USER MOD reduce.3.24.130724 H: found=0, std=0, add=677, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 702 hydrogens (24 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 164 LYS NZ :NH3+ 173:sc= 0.482 (180deg=0.445) USER MOD Set 1.2: A 198 TYR OH : rot 171:sc= -1.66! USER MOD Set 1.3: A 223 HIS : no HE2:sc= -0.544 K(o=-1.7,f=-3) USER MOD Set 2.1: A 163 ASN : amide:sc= -0.158 X(o=-0.7,f=-0.46) USER MOD Set 2.2: A 165 GLN : amide:sc= -0.538 X(o=-0.7,f=-0.46) USER MOD Single : A 151 SER OG : rot 29:sc= 0.199 USER MOD Single : A 153 GLN : amide:sc= 0 X(o=0,f=-0.41) USER MOD Single : A 154 LYS NZ :NH3+ -142:sc= -1.4 (180deg=-3.2!) USER MOD Single : A 167 THR OG1 : rot -140:sc= -1.36 USER MOD Single : A 173 CYS SG : rot 37:sc= 0.126 USER MOD Single : A 176 THR OG1 : rot -170:sc= -0.963 USER MOD Single : A 180 SER OG : rot -81:sc= 0.0315 USER MOD Single : A 182 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 183 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 186 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 187 MET CE :methyl -116:sc= -0.303 (180deg=-1.43!) USER MOD Single : A 194 CYS SG : rot -42:sc= -0.212 USER MOD Single : A 195 CYS SG : rot 98:sc= 0.696 USER MOD Single : A 201 GLN : amide:sc= -5.9! C(o=-5.9!,f=-5.3!) USER MOD Single : A 205 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 206 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 212 THR OG1 : rot -170:sc= 0 USER MOD Single : A 215 SER OG : rot -97:sc= 1.12 USER MOD Single : A 218 THR OG1 : rot 91:sc= 0.668 USER MOD Single : A 229 ASN : amide:sc= -1.34! K(o=-1.3!,f=-0.11) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 151 21.276 0.290 -4.320 1.00 5.02 N ATOM 2 CA SER A 151 21.630 0.447 -2.896 1.00 4.35 C ATOM 3 C SER A 151 21.731 -0.921 -2.226 1.00 3.18 C ATOM 4 O SER A 151 20.831 -1.750 -2.360 1.00 3.19 O ATOM 5 CB SER A 151 20.569 1.304 -2.206 1.00 5.00 C ATOM 6 OG SER A 151 20.363 2.517 -2.914 1.00 5.63 O ATOM 0 HA SER A 151 22.599 0.940 -2.813 1.00 4.35 H new ATOM 0 HB2 SER A 151 19.632 0.750 -2.143 1.00 5.00 H new ATOM 0 HB3 SER A 151 20.879 1.522 -1.184 1.00 5.00 H new ATOM 0 HG SER A 151 20.558 2.378 -3.864 1.00 5.63 H new ATOM 12 N PRO A 152 22.849 -1.180 -1.518 1.00 2.66 N ATOM 13 CA PRO A 152 23.090 -2.458 -0.833 1.00 2.06 C ATOM 14 C PRO A 152 22.055 -2.754 0.249 1.00 1.62 C ATOM 15 O PRO A 152 21.803 -3.912 0.576 1.00 1.74 O ATOM 16 CB PRO A 152 24.482 -2.282 -0.211 1.00 2.74 C ATOM 17 CG PRO A 152 24.692 -0.812 -0.151 1.00 3.37 C ATOM 18 CD PRO A 152 23.981 -0.254 -1.344 1.00 3.38 C ATOM 0 HA PRO A 152 23.021 -3.299 -1.523 1.00 2.06 H new ATOM 0 HB2 PRO A 152 24.530 -2.729 0.782 1.00 2.74 H new ATOM 0 HB3 PRO A 152 25.249 -2.766 -0.816 1.00 2.74 H new ATOM 0 HG2 PRO A 152 24.291 -0.396 0.774 1.00 3.37 H new ATOM 0 HG3 PRO A 152 25.754 -0.566 -0.177 1.00 3.37 H new ATOM 0 HD2 PRO A 152 23.644 0.768 -1.171 1.00 3.38 H new ATOM 0 HD3 PRO A 152 24.624 -0.233 -2.224 1.00 3.38 H new ATOM 26 N GLN A 153 21.463 -1.707 0.806 1.00 1.46 N ATOM 27 CA GLN A 153 20.394 -1.873 1.778 1.00 1.24 C ATOM 28 C GLN A 153 19.066 -2.029 1.055 1.00 0.99 C ATOM 29 O GLN A 153 18.815 -1.356 0.054 1.00 1.20 O ATOM 30 CB GLN A 153 20.329 -0.679 2.727 1.00 1.63 C ATOM 31 CG GLN A 153 19.379 -0.900 3.889 1.00 2.17 C ATOM 32 CD GLN A 153 19.174 0.345 4.726 1.00 2.74 C ATOM 33 OE1 GLN A 153 20.063 1.189 4.836 1.00 3.30 O ATOM 34 NE2 GLN A 153 18.007 0.467 5.333 1.00 3.28 N ATOM 0 H GLN A 153 21.704 -0.737 0.602 1.00 1.46 H new ATOM 0 HA GLN A 153 20.598 -2.767 2.367 1.00 1.24 H new ATOM 0 HB2 GLN A 153 21.327 -0.474 3.114 1.00 1.63 H new ATOM 0 HB3 GLN A 153 20.015 0.204 2.171 1.00 1.63 H new ATOM 0 HG2 GLN A 153 18.416 -1.237 3.506 1.00 2.17 H new ATOM 0 HG3 GLN A 153 19.767 -1.698 4.522 1.00 2.17 H new ATOM 0 HE21 GLN A 153 17.294 -0.254 5.218 1.00 3.28 H new ATOM 0 HE22 GLN A 153 17.819 1.282 5.917 1.00 3.28 H new ATOM 43 N LYS A 154 18.235 -2.933 1.544 1.00 0.80 N ATOM 44 CA LYS A 154 16.924 -3.159 0.960 1.00 0.67 C ATOM 45 C LYS A 154 15.921 -2.150 1.514 1.00 0.54 C ATOM 46 O LYS A 154 15.625 -2.156 2.709 1.00 0.62 O ATOM 47 CB LYS A 154 16.454 -4.587 1.255 1.00 0.87 C ATOM 48 CG LYS A 154 15.107 -4.938 0.638 1.00 0.98 C ATOM 49 CD LYS A 154 15.164 -4.997 -0.886 1.00 1.30 C ATOM 50 CE LYS A 154 15.748 -6.309 -1.401 1.00 1.78 C ATOM 51 NZ LYS A 154 17.205 -6.445 -1.134 1.00 2.33 N ATOM 0 H LYS A 154 18.446 -3.525 2.347 1.00 0.80 H new ATOM 0 HA LYS A 154 16.993 -3.029 -0.120 1.00 0.67 H new ATOM 0 HB2 LYS A 154 17.204 -5.288 0.888 1.00 0.87 H new ATOM 0 HB3 LYS A 154 16.393 -4.722 2.335 1.00 0.87 H new ATOM 0 HG2 LYS A 154 14.773 -5.901 1.024 1.00 0.98 H new ATOM 0 HG3 LYS A 154 14.367 -4.198 0.943 1.00 0.98 H new ATOM 0 HD2 LYS A 154 14.159 -4.868 -1.289 1.00 1.30 H new ATOM 0 HD3 LYS A 154 15.765 -4.166 -1.256 1.00 1.30 H new ATOM 0 HE2 LYS A 154 15.220 -7.142 -0.936 1.00 1.78 H new ATOM 0 HE3 LYS A 154 15.573 -6.381 -2.475 1.00 1.78 H new ATOM 0 HZ1 LYS A 154 17.665 -6.907 -1.944 1.00 2.33 H new ATOM 0 HZ2 LYS A 154 17.621 -5.503 -0.991 1.00 2.33 H new ATOM 0 HZ3 LYS A 154 17.349 -7.021 -0.280 1.00 2.33 H new ATOM 65 N PRO A 155 15.394 -1.261 0.661 1.00 0.42 N ATOM 66 CA PRO A 155 14.416 -0.254 1.078 1.00 0.38 C ATOM 67 C PRO A 155 13.010 -0.838 1.168 1.00 0.33 C ATOM 68 O PRO A 155 12.712 -1.851 0.534 1.00 0.33 O ATOM 69 CB PRO A 155 14.494 0.750 -0.060 1.00 0.40 C ATOM 70 CG PRO A 155 14.702 -0.116 -1.244 1.00 0.39 C ATOM 71 CD PRO A 155 15.694 -1.152 -0.787 1.00 0.43 C ATOM 0 HA PRO A 155 14.621 0.161 2.065 1.00 0.38 H new ATOM 0 HB2 PRO A 155 13.580 1.339 -0.144 1.00 0.40 H new ATOM 0 HB3 PRO A 155 15.315 1.454 0.076 1.00 0.40 H new ATOM 0 HG2 PRO A 155 13.768 -0.576 -1.567 1.00 0.39 H new ATOM 0 HG3 PRO A 155 15.086 0.454 -2.090 1.00 0.39 H new ATOM 0 HD2 PRO A 155 15.556 -2.102 -1.303 1.00 0.43 H new ATOM 0 HD3 PRO A 155 16.722 -0.838 -0.967 1.00 0.43 H new ATOM 79 N ILE A 156 12.141 -0.197 1.933 1.00 0.33 N ATOM 80 CA ILE A 156 10.781 -0.688 2.105 1.00 0.29 C ATOM 81 C ILE A 156 9.770 0.447 2.144 1.00 0.29 C ATOM 82 O ILE A 156 10.109 1.600 2.408 1.00 0.37 O ATOM 83 CB ILE A 156 10.625 -1.514 3.399 1.00 0.31 C ATOM 84 CG1 ILE A 156 11.185 -0.738 4.593 1.00 0.38 C ATOM 85 CG2 ILE A 156 11.296 -2.873 3.262 1.00 0.37 C ATOM 86 CD1 ILE A 156 10.943 -1.410 5.925 1.00 0.79 C ATOM 0 H ILE A 156 12.351 0.661 2.443 1.00 0.33 H new ATOM 0 HA ILE A 156 10.586 -1.323 1.241 1.00 0.29 H new ATOM 0 HB ILE A 156 9.563 -1.689 3.572 1.00 0.31 H new ATOM 0 HG12 ILE A 156 12.258 -0.602 4.455 1.00 0.38 H new ATOM 0 HG13 ILE A 156 10.737 0.256 4.611 1.00 0.38 H new ATOM 0 HG21 ILE A 156 11.172 -3.435 4.187 1.00 0.37 H new ATOM 0 HG22 ILE A 156 10.839 -3.423 2.439 1.00 0.37 H new ATOM 0 HG23 ILE A 156 12.358 -2.736 3.061 1.00 0.37 H new ATOM 0 HD11 ILE A 156 11.368 -0.801 6.722 1.00 0.79 H new ATOM 0 HD12 ILE A 156 9.871 -1.522 6.086 1.00 0.79 H new ATOM 0 HD13 ILE A 156 11.415 -2.392 5.928 1.00 0.79 H new ATOM 98 N VAL A 157 8.532 0.098 1.854 1.00 0.25 N ATOM 99 CA VAL A 157 7.403 0.979 2.043 1.00 0.27 C ATOM 100 C VAL A 157 6.258 0.189 2.677 1.00 0.21 C ATOM 101 O VAL A 157 5.912 -0.909 2.240 1.00 0.25 O ATOM 102 CB VAL A 157 6.973 1.684 0.733 1.00 0.38 C ATOM 103 CG1 VAL A 157 7.240 0.827 -0.494 1.00 1.05 C ATOM 104 CG2 VAL A 157 5.518 2.102 0.809 1.00 0.91 C ATOM 0 H VAL A 157 8.282 -0.816 1.476 1.00 0.25 H new ATOM 0 HA VAL A 157 7.697 1.784 2.717 1.00 0.27 H new ATOM 0 HB VAL A 157 7.584 2.580 0.626 1.00 0.38 H new ATOM 0 HG11 VAL A 157 6.922 1.363 -1.388 1.00 1.05 H new ATOM 0 HG12 VAL A 157 8.306 0.609 -0.561 1.00 1.05 H new ATOM 0 HG13 VAL A 157 6.683 -0.107 -0.414 1.00 1.05 H new ATOM 0 HG21 VAL A 157 5.232 2.596 -0.120 1.00 0.91 H new ATOM 0 HG22 VAL A 157 4.894 1.221 0.958 1.00 0.91 H new ATOM 0 HG23 VAL A 157 5.380 2.790 1.643 1.00 0.91 H new ATOM 114 N ARG A 158 5.708 0.753 3.736 1.00 0.21 N ATOM 115 CA ARG A 158 4.769 0.063 4.599 1.00 0.21 C ATOM 116 C ARG A 158 3.346 0.460 4.254 1.00 0.21 C ATOM 117 O ARG A 158 3.038 1.638 4.147 1.00 0.32 O ATOM 118 CB ARG A 158 5.078 0.423 6.049 1.00 0.26 C ATOM 119 CG ARG A 158 6.499 0.062 6.469 1.00 0.29 C ATOM 120 CD ARG A 158 7.008 0.953 7.590 1.00 0.49 C ATOM 121 NE ARG A 158 7.137 2.354 7.179 1.00 1.36 N ATOM 122 CZ ARG A 158 8.186 3.126 7.478 1.00 1.81 C ATOM 123 NH1 ARG A 158 9.219 2.623 8.145 1.00 1.70 N ATOM 124 NH2 ARG A 158 8.210 4.401 7.104 1.00 2.87 N ATOM 0 H ARG A 158 5.903 1.712 4.024 1.00 0.21 H new ATOM 0 HA ARG A 158 4.866 -1.013 4.458 1.00 0.21 H new ATOM 0 HB2 ARG A 158 4.925 1.493 6.191 1.00 0.26 H new ATOM 0 HB3 ARG A 158 4.372 -0.090 6.702 1.00 0.26 H new ATOM 0 HG2 ARG A 158 6.528 -0.979 6.792 1.00 0.29 H new ATOM 0 HG3 ARG A 158 7.163 0.147 5.609 1.00 0.29 H new ATOM 0 HD2 ARG A 158 6.327 0.888 8.439 1.00 0.49 H new ATOM 0 HD3 ARG A 158 7.977 0.587 7.929 1.00 0.49 H new ATOM 0 HE ARG A 158 6.380 2.764 6.632 1.00 1.36 H new ATOM 0 HH11 ARG A 158 9.214 1.644 8.431 1.00 1.70 H new ATOM 0 HH12 ARG A 158 10.018 3.216 8.371 1.00 1.70 H new ATOM 0 HH21 ARG A 158 7.425 4.795 6.586 1.00 2.87 H new ATOM 0 HH22 ARG A 158 9.013 4.985 7.335 1.00 2.87 H new ATOM 138 N VAL A 159 2.489 -0.524 4.077 1.00 0.20 N ATOM 139 CA VAL A 159 1.107 -0.270 3.676 1.00 0.21 C ATOM 140 C VAL A 159 0.124 -0.695 4.756 1.00 0.23 C ATOM 141 O VAL A 159 0.129 -1.836 5.184 1.00 0.36 O ATOM 142 CB VAL A 159 0.740 -1.035 2.393 1.00 0.28 C ATOM 143 CG1 VAL A 159 -0.555 -0.497 1.815 1.00 0.42 C ATOM 144 CG2 VAL A 159 1.864 -0.977 1.368 1.00 0.35 C ATOM 0 H VAL A 159 2.718 -1.510 4.203 1.00 0.20 H new ATOM 0 HA VAL A 159 1.038 0.804 3.506 1.00 0.21 H new ATOM 0 HB VAL A 159 0.595 -2.084 2.653 1.00 0.28 H new ATOM 0 HG11 VAL A 159 -0.804 -1.046 0.907 1.00 0.42 H new ATOM 0 HG12 VAL A 159 -1.357 -0.618 2.544 1.00 0.42 H new ATOM 0 HG13 VAL A 159 -0.436 0.560 1.578 1.00 0.42 H new ATOM 0 HG21 VAL A 159 1.570 -1.528 0.474 1.00 0.35 H new ATOM 0 HG22 VAL A 159 2.063 0.062 1.105 1.00 0.35 H new ATOM 0 HG23 VAL A 159 2.764 -1.423 1.790 1.00 0.35 H new ATOM 154 N PHE A 160 -0.737 0.207 5.174 1.00 0.22 N ATOM 155 CA PHE A 160 -1.779 -0.130 6.133 1.00 0.22 C ATOM 156 C PHE A 160 -2.915 -0.889 5.437 1.00 0.24 C ATOM 157 O PHE A 160 -3.712 -0.291 4.721 1.00 0.28 O ATOM 158 CB PHE A 160 -2.345 1.139 6.779 1.00 0.25 C ATOM 159 CG PHE A 160 -1.449 1.785 7.797 1.00 0.30 C ATOM 160 CD1 PHE A 160 -0.240 2.363 7.433 1.00 0.38 C ATOM 161 CD2 PHE A 160 -1.836 1.840 9.125 1.00 0.48 C ATOM 162 CE1 PHE A 160 0.559 2.978 8.375 1.00 0.46 C ATOM 163 CE2 PHE A 160 -1.036 2.450 10.071 1.00 0.58 C ATOM 164 CZ PHE A 160 0.161 3.020 9.693 1.00 0.51 C ATOM 0 H PHE A 160 -0.740 1.180 4.868 1.00 0.22 H new ATOM 0 HA PHE A 160 -1.338 -0.761 6.905 1.00 0.22 H new ATOM 0 HB2 PHE A 160 -2.560 1.864 5.994 1.00 0.25 H new ATOM 0 HB3 PHE A 160 -3.294 0.894 7.255 1.00 0.25 H new ATOM 0 HD1 PHE A 160 0.078 2.331 6.401 1.00 0.38 H new ATOM 0 HD2 PHE A 160 -2.776 1.400 9.425 1.00 0.48 H new ATOM 0 HE1 PHE A 160 1.496 3.426 8.079 1.00 0.46 H new ATOM 0 HE2 PHE A 160 -1.347 2.480 11.105 1.00 0.58 H new ATOM 0 HZ PHE A 160 0.787 3.500 10.431 1.00 0.51 H new ATOM 174 N LEU A 161 -2.963 -2.206 5.629 1.00 0.27 N ATOM 175 CA LEU A 161 -4.077 -3.040 5.156 1.00 0.33 C ATOM 176 C LEU A 161 -5.427 -2.484 5.617 1.00 0.33 C ATOM 177 O LEU A 161 -5.500 -1.675 6.547 1.00 0.37 O ATOM 178 CB LEU A 161 -3.995 -4.470 5.716 1.00 0.49 C ATOM 179 CG LEU A 161 -2.737 -5.298 5.422 1.00 0.72 C ATOM 180 CD1 LEU A 161 -2.405 -5.289 3.955 1.00 1.46 C ATOM 181 CD2 LEU A 161 -1.555 -4.830 6.221 1.00 0.98 C ATOM 0 H LEU A 161 -2.234 -2.728 6.115 1.00 0.27 H new ATOM 0 HA LEU A 161 -3.999 -3.041 4.069 1.00 0.33 H new ATOM 0 HB2 LEU A 161 -4.107 -4.409 6.799 1.00 0.49 H new ATOM 0 HB3 LEU A 161 -4.853 -5.025 5.337 1.00 0.49 H new ATOM 0 HG LEU A 161 -2.962 -6.321 5.722 1.00 0.72 H new ATOM 0 HD11 LEU A 161 -1.509 -5.885 3.781 1.00 1.46 H new ATOM 0 HD12 LEU A 161 -3.237 -5.712 3.391 1.00 1.46 H new ATOM 0 HD13 LEU A 161 -2.229 -4.264 3.628 1.00 1.46 H new ATOM 0 HD21 LEU A 161 -0.687 -5.444 5.981 1.00 0.98 H new ATOM 0 HD22 LEU A 161 -1.341 -3.789 5.978 1.00 0.98 H new ATOM 0 HD23 LEU A 161 -1.778 -4.916 7.285 1.00 0.98 H new ATOM 193 N PRO A 162 -6.512 -2.932 4.973 1.00 0.38 N ATOM 194 CA PRO A 162 -7.874 -2.722 5.471 1.00 0.43 C ATOM 195 C PRO A 162 -8.030 -3.189 6.919 1.00 0.42 C ATOM 196 O PRO A 162 -7.281 -4.053 7.385 1.00 0.40 O ATOM 197 CB PRO A 162 -8.726 -3.592 4.549 1.00 0.49 C ATOM 198 CG PRO A 162 -7.949 -3.676 3.285 1.00 0.50 C ATOM 199 CD PRO A 162 -6.498 -3.647 3.689 1.00 0.46 C ATOM 0 HA PRO A 162 -8.153 -1.668 5.468 1.00 0.43 H new ATOM 0 HB2 PRO A 162 -8.892 -4.580 4.978 1.00 0.49 H new ATOM 0 HB3 PRO A 162 -9.708 -3.149 4.382 1.00 0.49 H new ATOM 0 HG2 PRO A 162 -8.185 -4.591 2.742 1.00 0.50 H new ATOM 0 HG3 PRO A 162 -8.187 -2.843 2.624 1.00 0.50 H new ATOM 0 HD2 PRO A 162 -6.091 -4.653 3.794 1.00 0.46 H new ATOM 0 HD3 PRO A 162 -5.886 -3.131 2.949 1.00 0.46 H new ATOM 207 N ASN A 163 -8.994 -2.601 7.623 1.00 0.51 N ATOM 208 CA ASN A 163 -9.240 -2.901 9.037 1.00 0.54 C ATOM 209 C ASN A 163 -8.039 -2.464 9.885 1.00 0.48 C ATOM 210 O ASN A 163 -7.883 -2.863 11.041 1.00 0.53 O ATOM 211 CB ASN A 163 -9.564 -4.391 9.238 1.00 0.60 C ATOM 212 CG ASN A 163 -10.177 -4.691 10.598 1.00 1.26 C ATOM 213 OD1 ASN A 163 -9.478 -5.040 11.550 1.00 2.08 O ATOM 214 ND2 ASN A 163 -11.491 -4.559 10.699 1.00 1.86 N ATOM 0 H ASN A 163 -9.628 -1.903 7.233 1.00 0.51 H new ATOM 0 HA ASN A 163 -10.112 -2.336 9.368 1.00 0.54 H new ATOM 0 HB2 ASN A 163 -10.251 -4.716 8.457 1.00 0.60 H new ATOM 0 HB3 ASN A 163 -8.651 -4.974 9.121 1.00 0.60 H new ATOM 0 HD21 ASN A 163 -11.956 -4.749 11.587 1.00 1.86 H new ATOM 0 HD22 ASN A 163 -12.038 -4.268 9.889 1.00 1.86 H new ATOM 221 N LYS A 164 -7.193 -1.638 9.271 1.00 0.48 N ATOM 222 CA LYS A 164 -6.085 -0.962 9.946 1.00 0.52 C ATOM 223 C LYS A 164 -4.956 -1.910 10.360 1.00 0.44 C ATOM 224 O LYS A 164 -4.358 -1.729 11.423 1.00 0.52 O ATOM 225 CB LYS A 164 -6.576 -0.183 11.172 1.00 0.69 C ATOM 226 CG LYS A 164 -7.692 0.818 10.900 1.00 0.88 C ATOM 227 CD LYS A 164 -7.151 2.158 10.434 1.00 1.22 C ATOM 228 CE LYS A 164 -6.790 2.137 8.964 1.00 2.04 C ATOM 229 NZ LYS A 164 -7.998 2.191 8.095 1.00 2.74 N ATOM 0 H LYS A 164 -7.258 -1.416 8.278 1.00 0.48 H new ATOM 0 HA LYS A 164 -5.674 -0.270 9.211 1.00 0.52 H new ATOM 0 HB2 LYS A 164 -6.923 -0.896 11.920 1.00 0.69 H new ATOM 0 HB3 LYS A 164 -5.730 0.349 11.607 1.00 0.69 H new ATOM 0 HG2 LYS A 164 -8.364 0.415 10.143 1.00 0.88 H new ATOM 0 HG3 LYS A 164 -8.281 0.960 11.806 1.00 0.88 H new ATOM 0 HD2 LYS A 164 -7.895 2.933 10.615 1.00 1.22 H new ATOM 0 HD3 LYS A 164 -6.270 2.419 11.021 1.00 1.22 H new ATOM 0 HE2 LYS A 164 -6.142 2.983 8.737 1.00 2.04 H new ATOM 0 HE3 LYS A 164 -6.223 1.233 8.742 1.00 2.04 H new ATOM 0 HZ1 LYS A 164 -7.707 2.294 7.102 1.00 2.74 H new ATOM 0 HZ2 LYS A 164 -8.545 1.313 8.206 1.00 2.74 H new ATOM 0 HZ3 LYS A 164 -8.587 3.003 8.369 1.00 2.74 H new ATOM 243 N GLN A 165 -4.656 -2.908 9.536 1.00 0.36 N ATOM 244 CA GLN A 165 -3.441 -3.693 9.723 1.00 0.37 C ATOM 245 C GLN A 165 -2.314 -2.971 9.011 1.00 0.33 C ATOM 246 O GLN A 165 -2.552 -1.956 8.362 1.00 0.38 O ATOM 247 CB GLN A 165 -3.602 -5.100 9.138 1.00 0.42 C ATOM 248 CG GLN A 165 -4.998 -5.665 9.280 1.00 0.50 C ATOM 249 CD GLN A 165 -5.369 -5.952 10.724 1.00 0.66 C ATOM 250 OE1 GLN A 165 -4.506 -6.223 11.560 1.00 1.33 O ATOM 251 NE2 GLN A 165 -6.655 -5.924 11.020 1.00 1.33 N ATOM 0 H GLN A 165 -5.230 -3.190 8.741 1.00 0.36 H new ATOM 0 HA GLN A 165 -3.230 -3.797 10.787 1.00 0.37 H new ATOM 0 HB2 GLN A 165 -3.336 -5.077 8.081 1.00 0.42 H new ATOM 0 HB3 GLN A 165 -2.897 -5.770 9.630 1.00 0.42 H new ATOM 0 HG2 GLN A 165 -5.715 -4.961 8.858 1.00 0.50 H new ATOM 0 HG3 GLN A 165 -5.074 -6.585 8.700 1.00 0.50 H new ATOM 0 HE21 GLN A 165 -7.339 -5.695 10.299 1.00 1.33 H new ATOM 0 HE22 GLN A 165 -6.964 -6.131 11.970 1.00 1.33 H new ATOM 260 N ARG A 166 -1.097 -3.465 9.106 1.00 0.34 N ATOM 261 CA ARG A 166 -0.019 -2.847 8.367 1.00 0.32 C ATOM 262 C ARG A 166 0.989 -3.879 7.881 1.00 0.41 C ATOM 263 O ARG A 166 1.493 -4.698 8.644 1.00 0.79 O ATOM 264 CB ARG A 166 0.657 -1.764 9.188 1.00 0.40 C ATOM 265 CG ARG A 166 1.453 -0.810 8.353 1.00 0.95 C ATOM 266 CD ARG A 166 2.401 -0.002 9.208 1.00 0.96 C ATOM 267 NE ARG A 166 3.308 -0.849 9.982 1.00 1.54 N ATOM 268 CZ ARG A 166 4.464 -0.435 10.498 1.00 1.82 C ATOM 269 NH1 ARG A 166 4.888 0.808 10.294 1.00 1.62 N ATOM 270 NH2 ARG A 166 5.200 -1.274 11.217 1.00 2.49 N ATOM 0 H ARG A 166 -0.834 -4.272 9.672 1.00 0.34 H new ATOM 0 HA ARG A 166 -0.454 -2.376 7.486 1.00 0.32 H new ATOM 0 HB2 ARG A 166 -0.100 -1.209 9.742 1.00 0.40 H new ATOM 0 HB3 ARG A 166 1.313 -2.229 9.924 1.00 0.40 H new ATOM 0 HG2 ARG A 166 2.017 -1.362 7.601 1.00 0.95 H new ATOM 0 HG3 ARG A 166 0.780 -0.140 7.818 1.00 0.95 H new ATOM 0 HD2 ARG A 166 2.984 0.664 8.571 1.00 0.96 H new ATOM 0 HD3 ARG A 166 1.827 0.628 9.887 1.00 0.96 H new ATOM 0 HE ARG A 166 3.038 -1.820 10.137 1.00 1.54 H new ATOM 0 HH11 ARG A 166 4.327 1.454 9.738 1.00 1.62 H new ATOM 0 HH12 ARG A 166 5.775 1.116 10.693 1.00 1.62 H new ATOM 0 HH21 ARG A 166 4.879 -2.230 11.372 1.00 2.49 H new ATOM 0 HH22 ARG A 166 6.086 -0.963 11.615 1.00 2.49 H new ATOM 284 N THR A 167 1.225 -3.831 6.586 1.00 0.25 N ATOM 285 CA THR A 167 2.123 -4.724 5.892 1.00 0.27 C ATOM 286 C THR A 167 3.367 -3.948 5.505 1.00 0.25 C ATOM 287 O THR A 167 3.415 -2.725 5.666 1.00 0.31 O ATOM 288 CB THR A 167 1.462 -5.272 4.598 1.00 0.35 C ATOM 289 OG1 THR A 167 2.209 -6.375 4.080 1.00 0.50 O ATOM 290 CG2 THR A 167 1.414 -4.181 3.550 1.00 0.52 C ATOM 0 H THR A 167 0.783 -3.148 5.971 1.00 0.25 H new ATOM 0 HA THR A 167 2.367 -5.561 6.546 1.00 0.27 H new ATOM 0 HB THR A 167 0.453 -5.604 4.842 1.00 0.35 H new ATOM 0 HG1 THR A 167 2.244 -6.316 3.102 1.00 0.50 H new ATOM 0 HG21 THR A 167 0.950 -4.568 2.643 1.00 0.52 H new ATOM 0 HG22 THR A 167 0.831 -3.341 3.926 1.00 0.52 H new ATOM 0 HG23 THR A 167 2.427 -3.848 3.325 1.00 0.52 H new ATOM 298 N VAL A 168 4.368 -4.637 4.991 1.00 0.25 N ATOM 299 CA VAL A 168 5.529 -3.962 4.459 1.00 0.27 C ATOM 300 C VAL A 168 6.035 -4.688 3.231 1.00 0.25 C ATOM 301 O VAL A 168 6.246 -5.901 3.253 1.00 0.30 O ATOM 302 CB VAL A 168 6.692 -3.869 5.459 1.00 0.39 C ATOM 303 CG1 VAL A 168 7.637 -2.747 5.069 1.00 0.73 C ATOM 304 CG2 VAL A 168 6.202 -3.690 6.890 1.00 0.88 C ATOM 0 H VAL A 168 4.398 -5.655 4.932 1.00 0.25 H new ATOM 0 HA VAL A 168 5.201 -2.950 4.222 1.00 0.27 H new ATOM 0 HB VAL A 168 7.233 -4.814 5.421 1.00 0.39 H new ATOM 0 HG11 VAL A 168 8.455 -2.694 5.787 1.00 0.73 H new ATOM 0 HG12 VAL A 168 8.039 -2.939 4.074 1.00 0.73 H new ATOM 0 HG13 VAL A 168 7.096 -1.801 5.065 1.00 0.73 H new ATOM 0 HG21 VAL A 168 7.058 -3.629 7.563 1.00 0.88 H new ATOM 0 HG22 VAL A 168 5.617 -2.773 6.962 1.00 0.88 H new ATOM 0 HG23 VAL A 168 5.580 -4.540 7.171 1.00 0.88 H new ATOM 314 N VAL A 169 6.225 -3.938 2.176 1.00 0.26 N ATOM 315 CA VAL A 169 6.838 -4.446 0.965 1.00 0.26 C ATOM 316 C VAL A 169 8.104 -3.657 0.659 1.00 0.28 C ATOM 317 O VAL A 169 8.107 -2.427 0.733 1.00 0.29 O ATOM 318 CB VAL A 169 5.892 -4.363 -0.256 1.00 0.32 C ATOM 319 CG1 VAL A 169 4.802 -5.418 -0.167 1.00 1.17 C ATOM 320 CG2 VAL A 169 5.277 -2.976 -0.374 1.00 1.31 C ATOM 0 H VAL A 169 5.960 -2.954 2.127 1.00 0.26 H new ATOM 0 HA VAL A 169 7.069 -5.496 1.141 1.00 0.26 H new ATOM 0 HB VAL A 169 6.484 -4.553 -1.151 1.00 0.32 H new ATOM 0 HG11 VAL A 169 4.149 -5.341 -1.036 1.00 1.17 H new ATOM 0 HG12 VAL A 169 5.256 -6.409 -0.141 1.00 1.17 H new ATOM 0 HG13 VAL A 169 4.218 -5.263 0.740 1.00 1.17 H new ATOM 0 HG21 VAL A 169 4.616 -2.944 -1.240 1.00 1.31 H new ATOM 0 HG22 VAL A 169 4.706 -2.754 0.527 1.00 1.31 H new ATOM 0 HG23 VAL A 169 6.068 -2.236 -0.494 1.00 1.31 H new ATOM 330 N PRO A 170 9.212 -4.352 0.378 1.00 0.31 N ATOM 331 CA PRO A 170 10.416 -3.714 -0.146 1.00 0.32 C ATOM 332 C PRO A 170 10.083 -2.862 -1.361 1.00 0.28 C ATOM 333 O PRO A 170 9.255 -3.253 -2.182 1.00 0.33 O ATOM 334 CB PRO A 170 11.302 -4.895 -0.539 1.00 0.40 C ATOM 335 CG PRO A 170 10.861 -6.010 0.345 1.00 0.59 C ATOM 336 CD PRO A 170 9.389 -5.800 0.577 1.00 0.39 C ATOM 0 HA PRO A 170 10.893 -3.046 0.571 1.00 0.32 H new ATOM 0 HB2 PRO A 170 11.177 -5.151 -1.591 1.00 0.40 H new ATOM 0 HB3 PRO A 170 12.357 -4.665 -0.390 1.00 0.40 H new ATOM 0 HG2 PRO A 170 11.048 -6.976 -0.123 1.00 0.59 H new ATOM 0 HG3 PRO A 170 11.409 -6.001 1.287 1.00 0.59 H new ATOM 0 HD2 PRO A 170 8.786 -6.378 -0.123 1.00 0.39 H new ATOM 0 HD3 PRO A 170 9.093 -6.106 1.580 1.00 0.39 H new ATOM 344 N ALA A 171 10.708 -1.694 -1.463 1.00 0.24 N ATOM 345 CA ALA A 171 10.426 -0.777 -2.560 1.00 0.21 C ATOM 346 C ALA A 171 10.762 -1.429 -3.888 1.00 0.24 C ATOM 347 O ALA A 171 11.927 -1.527 -4.277 1.00 0.35 O ATOM 348 CB ALA A 171 11.190 0.522 -2.399 1.00 0.21 C ATOM 0 H ALA A 171 11.410 -1.361 -0.802 1.00 0.24 H new ATOM 0 HA ALA A 171 9.362 -0.543 -2.541 1.00 0.21 H new ATOM 0 HB1 ALA A 171 10.959 1.186 -3.232 1.00 0.21 H new ATOM 0 HB2 ALA A 171 10.901 1.001 -1.463 1.00 0.21 H new ATOM 0 HB3 ALA A 171 12.260 0.315 -2.385 1.00 0.21 H new ATOM 354 N ARG A 172 9.727 -1.887 -4.561 1.00 0.26 N ATOM 355 CA ARG A 172 9.872 -2.603 -5.809 1.00 0.29 C ATOM 356 C ARG A 172 10.068 -1.625 -6.963 1.00 0.27 C ATOM 357 O ARG A 172 9.149 -0.893 -7.328 1.00 0.27 O ATOM 358 CB ARG A 172 8.627 -3.460 -6.035 1.00 0.33 C ATOM 359 CG ARG A 172 8.382 -4.498 -4.954 1.00 0.46 C ATOM 360 CD ARG A 172 9.559 -5.444 -4.803 1.00 0.56 C ATOM 361 NE ARG A 172 9.297 -6.479 -3.810 1.00 1.33 N ATOM 362 CZ ARG A 172 10.245 -7.190 -3.209 1.00 1.81 C ATOM 363 NH1 ARG A 172 11.528 -6.932 -3.448 1.00 1.58 N ATOM 364 NH2 ARG A 172 9.911 -8.140 -2.345 1.00 2.81 N ATOM 0 H ARG A 172 8.760 -1.773 -4.257 1.00 0.26 H new ATOM 0 HA ARG A 172 10.751 -3.246 -5.763 1.00 0.29 H new ATOM 0 HB2 ARG A 172 7.757 -2.807 -6.100 1.00 0.33 H new ATOM 0 HB3 ARG A 172 8.718 -3.967 -6.996 1.00 0.33 H new ATOM 0 HG2 ARG A 172 8.195 -3.997 -4.004 1.00 0.46 H new ATOM 0 HG3 ARG A 172 7.485 -5.069 -5.195 1.00 0.46 H new ATOM 0 HD2 ARG A 172 9.777 -5.909 -5.764 1.00 0.56 H new ATOM 0 HD3 ARG A 172 10.445 -4.879 -4.514 1.00 0.56 H new ATOM 0 HE ARG A 172 8.326 -6.669 -3.561 1.00 1.33 H new ATOM 0 HH11 ARG A 172 11.786 -6.186 -4.094 1.00 1.58 H new ATOM 0 HH12 ARG A 172 12.253 -7.480 -2.985 1.00 1.58 H new ATOM 0 HH21 ARG A 172 8.928 -8.323 -2.143 1.00 2.81 H new ATOM 0 HH22 ARG A 172 10.637 -8.687 -1.883 1.00 2.81 H new ATOM 378 N CYS A 173 11.265 -1.616 -7.532 1.00 0.30 N ATOM 379 CA CYS A 173 11.595 -0.694 -8.611 1.00 0.32 C ATOM 380 C CYS A 173 11.138 -1.245 -9.956 1.00 0.31 C ATOM 381 O CYS A 173 11.519 -2.350 -10.347 1.00 0.41 O ATOM 382 CB CYS A 173 13.099 -0.419 -8.624 1.00 0.40 C ATOM 383 SG CYS A 173 14.122 -1.909 -8.584 1.00 1.44 S ATOM 0 H CYS A 173 12.027 -2.239 -7.264 1.00 0.30 H new ATOM 0 HA CYS A 173 11.068 0.244 -8.437 1.00 0.32 H new ATOM 0 HB2 CYS A 173 13.345 0.154 -9.518 1.00 0.40 H new ATOM 0 HB3 CYS A 173 13.351 0.205 -7.766 1.00 0.40 H new ATOM 0 HG CYS A 173 13.558 -2.842 -9.292 1.00 1.44 H new ATOM 389 N GLY A 174 10.322 -0.474 -10.661 1.00 0.30 N ATOM 390 CA GLY A 174 9.749 -0.951 -11.904 1.00 0.33 C ATOM 391 C GLY A 174 8.490 -1.741 -11.643 1.00 0.30 C ATOM 392 O GLY A 174 8.037 -2.524 -12.479 1.00 0.43 O ATOM 0 H GLY A 174 10.047 0.472 -10.395 1.00 0.30 H new ATOM 0 HA2 GLY A 174 9.525 -0.106 -12.555 1.00 0.33 H new ATOM 0 HA3 GLY A 174 10.473 -1.574 -12.428 1.00 0.33 H new ATOM 396 N VAL A 175 7.926 -1.519 -10.469 1.00 0.25 N ATOM 397 CA VAL A 175 6.770 -2.257 -10.004 1.00 0.28 C ATOM 398 C VAL A 175 5.696 -1.298 -9.525 1.00 0.26 C ATOM 399 O VAL A 175 5.977 -0.368 -8.772 1.00 0.35 O ATOM 400 CB VAL A 175 7.161 -3.215 -8.862 1.00 0.35 C ATOM 401 CG1 VAL A 175 5.927 -3.778 -8.169 1.00 0.69 C ATOM 402 CG2 VAL A 175 7.999 -4.358 -9.399 1.00 0.97 C ATOM 0 H VAL A 175 8.261 -0.817 -9.809 1.00 0.25 H new ATOM 0 HA VAL A 175 6.381 -2.845 -10.835 1.00 0.28 H new ATOM 0 HB VAL A 175 7.741 -2.645 -8.136 1.00 0.35 H new ATOM 0 HG11 VAL A 175 6.234 -4.450 -7.368 1.00 0.69 H new ATOM 0 HG12 VAL A 175 5.340 -2.960 -7.751 1.00 0.69 H new ATOM 0 HG13 VAL A 175 5.323 -4.327 -8.891 1.00 0.69 H new ATOM 0 HG21 VAL A 175 8.268 -5.027 -8.582 1.00 0.97 H new ATOM 0 HG22 VAL A 175 7.427 -4.909 -10.146 1.00 0.97 H new ATOM 0 HG23 VAL A 175 8.905 -3.961 -9.856 1.00 0.97 H new ATOM 412 N THR A 176 4.473 -1.519 -9.969 1.00 0.22 N ATOM 413 CA THR A 176 3.365 -0.688 -9.557 1.00 0.25 C ATOM 414 C THR A 176 2.913 -1.083 -8.159 1.00 0.23 C ATOM 415 O THR A 176 3.254 -2.179 -7.683 1.00 0.25 O ATOM 416 CB THR A 176 2.183 -0.818 -10.536 1.00 0.31 C ATOM 417 OG1 THR A 176 1.880 -2.203 -10.744 1.00 0.47 O ATOM 418 CG2 THR A 176 2.503 -0.158 -11.868 1.00 0.40 C ATOM 0 H THR A 176 4.225 -2.268 -10.615 1.00 0.22 H new ATOM 0 HA THR A 176 3.701 0.349 -9.555 1.00 0.25 H new ATOM 0 HB THR A 176 1.320 -0.313 -10.102 1.00 0.31 H new ATOM 0 HG1 THR A 176 1.239 -2.291 -11.480 1.00 0.47 H new ATOM 0 HG21 THR A 176 1.652 -0.264 -12.541 1.00 0.40 H new ATOM 0 HG22 THR A 176 2.710 0.900 -11.709 1.00 0.40 H new ATOM 0 HG23 THR A 176 3.377 -0.636 -12.310 1.00 0.40 H new ATOM 426 N VAL A 177 2.167 -0.207 -7.490 1.00 0.25 N ATOM 427 CA VAL A 177 1.591 -0.557 -6.200 1.00 0.27 C ATOM 428 C VAL A 177 0.837 -1.872 -6.345 1.00 0.24 C ATOM 429 O VAL A 177 0.900 -2.732 -5.481 1.00 0.28 O ATOM 430 CB VAL A 177 0.639 0.539 -5.642 1.00 0.34 C ATOM 431 CG1 VAL A 177 1.295 1.906 -5.682 1.00 1.20 C ATOM 432 CG2 VAL A 177 -0.670 0.578 -6.396 1.00 1.39 C ATOM 0 H VAL A 177 1.951 0.735 -7.815 1.00 0.25 H new ATOM 0 HA VAL A 177 2.408 -0.651 -5.485 1.00 0.27 H new ATOM 0 HB VAL A 177 0.430 0.278 -4.605 1.00 0.34 H new ATOM 0 HG11 VAL A 177 0.606 2.652 -5.286 1.00 1.20 H new ATOM 0 HG12 VAL A 177 2.202 1.892 -5.077 1.00 1.20 H new ATOM 0 HG13 VAL A 177 1.549 2.158 -6.712 1.00 1.20 H new ATOM 0 HG21 VAL A 177 -1.308 1.356 -5.977 1.00 1.39 H new ATOM 0 HG22 VAL A 177 -0.478 0.793 -7.447 1.00 1.39 H new ATOM 0 HG23 VAL A 177 -1.169 -0.387 -6.308 1.00 1.39 H new ATOM 442 N ARG A 178 0.206 -2.029 -7.507 1.00 0.23 N ATOM 443 CA ARG A 178 -0.592 -3.196 -7.842 1.00 0.26 C ATOM 444 C ARG A 178 0.076 -4.499 -7.439 1.00 0.23 C ATOM 445 O ARG A 178 -0.470 -5.251 -6.649 1.00 0.33 O ATOM 446 CB ARG A 178 -0.860 -3.191 -9.333 1.00 0.39 C ATOM 447 CG ARG A 178 -1.728 -4.332 -9.807 1.00 0.85 C ATOM 448 CD ARG A 178 -2.143 -4.078 -11.227 1.00 1.65 C ATOM 449 NE ARG A 178 -2.954 -5.155 -11.786 1.00 2.02 N ATOM 450 CZ ARG A 178 -2.985 -5.458 -13.082 1.00 2.82 C ATOM 451 NH1 ARG A 178 -2.249 -4.768 -13.946 1.00 3.53 N ATOM 452 NH2 ARG A 178 -3.752 -6.450 -13.515 1.00 3.28 N ATOM 0 H ARG A 178 0.239 -1.333 -8.252 1.00 0.23 H new ATOM 0 HA ARG A 178 -1.525 -3.137 -7.281 1.00 0.26 H new ATOM 0 HB2 ARG A 178 -1.338 -2.249 -9.602 1.00 0.39 H new ATOM 0 HB3 ARG A 178 0.092 -3.228 -9.863 1.00 0.39 H new ATOM 0 HG2 ARG A 178 -1.183 -5.273 -9.738 1.00 0.85 H new ATOM 0 HG3 ARG A 178 -2.607 -4.425 -9.169 1.00 0.85 H new ATOM 0 HD2 ARG A 178 -2.705 -3.145 -11.274 1.00 1.65 H new ATOM 0 HD3 ARG A 178 -1.253 -3.945 -11.842 1.00 1.65 H new ATOM 0 HE ARG A 178 -3.529 -5.706 -11.148 1.00 2.02 H new ATOM 0 HH11 ARG A 178 -1.658 -4.004 -13.617 1.00 3.53 H new ATOM 0 HH12 ARG A 178 -2.274 -5.002 -14.938 1.00 3.53 H new ATOM 0 HH21 ARG A 178 -4.319 -6.982 -12.855 1.00 3.28 H new ATOM 0 HH22 ARG A 178 -3.775 -6.681 -14.508 1.00 3.28 H new ATOM 466 N ASP A 179 1.262 -4.748 -7.961 1.00 0.20 N ATOM 467 CA ASP A 179 1.952 -6.008 -7.722 1.00 0.19 C ATOM 468 C ASP A 179 2.453 -6.079 -6.293 1.00 0.17 C ATOM 469 O ASP A 179 2.266 -7.080 -5.590 1.00 0.18 O ATOM 470 CB ASP A 179 3.140 -6.153 -8.674 1.00 0.23 C ATOM 471 CG ASP A 179 3.814 -7.509 -8.570 1.00 0.32 C ATOM 472 OD1 ASP A 179 3.520 -8.392 -9.403 1.00 1.12 O ATOM 473 OD2 ASP A 179 4.643 -7.700 -7.659 1.00 1.19 O ATOM 0 H ASP A 179 1.772 -4.094 -8.555 1.00 0.20 H new ATOM 0 HA ASP A 179 1.243 -6.817 -7.897 1.00 0.19 H new ATOM 0 HB2 ASP A 179 2.800 -5.999 -9.698 1.00 0.23 H new ATOM 0 HB3 ASP A 179 3.870 -5.372 -8.459 1.00 0.23 H new ATOM 478 N SER A 180 3.061 -4.997 -5.865 1.00 0.17 N ATOM 479 CA SER A 180 3.711 -4.953 -4.578 1.00 0.18 C ATOM 480 C SER A 180 2.707 -5.166 -3.456 1.00 0.17 C ATOM 481 O SER A 180 2.816 -6.110 -2.661 1.00 0.19 O ATOM 482 CB SER A 180 4.421 -3.615 -4.449 1.00 0.22 C ATOM 483 OG SER A 180 3.654 -2.582 -5.041 1.00 1.34 O ATOM 0 H SER A 180 3.118 -4.128 -6.396 1.00 0.17 H new ATOM 0 HA SER A 180 4.442 -5.758 -4.499 1.00 0.18 H new ATOM 0 HB2 SER A 180 4.593 -3.389 -3.397 1.00 0.22 H new ATOM 0 HB3 SER A 180 5.399 -3.669 -4.928 1.00 0.22 H new ATOM 0 HG SER A 180 3.795 -2.584 -6.011 1.00 1.34 H new ATOM 489 N LEU A 181 1.694 -4.332 -3.399 1.00 0.17 N ATOM 490 CA LEU A 181 0.772 -4.444 -2.323 1.00 0.18 C ATOM 491 C LEU A 181 -0.396 -5.388 -2.646 1.00 0.18 C ATOM 492 O LEU A 181 -1.244 -5.610 -1.795 1.00 0.20 O ATOM 493 CB LEU A 181 0.373 -3.043 -1.813 1.00 0.24 C ATOM 494 CG LEU A 181 -0.911 -2.373 -2.308 1.00 0.35 C ATOM 495 CD1 LEU A 181 -1.290 -2.760 -3.716 1.00 1.08 C ATOM 496 CD2 LEU A 181 -2.031 -2.645 -1.334 1.00 0.96 C ATOM 0 H LEU A 181 1.501 -3.591 -4.072 1.00 0.17 H new ATOM 0 HA LEU A 181 1.261 -4.935 -1.482 1.00 0.18 H new ATOM 0 HB2 LEU A 181 0.306 -3.103 -0.727 1.00 0.24 H new ATOM 0 HB3 LEU A 181 1.198 -2.369 -2.045 1.00 0.24 H new ATOM 0 HG LEU A 181 -0.721 -1.300 -2.352 1.00 0.35 H new ATOM 0 HD11 LEU A 181 -2.209 -2.247 -3.999 1.00 1.08 H new ATOM 0 HD12 LEU A 181 -0.490 -2.475 -4.399 1.00 1.08 H new ATOM 0 HD13 LEU A 181 -1.445 -3.838 -3.768 1.00 1.08 H new ATOM 0 HD21 LEU A 181 -2.945 -2.167 -1.688 1.00 0.96 H new ATOM 0 HD22 LEU A 181 -2.191 -3.720 -1.255 1.00 0.96 H new ATOM 0 HD23 LEU A 181 -1.767 -2.244 -0.355 1.00 0.96 H new ATOM 508 N LYS A 182 -0.448 -5.996 -3.850 1.00 0.18 N ATOM 509 CA LYS A 182 -1.382 -7.114 -4.005 1.00 0.22 C ATOM 510 C LYS A 182 -0.872 -8.253 -3.148 1.00 0.22 C ATOM 511 O LYS A 182 -1.649 -9.013 -2.570 1.00 0.25 O ATOM 512 CB LYS A 182 -1.578 -7.595 -5.450 1.00 0.32 C ATOM 513 CG LYS A 182 -0.369 -8.277 -6.053 1.00 0.75 C ATOM 514 CD LYS A 182 -0.705 -8.973 -7.366 1.00 0.76 C ATOM 515 CE LYS A 182 -1.339 -8.024 -8.375 1.00 0.80 C ATOM 516 NZ LYS A 182 -1.687 -8.720 -9.641 1.00 1.15 N ATOM 0 H LYS A 182 0.105 -5.751 -4.671 1.00 0.18 H new ATOM 0 HA LYS A 182 -2.365 -6.763 -3.692 1.00 0.22 H new ATOM 0 HB2 LYS A 182 -2.421 -8.285 -5.479 1.00 0.32 H new ATOM 0 HB3 LYS A 182 -1.845 -6.740 -6.071 1.00 0.32 H new ATOM 0 HG2 LYS A 182 0.416 -7.540 -6.223 1.00 0.75 H new ATOM 0 HG3 LYS A 182 0.026 -9.007 -5.346 1.00 0.75 H new ATOM 0 HD2 LYS A 182 0.203 -9.399 -7.792 1.00 0.76 H new ATOM 0 HD3 LYS A 182 -1.386 -9.802 -7.172 1.00 0.76 H new ATOM 0 HE2 LYS A 182 -2.237 -7.582 -7.944 1.00 0.80 H new ATOM 0 HE3 LYS A 182 -0.651 -7.206 -8.587 1.00 0.80 H new ATOM 0 HZ1 LYS A 182 -2.116 -8.042 -10.303 1.00 1.15 H new ATOM 0 HZ2 LYS A 182 -0.826 -9.120 -10.065 1.00 1.15 H new ATOM 0 HZ3 LYS A 182 -2.363 -9.485 -9.442 1.00 1.15 H new ATOM 530 N LYS A 183 0.453 -8.345 -3.059 1.00 0.22 N ATOM 531 CA LYS A 183 1.088 -9.239 -2.112 1.00 0.25 C ATOM 532 C LYS A 183 0.679 -8.837 -0.704 1.00 0.23 C ATOM 533 O LYS A 183 0.362 -9.689 0.113 1.00 0.26 O ATOM 534 CB LYS A 183 2.602 -9.181 -2.242 1.00 0.33 C ATOM 535 CG LYS A 183 3.310 -10.271 -1.462 1.00 0.40 C ATOM 536 CD LYS A 183 3.280 -11.599 -2.197 1.00 1.18 C ATOM 537 CE LYS A 183 4.649 -12.266 -2.191 1.00 1.31 C ATOM 538 NZ LYS A 183 4.631 -13.598 -2.849 1.00 1.80 N ATOM 0 H LYS A 183 1.102 -7.808 -3.634 1.00 0.22 H new ATOM 0 HA LYS A 183 0.768 -10.260 -2.320 1.00 0.25 H new ATOM 0 HB2 LYS A 183 2.873 -9.262 -3.295 1.00 0.33 H new ATOM 0 HB3 LYS A 183 2.953 -8.209 -1.896 1.00 0.33 H new ATOM 0 HG2 LYS A 183 4.344 -9.977 -1.284 1.00 0.40 H new ATOM 0 HG3 LYS A 183 2.838 -10.385 -0.486 1.00 0.40 H new ATOM 0 HD2 LYS A 183 2.549 -12.259 -1.730 1.00 1.18 H new ATOM 0 HD3 LYS A 183 2.955 -11.441 -3.225 1.00 1.18 H new ATOM 0 HE2 LYS A 183 5.367 -11.622 -2.699 1.00 1.31 H new ATOM 0 HE3 LYS A 183 4.992 -12.376 -1.162 1.00 1.31 H new ATOM 0 HZ1 LYS A 183 5.584 -14.012 -2.820 1.00 1.80 H new ATOM 0 HZ2 LYS A 183 3.967 -14.223 -2.349 1.00 1.80 H new ATOM 0 HZ3 LYS A 183 4.329 -13.492 -3.839 1.00 1.80 H new ATOM 552 N ALA A 184 0.689 -7.527 -0.435 1.00 0.23 N ATOM 553 CA ALA A 184 0.203 -6.996 0.847 1.00 0.26 C ATOM 554 C ALA A 184 -1.156 -7.586 1.216 1.00 0.25 C ATOM 555 O ALA A 184 -1.302 -8.206 2.274 1.00 0.29 O ATOM 556 CB ALA A 184 0.088 -5.483 0.803 1.00 0.30 C ATOM 0 H ALA A 184 1.026 -6.816 -1.084 1.00 0.23 H new ATOM 0 HA ALA A 184 0.933 -7.282 1.604 1.00 0.26 H new ATOM 0 HB1 ALA A 184 -0.274 -5.117 1.764 1.00 0.30 H new ATOM 0 HB2 ALA A 184 1.066 -5.050 0.595 1.00 0.30 H new ATOM 0 HB3 ALA A 184 -0.611 -5.194 0.019 1.00 0.30 H new ATOM 562 N LEU A 185 -2.148 -7.381 0.344 1.00 0.23 N ATOM 563 CA LEU A 185 -3.489 -7.926 0.561 1.00 0.26 C ATOM 564 C LEU A 185 -3.419 -9.424 0.820 1.00 0.24 C ATOM 565 O LEU A 185 -3.944 -9.912 1.818 1.00 0.27 O ATOM 566 CB LEU A 185 -4.410 -7.673 -0.648 1.00 0.31 C ATOM 567 CG LEU A 185 -5.046 -6.277 -0.769 1.00 0.50 C ATOM 568 CD1 LEU A 185 -5.655 -5.825 0.544 1.00 1.46 C ATOM 569 CD2 LEU A 185 -4.051 -5.258 -1.266 1.00 1.11 C ATOM 0 H LEU A 185 -2.047 -6.843 -0.516 1.00 0.23 H new ATOM 0 HA LEU A 185 -3.904 -7.416 1.430 1.00 0.26 H new ATOM 0 HB2 LEU A 185 -3.836 -7.862 -1.555 1.00 0.31 H new ATOM 0 HB3 LEU A 185 -5.214 -8.409 -0.620 1.00 0.31 H new ATOM 0 HG LEU A 185 -5.848 -6.356 -1.503 1.00 0.50 H new ATOM 0 HD11 LEU A 185 -6.094 -4.835 0.420 1.00 1.46 H new ATOM 0 HD12 LEU A 185 -6.429 -6.530 0.848 1.00 1.46 H new ATOM 0 HD13 LEU A 185 -4.880 -5.784 1.310 1.00 1.46 H new ATOM 0 HD21 LEU A 185 -4.534 -4.284 -1.340 1.00 1.11 H new ATOM 0 HD22 LEU A 185 -3.214 -5.197 -0.570 1.00 1.11 H new ATOM 0 HD23 LEU A 185 -3.685 -5.556 -2.248 1.00 1.11 H new ATOM 581 N MET A 186 -2.734 -10.139 -0.061 1.00 0.22 N ATOM 582 CA MET A 186 -2.699 -11.598 -0.018 1.00 0.26 C ATOM 583 C MET A 186 -1.949 -12.123 1.202 1.00 0.29 C ATOM 584 O MET A 186 -2.153 -13.259 1.622 1.00 0.34 O ATOM 585 CB MET A 186 -2.099 -12.154 -1.308 1.00 0.30 C ATOM 586 CG MET A 186 -2.916 -11.785 -2.534 1.00 0.35 C ATOM 587 SD MET A 186 -2.810 -12.998 -3.861 1.00 0.98 S ATOM 588 CE MET A 186 -4.062 -12.363 -4.976 1.00 1.45 C ATOM 0 H MET A 186 -2.190 -9.730 -0.821 1.00 0.22 H new ATOM 0 HA MET A 186 -3.728 -11.946 0.071 1.00 0.26 H new ATOM 0 HB2 MET A 186 -1.083 -11.777 -1.425 1.00 0.30 H new ATOM 0 HB3 MET A 186 -2.029 -13.239 -1.235 1.00 0.30 H new ATOM 0 HG2 MET A 186 -3.960 -11.667 -2.243 1.00 0.35 H new ATOM 0 HG3 MET A 186 -2.578 -10.819 -2.908 1.00 0.35 H new ATOM 0 HE1 MET A 186 -4.124 -13.004 -5.856 1.00 1.45 H new ATOM 0 HE2 MET A 186 -5.027 -12.348 -4.469 1.00 1.45 H new ATOM 0 HE3 MET A 186 -3.797 -11.351 -5.282 1.00 1.45 H new ATOM 598 N MET A 187 -1.097 -11.292 1.780 1.00 0.30 N ATOM 599 CA MET A 187 -0.363 -11.671 2.978 1.00 0.37 C ATOM 600 C MET A 187 -1.276 -11.573 4.188 1.00 0.40 C ATOM 601 O MET A 187 -1.093 -12.272 5.182 1.00 0.53 O ATOM 602 CB MET A 187 0.873 -10.787 3.162 1.00 0.44 C ATOM 603 CG MET A 187 1.997 -11.096 2.185 1.00 0.49 C ATOM 604 SD MET A 187 2.741 -12.707 2.486 1.00 0.72 S ATOM 605 CE MET A 187 4.154 -12.624 1.394 1.00 0.85 C ATOM 0 H MET A 187 -0.896 -10.351 1.440 1.00 0.30 H new ATOM 0 HA MET A 187 -0.023 -12.701 2.871 1.00 0.37 H new ATOM 0 HB2 MET A 187 0.582 -9.743 3.049 1.00 0.44 H new ATOM 0 HB3 MET A 187 1.245 -10.906 4.180 1.00 0.44 H new ATOM 0 HG2 MET A 187 1.610 -11.062 1.167 1.00 0.49 H new ATOM 0 HG3 MET A 187 2.763 -10.325 2.261 1.00 0.49 H new ATOM 0 HE1 MET A 187 4.058 -13.382 0.617 1.00 0.85 H new ATOM 0 HE2 MET A 187 4.201 -11.637 0.934 1.00 0.85 H new ATOM 0 HE3 MET A 187 5.066 -12.802 1.964 1.00 0.85 H new ATOM 615 N ARG A 188 -2.265 -10.695 4.088 1.00 0.35 N ATOM 616 CA ARG A 188 -3.296 -10.578 5.101 1.00 0.41 C ATOM 617 C ARG A 188 -4.414 -11.583 4.825 1.00 0.41 C ATOM 618 O ARG A 188 -5.193 -11.926 5.711 1.00 0.50 O ATOM 619 CB ARG A 188 -3.858 -9.153 5.103 1.00 0.47 C ATOM 620 CG ARG A 188 -4.715 -8.825 6.319 1.00 0.79 C ATOM 621 CD ARG A 188 -3.973 -9.090 7.616 1.00 0.63 C ATOM 622 NE ARG A 188 -4.842 -8.944 8.781 1.00 1.20 N ATOM 623 CZ ARG A 188 -4.544 -9.396 9.999 1.00 1.43 C ATOM 624 NH1 ARG A 188 -3.370 -9.980 10.228 1.00 1.42 N ATOM 625 NH2 ARG A 188 -5.418 -9.258 10.988 1.00 2.12 N ATOM 0 H ARG A 188 -2.372 -10.049 3.306 1.00 0.35 H new ATOM 0 HA ARG A 188 -2.865 -10.792 6.079 1.00 0.41 H new ATOM 0 HB2 ARG A 188 -3.029 -8.447 5.055 1.00 0.47 H new ATOM 0 HB3 ARG A 188 -4.454 -9.007 4.202 1.00 0.47 H new ATOM 0 HG2 ARG A 188 -5.017 -7.778 6.280 1.00 0.79 H new ATOM 0 HG3 ARG A 188 -5.627 -9.421 6.293 1.00 0.79 H new ATOM 0 HD2 ARG A 188 -3.558 -10.098 7.597 1.00 0.63 H new ATOM 0 HD3 ARG A 188 -3.133 -8.400 7.701 1.00 0.63 H new ATOM 0 HE ARG A 188 -5.734 -8.466 8.654 1.00 1.20 H new ATOM 0 HH11 ARG A 188 -2.695 -10.083 9.470 1.00 1.42 H new ATOM 0 HH12 ARG A 188 -3.145 -10.325 11.161 1.00 1.42 H new ATOM 0 HH21 ARG A 188 -6.316 -8.807 10.816 1.00 2.12 H new ATOM 0 HH22 ARG A 188 -5.192 -9.603 11.921 1.00 2.12 H new ATOM 639 N GLY A 189 -4.474 -12.052 3.586 1.00 0.37 N ATOM 640 CA GLY A 189 -5.510 -12.984 3.183 1.00 0.42 C ATOM 641 C GLY A 189 -6.620 -12.293 2.416 1.00 0.43 C ATOM 642 O GLY A 189 -7.704 -12.848 2.233 1.00 0.53 O ATOM 0 H GLY A 189 -3.818 -11.801 2.847 1.00 0.37 H new ATOM 0 HA2 GLY A 189 -5.073 -13.768 2.564 1.00 0.42 H new ATOM 0 HA3 GLY A 189 -5.926 -13.470 4.066 1.00 0.42 H new ATOM 646 N LEU A 190 -6.344 -11.076 1.974 1.00 0.37 N ATOM 647 CA LEU A 190 -7.324 -10.264 1.264 1.00 0.40 C ATOM 648 C LEU A 190 -6.955 -10.171 -0.214 1.00 0.35 C ATOM 649 O LEU A 190 -5.929 -10.703 -0.640 1.00 0.37 O ATOM 650 CB LEU A 190 -7.376 -8.853 1.863 1.00 0.45 C ATOM 651 CG LEU A 190 -7.387 -8.774 3.394 1.00 0.61 C ATOM 652 CD1 LEU A 190 -7.649 -7.351 3.856 1.00 1.05 C ATOM 653 CD2 LEU A 190 -8.411 -9.728 3.981 1.00 1.28 C ATOM 0 H LEU A 190 -5.438 -10.623 2.096 1.00 0.37 H new ATOM 0 HA LEU A 190 -8.302 -10.735 1.365 1.00 0.40 H new ATOM 0 HB2 LEU A 190 -6.517 -8.292 1.496 1.00 0.45 H new ATOM 0 HB3 LEU A 190 -8.268 -8.352 1.487 1.00 0.45 H new ATOM 0 HG LEU A 190 -6.403 -9.075 3.754 1.00 0.61 H new ATOM 0 HD11 LEU A 190 -7.653 -7.317 4.945 1.00 1.05 H new ATOM 0 HD12 LEU A 190 -6.866 -6.695 3.475 1.00 1.05 H new ATOM 0 HD13 LEU A 190 -8.616 -7.018 3.479 1.00 1.05 H new ATOM 0 HD21 LEU A 190 -8.398 -9.652 5.068 1.00 1.28 H new ATOM 0 HD22 LEU A 190 -9.403 -9.470 3.611 1.00 1.28 H new ATOM 0 HD23 LEU A 190 -8.168 -10.749 3.686 1.00 1.28 H new ATOM 665 N ILE A 191 -7.797 -9.507 -0.994 1.00 0.37 N ATOM 666 CA ILE A 191 -7.525 -9.286 -2.404 1.00 0.35 C ATOM 667 C ILE A 191 -7.575 -7.798 -2.745 1.00 0.36 C ATOM 668 O ILE A 191 -8.348 -7.034 -2.160 1.00 0.39 O ATOM 669 CB ILE A 191 -8.529 -10.037 -3.294 1.00 0.39 C ATOM 670 CG1 ILE A 191 -9.947 -9.517 -3.052 1.00 0.45 C ATOM 671 CG2 ILE A 191 -8.445 -11.527 -3.016 1.00 0.41 C ATOM 672 CD1 ILE A 191 -10.939 -9.970 -4.085 1.00 0.52 C ATOM 0 H ILE A 191 -8.679 -9.111 -0.670 1.00 0.37 H new ATOM 0 HA ILE A 191 -6.523 -9.669 -2.597 1.00 0.35 H new ATOM 0 HB ILE A 191 -8.280 -9.863 -4.341 1.00 0.39 H new ATOM 0 HG12 ILE A 191 -10.283 -9.847 -2.069 1.00 0.45 H new ATOM 0 HG13 ILE A 191 -9.927 -8.427 -3.033 1.00 0.45 H new ATOM 0 HG21 ILE A 191 -9.158 -12.056 -3.649 1.00 0.41 H new ATOM 0 HG22 ILE A 191 -7.437 -11.881 -3.231 1.00 0.41 H new ATOM 0 HG23 ILE A 191 -8.680 -11.715 -1.968 1.00 0.41 H new ATOM 0 HD11 ILE A 191 -11.922 -9.563 -3.849 1.00 0.52 H new ATOM 0 HD12 ILE A 191 -10.627 -9.618 -5.068 1.00 0.52 H new ATOM 0 HD13 ILE A 191 -10.989 -11.059 -4.089 1.00 0.52 H new ATOM 684 N PRO A 192 -6.736 -7.371 -3.700 1.00 0.39 N ATOM 685 CA PRO A 192 -6.655 -5.973 -4.133 1.00 0.43 C ATOM 686 C PRO A 192 -7.797 -5.581 -5.065 1.00 0.41 C ATOM 687 O PRO A 192 -8.017 -4.399 -5.330 1.00 0.46 O ATOM 688 CB PRO A 192 -5.324 -5.925 -4.877 1.00 0.52 C ATOM 689 CG PRO A 192 -5.168 -7.293 -5.439 1.00 0.48 C ATOM 690 CD PRO A 192 -5.775 -8.226 -4.426 1.00 0.43 C ATOM 0 HA PRO A 192 -6.726 -5.279 -3.295 1.00 0.43 H new ATOM 0 HB2 PRO A 192 -5.335 -5.171 -5.664 1.00 0.52 H new ATOM 0 HB3 PRO A 192 -4.502 -5.674 -4.206 1.00 0.52 H new ATOM 0 HG2 PRO A 192 -5.672 -7.380 -6.402 1.00 0.48 H new ATOM 0 HG3 PRO A 192 -4.117 -7.529 -5.607 1.00 0.48 H new ATOM 0 HD2 PRO A 192 -6.271 -9.070 -4.905 1.00 0.43 H new ATOM 0 HD3 PRO A 192 -5.020 -8.638 -3.757 1.00 0.43 H new ATOM 698 N GLU A 193 -8.528 -6.580 -5.548 1.00 0.39 N ATOM 699 CA GLU A 193 -9.609 -6.357 -6.502 1.00 0.43 C ATOM 700 C GLU A 193 -10.741 -5.560 -5.862 1.00 0.36 C ATOM 701 O GLU A 193 -11.483 -4.859 -6.545 1.00 0.45 O ATOM 702 CB GLU A 193 -10.148 -7.692 -7.017 1.00 0.57 C ATOM 703 CG GLU A 193 -9.059 -8.670 -7.425 1.00 0.99 C ATOM 704 CD GLU A 193 -9.611 -9.964 -7.985 1.00 1.20 C ATOM 705 OE1 GLU A 193 -9.637 -10.113 -9.222 1.00 1.73 O ATOM 706 OE2 GLU A 193 -10.020 -10.837 -7.190 1.00 1.74 O ATOM 0 H GLU A 193 -8.390 -7.558 -5.293 1.00 0.39 H new ATOM 0 HA GLU A 193 -9.207 -5.785 -7.339 1.00 0.43 H new ATOM 0 HB2 GLU A 193 -10.764 -8.149 -6.242 1.00 0.57 H new ATOM 0 HB3 GLU A 193 -10.798 -7.507 -7.872 1.00 0.57 H new ATOM 0 HG2 GLU A 193 -8.417 -8.201 -8.171 1.00 0.99 H new ATOM 0 HG3 GLU A 193 -8.433 -8.891 -6.560 1.00 0.99 H new ATOM 713 N CYS A 194 -10.866 -5.669 -4.547 1.00 0.33 N ATOM 714 CA CYS A 194 -11.919 -4.972 -3.825 1.00 0.36 C ATOM 715 C CYS A 194 -11.327 -3.916 -2.886 1.00 0.33 C ATOM 716 O CYS A 194 -11.988 -3.454 -1.959 1.00 0.49 O ATOM 717 CB CYS A 194 -12.763 -5.983 -3.038 1.00 0.48 C ATOM 718 SG CYS A 194 -14.300 -5.313 -2.358 1.00 1.69 S ATOM 0 H CYS A 194 -10.252 -6.233 -3.960 1.00 0.33 H new ATOM 0 HA CYS A 194 -12.559 -4.460 -4.544 1.00 0.36 H new ATOM 0 HB2 CYS A 194 -13.005 -6.821 -3.691 1.00 0.48 H new ATOM 0 HB3 CYS A 194 -12.162 -6.380 -2.220 1.00 0.48 H new ATOM 0 HG CYS A 194 -14.078 -4.129 -1.868 1.00 1.69 H new ATOM 724 N CYS A 195 -10.088 -3.519 -3.141 1.00 0.27 N ATOM 725 CA CYS A 195 -9.411 -2.554 -2.280 1.00 0.25 C ATOM 726 C CYS A 195 -8.888 -1.372 -3.093 1.00 0.23 C ATOM 727 O CYS A 195 -8.721 -1.475 -4.307 1.00 0.29 O ATOM 728 CB CYS A 195 -8.264 -3.239 -1.521 1.00 0.28 C ATOM 729 SG CYS A 195 -8.818 -4.502 -0.351 1.00 0.52 S ATOM 0 H CYS A 195 -9.533 -3.847 -3.931 1.00 0.27 H new ATOM 0 HA CYS A 195 -10.131 -2.171 -1.557 1.00 0.25 H new ATOM 0 HB2 CYS A 195 -7.586 -3.696 -2.241 1.00 0.28 H new ATOM 0 HB3 CYS A 195 -7.694 -2.482 -0.982 1.00 0.28 H new ATOM 0 HG CYS A 195 -8.713 -5.676 -0.898 1.00 0.52 H new ATOM 735 N ALA A 196 -8.676 -0.244 -2.423 1.00 0.26 N ATOM 736 CA ALA A 196 -8.074 0.929 -3.047 1.00 0.26 C ATOM 737 C ALA A 196 -6.906 1.416 -2.214 1.00 0.25 C ATOM 738 O ALA A 196 -6.867 1.191 -1.005 1.00 0.39 O ATOM 739 CB ALA A 196 -9.081 2.051 -3.205 1.00 0.37 C ATOM 0 H ALA A 196 -8.915 -0.117 -1.439 1.00 0.26 H new ATOM 0 HA ALA A 196 -7.727 0.637 -4.038 1.00 0.26 H new ATOM 0 HB1 ALA A 196 -8.599 2.909 -3.673 1.00 0.37 H new ATOM 0 HB2 ALA A 196 -9.907 1.713 -3.831 1.00 0.37 H new ATOM 0 HB3 ALA A 196 -9.462 2.339 -2.225 1.00 0.37 H new ATOM 745 N VAL A 197 -5.967 2.090 -2.848 1.00 0.23 N ATOM 746 CA VAL A 197 -4.792 2.576 -2.139 1.00 0.23 C ATOM 747 C VAL A 197 -4.709 4.093 -2.171 1.00 0.24 C ATOM 748 O VAL A 197 -4.753 4.717 -3.229 1.00 0.36 O ATOM 749 CB VAL A 197 -3.483 2.015 -2.716 1.00 0.29 C ATOM 750 CG1 VAL A 197 -2.300 2.361 -1.823 1.00 0.94 C ATOM 751 CG2 VAL A 197 -3.587 0.521 -2.926 1.00 1.06 C ATOM 0 H VAL A 197 -5.990 2.314 -3.843 1.00 0.23 H new ATOM 0 HA VAL A 197 -4.908 2.228 -1.112 1.00 0.23 H new ATOM 0 HB VAL A 197 -3.314 2.481 -3.687 1.00 0.29 H new ATOM 0 HG11 VAL A 197 -1.386 1.952 -2.255 1.00 0.94 H new ATOM 0 HG12 VAL A 197 -2.210 3.444 -1.742 1.00 0.94 H new ATOM 0 HG13 VAL A 197 -2.455 1.935 -0.832 1.00 0.94 H new ATOM 0 HG21 VAL A 197 -2.649 0.145 -3.335 1.00 1.06 H new ATOM 0 HG22 VAL A 197 -3.789 0.033 -1.973 1.00 1.06 H new ATOM 0 HG23 VAL A 197 -4.398 0.307 -3.622 1.00 1.06 H new ATOM 761 N TYR A 198 -4.593 4.669 -0.997 1.00 0.29 N ATOM 762 CA TYR A 198 -4.353 6.089 -0.842 1.00 0.37 C ATOM 763 C TYR A 198 -3.665 6.335 0.497 1.00 0.45 C ATOM 764 O TYR A 198 -3.827 5.561 1.429 1.00 0.88 O ATOM 765 CB TYR A 198 -5.639 6.895 -1.024 1.00 0.93 C ATOM 766 CG TYR A 198 -6.744 6.629 -0.063 1.00 0.33 C ATOM 767 CD1 TYR A 198 -6.800 7.374 1.068 1.00 0.69 C ATOM 768 CD2 TYR A 198 -7.739 5.697 -0.308 1.00 0.53 C ATOM 769 CE1 TYR A 198 -7.822 7.227 1.976 1.00 1.46 C ATOM 770 CE2 TYR A 198 -8.772 5.520 0.590 1.00 1.18 C ATOM 771 CZ TYR A 198 -8.810 6.295 1.734 1.00 1.70 C ATOM 772 OH TYR A 198 -9.846 6.159 2.626 1.00 2.49 O ATOM 0 H TYR A 198 -4.663 4.163 -0.114 1.00 0.29 H new ATOM 0 HA TYR A 198 -3.683 6.440 -1.627 1.00 0.37 H new ATOM 0 HB2 TYR A 198 -5.387 7.954 -0.966 1.00 0.93 H new ATOM 0 HB3 TYR A 198 -6.014 6.712 -2.031 1.00 0.93 H new ATOM 0 HD1 TYR A 198 -6.024 8.100 1.260 1.00 0.69 H new ATOM 0 HD2 TYR A 198 -7.706 5.104 -1.210 1.00 0.53 H new ATOM 0 HE1 TYR A 198 -7.851 7.834 2.869 1.00 1.46 H new ATOM 0 HE2 TYR A 198 -9.541 4.785 0.401 1.00 1.18 H new ATOM 0 HH TYR A 198 -10.530 5.569 2.246 1.00 2.49 H new ATOM 782 N ARG A 199 -2.862 7.373 0.596 1.00 0.34 N ATOM 783 CA ARG A 199 -2.015 7.535 1.771 1.00 0.45 C ATOM 784 C ARG A 199 -2.400 8.768 2.569 1.00 0.51 C ATOM 785 O ARG A 199 -2.563 9.850 2.015 1.00 0.60 O ATOM 786 CB ARG A 199 -0.536 7.576 1.387 1.00 0.58 C ATOM 787 CG ARG A 199 -0.195 8.567 0.289 1.00 0.81 C ATOM 788 CD ARG A 199 1.284 8.503 -0.045 1.00 0.80 C ATOM 789 NE ARG A 199 2.096 9.039 1.044 1.00 1.01 N ATOM 790 CZ ARG A 199 3.372 9.390 0.935 1.00 1.23 C ATOM 791 NH1 ARG A 199 3.998 9.315 -0.234 1.00 1.49 N ATOM 792 NH2 ARG A 199 4.018 9.836 2.005 1.00 1.57 N ATOM 0 H ARG A 199 -2.774 8.108 -0.106 1.00 0.34 H new ATOM 0 HA ARG A 199 -2.174 6.664 2.407 1.00 0.45 H new ATOM 0 HB2 ARG A 199 0.049 7.820 2.273 1.00 0.58 H new ATOM 0 HB3 ARG A 199 -0.229 6.580 1.067 1.00 0.58 H new ATOM 0 HG2 ARG A 199 -0.785 8.349 -0.601 1.00 0.81 H new ATOM 0 HG3 ARG A 199 -0.459 9.576 0.607 1.00 0.81 H new ATOM 0 HD2 ARG A 199 1.571 7.470 -0.241 1.00 0.80 H new ATOM 0 HD3 ARG A 199 1.478 9.066 -0.958 1.00 0.80 H new ATOM 0 HE ARG A 199 1.651 9.152 1.955 1.00 1.01 H new ATOM 0 HH11 ARG A 199 3.498 8.985 -1.060 1.00 1.49 H new ATOM 0 HH12 ARG A 199 4.978 9.587 -0.306 1.00 1.49 H new ATOM 0 HH21 ARG A 199 3.534 9.907 2.900 1.00 1.57 H new ATOM 0 HH22 ARG A 199 4.998 10.108 1.932 1.00 1.57 H new ATOM 806 N ILE A 200 -2.551 8.599 3.870 1.00 0.61 N ATOM 807 CA ILE A 200 -2.972 9.689 4.730 1.00 0.66 C ATOM 808 C ILE A 200 -1.798 10.544 5.164 1.00 0.75 C ATOM 809 O ILE A 200 -0.832 10.064 5.761 1.00 0.88 O ATOM 810 CB ILE A 200 -3.721 9.180 5.977 1.00 0.81 C ATOM 811 CG1 ILE A 200 -4.967 8.422 5.552 1.00 0.82 C ATOM 812 CG2 ILE A 200 -4.102 10.331 6.896 1.00 0.88 C ATOM 813 CD1 ILE A 200 -6.116 9.299 5.102 1.00 0.80 C ATOM 0 H ILE A 200 -2.388 7.716 4.354 1.00 0.61 H new ATOM 0 HA ILE A 200 -3.654 10.299 4.138 1.00 0.66 H new ATOM 0 HB ILE A 200 -3.057 8.513 6.527 1.00 0.81 H new ATOM 0 HG12 ILE A 200 -4.705 7.744 4.739 1.00 0.82 H new ATOM 0 HG13 ILE A 200 -5.303 7.805 6.385 1.00 0.82 H new ATOM 0 HG21 ILE A 200 -4.629 9.942 7.767 1.00 0.88 H new ATOM 0 HG22 ILE A 200 -3.201 10.852 7.220 1.00 0.88 H new ATOM 0 HG23 ILE A 200 -4.750 11.025 6.360 1.00 0.88 H new ATOM 0 HD11 ILE A 200 -6.962 8.673 4.818 1.00 0.80 H new ATOM 0 HD12 ILE A 200 -6.411 9.959 5.918 1.00 0.80 H new ATOM 0 HD13 ILE A 200 -5.804 9.897 4.246 1.00 0.80 H new ATOM 825 N GLN A 201 -1.913 11.814 4.850 1.00 0.75 N ATOM 826 CA GLN A 201 -0.974 12.817 5.289 1.00 0.91 C ATOM 827 C GLN A 201 -1.522 13.474 6.551 1.00 0.98 C ATOM 828 O GLN A 201 -2.284 12.841 7.276 1.00 0.99 O ATOM 829 CB GLN A 201 -0.754 13.847 4.183 1.00 0.98 C ATOM 830 CG GLN A 201 0.407 13.522 3.251 1.00 1.22 C ATOM 831 CD GLN A 201 0.746 14.654 2.301 1.00 1.76 C ATOM 832 OE1 GLN A 201 1.212 14.427 1.185 1.00 2.41 O ATOM 833 NE2 GLN A 201 0.531 15.883 2.735 1.00 2.39 N ATOM 0 H GLN A 201 -2.671 12.183 4.276 1.00 0.75 H new ATOM 0 HA GLN A 201 -0.010 12.361 5.513 1.00 0.91 H new ATOM 0 HB2 GLN A 201 -1.667 13.931 3.593 1.00 0.98 H new ATOM 0 HB3 GLN A 201 -0.578 14.821 4.639 1.00 0.98 H new ATOM 0 HG2 GLN A 201 1.287 13.281 3.848 1.00 1.22 H new ATOM 0 HG3 GLN A 201 0.161 12.632 2.672 1.00 1.22 H new ATOM 0 HE21 GLN A 201 0.143 16.035 3.666 1.00 2.39 H new ATOM 0 HE22 GLN A 201 0.753 16.680 2.139 1.00 2.39 H new ATOM 842 N ASP A 202 -1.147 14.724 6.810 1.00 1.08 N ATOM 843 CA ASP A 202 -1.640 15.465 7.981 1.00 1.18 C ATOM 844 C ASP A 202 -3.167 15.494 8.027 1.00 1.09 C ATOM 845 O ASP A 202 -3.794 16.433 7.529 1.00 1.07 O ATOM 846 CB ASP A 202 -1.137 16.899 7.932 1.00 1.30 C ATOM 847 CG ASP A 202 -1.423 17.673 9.209 1.00 1.45 C ATOM 848 OD1 ASP A 202 -0.633 17.563 10.171 1.00 1.84 O ATOM 849 OD2 ASP A 202 -2.429 18.412 9.255 1.00 1.91 O ATOM 0 H ASP A 202 -0.500 15.252 6.225 1.00 1.08 H new ATOM 0 HA ASP A 202 -1.269 14.955 8.870 1.00 1.18 H new ATOM 0 HB2 ASP A 202 -0.062 16.895 7.749 1.00 1.30 H new ATOM 0 HB3 ASP A 202 -1.602 17.413 7.091 1.00 1.30 H new ATOM 854 N GLY A 203 -3.756 14.455 8.602 1.00 1.11 N ATOM 855 CA GLY A 203 -5.196 14.364 8.713 1.00 1.12 C ATOM 856 C GLY A 203 -5.898 14.325 7.367 1.00 0.99 C ATOM 857 O GLY A 203 -7.127 14.392 7.310 1.00 1.07 O ATOM 0 H GLY A 203 -3.252 13.662 8.999 1.00 1.11 H new ATOM 0 HA2 GLY A 203 -5.455 13.468 9.277 1.00 1.12 H new ATOM 0 HA3 GLY A 203 -5.565 15.217 9.283 1.00 1.12 H new ATOM 861 N GLU A 204 -5.140 14.215 6.279 1.00 0.86 N ATOM 862 CA GLU A 204 -5.732 14.272 4.953 1.00 0.79 C ATOM 863 C GLU A 204 -5.385 13.034 4.148 1.00 0.68 C ATOM 864 O GLU A 204 -4.621 12.192 4.592 1.00 0.67 O ATOM 865 CB GLU A 204 -5.246 15.518 4.230 1.00 0.83 C ATOM 866 CG GLU A 204 -3.783 15.449 3.866 1.00 0.82 C ATOM 867 CD GLU A 204 -3.261 16.734 3.268 1.00 0.98 C ATOM 868 OE1 GLU A 204 -3.688 17.093 2.151 1.00 1.54 O ATOM 869 OE2 GLU A 204 -2.419 17.388 3.910 1.00 1.51 O ATOM 0 H GLU A 204 -4.128 14.088 6.292 1.00 0.86 H new ATOM 0 HA GLU A 204 -6.816 14.313 5.059 1.00 0.79 H new ATOM 0 HB2 GLU A 204 -5.835 15.660 3.324 1.00 0.83 H new ATOM 0 HB3 GLU A 204 -5.418 16.390 4.862 1.00 0.83 H new ATOM 0 HG2 GLU A 204 -3.204 15.208 4.757 1.00 0.82 H new ATOM 0 HG3 GLU A 204 -3.629 14.636 3.157 1.00 0.82 H new ATOM 876 N LYS A 205 -5.934 12.943 2.953 1.00 0.69 N ATOM 877 CA LYS A 205 -5.772 11.756 2.127 1.00 0.62 C ATOM 878 C LYS A 205 -5.174 12.116 0.776 1.00 0.61 C ATOM 879 O LYS A 205 -5.672 12.997 0.076 1.00 0.71 O ATOM 880 CB LYS A 205 -7.123 11.072 1.916 1.00 0.73 C ATOM 881 CG LYS A 205 -8.021 11.152 3.131 1.00 0.90 C ATOM 882 CD LYS A 205 -9.489 10.983 2.787 1.00 1.16 C ATOM 883 CE LYS A 205 -9.749 9.831 1.831 1.00 1.29 C ATOM 884 NZ LYS A 205 -11.198 9.666 1.547 1.00 1.69 N ATOM 0 H LYS A 205 -6.499 13.678 2.528 1.00 0.69 H new ATOM 0 HA LYS A 205 -5.095 11.075 2.643 1.00 0.62 H new ATOM 0 HB2 LYS A 205 -7.628 11.532 1.067 1.00 0.73 H new ATOM 0 HB3 LYS A 205 -6.958 10.025 1.661 1.00 0.73 H new ATOM 0 HG2 LYS A 205 -7.729 10.382 3.845 1.00 0.90 H new ATOM 0 HG3 LYS A 205 -7.876 12.114 3.622 1.00 0.90 H new ATOM 0 HD2 LYS A 205 -10.055 10.820 3.705 1.00 1.16 H new ATOM 0 HD3 LYS A 205 -9.861 11.907 2.343 1.00 1.16 H new ATOM 0 HE2 LYS A 205 -9.213 10.005 0.898 1.00 1.29 H new ATOM 0 HE3 LYS A 205 -9.355 8.909 2.258 1.00 1.29 H new ATOM 0 HZ1 LYS A 205 -11.335 8.870 0.891 1.00 1.69 H new ATOM 0 HZ2 LYS A 205 -11.706 9.475 2.434 1.00 1.69 H new ATOM 0 HZ3 LYS A 205 -11.569 10.537 1.117 1.00 1.69 H new ATOM 898 N LYS A 206 -4.104 11.435 0.431 1.00 0.57 N ATOM 899 CA LYS A 206 -3.467 11.573 -0.868 1.00 0.61 C ATOM 900 C LYS A 206 -3.687 10.291 -1.656 1.00 0.57 C ATOM 901 O LYS A 206 -2.995 9.297 -1.433 1.00 0.60 O ATOM 902 CB LYS A 206 -1.967 11.823 -0.699 1.00 0.65 C ATOM 903 CG LYS A 206 -1.638 13.028 0.163 1.00 0.84 C ATOM 904 CD LYS A 206 -1.921 14.332 -0.560 1.00 1.09 C ATOM 905 CE LYS A 206 -1.654 15.525 0.340 1.00 1.23 C ATOM 906 NZ LYS A 206 -1.653 16.807 -0.412 1.00 1.66 N ATOM 0 H LYS A 206 -3.645 10.763 1.046 1.00 0.57 H new ATOM 0 HA LYS A 206 -3.901 12.420 -1.399 1.00 0.61 H new ATOM 0 HB2 LYS A 206 -1.508 10.938 -0.259 1.00 0.65 H new ATOM 0 HB3 LYS A 206 -1.518 11.959 -1.683 1.00 0.65 H new ATOM 0 HG2 LYS A 206 -2.222 12.988 1.082 1.00 0.84 H new ATOM 0 HG3 LYS A 206 -0.587 12.993 0.451 1.00 0.84 H new ATOM 0 HD2 LYS A 206 -1.299 14.399 -1.452 1.00 1.09 H new ATOM 0 HD3 LYS A 206 -2.959 14.349 -0.893 1.00 1.09 H new ATOM 0 HE2 LYS A 206 -2.412 15.565 1.122 1.00 1.23 H new ATOM 0 HE3 LYS A 206 -0.692 15.396 0.836 1.00 1.23 H new ATOM 0 HZ1 LYS A 206 -1.467 17.593 0.243 1.00 1.66 H new ATOM 0 HZ2 LYS A 206 -0.912 16.781 -1.141 1.00 1.66 H new ATOM 0 HZ3 LYS A 206 -2.579 16.945 -0.864 1.00 1.66 H new ATOM 920 N PRO A 207 -4.681 10.267 -2.551 1.00 0.52 N ATOM 921 CA PRO A 207 -5.029 9.058 -3.278 1.00 0.47 C ATOM 922 C PRO A 207 -4.002 8.687 -4.333 1.00 0.44 C ATOM 923 O PRO A 207 -3.771 9.429 -5.288 1.00 0.53 O ATOM 924 CB PRO A 207 -6.380 9.374 -3.921 1.00 0.54 C ATOM 925 CG PRO A 207 -6.806 10.689 -3.351 1.00 0.58 C ATOM 926 CD PRO A 207 -5.550 11.388 -2.920 1.00 0.56 C ATOM 0 HA PRO A 207 -5.064 8.197 -2.611 1.00 0.47 H new ATOM 0 HB2 PRO A 207 -6.293 9.428 -5.006 1.00 0.54 H new ATOM 0 HB3 PRO A 207 -7.110 8.596 -3.698 1.00 0.54 H new ATOM 0 HG2 PRO A 207 -7.344 11.279 -4.093 1.00 0.58 H new ATOM 0 HG3 PRO A 207 -7.481 10.547 -2.507 1.00 0.58 H new ATOM 0 HD2 PRO A 207 -5.122 11.987 -3.723 1.00 0.56 H new ATOM 0 HD3 PRO A 207 -5.726 12.060 -2.080 1.00 0.56 H new ATOM 934 N ILE A 208 -3.401 7.525 -4.150 1.00 0.36 N ATOM 935 CA ILE A 208 -2.388 7.025 -5.049 1.00 0.36 C ATOM 936 C ILE A 208 -3.022 6.177 -6.142 1.00 0.32 C ATOM 937 O ILE A 208 -4.083 5.583 -5.943 1.00 0.44 O ATOM 938 CB ILE A 208 -1.386 6.172 -4.258 1.00 0.42 C ATOM 939 CG1 ILE A 208 -1.111 6.843 -2.916 1.00 0.56 C ATOM 940 CG2 ILE A 208 -0.105 5.997 -5.039 1.00 0.52 C ATOM 941 CD1 ILE A 208 -0.453 5.947 -1.906 1.00 0.90 C ATOM 0 H ILE A 208 -3.606 6.902 -3.369 1.00 0.36 H new ATOM 0 HA ILE A 208 -1.875 7.869 -5.511 1.00 0.36 H new ATOM 0 HB ILE A 208 -1.809 5.182 -4.086 1.00 0.42 H new ATOM 0 HG12 ILE A 208 -0.477 7.714 -3.081 1.00 0.56 H new ATOM 0 HG13 ILE A 208 -2.052 7.207 -2.504 1.00 0.56 H new ATOM 0 HG21 ILE A 208 0.593 5.390 -4.462 1.00 0.52 H new ATOM 0 HG22 ILE A 208 -0.321 5.501 -5.986 1.00 0.52 H new ATOM 0 HG23 ILE A 208 0.339 6.973 -5.234 1.00 0.52 H new ATOM 0 HD11 ILE A 208 -0.292 6.499 -0.980 1.00 0.90 H new ATOM 0 HD12 ILE A 208 -1.094 5.088 -1.709 1.00 0.90 H new ATOM 0 HD13 ILE A 208 0.505 5.603 -2.295 1.00 0.90 H new ATOM 953 N GLY A 209 -2.381 6.132 -7.295 1.00 0.34 N ATOM 954 CA GLY A 209 -2.868 5.307 -8.370 1.00 0.37 C ATOM 955 C GLY A 209 -2.280 3.918 -8.314 1.00 0.31 C ATOM 956 O GLY A 209 -1.134 3.743 -7.903 1.00 0.33 O ATOM 0 H GLY A 209 -1.530 6.654 -7.505 1.00 0.34 H new ATOM 0 HA2 GLY A 209 -3.955 5.245 -8.318 1.00 0.37 H new ATOM 0 HA3 GLY A 209 -2.620 5.769 -9.325 1.00 0.37 H new ATOM 960 N TRP A 210 -3.054 2.929 -8.729 1.00 0.29 N ATOM 961 CA TRP A 210 -2.588 1.549 -8.734 1.00 0.27 C ATOM 962 C TRP A 210 -1.525 1.343 -9.807 1.00 0.27 C ATOM 963 O TRP A 210 -0.811 0.339 -9.809 1.00 0.30 O ATOM 964 CB TRP A 210 -3.759 0.583 -8.949 1.00 0.31 C ATOM 965 CG TRP A 210 -4.655 0.449 -7.752 1.00 0.28 C ATOM 966 CD1 TRP A 210 -5.652 1.298 -7.366 1.00 0.31 C ATOM 967 CD2 TRP A 210 -4.633 -0.608 -6.787 1.00 0.26 C ATOM 968 NE1 TRP A 210 -6.245 0.840 -6.213 1.00 0.30 N ATOM 969 CE2 TRP A 210 -5.636 -0.332 -5.841 1.00 0.26 C ATOM 970 CE3 TRP A 210 -3.862 -1.760 -6.632 1.00 0.29 C ATOM 971 CZ2 TRP A 210 -5.883 -1.168 -4.757 1.00 0.26 C ATOM 972 CZ3 TRP A 210 -4.109 -2.589 -5.554 1.00 0.31 C ATOM 973 CH2 TRP A 210 -5.114 -2.288 -4.627 1.00 0.29 C ATOM 0 H TRP A 210 -4.008 3.054 -9.067 1.00 0.29 H new ATOM 0 HA TRP A 210 -2.141 1.338 -7.762 1.00 0.27 H new ATOM 0 HB2 TRP A 210 -4.350 0.925 -9.798 1.00 0.31 H new ATOM 0 HB3 TRP A 210 -3.365 -0.399 -9.210 1.00 0.31 H new ATOM 0 HD1 TRP A 210 -5.934 2.199 -7.890 1.00 0.31 H new ATOM 0 HE1 TRP A 210 -7.011 1.296 -5.717 1.00 0.30 H new ATOM 0 HE3 TRP A 210 -3.085 -2.000 -7.343 1.00 0.29 H new ATOM 0 HZ2 TRP A 210 -6.658 -0.938 -4.041 1.00 0.26 H new ATOM 0 HZ3 TRP A 210 -3.517 -3.483 -5.425 1.00 0.31 H new ATOM 0 HH2 TRP A 210 -5.284 -2.954 -3.794 1.00 0.29 H new ATOM 984 N ASP A 211 -1.413 2.312 -10.706 1.00 0.27 N ATOM 985 CA ASP A 211 -0.422 2.263 -11.771 1.00 0.29 C ATOM 986 C ASP A 211 0.834 3.022 -11.357 1.00 0.25 C ATOM 987 O ASP A 211 1.792 3.123 -12.123 1.00 0.32 O ATOM 988 CB ASP A 211 -0.984 2.856 -13.067 1.00 0.39 C ATOM 989 CG ASP A 211 -2.197 2.107 -13.580 1.00 1.49 C ATOM 990 OD1 ASP A 211 -3.333 2.484 -13.218 1.00 2.30 O ATOM 991 OD2 ASP A 211 -2.028 1.144 -14.359 1.00 2.30 O ATOM 0 H ASP A 211 -2.000 3.146 -10.718 1.00 0.27 H new ATOM 0 HA ASP A 211 -0.167 1.218 -11.950 1.00 0.29 H new ATOM 0 HB2 ASP A 211 -1.252 3.899 -12.897 1.00 0.39 H new ATOM 0 HB3 ASP A 211 -0.207 2.847 -13.832 1.00 0.39 H new ATOM 996 N THR A 212 0.816 3.555 -10.140 1.00 0.23 N ATOM 997 CA THR A 212 1.955 4.273 -9.588 1.00 0.23 C ATOM 998 C THR A 212 3.065 3.302 -9.194 1.00 0.21 C ATOM 999 O THR A 212 2.816 2.306 -8.514 1.00 0.26 O ATOM 1000 CB THR A 212 1.521 5.108 -8.364 1.00 0.25 C ATOM 1001 OG1 THR A 212 0.600 6.123 -8.786 1.00 0.30 O ATOM 1002 CG2 THR A 212 2.708 5.751 -7.649 1.00 0.31 C ATOM 0 H THR A 212 0.014 3.501 -9.512 1.00 0.23 H new ATOM 0 HA THR A 212 2.339 4.945 -10.355 1.00 0.23 H new ATOM 0 HB THR A 212 1.044 4.433 -7.653 1.00 0.25 H new ATOM 0 HG1 THR A 212 0.444 6.750 -8.049 1.00 0.30 H new ATOM 0 HG21 THR A 212 2.350 6.327 -6.796 1.00 0.31 H new ATOM 0 HG22 THR A 212 3.389 4.973 -7.302 1.00 0.31 H new ATOM 0 HG23 THR A 212 3.233 6.412 -8.338 1.00 0.31 H new ATOM 1010 N ASP A 213 4.279 3.584 -9.658 1.00 0.23 N ATOM 1011 CA ASP A 213 5.440 2.769 -9.323 1.00 0.25 C ATOM 1012 C ASP A 213 5.763 2.925 -7.840 1.00 0.23 C ATOM 1013 O ASP A 213 6.093 4.017 -7.377 1.00 0.29 O ATOM 1014 CB ASP A 213 6.636 3.181 -10.181 1.00 0.32 C ATOM 1015 CG ASP A 213 7.722 2.127 -10.220 1.00 0.93 C ATOM 1016 OD1 ASP A 213 8.529 2.058 -9.274 1.00 1.73 O ATOM 1017 OD2 ASP A 213 7.784 1.376 -11.214 1.00 1.66 O ATOM 0 H ASP A 213 4.484 4.374 -10.269 1.00 0.23 H new ATOM 0 HA ASP A 213 5.218 1.721 -9.526 1.00 0.25 H new ATOM 0 HB2 ASP A 213 6.296 3.383 -11.197 1.00 0.32 H new ATOM 0 HB3 ASP A 213 7.052 4.111 -9.793 1.00 0.32 H new ATOM 1022 N ILE A 214 5.668 1.826 -7.107 1.00 0.23 N ATOM 1023 CA ILE A 214 5.725 1.851 -5.647 1.00 0.21 C ATOM 1024 C ILE A 214 7.102 2.273 -5.118 1.00 0.19 C ATOM 1025 O ILE A 214 7.228 2.750 -3.990 1.00 0.21 O ATOM 1026 CB ILE A 214 5.336 0.472 -5.057 1.00 0.22 C ATOM 1027 CG1 ILE A 214 5.410 0.500 -3.531 1.00 0.24 C ATOM 1028 CG2 ILE A 214 6.216 -0.633 -5.623 1.00 0.26 C ATOM 1029 CD1 ILE A 214 5.143 -0.833 -2.886 1.00 0.29 C ATOM 0 H ILE A 214 5.550 0.893 -7.502 1.00 0.23 H new ATOM 0 HA ILE A 214 5.004 2.601 -5.322 1.00 0.21 H new ATOM 0 HB ILE A 214 4.307 0.258 -5.345 1.00 0.22 H new ATOM 0 HG12 ILE A 214 6.399 0.847 -3.231 1.00 0.24 H new ATOM 0 HG13 ILE A 214 4.689 1.226 -3.155 1.00 0.24 H new ATOM 0 HG21 ILE A 214 5.921 -1.590 -5.192 1.00 0.26 H new ATOM 0 HG22 ILE A 214 6.100 -0.672 -6.706 1.00 0.26 H new ATOM 0 HG23 ILE A 214 7.258 -0.430 -5.377 1.00 0.26 H new ATOM 0 HD11 ILE A 214 5.213 -0.734 -1.803 1.00 0.29 H new ATOM 0 HD12 ILE A 214 4.143 -1.174 -3.155 1.00 0.29 H new ATOM 0 HD13 ILE A 214 5.879 -1.559 -3.232 1.00 0.29 H new ATOM 1041 N SER A 215 8.124 2.135 -5.944 1.00 0.21 N ATOM 1042 CA SER A 215 9.493 2.404 -5.518 1.00 0.23 C ATOM 1043 C SER A 215 9.737 3.907 -5.310 1.00 0.25 C ATOM 1044 O SER A 215 10.809 4.312 -4.857 1.00 0.31 O ATOM 1045 CB SER A 215 10.471 1.825 -6.539 1.00 0.31 C ATOM 1046 OG SER A 215 10.456 2.564 -7.746 1.00 1.07 O ATOM 0 H SER A 215 8.035 1.838 -6.916 1.00 0.21 H new ATOM 0 HA SER A 215 9.656 1.920 -4.555 1.00 0.23 H new ATOM 0 HB2 SER A 215 11.478 1.827 -6.122 1.00 0.31 H new ATOM 0 HB3 SER A 215 10.213 0.786 -6.744 1.00 0.31 H new ATOM 0 HG SER A 215 9.868 2.121 -8.393 1.00 1.07 H new ATOM 1052 N TRP A 216 8.758 4.736 -5.670 1.00 0.25 N ATOM 1053 CA TRP A 216 8.845 6.172 -5.404 1.00 0.33 C ATOM 1054 C TRP A 216 8.241 6.487 -4.037 1.00 0.33 C ATOM 1055 O TRP A 216 8.365 7.598 -3.520 1.00 0.45 O ATOM 1056 CB TRP A 216 8.102 6.978 -6.474 1.00 0.40 C ATOM 1057 CG TRP A 216 8.526 6.680 -7.879 1.00 1.13 C ATOM 1058 CD1 TRP A 216 9.781 6.378 -8.318 1.00 1.75 C ATOM 1059 CD2 TRP A 216 7.684 6.680 -9.035 1.00 1.92 C ATOM 1060 NE1 TRP A 216 9.768 6.176 -9.676 1.00 2.60 N ATOM 1061 CE2 TRP A 216 8.492 6.358 -10.139 1.00 2.73 C ATOM 1062 CE3 TRP A 216 6.322 6.916 -9.242 1.00 2.29 C ATOM 1063 CZ2 TRP A 216 7.984 6.265 -11.431 1.00 3.66 C ATOM 1064 CZ3 TRP A 216 5.818 6.825 -10.524 1.00 3.27 C ATOM 1065 CH2 TRP A 216 6.647 6.502 -11.605 1.00 3.87 C ATOM 0 H TRP A 216 7.903 4.442 -6.142 1.00 0.25 H new ATOM 0 HA TRP A 216 9.898 6.451 -5.420 1.00 0.33 H new ATOM 0 HB2 TRP A 216 7.033 6.784 -6.381 1.00 0.40 H new ATOM 0 HB3 TRP A 216 8.251 8.040 -6.280 1.00 0.40 H new ATOM 0 HD1 TRP A 216 10.657 6.308 -7.690 1.00 1.75 H new ATOM 0 HE1 TRP A 216 10.577 5.930 -10.247 1.00 2.60 H new ATOM 0 HE3 TRP A 216 5.675 7.165 -8.414 1.00 2.29 H new ATOM 0 HZ2 TRP A 216 8.621 6.015 -12.266 1.00 3.66 H new ATOM 0 HZ3 TRP A 216 4.767 7.006 -10.696 1.00 3.27 H new ATOM 0 HH2 TRP A 216 6.223 6.439 -12.596 1.00 3.87 H new ATOM 1076 N LEU A 217 7.577 5.494 -3.469 1.00 0.25 N ATOM 1077 CA LEU A 217 6.835 5.647 -2.226 1.00 0.26 C ATOM 1078 C LEU A 217 7.572 4.977 -1.090 1.00 0.24 C ATOM 1079 O LEU A 217 7.036 4.749 -0.011 1.00 0.25 O ATOM 1080 CB LEU A 217 5.436 5.072 -2.412 1.00 0.26 C ATOM 1081 CG LEU A 217 4.590 5.876 -3.397 1.00 0.47 C ATOM 1082 CD1 LEU A 217 4.968 5.590 -4.836 1.00 1.21 C ATOM 1083 CD2 LEU A 217 3.111 5.622 -3.206 1.00 0.92 C ATOM 0 H LEU A 217 7.537 4.552 -3.859 1.00 0.25 H new ATOM 0 HA LEU A 217 6.744 6.703 -1.971 1.00 0.26 H new ATOM 0 HB2 LEU A 217 5.515 4.043 -2.764 1.00 0.26 H new ATOM 0 HB3 LEU A 217 4.930 5.041 -1.447 1.00 0.26 H new ATOM 0 HG LEU A 217 4.797 6.925 -3.185 1.00 0.47 H new ATOM 0 HD11 LEU A 217 4.341 6.183 -5.502 1.00 1.21 H new ATOM 0 HD12 LEU A 217 6.014 5.850 -4.996 1.00 1.21 H new ATOM 0 HD13 LEU A 217 4.821 4.531 -5.047 1.00 1.21 H new ATOM 0 HD21 LEU A 217 2.544 6.213 -3.926 1.00 0.92 H new ATOM 0 HD22 LEU A 217 2.901 4.564 -3.360 1.00 0.92 H new ATOM 0 HD23 LEU A 217 2.821 5.906 -2.195 1.00 0.92 H new ATOM 1095 N THR A 218 8.815 4.672 -1.376 1.00 0.25 N ATOM 1096 CA THR A 218 9.736 4.109 -0.403 1.00 0.26 C ATOM 1097 C THR A 218 9.823 4.963 0.857 1.00 0.28 C ATOM 1098 O THR A 218 9.792 6.194 0.787 1.00 0.32 O ATOM 1099 CB THR A 218 11.147 4.008 -0.983 1.00 0.31 C ATOM 1100 OG1 THR A 218 11.094 3.568 -2.343 1.00 0.32 O ATOM 1101 CG2 THR A 218 11.962 3.038 -0.161 1.00 0.39 C ATOM 0 H THR A 218 9.225 4.807 -2.300 1.00 0.25 H new ATOM 0 HA THR A 218 9.348 3.121 -0.154 1.00 0.26 H new ATOM 0 HB THR A 218 11.615 4.992 -0.953 1.00 0.31 H new ATOM 0 HG1 THR A 218 11.050 4.346 -2.937 1.00 0.32 H new ATOM 0 HG21 THR A 218 12.968 2.966 -0.575 1.00 0.39 H new ATOM 0 HG22 THR A 218 12.018 3.391 0.869 1.00 0.39 H new ATOM 0 HG23 THR A 218 11.490 2.056 -0.183 1.00 0.39 H new ATOM 1109 N GLY A 219 9.941 4.301 2.003 1.00 0.30 N ATOM 1110 CA GLY A 219 10.121 4.998 3.258 1.00 0.37 C ATOM 1111 C GLY A 219 8.844 5.647 3.745 1.00 0.38 C ATOM 1112 O GLY A 219 8.802 6.228 4.830 1.00 0.53 O ATOM 0 H GLY A 219 9.914 3.284 2.082 1.00 0.30 H new ATOM 0 HA2 GLY A 219 10.480 4.297 4.012 1.00 0.37 H new ATOM 0 HA3 GLY A 219 10.891 5.761 3.140 1.00 0.37 H new ATOM 1116 N GLU A 220 7.804 5.539 2.939 1.00 0.29 N ATOM 1117 CA GLU A 220 6.528 6.161 3.240 1.00 0.29 C ATOM 1118 C GLU A 220 5.536 5.097 3.702 1.00 0.28 C ATOM 1119 O GLU A 220 5.832 3.900 3.647 1.00 0.40 O ATOM 1120 CB GLU A 220 6.005 6.895 1.998 1.00 0.36 C ATOM 1121 CG GLU A 220 6.991 7.911 1.426 1.00 1.26 C ATOM 1122 CD GLU A 220 7.237 9.097 2.340 1.00 1.53 C ATOM 1123 OE1 GLU A 220 6.636 10.168 2.099 1.00 2.02 O ATOM 1124 OE2 GLU A 220 8.035 8.971 3.294 1.00 2.16 O ATOM 0 H GLU A 220 7.819 5.020 2.061 1.00 0.29 H new ATOM 0 HA GLU A 220 6.653 6.888 4.042 1.00 0.29 H new ATOM 0 HB2 GLU A 220 5.764 6.162 1.228 1.00 0.36 H new ATOM 0 HB3 GLU A 220 5.077 7.406 2.253 1.00 0.36 H new ATOM 0 HG2 GLU A 220 7.940 7.413 1.227 1.00 1.26 H new ATOM 0 HG3 GLU A 220 6.614 8.272 0.469 1.00 1.26 H new ATOM 1131 N GLU A 221 4.379 5.526 4.186 1.00 0.30 N ATOM 1132 CA GLU A 221 3.345 4.593 4.605 1.00 0.30 C ATOM 1133 C GLU A 221 2.065 4.821 3.826 1.00 0.31 C ATOM 1134 O GLU A 221 1.528 5.929 3.771 1.00 0.38 O ATOM 1135 CB GLU A 221 3.077 4.682 6.109 1.00 0.38 C ATOM 1136 CG GLU A 221 4.252 4.232 6.965 1.00 0.46 C ATOM 1137 CD GLU A 221 3.890 4.066 8.426 1.00 1.26 C ATOM 1138 OE1 GLU A 221 3.843 2.911 8.905 1.00 2.01 O ATOM 1139 OE2 GLU A 221 3.654 5.089 9.104 1.00 2.03 O ATOM 0 H GLU A 221 4.134 6.510 4.298 1.00 0.30 H new ATOM 0 HA GLU A 221 3.710 3.588 4.391 1.00 0.30 H new ATOM 0 HB2 GLU A 221 2.825 5.711 6.364 1.00 0.38 H new ATOM 0 HB3 GLU A 221 2.207 4.072 6.351 1.00 0.38 H new ATOM 0 HG2 GLU A 221 4.633 3.286 6.581 1.00 0.46 H new ATOM 0 HG3 GLU A 221 5.059 4.960 6.877 1.00 0.46 H new ATOM 1146 N LEU A 222 1.595 3.750 3.227 1.00 0.26 N ATOM 1147 CA LEU A 222 0.426 3.768 2.386 1.00 0.27 C ATOM 1148 C LEU A 222 -0.760 3.233 3.164 1.00 0.25 C ATOM 1149 O LEU A 222 -0.581 2.647 4.225 1.00 0.32 O ATOM 1150 CB LEU A 222 0.705 2.906 1.163 1.00 0.29 C ATOM 1151 CG LEU A 222 1.971 3.276 0.383 1.00 0.54 C ATOM 1152 CD1 LEU A 222 2.030 2.522 -0.936 1.00 1.19 C ATOM 1153 CD2 LEU A 222 2.048 4.776 0.154 1.00 1.19 C ATOM 0 H LEU A 222 2.023 2.828 3.314 1.00 0.26 H new ATOM 0 HA LEU A 222 0.194 4.784 2.066 1.00 0.27 H new ATOM 0 HB2 LEU A 222 0.783 1.866 1.481 1.00 0.29 H new ATOM 0 HB3 LEU A 222 -0.150 2.970 0.490 1.00 0.29 H new ATOM 0 HG LEU A 222 2.835 2.983 0.980 1.00 0.54 H new ATOM 0 HD11 LEU A 222 2.937 2.800 -1.474 1.00 1.19 H new ATOM 0 HD12 LEU A 222 2.037 1.449 -0.742 1.00 1.19 H new ATOM 0 HD13 LEU A 222 1.158 2.776 -1.539 1.00 1.19 H new ATOM 0 HD21 LEU A 222 2.955 5.013 -0.402 1.00 1.19 H new ATOM 0 HD22 LEU A 222 1.178 5.102 -0.416 1.00 1.19 H new ATOM 0 HD23 LEU A 222 2.066 5.290 1.115 1.00 1.19 H new ATOM 1165 N HIS A 223 -1.964 3.433 2.660 1.00 0.24 N ATOM 1166 CA HIS A 223 -3.142 3.056 3.406 1.00 0.26 C ATOM 1167 C HIS A 223 -4.238 2.525 2.469 1.00 0.28 C ATOM 1168 O HIS A 223 -4.686 3.202 1.549 1.00 0.46 O ATOM 1169 CB HIS A 223 -3.538 4.285 4.244 1.00 0.45 C ATOM 1170 CG HIS A 223 -4.984 4.499 4.510 1.00 0.94 C ATOM 1171 ND1 HIS A 223 -5.574 4.226 5.716 1.00 1.30 N ATOM 1172 CD2 HIS A 223 -5.930 5.071 3.745 1.00 1.85 C ATOM 1173 CE1 HIS A 223 -6.827 4.623 5.687 1.00 2.26 C ATOM 1174 NE2 HIS A 223 -7.073 5.143 4.501 1.00 2.63 N ATOM 0 H HIS A 223 -2.147 3.850 1.747 1.00 0.24 H new ATOM 0 HA HIS A 223 -2.961 2.223 4.085 1.00 0.26 H new ATOM 0 HB2 HIS A 223 -3.026 4.216 5.204 1.00 0.45 H new ATOM 0 HB3 HIS A 223 -3.154 5.173 3.741 1.00 0.45 H new ATOM 0 HD1 HIS A 223 -5.113 3.784 6.512 1.00 1.30 H new ATOM 0 HD2 HIS A 223 -5.812 5.410 2.726 1.00 1.85 H new ATOM 0 HE1 HIS A 223 -7.535 4.538 6.498 1.00 2.26 H new ATOM 1183 N VAL A 224 -4.631 1.282 2.688 1.00 0.27 N ATOM 1184 CA VAL A 224 -5.590 0.612 1.822 1.00 0.34 C ATOM 1185 C VAL A 224 -6.971 0.600 2.450 1.00 0.38 C ATOM 1186 O VAL A 224 -7.129 0.310 3.636 1.00 0.51 O ATOM 1187 CB VAL A 224 -5.164 -0.839 1.518 1.00 0.55 C ATOM 1188 CG1 VAL A 224 -6.206 -1.551 0.670 1.00 0.91 C ATOM 1189 CG2 VAL A 224 -3.839 -0.855 0.799 1.00 0.97 C ATOM 0 H VAL A 224 -4.298 0.711 3.465 1.00 0.27 H new ATOM 0 HA VAL A 224 -5.618 1.174 0.888 1.00 0.34 H new ATOM 0 HB VAL A 224 -5.070 -1.363 2.469 1.00 0.55 H new ATOM 0 HG11 VAL A 224 -5.878 -2.572 0.472 1.00 0.91 H new ATOM 0 HG12 VAL A 224 -7.156 -1.572 1.203 1.00 0.91 H new ATOM 0 HG13 VAL A 224 -6.331 -1.020 -0.274 1.00 0.91 H new ATOM 0 HG21 VAL A 224 -3.550 -1.885 0.591 1.00 0.97 H new ATOM 0 HG22 VAL A 224 -3.927 -0.306 -0.139 1.00 0.97 H new ATOM 0 HG23 VAL A 224 -3.080 -0.385 1.424 1.00 0.97 H new ATOM 1199 N GLU A 225 -7.961 0.925 1.643 1.00 0.38 N ATOM 1200 CA GLU A 225 -9.338 0.946 2.086 1.00 0.49 C ATOM 1201 C GLU A 225 -10.198 0.147 1.121 1.00 0.39 C ATOM 1202 O GLU A 225 -10.076 0.294 -0.094 1.00 0.46 O ATOM 1203 CB GLU A 225 -9.814 2.391 2.175 1.00 0.68 C ATOM 1204 CG GLU A 225 -9.053 3.188 3.220 1.00 0.93 C ATOM 1205 CD GLU A 225 -9.527 2.892 4.630 1.00 1.32 C ATOM 1206 OE1 GLU A 225 -8.759 2.283 5.408 1.00 1.78 O ATOM 1207 OE2 GLU A 225 -10.670 3.262 4.969 1.00 1.94 O ATOM 0 H GLU A 225 -7.833 1.181 0.664 1.00 0.38 H new ATOM 0 HA GLU A 225 -9.420 0.490 3.073 1.00 0.49 H new ATOM 0 HB2 GLU A 225 -9.699 2.869 1.202 1.00 0.68 H new ATOM 0 HB3 GLU A 225 -10.877 2.406 2.414 1.00 0.68 H new ATOM 0 HG2 GLU A 225 -7.990 2.962 3.142 1.00 0.93 H new ATOM 0 HG3 GLU A 225 -9.169 4.253 3.017 1.00 0.93 H new ATOM 1214 N VAL A 226 -11.044 -0.716 1.664 1.00 0.50 N ATOM 1215 CA VAL A 226 -11.889 -1.572 0.847 1.00 0.48 C ATOM 1216 C VAL A 226 -12.919 -0.746 0.088 1.00 0.52 C ATOM 1217 O VAL A 226 -13.599 0.104 0.662 1.00 0.69 O ATOM 1218 CB VAL A 226 -12.606 -2.642 1.702 1.00 0.64 C ATOM 1219 CG1 VAL A 226 -13.526 -3.504 0.849 1.00 1.12 C ATOM 1220 CG2 VAL A 226 -11.587 -3.512 2.417 1.00 1.12 C ATOM 0 H VAL A 226 -11.163 -0.842 2.669 1.00 0.50 H new ATOM 0 HA VAL A 226 -11.241 -2.081 0.133 1.00 0.48 H new ATOM 0 HB VAL A 226 -13.217 -2.127 2.443 1.00 0.64 H new ATOM 0 HG11 VAL A 226 -14.016 -4.247 1.479 1.00 1.12 H new ATOM 0 HG12 VAL A 226 -14.280 -2.874 0.377 1.00 1.12 H new ATOM 0 HG13 VAL A 226 -12.942 -4.009 0.080 1.00 1.12 H new ATOM 0 HG21 VAL A 226 -12.105 -4.261 3.016 1.00 1.12 H new ATOM 0 HG22 VAL A 226 -10.953 -4.009 1.682 1.00 1.12 H new ATOM 0 HG23 VAL A 226 -10.971 -2.891 3.067 1.00 1.12 H new ATOM 1230 N LEU A 227 -13.013 -0.987 -1.208 1.00 0.49 N ATOM 1231 CA LEU A 227 -13.964 -0.296 -2.049 1.00 0.65 C ATOM 1232 C LEU A 227 -15.314 -0.987 -1.969 1.00 0.83 C ATOM 1233 O LEU A 227 -15.672 -1.797 -2.826 1.00 0.94 O ATOM 1234 CB LEU A 227 -13.453 -0.267 -3.482 1.00 0.71 C ATOM 1235 CG LEU A 227 -12.202 0.583 -3.697 1.00 0.58 C ATOM 1236 CD1 LEU A 227 -11.547 0.259 -5.029 1.00 1.69 C ATOM 1237 CD2 LEU A 227 -12.559 2.058 -3.624 1.00 1.23 C ATOM 0 H LEU A 227 -12.433 -1.665 -1.702 1.00 0.49 H new ATOM 0 HA LEU A 227 -14.082 0.731 -1.704 1.00 0.65 H new ATOM 0 HB2 LEU A 227 -13.240 -1.288 -3.798 1.00 0.71 H new ATOM 0 HB3 LEU A 227 -14.246 0.108 -4.129 1.00 0.71 H new ATOM 0 HG LEU A 227 -11.487 0.352 -2.907 1.00 0.58 H new ATOM 0 HD11 LEU A 227 -10.659 0.878 -5.158 1.00 1.69 H new ATOM 0 HD12 LEU A 227 -11.262 -0.793 -5.048 1.00 1.69 H new ATOM 0 HD13 LEU A 227 -12.249 0.460 -5.838 1.00 1.69 H new ATOM 0 HD21 LEU A 227 -11.662 2.658 -3.778 1.00 1.23 H new ATOM 0 HD22 LEU A 227 -13.290 2.294 -4.397 1.00 1.23 H new ATOM 0 HD23 LEU A 227 -12.981 2.282 -2.644 1.00 1.23 H new ATOM 1249 N GLU A 228 -16.047 -0.661 -0.921 1.00 0.99 N ATOM 1250 CA GLU A 228 -17.296 -1.329 -0.617 1.00 1.23 C ATOM 1251 C GLU A 228 -18.465 -0.653 -1.319 1.00 1.51 C ATOM 1252 O GLU A 228 -18.986 0.362 -0.851 1.00 1.69 O ATOM 1253 CB GLU A 228 -17.524 -1.334 0.893 1.00 1.37 C ATOM 1254 CG GLU A 228 -16.365 -1.933 1.666 1.00 1.33 C ATOM 1255 CD GLU A 228 -16.534 -1.810 3.163 1.00 1.66 C ATOM 1256 OE1 GLU A 228 -16.115 -0.780 3.727 1.00 2.12 O ATOM 1257 OE2 GLU A 228 -17.084 -2.741 3.786 1.00 2.12 O ATOM 0 H GLU A 228 -15.793 0.072 -0.259 1.00 0.99 H new ATOM 0 HA GLU A 228 -17.233 -2.355 -0.978 1.00 1.23 H new ATOM 0 HB2 GLU A 228 -17.690 -0.312 1.233 1.00 1.37 H new ATOM 0 HB3 GLU A 228 -18.431 -1.896 1.116 1.00 1.37 H new ATOM 0 HG2 GLU A 228 -16.263 -2.986 1.402 1.00 1.33 H new ATOM 0 HG3 GLU A 228 -15.441 -1.438 1.367 1.00 1.33 H new ATOM 1264 N ASN A 229 -18.865 -1.213 -2.447 1.00 1.75 N ATOM 1265 CA ASN A 229 -20.034 -0.733 -3.166 1.00 2.12 C ATOM 1266 C ASN A 229 -20.975 -1.892 -3.414 1.00 2.52 C ATOM 1267 O ASN A 229 -21.358 -2.191 -4.547 1.00 3.17 O ATOM 1268 CB ASN A 229 -19.635 -0.058 -4.483 1.00 2.91 C ATOM 1269 CG ASN A 229 -20.798 0.654 -5.154 1.00 3.55 C ATOM 1270 OD1 ASN A 229 -20.887 0.706 -6.383 1.00 4.42 O ATOM 1271 ND2 ASN A 229 -21.683 1.232 -4.355 1.00 3.65 N ATOM 0 H ASN A 229 -18.396 -2.004 -2.887 1.00 1.75 H new ATOM 0 HA ASN A 229 -20.541 0.018 -2.560 1.00 2.12 H new ATOM 0 HB2 ASN A 229 -18.837 0.659 -4.291 1.00 2.91 H new ATOM 0 HB3 ASN A 229 -19.232 -0.808 -5.164 1.00 2.91 H new ATOM 0 HD21 ASN A 229 -22.472 1.742 -4.752 1.00 3.65 H new ATOM 0 HD22 ASN A 229 -21.575 1.167 -3.343 1.00 3.65 H new ATOM 1278 N VAL A 230 -21.314 -2.559 -2.330 1.00 2.85 N ATOM 1279 CA VAL A 230 -22.252 -3.653 -2.362 1.00 3.94 C ATOM 1280 C VAL A 230 -23.681 -3.125 -2.433 1.00 4.43 C ATOM 1281 O VAL A 230 -24.103 -2.357 -1.565 1.00 4.68 O ATOM 1282 CB VAL A 230 -22.076 -4.544 -1.131 1.00 4.70 C ATOM 1283 CG1 VAL A 230 -23.319 -5.376 -0.876 1.00 5.77 C ATOM 1284 CG2 VAL A 230 -20.857 -5.430 -1.301 1.00 4.92 C ATOM 0 H VAL A 230 -20.944 -2.354 -1.402 1.00 2.85 H new ATOM 0 HA VAL A 230 -22.057 -4.250 -3.253 1.00 3.94 H new ATOM 0 HB VAL A 230 -21.924 -3.905 -0.261 1.00 4.70 H new ATOM 0 HG11 VAL A 230 -23.165 -5.999 0.005 1.00 5.77 H new ATOM 0 HG12 VAL A 230 -24.171 -4.716 -0.709 1.00 5.77 H new ATOM 0 HG13 VAL A 230 -23.515 -6.011 -1.740 1.00 5.77 H new ATOM 0 HG21 VAL A 230 -20.740 -6.061 -0.420 1.00 4.92 H new ATOM 0 HG22 VAL A 230 -20.984 -6.058 -2.183 1.00 4.92 H new ATOM 0 HG23 VAL A 230 -19.970 -4.809 -1.423 1.00 4.92 H new ATOM 1294 N PRO A 231 -24.427 -3.494 -3.486 1.00 4.99 N ATOM 1295 CA PRO A 231 -25.834 -3.116 -3.629 1.00 5.82 C ATOM 1296 C PRO A 231 -26.710 -3.761 -2.559 1.00 6.50 C ATOM 1297 O PRO A 231 -27.310 -4.816 -2.783 1.00 7.15 O ATOM 1298 CB PRO A 231 -26.221 -3.638 -5.021 1.00 6.52 C ATOM 1299 CG PRO A 231 -24.929 -3.916 -5.711 1.00 6.28 C ATOM 1300 CD PRO A 231 -23.957 -4.287 -4.631 1.00 5.31 C ATOM 0 HA PRO A 231 -25.976 -2.041 -3.516 1.00 5.82 H new ATOM 0 HB2 PRO A 231 -26.829 -4.539 -4.948 1.00 6.52 H new ATOM 0 HB3 PRO A 231 -26.808 -2.901 -5.568 1.00 6.52 H new ATOM 0 HG2 PRO A 231 -25.038 -4.725 -6.433 1.00 6.28 H new ATOM 0 HG3 PRO A 231 -24.585 -3.041 -6.263 1.00 6.28 H new ATOM 0 HD2 PRO A 231 -23.977 -5.356 -4.418 1.00 5.31 H new ATOM 0 HD3 PRO A 231 -22.932 -4.035 -4.905 1.00 5.31 H new ATOM 1308 N LEU A 232 -26.758 -3.135 -1.393 1.00 6.68 N ATOM 1309 CA LEU A 232 -27.573 -3.615 -0.291 1.00 7.61 C ATOM 1310 C LEU A 232 -29.028 -3.237 -0.519 1.00 8.10 C ATOM 1311 O LEU A 232 -29.346 -2.031 -0.450 1.00 8.45 O ATOM 1312 CB LEU A 232 -27.072 -3.032 1.035 1.00 8.09 C ATOM 1313 CG LEU A 232 -27.920 -3.369 2.265 1.00 8.52 C ATOM 1314 CD1 LEU A 232 -27.918 -4.868 2.530 1.00 9.01 C ATOM 1315 CD2 LEU A 232 -27.413 -2.611 3.481 1.00 8.89 C ATOM 1316 OXT LEU A 232 -29.847 -4.142 -0.775 1.00 8.40 O ATOM 0 H LEU A 232 -26.235 -2.284 -1.186 1.00 6.68 H new ATOM 0 HA LEU A 232 -27.495 -4.701 -0.242 1.00 7.61 H new ATOM 0 HB2 LEU A 232 -26.056 -3.387 1.207 1.00 8.09 H new ATOM 0 HB3 LEU A 232 -27.018 -1.948 0.938 1.00 8.09 H new ATOM 0 HG LEU A 232 -28.947 -3.062 2.067 1.00 8.52 H new ATOM 0 HD11 LEU A 232 -28.527 -5.083 3.408 1.00 9.01 H new ATOM 0 HD12 LEU A 232 -28.329 -5.391 1.666 1.00 9.01 H new ATOM 0 HD13 LEU A 232 -26.896 -5.205 2.705 1.00 9.01 H new ATOM 0 HD21 LEU A 232 -28.026 -2.861 4.347 1.00 8.89 H new ATOM 0 HD22 LEU A 232 -26.377 -2.889 3.677 1.00 8.89 H new ATOM 0 HD23 LEU A 232 -27.472 -1.539 3.292 1.00 8.89 H new TER 1328 LEU A 232 HETATM 1329 C1 6FS A 301 3.121 -7.294 7.965 1.00 0.80 C HETATM 1330 C2 6FS A 301 4.498 -7.069 7.896 1.00 0.77 C HETATM 1331 C3 6FS A 301 5.233 -7.478 6.786 1.00 0.81 C HETATM 1332 C5 6FS A 301 3.187 -8.307 5.777 1.00 0.95 C HETATM 1333 C6 6FS A 301 2.462 -7.917 6.912 1.00 0.91 C HETATM 1334 C7 6FS A 301 0.568 -8.784 5.868 1.00 1.27 C HETATM 1335 C8 6FS A 301 4.547 -8.920 3.561 1.00 0.80 C HETATM 1336 C10 6FS A 301 4.315 -5.981 9.925 1.00 0.82 C HETATM 1337 C11 6FS A 301 7.513 -6.965 7.935 1.00 1.49 C HETATM 1338 C12 6FS A 301 9.519 -5.324 6.588 1.00 1.96 C HETATM 1339 C13 6FS A 301 11.502 -5.553 5.248 1.00 1.84 C HETATM 1340 C14 6FS A 301 12.859 -5.321 5.052 1.00 1.74 C HETATM 1341 C15 6FS A 301 13.598 -4.687 6.053 1.00 1.69 C HETATM 1342 C16 6FS A 301 12.990 -4.301 7.233 1.00 2.16 C HETATM 1343 C19 6FS A 301 15.431 -4.818 4.669 1.00 1.67 C HETATM 1344 C21 6FS A 301 12.520 -1.985 9.254 1.00 4.68 C HETATM 1345 O7 6FS A 301 12.909 -1.254 8.320 1.00 5.16 O HETATM 1346 S1 6FS A 301 9.230 -6.763 7.672 1.00 1.70 S HETATM 1347 C18 6FS A 301 10.888 -5.151 6.432 1.00 1.73 C HETATM 1348 O8 6FS A 301 11.575 -1.738 10.030 1.00 5.16 O HETATM 1349 O4 6FS A 301 9.958 -6.564 9.010 1.00 2.47 O HETATM 1350 O3 6FS A 301 5.176 -6.365 8.852 1.00 0.90 O HETATM 1351 O6 6FS A 301 14.923 -4.379 5.930 1.00 1.94 O HETATM 1352 C17 6FS A 301 11.633 -4.526 7.432 1.00 2.11 C HETATM 1353 C9 6FS A 301 6.627 -7.330 6.732 1.00 0.93 C HETATM 1354 O1 6FS A 301 1.109 -8.130 7.021 1.00 1.11 O HETATM 1355 C4 6FS A 301 4.567 -8.072 5.722 1.00 0.89 C HETATM 1356 C20 6FS A 301 13.275 -3.300 9.465 1.00 3.94 C HETATM 1357 O5 6FS A 301 9.784 -8.019 6.985 1.00 2.60 O HETATM 1358 N1 6FS A 301 13.780 -3.759 8.161 1.00 3.01 N HETATM 1359 O2 6FS A 301 5.323 -8.316 4.605 1.00 1.06 O