USER MOD reduce.3.24.130724 H: found=0, std=0, add=711, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 711 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 107 ASN : amide:sc= -12.2! C(o=-21!,f=-27!) USER MOD Set 1.2: A 170 MET CE :methyl -170:sc= -8.66! (180deg=-9.31!) USER MOD Set 2.1: A 155 ASN :FLIP amide:sc= 0.64 F(o=-6.2,f=-4.1) USER MOD Set 2.2: A 160 HIS :FLIP no HD1:sc= -4.69! C(o=-6.3!,f=-4.1!) USER MOD Single : A 98 CYS SG : rot 180:sc= 0 USER MOD Single : A 102 ASN : amide:sc= -0.045 K(o=-0.045,f=-2!) USER MOD Single : A 105 CYS SG : rot 140:sc= -1.02 USER MOD Single : A 110 LYS NZ :NH3+ -127:sc= 0 (180deg=-0.131) USER MOD Single : A 118 GLN :FLIP amide:sc= -1.17 F(o=-1.8,f=-1.2) USER MOD Single : A 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 122 SER OG : rot 180:sc= 0.0663 USER MOD Single : A 124 THR OG1 : rot 180:sc= 0.17 USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 SER OG : rot 180:sc= 0 USER MOD Single : A 133 TYR OH : rot 180:sc= 0 USER MOD Single : A 136 ASN : amide:sc= -6.38! C(o=-6.4!,f=-22!) USER MOD Single : A 138 THR OG1 : rot 180:sc= 0.145 USER MOD Single : A 144 SER OG : rot 180:sc= 0 USER MOD Single : A 149 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 150 ASN : amide:sc=-1.98e-05 X(o=-2e-05,f=-0.5) USER MOD Single : A 151 THR OG1 : rot 180:sc= 0 USER MOD Single : A 153 LYS NZ :NH3+ 167:sc= -1.08 (180deg=-1.33) USER MOD Single : A 157 THR OG1 : rot 180:sc= 0.0433 USER MOD Single : A 167 SER OG : rot 180:sc= 0 USER MOD Single : A 168 CYS SG : rot 157:sc= -2.88! USER MOD Single : A 169 GLN : amide:sc= 0 X(o=0,f=0.44) USER MOD Single : A 171 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 178 GLN :FLIP amide:sc= -2.96 F(o=-7.9!,f=-3) USER MOD Single : A 181 GLN :FLIP amide:sc= 0.334 F(o=-1.3,f=0.33) USER MOD Single : A 182 GLN : amide:sc= -0.0496 X(o=-0.05,f=-0.15) USER MOD ----------------------------------------------------------------- ATOM 92 N ASP A 96 79.620 -15.097 4.648 1.00 0.00 N ATOM 93 CA ASP A 96 80.083 -15.839 3.445 1.00 0.00 C ATOM 94 C ASP A 96 78.973 -15.837 2.398 1.00 0.00 C ATOM 95 O ASP A 96 79.167 -15.413 1.275 1.00 0.00 O ATOM 96 CB ASP A 96 80.390 -17.251 3.939 1.00 0.00 C ATOM 97 CG ASP A 96 81.427 -17.905 3.023 1.00 0.00 C ATOM 98 OD1 ASP A 96 81.674 -17.364 1.957 1.00 0.00 O ATOM 99 OD2 ASP A 96 81.958 -18.936 3.402 1.00 0.00 O ATOM 0 HA ASP A 96 80.961 -15.394 2.977 1.00 0.00 H new ATOM 0 HB2 ASP A 96 80.765 -17.215 4.962 1.00 0.00 H new ATOM 0 HB3 ASP A 96 79.478 -17.847 3.955 1.00 0.00 H new ATOM 104 N LEU A 97 77.802 -16.275 2.760 1.00 0.00 N ATOM 105 CA LEU A 97 76.681 -16.260 1.787 1.00 0.00 C ATOM 106 C LEU A 97 76.526 -14.844 1.249 1.00 0.00 C ATOM 107 O LEU A 97 76.066 -14.635 0.149 1.00 0.00 O ATOM 108 CB LEU A 97 75.438 -16.658 2.583 1.00 0.00 C ATOM 109 CG LEU A 97 75.407 -18.170 2.804 1.00 0.00 C ATOM 110 CD1 LEU A 97 74.024 -18.561 3.320 1.00 0.00 C ATOM 111 CD2 LEU A 97 75.678 -18.901 1.486 1.00 0.00 C ATOM 0 H LEU A 97 77.574 -16.641 3.684 1.00 0.00 H new ATOM 0 HA LEU A 97 76.844 -16.934 0.946 1.00 0.00 H new ATOM 0 HB2 LEU A 97 75.434 -16.144 3.544 1.00 0.00 H new ATOM 0 HB3 LEU A 97 74.541 -16.344 2.050 1.00 0.00 H new ATOM 0 HG LEU A 97 76.174 -18.447 3.527 1.00 0.00 H new ATOM 0 HD11 LEU A 97 73.987 -19.638 3.482 1.00 0.00 H new ATOM 0 HD12 LEU A 97 73.827 -18.046 4.260 1.00 0.00 H new ATOM 0 HD13 LEU A 97 73.269 -18.279 2.586 1.00 0.00 H new ATOM 0 HD21 LEU A 97 75.654 -19.977 1.655 1.00 0.00 H new ATOM 0 HD22 LEU A 97 74.914 -18.631 0.756 1.00 0.00 H new ATOM 0 HD23 LEU A 97 76.659 -18.616 1.107 1.00 0.00 H new ATOM 123 N CYS A 98 76.915 -13.865 2.021 1.00 0.00 N ATOM 124 CA CYS A 98 76.798 -12.461 1.544 1.00 0.00 C ATOM 125 C CYS A 98 77.482 -12.325 0.182 1.00 0.00 C ATOM 126 O CYS A 98 77.055 -11.569 -0.668 1.00 0.00 O ATOM 127 CB CYS A 98 77.519 -11.626 2.606 1.00 0.00 C ATOM 128 SG CYS A 98 77.653 -9.910 2.046 1.00 0.00 S ATOM 0 H CYS A 98 77.306 -13.978 2.956 1.00 0.00 H new ATOM 0 HA CYS A 98 75.764 -12.140 1.415 1.00 0.00 H new ATOM 0 HB2 CYS A 98 76.973 -11.669 3.549 1.00 0.00 H new ATOM 0 HB3 CYS A 98 78.511 -12.036 2.793 1.00 0.00 H new ATOM 0 HG CYS A 98 78.264 -9.205 2.951 1.00 0.00 H new ATOM 134 N ALA A 99 78.540 -13.053 -0.031 1.00 0.00 N ATOM 135 CA ALA A 99 79.257 -12.972 -1.332 1.00 0.00 C ATOM 136 C ALA A 99 78.484 -13.693 -2.426 1.00 0.00 C ATOM 137 O ALA A 99 78.463 -13.261 -3.560 1.00 0.00 O ATOM 138 CB ALA A 99 80.596 -13.646 -1.070 1.00 0.00 C ATOM 0 H ALA A 99 78.941 -13.704 0.644 1.00 0.00 H new ATOM 0 HA ALA A 99 79.374 -11.945 -1.678 1.00 0.00 H new ATOM 0 HB1 ALA A 99 81.195 -13.632 -1.981 1.00 0.00 H new ATOM 0 HB2 ALA A 99 81.124 -13.111 -0.280 1.00 0.00 H new ATOM 0 HB3 ALA A 99 80.430 -14.678 -0.761 1.00 0.00 H new ATOM 144 N ALA A 100 77.845 -14.776 -2.109 1.00 0.00 N ATOM 145 CA ALA A 100 77.076 -15.495 -3.150 1.00 0.00 C ATOM 146 C ALA A 100 75.700 -14.849 -3.308 1.00 0.00 C ATOM 147 O ALA A 100 75.079 -14.925 -4.349 1.00 0.00 O ATOM 148 CB ALA A 100 76.953 -16.930 -2.636 1.00 0.00 C ATOM 0 H ALA A 100 77.822 -15.193 -1.178 1.00 0.00 H new ATOM 0 HA ALA A 100 77.558 -15.464 -4.127 1.00 0.00 H new ATOM 0 HB1 ALA A 100 76.393 -17.527 -3.356 1.00 0.00 H new ATOM 0 HB2 ALA A 100 77.948 -17.356 -2.506 1.00 0.00 H new ATOM 0 HB3 ALA A 100 76.430 -16.930 -1.680 1.00 0.00 H new ATOM 154 N PHE A 101 75.224 -14.206 -2.283 1.00 0.00 N ATOM 155 CA PHE A 101 73.896 -13.550 -2.376 1.00 0.00 C ATOM 156 C PHE A 101 74.077 -12.139 -2.931 1.00 0.00 C ATOM 157 O PHE A 101 73.330 -11.691 -3.789 1.00 0.00 O ATOM 158 CB PHE A 101 73.361 -13.520 -0.939 1.00 0.00 C ATOM 159 CG PHE A 101 73.075 -14.933 -0.456 1.00 0.00 C ATOM 160 CD1 PHE A 101 73.444 -16.040 -1.235 1.00 0.00 C ATOM 161 CD2 PHE A 101 72.435 -15.136 0.775 1.00 0.00 C ATOM 162 CE1 PHE A 101 73.180 -17.336 -0.786 1.00 0.00 C ATOM 163 CE2 PHE A 101 72.170 -16.435 1.223 1.00 0.00 C ATOM 164 CZ PHE A 101 72.543 -17.535 0.442 1.00 0.00 C ATOM 0 H PHE A 101 75.697 -14.107 -1.385 1.00 0.00 H new ATOM 0 HA PHE A 101 73.205 -14.072 -3.038 1.00 0.00 H new ATOM 0 HB2 PHE A 101 74.089 -13.044 -0.282 1.00 0.00 H new ATOM 0 HB3 PHE A 101 72.451 -12.921 -0.894 1.00 0.00 H new ATOM 0 HD1 PHE A 101 73.934 -15.889 -2.186 1.00 0.00 H new ATOM 0 HD2 PHE A 101 72.146 -14.288 1.379 1.00 0.00 H new ATOM 0 HE1 PHE A 101 73.468 -18.185 -1.388 1.00 0.00 H new ATOM 0 HE2 PHE A 101 71.677 -16.589 2.172 1.00 0.00 H new ATOM 0 HZ PHE A 101 72.339 -18.537 0.788 1.00 0.00 H new ATOM 174 N ASN A 102 75.088 -11.439 -2.483 1.00 0.00 N ATOM 175 CA ASN A 102 75.313 -10.083 -3.022 1.00 0.00 C ATOM 176 C ASN A 102 75.772 -10.212 -4.462 1.00 0.00 C ATOM 177 O ASN A 102 75.518 -9.359 -5.281 1.00 0.00 O ATOM 178 CB ASN A 102 76.401 -9.458 -2.146 1.00 0.00 C ATOM 179 CG ASN A 102 76.395 -7.940 -2.335 1.00 0.00 C ATOM 180 OD1 ASN A 102 75.630 -7.417 -3.120 1.00 0.00 O ATOM 181 ND2 ASN A 102 77.221 -7.207 -1.641 1.00 0.00 N ATOM 0 H ASN A 102 75.754 -11.750 -1.776 1.00 0.00 H new ATOM 0 HA ASN A 102 74.416 -9.463 -3.010 1.00 0.00 H new ATOM 0 HB2 ASN A 102 76.227 -9.706 -1.099 1.00 0.00 H new ATOM 0 HB3 ASN A 102 77.376 -9.865 -2.412 1.00 0.00 H new ATOM 0 HD21 ASN A 102 77.225 -6.194 -1.757 1.00 0.00 H new ATOM 0 HD22 ASN A 102 77.863 -7.647 -0.982 1.00 0.00 H new ATOM 188 N VAL A 103 76.425 -11.295 -4.787 1.00 0.00 N ATOM 189 CA VAL A 103 76.873 -11.486 -6.188 1.00 0.00 C ATOM 190 C VAL A 103 75.652 -11.615 -7.087 1.00 0.00 C ATOM 191 O VAL A 103 75.408 -10.796 -7.948 1.00 0.00 O ATOM 192 CB VAL A 103 77.669 -12.792 -6.174 1.00 0.00 C ATOM 193 CG1 VAL A 103 77.345 -13.613 -7.426 1.00 0.00 C ATOM 194 CG2 VAL A 103 79.159 -12.464 -6.149 1.00 0.00 C ATOM 0 H VAL A 103 76.665 -12.050 -4.144 1.00 0.00 H new ATOM 0 HA VAL A 103 77.472 -10.655 -6.560 1.00 0.00 H new ATOM 0 HB VAL A 103 77.402 -13.373 -5.291 1.00 0.00 H new ATOM 0 HG11 VAL A 103 77.915 -14.542 -7.410 1.00 0.00 H new ATOM 0 HG12 VAL A 103 76.279 -13.842 -7.445 1.00 0.00 H new ATOM 0 HG13 VAL A 103 77.609 -13.040 -8.315 1.00 0.00 H new ATOM 0 HG21 VAL A 103 79.735 -13.389 -6.139 1.00 0.00 H new ATOM 0 HG22 VAL A 103 79.419 -11.884 -7.035 1.00 0.00 H new ATOM 0 HG23 VAL A 103 79.389 -11.884 -5.255 1.00 0.00 H new ATOM 204 N ILE A 104 74.883 -12.646 -6.870 1.00 0.00 N ATOM 205 CA ILE A 104 73.668 -12.878 -7.675 1.00 0.00 C ATOM 206 C ILE A 104 72.980 -11.546 -7.954 1.00 0.00 C ATOM 207 O ILE A 104 72.476 -11.298 -9.031 1.00 0.00 O ATOM 208 CB ILE A 104 72.808 -13.761 -6.769 1.00 0.00 C ATOM 209 CG1 ILE A 104 73.399 -15.175 -6.705 1.00 0.00 C ATOM 210 CG2 ILE A 104 71.391 -13.825 -7.309 1.00 0.00 C ATOM 211 CD1 ILE A 104 72.633 -16.004 -5.669 1.00 0.00 C ATOM 0 H ILE A 104 75.056 -13.348 -6.151 1.00 0.00 H new ATOM 0 HA ILE A 104 73.861 -13.338 -8.644 1.00 0.00 H new ATOM 0 HB ILE A 104 72.793 -13.333 -5.767 1.00 0.00 H new ATOM 0 HG12 ILE A 104 73.338 -15.651 -7.684 1.00 0.00 H new ATOM 0 HG13 ILE A 104 74.455 -15.127 -6.439 1.00 0.00 H new ATOM 0 HG21 ILE A 104 70.783 -14.455 -6.660 1.00 0.00 H new ATOM 0 HG22 ILE A 104 70.968 -12.821 -7.340 1.00 0.00 H new ATOM 0 HG23 ILE A 104 71.404 -14.245 -8.315 1.00 0.00 H new ATOM 0 HD11 ILE A 104 73.053 -17.009 -5.624 1.00 0.00 H new ATOM 0 HD12 ILE A 104 72.717 -15.531 -4.690 1.00 0.00 H new ATOM 0 HD13 ILE A 104 71.583 -16.063 -5.954 1.00 0.00 H new ATOM 223 N CYS A 105 72.956 -10.694 -6.974 1.00 0.00 N ATOM 224 CA CYS A 105 72.293 -9.364 -7.158 1.00 0.00 C ATOM 225 C CYS A 105 73.276 -8.264 -7.606 1.00 0.00 C ATOM 226 O CYS A 105 72.868 -7.187 -7.990 1.00 0.00 O ATOM 227 CB CYS A 105 71.763 -9.025 -5.772 1.00 0.00 C ATOM 228 SG CYS A 105 70.521 -10.242 -5.277 1.00 0.00 S ATOM 0 H CYS A 105 73.364 -10.853 -6.053 1.00 0.00 H new ATOM 0 HA CYS A 105 71.529 -9.414 -7.934 1.00 0.00 H new ATOM 0 HB2 CYS A 105 72.582 -9.014 -5.052 1.00 0.00 H new ATOM 0 HB3 CYS A 105 71.326 -8.026 -5.774 1.00 0.00 H new ATOM 0 HG CYS A 105 70.673 -10.530 -4.018 1.00 0.00 H new ATOM 234 N ASP A 106 74.554 -8.485 -7.468 1.00 0.00 N ATOM 235 CA ASP A 106 75.544 -7.400 -7.785 1.00 0.00 C ATOM 236 C ASP A 106 76.175 -7.430 -9.197 1.00 0.00 C ATOM 237 O ASP A 106 76.901 -6.514 -9.535 1.00 0.00 O ATOM 238 CB ASP A 106 76.649 -7.592 -6.748 1.00 0.00 C ATOM 239 CG ASP A 106 77.779 -6.591 -7.008 1.00 0.00 C ATOM 240 OD1 ASP A 106 77.503 -5.403 -7.014 1.00 0.00 O ATOM 241 OD2 ASP A 106 78.901 -7.031 -7.199 1.00 0.00 O ATOM 0 H ASP A 106 74.961 -9.365 -7.151 1.00 0.00 H new ATOM 0 HA ASP A 106 75.023 -6.443 -7.760 1.00 0.00 H new ATOM 0 HB2 ASP A 106 76.248 -7.450 -5.744 1.00 0.00 H new ATOM 0 HB3 ASP A 106 77.034 -8.611 -6.797 1.00 0.00 H new ATOM 246 N ASN A 107 75.987 -8.428 -10.017 1.00 0.00 N ATOM 247 CA ASN A 107 76.684 -8.383 -11.335 1.00 0.00 C ATOM 248 C ASN A 107 75.851 -7.686 -12.410 1.00 0.00 C ATOM 249 O ASN A 107 76.114 -6.557 -12.775 1.00 0.00 O ATOM 250 CB ASN A 107 76.958 -9.835 -11.724 1.00 0.00 C ATOM 251 CG ASN A 107 75.802 -10.738 -11.301 1.00 0.00 C ATOM 252 OD1 ASN A 107 74.876 -10.957 -12.058 1.00 0.00 O ATOM 253 ND2 ASN A 107 75.815 -11.274 -10.116 1.00 0.00 N ATOM 0 H ASN A 107 75.403 -9.246 -9.842 1.00 0.00 H new ATOM 0 HA ASN A 107 77.604 -7.804 -11.253 1.00 0.00 H new ATOM 0 HB2 ASN A 107 77.105 -9.906 -12.802 1.00 0.00 H new ATOM 0 HB3 ASN A 107 77.881 -10.174 -11.254 1.00 0.00 H new ATOM 0 HD21 ASN A 107 75.048 -11.878 -9.821 1.00 0.00 H new ATOM 0 HD22 ASN A 107 76.592 -11.090 -9.481 1.00 0.00 H new ATOM 260 N VAL A 108 74.865 -8.346 -12.933 1.00 0.00 N ATOM 261 CA VAL A 108 74.040 -7.710 -14.002 1.00 0.00 C ATOM 262 C VAL A 108 73.245 -6.533 -13.440 1.00 0.00 C ATOM 263 O VAL A 108 73.138 -6.351 -12.243 1.00 0.00 O ATOM 264 CB VAL A 108 73.045 -8.771 -14.459 1.00 0.00 C ATOM 265 CG1 VAL A 108 72.227 -8.226 -15.633 1.00 0.00 C ATOM 266 CG2 VAL A 108 73.741 -10.056 -14.894 1.00 0.00 C ATOM 0 H VAL A 108 74.590 -9.293 -12.673 1.00 0.00 H new ATOM 0 HA VAL A 108 74.678 -7.349 -14.809 1.00 0.00 H new ATOM 0 HB VAL A 108 72.399 -9.006 -13.613 1.00 0.00 H new ATOM 0 HG11 VAL A 108 71.515 -8.982 -15.962 1.00 0.00 H new ATOM 0 HG12 VAL A 108 71.688 -7.333 -15.317 1.00 0.00 H new ATOM 0 HG13 VAL A 108 72.895 -7.974 -16.456 1.00 0.00 H new ATOM 0 HG21 VAL A 108 72.995 -10.784 -15.212 1.00 0.00 H new ATOM 0 HG22 VAL A 108 74.415 -9.842 -15.723 1.00 0.00 H new ATOM 0 HG23 VAL A 108 74.311 -10.462 -14.058 1.00 0.00 H new ATOM 276 N GLY A 109 72.632 -5.773 -14.304 1.00 0.00 N ATOM 277 CA GLY A 109 71.783 -4.653 -13.836 1.00 0.00 C ATOM 278 C GLY A 109 70.434 -5.240 -13.403 1.00 0.00 C ATOM 279 O GLY A 109 69.535 -4.539 -12.986 1.00 0.00 O ATOM 0 H GLY A 109 72.685 -5.883 -15.317 1.00 0.00 H new ATOM 0 HA2 GLY A 109 72.259 -4.134 -13.004 1.00 0.00 H new ATOM 0 HA3 GLY A 109 71.644 -3.920 -14.631 1.00 0.00 H new ATOM 283 N LYS A 110 70.311 -6.537 -13.515 1.00 0.00 N ATOM 284 CA LYS A 110 69.061 -7.246 -13.135 1.00 0.00 C ATOM 285 C LYS A 110 69.408 -8.678 -12.684 1.00 0.00 C ATOM 286 O LYS A 110 68.754 -9.247 -11.833 1.00 0.00 O ATOM 287 CB LYS A 110 68.215 -7.236 -14.412 1.00 0.00 C ATOM 288 CG LYS A 110 68.639 -8.364 -15.361 1.00 0.00 C ATOM 289 CD LYS A 110 68.355 -7.950 -16.810 1.00 0.00 C ATOM 290 CE LYS A 110 66.897 -7.496 -16.948 1.00 0.00 C ATOM 291 NZ LYS A 110 66.098 -8.752 -16.943 1.00 0.00 N ATOM 0 H LYS A 110 71.049 -7.148 -13.865 1.00 0.00 H new ATOM 0 HA LYS A 110 68.526 -6.782 -12.306 1.00 0.00 H new ATOM 0 HB2 LYS A 110 67.162 -7.348 -14.156 1.00 0.00 H new ATOM 0 HB3 LYS A 110 68.320 -6.274 -14.914 1.00 0.00 H new ATOM 0 HG2 LYS A 110 69.700 -8.580 -15.235 1.00 0.00 H new ATOM 0 HG3 LYS A 110 68.097 -9.279 -15.120 1.00 0.00 H new ATOM 0 HD2 LYS A 110 69.026 -7.143 -17.105 1.00 0.00 H new ATOM 0 HD3 LYS A 110 68.549 -8.787 -17.481 1.00 0.00 H new ATOM 0 HE2 LYS A 110 66.608 -6.842 -16.125 1.00 0.00 H new ATOM 0 HE3 LYS A 110 66.744 -6.935 -17.870 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 65.477 -8.772 -17.777 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 66.738 -9.571 -16.969 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 65.520 -8.792 -16.080 1.00 0.00 H new ATOM 305 N ASP A 111 70.455 -9.245 -13.246 1.00 0.00 N ATOM 306 CA ASP A 111 70.900 -10.635 -12.872 1.00 0.00 C ATOM 307 C ASP A 111 69.691 -11.465 -12.507 1.00 0.00 C ATOM 308 O ASP A 111 69.648 -12.153 -11.507 1.00 0.00 O ATOM 309 CB ASP A 111 71.843 -10.456 -11.681 1.00 0.00 C ATOM 310 CG ASP A 111 71.273 -9.416 -10.716 1.00 0.00 C ATOM 311 OD1 ASP A 111 71.538 -8.243 -10.924 1.00 0.00 O ATOM 312 OD2 ASP A 111 70.580 -9.807 -9.792 1.00 0.00 O ATOM 0 H ASP A 111 71.030 -8.797 -13.960 1.00 0.00 H new ATOM 0 HA ASP A 111 71.406 -11.153 -13.687 1.00 0.00 H new ATOM 0 HB2 ASP A 111 71.977 -11.407 -11.166 1.00 0.00 H new ATOM 0 HB3 ASP A 111 72.827 -10.141 -12.029 1.00 0.00 H new ATOM 317 N TRP A 112 68.691 -11.340 -13.308 1.00 0.00 N ATOM 318 CA TRP A 112 67.419 -12.040 -13.045 1.00 0.00 C ATOM 319 C TRP A 112 67.369 -13.463 -13.578 1.00 0.00 C ATOM 320 O TRP A 112 67.631 -14.416 -12.875 1.00 0.00 O ATOM 321 CB TRP A 112 66.390 -11.198 -13.780 1.00 0.00 C ATOM 322 CG TRP A 112 65.651 -10.353 -12.827 1.00 0.00 C ATOM 323 CD1 TRP A 112 66.045 -9.141 -12.409 1.00 0.00 C ATOM 324 CD2 TRP A 112 64.396 -10.642 -12.176 1.00 0.00 C ATOM 325 NE1 TRP A 112 65.090 -8.647 -11.533 1.00 0.00 N ATOM 326 CE2 TRP A 112 64.050 -9.546 -11.359 1.00 0.00 C ATOM 327 CE3 TRP A 112 63.532 -11.744 -12.221 1.00 0.00 C ATOM 328 CZ2 TRP A 112 62.876 -9.546 -10.609 1.00 0.00 C ATOM 329 CZ3 TRP A 112 62.354 -11.749 -11.471 1.00 0.00 C ATOM 330 CH2 TRP A 112 62.025 -10.655 -10.668 1.00 0.00 C ATOM 0 H TRP A 112 68.699 -10.770 -14.154 1.00 0.00 H new ATOM 0 HA TRP A 112 67.258 -12.138 -11.971 1.00 0.00 H new ATOM 0 HB2 TRP A 112 66.885 -10.573 -14.524 1.00 0.00 H new ATOM 0 HB3 TRP A 112 65.697 -11.845 -14.317 1.00 0.00 H new ATOM 0 HD1 TRP A 112 66.952 -8.635 -12.705 1.00 0.00 H new ATOM 0 HE1 TRP A 112 65.146 -7.737 -11.075 1.00 0.00 H new ATOM 0 HE3 TRP A 112 63.778 -12.595 -12.839 1.00 0.00 H new ATOM 0 HZ2 TRP A 112 62.625 -8.698 -9.988 1.00 0.00 H new ATOM 0 HZ3 TRP A 112 61.694 -12.603 -11.512 1.00 0.00 H new ATOM 0 HH2 TRP A 112 61.112 -10.665 -10.091 1.00 0.00 H new ATOM 341 N ARG A 113 66.977 -13.608 -14.806 1.00 0.00 N ATOM 342 CA ARG A 113 66.833 -14.962 -15.386 1.00 0.00 C ATOM 343 C ARG A 113 68.143 -15.701 -15.375 1.00 0.00 C ATOM 344 O ARG A 113 68.208 -16.854 -15.748 1.00 0.00 O ATOM 345 CB ARG A 113 66.329 -14.747 -16.812 1.00 0.00 C ATOM 346 CG ARG A 113 65.061 -13.892 -16.783 1.00 0.00 C ATOM 347 CD ARG A 113 64.051 -14.453 -17.786 1.00 0.00 C ATOM 348 NE ARG A 113 63.706 -13.307 -18.673 1.00 0.00 N ATOM 349 CZ ARG A 113 63.198 -13.527 -19.856 1.00 0.00 C ATOM 350 NH1 ARG A 113 63.673 -14.485 -20.604 1.00 0.00 N ATOM 351 NH2 ARG A 113 62.213 -12.789 -20.291 1.00 0.00 N ATOM 0 H ARG A 113 66.749 -12.840 -15.437 1.00 0.00 H new ATOM 0 HA ARG A 113 66.141 -15.574 -14.807 1.00 0.00 H new ATOM 0 HB2 ARG A 113 67.097 -14.257 -17.410 1.00 0.00 H new ATOM 0 HB3 ARG A 113 66.122 -15.707 -17.284 1.00 0.00 H new ATOM 0 HG2 ARG A 113 64.633 -13.890 -15.781 1.00 0.00 H new ATOM 0 HG3 ARG A 113 65.300 -12.858 -17.030 1.00 0.00 H new ATOM 0 HD2 ARG A 113 64.478 -15.278 -18.356 1.00 0.00 H new ATOM 0 HD3 ARG A 113 63.166 -14.840 -17.280 1.00 0.00 H new ATOM 0 HE ARG A 113 63.866 -12.351 -18.357 1.00 0.00 H new ATOM 0 HH11 ARG A 113 64.442 -15.063 -20.265 1.00 0.00 H new ATOM 0 HH12 ARG A 113 63.275 -14.656 -21.528 1.00 0.00 H new ATOM 0 HH21 ARG A 113 61.840 -12.040 -19.707 1.00 0.00 H new ATOM 0 HH22 ARG A 113 61.816 -12.961 -21.215 1.00 0.00 H new ATOM 365 N ARG A 114 69.190 -15.080 -14.945 1.00 0.00 N ATOM 366 CA ARG A 114 70.460 -15.824 -14.924 1.00 0.00 C ATOM 367 C ARG A 114 70.553 -16.586 -13.623 1.00 0.00 C ATOM 368 O ARG A 114 70.481 -17.798 -13.601 1.00 0.00 O ATOM 369 CB ARG A 114 71.572 -14.783 -15.056 1.00 0.00 C ATOM 370 CG ARG A 114 71.606 -14.258 -16.491 1.00 0.00 C ATOM 371 CD ARG A 114 72.885 -14.736 -17.180 1.00 0.00 C ATOM 372 NE ARG A 114 73.495 -13.508 -17.759 1.00 0.00 N ATOM 373 CZ ARG A 114 74.374 -13.607 -18.718 1.00 0.00 C ATOM 374 NH1 ARG A 114 74.080 -14.268 -19.803 1.00 0.00 N ATOM 375 NH2 ARG A 114 75.546 -13.049 -18.589 1.00 0.00 N ATOM 0 H ARG A 114 69.224 -14.115 -14.615 1.00 0.00 H new ATOM 0 HA ARG A 114 70.539 -16.550 -15.734 1.00 0.00 H new ATOM 0 HB2 ARG A 114 71.401 -13.962 -14.360 1.00 0.00 H new ATOM 0 HB3 ARG A 114 72.533 -15.226 -14.796 1.00 0.00 H new ATOM 0 HG2 ARG A 114 70.732 -14.610 -17.039 1.00 0.00 H new ATOM 0 HG3 ARG A 114 71.565 -13.169 -16.492 1.00 0.00 H new ATOM 0 HD2 ARG A 114 73.560 -15.215 -16.470 1.00 0.00 H new ATOM 0 HD3 ARG A 114 72.665 -15.470 -17.955 1.00 0.00 H new ATOM 0 HE ARG A 114 73.226 -12.590 -17.406 1.00 0.00 H new ATOM 0 HH11 ARG A 114 73.164 -14.706 -19.901 1.00 0.00 H new ATOM 0 HH12 ARG A 114 74.766 -14.347 -20.554 1.00 0.00 H new ATOM 0 HH21 ARG A 114 75.775 -12.535 -17.738 1.00 0.00 H new ATOM 0 HH22 ARG A 114 76.233 -13.127 -19.339 1.00 0.00 H new ATOM 389 N LEU A 115 70.665 -15.903 -12.535 1.00 0.00 N ATOM 390 CA LEU A 115 70.715 -16.631 -11.253 1.00 0.00 C ATOM 391 C LEU A 115 69.326 -17.165 -10.953 1.00 0.00 C ATOM 392 O LEU A 115 69.170 -18.170 -10.301 1.00 0.00 O ATOM 393 CB LEU A 115 71.149 -15.612 -10.197 1.00 0.00 C ATOM 394 CG LEU A 115 72.672 -15.447 -10.215 1.00 0.00 C ATOM 395 CD1 LEU A 115 73.354 -16.819 -10.214 1.00 0.00 C ATOM 396 CD2 LEU A 115 73.084 -14.679 -11.468 1.00 0.00 C ATOM 0 H LEU A 115 70.724 -14.886 -12.474 1.00 0.00 H new ATOM 0 HA LEU A 115 71.408 -17.472 -11.272 1.00 0.00 H new ATOM 0 HB2 LEU A 115 70.670 -14.652 -10.389 1.00 0.00 H new ATOM 0 HB3 LEU A 115 70.823 -15.939 -9.210 1.00 0.00 H new ATOM 0 HG LEU A 115 72.979 -14.897 -9.325 1.00 0.00 H new ATOM 0 HD11 LEU A 115 74.436 -16.687 -10.227 1.00 0.00 H new ATOM 0 HD12 LEU A 115 73.066 -17.368 -9.317 1.00 0.00 H new ATOM 0 HD13 LEU A 115 73.046 -17.379 -11.097 1.00 0.00 H new ATOM 0 HD21 LEU A 115 74.167 -14.561 -11.482 1.00 0.00 H new ATOM 0 HD22 LEU A 115 72.767 -15.230 -12.353 1.00 0.00 H new ATOM 0 HD23 LEU A 115 72.612 -13.697 -11.464 1.00 0.00 H new ATOM 408 N ALA A 116 68.305 -16.527 -11.448 1.00 0.00 N ATOM 409 CA ALA A 116 66.956 -17.058 -11.185 1.00 0.00 C ATOM 410 C ALA A 116 66.837 -18.409 -11.870 1.00 0.00 C ATOM 411 O ALA A 116 66.502 -19.414 -11.256 1.00 0.00 O ATOM 412 CB ALA A 116 65.983 -16.045 -11.789 1.00 0.00 C ATOM 0 H ALA A 116 68.350 -15.678 -12.012 1.00 0.00 H new ATOM 0 HA ALA A 116 66.748 -17.197 -10.124 1.00 0.00 H new ATOM 0 HB1 ALA A 116 64.959 -16.382 -11.627 1.00 0.00 H new ATOM 0 HB2 ALA A 116 66.125 -15.075 -11.312 1.00 0.00 H new ATOM 0 HB3 ALA A 116 66.170 -15.954 -12.859 1.00 0.00 H new ATOM 418 N ARG A 117 67.142 -18.472 -13.134 1.00 0.00 N ATOM 419 CA ARG A 117 67.040 -19.781 -13.803 1.00 0.00 C ATOM 420 C ARG A 117 67.977 -20.775 -13.135 1.00 0.00 C ATOM 421 O ARG A 117 67.544 -21.783 -12.598 1.00 0.00 O ATOM 422 CB ARG A 117 67.457 -19.545 -15.253 1.00 0.00 C ATOM 423 CG ARG A 117 66.232 -19.154 -16.077 1.00 0.00 C ATOM 424 CD ARG A 117 65.967 -20.227 -17.133 1.00 0.00 C ATOM 425 NE ARG A 117 66.644 -19.728 -18.361 1.00 0.00 N ATOM 426 CZ ARG A 117 65.985 -18.999 -19.217 1.00 0.00 C ATOM 427 NH1 ARG A 117 64.771 -19.335 -19.559 1.00 0.00 N ATOM 428 NH2 ARG A 117 66.537 -17.936 -19.732 1.00 0.00 N ATOM 0 H ARG A 117 67.449 -17.692 -13.715 1.00 0.00 H new ATOM 0 HA ARG A 117 66.032 -20.190 -13.744 1.00 0.00 H new ATOM 0 HB2 ARG A 117 68.209 -18.757 -15.303 1.00 0.00 H new ATOM 0 HB3 ARG A 117 67.912 -20.447 -15.663 1.00 0.00 H new ATOM 0 HG2 ARG A 117 65.363 -19.045 -15.428 1.00 0.00 H new ATOM 0 HG3 ARG A 117 66.395 -18.189 -16.556 1.00 0.00 H new ATOM 0 HD2 ARG A 117 66.368 -21.193 -16.825 1.00 0.00 H new ATOM 0 HD3 ARG A 117 64.898 -20.364 -17.298 1.00 0.00 H new ATOM 0 HE ARG A 117 67.623 -19.956 -18.533 1.00 0.00 H new ATOM 0 HH11 ARG A 117 64.340 -20.167 -19.156 1.00 0.00 H new ATOM 0 HH12 ARG A 117 64.254 -18.766 -20.229 1.00 0.00 H new ATOM 0 HH21 ARG A 117 67.486 -17.674 -19.465 1.00 0.00 H new ATOM 0 HH22 ARG A 117 66.020 -17.366 -20.402 1.00 0.00 H new ATOM 442 N GLN A 118 69.253 -20.463 -13.161 1.00 0.00 N ATOM 443 CA GLN A 118 70.299 -21.344 -12.571 1.00 0.00 C ATOM 444 C GLN A 118 69.941 -21.739 -11.152 1.00 0.00 C ATOM 445 O GLN A 118 69.953 -22.902 -10.799 1.00 0.00 O ATOM 446 CB GLN A 118 71.568 -20.489 -12.618 1.00 0.00 C ATOM 447 CG GLN A 118 72.447 -20.763 -11.401 1.00 0.00 C ATOM 448 CD GLN A 118 72.902 -22.225 -11.403 1.00 0.00 C ATOM 449 OE1 GLN A 118 73.152 -22.820 -12.539 1.00 0.00 O flip ATOM 450 NE2 GLN A 118 73.034 -22.833 -10.359 1.00 0.00 N flip ATOM 0 H GLN A 118 69.617 -19.607 -13.581 1.00 0.00 H new ATOM 0 HA GLN A 118 70.415 -22.285 -13.110 1.00 0.00 H new ATOM 0 HB2 GLN A 118 72.124 -20.704 -13.531 1.00 0.00 H new ATOM 0 HB3 GLN A 118 71.300 -19.433 -12.649 1.00 0.00 H new ATOM 0 HG2 GLN A 118 73.315 -20.103 -11.413 1.00 0.00 H new ATOM 0 HG3 GLN A 118 71.894 -20.547 -10.487 1.00 0.00 H new ATOM 0 HE21 GLN A 118 72.839 -22.370 -9.471 1.00 0.00 H new ATOM 0 HE22 GLN A 118 73.340 -23.806 -10.371 1.00 0.00 H new ATOM 459 N LEU A 119 69.606 -20.793 -10.336 1.00 0.00 N ATOM 460 CA LEU A 119 69.232 -21.152 -8.949 1.00 0.00 C ATOM 461 C LEU A 119 68.007 -22.070 -9.006 1.00 0.00 C ATOM 462 O LEU A 119 67.606 -22.649 -8.017 1.00 0.00 O ATOM 463 CB LEU A 119 68.929 -19.828 -8.247 1.00 0.00 C ATOM 464 CG LEU A 119 70.227 -19.017 -8.071 1.00 0.00 C ATOM 465 CD1 LEU A 119 69.981 -17.883 -7.079 1.00 0.00 C ATOM 466 CD2 LEU A 119 71.361 -19.913 -7.548 1.00 0.00 C ATOM 0 H LEU A 119 69.574 -19.799 -10.562 1.00 0.00 H new ATOM 0 HA LEU A 119 70.014 -21.686 -8.409 1.00 0.00 H new ATOM 0 HB2 LEU A 119 68.208 -19.254 -8.830 1.00 0.00 H new ATOM 0 HB3 LEU A 119 68.474 -20.018 -7.275 1.00 0.00 H new ATOM 0 HG LEU A 119 70.521 -18.612 -9.039 1.00 0.00 H new ATOM 0 HD11 LEU A 119 70.897 -17.306 -6.951 1.00 0.00 H new ATOM 0 HD12 LEU A 119 69.193 -17.233 -7.458 1.00 0.00 H new ATOM 0 HD13 LEU A 119 69.677 -18.299 -6.118 1.00 0.00 H new ATOM 0 HD21 LEU A 119 72.268 -19.320 -7.431 1.00 0.00 H new ATOM 0 HD22 LEU A 119 71.076 -20.335 -6.584 1.00 0.00 H new ATOM 0 HD23 LEU A 119 71.544 -20.720 -8.258 1.00 0.00 H new ATOM 478 N LYS A 120 67.435 -22.215 -10.187 1.00 0.00 N ATOM 479 CA LYS A 120 66.255 -23.107 -10.400 1.00 0.00 C ATOM 480 C LYS A 120 64.980 -22.367 -10.056 1.00 0.00 C ATOM 481 O LYS A 120 64.118 -22.878 -9.370 1.00 0.00 O ATOM 482 CB LYS A 120 66.452 -24.331 -9.498 1.00 0.00 C ATOM 483 CG LYS A 120 67.860 -24.896 -9.709 1.00 0.00 C ATOM 484 CD LYS A 120 67.881 -26.374 -9.316 1.00 0.00 C ATOM 485 CE LYS A 120 67.135 -27.198 -10.368 1.00 0.00 C ATOM 486 NZ LYS A 120 66.492 -28.303 -9.606 1.00 0.00 N ATOM 0 H LYS A 120 67.752 -21.736 -11.030 1.00 0.00 H new ATOM 0 HA LYS A 120 66.173 -23.419 -11.441 1.00 0.00 H new ATOM 0 HB2 LYS A 120 66.312 -24.053 -8.453 1.00 0.00 H new ATOM 0 HB3 LYS A 120 65.705 -25.091 -9.728 1.00 0.00 H new ATOM 0 HG2 LYS A 120 68.157 -24.782 -10.752 1.00 0.00 H new ATOM 0 HG3 LYS A 120 68.580 -24.339 -9.110 1.00 0.00 H new ATOM 0 HD2 LYS A 120 68.910 -26.723 -9.230 1.00 0.00 H new ATOM 0 HD3 LYS A 120 67.416 -26.507 -8.339 1.00 0.00 H new ATOM 0 HE2 LYS A 120 66.393 -26.594 -10.889 1.00 0.00 H new ATOM 0 HE3 LYS A 120 67.818 -27.585 -11.124 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 65.961 -28.912 -10.260 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 67.223 -28.865 -9.126 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 65.842 -27.905 -8.899 1.00 0.00 H new ATOM 500 N VAL A 121 64.843 -21.166 -10.536 1.00 0.00 N ATOM 501 CA VAL A 121 63.587 -20.411 -10.228 1.00 0.00 C ATOM 502 C VAL A 121 62.666 -20.391 -11.450 1.00 0.00 C ATOM 503 O VAL A 121 63.052 -19.991 -12.532 1.00 0.00 O ATOM 504 CB VAL A 121 64.016 -18.999 -9.810 1.00 0.00 C ATOM 505 CG1 VAL A 121 62.817 -18.048 -9.883 1.00 0.00 C ATOM 506 CG2 VAL A 121 64.520 -19.040 -8.364 1.00 0.00 C ATOM 0 H VAL A 121 65.525 -20.678 -11.116 1.00 0.00 H new ATOM 0 HA VAL A 121 63.020 -20.882 -9.425 1.00 0.00 H new ATOM 0 HB VAL A 121 64.802 -18.649 -10.479 1.00 0.00 H new ATOM 0 HG11 VAL A 121 63.128 -17.047 -9.585 1.00 0.00 H new ATOM 0 HG12 VAL A 121 62.436 -18.021 -10.904 1.00 0.00 H new ATOM 0 HG13 VAL A 121 62.033 -18.399 -9.212 1.00 0.00 H new ATOM 0 HG21 VAL A 121 64.828 -18.040 -8.057 1.00 0.00 H new ATOM 0 HG22 VAL A 121 63.721 -19.390 -7.710 1.00 0.00 H new ATOM 0 HG23 VAL A 121 65.370 -19.719 -8.294 1.00 0.00 H new ATOM 516 N SER A 122 61.453 -20.833 -11.279 1.00 0.00 N ATOM 517 CA SER A 122 60.489 -20.864 -12.416 1.00 0.00 C ATOM 518 C SER A 122 59.964 -19.456 -12.719 1.00 0.00 C ATOM 519 O SER A 122 59.912 -18.607 -11.852 1.00 0.00 O ATOM 520 CB SER A 122 59.352 -21.763 -11.936 1.00 0.00 C ATOM 521 OG SER A 122 58.931 -21.333 -10.650 1.00 0.00 O ATOM 0 H SER A 122 61.083 -21.178 -10.393 1.00 0.00 H new ATOM 0 HA SER A 122 60.949 -21.230 -13.334 1.00 0.00 H new ATOM 0 HB2 SER A 122 58.519 -21.722 -12.638 1.00 0.00 H new ATOM 0 HB3 SER A 122 59.684 -22.800 -11.896 1.00 0.00 H new ATOM 0 HG SER A 122 58.200 -21.905 -10.337 1.00 0.00 H new ATOM 527 N ASP A 123 59.569 -19.204 -13.941 1.00 0.00 N ATOM 528 CA ASP A 123 59.046 -17.852 -14.282 1.00 0.00 C ATOM 529 C ASP A 123 57.828 -17.542 -13.441 1.00 0.00 C ATOM 530 O ASP A 123 57.445 -16.404 -13.248 1.00 0.00 O ATOM 531 CB ASP A 123 58.694 -17.903 -15.771 1.00 0.00 C ATOM 532 CG ASP A 123 59.906 -17.480 -16.603 1.00 0.00 C ATOM 533 OD1 ASP A 123 60.775 -16.820 -16.059 1.00 0.00 O ATOM 534 OD2 ASP A 123 59.942 -17.822 -17.775 1.00 0.00 O ATOM 0 H ASP A 123 59.587 -19.873 -14.711 1.00 0.00 H new ATOM 0 HA ASP A 123 59.775 -17.067 -14.082 1.00 0.00 H new ATOM 0 HB2 ASP A 123 58.385 -18.911 -16.047 1.00 0.00 H new ATOM 0 HB3 ASP A 123 57.851 -17.244 -15.978 1.00 0.00 H new ATOM 539 N THR A 124 57.246 -18.553 -12.921 1.00 0.00 N ATOM 540 CA THR A 124 56.066 -18.384 -12.052 1.00 0.00 C ATOM 541 C THR A 124 56.493 -17.635 -10.794 1.00 0.00 C ATOM 542 O THR A 124 55.714 -16.952 -10.159 1.00 0.00 O ATOM 543 CB THR A 124 55.645 -19.808 -11.710 1.00 0.00 C ATOM 544 OG1 THR A 124 56.058 -20.684 -12.751 1.00 0.00 O ATOM 545 CG2 THR A 124 54.128 -19.871 -11.564 1.00 0.00 C ATOM 0 H THR A 124 57.539 -19.520 -13.060 1.00 0.00 H new ATOM 0 HA THR A 124 55.256 -17.821 -12.516 1.00 0.00 H new ATOM 0 HB THR A 124 56.111 -20.110 -10.772 1.00 0.00 H new ATOM 0 HG1 THR A 124 55.790 -21.601 -12.533 1.00 0.00 H new ATOM 0 HG21 THR A 124 53.828 -20.890 -11.319 1.00 0.00 H new ATOM 0 HG22 THR A 124 53.811 -19.198 -10.767 1.00 0.00 H new ATOM 0 HG23 THR A 124 53.659 -19.570 -12.501 1.00 0.00 H new ATOM 553 N LYS A 125 57.743 -17.759 -10.443 1.00 0.00 N ATOM 554 CA LYS A 125 58.257 -17.061 -9.242 1.00 0.00 C ATOM 555 C LYS A 125 58.965 -15.782 -9.664 1.00 0.00 C ATOM 556 O LYS A 125 58.732 -14.722 -9.119 1.00 0.00 O ATOM 557 CB LYS A 125 59.239 -18.040 -8.597 1.00 0.00 C ATOM 558 CG LYS A 125 58.465 -19.125 -7.849 1.00 0.00 C ATOM 559 CD LYS A 125 58.127 -18.636 -6.440 1.00 0.00 C ATOM 560 CE LYS A 125 58.764 -19.570 -5.409 1.00 0.00 C ATOM 561 NZ LYS A 125 57.709 -20.578 -5.098 1.00 0.00 N ATOM 0 H LYS A 125 58.432 -18.320 -10.944 1.00 0.00 H new ATOM 0 HA LYS A 125 57.465 -16.779 -8.548 1.00 0.00 H new ATOM 0 HB2 LYS A 125 59.872 -18.492 -9.361 1.00 0.00 H new ATOM 0 HB3 LYS A 125 59.898 -17.510 -7.909 1.00 0.00 H new ATOM 0 HG2 LYS A 125 57.550 -19.371 -8.389 1.00 0.00 H new ATOM 0 HG3 LYS A 125 59.058 -20.038 -7.795 1.00 0.00 H new ATOM 0 HD2 LYS A 125 58.492 -17.619 -6.299 1.00 0.00 H new ATOM 0 HD3 LYS A 125 57.046 -18.609 -6.303 1.00 0.00 H new ATOM 0 HE2 LYS A 125 59.660 -20.046 -5.808 1.00 0.00 H new ATOM 0 HE3 LYS A 125 59.065 -19.024 -4.515 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 58.072 -21.255 -4.396 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 56.871 -20.096 -4.714 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 57.448 -21.087 -5.967 1.00 0.00 H new ATOM 575 N ILE A 126 59.812 -15.869 -10.653 1.00 0.00 N ATOM 576 CA ILE A 126 60.513 -14.646 -11.132 1.00 0.00 C ATOM 577 C ILE A 126 59.470 -13.544 -11.339 1.00 0.00 C ATOM 578 O ILE A 126 59.705 -12.384 -11.067 1.00 0.00 O ATOM 579 CB ILE A 126 61.179 -15.057 -12.460 1.00 0.00 C ATOM 580 CG1 ILE A 126 62.577 -15.621 -12.172 1.00 0.00 C ATOM 581 CG2 ILE A 126 61.310 -13.847 -13.397 1.00 0.00 C ATOM 582 CD1 ILE A 126 62.816 -16.885 -13.012 1.00 0.00 C ATOM 0 H ILE A 126 60.048 -16.730 -11.147 1.00 0.00 H new ATOM 0 HA ILE A 126 61.258 -14.265 -10.434 1.00 0.00 H new ATOM 0 HB ILE A 126 60.559 -15.812 -12.943 1.00 0.00 H new ATOM 0 HG12 ILE A 126 63.335 -14.872 -12.403 1.00 0.00 H new ATOM 0 HG13 ILE A 126 62.672 -15.855 -11.112 1.00 0.00 H new ATOM 0 HG21 ILE A 126 61.782 -14.158 -14.329 1.00 0.00 H new ATOM 0 HG22 ILE A 126 60.320 -13.442 -13.609 1.00 0.00 H new ATOM 0 HG23 ILE A 126 61.920 -13.081 -12.919 1.00 0.00 H new ATOM 0 HD11 ILE A 126 63.810 -17.279 -12.802 1.00 0.00 H new ATOM 0 HD12 ILE A 126 62.067 -17.636 -12.760 1.00 0.00 H new ATOM 0 HD13 ILE A 126 62.740 -16.638 -14.071 1.00 0.00 H new ATOM 594 N ASP A 127 58.310 -13.910 -11.807 1.00 0.00 N ATOM 595 CA ASP A 127 57.244 -12.904 -12.020 1.00 0.00 C ATOM 596 C ASP A 127 56.599 -12.528 -10.684 1.00 0.00 C ATOM 597 O ASP A 127 56.183 -11.400 -10.473 1.00 0.00 O ATOM 598 CB ASP A 127 56.231 -13.588 -12.937 1.00 0.00 C ATOM 599 CG ASP A 127 55.397 -12.525 -13.655 1.00 0.00 C ATOM 600 OD1 ASP A 127 54.581 -11.899 -13.001 1.00 0.00 O ATOM 601 OD2 ASP A 127 55.589 -12.356 -14.849 1.00 0.00 O ATOM 0 H ASP A 127 58.057 -14.868 -12.051 1.00 0.00 H new ATOM 0 HA ASP A 127 57.626 -11.981 -12.456 1.00 0.00 H new ATOM 0 HB2 ASP A 127 56.747 -14.214 -13.665 1.00 0.00 H new ATOM 0 HB3 ASP A 127 55.582 -14.244 -12.356 1.00 0.00 H new ATOM 606 N SER A 128 56.531 -13.455 -9.765 1.00 0.00 N ATOM 607 CA SER A 128 55.929 -13.139 -8.444 1.00 0.00 C ATOM 608 C SER A 128 56.853 -12.177 -7.719 1.00 0.00 C ATOM 609 O SER A 128 56.461 -11.111 -7.284 1.00 0.00 O ATOM 610 CB SER A 128 55.852 -14.474 -7.705 1.00 0.00 C ATOM 611 OG SER A 128 54.771 -14.433 -6.785 1.00 0.00 O ATOM 0 H SER A 128 56.866 -14.412 -9.875 1.00 0.00 H new ATOM 0 HA SER A 128 54.945 -12.676 -8.518 1.00 0.00 H new ATOM 0 HB2 SER A 128 55.711 -15.289 -8.415 1.00 0.00 H new ATOM 0 HB3 SER A 128 56.787 -14.667 -7.179 1.00 0.00 H new ATOM 0 HG SER A 128 54.715 -15.287 -6.308 1.00 0.00 H new ATOM 617 N ILE A 129 58.091 -12.548 -7.617 1.00 0.00 N ATOM 618 CA ILE A 129 59.085 -11.678 -6.959 1.00 0.00 C ATOM 619 C ILE A 129 59.010 -10.269 -7.566 1.00 0.00 C ATOM 620 O ILE A 129 58.993 -9.279 -6.861 1.00 0.00 O ATOM 621 CB ILE A 129 60.407 -12.369 -7.276 1.00 0.00 C ATOM 622 CG1 ILE A 129 60.776 -13.274 -6.108 1.00 0.00 C ATOM 623 CG2 ILE A 129 61.502 -11.341 -7.498 1.00 0.00 C ATOM 624 CD1 ILE A 129 61.141 -14.658 -6.637 1.00 0.00 C ATOM 0 H ILE A 129 58.460 -13.432 -7.968 1.00 0.00 H new ATOM 0 HA ILE A 129 58.937 -11.550 -5.887 1.00 0.00 H new ATOM 0 HB ILE A 129 60.301 -12.958 -8.187 1.00 0.00 H new ATOM 0 HG12 ILE A 129 61.615 -12.850 -5.556 1.00 0.00 H new ATOM 0 HG13 ILE A 129 59.941 -13.347 -5.412 1.00 0.00 H new ATOM 0 HG21 ILE A 129 62.439 -11.850 -7.723 1.00 0.00 H new ATOM 0 HG22 ILE A 129 61.231 -10.695 -8.333 1.00 0.00 H new ATOM 0 HG23 ILE A 129 61.624 -10.739 -6.598 1.00 0.00 H new ATOM 0 HD11 ILE A 129 61.406 -15.308 -5.803 1.00 0.00 H new ATOM 0 HD12 ILE A 129 60.289 -15.080 -7.170 1.00 0.00 H new ATOM 0 HD13 ILE A 129 61.989 -14.576 -7.316 1.00 0.00 H new ATOM 636 N GLU A 130 58.954 -10.179 -8.870 1.00 0.00 N ATOM 637 CA GLU A 130 58.867 -8.843 -9.531 1.00 0.00 C ATOM 638 C GLU A 130 57.706 -8.042 -8.944 1.00 0.00 C ATOM 639 O GLU A 130 57.795 -6.844 -8.755 1.00 0.00 O ATOM 640 CB GLU A 130 58.603 -9.153 -11.005 1.00 0.00 C ATOM 641 CG GLU A 130 59.914 -9.082 -11.789 1.00 0.00 C ATOM 642 CD GLU A 130 59.734 -8.188 -13.017 1.00 0.00 C ATOM 643 OE1 GLU A 130 58.613 -8.083 -13.490 1.00 0.00 O ATOM 644 OE2 GLU A 130 60.718 -7.625 -13.465 1.00 0.00 O ATOM 0 H GLU A 130 58.965 -10.976 -9.507 1.00 0.00 H new ATOM 0 HA GLU A 130 59.771 -8.250 -9.389 1.00 0.00 H new ATOM 0 HB2 GLU A 130 58.162 -10.145 -11.105 1.00 0.00 H new ATOM 0 HB3 GLU A 130 57.885 -8.442 -11.413 1.00 0.00 H new ATOM 0 HG2 GLU A 130 60.708 -8.688 -11.154 1.00 0.00 H new ATOM 0 HG3 GLU A 130 60.219 -10.082 -12.097 1.00 0.00 H new ATOM 651 N ASP A 131 56.613 -8.694 -8.664 1.00 0.00 N ATOM 652 CA ASP A 131 55.439 -7.972 -8.099 1.00 0.00 C ATOM 653 C ASP A 131 55.713 -7.524 -6.657 1.00 0.00 C ATOM 654 O ASP A 131 55.199 -6.521 -6.204 1.00 0.00 O ATOM 655 CB ASP A 131 54.296 -8.991 -8.138 1.00 0.00 C ATOM 656 CG ASP A 131 53.130 -8.501 -7.273 1.00 0.00 C ATOM 657 OD1 ASP A 131 53.009 -7.299 -7.101 1.00 0.00 O ATOM 658 OD2 ASP A 131 52.379 -9.337 -6.799 1.00 0.00 O ATOM 0 H ASP A 131 56.481 -9.696 -8.802 1.00 0.00 H new ATOM 0 HA ASP A 131 55.207 -7.068 -8.662 1.00 0.00 H new ATOM 0 HB2 ASP A 131 53.962 -9.136 -9.165 1.00 0.00 H new ATOM 0 HB3 ASP A 131 54.647 -9.958 -7.777 1.00 0.00 H new ATOM 663 N ARG A 132 56.502 -8.266 -5.930 1.00 0.00 N ATOM 664 CA ARG A 132 56.787 -7.889 -4.519 1.00 0.00 C ATOM 665 C ARG A 132 57.917 -6.857 -4.442 1.00 0.00 C ATOM 666 O ARG A 132 57.986 -6.068 -3.519 1.00 0.00 O ATOM 667 CB ARG A 132 57.206 -9.196 -3.844 1.00 0.00 C ATOM 668 CG ARG A 132 55.980 -9.862 -3.221 1.00 0.00 C ATOM 669 CD ARG A 132 55.495 -10.987 -4.140 1.00 0.00 C ATOM 670 NE ARG A 132 54.725 -11.903 -3.257 1.00 0.00 N ATOM 671 CZ ARG A 132 53.651 -12.490 -3.709 1.00 0.00 C ATOM 672 NH1 ARG A 132 53.660 -13.772 -3.951 1.00 0.00 N ATOM 673 NH2 ARG A 132 52.572 -11.790 -3.928 1.00 0.00 N ATOM 0 H ARG A 132 56.961 -9.117 -6.253 1.00 0.00 H new ATOM 0 HA ARG A 132 55.923 -7.431 -4.038 1.00 0.00 H new ATOM 0 HB2 ARG A 132 57.665 -9.864 -4.573 1.00 0.00 H new ATOM 0 HB3 ARG A 132 57.955 -8.998 -3.077 1.00 0.00 H new ATOM 0 HG2 ARG A 132 56.229 -10.261 -2.238 1.00 0.00 H new ATOM 0 HG3 ARG A 132 55.187 -9.128 -3.076 1.00 0.00 H new ATOM 0 HD2 ARG A 132 54.871 -10.598 -4.944 1.00 0.00 H new ATOM 0 HD3 ARG A 132 56.333 -11.503 -4.608 1.00 0.00 H new ATOM 0 HE ARG A 132 55.036 -12.072 -2.300 1.00 0.00 H new ATOM 0 HH11 ARG A 132 54.507 -14.316 -3.787 1.00 0.00 H new ATOM 0 HH12 ARG A 132 52.820 -14.230 -4.304 1.00 0.00 H new ATOM 0 HH21 ARG A 132 52.569 -10.786 -3.746 1.00 0.00 H new ATOM 0 HH22 ARG A 132 51.731 -12.246 -4.281 1.00 0.00 H new ATOM 687 N TYR A 133 58.803 -6.854 -5.395 1.00 0.00 N ATOM 688 CA TYR A 133 59.926 -5.871 -5.362 1.00 0.00 C ATOM 689 C TYR A 133 60.201 -5.321 -6.767 1.00 0.00 C ATOM 690 O TYR A 133 61.197 -5.646 -7.380 1.00 0.00 O ATOM 691 CB TYR A 133 61.124 -6.663 -4.844 1.00 0.00 C ATOM 692 CG TYR A 133 60.801 -7.227 -3.482 1.00 0.00 C ATOM 693 CD1 TYR A 133 60.460 -6.370 -2.429 1.00 0.00 C ATOM 694 CD2 TYR A 133 60.841 -8.611 -3.275 1.00 0.00 C ATOM 695 CE1 TYR A 133 60.159 -6.899 -1.167 1.00 0.00 C ATOM 696 CE2 TYR A 133 60.541 -9.139 -2.015 1.00 0.00 C ATOM 697 CZ TYR A 133 60.199 -8.283 -0.959 1.00 0.00 C ATOM 698 OH TYR A 133 59.902 -8.802 0.285 1.00 0.00 O ATOM 0 H TYR A 133 58.801 -7.487 -6.195 1.00 0.00 H new ATOM 0 HA TYR A 133 59.703 -5.010 -4.732 1.00 0.00 H new ATOM 0 HB2 TYR A 133 61.367 -7.470 -5.536 1.00 0.00 H new ATOM 0 HB3 TYR A 133 62.001 -6.019 -4.784 1.00 0.00 H new ATOM 0 HD1 TYR A 133 60.429 -5.302 -2.589 1.00 0.00 H new ATOM 0 HD2 TYR A 133 61.104 -9.271 -4.088 1.00 0.00 H new ATOM 0 HE1 TYR A 133 59.896 -6.239 -0.354 1.00 0.00 H new ATOM 0 HE2 TYR A 133 60.573 -10.207 -1.856 1.00 0.00 H new ATOM 0 HH TYR A 133 59.976 -9.779 0.258 1.00 0.00 H new ATOM 708 N PRO A 134 59.299 -4.499 -7.229 1.00 0.00 N ATOM 709 CA PRO A 134 59.430 -3.884 -8.577 1.00 0.00 C ATOM 710 C PRO A 134 60.501 -2.787 -8.607 1.00 0.00 C ATOM 711 O PRO A 134 60.633 -2.066 -9.576 1.00 0.00 O ATOM 712 CB PRO A 134 58.061 -3.269 -8.818 1.00 0.00 C ATOM 713 CG PRO A 134 57.488 -3.030 -7.458 1.00 0.00 C ATOM 714 CD PRO A 134 58.077 -4.066 -6.541 1.00 0.00 C ATOM 0 HA PRO A 134 59.730 -4.614 -9.329 1.00 0.00 H new ATOM 0 HB2 PRO A 134 58.142 -2.338 -9.379 1.00 0.00 H new ATOM 0 HB3 PRO A 134 57.427 -3.938 -9.400 1.00 0.00 H new ATOM 0 HG2 PRO A 134 57.729 -2.026 -7.110 1.00 0.00 H new ATOM 0 HG3 PRO A 134 56.401 -3.108 -7.479 1.00 0.00 H new ATOM 0 HD2 PRO A 134 58.299 -3.649 -5.559 1.00 0.00 H new ATOM 0 HD3 PRO A 134 57.390 -4.898 -6.386 1.00 0.00 H new ATOM 722 N ARG A 135 61.249 -2.635 -7.557 1.00 0.00 N ATOM 723 CA ARG A 135 62.287 -1.562 -7.533 1.00 0.00 C ATOM 724 C ARG A 135 63.649 -2.060 -8.039 1.00 0.00 C ATOM 725 O ARG A 135 64.102 -1.674 -9.098 1.00 0.00 O ATOM 726 CB ARG A 135 62.379 -1.138 -6.068 1.00 0.00 C ATOM 727 CG ARG A 135 61.121 -0.359 -5.682 1.00 0.00 C ATOM 728 CD ARG A 135 61.193 1.056 -6.266 1.00 0.00 C ATOM 729 NE ARG A 135 60.221 1.064 -7.393 1.00 0.00 N ATOM 730 CZ ARG A 135 59.136 1.785 -7.309 1.00 0.00 C ATOM 731 NH1 ARG A 135 59.088 2.962 -7.872 1.00 0.00 N ATOM 732 NH2 ARG A 135 58.101 1.328 -6.660 1.00 0.00 N ATOM 0 H ARG A 135 61.191 -3.204 -6.712 1.00 0.00 H new ATOM 0 HA ARG A 135 62.016 -0.738 -8.193 1.00 0.00 H new ATOM 0 HB2 ARG A 135 62.486 -2.016 -5.430 1.00 0.00 H new ATOM 0 HB3 ARG A 135 63.264 -0.521 -5.912 1.00 0.00 H new ATOM 0 HG2 ARG A 135 60.235 -0.872 -6.055 1.00 0.00 H new ATOM 0 HG3 ARG A 135 61.029 -0.311 -4.597 1.00 0.00 H new ATOM 0 HD2 ARG A 135 60.934 1.804 -5.517 1.00 0.00 H new ATOM 0 HD3 ARG A 135 62.200 1.288 -6.613 1.00 0.00 H new ATOM 0 HE ARG A 135 60.402 0.508 -8.229 1.00 0.00 H new ATOM 0 HH11 ARG A 135 59.899 3.319 -8.378 1.00 0.00 H new ATOM 0 HH12 ARG A 135 58.240 3.525 -7.806 1.00 0.00 H new ATOM 0 HH21 ARG A 135 58.140 0.409 -6.219 1.00 0.00 H new ATOM 0 HH22 ARG A 135 57.252 1.890 -6.593 1.00 0.00 H new ATOM 746 N ASN A 136 64.326 -2.880 -7.282 1.00 0.00 N ATOM 747 CA ASN A 136 65.675 -3.353 -7.719 1.00 0.00 C ATOM 748 C ASN A 136 65.822 -4.874 -7.662 1.00 0.00 C ATOM 749 O ASN A 136 65.285 -5.542 -6.797 1.00 0.00 O ATOM 750 CB ASN A 136 66.654 -2.690 -6.750 1.00 0.00 C ATOM 751 CG ASN A 136 66.382 -3.179 -5.325 1.00 0.00 C ATOM 752 OD1 ASN A 136 66.420 -4.364 -5.060 1.00 0.00 O ATOM 753 ND2 ASN A 136 66.111 -2.311 -4.390 1.00 0.00 N ATOM 0 H ASN A 136 64.007 -3.243 -6.384 1.00 0.00 H new ATOM 0 HA ASN A 136 65.854 -3.089 -8.761 1.00 0.00 H new ATOM 0 HB2 ASN A 136 67.679 -2.926 -7.036 1.00 0.00 H new ATOM 0 HB3 ASN A 136 66.551 -1.606 -6.799 1.00 0.00 H new ATOM 0 HD21 ASN A 136 65.931 -2.627 -3.437 1.00 0.00 H new ATOM 0 HD22 ASN A 136 66.079 -1.316 -4.612 1.00 0.00 H new ATOM 760 N LEU A 137 66.587 -5.415 -8.576 1.00 0.00 N ATOM 761 CA LEU A 137 66.827 -6.882 -8.584 1.00 0.00 C ATOM 762 C LEU A 137 67.369 -7.300 -7.225 1.00 0.00 C ATOM 763 O LEU A 137 67.268 -8.439 -6.815 1.00 0.00 O ATOM 764 CB LEU A 137 67.892 -7.108 -9.647 1.00 0.00 C ATOM 765 CG LEU A 137 69.102 -6.238 -9.325 1.00 0.00 C ATOM 766 CD1 LEU A 137 70.205 -7.086 -8.689 1.00 0.00 C ATOM 767 CD2 LEU A 137 69.616 -5.613 -10.615 1.00 0.00 C ATOM 0 H LEU A 137 67.056 -4.897 -9.319 1.00 0.00 H new ATOM 0 HA LEU A 137 65.921 -7.453 -8.786 1.00 0.00 H new ATOM 0 HB2 LEU A 137 68.180 -8.159 -9.675 1.00 0.00 H new ATOM 0 HB3 LEU A 137 67.500 -6.859 -10.633 1.00 0.00 H new ATOM 0 HG LEU A 137 68.812 -5.457 -8.622 1.00 0.00 H new ATOM 0 HD11 LEU A 137 71.065 -6.455 -8.463 1.00 0.00 H new ATOM 0 HD12 LEU A 137 69.833 -7.536 -7.768 1.00 0.00 H new ATOM 0 HD13 LEU A 137 70.504 -7.872 -9.382 1.00 0.00 H new ATOM 0 HD21 LEU A 137 70.482 -4.988 -10.397 1.00 0.00 H new ATOM 0 HD22 LEU A 137 69.903 -6.401 -11.312 1.00 0.00 H new ATOM 0 HD23 LEU A 137 68.831 -5.002 -11.061 1.00 0.00 H new ATOM 779 N THR A 138 67.957 -6.368 -6.531 1.00 0.00 N ATOM 780 CA THR A 138 68.533 -6.672 -5.199 1.00 0.00 C ATOM 781 C THR A 138 67.452 -7.220 -4.269 1.00 0.00 C ATOM 782 O THR A 138 67.717 -8.011 -3.388 1.00 0.00 O ATOM 783 CB THR A 138 69.051 -5.328 -4.694 1.00 0.00 C ATOM 784 OG1 THR A 138 69.375 -4.502 -5.803 1.00 0.00 O ATOM 785 CG2 THR A 138 70.296 -5.550 -3.843 1.00 0.00 C ATOM 0 H THR A 138 68.063 -5.400 -6.835 1.00 0.00 H new ATOM 0 HA THR A 138 69.318 -7.426 -5.242 1.00 0.00 H new ATOM 0 HB THR A 138 68.283 -4.844 -4.091 1.00 0.00 H new ATOM 0 HG1 THR A 138 69.706 -3.638 -5.481 1.00 0.00 H new ATOM 0 HG21 THR A 138 70.666 -4.590 -3.482 1.00 0.00 H new ATOM 0 HG22 THR A 138 70.047 -6.186 -2.993 1.00 0.00 H new ATOM 0 HG23 THR A 138 71.066 -6.033 -4.444 1.00 0.00 H new ATOM 793 N GLU A 139 66.234 -6.802 -4.459 1.00 0.00 N ATOM 794 CA GLU A 139 65.136 -7.299 -3.586 1.00 0.00 C ATOM 795 C GLU A 139 64.388 -8.443 -4.279 1.00 0.00 C ATOM 796 O GLU A 139 63.861 -9.333 -3.637 1.00 0.00 O ATOM 797 CB GLU A 139 64.216 -6.096 -3.386 1.00 0.00 C ATOM 798 CG GLU A 139 64.897 -5.081 -2.467 1.00 0.00 C ATOM 799 CD GLU A 139 63.850 -4.116 -1.912 1.00 0.00 C ATOM 800 OE1 GLU A 139 62.989 -3.705 -2.674 1.00 0.00 O ATOM 801 OE2 GLU A 139 63.924 -3.804 -0.735 1.00 0.00 O ATOM 0 H GLU A 139 65.951 -6.138 -5.180 1.00 0.00 H new ATOM 0 HA GLU A 139 65.504 -7.691 -2.638 1.00 0.00 H new ATOM 0 HB2 GLU A 139 63.987 -5.636 -4.347 1.00 0.00 H new ATOM 0 HB3 GLU A 139 63.269 -6.417 -2.953 1.00 0.00 H new ATOM 0 HG2 GLU A 139 65.403 -5.596 -1.650 1.00 0.00 H new ATOM 0 HG3 GLU A 139 65.660 -4.530 -3.017 1.00 0.00 H new ATOM 808 N ARG A 140 64.337 -8.431 -5.585 1.00 0.00 N ATOM 809 CA ARG A 140 63.620 -9.517 -6.307 1.00 0.00 C ATOM 810 C ARG A 140 64.438 -10.810 -6.279 1.00 0.00 C ATOM 811 O ARG A 140 64.078 -11.791 -5.646 1.00 0.00 O ATOM 812 CB ARG A 140 63.485 -9.018 -7.747 1.00 0.00 C ATOM 813 CG ARG A 140 62.666 -7.731 -7.780 1.00 0.00 C ATOM 814 CD ARG A 140 63.340 -6.726 -8.721 1.00 0.00 C ATOM 815 NE ARG A 140 62.378 -6.528 -9.839 1.00 0.00 N ATOM 816 CZ ARG A 140 62.632 -5.644 -10.765 1.00 0.00 C ATOM 817 NH1 ARG A 140 63.223 -6.003 -11.872 1.00 0.00 N ATOM 818 NH2 ARG A 140 62.299 -4.399 -10.582 1.00 0.00 N ATOM 0 H ARG A 140 64.760 -7.718 -6.179 1.00 0.00 H new ATOM 0 HA ARG A 140 62.654 -9.736 -5.852 1.00 0.00 H new ATOM 0 HB2 ARG A 140 64.473 -8.841 -8.173 1.00 0.00 H new ATOM 0 HB3 ARG A 140 63.005 -9.780 -8.361 1.00 0.00 H new ATOM 0 HG2 ARG A 140 61.652 -7.940 -8.119 1.00 0.00 H new ATOM 0 HG3 ARG A 140 62.586 -7.311 -6.777 1.00 0.00 H new ATOM 0 HD2 ARG A 140 63.547 -5.786 -8.209 1.00 0.00 H new ATOM 0 HD3 ARG A 140 64.294 -7.107 -9.086 1.00 0.00 H new ATOM 0 HE ARG A 140 61.522 -7.082 -9.882 1.00 0.00 H new ATOM 0 HH11 ARG A 140 63.488 -6.977 -12.016 1.00 0.00 H new ATOM 0 HH12 ARG A 140 63.420 -5.309 -12.593 1.00 0.00 H new ATOM 0 HH21 ARG A 140 61.840 -4.116 -9.716 1.00 0.00 H new ATOM 0 HH22 ARG A 140 62.497 -3.707 -11.305 1.00 0.00 H new ATOM 832 N VAL A 141 65.539 -10.816 -6.970 1.00 0.00 N ATOM 833 CA VAL A 141 66.390 -12.036 -7.001 1.00 0.00 C ATOM 834 C VAL A 141 66.743 -12.450 -5.571 1.00 0.00 C ATOM 835 O VAL A 141 66.480 -13.560 -5.144 1.00 0.00 O ATOM 836 CB VAL A 141 67.645 -11.626 -7.767 1.00 0.00 C ATOM 837 CG1 VAL A 141 68.526 -12.851 -7.967 1.00 0.00 C ATOM 838 CG2 VAL A 141 67.263 -11.048 -9.136 1.00 0.00 C ATOM 0 H VAL A 141 65.888 -10.028 -7.516 1.00 0.00 H new ATOM 0 HA VAL A 141 65.892 -12.884 -7.471 1.00 0.00 H new ATOM 0 HB VAL A 141 68.182 -10.867 -7.198 1.00 0.00 H new ATOM 0 HG11 VAL A 141 69.425 -12.567 -8.514 1.00 0.00 H new ATOM 0 HG12 VAL A 141 68.806 -13.261 -6.996 1.00 0.00 H new ATOM 0 HG13 VAL A 141 67.979 -13.604 -8.534 1.00 0.00 H new ATOM 0 HG21 VAL A 141 68.166 -10.759 -9.674 1.00 0.00 H new ATOM 0 HG22 VAL A 141 66.724 -11.801 -9.711 1.00 0.00 H new ATOM 0 HG23 VAL A 141 66.628 -10.173 -8.997 1.00 0.00 H new ATOM 848 N ARG A 142 67.335 -11.557 -4.827 1.00 0.00 N ATOM 849 CA ARG A 142 67.699 -11.881 -3.420 1.00 0.00 C ATOM 850 C ARG A 142 66.522 -12.556 -2.721 1.00 0.00 C ATOM 851 O ARG A 142 66.696 -13.488 -1.964 1.00 0.00 O ATOM 852 CB ARG A 142 68.014 -10.538 -2.768 1.00 0.00 C ATOM 853 CG ARG A 142 68.689 -10.772 -1.414 1.00 0.00 C ATOM 854 CD ARG A 142 69.496 -9.531 -1.030 1.00 0.00 C ATOM 855 NE ARG A 142 68.594 -8.748 -0.140 1.00 0.00 N ATOM 856 CZ ARG A 142 69.085 -8.096 0.877 1.00 0.00 C ATOM 857 NH1 ARG A 142 69.049 -6.791 0.894 1.00 0.00 N ATOM 858 NH2 ARG A 142 69.609 -8.748 1.879 1.00 0.00 N ATOM 0 H ARG A 142 67.582 -10.616 -5.133 1.00 0.00 H new ATOM 0 HA ARG A 142 68.545 -12.566 -3.358 1.00 0.00 H new ATOM 0 HB2 ARG A 142 68.667 -9.952 -3.415 1.00 0.00 H new ATOM 0 HB3 ARG A 142 67.098 -9.963 -2.635 1.00 0.00 H new ATOM 0 HG2 ARG A 142 67.938 -10.982 -0.652 1.00 0.00 H new ATOM 0 HG3 ARG A 142 69.342 -11.643 -1.466 1.00 0.00 H new ATOM 0 HD2 ARG A 142 70.419 -9.803 -0.517 1.00 0.00 H new ATOM 0 HD3 ARG A 142 69.779 -8.955 -1.911 1.00 0.00 H new ATOM 0 HE ARG A 142 67.591 -8.722 -0.326 1.00 0.00 H new ATOM 0 HH11 ARG A 142 68.637 -6.282 0.112 1.00 0.00 H new ATOM 0 HH12 ARG A 142 69.433 -6.281 1.689 1.00 0.00 H new ATOM 0 HH21 ARG A 142 69.634 -9.768 1.867 1.00 0.00 H new ATOM 0 HH22 ARG A 142 69.993 -8.238 2.674 1.00 0.00 H new ATOM 872 N GLU A 143 65.315 -12.119 -2.976 1.00 0.00 N ATOM 873 CA GLU A 143 64.161 -12.780 -2.325 1.00 0.00 C ATOM 874 C GLU A 143 64.189 -14.257 -2.700 1.00 0.00 C ATOM 875 O GLU A 143 63.944 -15.111 -1.870 1.00 0.00 O ATOM 876 CB GLU A 143 62.920 -12.053 -2.863 1.00 0.00 C ATOM 877 CG GLU A 143 61.771 -13.039 -3.065 1.00 0.00 C ATOM 878 CD GLU A 143 61.284 -13.550 -1.706 1.00 0.00 C ATOM 879 OE1 GLU A 143 62.006 -13.377 -0.737 1.00 0.00 O ATOM 880 OE2 GLU A 143 60.199 -14.107 -1.657 1.00 0.00 O ATOM 0 H GLU A 143 65.087 -11.344 -3.599 1.00 0.00 H new ATOM 0 HA GLU A 143 64.172 -12.728 -1.236 1.00 0.00 H new ATOM 0 HB2 GLU A 143 62.618 -11.271 -2.166 1.00 0.00 H new ATOM 0 HB3 GLU A 143 63.158 -11.564 -3.808 1.00 0.00 H new ATOM 0 HG2 GLU A 143 60.952 -12.554 -3.597 1.00 0.00 H new ATOM 0 HG3 GLU A 143 62.101 -13.875 -3.682 1.00 0.00 H new ATOM 887 N SER A 144 64.531 -14.589 -3.924 1.00 0.00 N ATOM 888 CA SER A 144 64.609 -16.041 -4.252 1.00 0.00 C ATOM 889 C SER A 144 65.561 -16.681 -3.259 1.00 0.00 C ATOM 890 O SER A 144 65.225 -17.639 -2.619 1.00 0.00 O ATOM 891 CB SER A 144 65.178 -16.194 -5.662 1.00 0.00 C ATOM 892 OG SER A 144 64.213 -15.762 -6.614 1.00 0.00 O ATOM 0 H SER A 144 64.751 -13.942 -4.681 1.00 0.00 H new ATOM 0 HA SER A 144 63.626 -16.510 -4.202 1.00 0.00 H new ATOM 0 HB2 SER A 144 66.091 -15.607 -5.762 1.00 0.00 H new ATOM 0 HB3 SER A 144 65.446 -17.234 -5.846 1.00 0.00 H new ATOM 0 HG SER A 144 64.579 -15.859 -7.518 1.00 0.00 H new ATOM 898 N LEU A 145 66.754 -16.152 -3.119 1.00 0.00 N ATOM 899 CA LEU A 145 67.721 -16.764 -2.154 1.00 0.00 C ATOM 900 C LEU A 145 66.970 -17.468 -1.014 1.00 0.00 C ATOM 901 O LEU A 145 67.227 -18.617 -0.708 1.00 0.00 O ATOM 902 CB LEU A 145 68.584 -15.631 -1.599 1.00 0.00 C ATOM 903 CG LEU A 145 69.490 -15.076 -2.700 1.00 0.00 C ATOM 904 CD1 LEU A 145 70.402 -14.002 -2.106 1.00 0.00 C ATOM 905 CD2 LEU A 145 70.354 -16.200 -3.279 1.00 0.00 C ATOM 0 H LEU A 145 67.096 -15.334 -3.624 1.00 0.00 H new ATOM 0 HA LEU A 145 68.338 -17.512 -2.652 1.00 0.00 H new ATOM 0 HB2 LEU A 145 67.948 -14.838 -1.205 1.00 0.00 H new ATOM 0 HB3 LEU A 145 69.189 -15.996 -0.769 1.00 0.00 H new ATOM 0 HG LEU A 145 68.874 -14.649 -3.491 1.00 0.00 H new ATOM 0 HD11 LEU A 145 71.050 -13.603 -2.886 1.00 0.00 H new ATOM 0 HD12 LEU A 145 69.795 -13.197 -1.692 1.00 0.00 H new ATOM 0 HD13 LEU A 145 71.012 -14.439 -1.316 1.00 0.00 H new ATOM 0 HD21 LEU A 145 70.997 -15.798 -4.062 1.00 0.00 H new ATOM 0 HD22 LEU A 145 70.970 -16.629 -2.489 1.00 0.00 H new ATOM 0 HD23 LEU A 145 69.711 -16.974 -3.699 1.00 0.00 H new ATOM 917 N ARG A 146 66.024 -16.808 -0.397 1.00 0.00 N ATOM 918 CA ARG A 146 65.268 -17.486 0.690 1.00 0.00 C ATOM 919 C ARG A 146 64.638 -18.767 0.118 1.00 0.00 C ATOM 920 O ARG A 146 64.573 -19.792 0.767 1.00 0.00 O ATOM 921 CB ARG A 146 64.212 -16.462 1.144 1.00 0.00 C ATOM 922 CG ARG A 146 62.872 -16.731 0.459 1.00 0.00 C ATOM 923 CD ARG A 146 61.815 -15.760 0.998 1.00 0.00 C ATOM 924 NE ARG A 146 60.889 -16.606 1.799 1.00 0.00 N ATOM 925 CZ ARG A 146 60.506 -16.219 2.986 1.00 0.00 C ATOM 926 NH1 ARG A 146 60.982 -16.809 4.048 1.00 0.00 N ATOM 927 NH2 ARG A 146 59.645 -15.245 3.111 1.00 0.00 N ATOM 0 H ARG A 146 65.748 -15.846 -0.596 1.00 0.00 H new ATOM 0 HA ARG A 146 65.884 -17.788 1.537 1.00 0.00 H new ATOM 0 HB2 ARG A 146 64.090 -16.513 2.226 1.00 0.00 H new ATOM 0 HB3 ARG A 146 64.551 -15.453 0.908 1.00 0.00 H new ATOM 0 HG2 ARG A 146 62.973 -16.612 -0.620 1.00 0.00 H new ATOM 0 HG3 ARG A 146 62.560 -17.760 0.638 1.00 0.00 H new ATOM 0 HD2 ARG A 146 62.270 -14.982 1.612 1.00 0.00 H new ATOM 0 HD3 ARG A 146 61.289 -15.258 0.186 1.00 0.00 H new ATOM 0 HE ARG A 146 60.552 -17.491 1.420 1.00 0.00 H new ATOM 0 HH11 ARG A 146 61.652 -17.571 3.950 1.00 0.00 H new ATOM 0 HH12 ARG A 146 60.684 -16.508 4.976 1.00 0.00 H new ATOM 0 HH21 ARG A 146 59.271 -14.785 2.281 1.00 0.00 H new ATOM 0 HH22 ARG A 146 59.347 -14.944 4.039 1.00 0.00 H new ATOM 941 N ILE A 147 64.187 -18.698 -1.109 1.00 0.00 N ATOM 942 CA ILE A 147 63.572 -19.875 -1.772 1.00 0.00 C ATOM 943 C ILE A 147 64.626 -20.660 -2.577 1.00 0.00 C ATOM 944 O ILE A 147 64.745 -21.859 -2.440 1.00 0.00 O ATOM 945 CB ILE A 147 62.526 -19.265 -2.696 1.00 0.00 C ATOM 946 CG1 ILE A 147 61.376 -18.738 -1.844 1.00 0.00 C ATOM 947 CG2 ILE A 147 62.002 -20.324 -3.663 1.00 0.00 C ATOM 948 CD1 ILE A 147 61.196 -17.247 -2.103 1.00 0.00 C ATOM 0 H ILE A 147 64.222 -17.857 -1.685 1.00 0.00 H new ATOM 0 HA ILE A 147 63.145 -20.585 -1.064 1.00 0.00 H new ATOM 0 HB ILE A 147 62.971 -18.454 -3.272 1.00 0.00 H new ATOM 0 HG12 ILE A 147 60.457 -19.273 -2.083 1.00 0.00 H new ATOM 0 HG13 ILE A 147 61.582 -18.913 -0.788 1.00 0.00 H new ATOM 0 HG21 ILE A 147 61.255 -19.879 -4.320 1.00 0.00 H new ATOM 0 HG22 ILE A 147 62.827 -20.710 -4.261 1.00 0.00 H new ATOM 0 HG23 ILE A 147 61.550 -21.140 -3.099 1.00 0.00 H new ATOM 0 HD11 ILE A 147 60.374 -16.869 -1.495 1.00 0.00 H new ATOM 0 HD12 ILE A 147 62.113 -16.719 -1.842 1.00 0.00 H new ATOM 0 HD13 ILE A 147 60.971 -17.085 -3.157 1.00 0.00 H new ATOM 960 N TRP A 148 65.382 -19.989 -3.425 1.00 0.00 N ATOM 961 CA TRP A 148 66.418 -20.684 -4.245 1.00 0.00 C ATOM 962 C TRP A 148 67.082 -21.804 -3.428 1.00 0.00 C ATOM 963 O TRP A 148 67.205 -22.931 -3.866 1.00 0.00 O ATOM 964 CB TRP A 148 67.452 -19.606 -4.594 1.00 0.00 C ATOM 965 CG TRP A 148 68.847 -20.144 -4.428 1.00 0.00 C ATOM 966 CD1 TRP A 148 69.501 -20.927 -5.321 1.00 0.00 C ATOM 967 CD2 TRP A 148 69.762 -19.955 -3.314 1.00 0.00 C ATOM 968 NE1 TRP A 148 70.767 -21.207 -4.830 1.00 0.00 N ATOM 969 CE2 TRP A 148 70.972 -20.629 -3.594 1.00 0.00 C ATOM 970 CE3 TRP A 148 69.659 -19.262 -2.103 1.00 0.00 C ATOM 971 CZ2 TRP A 148 72.040 -20.609 -2.696 1.00 0.00 C ATOM 972 CZ3 TRP A 148 70.724 -19.237 -1.200 1.00 0.00 C ATOM 973 CH2 TRP A 148 71.910 -19.905 -1.494 1.00 0.00 C ATOM 0 H TRP A 148 65.319 -18.983 -3.580 1.00 0.00 H new ATOM 0 HA TRP A 148 65.988 -21.143 -5.135 1.00 0.00 H new ATOM 0 HB2 TRP A 148 67.305 -19.270 -5.621 1.00 0.00 H new ATOM 0 HB3 TRP A 148 67.312 -18.737 -3.951 1.00 0.00 H new ATOM 0 HD1 TRP A 148 69.101 -21.276 -6.262 1.00 0.00 H new ATOM 0 HE1 TRP A 148 71.461 -21.770 -5.322 1.00 0.00 H new ATOM 0 HE3 TRP A 148 68.744 -18.740 -1.864 1.00 0.00 H new ATOM 0 HZ2 TRP A 148 72.957 -21.131 -2.926 1.00 0.00 H new ATOM 0 HZ3 TRP A 148 70.627 -18.697 -0.270 1.00 0.00 H new ATOM 0 HH2 TRP A 148 72.731 -19.880 -0.793 1.00 0.00 H new ATOM 984 N LYS A 149 67.528 -21.475 -2.241 1.00 0.00 N ATOM 985 CA LYS A 149 68.208 -22.477 -1.371 1.00 0.00 C ATOM 986 C LYS A 149 67.267 -23.635 -1.018 1.00 0.00 C ATOM 987 O LYS A 149 67.701 -24.748 -0.799 1.00 0.00 O ATOM 988 CB LYS A 149 68.600 -21.686 -0.120 1.00 0.00 C ATOM 989 CG LYS A 149 68.943 -22.643 1.027 1.00 0.00 C ATOM 990 CD LYS A 149 69.822 -21.920 2.058 1.00 0.00 C ATOM 991 CE LYS A 149 69.163 -20.598 2.461 1.00 0.00 C ATOM 992 NZ LYS A 149 69.733 -20.272 3.798 1.00 0.00 N ATOM 0 H LYS A 149 67.448 -20.543 -1.835 1.00 0.00 H new ATOM 0 HA LYS A 149 69.067 -22.935 -1.861 1.00 0.00 H new ATOM 0 HB2 LYS A 149 69.456 -21.047 -0.338 1.00 0.00 H new ATOM 0 HB3 LYS A 149 67.781 -21.031 0.176 1.00 0.00 H new ATOM 0 HG2 LYS A 149 68.029 -23.001 1.501 1.00 0.00 H new ATOM 0 HG3 LYS A 149 69.465 -23.518 0.640 1.00 0.00 H new ATOM 0 HD2 LYS A 149 69.962 -22.550 2.936 1.00 0.00 H new ATOM 0 HD3 LYS A 149 70.811 -21.732 1.639 1.00 0.00 H new ATOM 0 HE2 LYS A 149 69.381 -19.812 1.737 1.00 0.00 H new ATOM 0 HE3 LYS A 149 68.078 -20.696 2.508 1.00 0.00 H new ATOM 0 HZ1 LYS A 149 69.328 -19.377 4.139 1.00 0.00 H new ATOM 0 HZ2 LYS A 149 69.504 -21.034 4.468 1.00 0.00 H new ATOM 0 HZ3 LYS A 149 70.766 -20.177 3.721 1.00 0.00 H new ATOM 1006 N ASN A 150 65.989 -23.389 -0.960 1.00 0.00 N ATOM 1007 CA ASN A 150 65.037 -24.491 -0.621 1.00 0.00 C ATOM 1008 C ASN A 150 65.322 -25.713 -1.495 1.00 0.00 C ATOM 1009 O ASN A 150 65.043 -26.837 -1.126 1.00 0.00 O ATOM 1010 CB ASN A 150 63.648 -23.928 -0.922 1.00 0.00 C ATOM 1011 CG ASN A 150 62.603 -24.674 -0.087 1.00 0.00 C ATOM 1012 OD1 ASN A 150 62.835 -25.785 0.346 1.00 0.00 O ATOM 1013 ND2 ASN A 150 61.455 -24.104 0.160 1.00 0.00 N ATOM 0 H ASN A 150 65.561 -22.479 -1.131 1.00 0.00 H new ATOM 0 HA ASN A 150 65.126 -24.810 0.417 1.00 0.00 H new ATOM 0 HB2 ASN A 150 63.618 -22.863 -0.694 1.00 0.00 H new ATOM 0 HB3 ASN A 150 63.423 -24.033 -1.983 1.00 0.00 H new ATOM 0 HD21 ASN A 150 60.753 -24.591 0.717 1.00 0.00 H new ATOM 0 HD22 ASN A 150 61.260 -23.171 -0.204 1.00 0.00 H new ATOM 1020 N THR A 151 65.876 -25.500 -2.655 1.00 0.00 N ATOM 1021 CA THR A 151 66.181 -26.627 -3.559 1.00 0.00 C ATOM 1022 C THR A 151 67.643 -27.069 -3.385 1.00 0.00 C ATOM 1023 O THR A 151 67.930 -28.228 -3.168 1.00 0.00 O ATOM 1024 CB THR A 151 65.941 -26.052 -4.956 1.00 0.00 C ATOM 1025 OG1 THR A 151 64.555 -26.117 -5.263 1.00 0.00 O ATOM 1026 CG2 THR A 151 66.731 -26.847 -5.987 1.00 0.00 C ATOM 0 H THR A 151 66.131 -24.580 -3.014 1.00 0.00 H new ATOM 0 HA THR A 151 65.572 -27.510 -3.364 1.00 0.00 H new ATOM 0 HB THR A 151 66.271 -25.013 -4.978 1.00 0.00 H new ATOM 0 HG1 THR A 151 64.400 -25.747 -6.157 1.00 0.00 H new ATOM 0 HG21 THR A 151 66.555 -26.432 -6.979 1.00 0.00 H new ATOM 0 HG22 THR A 151 67.794 -26.791 -5.753 1.00 0.00 H new ATOM 0 HG23 THR A 151 66.410 -27.888 -5.967 1.00 0.00 H new ATOM 1034 N GLU A 152 68.566 -26.146 -3.487 1.00 0.00 N ATOM 1035 CA GLU A 152 70.005 -26.495 -3.336 1.00 0.00 C ATOM 1036 C GLU A 152 70.417 -26.475 -1.861 1.00 0.00 C ATOM 1037 O GLU A 152 71.584 -26.402 -1.541 1.00 0.00 O ATOM 1038 CB GLU A 152 70.754 -25.404 -4.098 1.00 0.00 C ATOM 1039 CG GLU A 152 70.948 -25.832 -5.552 1.00 0.00 C ATOM 1040 CD GLU A 152 70.817 -24.610 -6.465 1.00 0.00 C ATOM 1041 OE1 GLU A 152 71.019 -23.508 -5.980 1.00 0.00 O ATOM 1042 OE2 GLU A 152 70.519 -24.797 -7.632 1.00 0.00 O ATOM 0 H GLU A 152 68.380 -25.160 -3.670 1.00 0.00 H new ATOM 0 HA GLU A 152 70.220 -27.495 -3.713 1.00 0.00 H new ATOM 0 HB2 GLU A 152 70.196 -24.469 -4.056 1.00 0.00 H new ATOM 0 HB3 GLU A 152 71.721 -25.219 -3.631 1.00 0.00 H new ATOM 0 HG2 GLU A 152 71.928 -26.291 -5.679 1.00 0.00 H new ATOM 0 HG3 GLU A 152 70.206 -26.583 -5.823 1.00 0.00 H new ATOM 1049 N LYS A 153 69.467 -26.517 -0.967 1.00 0.00 N ATOM 1050 CA LYS A 153 69.780 -26.480 0.501 1.00 0.00 C ATOM 1051 C LYS A 153 71.157 -27.077 0.811 1.00 0.00 C ATOM 1052 O LYS A 153 71.989 -26.442 1.429 1.00 0.00 O ATOM 1053 CB LYS A 153 68.682 -27.305 1.184 1.00 0.00 C ATOM 1054 CG LYS A 153 68.172 -28.407 0.248 1.00 0.00 C ATOM 1055 CD LYS A 153 67.742 -29.620 1.076 1.00 0.00 C ATOM 1056 CE LYS A 153 67.863 -30.888 0.227 1.00 0.00 C ATOM 1057 NZ LYS A 153 69.317 -31.213 0.228 1.00 0.00 N ATOM 0 H LYS A 153 68.473 -26.576 -1.189 1.00 0.00 H new ATOM 0 HA LYS A 153 69.808 -25.451 0.858 1.00 0.00 H new ATOM 0 HB2 LYS A 153 69.071 -27.750 2.100 1.00 0.00 H new ATOM 0 HB3 LYS A 153 67.856 -26.654 1.471 1.00 0.00 H new ATOM 0 HG2 LYS A 153 67.332 -28.039 -0.341 1.00 0.00 H new ATOM 0 HG3 LYS A 153 68.954 -28.692 -0.456 1.00 0.00 H new ATOM 0 HD2 LYS A 153 68.365 -29.705 1.966 1.00 0.00 H new ATOM 0 HD3 LYS A 153 66.714 -29.495 1.417 1.00 0.00 H new ATOM 0 HE2 LYS A 153 67.276 -31.703 0.649 1.00 0.00 H new ATOM 0 HE3 LYS A 153 67.496 -30.722 -0.786 1.00 0.00 H new ATOM 0 HZ1 LYS A 153 69.458 -32.176 -0.140 1.00 0.00 H new ATOM 0 HZ2 LYS A 153 69.825 -30.534 -0.375 1.00 0.00 H new ATOM 0 HZ3 LYS A 153 69.685 -31.156 1.199 1.00 0.00 H new ATOM 1071 N GLU A 154 71.405 -28.287 0.404 1.00 0.00 N ATOM 1072 CA GLU A 154 72.734 -28.901 0.703 1.00 0.00 C ATOM 1073 C GLU A 154 73.795 -28.416 -0.286 1.00 0.00 C ATOM 1074 O GLU A 154 74.953 -28.286 0.053 1.00 0.00 O ATOM 1075 CB GLU A 154 72.520 -30.416 0.611 1.00 0.00 C ATOM 1076 CG GLU A 154 72.390 -30.855 -0.851 1.00 0.00 C ATOM 1077 CD GLU A 154 73.663 -31.589 -1.280 1.00 0.00 C ATOM 1078 OE1 GLU A 154 73.868 -32.699 -0.817 1.00 0.00 O ATOM 1079 OE2 GLU A 154 74.409 -31.029 -2.065 1.00 0.00 O ATOM 0 H GLU A 154 70.756 -28.876 -0.118 1.00 0.00 H new ATOM 0 HA GLU A 154 73.099 -28.618 1.690 1.00 0.00 H new ATOM 0 HB2 GLU A 154 73.356 -30.936 1.079 1.00 0.00 H new ATOM 0 HB3 GLU A 154 71.622 -30.696 1.162 1.00 0.00 H new ATOM 0 HG2 GLU A 154 71.524 -31.507 -0.970 1.00 0.00 H new ATOM 0 HG3 GLU A 154 72.226 -29.987 -1.489 1.00 0.00 H new ATOM 1086 N ASN A 155 73.414 -28.125 -1.495 1.00 0.00 N ATOM 1087 CA ASN A 155 74.403 -27.628 -2.480 1.00 0.00 C ATOM 1088 C ASN A 155 74.258 -26.113 -2.607 1.00 0.00 C ATOM 1089 O ASN A 155 74.594 -25.525 -3.613 1.00 0.00 O ATOM 1090 CB ASN A 155 74.054 -28.320 -3.798 1.00 0.00 C ATOM 1091 CG ASN A 155 75.292 -29.037 -4.341 1.00 0.00 C ATOM 1092 OD1 ASN A 155 75.847 -28.614 -5.444 1.00 0.00 O flip ATOM 1093 ND2 ASN A 155 75.761 -29.991 -3.755 1.00 0.00 N flip ATOM 0 H ASN A 155 72.459 -28.211 -1.842 1.00 0.00 H new ATOM 0 HA ASN A 155 75.432 -27.840 -2.189 1.00 0.00 H new ATOM 0 HB2 ASN A 155 73.246 -29.034 -3.643 1.00 0.00 H new ATOM 0 HB3 ASN A 155 73.698 -27.588 -4.522 1.00 0.00 H new ATOM 0 HD21 ASN A 155 75.329 -30.323 -2.893 1.00 0.00 H new ATOM 0 HD22 ASN A 155 76.588 -30.461 -4.125 1.00 0.00 H new ATOM 1100 N ALA A 156 73.742 -25.483 -1.586 1.00 0.00 N ATOM 1101 CA ALA A 156 73.553 -24.005 -1.639 1.00 0.00 C ATOM 1102 C ALA A 156 74.648 -23.297 -0.852 1.00 0.00 C ATOM 1103 O ALA A 156 74.406 -22.651 0.147 1.00 0.00 O ATOM 1104 CB ALA A 156 72.205 -23.762 -0.993 1.00 0.00 C ATOM 0 H ALA A 156 73.443 -25.928 -0.718 1.00 0.00 H new ATOM 0 HA ALA A 156 73.599 -23.624 -2.659 1.00 0.00 H new ATOM 0 HB1 ALA A 156 71.989 -22.694 -0.992 1.00 0.00 H new ATOM 0 HB2 ALA A 156 71.432 -24.288 -1.554 1.00 0.00 H new ATOM 0 HB3 ALA A 156 72.222 -24.130 0.033 1.00 0.00 H new ATOM 1110 N THR A 157 75.845 -23.427 -1.308 1.00 0.00 N ATOM 1111 CA THR A 157 76.997 -22.782 -0.620 1.00 0.00 C ATOM 1112 C THR A 157 77.627 -21.712 -1.509 1.00 0.00 C ATOM 1113 O THR A 157 77.394 -21.659 -2.699 1.00 0.00 O ATOM 1114 CB THR A 157 77.984 -23.918 -0.381 1.00 0.00 C ATOM 1115 OG1 THR A 157 78.082 -24.712 -1.556 1.00 0.00 O ATOM 1116 CG2 THR A 157 77.482 -24.776 0.773 1.00 0.00 C ATOM 0 H THR A 157 76.089 -23.960 -2.143 1.00 0.00 H new ATOM 0 HA THR A 157 76.699 -22.285 0.303 1.00 0.00 H new ATOM 0 HB THR A 157 78.965 -23.511 -0.137 1.00 0.00 H new ATOM 0 HG1 THR A 157 78.718 -25.442 -1.405 1.00 0.00 H new ATOM 0 HG21 THR A 157 78.182 -25.592 0.951 1.00 0.00 H new ATOM 0 HG22 THR A 157 77.400 -24.165 1.672 1.00 0.00 H new ATOM 0 HG23 THR A 157 76.504 -25.186 0.523 1.00 0.00 H new ATOM 1124 N VAL A 158 78.430 -20.860 -0.936 1.00 0.00 N ATOM 1125 CA VAL A 158 79.085 -19.794 -1.746 1.00 0.00 C ATOM 1126 C VAL A 158 79.817 -20.417 -2.930 1.00 0.00 C ATOM 1127 O VAL A 158 79.730 -19.950 -4.048 1.00 0.00 O ATOM 1128 CB VAL A 158 80.072 -19.119 -0.794 1.00 0.00 C ATOM 1129 CG1 VAL A 158 80.945 -18.129 -1.570 1.00 0.00 C ATOM 1130 CG2 VAL A 158 79.293 -18.369 0.287 1.00 0.00 C ATOM 0 H VAL A 158 78.661 -20.855 0.057 1.00 0.00 H new ATOM 0 HA VAL A 158 78.368 -19.081 -2.153 1.00 0.00 H new ATOM 0 HB VAL A 158 80.708 -19.875 -0.334 1.00 0.00 H new ATOM 0 HG11 VAL A 158 81.647 -17.650 -0.887 1.00 0.00 H new ATOM 0 HG12 VAL A 158 81.498 -18.661 -2.345 1.00 0.00 H new ATOM 0 HG13 VAL A 158 80.313 -17.370 -2.031 1.00 0.00 H new ATOM 0 HG21 VAL A 158 79.992 -17.885 0.969 1.00 0.00 H new ATOM 0 HG22 VAL A 158 78.659 -17.614 -0.179 1.00 0.00 H new ATOM 0 HG23 VAL A 158 78.672 -19.072 0.842 1.00 0.00 H new ATOM 1140 N ALA A 159 80.535 -21.476 -2.690 1.00 0.00 N ATOM 1141 CA ALA A 159 81.268 -22.137 -3.800 1.00 0.00 C ATOM 1142 C ALA A 159 80.272 -22.601 -4.858 1.00 0.00 C ATOM 1143 O ALA A 159 80.506 -22.482 -6.043 1.00 0.00 O ATOM 1144 CB ALA A 159 81.980 -23.331 -3.164 1.00 0.00 C ATOM 0 H ALA A 159 80.645 -21.911 -1.774 1.00 0.00 H new ATOM 0 HA ALA A 159 81.977 -21.470 -4.290 1.00 0.00 H new ATOM 0 HB1 ALA A 159 82.543 -23.868 -3.927 1.00 0.00 H new ATOM 0 HB2 ALA A 159 82.662 -22.978 -2.391 1.00 0.00 H new ATOM 0 HB3 ALA A 159 81.243 -24.000 -2.720 1.00 0.00 H new ATOM 1150 N HIS A 160 79.154 -23.117 -4.436 1.00 0.00 N ATOM 1151 CA HIS A 160 78.140 -23.572 -5.419 1.00 0.00 C ATOM 1152 C HIS A 160 77.742 -22.396 -6.311 1.00 0.00 C ATOM 1153 O HIS A 160 77.524 -22.551 -7.492 1.00 0.00 O ATOM 1154 CB HIS A 160 76.951 -24.053 -4.580 1.00 0.00 C ATOM 1155 CG HIS A 160 75.671 -23.829 -5.338 1.00 0.00 C ATOM 1156 ND1 HIS A 160 74.886 -22.714 -5.495 1.00 0.00 N flip ATOM 1157 CD2 HIS A 160 75.058 -24.831 -6.075 1.00 0.00 C flip ATOM 1158 CE1 HIS A 160 73.803 -23.016 -6.316 1.00 0.00 C flip ATOM 1159 NE2 HIS A 160 73.956 -24.303 -6.638 1.00 0.00 N flip ATOM 0 H HIS A 160 78.900 -23.242 -3.456 1.00 0.00 H new ATOM 0 HA HIS A 160 78.507 -24.365 -6.071 1.00 0.00 H new ATOM 0 HB2 HIS A 160 77.065 -25.111 -4.344 1.00 0.00 H new ATOM 0 HB3 HIS A 160 76.922 -23.516 -3.632 1.00 0.00 H new ATOM 0 HD2 HIS A 160 75.402 -25.849 -6.178 1.00 0.00 H new ATOM 0 HE1 HIS A 160 73.010 -22.352 -6.626 1.00 0.00 H new ATOM 0 HE2 HIS A 160 73.315 -24.823 -7.238 1.00 0.00 H new ATOM 1167 N LEU A 161 77.634 -21.220 -5.748 1.00 0.00 N ATOM 1168 CA LEU A 161 77.241 -20.044 -6.558 1.00 0.00 C ATOM 1169 C LEU A 161 78.323 -19.696 -7.571 1.00 0.00 C ATOM 1170 O LEU A 161 78.059 -19.652 -8.756 1.00 0.00 O ATOM 1171 CB LEU A 161 77.028 -18.929 -5.553 1.00 0.00 C ATOM 1172 CG LEU A 161 75.545 -18.879 -5.222 1.00 0.00 C ATOM 1173 CD1 LEU A 161 75.301 -19.610 -3.907 1.00 0.00 C ATOM 1174 CD2 LEU A 161 75.092 -17.426 -5.111 1.00 0.00 C ATOM 0 H LEU A 161 77.803 -21.030 -4.760 1.00 0.00 H new ATOM 0 HA LEU A 161 76.341 -20.227 -7.145 1.00 0.00 H new ATOM 0 HB2 LEU A 161 77.615 -19.109 -4.652 1.00 0.00 H new ATOM 0 HB3 LEU A 161 77.360 -17.976 -5.964 1.00 0.00 H new ATOM 0 HG LEU A 161 74.973 -19.364 -6.013 1.00 0.00 H new ATOM 0 HD11 LEU A 161 74.239 -19.577 -3.664 1.00 0.00 H new ATOM 0 HD12 LEU A 161 75.620 -20.648 -4.003 1.00 0.00 H new ATOM 0 HD13 LEU A 161 75.870 -19.128 -3.112 1.00 0.00 H new ATOM 0 HD21 LEU A 161 74.029 -17.394 -4.874 1.00 0.00 H new ATOM 0 HD22 LEU A 161 75.655 -16.929 -4.322 1.00 0.00 H new ATOM 0 HD23 LEU A 161 75.268 -16.917 -6.058 1.00 0.00 H new ATOM 1186 N VAL A 162 79.541 -19.470 -7.148 1.00 0.00 N ATOM 1187 CA VAL A 162 80.595 -19.165 -8.158 1.00 0.00 C ATOM 1188 C VAL A 162 80.468 -20.198 -9.274 1.00 0.00 C ATOM 1189 O VAL A 162 80.477 -19.888 -10.455 1.00 0.00 O ATOM 1190 CB VAL A 162 81.931 -19.312 -7.435 1.00 0.00 C ATOM 1191 CG1 VAL A 162 83.058 -18.942 -8.395 1.00 0.00 C ATOM 1192 CG2 VAL A 162 81.974 -18.365 -6.242 1.00 0.00 C ATOM 0 H VAL A 162 79.845 -19.483 -6.174 1.00 0.00 H new ATOM 0 HA VAL A 162 80.508 -18.167 -8.587 1.00 0.00 H new ATOM 0 HB VAL A 162 82.047 -20.340 -7.092 1.00 0.00 H new ATOM 0 HG11 VAL A 162 84.017 -19.044 -7.887 1.00 0.00 H new ATOM 0 HG12 VAL A 162 83.033 -19.606 -9.259 1.00 0.00 H new ATOM 0 HG13 VAL A 162 82.931 -17.911 -8.726 1.00 0.00 H new ATOM 0 HG21 VAL A 162 82.929 -18.472 -5.727 1.00 0.00 H new ATOM 0 HG22 VAL A 162 81.861 -17.338 -6.589 1.00 0.00 H new ATOM 0 HG23 VAL A 162 81.163 -18.607 -5.556 1.00 0.00 H new ATOM 1202 N GLY A 163 80.298 -21.429 -8.887 1.00 0.00 N ATOM 1203 CA GLY A 163 80.114 -22.511 -9.891 1.00 0.00 C ATOM 1204 C GLY A 163 78.786 -22.275 -10.620 1.00 0.00 C ATOM 1205 O GLY A 163 78.675 -22.489 -11.810 1.00 0.00 O ATOM 0 H GLY A 163 80.278 -21.734 -7.914 1.00 0.00 H new ATOM 0 HA2 GLY A 163 80.941 -22.514 -10.601 1.00 0.00 H new ATOM 0 HA3 GLY A 163 80.110 -23.485 -9.402 1.00 0.00 H new ATOM 1209 N ALA A 164 77.780 -21.818 -9.912 1.00 0.00 N ATOM 1210 CA ALA A 164 76.469 -21.549 -10.559 1.00 0.00 C ATOM 1211 C ALA A 164 76.647 -20.462 -11.614 1.00 0.00 C ATOM 1212 O ALA A 164 75.962 -20.427 -12.616 1.00 0.00 O ATOM 1213 CB ALA A 164 75.560 -21.065 -9.423 1.00 0.00 C ATOM 0 H ALA A 164 77.817 -21.621 -8.912 1.00 0.00 H new ATOM 0 HA ALA A 164 76.051 -22.423 -11.059 1.00 0.00 H new ATOM 0 HB1 ALA A 164 74.569 -20.844 -9.819 1.00 0.00 H new ATOM 0 HB2 ALA A 164 75.482 -21.842 -8.663 1.00 0.00 H new ATOM 0 HB3 ALA A 164 75.982 -20.164 -8.978 1.00 0.00 H new ATOM 1219 N LEU A 165 77.579 -19.578 -11.391 1.00 0.00 N ATOM 1220 CA LEU A 165 77.827 -18.493 -12.373 1.00 0.00 C ATOM 1221 C LEU A 165 78.416 -19.094 -13.644 1.00 0.00 C ATOM 1222 O LEU A 165 78.123 -18.673 -14.746 1.00 0.00 O ATOM 1223 CB LEU A 165 78.856 -17.572 -11.708 1.00 0.00 C ATOM 1224 CG LEU A 165 78.418 -17.156 -10.296 1.00 0.00 C ATOM 1225 CD1 LEU A 165 78.799 -15.697 -10.067 1.00 0.00 C ATOM 1226 CD2 LEU A 165 76.909 -17.287 -10.127 1.00 0.00 C ATOM 0 H LEU A 165 78.180 -19.563 -10.567 1.00 0.00 H new ATOM 0 HA LEU A 165 76.916 -17.957 -12.641 1.00 0.00 H new ATOM 0 HB2 LEU A 165 79.819 -18.080 -11.655 1.00 0.00 H new ATOM 0 HB3 LEU A 165 78.998 -16.682 -12.322 1.00 0.00 H new ATOM 0 HG LEU A 165 78.914 -17.810 -9.578 1.00 0.00 H new ATOM 0 HD11 LEU A 165 78.491 -15.393 -9.066 1.00 0.00 H new ATOM 0 HD12 LEU A 165 79.879 -15.583 -10.165 1.00 0.00 H new ATOM 0 HD13 LEU A 165 78.300 -15.070 -10.806 1.00 0.00 H new ATOM 0 HD21 LEU A 165 76.628 -16.986 -9.118 1.00 0.00 H new ATOM 0 HD22 LEU A 165 76.405 -16.646 -10.850 1.00 0.00 H new ATOM 0 HD23 LEU A 165 76.613 -18.323 -10.292 1.00 0.00 H new ATOM 1238 N ARG A 166 79.256 -20.077 -13.489 1.00 0.00 N ATOM 1239 CA ARG A 166 79.886 -20.720 -14.678 1.00 0.00 C ATOM 1240 C ARG A 166 78.809 -21.265 -15.619 1.00 0.00 C ATOM 1241 O ARG A 166 78.934 -21.203 -16.827 1.00 0.00 O ATOM 1242 CB ARG A 166 80.743 -21.868 -14.127 1.00 0.00 C ATOM 1243 CG ARG A 166 81.563 -21.386 -12.930 1.00 0.00 C ATOM 1244 CD ARG A 166 82.708 -22.369 -12.670 1.00 0.00 C ATOM 1245 NE ARG A 166 83.946 -21.582 -12.917 1.00 0.00 N ATOM 1246 CZ ARG A 166 84.998 -22.161 -13.432 1.00 0.00 C ATOM 1247 NH1 ARG A 166 85.439 -21.787 -14.602 1.00 0.00 N ATOM 1248 NH2 ARG A 166 85.610 -23.112 -12.779 1.00 0.00 N ATOM 0 H ARG A 166 79.535 -20.465 -12.588 1.00 0.00 H new ATOM 0 HA ARG A 166 80.485 -20.010 -15.249 1.00 0.00 H new ATOM 0 HB2 ARG A 166 80.103 -22.698 -13.828 1.00 0.00 H new ATOM 0 HB3 ARG A 166 81.408 -22.242 -14.906 1.00 0.00 H new ATOM 0 HG2 ARG A 166 81.961 -20.390 -13.125 1.00 0.00 H new ATOM 0 HG3 ARG A 166 80.928 -21.308 -12.047 1.00 0.00 H new ATOM 0 HD2 ARG A 166 82.678 -22.750 -11.649 1.00 0.00 H new ATOM 0 HD3 ARG A 166 82.648 -23.231 -13.334 1.00 0.00 H new ATOM 0 HE ARG A 166 83.974 -20.589 -12.684 1.00 0.00 H new ATOM 0 HH11 ARG A 166 84.963 -21.044 -15.113 1.00 0.00 H new ATOM 0 HH12 ARG A 166 86.260 -22.238 -15.006 1.00 0.00 H new ATOM 0 HH21 ARG A 166 85.267 -23.405 -11.864 1.00 0.00 H new ATOM 0 HH22 ARG A 166 86.431 -23.562 -13.184 1.00 0.00 H new ATOM 1262 N SER A 167 77.755 -21.808 -15.075 1.00 0.00 N ATOM 1263 CA SER A 167 76.674 -22.369 -15.932 1.00 0.00 C ATOM 1264 C SER A 167 75.853 -21.251 -16.579 1.00 0.00 C ATOM 1265 O SER A 167 75.304 -21.414 -17.651 1.00 0.00 O ATOM 1266 CB SER A 167 75.802 -23.186 -14.982 1.00 0.00 C ATOM 1267 OG SER A 167 74.561 -23.473 -15.614 1.00 0.00 O ATOM 0 H SER A 167 77.596 -21.887 -14.071 1.00 0.00 H new ATOM 0 HA SER A 167 77.076 -22.971 -16.747 1.00 0.00 H new ATOM 0 HB2 SER A 167 76.308 -24.113 -14.711 1.00 0.00 H new ATOM 0 HB3 SER A 167 75.634 -22.633 -14.058 1.00 0.00 H new ATOM 0 HG SER A 167 73.999 -23.999 -15.007 1.00 0.00 H new ATOM 1273 N CYS A 168 75.753 -20.122 -15.932 1.00 0.00 N ATOM 1274 CA CYS A 168 74.956 -19.005 -16.506 1.00 0.00 C ATOM 1275 C CYS A 168 75.799 -18.172 -17.479 1.00 0.00 C ATOM 1276 O CYS A 168 75.447 -17.063 -17.828 1.00 0.00 O ATOM 1277 CB CYS A 168 74.532 -18.165 -15.304 1.00 0.00 C ATOM 1278 SG CYS A 168 72.754 -18.352 -15.043 1.00 0.00 S ATOM 0 H CYS A 168 76.189 -19.926 -15.031 1.00 0.00 H new ATOM 0 HA CYS A 168 74.101 -19.368 -17.076 1.00 0.00 H new ATOM 0 HB2 CYS A 168 75.077 -18.481 -14.414 1.00 0.00 H new ATOM 0 HB3 CYS A 168 74.778 -17.117 -15.473 1.00 0.00 H new ATOM 0 HG CYS A 168 72.466 -18.077 -13.805 1.00 0.00 H new ATOM 1284 N GLN A 169 76.902 -18.701 -17.924 1.00 0.00 N ATOM 1285 CA GLN A 169 77.764 -17.948 -18.882 1.00 0.00 C ATOM 1286 C GLN A 169 78.073 -16.555 -18.350 1.00 0.00 C ATOM 1287 O GLN A 169 78.348 -15.633 -19.093 1.00 0.00 O ATOM 1288 CB GLN A 169 76.944 -17.857 -20.161 1.00 0.00 C ATOM 1289 CG GLN A 169 76.803 -19.248 -20.783 1.00 0.00 C ATOM 1290 CD GLN A 169 75.328 -19.539 -21.062 1.00 0.00 C ATOM 1291 OE1 GLN A 169 74.619 -20.025 -20.203 1.00 0.00 O ATOM 1292 NE2 GLN A 169 74.831 -19.259 -22.235 1.00 0.00 N ATOM 0 H GLN A 169 77.247 -19.626 -17.666 1.00 0.00 H new ATOM 0 HA GLN A 169 78.723 -18.441 -19.040 1.00 0.00 H new ATOM 0 HB2 GLN A 169 75.959 -17.443 -19.944 1.00 0.00 H new ATOM 0 HB3 GLN A 169 77.426 -17.180 -20.866 1.00 0.00 H new ATOM 0 HG2 GLN A 169 77.376 -19.303 -21.708 1.00 0.00 H new ATOM 0 HG3 GLN A 169 77.212 -20.001 -20.110 1.00 0.00 H new ATOM 0 HE21 GLN A 169 75.425 -18.851 -22.957 1.00 0.00 H new ATOM 0 HE22 GLN A 169 73.848 -19.448 -22.431 1.00 0.00 H new ATOM 1301 N MET A 170 78.050 -16.409 -17.069 1.00 0.00 N ATOM 1302 CA MET A 170 78.360 -15.086 -16.458 1.00 0.00 C ATOM 1303 C MET A 170 79.695 -15.177 -15.714 1.00 0.00 C ATOM 1304 O MET A 170 79.783 -14.927 -14.528 1.00 0.00 O ATOM 1305 CB MET A 170 77.205 -14.796 -15.497 1.00 0.00 C ATOM 1306 CG MET A 170 77.119 -15.894 -14.436 1.00 0.00 C ATOM 1307 SD MET A 170 76.553 -15.183 -12.866 1.00 0.00 S ATOM 1308 CE MET A 170 75.129 -14.259 -13.501 1.00 0.00 C ATOM 0 H MET A 170 77.829 -17.151 -16.405 1.00 0.00 H new ATOM 0 HA MET A 170 78.455 -14.290 -17.197 1.00 0.00 H new ATOM 0 HB2 MET A 170 77.353 -13.828 -15.019 1.00 0.00 H new ATOM 0 HB3 MET A 170 76.267 -14.738 -16.049 1.00 0.00 H new ATOM 0 HG2 MET A 170 76.432 -16.675 -14.762 1.00 0.00 H new ATOM 0 HG3 MET A 170 78.094 -16.363 -14.304 1.00 0.00 H new ATOM 0 HE1 MET A 170 74.742 -13.604 -12.720 1.00 0.00 H new ATOM 0 HE2 MET A 170 75.437 -13.659 -14.358 1.00 0.00 H new ATOM 0 HE3 MET A 170 74.350 -14.957 -13.808 1.00 0.00 H new ATOM 1318 N ASN A 171 80.731 -15.554 -16.415 1.00 0.00 N ATOM 1319 CA ASN A 171 82.072 -15.693 -15.780 1.00 0.00 C ATOM 1320 C ASN A 171 82.469 -14.416 -15.038 1.00 0.00 C ATOM 1321 O ASN A 171 83.057 -14.471 -13.978 1.00 0.00 O ATOM 1322 CB ASN A 171 83.032 -15.958 -16.942 1.00 0.00 C ATOM 1323 CG ASN A 171 83.248 -17.464 -17.092 1.00 0.00 C ATOM 1324 OD1 ASN A 171 84.275 -17.983 -16.705 1.00 0.00 O ATOM 1325 ND2 ASN A 171 82.316 -18.193 -17.644 1.00 0.00 N ATOM 0 H ASN A 171 80.704 -15.774 -17.411 1.00 0.00 H new ATOM 0 HA ASN A 171 82.086 -16.492 -15.039 1.00 0.00 H new ATOM 0 HB2 ASN A 171 82.625 -15.545 -17.865 1.00 0.00 H new ATOM 0 HB3 ASN A 171 83.984 -15.459 -16.762 1.00 0.00 H new ATOM 0 HD21 ASN A 171 82.451 -19.198 -17.750 1.00 0.00 H new ATOM 0 HD22 ASN A 171 81.453 -17.757 -17.969 1.00 0.00 H new ATOM 1332 N LEU A 172 82.155 -13.270 -15.575 1.00 0.00 N ATOM 1333 CA LEU A 172 82.524 -12.006 -14.875 1.00 0.00 C ATOM 1334 C LEU A 172 82.054 -12.092 -13.429 1.00 0.00 C ATOM 1335 O LEU A 172 82.811 -11.885 -12.494 1.00 0.00 O ATOM 1336 CB LEU A 172 81.789 -10.899 -15.629 1.00 0.00 C ATOM 1337 CG LEU A 172 82.700 -10.338 -16.723 1.00 0.00 C ATOM 1338 CD1 LEU A 172 83.110 -11.460 -17.680 1.00 0.00 C ATOM 1339 CD2 LEU A 172 81.948 -9.258 -17.502 1.00 0.00 C ATOM 0 H LEU A 172 81.663 -13.153 -16.461 1.00 0.00 H new ATOM 0 HA LEU A 172 83.598 -11.820 -14.861 1.00 0.00 H new ATOM 0 HB2 LEU A 172 80.872 -11.291 -16.069 1.00 0.00 H new ATOM 0 HB3 LEU A 172 81.498 -10.106 -14.940 1.00 0.00 H new ATOM 0 HG LEU A 172 83.592 -9.910 -16.266 1.00 0.00 H new ATOM 0 HD11 LEU A 172 83.759 -11.056 -18.457 1.00 0.00 H new ATOM 0 HD12 LEU A 172 83.644 -12.233 -17.127 1.00 0.00 H new ATOM 0 HD13 LEU A 172 82.220 -11.891 -18.138 1.00 0.00 H new ATOM 0 HD21 LEU A 172 82.594 -8.856 -18.282 1.00 0.00 H new ATOM 0 HD22 LEU A 172 81.057 -9.691 -17.956 1.00 0.00 H new ATOM 0 HD23 LEU A 172 81.657 -8.456 -16.823 1.00 0.00 H new ATOM 1351 N VAL A 173 80.818 -12.437 -13.239 1.00 0.00 N ATOM 1352 CA VAL A 173 80.305 -12.580 -11.853 1.00 0.00 C ATOM 1353 C VAL A 173 81.057 -13.723 -11.191 1.00 0.00 C ATOM 1354 O VAL A 173 81.770 -13.553 -10.227 1.00 0.00 O ATOM 1355 CB VAL A 173 78.826 -12.942 -11.978 1.00 0.00 C ATOM 1356 CG1 VAL A 173 78.144 -12.765 -10.622 1.00 0.00 C ATOM 1357 CG2 VAL A 173 78.159 -12.040 -13.009 1.00 0.00 C ATOM 0 H VAL A 173 80.142 -12.626 -13.979 1.00 0.00 H new ATOM 0 HA VAL A 173 80.435 -11.672 -11.264 1.00 0.00 H new ATOM 0 HB VAL A 173 78.734 -13.980 -12.299 1.00 0.00 H new ATOM 0 HG11 VAL A 173 77.089 -13.023 -10.709 1.00 0.00 H new ATOM 0 HG12 VAL A 173 78.618 -13.418 -9.889 1.00 0.00 H new ATOM 0 HG13 VAL A 173 78.239 -11.728 -10.300 1.00 0.00 H new ATOM 0 HG21 VAL A 173 77.105 -12.302 -13.094 1.00 0.00 H new ATOM 0 HG22 VAL A 173 78.250 -11.000 -12.696 1.00 0.00 H new ATOM 0 HG23 VAL A 173 78.645 -12.171 -13.976 1.00 0.00 H new ATOM 1367 N ALA A 174 80.927 -14.894 -11.729 1.00 0.00 N ATOM 1368 CA ALA A 174 81.660 -16.050 -11.141 1.00 0.00 C ATOM 1369 C ALA A 174 83.074 -15.595 -10.776 1.00 0.00 C ATOM 1370 O ALA A 174 83.662 -16.054 -9.822 1.00 0.00 O ATOM 1371 CB ALA A 174 81.712 -17.099 -12.252 1.00 0.00 C ATOM 0 H ALA A 174 80.351 -15.106 -12.544 1.00 0.00 H new ATOM 0 HA ALA A 174 81.185 -16.444 -10.242 1.00 0.00 H new ATOM 0 HB1 ALA A 174 82.239 -17.983 -11.893 1.00 0.00 H new ATOM 0 HB2 ALA A 174 80.697 -17.373 -12.541 1.00 0.00 H new ATOM 0 HB3 ALA A 174 82.237 -16.689 -13.115 1.00 0.00 H new ATOM 1377 N ASP A 175 83.607 -14.677 -11.540 1.00 0.00 N ATOM 1378 CA ASP A 175 84.975 -14.158 -11.270 1.00 0.00 C ATOM 1379 C ASP A 175 85.057 -13.502 -9.892 1.00 0.00 C ATOM 1380 O ASP A 175 85.943 -13.797 -9.112 1.00 0.00 O ATOM 1381 CB ASP A 175 85.230 -13.122 -12.367 1.00 0.00 C ATOM 1382 CG ASP A 175 86.721 -13.086 -12.703 1.00 0.00 C ATOM 1383 OD1 ASP A 175 87.404 -14.042 -12.375 1.00 0.00 O ATOM 1384 OD2 ASP A 175 87.153 -12.102 -13.280 1.00 0.00 O ATOM 0 H ASP A 175 83.144 -14.262 -12.349 1.00 0.00 H new ATOM 0 HA ASP A 175 85.714 -14.959 -11.273 1.00 0.00 H new ATOM 0 HB2 ASP A 175 84.652 -13.371 -13.257 1.00 0.00 H new ATOM 0 HB3 ASP A 175 84.898 -12.138 -12.036 1.00 0.00 H new ATOM 1389 N LEU A 176 84.160 -12.604 -9.577 1.00 0.00 N ATOM 1390 CA LEU A 176 84.236 -11.945 -8.255 1.00 0.00 C ATOM 1391 C LEU A 176 83.928 -12.943 -7.140 1.00 0.00 C ATOM 1392 O LEU A 176 84.488 -12.885 -6.050 1.00 0.00 O ATOM 1393 CB LEU A 176 83.221 -10.789 -8.339 1.00 0.00 C ATOM 1394 CG LEU A 176 81.827 -11.229 -7.896 1.00 0.00 C ATOM 1395 CD1 LEU A 176 81.128 -10.055 -7.239 1.00 0.00 C ATOM 1396 CD2 LEU A 176 81.010 -11.636 -9.114 1.00 0.00 C ATOM 0 H LEU A 176 83.389 -12.306 -10.175 1.00 0.00 H new ATOM 0 HA LEU A 176 85.230 -11.565 -8.017 1.00 0.00 H new ATOM 0 HB2 LEU A 176 83.558 -9.963 -7.713 1.00 0.00 H new ATOM 0 HB3 LEU A 176 83.177 -10.417 -9.362 1.00 0.00 H new ATOM 0 HG LEU A 176 81.917 -12.066 -7.204 1.00 0.00 H new ATOM 0 HD11 LEU A 176 80.131 -10.358 -6.919 1.00 0.00 H new ATOM 0 HD12 LEU A 176 81.703 -9.727 -6.373 1.00 0.00 H new ATOM 0 HD13 LEU A 176 81.046 -9.235 -7.952 1.00 0.00 H new ATOM 0 HD21 LEU A 176 80.016 -11.950 -8.797 1.00 0.00 H new ATOM 0 HD22 LEU A 176 80.923 -10.788 -9.794 1.00 0.00 H new ATOM 0 HD23 LEU A 176 81.505 -12.462 -9.625 1.00 0.00 H new ATOM 1408 N VAL A 177 83.087 -13.895 -7.397 1.00 0.00 N ATOM 1409 CA VAL A 177 82.813 -14.874 -6.350 1.00 0.00 C ATOM 1410 C VAL A 177 83.937 -15.904 -6.390 1.00 0.00 C ATOM 1411 O VAL A 177 84.317 -16.451 -5.386 1.00 0.00 O ATOM 1412 CB VAL A 177 81.429 -15.458 -6.640 1.00 0.00 C ATOM 1413 CG1 VAL A 177 80.652 -15.574 -5.316 1.00 0.00 C ATOM 1414 CG2 VAL A 177 80.658 -14.538 -7.584 1.00 0.00 C ATOM 0 H VAL A 177 82.589 -14.029 -8.277 1.00 0.00 H new ATOM 0 HA VAL A 177 82.791 -14.457 -5.343 1.00 0.00 H new ATOM 0 HB VAL A 177 81.542 -16.437 -7.105 1.00 0.00 H new ATOM 0 HG11 VAL A 177 79.663 -15.989 -5.510 1.00 0.00 H new ATOM 0 HG12 VAL A 177 81.193 -16.229 -4.633 1.00 0.00 H new ATOM 0 HG13 VAL A 177 80.549 -14.586 -4.867 1.00 0.00 H new ATOM 0 HG21 VAL A 177 79.674 -14.963 -7.784 1.00 0.00 H new ATOM 0 HG22 VAL A 177 80.542 -13.557 -7.122 1.00 0.00 H new ATOM 0 HG23 VAL A 177 81.206 -14.436 -8.521 1.00 0.00 H new ATOM 1424 N GLN A 178 84.535 -16.139 -7.529 1.00 0.00 N ATOM 1425 CA GLN A 178 85.677 -17.083 -7.534 1.00 0.00 C ATOM 1426 C GLN A 178 86.657 -16.579 -6.483 1.00 0.00 C ATOM 1427 O GLN A 178 87.235 -17.340 -5.730 1.00 0.00 O ATOM 1428 CB GLN A 178 86.282 -17.029 -8.935 1.00 0.00 C ATOM 1429 CG GLN A 178 86.210 -18.428 -9.538 1.00 0.00 C ATOM 1430 CD GLN A 178 85.596 -18.362 -10.934 1.00 0.00 C ATOM 1431 OE1 GLN A 178 84.340 -18.040 -11.056 1.00 0.00 O flip ATOM 1432 NE2 GLN A 178 86.263 -18.604 -11.921 1.00 0.00 N flip ATOM 0 H GLN A 178 84.287 -15.729 -8.429 1.00 0.00 H new ATOM 0 HA GLN A 178 85.401 -18.112 -7.304 1.00 0.00 H new ATOM 0 HB2 GLN A 178 85.738 -16.318 -9.557 1.00 0.00 H new ATOM 0 HB3 GLN A 178 87.316 -16.687 -8.890 1.00 0.00 H new ATOM 0 HG2 GLN A 178 87.208 -18.862 -9.591 1.00 0.00 H new ATOM 0 HG3 GLN A 178 85.613 -19.078 -8.899 1.00 0.00 H new ATOM 0 HE21 GLN A 178 87.246 -18.856 -11.823 1.00 0.00 H new ATOM 0 HE22 GLN A 178 85.839 -18.555 -12.847 1.00 0.00 H new ATOM 1441 N GLU A 179 86.786 -15.279 -6.378 1.00 0.00 N ATOM 1442 CA GLU A 179 87.655 -14.718 -5.323 1.00 0.00 C ATOM 1443 C GLU A 179 87.062 -15.160 -3.991 1.00 0.00 C ATOM 1444 O GLU A 179 87.759 -15.497 -3.060 1.00 0.00 O ATOM 1445 CB GLU A 179 87.562 -13.202 -5.477 1.00 0.00 C ATOM 1446 CG GLU A 179 88.898 -12.658 -5.977 1.00 0.00 C ATOM 1447 CD GLU A 179 89.327 -11.484 -5.098 1.00 0.00 C ATOM 1448 OE1 GLU A 179 89.726 -11.727 -3.971 1.00 0.00 O ATOM 1449 OE2 GLU A 179 89.246 -10.360 -5.566 1.00 0.00 O ATOM 0 H GLU A 179 86.326 -14.594 -6.978 1.00 0.00 H new ATOM 0 HA GLU A 179 88.694 -15.041 -5.382 1.00 0.00 H new ATOM 0 HB2 GLU A 179 86.768 -12.945 -6.178 1.00 0.00 H new ATOM 0 HB3 GLU A 179 87.305 -12.744 -4.522 1.00 0.00 H new ATOM 0 HG2 GLU A 179 89.655 -13.442 -5.952 1.00 0.00 H new ATOM 0 HG3 GLU A 179 88.807 -12.336 -7.014 1.00 0.00 H new ATOM 1456 N VAL A 180 85.756 -15.187 -3.927 1.00 0.00 N ATOM 1457 CA VAL A 180 85.057 -15.640 -2.685 1.00 0.00 C ATOM 1458 C VAL A 180 85.673 -16.936 -2.188 1.00 0.00 C ATOM 1459 O VAL A 180 86.062 -17.067 -1.045 1.00 0.00 O ATOM 1460 CB VAL A 180 83.595 -15.850 -3.136 1.00 0.00 C ATOM 1461 CG1 VAL A 180 83.217 -17.343 -3.306 1.00 0.00 C ATOM 1462 CG2 VAL A 180 82.661 -15.212 -2.122 1.00 0.00 C ATOM 0 H VAL A 180 85.137 -14.912 -4.690 1.00 0.00 H new ATOM 0 HA VAL A 180 85.133 -14.929 -1.862 1.00 0.00 H new ATOM 0 HB VAL A 180 83.494 -15.381 -4.115 1.00 0.00 H new ATOM 0 HG11 VAL A 180 82.177 -17.421 -3.624 1.00 0.00 H new ATOM 0 HG12 VAL A 180 83.862 -17.798 -4.058 1.00 0.00 H new ATOM 0 HG13 VAL A 180 83.346 -17.861 -2.356 1.00 0.00 H new ATOM 0 HG21 VAL A 180 81.628 -15.358 -2.437 1.00 0.00 H new ATOM 0 HG22 VAL A 180 82.812 -15.675 -1.147 1.00 0.00 H new ATOM 0 HG23 VAL A 180 82.872 -14.145 -2.054 1.00 0.00 H new ATOM 1472 N GLN A 181 85.743 -17.891 -3.048 1.00 0.00 N ATOM 1473 CA GLN A 181 86.314 -19.206 -2.658 1.00 0.00 C ATOM 1474 C GLN A 181 87.783 -19.065 -2.255 1.00 0.00 C ATOM 1475 O GLN A 181 88.273 -19.782 -1.406 1.00 0.00 O ATOM 1476 CB GLN A 181 86.173 -20.087 -3.898 1.00 0.00 C ATOM 1477 CG GLN A 181 86.817 -21.450 -3.635 1.00 0.00 C ATOM 1478 CD GLN A 181 86.245 -22.051 -2.346 1.00 0.00 C ATOM 1479 OE1 GLN A 181 85.126 -22.721 -2.393 1.00 0.00 O flip ATOM 1480 NE2 GLN A 181 86.825 -21.909 -1.286 1.00 0.00 N flip ATOM 0 H GLN A 181 85.428 -17.825 -4.016 1.00 0.00 H new ATOM 0 HA GLN A 181 85.800 -19.632 -1.796 1.00 0.00 H new ATOM 0 HB2 GLN A 181 85.120 -20.213 -4.149 1.00 0.00 H new ATOM 0 HB3 GLN A 181 86.649 -19.607 -4.753 1.00 0.00 H new ATOM 0 HG2 GLN A 181 86.630 -22.120 -4.474 1.00 0.00 H new ATOM 0 HG3 GLN A 181 87.898 -21.342 -3.549 1.00 0.00 H new ATOM 0 HE21 GLN A 181 87.700 -21.385 -1.249 1.00 0.00 H new ATOM 0 HE22 GLN A 181 86.437 -22.314 -0.434 1.00 0.00 H new ATOM 1489 N GLN A 182 88.493 -18.162 -2.862 1.00 0.00 N ATOM 1490 CA GLN A 182 89.932 -17.995 -2.515 1.00 0.00 C ATOM 1491 C GLN A 182 90.129 -16.955 -1.402 1.00 0.00 C ATOM 1492 O GLN A 182 91.065 -17.034 -0.633 1.00 0.00 O ATOM 1493 CB GLN A 182 90.601 -17.536 -3.809 1.00 0.00 C ATOM 1494 CG GLN A 182 90.958 -18.762 -4.649 1.00 0.00 C ATOM 1495 CD GLN A 182 91.023 -18.372 -6.125 1.00 0.00 C ATOM 1496 OE1 GLN A 182 90.116 -17.747 -6.640 1.00 0.00 O ATOM 1497 NE2 GLN A 182 92.064 -18.713 -6.833 1.00 0.00 N ATOM 0 H GLN A 182 88.143 -17.531 -3.583 1.00 0.00 H new ATOM 0 HA GLN A 182 90.360 -18.922 -2.134 1.00 0.00 H new ATOM 0 HB2 GLN A 182 89.932 -16.880 -4.366 1.00 0.00 H new ATOM 0 HB3 GLN A 182 91.498 -16.960 -3.584 1.00 0.00 H new ATOM 0 HG2 GLN A 182 91.917 -19.169 -4.328 1.00 0.00 H new ATOM 0 HG3 GLN A 182 90.214 -19.545 -4.502 1.00 0.00 H new ATOM 0 HE21 GLN A 182 92.825 -19.237 -6.401 1.00 0.00 H new ATOM 0 HE22 GLN A 182 92.117 -18.455 -7.818 1.00 0.00 H new