764 11.702 1.00 3.27 H new ATOM 0 HB2 LEU A 250 5.738 -5.612 14.702 1.00 3.61 H new ATOM 0 HB3 LEU A 250 6.013 -4.239 13.648 1.00 3.61 H new ATOM 0 HG LEU A 250 3.731 -6.005 12.925 1.00 3.68 H new ATOM 0 HD11 LEU A 250 2.258 -4.951 14.594 1.00 5.17 H new ATOM 0 HD12 LEU A 250 3.523 -5.939 15.361 1.00 5.17 H new ATOM 0 HD13 LEU A 250 3.670 -4.165 15.339 1.00 5.17 H new ATOM 0 HD21 LEU A 250 2.685 -3.827 12.440 1.00 3.84 H new ATOM 0 HD22 LEU A 250 4.114 -2.998 13.100 1.00 3.84 H new ATOM 0 HD23 LEU A 250 4.262 -3.996 11.634 1.00 3.84 H new ATOM 2110 N SER A 251 8.525 -5.110 12.520 1.00 3.39 N ATOM 2111 CA SER A 251 9.958 -4.973 12.753 1.00 3.65 C ATOM 2112 C SER A 251 10.248 -3.798 13.682 1.00 3.63 C ATOM 2113 O SER A 251 9.360 -3.003 13.990 1.00 3.67 O ATOM 2114 CB SER A 251 10.696 -4.783 11.426 1.00 4.25 C ATOM 2115 OG SER A 251 12.096 -4.689 11.630 1.00 5.77 O ATOM 0 H SER A 251 8.121 -4.379 11.934 1.00 3.39 H new ATOM 0 HA SER A 251 10.312 -5.887 13.230 1.00 3.65 H new ATOM 0 HB2 SER A 251 10.477 -5.619 10.762 1.00 4.25 H new ATOM 0 HB3 SER A 251 10.336 -3.881 10.932 1.00 4.25 H new ATOM 0 HG SER A 251 12.545 -4.570 10.767 1.00 5.77 H new ATOM 2121 N ALA A 252 11.497 -3.695 14.124 1.00 3.90 N ATOM 2122 CA ALA A 252 11.905 -2.617 15.016 1.00 3.99 C ATOM 2123 C ALA A 252 12.021 -1.296 14.263 1.00 3.80 C ATOM 2124 O ALA A 252 13.124 -0.811 14.007 1.00 5.11 O ATOM 2125 CB ALA A 252 13.225 -2.961 15.690 1.00 4.79 C ATOM 0 H ALA A 252 12.244 -4.345 13.879 1.00 3.90 H new ATOM 0 HA ALA A 252 11.138 -2.502 15.782 1.00 3.99 H new ATOM 0 HB1 ALA A 252 13.518 -2.147 16.353 1.00 4.79 H new ATOM 0 HB2 ALA A 252 13.110 -3.877 16.269 1.00 4.79 H new ATOM 0 HB3 ALA A 252 13.994 -3.105 14.931 1.00 4.79 H new ATOM 2131 N ASP A 253 10.878 -0.719 13.909 1.00 3.04 N ATOM 2132 CA ASP A 253 10.852 0.547 13.185 1.00 3.36 C ATOM 2133 C ASP A 253 9.418 0.968 12.878 1.00 3.03 C ATOM 2134 O ASP A 253 9.106 2.158 12.834 1.00 3.31 O ATOM 2135 CB ASP A 253 11.653 0.432 11.887 1.00 3.94 C ATOM 2136 CG ASP A 253 12.865 1.343 11.872 1.00 4.84 C ATOM 2137 OD1 ASP A 253 12.684 2.573 11.991 1.00 6.23 O ATOM 2138 OD2 ASP A 253 13.994 0.826 11.741 1.00 4.63 O ATOM 0 H ASP A 253 9.957 -1.108 14.112 1.00 3.04 H new ATOM 0 HA ASP A 253 11.307 1.309 13.817 1.00 3.36 H new ATOM 0 HB2 ASP A 253 11.976 -0.600 11.753 1.00 3.94 H new ATOM 0 HB3 ASP A 253 11.008 0.676 11.043 1.00 3.94 H new ATOM 2143 N ASP A 254 8.551 -0.016 12.665 1.00 2.95 N ATOM 2144 CA ASP A 254 7.150 0.252 12.362 1.00 3.17 C ATOM 2145 C ASP A 254 6.559 1.246 13.357 1.00 3.03 C ATOM 2146 O ASP A 254 6.063 2.305 12.971 1.00 2.97 O ATOM 2147 CB ASP A 254 6.345 -1.048 12.380 1.00 4.17 C ATOM 2148 CG ASP A 254 6.951 -2.118 11.494 1.00 4.48 C ATOM 2149 OD1 ASP A 254 7.842 -1.783 10.686 1.00 4.42 O ATOM 2150 OD2 ASP A 254 6.534 -3.289 11.608 1.00 5.54 O ATOM 0 H ASP A 254 8.794 -1.006 12.697 1.00 2.95 H new ATOM 0 HA ASP A 254 7.096 0.689 11.365 1.00 3.17 H new ATOM 0 HB2 ASP A 254 6.284 -1.420 13.403 1.00 4.17 H new ATOM 0 HB3 ASP A 254 5.325 -0.845 12.053 1.00 4.17 H new ATOM 2155 N ILE A 255 6.615 0.897 14.638 1.00 3.50 N ATOM 2156 CA ILE A 255 6.086 1.758 15.688 1.00 4.16 C ATOM 2157 C ILE A 255 6.894 3.046 15.802 1.00 4.12 C ATOM 2158 O ILE A 255 6.363 4.094 16.171 1.00 4.69 O ATOM 2159 CB ILE A 255 6.082 1.045 17.053 1.00 5.15 C ATOM 2160 CG1 ILE A 255 5.299 1.866 18.079 1.00 6.75 C ATOM 2161 CG2 ILE A 255 7.507 0.808 17.531 1.00 5.75 C ATOM 2162 CD1 ILE A 255 4.320 1.046 18.889 1.00 7.33 C ATOM 0 H ILE A 255 7.022 0.024 14.973 1.00 3.50 H new ATOM 0 HA ILE A 255 5.060 1.999 15.411 1.00 4.16 H new ATOM 0 HB ILE A 255 5.592 0.078 16.940 1.00 5.15 H new ATOM 0 HG12 ILE A 255 6.002 2.351 18.756 1.00 6.75 H new ATOM 0 HG13 ILE A 255 4.757 2.657 17.562 1.00 6.75 H new ATOM 0 HG21 ILE A 255 7.488 0.303 18.497 1.00 5.75 H new ATOM 0 HG22 ILE A 255 8.035 0.187 16.808 1.00 5.75 H new ATOM 0 HG23 ILE A 255 8.021 1.764 17.631 1.00 5.75 H new ATOM 0 HD11 ILE A 255 3.801 1.693 19.596 1.00 7.33 H new ATOM 0 HD12 ILE A 255 3.594 0.582 18.221 1.00 7.33 H new ATOM 0 HD13 ILE A 255 4.858 0.271 19.435 1.00 7.33 H new ATOM 2174 N ARG A 256 8.181 2.961 15.482 1.00 3.78 N ATOM 2175 CA ARG A 256 9.064 4.120 15.548 1.00 4.37 C ATOM 2176 C ARG A 256 8.484 5.290 14.759 1.00 4.50 C ATOM 2177 O ARG A 256 8.640 6.448 15.142 1.00 5.37 O ATOM 2178 CB ARG A 256 10.450 3.763 15.009 1.00 4.60 C ATOM 2179 CG ARG A 256 11.582 4.503 15.703 1.00 6.16 C ATOM 2180 CD ARG A 256 12.941 4.026 15.215 1.00 6.54 C ATOM 2181 NE ARG A 256 13.359 2.793 15.876 1.00 6.48 N ATOM 2182 CZ ARG A 256 14.499 2.166 15.608 1.00 7.36 C ATOM 2183 NH1 ARG A 256 15.330 2.653 14.697 1.00 8.36 N ATOM 2184 NH2 ARG A 256 14.810 1.048 16.253 1.00 7.65 N ATOM 0 H ARG A 256 8.636 2.101 15.174 1.00 3.78 H new ATOM 0 HA ARG A 256 9.155 4.418 16.592 1.00 4.37 H new ATOM 0 HB2 ARG A 256 10.608 2.690 15.118 1.00 4.60 H new ATOM 0 HB3 ARG A 256 10.484 3.983 13.942 1.00 4.60 H new ATOM 0 HG2 ARG A 256 11.484 5.573 15.521 1.00 6.16 H new ATOM 0 HG3 ARG A 256 11.508 4.355 16.780 1.00 6.16 H new ATOM 0 HD2 ARG A 256 12.903 3.865 14.138 1.00 6.54 H new ATOM 0 HD3 ARG A 256 13.684 4.803 15.395 1.00 6.54 H new ATOM 0 HE ARG A 256 12.742 2.391 16.582 1.00 6.48 H new ATOM 0 HH11 ARG A 256 15.095 3.512 14.199 1.00 8.36 H new ATOM 0 HH12 ARG A 256 16.205 2.169 14.494 1.00 8.36 H new ATOM 0 HH21 ARG A 256 14.173 0.670 16.955 1.00 7.65 H new ATOM 0 HH22 ARG A 256 15.685 0.567 16.047 1.00 7.65 H new ATOM 2198 N GLY A 257 7.815 4.977 13.653 1.00 3.97 N ATOM 2199 CA GLY A 257 7.224 6.013 12.826 1.00 4.61 C ATOM 2200 C GLY A 257 7.204 5.642 11.357 1.00 4.09 C ATOM 2201 O GLY A 257 7.510 4.506 10.993 1.00 4.11 O ATOM 0 H GLY A 257 7.672 4.025 13.315 1.00 3.97 H new ATOM 0 HA2 GLY A 257 6.205 6.205 13.163 1.00 4.61 H new ATOM 0 HA3 GLY A 257 7.783 6.940 12.956 1.00 4.61 H new ATOM 2205 N ILE A 258 6.842 6.600 10.511 1.00 4.35 N ATOM 2206 CA ILE A 258 6.784 6.367 9.073 1.00 4.39 C ATOM 2207 C ILE A 258 6.417 7.644 8.324 1.00 5.66 C ATOM 2208 O ILE A 258 6.879 7.873 7.206 1.00 6.54 O ATOM 2209 CB ILE A 258 5.763 5.268 8.722 1.00 3.71 C ATOM 2210 CG1 ILE A 258 5.612 5.149 7.204 1.00 4.09 C ATOM 2211 CG2 ILE A 258 4.420 5.565 9.372 1.00 3.65 C ATOM 2212 CD1 ILE A 258 6.897 4.780 6.496 1.00 4.34 C ATOM 0 H ILE A 258 6.584 7.545 10.796 1.00 4.35 H new ATOM 0 HA ILE A 258 7.777 6.041 8.765 1.00 4.39 H new ATOM 0 HB ILE A 258 6.128 4.316 9.108 1.00 3.71 H new ATOM 0 HG12 ILE A 258 4.855 4.398 6.980 1.00 4.09 H new ATOM 0 HG13 ILE A 258 5.248 6.097 6.808 1.00 4.09 H new ATOM 0 HG21 ILE A 258 3.710 4.780 9.114 1.00 3.65 H new ATOM 0 HG22 ILE A 258 4.541 5.605 10.455 1.00 3.65 H new ATOM 0 HG23 ILE A 258 4.046 6.524 9.013 1.00 3.65 H new ATOM 0 HD11 ILE A 258 6.715 4.713 5.423 1.00 4.34 H new ATOM 0 HD12 ILE A 258 7.651 5.543 6.689 1.00 4.34 H new ATOM 0 HD13 ILE A 258 7.252 3.817 6.864 1.00 4.34 H new