USER MOD reduce.3.24.130724 H: found=0, std=0, add=677, rem=0, adj=17 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 Single : A 151 SER OG : rot -97:sc= 1.06 USER MOD Single : A 153 GLN : amide:sc= -0.0702 K(o=-0.07,f=-0.93) USER MOD Single : A 154 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 163 ASN : amide:sc= -0.0356 K(o=-0.036,f=-1.1) USER MOD Single : A 164 LYS NZ :NH3+ 164:sc= -0.0657 (180deg=-0.379) USER MOD Single : A 165 GLN : amide:sc= -0.129 K(o=-0.13,f=-2.8!) USER MOD Single : A 167 THR OG1 : rot 180:sc= -1.62 USER MOD Single : A 173 CYS SG : rot 29:sc= 0.123 USER MOD Single : A 176 THR OG1 : rot 180:sc=-0.00121 USER MOD Single : A 180 SER OG : rot -85:sc= 0.0124 USER MOD Single : A 182 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 183 LYS NZ :NH3+ -148:sc= -0.238 (180deg=-1.67!) USER MOD Single : A 186 MET CE :methyl 160:sc= -0.0412 (180deg=-0.383) USER MOD Single : A 187 MET CE :methyl -113:sc= 0 (180deg=-2.41!) USER MOD Single : A 194 CYS SG : rot -37:sc= -0.233 USER MOD Single : A 195 CYS SG : rot 4:sc= -0.246 USER MOD Single : A 198 TYR OH : rot 180:sc= 0 USER MOD Single : A 201 GLN : amide:sc= -1.03! C(o=-1!,f=-6.5!) USER MOD Single : A 205 LYS NZ :NH3+ -135:sc= 1.2 (180deg=0.406) USER MOD Single : A 206 LYS NZ :NH3+ -139:sc= 1.23 (180deg=0.307) USER MOD Single : A 212 THR OG1 : rot -160:sc= 0 USER MOD Single : A 215 SER OG : rot -22:sc= 0.0873 USER MOD Single : A 218 THR OG1 : rot 88:sc= 1.26 USER MOD Single : A 223 HIS : no HD1:sc= 0.99 K(o=0.99,f=-5.2!) USER MOD Single : A 229 ASN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 151 22.403 -1.345 -3.291 1.00 5.02 N ATOM 2 CA SER A 151 21.952 -0.475 -2.184 1.00 4.35 C ATOM 3 C SER A 151 22.065 -1.209 -0.848 1.00 3.18 C ATOM 4 O SER A 151 21.257 -2.092 -0.546 1.00 3.19 O ATOM 5 CB SER A 151 20.502 -0.038 -2.424 1.00 5.00 C ATOM 6 OG SER A 151 20.075 0.917 -1.461 1.00 5.63 O ATOM 0 HA SER A 151 22.590 0.408 -2.149 1.00 4.35 H new ATOM 0 HB2 SER A 151 20.411 0.387 -3.424 1.00 5.00 H new ATOM 0 HB3 SER A 151 19.848 -0.909 -2.387 1.00 5.00 H new ATOM 0 HG SER A 151 19.583 0.463 -0.746 1.00 5.63 H new ATOM 12 N PRO A 152 23.089 -0.869 -0.039 1.00 2.66 N ATOM 13 CA PRO A 152 23.269 -1.432 1.306 1.00 2.06 C ATOM 14 C PRO A 152 22.025 -1.259 2.173 1.00 1.62 C ATOM 15 O PRO A 152 21.680 -2.131 2.969 1.00 1.74 O ATOM 16 CB PRO A 152 24.436 -0.624 1.876 1.00 2.74 C ATOM 17 CG PRO A 152 25.197 -0.172 0.681 1.00 3.37 C ATOM 18 CD PRO A 152 24.168 0.077 -0.381 1.00 3.38 C ATOM 0 HA PRO A 152 23.452 -2.506 1.280 1.00 2.06 H new ATOM 0 HB2 PRO A 152 24.082 0.223 2.464 1.00 2.74 H new ATOM 0 HB3 PRO A 152 25.056 -1.233 2.534 1.00 2.74 H new ATOM 0 HG2 PRO A 152 25.765 0.733 0.897 1.00 3.37 H new ATOM 0 HG3 PRO A 152 25.914 -0.929 0.363 1.00 3.37 H new ATOM 0 HD2 PRO A 152 23.817 1.109 -0.367 1.00 3.38 H new ATOM 0 HD3 PRO A 152 24.566 -0.111 -1.378 1.00 3.38 H new ATOM 26 N GLN A 153 21.358 -0.124 2.015 1.00 1.46 N ATOM 27 CA GLN A 153 20.099 0.128 2.696 1.00 1.24 C ATOM 28 C GLN A 153 18.944 -0.371 1.840 1.00 0.99 C ATOM 29 O GLN A 153 18.635 0.214 0.798 1.00 1.20 O ATOM 30 CB GLN A 153 19.927 1.618 2.982 1.00 1.63 C ATOM 31 CG GLN A 153 18.723 1.921 3.849 1.00 2.17 C ATOM 32 CD GLN A 153 18.897 1.452 5.279 1.00 2.74 C ATOM 33 OE1 GLN A 153 20.014 1.392 5.793 1.00 3.30 O ATOM 34 NE2 GLN A 153 17.799 1.112 5.932 1.00 3.28 N ATOM 0 H GLN A 153 21.672 0.640 1.417 1.00 1.46 H new ATOM 0 HA GLN A 153 20.105 -0.406 3.646 1.00 1.24 H new ATOM 0 HB2 GLN A 153 20.825 1.994 3.473 1.00 1.63 H new ATOM 0 HB3 GLN A 153 19.832 2.155 2.038 1.00 1.63 H new ATOM 0 HG2 GLN A 153 18.538 2.995 3.844 1.00 2.17 H new ATOM 0 HG3 GLN A 153 17.842 1.444 3.419 1.00 2.17 H new ATOM 0 HE21 GLN A 153 16.891 1.176 5.471 1.00 3.28 H new ATOM 0 HE22 GLN A 153 17.860 0.786 6.897 1.00 3.28 H new ATOM 43 N LYS A 154 18.331 -1.463 2.266 1.00 0.80 N ATOM 44 CA LYS A 154 17.193 -2.022 1.558 1.00 0.67 C ATOM 45 C LYS A 154 15.956 -1.169 1.816 1.00 0.54 C ATOM 46 O LYS A 154 15.494 -1.071 2.955 1.00 0.62 O ATOM 47 CB LYS A 154 16.935 -3.459 2.012 1.00 0.87 C ATOM 48 CG LYS A 154 15.874 -4.177 1.195 1.00 0.98 C ATOM 49 CD LYS A 154 16.379 -4.508 -0.195 1.00 1.30 C ATOM 50 CE LYS A 154 15.339 -5.261 -1.007 1.00 1.78 C ATOM 51 NZ LYS A 154 15.838 -5.605 -2.363 1.00 2.33 N ATOM 0 H LYS A 154 18.604 -1.981 3.101 1.00 0.80 H new ATOM 0 HA LYS A 154 17.413 -2.027 0.490 1.00 0.67 H new ATOM 0 HB2 LYS A 154 17.867 -4.021 1.955 1.00 0.87 H new ATOM 0 HB3 LYS A 154 16.631 -3.451 3.059 1.00 0.87 H new ATOM 0 HG2 LYS A 154 15.578 -5.094 1.705 1.00 0.98 H new ATOM 0 HG3 LYS A 154 14.984 -3.552 1.122 1.00 0.98 H new ATOM 0 HD2 LYS A 154 16.648 -3.588 -0.713 1.00 1.30 H new ATOM 0 HD3 LYS A 154 17.286 -5.108 -0.119 1.00 1.30 H new ATOM 0 HE2 LYS A 154 15.059 -6.174 -0.481 1.00 1.78 H new ATOM 0 HE3 LYS A 154 14.438 -4.654 -1.095 1.00 1.78 H new ATOM 0 HZ1 LYS A 154 15.099 -6.118 -2.885 1.00 2.33 H new ATOM 0 HZ2 LYS A 154 16.082 -4.733 -2.875 1.00 2.33 H new ATOM 0 HZ3 LYS A 154 16.683 -6.205 -2.280 1.00 2.33 H new ATOM 65 N PRO A 155 15.411 -0.531 0.772 1.00 0.42 N ATOM 66 CA PRO A 155 14.234 0.328 0.907 1.00 0.38 C ATOM 67 C PRO A 155 12.949 -0.474 1.059 1.00 0.33 C ATOM 68 O PRO A 155 12.790 -1.533 0.449 1.00 0.33 O ATOM 69 CB PRO A 155 14.221 1.088 -0.410 1.00 0.40 C ATOM 70 CG PRO A 155 14.792 0.124 -1.381 1.00 0.39 C ATOM 71 CD PRO A 155 15.882 -0.591 -0.630 1.00 0.43 C ATOM 0 HA PRO A 155 14.284 0.961 1.793 1.00 0.38 H new ATOM 0 HB2 PRO A 155 13.211 1.386 -0.690 1.00 0.40 H new ATOM 0 HB3 PRO A 155 14.818 1.998 -0.352 1.00 0.40 H new ATOM 0 HG2 PRO A 155 14.034 -0.575 -1.735 1.00 0.39 H new ATOM 0 HG3 PRO A 155 15.188 0.636 -2.258 1.00 0.39 H new ATOM 0 HD2 PRO A 155 16.001 -1.619 -0.973 1.00 0.43 H new ATOM 0 HD3 PRO A 155 16.847 -0.100 -0.753 1.00 0.43 H new ATOM 79 N ILE A 156 12.033 0.032 1.864 1.00 0.33 N ATOM 80 CA ILE A 156 10.758 -0.633 2.075 1.00 0.29 C ATOM 81 C ILE A 156 9.615 0.378 2.181 1.00 0.29 C ATOM 82 O ILE A 156 9.808 1.505 2.639 1.00 0.37 O ATOM 83 CB ILE A 156 10.791 -1.542 3.330 1.00 0.31 C ATOM 84 CG1 ILE A 156 11.586 -0.893 4.465 1.00 0.38 C ATOM 85 CG2 ILE A 156 11.364 -2.916 3.004 1.00 0.37 C ATOM 86 CD1 ILE A 156 10.744 -0.065 5.406 1.00 0.79 C ATOM 0 H ILE A 156 12.147 0.902 2.384 1.00 0.33 H new ATOM 0 HA ILE A 156 10.579 -1.264 1.205 1.00 0.29 H new ATOM 0 HB ILE A 156 9.761 -1.670 3.662 1.00 0.31 H new ATOM 0 HG12 ILE A 156 12.090 -1.674 5.035 1.00 0.38 H new ATOM 0 HG13 ILE A 156 12.363 -0.260 4.036 1.00 0.38 H new ATOM 0 HG21 ILE A 156 11.374 -3.529 3.905 1.00 0.37 H new ATOM 0 HG22 ILE A 156 10.747 -3.397 2.244 1.00 0.37 H new ATOM 0 HG23 ILE A 156 12.382 -2.806 2.629 1.00 0.37 H new ATOM 0 HD11 ILE A 156 11.379 0.361 6.183 1.00 0.79 H new ATOM 0 HD12 ILE A 156 10.261 0.739 4.850 1.00 0.79 H new ATOM 0 HD13 ILE A 156 9.984 -0.697 5.865 1.00 0.79 H new ATOM 98 N VAL A 157 8.443 -0.024 1.708 1.00 0.25 N ATOM 99 CA VAL A 157 7.233 0.767 1.831 1.00 0.27 C ATOM 100 C VAL A 157 6.222 0.002 2.684 1.00 0.21 C ATOM 101 O VAL A 157 5.873 -1.144 2.389 1.00 0.25 O ATOM 102 CB VAL A 157 6.601 1.114 0.458 1.00 0.38 C ATOM 103 CG1 VAL A 157 5.292 1.869 0.654 1.00 1.05 C ATOM 104 CG2 VAL A 157 7.554 1.941 -0.402 1.00 0.91 C ATOM 0 H VAL A 157 8.308 -0.913 1.226 1.00 0.25 H new ATOM 0 HA VAL A 157 7.503 1.711 2.304 1.00 0.27 H new ATOM 0 HB VAL A 157 6.402 0.177 -0.062 1.00 0.38 H new ATOM 0 HG11 VAL A 157 4.860 2.106 -0.318 1.00 1.05 H new ATOM 0 HG12 VAL A 157 4.596 1.250 1.219 1.00 1.05 H new ATOM 0 HG13 VAL A 157 5.483 2.792 1.201 1.00 1.05 H new ATOM 0 HG21 VAL A 157 7.079 2.167 -1.357 1.00 0.91 H new ATOM 0 HG22 VAL A 157 7.794 2.871 0.113 1.00 0.91 H new ATOM 0 HG23 VAL A 157 8.470 1.376 -0.576 1.00 0.91 H new ATOM 114 N ARG A 158 5.785 0.638 3.750 1.00 0.21 N ATOM 115 CA ARG A 158 4.899 0.026 4.727 1.00 0.21 C ATOM 116 C ARG A 158 3.455 0.435 4.480 1.00 0.21 C ATOM 117 O ARG A 158 3.103 1.601 4.616 1.00 0.32 O ATOM 118 CB ARG A 158 5.332 0.451 6.125 1.00 0.26 C ATOM 119 CG ARG A 158 6.756 0.037 6.450 1.00 0.29 C ATOM 120 CD ARG A 158 7.378 0.910 7.519 1.00 0.49 C ATOM 121 NE ARG A 158 6.686 0.808 8.802 1.00 1.36 N ATOM 122 CZ ARG A 158 6.486 1.835 9.626 1.00 1.81 C ATOM 123 NH1 ARG A 158 6.840 3.065 9.267 1.00 1.70 N ATOM 124 NH2 ARG A 158 5.913 1.634 10.804 1.00 2.87 N ATOM 0 H ARG A 158 6.035 1.603 3.968 1.00 0.21 H new ATOM 0 HA ARG A 158 4.962 -1.058 4.634 1.00 0.21 H new ATOM 0 HB2 ARG A 158 5.244 1.534 6.215 1.00 0.26 H new ATOM 0 HB3 ARG A 158 4.655 0.014 6.859 1.00 0.26 H new ATOM 0 HG2 ARG A 158 6.763 -1.001 6.782 1.00 0.29 H new ATOM 0 HG3 ARG A 158 7.362 0.087 5.545 1.00 0.29 H new ATOM 0 HD2 ARG A 158 8.423 0.628 7.651 1.00 0.49 H new ATOM 0 HD3 ARG A 158 7.368 1.948 7.186 1.00 0.49 H new ATOM 0 HE ARG A 158 6.334 -0.107 9.084 1.00 1.36 H new ATOM 0 HH11 ARG A 158 7.268 3.227 8.355 1.00 1.70 H new ATOM 0 HH12 ARG A 158 6.684 3.847 9.903 1.00 1.70 H new ATOM 0 HH21 ARG A 158 5.626 0.694 11.078 1.00 2.87 H new ATOM 0 HH22 ARG A 158 5.759 2.419 11.437 1.00 2.87 H new ATOM 138 N VAL A 159 2.627 -0.527 4.115 1.00 0.20 N ATOM 139 CA VAL A 159 1.226 -0.249 3.812 1.00 0.21 C ATOM 140 C VAL A 159 0.308 -0.708 4.939 1.00 0.23 C ATOM 141 O VAL A 159 0.348 -1.867 5.341 1.00 0.36 O ATOM 142 CB VAL A 159 0.766 -0.954 2.524 1.00 0.28 C ATOM 143 CG1 VAL A 159 -0.483 -0.286 1.981 1.00 0.42 C ATOM 144 CG2 VAL A 159 1.871 -0.976 1.480 1.00 0.35 C ATOM 0 H VAL A 159 2.895 -1.507 4.020 1.00 0.20 H new ATOM 0 HA VAL A 159 1.160 0.832 3.687 1.00 0.21 H new ATOM 0 HB VAL A 159 0.529 -1.990 2.767 1.00 0.28 H new ATOM 0 HG11 VAL A 159 -0.800 -0.793 1.070 1.00 0.42 H new ATOM 0 HG12 VAL A 159 -1.279 -0.344 2.724 1.00 0.42 H new ATOM 0 HG13 VAL A 159 -0.269 0.760 1.759 1.00 0.42 H new ATOM 0 HG21 VAL A 159 1.514 -1.481 0.583 1.00 0.35 H new ATOM 0 HG22 VAL A 159 2.157 0.046 1.232 1.00 0.35 H new ATOM 0 HG23 VAL A 159 2.735 -1.509 1.876 1.00 0.35 H new ATOM 154 N PHE A 160 -0.521 0.192 5.440 1.00 0.22 N ATOM 155 CA PHE A 160 -1.545 -0.178 6.405 1.00 0.22 C ATOM 156 C PHE A 160 -2.697 -0.878 5.687 1.00 0.24 C ATOM 157 O PHE A 160 -3.526 -0.236 5.042 1.00 0.28 O ATOM 158 CB PHE A 160 -2.082 1.055 7.139 1.00 0.25 C ATOM 159 CG PHE A 160 -1.139 1.642 8.158 1.00 0.30 C ATOM 160 CD1 PHE A 160 0.051 2.242 7.772 1.00 0.38 C ATOM 161 CD2 PHE A 160 -1.460 1.612 9.505 1.00 0.48 C ATOM 162 CE1 PHE A 160 0.900 2.799 8.708 1.00 0.46 C ATOM 163 CE2 PHE A 160 -0.613 2.164 10.447 1.00 0.58 C ATOM 164 CZ PHE A 160 0.568 2.758 10.049 1.00 0.51 C ATOM 0 H PHE A 160 -0.506 1.182 5.196 1.00 0.22 H new ATOM 0 HA PHE A 160 -1.097 -0.850 7.137 1.00 0.22 H new ATOM 0 HB2 PHE A 160 -2.324 1.822 6.403 1.00 0.25 H new ATOM 0 HB3 PHE A 160 -3.013 0.787 7.638 1.00 0.25 H new ATOM 0 HD1 PHE A 160 0.317 2.274 6.726 1.00 0.38 H new ATOM 0 HD2 PHE A 160 -2.384 1.151 9.823 1.00 0.48 H new ATOM 0 HE1 PHE A 160 1.822 3.266 8.393 1.00 0.46 H new ATOM 0 HE2 PHE A 160 -0.875 2.131 11.494 1.00 0.58 H new ATOM 0 HZ PHE A 160 1.231 3.190 10.784 1.00 0.51 H new ATOM 174 N LEU A 161 -2.721 -2.193 5.796 1.00 0.27 N ATOM 175 CA LEU A 161 -3.783 -3.017 5.230 1.00 0.33 C ATOM 176 C LEU A 161 -5.110 -2.768 5.940 1.00 0.33 C ATOM 177 O LEU A 161 -5.135 -2.311 7.084 1.00 0.37 O ATOM 178 CB LEU A 161 -3.399 -4.494 5.350 1.00 0.49 C ATOM 179 CG LEU A 161 -2.595 -5.078 4.191 1.00 0.72 C ATOM 180 CD1 LEU A 161 -1.812 -3.994 3.484 1.00 1.46 C ATOM 181 CD2 LEU A 161 -1.657 -6.143 4.713 1.00 0.98 C ATOM 0 H LEU A 161 -2.001 -2.727 6.282 1.00 0.27 H new ATOM 0 HA LEU A 161 -3.906 -2.750 4.180 1.00 0.33 H new ATOM 0 HB2 LEU A 161 -2.824 -4.625 6.266 1.00 0.49 H new ATOM 0 HB3 LEU A 161 -4.313 -5.078 5.461 1.00 0.49 H new ATOM 0 HG LEU A 161 -3.284 -5.523 3.473 1.00 0.72 H new ATOM 0 HD11 LEU A 161 -1.246 -4.431 2.662 1.00 1.46 H new ATOM 0 HD12 LEU A 161 -2.500 -3.244 3.093 1.00 1.46 H new ATOM 0 HD13 LEU A 161 -1.125 -3.524 4.187 1.00 1.46 H new ATOM 0 HD21 LEU A 161 -1.083 -6.560 3.885 1.00 0.98 H new ATOM 0 HD22 LEU A 161 -0.976 -5.703 5.441 1.00 0.98 H new ATOM 0 HD23 LEU A 161 -2.235 -6.935 5.189 1.00 0.98 H new ATOM 193 N PRO A 162 -6.226 -3.086 5.269 1.00 0.38 N ATOM 194 CA PRO A 162 -7.577 -2.863 5.797 1.00 0.43 C ATOM 195 C PRO A 162 -7.796 -3.540 7.142 1.00 0.42 C ATOM 196 O PRO A 162 -7.273 -4.625 7.376 1.00 0.40 O ATOM 197 CB PRO A 162 -8.483 -3.485 4.742 1.00 0.49 C ATOM 198 CG PRO A 162 -7.672 -3.446 3.503 1.00 0.50 C ATOM 199 CD PRO A 162 -6.262 -3.703 3.938 1.00 0.46 C ATOM 0 HA PRO A 162 -7.769 -1.805 5.974 1.00 0.43 H new ATOM 0 HB2 PRO A 162 -8.760 -4.506 5.006 1.00 0.49 H new ATOM 0 HB3 PRO A 162 -9.410 -2.922 4.630 1.00 0.49 H new ATOM 0 HG2 PRO A 162 -8.007 -4.201 2.791 1.00 0.50 H new ATOM 0 HG3 PRO A 162 -7.759 -2.479 3.007 1.00 0.50 H new ATOM 0 HD2 PRO A 162 -6.037 -4.769 3.978 1.00 0.46 H new ATOM 0 HD3 PRO A 162 -5.539 -3.250 3.260 1.00 0.46 H new ATOM 207 N ASN A 163 -8.573 -2.893 8.010 1.00 0.51 N ATOM 208 CA ASN A 163 -8.843 -3.390 9.365 1.00 0.54 C ATOM 209 C ASN A 163 -7.630 -3.206 10.267 1.00 0.48 C ATOM 210 O ASN A 163 -7.407 -3.982 11.200 1.00 0.53 O ATOM 211 CB ASN A 163 -9.289 -4.860 9.360 1.00 0.60 C ATOM 212 CG ASN A 163 -10.685 -5.043 8.801 1.00 1.26 C ATOM 213 OD1 ASN A 163 -11.542 -4.168 8.929 1.00 2.08 O ATOM 214 ND2 ASN A 163 -10.924 -6.183 8.174 1.00 1.86 N ATOM 0 H ASN A 163 -9.035 -2.009 7.797 1.00 0.51 H new ATOM 0 HA ASN A 163 -9.666 -2.797 9.763 1.00 0.54 H new ATOM 0 HB2 ASN A 163 -8.585 -5.447 8.770 1.00 0.60 H new ATOM 0 HB3 ASN A 163 -9.255 -5.250 10.377 1.00 0.60 H new ATOM 0 HD21 ASN A 163 -11.846 -6.362 7.775 1.00 1.86 H new ATOM 0 HD22 ASN A 163 -10.187 -6.883 8.089 1.00 1.86 H new ATOM 221 N LYS A 164 -6.854 -2.166 9.970 1.00 0.48 N ATOM 222 CA LYS A 164 -5.728 -1.747 10.807 1.00 0.52 C ATOM 223 C LYS A 164 -4.599 -2.775 10.837 1.00 0.44 C ATOM 224 O LYS A 164 -3.906 -2.909 11.848 1.00 0.52 O ATOM 225 CB LYS A 164 -6.193 -1.451 12.237 1.00 0.69 C ATOM 226 CG LYS A 164 -7.110 -0.242 12.366 1.00 0.88 C ATOM 227 CD LYS A 164 -6.328 1.058 12.502 1.00 1.22 C ATOM 228 CE LYS A 164 -5.624 1.450 11.215 1.00 2.04 C ATOM 229 NZ LYS A 164 -6.573 1.598 10.083 1.00 2.74 N ATOM 0 H LYS A 164 -6.987 -1.588 9.140 1.00 0.48 H new ATOM 0 HA LYS A 164 -5.333 -0.838 10.355 1.00 0.52 H new ATOM 0 HB2 LYS A 164 -6.712 -2.327 12.626 1.00 0.69 H new ATOM 0 HB3 LYS A 164 -5.316 -1.295 12.866 1.00 0.69 H new ATOM 0 HG2 LYS A 164 -7.759 -0.185 11.492 1.00 0.88 H new ATOM 0 HG3 LYS A 164 -7.756 -0.369 13.235 1.00 0.88 H new ATOM 0 HD2 LYS A 164 -7.007 1.857 12.799 1.00 1.22 H new ATOM 0 HD3 LYS A 164 -5.591 0.953 13.298 1.00 1.22 H new ATOM 0 HE2 LYS A 164 -5.090 2.388 11.365 1.00 2.04 H new ATOM 0 HE3 LYS A 164 -4.878 0.695 10.966 1.00 2.04 H new ATOM 0 HZ1 LYS A 164 -6.112 2.118 9.309 1.00 2.74 H new ATOM 0 HZ2 LYS A 164 -6.860 0.657 9.745 1.00 2.74 H new ATOM 0 HZ3 LYS A 164 -7.413 2.123 10.401 1.00 2.74 H new ATOM 243 N GLN A 165 -4.405 -3.494 9.742 1.00 0.36 N ATOM 244 CA GLN A 165 -3.242 -4.353 9.611 1.00 0.37 C ATOM 245 C GLN A 165 -2.165 -3.518 8.977 1.00 0.33 C ATOM 246 O GLN A 165 -2.438 -2.417 8.506 1.00 0.38 O ATOM 247 CB GLN A 165 -3.539 -5.579 8.733 1.00 0.42 C ATOM 248 CG GLN A 165 -5.013 -5.908 8.619 1.00 0.50 C ATOM 249 CD GLN A 165 -5.619 -6.478 9.890 1.00 0.66 C ATOM 250 OE1 GLN A 165 -5.157 -6.208 11.000 1.00 1.33 O ATOM 251 NE2 GLN A 165 -6.675 -7.262 9.735 1.00 1.33 N ATOM 0 H GLN A 165 -5.033 -3.499 8.938 1.00 0.36 H new ATOM 0 HA GLN A 165 -2.941 -4.731 10.588 1.00 0.37 H new ATOM 0 HB2 GLN A 165 -3.137 -5.405 7.735 1.00 0.42 H new ATOM 0 HB3 GLN A 165 -3.014 -6.442 9.142 1.00 0.42 H new ATOM 0 HG2 GLN A 165 -5.556 -5.004 8.343 1.00 0.50 H new ATOM 0 HG3 GLN A 165 -5.153 -6.624 7.809 1.00 0.50 H new ATOM 0 HE21 GLN A 165 -7.028 -7.462 8.799 1.00 1.33 H new ATOM 0 HE22 GLN A 165 -7.135 -7.665 10.551 1.00 1.33 H new ATOM 260 N ARG A 166 -0.949 -3.985 8.989 1.00 0.34 N ATOM 261 CA ARG A 166 0.094 -3.262 8.328 1.00 0.32 C ATOM 262 C ARG A 166 1.139 -4.214 7.800 1.00 0.41 C ATOM 263 O ARG A 166 1.520 -5.167 8.467 1.00 0.79 O ATOM 264 CB ARG A 166 0.694 -2.221 9.259 1.00 0.40 C ATOM 265 CG ARG A 166 1.543 -1.217 8.554 1.00 0.95 C ATOM 266 CD ARG A 166 2.179 -0.270 9.543 1.00 0.96 C ATOM 267 NE ARG A 166 2.827 -0.966 10.654 1.00 1.54 N ATOM 268 CZ ARG A 166 2.972 -0.450 11.877 1.00 1.82 C ATOM 269 NH1 ARG A 166 2.510 0.766 12.150 1.00 1.62 N ATOM 270 NH2 ARG A 166 3.584 -1.149 12.822 1.00 2.49 N ATOM 0 H ARG A 166 -0.660 -4.851 9.443 1.00 0.34 H new ATOM 0 HA ARG A 166 -0.328 -2.731 7.475 1.00 0.32 H new ATOM 0 HB2 ARG A 166 -0.111 -1.703 9.781 1.00 0.40 H new ATOM 0 HB3 ARG A 166 1.293 -2.725 10.018 1.00 0.40 H new ATOM 0 HG2 ARG A 166 2.317 -1.726 7.980 1.00 0.95 H new ATOM 0 HG3 ARG A 166 0.937 -0.656 7.843 1.00 0.95 H new ATOM 0 HD2 ARG A 166 2.915 0.347 9.027 1.00 0.96 H new ATOM 0 HD3 ARG A 166 1.418 0.404 9.936 1.00 0.96 H new ATOM 0 HE ARG A 166 3.191 -1.904 10.484 1.00 1.54 H new ATOM 0 HH11 ARG A 166 2.043 1.309 11.424 1.00 1.62 H new ATOM 0 HH12 ARG A 166 2.623 1.156 13.086 1.00 1.62 H new ATOM 0 HH21 ARG A 166 3.944 -2.081 12.615 1.00 2.49 H new ATOM 0 HH22 ARG A 166 3.695 -0.755 13.756 1.00 2.49 H new ATOM 284 N THR A 167 1.564 -3.960 6.591 1.00 0.25 N ATOM 285 CA THR A 167 2.536 -4.788 5.925 1.00 0.27 C ATOM 286 C THR A 167 3.715 -3.950 5.496 1.00 0.25 C ATOM 287 O THR A 167 3.688 -2.723 5.601 1.00 0.31 O ATOM 288 CB THR A 167 1.929 -5.447 4.674 1.00 0.35 C ATOM 289 OG1 THR A 167 2.787 -6.481 4.187 1.00 0.50 O ATOM 290 CG2 THR A 167 1.735 -4.410 3.584 1.00 0.52 C ATOM 0 H THR A 167 1.243 -3.167 6.036 1.00 0.25 H new ATOM 0 HA THR A 167 2.853 -5.561 6.624 1.00 0.27 H new ATOM 0 HB THR A 167 0.966 -5.878 4.948 1.00 0.35 H new ATOM 0 HG1 THR A 167 2.386 -6.891 3.392 1.00 0.50 H new ATOM 0 HG21 THR A 167 1.305 -4.885 2.702 1.00 0.52 H new ATOM 0 HG22 THR A 167 1.063 -3.629 3.940 1.00 0.52 H new ATOM 0 HG23 THR A 167 2.698 -3.969 3.326 1.00 0.52 H new ATOM 298 N VAL A 168 4.743 -4.611 5.010 1.00 0.25 N ATOM 299 CA VAL A 168 5.860 -3.925 4.421 1.00 0.27 C ATOM 300 C VAL A 168 6.355 -4.712 3.224 1.00 0.25 C ATOM 301 O VAL A 168 6.616 -5.912 3.316 1.00 0.30 O ATOM 302 CB VAL A 168 7.036 -3.752 5.397 1.00 0.39 C ATOM 303 CG1 VAL A 168 7.956 -2.640 4.929 1.00 0.73 C ATOM 304 CG2 VAL A 168 6.556 -3.496 6.821 1.00 0.88 C ATOM 0 H VAL A 168 4.823 -5.628 5.014 1.00 0.25 H new ATOM 0 HA VAL A 168 5.508 -2.934 4.135 1.00 0.27 H new ATOM 0 HB VAL A 168 7.597 -4.687 5.408 1.00 0.39 H new ATOM 0 HG11 VAL A 168 8.782 -2.532 5.631 1.00 0.73 H new ATOM 0 HG12 VAL A 168 8.349 -2.884 3.942 1.00 0.73 H new ATOM 0 HG13 VAL A 168 7.399 -1.705 4.877 1.00 0.73 H new ATOM 0 HG21 VAL A 168 7.417 -3.379 7.480 1.00 0.88 H new ATOM 0 HG22 VAL A 168 5.955 -2.587 6.845 1.00 0.88 H new ATOM 0 HG23 VAL A 168 5.952 -4.339 7.158 1.00 0.88 H new ATOM 314 N VAL A 169 6.472 -4.026 2.118 1.00 0.26 N ATOM 315 CA VAL A 169 7.080 -4.574 0.919 1.00 0.26 C ATOM 316 C VAL A 169 8.300 -3.746 0.565 1.00 0.28 C ATOM 317 O VAL A 169 8.254 -2.522 0.641 1.00 0.29 O ATOM 318 CB VAL A 169 6.125 -4.585 -0.293 1.00 0.32 C ATOM 319 CG1 VAL A 169 5.141 -5.733 -0.185 1.00 1.17 C ATOM 320 CG2 VAL A 169 5.389 -3.262 -0.423 1.00 1.31 C ATOM 0 H VAL A 169 6.148 -3.064 2.016 1.00 0.26 H new ATOM 0 HA VAL A 169 7.343 -5.609 1.137 1.00 0.26 H new ATOM 0 HB VAL A 169 6.725 -4.725 -1.192 1.00 0.32 H new ATOM 0 HG11 VAL A 169 4.476 -5.724 -1.048 1.00 1.17 H new ATOM 0 HG12 VAL A 169 5.685 -6.677 -0.155 1.00 1.17 H new ATOM 0 HG13 VAL A 169 4.554 -5.624 0.727 1.00 1.17 H new ATOM 0 HG21 VAL A 169 4.723 -3.299 -1.285 1.00 1.31 H new ATOM 0 HG22 VAL A 169 4.804 -3.081 0.479 1.00 1.31 H new ATOM 0 HG23 VAL A 169 6.110 -2.456 -0.556 1.00 1.31 H new ATOM 330 N PRO A 170 9.419 -4.390 0.221 1.00 0.31 N ATOM 331 CA PRO A 170 10.589 -3.683 -0.289 1.00 0.32 C ATOM 332 C PRO A 170 10.199 -2.764 -1.434 1.00 0.28 C ATOM 333 O PRO A 170 9.272 -3.076 -2.183 1.00 0.33 O ATOM 334 CB PRO A 170 11.494 -4.809 -0.789 1.00 0.40 C ATOM 335 CG PRO A 170 11.103 -5.999 0.015 1.00 0.59 C ATOM 336 CD PRO A 170 9.638 -5.842 0.319 1.00 0.39 C ATOM 0 HA PRO A 170 11.067 -3.052 0.460 1.00 0.32 H new ATOM 0 HB2 PRO A 170 11.351 -4.988 -1.855 1.00 0.40 H new ATOM 0 HB3 PRO A 170 12.546 -4.564 -0.646 1.00 0.40 H new ATOM 0 HG2 PRO A 170 11.289 -6.920 -0.538 1.00 0.59 H new ATOM 0 HG3 PRO A 170 11.687 -6.056 0.934 1.00 0.59 H new ATOM 0 HD2 PRO A 170 9.020 -6.390 -0.392 1.00 0.39 H new ATOM 0 HD3 PRO A 170 9.392 -6.219 1.312 1.00 0.39 H new ATOM 344 N ALA A 171 10.872 -1.623 -1.547 1.00 0.24 N ATOM 345 CA ALA A 171 10.602 -0.695 -2.635 1.00 0.21 C ATOM 346 C ALA A 171 11.002 -1.334 -3.953 1.00 0.24 C ATOM 347 O ALA A 171 12.097 -1.107 -4.469 1.00 0.35 O ATOM 348 CB ALA A 171 11.332 0.623 -2.430 1.00 0.21 C ATOM 0 H ALA A 171 11.603 -1.322 -0.902 1.00 0.24 H new ATOM 0 HA ALA A 171 9.535 -0.475 -2.652 1.00 0.21 H new ATOM 0 HB1 ALA A 171 11.110 1.295 -3.259 1.00 0.21 H new ATOM 0 HB2 ALA A 171 11.004 1.079 -1.496 1.00 0.21 H new ATOM 0 HB3 ALA A 171 12.406 0.441 -2.388 1.00 0.21 H new ATOM 354 N ARG A 172 10.109 -2.166 -4.456 1.00 0.26 N ATOM 355 CA ARG A 172 10.326 -2.907 -5.678 1.00 0.29 C ATOM 356 C ARG A 172 10.426 -1.949 -6.856 1.00 0.27 C ATOM 357 O ARG A 172 9.441 -1.314 -7.237 1.00 0.27 O ATOM 358 CB ARG A 172 9.167 -3.882 -5.881 1.00 0.33 C ATOM 359 CG ARG A 172 8.993 -4.904 -4.768 1.00 0.46 C ATOM 360 CD ARG A 172 10.140 -5.900 -4.704 1.00 0.56 C ATOM 361 NE ARG A 172 9.847 -6.985 -3.767 1.00 1.33 N ATOM 362 CZ ARG A 172 10.770 -7.730 -3.165 1.00 1.81 C ATOM 363 NH1 ARG A 172 12.059 -7.525 -3.405 1.00 1.58 N ATOM 364 NH2 ARG A 172 10.402 -8.687 -2.320 1.00 2.81 N ATOM 0 H ARG A 172 9.204 -2.346 -4.021 1.00 0.26 H new ATOM 0 HA ARG A 172 11.260 -3.465 -5.610 1.00 0.29 H new ATOM 0 HB2 ARG A 172 8.243 -3.312 -5.979 1.00 0.33 H new ATOM 0 HB3 ARG A 172 9.316 -4.412 -6.822 1.00 0.33 H new ATOM 0 HG2 ARG A 172 8.913 -4.385 -3.813 1.00 0.46 H new ATOM 0 HG3 ARG A 172 8.057 -5.442 -4.917 1.00 0.46 H new ATOM 0 HD2 ARG A 172 10.323 -6.312 -5.696 1.00 0.56 H new ATOM 0 HD3 ARG A 172 11.053 -5.388 -4.398 1.00 0.56 H new ATOM 0 HE ARG A 172 8.868 -7.184 -3.561 1.00 1.33 H new ATOM 0 HH11 ARG A 172 12.347 -6.793 -4.054 1.00 1.58 H new ATOM 0 HH12 ARG A 172 12.762 -8.100 -2.940 1.00 1.58 H new ATOM 0 HH21 ARG A 172 9.413 -8.850 -2.133 1.00 2.81 H new ATOM 0 HH22 ARG A 172 11.109 -9.259 -1.858 1.00 2.81 H new ATOM 378 N CYS A 173 11.612 -1.839 -7.426 1.00 0.30 N ATOM 379 CA CYS A 173 11.841 -0.904 -8.511 1.00 0.32 C ATOM 380 C CYS A 173 11.302 -1.456 -9.822 1.00 0.31 C ATOM 381 O CYS A 173 11.566 -2.608 -10.181 1.00 0.41 O ATOM 382 CB CYS A 173 13.332 -0.582 -8.633 1.00 0.40 C ATOM 383 SG CYS A 173 14.380 -2.022 -8.953 1.00 1.44 S ATOM 0 H CYS A 173 12.430 -2.385 -7.156 1.00 0.30 H new ATOM 0 HA CYS A 173 11.306 0.019 -8.287 1.00 0.32 H new ATOM 0 HB2 CYS A 173 13.471 0.140 -9.437 1.00 0.40 H new ATOM 0 HB3 CYS A 173 13.665 -0.102 -7.713 1.00 0.40 H new ATOM 0 HG CYS A 173 13.699 -2.919 -9.602 1.00 1.44 H new ATOM 389 N GLY A 174 10.530 -0.642 -10.521 1.00 0.30 N ATOM 390 CA GLY A 174 9.996 -1.051 -11.798 1.00 0.33 C ATOM 391 C GLY A 174 8.687 -1.796 -11.667 1.00 0.30 C ATOM 392 O GLY A 174 8.312 -2.560 -12.557 1.00 0.43 O ATOM 0 H GLY A 174 10.264 0.297 -10.225 1.00 0.30 H new ATOM 0 HA2 GLY A 174 9.849 -0.172 -12.425 1.00 0.33 H new ATOM 0 HA3 GLY A 174 10.722 -1.686 -12.305 1.00 0.33 H new ATOM 396 N VAL A 175 7.987 -1.588 -10.564 1.00 0.25 N ATOM 397 CA VAL A 175 6.723 -2.269 -10.342 1.00 0.28 C ATOM 398 C VAL A 175 5.686 -1.312 -9.764 1.00 0.26 C ATOM 399 O VAL A 175 6.027 -0.324 -9.108 1.00 0.35 O ATOM 400 CB VAL A 175 6.897 -3.491 -9.412 1.00 0.35 C ATOM 401 CG1 VAL A 175 6.841 -3.085 -7.963 1.00 0.69 C ATOM 402 CG2 VAL A 175 5.846 -4.544 -9.682 1.00 0.97 C ATOM 0 H VAL A 175 8.270 -0.958 -9.814 1.00 0.25 H new ATOM 0 HA VAL A 175 6.370 -2.626 -11.309 1.00 0.28 H new ATOM 0 HB VAL A 175 7.879 -3.914 -9.623 1.00 0.35 H new ATOM 0 HG11 VAL A 175 6.966 -3.966 -7.333 1.00 0.69 H new ATOM 0 HG12 VAL A 175 7.639 -2.373 -7.754 1.00 0.69 H new ATOM 0 HG13 VAL A 175 5.877 -2.622 -7.752 1.00 0.69 H new ATOM 0 HG21 VAL A 175 5.997 -5.390 -9.011 1.00 0.97 H new ATOM 0 HG22 VAL A 175 4.856 -4.121 -9.515 1.00 0.97 H new ATOM 0 HG23 VAL A 175 5.926 -4.882 -10.715 1.00 0.97 H new ATOM 412 N THR A 176 4.422 -1.606 -10.015 1.00 0.22 N ATOM 413 CA THR A 176 3.345 -0.755 -9.555 1.00 0.25 C ATOM 414 C THR A 176 2.857 -1.194 -8.183 1.00 0.23 C ATOM 415 O THR A 176 3.169 -2.307 -7.731 1.00 0.25 O ATOM 416 CB THR A 176 2.168 -0.767 -10.548 1.00 0.31 C ATOM 417 OG1 THR A 176 1.755 -2.117 -10.804 1.00 0.47 O ATOM 418 CG2 THR A 176 2.559 -0.097 -11.855 1.00 0.40 C ATOM 0 H THR A 176 4.119 -2.429 -10.536 1.00 0.22 H new ATOM 0 HA THR A 176 3.737 0.260 -9.486 1.00 0.25 H new ATOM 0 HB THR A 176 1.341 -0.212 -10.105 1.00 0.31 H new ATOM 0 HG1 THR A 176 1.005 -2.116 -11.435 1.00 0.47 H new ATOM 0 HG21 THR A 176 1.713 -0.117 -12.542 1.00 0.40 H new ATOM 0 HG22 THR A 176 2.846 0.937 -11.662 1.00 0.40 H new ATOM 0 HG23 THR A 176 3.399 -0.630 -12.300 1.00 0.40 H new ATOM 426 N VAL A 177 2.103 -0.327 -7.514 1.00 0.25 N ATOM 427 CA VAL A 177 1.508 -0.671 -6.227 1.00 0.27 C ATOM 428 C VAL A 177 0.675 -1.944 -6.371 1.00 0.24 C ATOM 429 O VAL A 177 0.609 -2.771 -5.461 1.00 0.28 O ATOM 430 CB VAL A 177 0.610 0.469 -5.677 1.00 0.34 C ATOM 431 CG1 VAL A 177 1.314 1.808 -5.719 1.00 1.20 C ATOM 432 CG2 VAL A 177 -0.693 0.562 -6.429 1.00 1.39 C ATOM 0 H VAL A 177 1.890 0.616 -7.840 1.00 0.25 H new ATOM 0 HA VAL A 177 2.322 -0.827 -5.520 1.00 0.27 H new ATOM 0 HB VAL A 177 0.398 0.219 -4.637 1.00 0.34 H new ATOM 0 HG11 VAL A 177 0.652 2.580 -5.326 1.00 1.20 H new ATOM 0 HG12 VAL A 177 2.219 1.763 -5.113 1.00 1.20 H new ATOM 0 HG13 VAL A 177 1.579 2.048 -6.749 1.00 1.20 H new ATOM 0 HG21 VAL A 177 -1.295 1.371 -6.015 1.00 1.39 H new ATOM 0 HG22 VAL A 177 -0.492 0.761 -7.482 1.00 1.39 H new ATOM 0 HG23 VAL A 177 -1.236 -0.379 -6.334 1.00 1.39 H new ATOM 442 N ARG A 178 0.082 -2.102 -7.550 1.00 0.23 N ATOM 443 CA ARG A 178 -0.823 -3.192 -7.834 1.00 0.26 C ATOM 444 C ARG A 178 -0.212 -4.537 -7.519 1.00 0.23 C ATOM 445 O ARG A 178 -0.827 -5.344 -6.857 1.00 0.33 O ATOM 446 CB ARG A 178 -1.255 -3.121 -9.296 1.00 0.39 C ATOM 447 CG ARG A 178 -2.268 -4.174 -9.693 1.00 0.85 C ATOM 448 CD ARG A 178 -3.437 -4.202 -8.728 1.00 1.65 C ATOM 449 NE ARG A 178 -4.466 -5.163 -9.133 1.00 2.02 N ATOM 450 CZ ARG A 178 -5.776 -4.899 -9.151 1.00 2.82 C ATOM 451 NH1 ARG A 178 -6.229 -3.712 -8.762 1.00 3.53 N ATOM 452 NH2 ARG A 178 -6.632 -5.828 -9.555 1.00 3.28 N ATOM 0 H ARG A 178 0.222 -1.468 -8.337 1.00 0.23 H new ATOM 0 HA ARG A 178 -1.695 -3.088 -7.189 1.00 0.26 H new ATOM 0 HB2 ARG A 178 -1.676 -2.135 -9.492 1.00 0.39 H new ATOM 0 HB3 ARG A 178 -0.374 -3.223 -9.929 1.00 0.39 H new ATOM 0 HG2 ARG A 178 -2.630 -3.972 -10.701 1.00 0.85 H new ATOM 0 HG3 ARG A 178 -1.789 -5.153 -9.716 1.00 0.85 H new ATOM 0 HD2 ARG A 178 -3.077 -4.456 -7.731 1.00 1.65 H new ATOM 0 HD3 ARG A 178 -3.877 -3.207 -8.664 1.00 1.65 H new ATOM 0 HE ARG A 178 -4.163 -6.094 -9.420 1.00 2.02 H new ATOM 0 HH11 ARG A 178 -5.576 -2.995 -8.447 1.00 3.53 H new ATOM 0 HH12 ARG A 178 -7.230 -3.518 -8.779 1.00 3.53 H new ATOM 0 HH21 ARG A 178 -6.290 -6.742 -9.851 1.00 3.28 H new ATOM 0 HH22 ARG A 178 -7.632 -5.628 -9.569 1.00 3.28 H new ATOM 466 N ASP A 179 0.993 -4.761 -7.975 1.00 0.20 N ATOM 467 CA ASP A 179 1.666 -6.033 -7.751 1.00 0.19 C ATOM 468 C ASP A 179 2.171 -6.124 -6.326 1.00 0.17 C ATOM 469 O ASP A 179 1.902 -7.095 -5.608 1.00 0.18 O ATOM 470 CB ASP A 179 2.846 -6.188 -8.711 1.00 0.23 C ATOM 471 CG ASP A 179 3.541 -7.533 -8.577 1.00 0.32 C ATOM 472 OD1 ASP A 179 3.225 -8.451 -9.362 1.00 1.12 O ATOM 473 OD2 ASP A 179 4.407 -7.683 -7.686 1.00 1.19 O ATOM 0 H ASP A 179 1.538 -4.082 -8.507 1.00 0.20 H new ATOM 0 HA ASP A 179 0.945 -6.831 -7.929 1.00 0.19 H new ATOM 0 HB2 ASP A 179 2.494 -6.067 -9.735 1.00 0.23 H new ATOM 0 HB3 ASP A 179 3.567 -5.392 -8.525 1.00 0.23 H new ATOM 478 N SER A 180 2.865 -5.085 -5.916 1.00 0.17 N ATOM 479 CA SER A 180 3.562 -5.076 -4.651 1.00 0.18 C ATOM 480 C SER A 180 2.589 -5.290 -3.499 1.00 0.17 C ATOM 481 O SER A 180 2.716 -6.245 -2.713 1.00 0.19 O ATOM 482 CB SER A 180 4.305 -3.749 -4.533 1.00 0.22 C ATOM 483 OG SER A 180 3.500 -2.679 -4.995 1.00 1.34 O ATOM 0 H SER A 180 2.961 -4.222 -6.452 1.00 0.17 H new ATOM 0 HA SER A 180 4.280 -5.895 -4.603 1.00 0.18 H new ATOM 0 HB2 SER A 180 4.587 -3.576 -3.494 1.00 0.22 H new ATOM 0 HB3 SER A 180 5.228 -3.791 -5.111 1.00 0.22 H new ATOM 0 HG SER A 180 3.598 -2.592 -5.966 1.00 1.34 H new ATOM 489 N LEU A 181 1.579 -4.450 -3.419 1.00 0.17 N ATOM 490 CA LEU A 181 0.669 -4.559 -2.319 1.00 0.18 C ATOM 491 C LEU A 181 -0.529 -5.446 -2.634 1.00 0.18 C ATOM 492 O LEU A 181 -1.336 -5.699 -1.741 1.00 0.20 O ATOM 493 CB LEU A 181 0.201 -3.202 -1.824 1.00 0.24 C ATOM 494 CG LEU A 181 -1.112 -2.709 -2.391 1.00 0.35 C ATOM 495 CD1 LEU A 181 -2.113 -2.482 -1.280 1.00 1.08 C ATOM 496 CD2 LEU A 181 -0.861 -1.476 -3.200 1.00 0.96 C ATOM 0 H LEU A 181 1.377 -3.706 -4.087 1.00 0.17 H new ATOM 0 HA LEU A 181 1.235 -5.037 -1.519 1.00 0.18 H new ATOM 0 HB2 LEU A 181 0.113 -3.243 -0.738 1.00 0.24 H new ATOM 0 HB3 LEU A 181 0.973 -2.467 -2.054 1.00 0.24 H new ATOM 0 HG LEU A 181 -1.546 -3.461 -3.050 1.00 0.35 H new ATOM 0 HD11 LEU A 181 -3.053 -2.127 -1.704 1.00 1.08 H new ATOM 0 HD12 LEU A 181 -2.285 -3.418 -0.748 1.00 1.08 H new ATOM 0 HD13 LEU A 181 -1.724 -1.737 -0.586 1.00 1.08 H new ATOM 0 HD21 LEU A 181 -1.803 -1.114 -3.613 1.00 0.96 H new ATOM 0 HD22 LEU A 181 -0.423 -0.706 -2.564 1.00 0.96 H new ATOM 0 HD23 LEU A 181 -0.174 -1.708 -4.014 1.00 0.96 H new ATOM 508 N LYS A 182 -0.690 -5.934 -3.872 1.00 0.18 N ATOM 509 CA LYS A 182 -1.695 -6.986 -4.043 1.00 0.22 C ATOM 510 C LYS A 182 -1.279 -8.165 -3.186 1.00 0.22 C ATOM 511 O LYS A 182 -2.106 -8.785 -2.527 1.00 0.25 O ATOM 512 CB LYS A 182 -1.922 -7.467 -5.486 1.00 0.32 C ATOM 513 CG LYS A 182 -0.786 -8.294 -6.053 1.00 0.75 C ATOM 514 CD LYS A 182 -1.179 -9.030 -7.328 1.00 0.76 C ATOM 515 CE LYS A 182 -1.688 -8.089 -8.406 1.00 0.80 C ATOM 516 NZ LYS A 182 -1.924 -8.802 -9.689 1.00 1.15 N ATOM 0 H LYS A 182 -0.182 -5.645 -4.708 1.00 0.18 H new ATOM 0 HA LYS A 182 -2.648 -6.550 -3.743 1.00 0.22 H new ATOM 0 HB2 LYS A 182 -2.838 -8.057 -5.520 1.00 0.32 H new ATOM 0 HB3 LYS A 182 -2.078 -6.599 -6.126 1.00 0.32 H new ATOM 0 HG2 LYS A 182 0.064 -7.644 -6.260 1.00 0.75 H new ATOM 0 HG3 LYS A 182 -0.460 -9.017 -5.306 1.00 0.75 H new ATOM 0 HD2 LYS A 182 -0.318 -9.580 -7.707 1.00 0.76 H new ATOM 0 HD3 LYS A 182 -1.950 -9.765 -7.097 1.00 0.76 H new ATOM 0 HE2 LYS A 182 -2.615 -7.621 -8.073 1.00 0.80 H new ATOM 0 HE3 LYS A 182 -0.965 -7.288 -8.562 1.00 0.80 H new ATOM 0 HZ1 LYS A 182 -2.271 -8.129 -10.402 1.00 1.15 H new ATOM 0 HZ2 LYS A 182 -1.034 -9.227 -10.019 1.00 1.15 H new ATOM 0 HZ3 LYS A 182 -2.633 -9.550 -9.545 1.00 1.15 H new ATOM 530 N LYS A 183 0.023 -8.443 -3.169 1.00 0.22 N ATOM 531 CA LYS A 183 0.549 -9.469 -2.294 1.00 0.25 C ATOM 532 C LYS A 183 0.385 -9.047 -0.845 1.00 0.23 C ATOM 533 O LYS A 183 0.079 -9.871 0.006 1.00 0.26 O ATOM 534 CB LYS A 183 2.007 -9.773 -2.592 1.00 0.33 C ATOM 535 CG LYS A 183 2.576 -10.811 -1.655 1.00 0.40 C ATOM 536 CD LYS A 183 3.855 -11.398 -2.190 1.00 1.18 C ATOM 537 CE LYS A 183 5.077 -10.545 -1.868 1.00 1.31 C ATOM 538 NZ LYS A 183 5.135 -9.288 -2.662 1.00 1.80 N ATOM 0 H LYS A 183 0.720 -7.974 -3.747 1.00 0.22 H new ATOM 0 HA LYS A 183 -0.018 -10.382 -2.473 1.00 0.25 H new ATOM 0 HB2 LYS A 183 2.101 -10.124 -3.620 1.00 0.33 H new ATOM 0 HB3 LYS A 183 2.591 -8.856 -2.514 1.00 0.33 H new ATOM 0 HG2 LYS A 183 2.762 -10.360 -0.680 1.00 0.40 H new ATOM 0 HG3 LYS A 183 1.845 -11.606 -1.504 1.00 0.40 H new ATOM 0 HD2 LYS A 183 3.994 -12.395 -1.773 1.00 1.18 H new ATOM 0 HD3 LYS A 183 3.772 -11.513 -3.271 1.00 1.18 H new ATOM 0 HE2 LYS A 183 5.071 -10.298 -0.806 1.00 1.31 H new ATOM 0 HE3 LYS A 183 5.979 -11.128 -2.054 1.00 1.31 H new ATOM 0 HZ1 LYS A 183 6.128 -9.034 -2.838 1.00 1.80 H new ATOM 0 HZ2 LYS A 183 4.647 -9.428 -3.570 1.00 1.80 H new ATOM 0 HZ3 LYS A 183 4.670 -8.522 -2.134 1.00 1.80 H new ATOM 552 N ALA A 184 0.585 -7.758 -0.570 1.00 0.23 N ATOM 553 CA ALA A 184 0.315 -7.217 0.761 1.00 0.26 C ATOM 554 C ALA A 184 -1.078 -7.630 1.233 1.00 0.25 C ATOM 555 O ALA A 184 -1.241 -8.222 2.301 1.00 0.29 O ATOM 556 CB ALA A 184 0.425 -5.704 0.732 1.00 0.30 C ATOM 0 H ALA A 184 0.930 -7.075 -1.244 1.00 0.23 H new ATOM 0 HA ALA A 184 1.051 -7.618 1.458 1.00 0.26 H new ATOM 0 HB1 ALA A 184 0.223 -5.305 1.726 1.00 0.30 H new ATOM 0 HB2 ALA A 184 1.431 -5.418 0.424 1.00 0.30 H new ATOM 0 HB3 ALA A 184 -0.300 -5.300 0.025 1.00 0.30 H new ATOM 562 N LEU A 185 -2.072 -7.331 0.409 1.00 0.23 N ATOM 563 CA LEU A 185 -3.458 -7.666 0.704 1.00 0.26 C ATOM 564 C LEU A 185 -3.653 -9.175 0.802 1.00 0.24 C ATOM 565 O LEU A 185 -4.198 -9.673 1.786 1.00 0.27 O ATOM 566 CB LEU A 185 -4.367 -7.105 -0.390 1.00 0.31 C ATOM 567 CG LEU A 185 -4.404 -5.581 -0.492 1.00 0.50 C ATOM 568 CD1 LEU A 185 -4.568 -5.156 -1.937 1.00 1.46 C ATOM 569 CD2 LEU A 185 -5.541 -5.017 0.339 1.00 1.11 C ATOM 0 H LEU A 185 -1.941 -6.850 -0.481 1.00 0.23 H new ATOM 0 HA LEU A 185 -3.717 -7.224 1.666 1.00 0.26 H new ATOM 0 HB2 LEU A 185 -4.044 -7.509 -1.350 1.00 0.31 H new ATOM 0 HB3 LEU A 185 -5.381 -7.466 -0.217 1.00 0.31 H new ATOM 0 HG LEU A 185 -3.461 -5.191 -0.108 1.00 0.50 H new ATOM 0 HD11 LEU A 185 -4.593 -4.068 -1.996 1.00 1.46 H new ATOM 0 HD12 LEU A 185 -3.730 -5.532 -2.524 1.00 1.46 H new ATOM 0 HD13 LEU A 185 -5.499 -5.562 -2.332 1.00 1.46 H new ATOM 0 HD21 LEU A 185 -5.550 -3.930 0.253 1.00 1.11 H new ATOM 0 HD22 LEU A 185 -6.489 -5.418 -0.021 1.00 1.11 H new ATOM 0 HD23 LEU A 185 -5.402 -5.297 1.383 1.00 1.11 H new ATOM 581 N MET A 186 -3.187 -9.900 -0.209 1.00 0.22 N ATOM 582 CA MET A 186 -3.436 -11.338 -0.306 1.00 0.26 C ATOM 583 C MET A 186 -2.716 -12.114 0.792 1.00 0.29 C ATOM 584 O MET A 186 -3.118 -13.225 1.139 1.00 0.34 O ATOM 585 CB MET A 186 -3.031 -11.868 -1.682 1.00 0.30 C ATOM 586 CG MET A 186 -3.755 -11.178 -2.828 1.00 0.35 C ATOM 587 SD MET A 186 -3.565 -12.029 -4.404 1.00 0.98 S ATOM 588 CE MET A 186 -4.594 -13.467 -4.122 1.00 1.45 C ATOM 0 H MET A 186 -2.634 -9.517 -0.975 1.00 0.22 H new ATOM 0 HA MET A 186 -4.507 -11.489 -0.172 1.00 0.26 H new ATOM 0 HB2 MET A 186 -1.956 -11.741 -1.811 1.00 0.30 H new ATOM 0 HB3 MET A 186 -3.233 -12.938 -1.726 1.00 0.30 H new ATOM 0 HG2 MET A 186 -4.816 -11.105 -2.588 1.00 0.35 H new ATOM 0 HG3 MET A 186 -3.380 -10.159 -2.925 1.00 0.35 H new ATOM 0 HE1 MET A 186 -4.875 -13.907 -5.079 1.00 1.45 H new ATOM 0 HE2 MET A 186 -4.042 -14.200 -3.534 1.00 1.45 H new ATOM 0 HE3 MET A 186 -5.493 -13.171 -3.581 1.00 1.45 H new ATOM 598 N MET A 187 -1.674 -11.525 1.358 1.00 0.30 N ATOM 599 CA MET A 187 -0.947 -12.164 2.442 1.00 0.37 C ATOM 600 C MET A 187 -1.729 -12.014 3.736 1.00 0.40 C ATOM 601 O MET A 187 -1.610 -12.830 4.651 1.00 0.53 O ATOM 602 CB MET A 187 0.464 -11.583 2.600 1.00 0.44 C ATOM 603 CG MET A 187 1.475 -12.115 1.591 1.00 0.49 C ATOM 604 SD MET A 187 3.171 -11.779 2.087 1.00 0.72 S ATOM 605 CE MET A 187 4.056 -12.939 1.055 1.00 0.85 C ATOM 0 H MET A 187 -1.315 -10.610 1.086 1.00 0.30 H new ATOM 0 HA MET A 187 -0.837 -13.221 2.201 1.00 0.37 H new ATOM 0 HB2 MET A 187 0.411 -10.498 2.507 1.00 0.44 H new ATOM 0 HB3 MET A 187 0.823 -11.799 3.606 1.00 0.44 H new ATOM 0 HG2 MET A 187 1.338 -13.190 1.475 1.00 0.49 H new ATOM 0 HG3 MET A 187 1.287 -11.663 0.617 1.00 0.49 H new ATOM 0 HE1 MET A 187 4.515 -13.705 1.680 1.00 0.85 H new ATOM 0 HE2 MET A 187 3.362 -13.408 0.357 1.00 0.85 H new ATOM 0 HE3 MET A 187 4.831 -12.413 0.498 1.00 0.85 H new ATOM 615 N ARG A 188 -2.543 -10.967 3.794 1.00 0.35 N ATOM 616 CA ARG A 188 -3.441 -10.755 4.919 1.00 0.41 C ATOM 617 C ARG A 188 -4.760 -11.492 4.662 1.00 0.41 C ATOM 618 O ARG A 188 -5.593 -11.638 5.554 1.00 0.50 O ATOM 619 CB ARG A 188 -3.696 -9.256 5.126 1.00 0.47 C ATOM 620 CG ARG A 188 -4.360 -8.936 6.458 1.00 0.79 C ATOM 621 CD ARG A 188 -3.359 -8.803 7.591 1.00 0.63 C ATOM 622 NE ARG A 188 -3.986 -9.013 8.895 1.00 1.20 N ATOM 623 CZ ARG A 188 -3.316 -9.100 10.043 1.00 1.43 C ATOM 624 NH1 ARG A 188 -1.990 -9.034 10.050 1.00 1.42 N ATOM 625 NH2 ARG A 188 -3.974 -9.268 11.184 1.00 2.12 N ATOM 0 H ARG A 188 -2.598 -10.250 3.071 1.00 0.35 H new ATOM 0 HA ARG A 188 -2.981 -11.149 5.825 1.00 0.41 H new ATOM 0 HB2 ARG A 188 -2.748 -8.721 5.063 1.00 0.47 H new ATOM 0 HB3 ARG A 188 -4.325 -8.886 4.316 1.00 0.47 H new ATOM 0 HG2 ARG A 188 -4.924 -8.008 6.365 1.00 0.79 H new ATOM 0 HG3 ARG A 188 -5.076 -9.721 6.701 1.00 0.79 H new ATOM 0 HD2 ARG A 188 -2.555 -9.526 7.453 1.00 0.63 H new ATOM 0 HD3 ARG A 188 -2.905 -7.812 7.561 1.00 0.63 H new ATOM 0 HE ARG A 188 -5.002 -9.098 8.928 1.00 1.20 H new ATOM 0 HH11 ARG A 188 -1.481 -8.916 9.174 1.00 1.42 H new ATOM 0 HH12 ARG A 188 -1.481 -9.101 10.931 1.00 1.42 H new ATOM 0 HH21 ARG A 188 -4.992 -9.330 11.181 1.00 2.12 H new ATOM 0 HH22 ARG A 188 -3.461 -9.335 12.063 1.00 2.12 H new ATOM 639 N GLY A 189 -4.930 -11.959 3.427 1.00 0.37 N ATOM 640 CA GLY A 189 -6.118 -12.712 3.059 1.00 0.42 C ATOM 641 C GLY A 189 -7.109 -11.905 2.237 1.00 0.43 C ATOM 642 O GLY A 189 -8.197 -12.385 1.917 1.00 0.53 O ATOM 0 H GLY A 189 -4.260 -11.828 2.669 1.00 0.37 H new ATOM 0 HA2 GLY A 189 -5.820 -13.594 2.493 1.00 0.42 H new ATOM 0 HA3 GLY A 189 -6.611 -13.066 3.965 1.00 0.42 H new ATOM 646 N LEU A 190 -6.734 -10.683 1.891 1.00 0.37 N ATOM 647 CA LEU A 190 -7.597 -9.797 1.122 1.00 0.40 C ATOM 648 C LEU A 190 -7.255 -9.831 -0.365 1.00 0.35 C ATOM 649 O LEU A 190 -6.325 -10.518 -0.785 1.00 0.37 O ATOM 650 CB LEU A 190 -7.466 -8.367 1.645 1.00 0.45 C ATOM 651 CG LEU A 190 -7.885 -8.178 3.099 1.00 0.61 C ATOM 652 CD1 LEU A 190 -6.763 -8.540 4.047 1.00 1.05 C ATOM 653 CD2 LEU A 190 -8.329 -6.757 3.345 1.00 1.28 C ATOM 0 H LEU A 190 -5.829 -10.279 2.133 1.00 0.37 H new ATOM 0 HA LEU A 190 -8.623 -10.144 1.240 1.00 0.40 H new ATOM 0 HB2 LEU A 190 -6.429 -8.049 1.536 1.00 0.45 H new ATOM 0 HB3 LEU A 190 -8.069 -7.709 1.019 1.00 0.45 H new ATOM 0 HG LEU A 190 -8.723 -8.849 3.289 1.00 0.61 H new ATOM 0 HD11 LEU A 190 -7.094 -8.394 5.075 1.00 1.05 H new ATOM 0 HD12 LEU A 190 -6.485 -9.584 3.900 1.00 1.05 H new ATOM 0 HD13 LEU A 190 -5.900 -7.903 3.850 1.00 1.05 H new ATOM 0 HD21 LEU A 190 -8.624 -6.643 4.388 1.00 1.28 H new ATOM 0 HD22 LEU A 190 -7.507 -6.076 3.124 1.00 1.28 H new ATOM 0 HD23 LEU A 190 -9.177 -6.524 2.701 1.00 1.28 H new ATOM 665 N ILE A 191 -8.036 -9.100 -1.155 1.00 0.37 N ATOM 666 CA ILE A 191 -7.799 -8.964 -2.583 1.00 0.35 C ATOM 667 C ILE A 191 -7.854 -7.491 -2.992 1.00 0.36 C ATOM 668 O ILE A 191 -8.614 -6.707 -2.421 1.00 0.39 O ATOM 669 CB ILE A 191 -8.834 -9.751 -3.413 1.00 0.39 C ATOM 670 CG1 ILE A 191 -10.252 -9.241 -3.132 1.00 0.45 C ATOM 671 CG2 ILE A 191 -8.732 -11.233 -3.099 1.00 0.41 C ATOM 672 CD1 ILE A 191 -11.284 -9.760 -4.101 1.00 0.52 C ATOM 0 H ILE A 191 -8.851 -8.586 -0.820 1.00 0.37 H new ATOM 0 HA ILE A 191 -6.809 -9.373 -2.784 1.00 0.35 H new ATOM 0 HB ILE A 191 -8.621 -9.599 -4.471 1.00 0.39 H new ATOM 0 HG12 ILE A 191 -10.539 -9.529 -2.120 1.00 0.45 H new ATOM 0 HG13 ILE A 191 -10.250 -8.152 -3.165 1.00 0.45 H new ATOM 0 HG21 ILE A 191 -9.466 -11.781 -3.689 1.00 0.41 H new ATOM 0 HG22 ILE A 191 -7.731 -11.589 -3.343 1.00 0.41 H new ATOM 0 HG23 ILE A 191 -8.925 -11.394 -2.039 1.00 0.41 H new ATOM 0 HD11 ILE A 191 -12.263 -9.357 -3.840 1.00 0.52 H new ATOM 0 HD12 ILE A 191 -11.022 -9.450 -5.113 1.00 0.52 H new ATOM 0 HD13 ILE A 191 -11.315 -10.848 -4.052 1.00 0.52 H new ATOM 684 N PRO A 192 -7.048 -7.106 -3.992 1.00 0.39 N ATOM 685 CA PRO A 192 -6.948 -5.716 -4.460 1.00 0.43 C ATOM 686 C PRO A 192 -8.173 -5.253 -5.242 1.00 0.41 C ATOM 687 O PRO A 192 -8.263 -4.091 -5.635 1.00 0.46 O ATOM 688 CB PRO A 192 -5.718 -5.737 -5.369 1.00 0.52 C ATOM 689 CG PRO A 192 -5.645 -7.137 -5.865 1.00 0.48 C ATOM 690 CD PRO A 192 -6.146 -8.001 -4.741 1.00 0.43 C ATOM 0 HA PRO A 192 -6.877 -5.021 -3.624 1.00 0.43 H new ATOM 0 HB2 PRO A 192 -5.820 -5.029 -6.192 1.00 0.52 H new ATOM 0 HB3 PRO A 192 -4.816 -5.462 -4.822 1.00 0.52 H new ATOM 0 HG2 PRO A 192 -6.255 -7.267 -6.759 1.00 0.48 H new ATOM 0 HG3 PRO A 192 -4.623 -7.402 -6.136 1.00 0.48 H new ATOM 0 HD2 PRO A 192 -6.672 -8.880 -5.114 1.00 0.43 H new ATOM 0 HD3 PRO A 192 -5.328 -8.361 -4.116 1.00 0.43 H new ATOM 698 N GLU A 193 -9.107 -6.162 -5.480 1.00 0.39 N ATOM 699 CA GLU A 193 -10.329 -5.820 -6.190 1.00 0.43 C ATOM 700 C GLU A 193 -11.304 -5.130 -5.247 1.00 0.36 C ATOM 701 O GLU A 193 -12.108 -4.296 -5.661 1.00 0.45 O ATOM 702 CB GLU A 193 -10.977 -7.069 -6.783 1.00 0.57 C ATOM 703 CG GLU A 193 -10.004 -7.960 -7.533 1.00 0.99 C ATOM 704 CD GLU A 193 -10.698 -9.073 -8.284 1.00 1.20 C ATOM 705 OE1 GLU A 193 -10.770 -9.000 -9.528 1.00 1.73 O ATOM 706 OE2 GLU A 193 -11.183 -10.023 -7.636 1.00 1.74 O ATOM 0 H GLU A 193 -9.042 -7.139 -5.193 1.00 0.39 H new ATOM 0 HA GLU A 193 -10.075 -5.141 -7.004 1.00 0.43 H new ATOM 0 HB2 GLU A 193 -11.439 -7.644 -5.981 1.00 0.57 H new ATOM 0 HB3 GLU A 193 -11.776 -6.767 -7.460 1.00 0.57 H new ATOM 0 HG2 GLU A 193 -9.430 -7.355 -8.235 1.00 0.99 H new ATOM 0 HG3 GLU A 193 -9.293 -8.390 -6.828 1.00 0.99 H new ATOM 713 N CYS A 194 -11.212 -5.479 -3.972 1.00 0.33 N ATOM 714 CA CYS A 194 -12.085 -4.909 -2.959 1.00 0.36 C ATOM 715 C CYS A 194 -11.310 -3.933 -2.077 1.00 0.33 C ATOM 716 O CYS A 194 -11.640 -3.725 -0.908 1.00 0.49 O ATOM 717 CB CYS A 194 -12.706 -6.030 -2.116 1.00 0.48 C ATOM 718 SG CYS A 194 -13.943 -5.474 -0.917 1.00 1.69 S ATOM 0 H CYS A 194 -10.539 -6.157 -3.615 1.00 0.33 H new ATOM 0 HA CYS A 194 -12.887 -4.357 -3.450 1.00 0.36 H new ATOM 0 HB2 CYS A 194 -13.168 -6.756 -2.785 1.00 0.48 H new ATOM 0 HB3 CYS A 194 -11.910 -6.549 -1.583 1.00 0.48 H new ATOM 0 HG CYS A 194 -13.583 -4.327 -0.422 1.00 1.69 H new ATOM 724 N CYS A 195 -10.278 -3.325 -2.643 1.00 0.27 N ATOM 725 CA CYS A 195 -9.467 -2.361 -1.916 1.00 0.25 C ATOM 726 C CYS A 195 -8.869 -1.337 -2.884 1.00 0.23 C ATOM 727 O CYS A 195 -8.748 -1.605 -4.076 1.00 0.29 O ATOM 728 CB CYS A 195 -8.347 -3.075 -1.135 1.00 0.28 C ATOM 729 SG CYS A 195 -8.949 -4.156 0.187 1.00 0.52 S ATOM 0 H CYS A 195 -9.982 -3.483 -3.606 1.00 0.27 H new ATOM 0 HA CYS A 195 -10.106 -1.840 -1.203 1.00 0.25 H new ATOM 0 HB2 CYS A 195 -7.752 -3.666 -1.831 1.00 0.28 H new ATOM 0 HB3 CYS A 195 -7.683 -2.325 -0.704 1.00 0.28 H new ATOM 0 HG CYS A 195 -10.248 -4.190 0.162 1.00 0.52 H new ATOM 735 N ALA A 196 -8.548 -0.157 -2.372 1.00 0.26 N ATOM 736 CA ALA A 196 -7.774 0.835 -3.110 1.00 0.26 C ATOM 737 C ALA A 196 -6.658 1.327 -2.211 1.00 0.25 C ATOM 738 O ALA A 196 -6.615 0.987 -1.034 1.00 0.39 O ATOM 739 CB ALA A 196 -8.607 2.011 -3.582 1.00 0.37 C ATOM 0 H ALA A 196 -8.816 0.141 -1.434 1.00 0.26 H new ATOM 0 HA ALA A 196 -7.383 0.356 -4.008 1.00 0.26 H new ATOM 0 HB1 ALA A 196 -7.972 2.712 -4.124 1.00 0.37 H new ATOM 0 HB2 ALA A 196 -9.399 1.655 -4.241 1.00 0.37 H new ATOM 0 HB3 ALA A 196 -9.049 2.512 -2.721 1.00 0.37 H new ATOM 745 N VAL A 197 -5.772 2.128 -2.747 1.00 0.23 N ATOM 746 CA VAL A 197 -4.634 2.597 -1.979 1.00 0.23 C ATOM 747 C VAL A 197 -4.697 4.102 -1.758 1.00 0.24 C ATOM 748 O VAL A 197 -5.022 4.868 -2.665 1.00 0.36 O ATOM 749 CB VAL A 197 -3.309 2.231 -2.664 1.00 0.29 C ATOM 750 CG1 VAL A 197 -2.124 2.473 -1.740 1.00 0.94 C ATOM 751 CG2 VAL A 197 -3.350 0.796 -3.130 1.00 1.06 C ATOM 0 H VAL A 197 -5.811 2.471 -3.707 1.00 0.23 H new ATOM 0 HA VAL A 197 -4.677 2.099 -1.010 1.00 0.23 H new ATOM 0 HB VAL A 197 -3.179 2.877 -3.532 1.00 0.29 H new ATOM 0 HG11 VAL A 197 -1.201 2.204 -2.254 1.00 0.94 H new ATOM 0 HG12 VAL A 197 -2.090 3.526 -1.460 1.00 0.94 H new ATOM 0 HG13 VAL A 197 -2.231 1.862 -0.844 1.00 0.94 H new ATOM 0 HG21 VAL A 197 -2.407 0.544 -3.615 1.00 1.06 H new ATOM 0 HG22 VAL A 197 -3.505 0.140 -2.274 1.00 1.06 H new ATOM 0 HG23 VAL A 197 -4.168 0.667 -3.839 1.00 1.06 H new ATOM 761 N TYR A 198 -4.393 4.504 -0.540 1.00 0.29 N ATOM 762 CA TYR A 198 -4.401 5.897 -0.133 1.00 0.37 C ATOM 763 C TYR A 198 -3.154 6.212 0.684 1.00 0.45 C ATOM 764 O TYR A 198 -2.420 5.312 1.093 1.00 0.88 O ATOM 765 CB TYR A 198 -5.627 6.189 0.732 1.00 0.93 C ATOM 766 CG TYR A 198 -6.848 6.660 -0.019 1.00 0.33 C ATOM 767 CD1 TYR A 198 -7.277 7.968 0.113 1.00 0.69 C ATOM 768 CD2 TYR A 198 -7.582 5.806 -0.830 1.00 0.53 C ATOM 769 CE1 TYR A 198 -8.402 8.421 -0.539 1.00 1.46 C ATOM 770 CE2 TYR A 198 -8.711 6.249 -1.494 1.00 1.18 C ATOM 771 CZ TYR A 198 -9.119 7.560 -1.342 1.00 1.70 C ATOM 772 OH TYR A 198 -10.243 8.011 -1.994 1.00 2.49 O ATOM 0 H TYR A 198 -4.129 3.862 0.208 1.00 0.29 H new ATOM 0 HA TYR A 198 -4.425 6.512 -1.032 1.00 0.37 H new ATOM 0 HB2 TYR A 198 -5.886 5.285 1.283 1.00 0.93 H new ATOM 0 HB3 TYR A 198 -5.359 6.946 1.469 1.00 0.93 H new ATOM 0 HD1 TYR A 198 -6.719 8.648 0.740 1.00 0.69 H new ATOM 0 HD2 TYR A 198 -7.266 4.779 -0.944 1.00 0.53 H new ATOM 0 HE1 TYR A 198 -8.721 9.446 -0.422 1.00 1.46 H new ATOM 0 HE2 TYR A 198 -9.270 5.575 -2.127 1.00 1.18 H new ATOM 0 HH TYR A 198 -10.632 7.281 -2.520 1.00 2.49 H new ATOM 782 N ARG A 199 -2.925 7.489 0.913 1.00 0.34 N ATOM 783 CA ARG A 199 -1.926 7.931 1.868 1.00 0.45 C ATOM 784 C ARG A 199 -2.495 9.101 2.652 1.00 0.51 C ATOM 785 O ARG A 199 -3.141 9.974 2.076 1.00 0.60 O ATOM 786 CB ARG A 199 -0.619 8.340 1.173 1.00 0.58 C ATOM 787 CG ARG A 199 -0.775 9.502 0.205 1.00 0.81 C ATOM 788 CD ARG A 199 0.504 9.762 -0.573 1.00 0.80 C ATOM 789 NE ARG A 199 1.462 10.567 0.183 1.00 1.01 N ATOM 790 CZ ARG A 199 2.783 10.391 0.144 1.00 1.23 C ATOM 791 NH1 ARG A 199 3.313 9.450 -0.629 1.00 1.49 N ATOM 792 NH2 ARG A 199 3.578 11.174 0.859 1.00 1.57 N ATOM 0 H ARG A 199 -3.422 8.247 0.446 1.00 0.34 H new ATOM 0 HA ARG A 199 -1.687 7.106 2.539 1.00 0.45 H new ATOM 0 HB2 ARG A 199 0.116 8.608 1.932 1.00 0.58 H new ATOM 0 HB3 ARG A 199 -0.221 7.481 0.633 1.00 0.58 H new ATOM 0 HG2 ARG A 199 -1.587 9.290 -0.490 1.00 0.81 H new ATOM 0 HG3 ARG A 199 -1.054 10.400 0.756 1.00 0.81 H new ATOM 0 HD2 ARG A 199 0.964 8.810 -0.840 1.00 0.80 H new ATOM 0 HD3 ARG A 199 0.262 10.271 -1.506 1.00 0.80 H new ATOM 0 HE ARG A 199 1.097 11.310 0.778 1.00 1.01 H new ATOM 0 HH11 ARG A 199 2.709 8.857 -1.197 1.00 1.49 H new ATOM 0 HH12 ARG A 199 4.324 9.321 -0.654 1.00 1.49 H new ATOM 0 HH21 ARG A 199 3.179 11.912 1.440 1.00 1.57 H new ATOM 0 HH22 ARG A 199 4.589 11.039 0.829 1.00 1.57 H new ATOM 806 N ILE A 200 -2.305 9.116 3.957 1.00 0.61 N ATOM 807 CA ILE A 200 -2.813 10.217 4.751 1.00 0.66 C ATOM 808 C ILE A 200 -1.810 11.342 4.818 1.00 0.75 C ATOM 809 O ILE A 200 -0.687 11.187 5.301 1.00 0.88 O ATOM 810 CB ILE A 200 -3.218 9.797 6.170 1.00 0.81 C ATOM 811 CG1 ILE A 200 -4.361 8.801 6.089 1.00 0.82 C ATOM 812 CG2 ILE A 200 -3.637 11.009 6.993 1.00 0.88 C ATOM 813 CD1 ILE A 200 -5.691 9.406 5.690 1.00 0.80 C ATOM 0 H ILE A 200 -1.812 8.393 4.482 1.00 0.61 H new ATOM 0 HA ILE A 200 -3.715 10.562 4.245 1.00 0.66 H new ATOM 0 HB ILE A 200 -2.362 9.334 6.661 1.00 0.81 H new ATOM 0 HG12 ILE A 200 -4.099 8.024 5.371 1.00 0.82 H new ATOM 0 HG13 ILE A 200 -4.473 8.315 7.058 1.00 0.82 H new ATOM 0 HG21 ILE A 200 -3.920 10.688 7.995 1.00 0.88 H new ATOM 0 HG22 ILE A 200 -2.805 11.710 7.058 1.00 0.88 H new ATOM 0 HG23 ILE A 200 -4.486 11.497 6.515 1.00 0.88 H new ATOM 0 HD11 ILE A 200 -6.451 8.625 5.657 1.00 0.80 H new ATOM 0 HD12 ILE A 200 -5.980 10.163 6.420 1.00 0.80 H new ATOM 0 HD13 ILE A 200 -5.601 9.866 4.706 1.00 0.80 H new ATOM 825 N GLN A 201 -2.245 12.470 4.325 1.00 0.75 N ATOM 826 CA GLN A 201 -1.445 13.667 4.319 1.00 0.91 C ATOM 827 C GLN A 201 -1.848 14.532 5.503 1.00 0.98 C ATOM 828 O GLN A 201 -2.229 13.991 6.536 1.00 0.99 O ATOM 829 CB GLN A 201 -1.615 14.401 3.007 1.00 0.98 C ATOM 830 CG GLN A 201 -0.288 14.846 2.430 1.00 1.22 C ATOM 831 CD GLN A 201 0.769 13.756 2.482 1.00 1.76 C ATOM 832 OE1 GLN A 201 0.895 12.948 1.562 1.00 2.41 O ATOM 833 NE2 GLN A 201 1.541 13.728 3.557 1.00 2.39 N ATOM 0 H GLN A 201 -3.171 12.586 3.913 1.00 0.75 H new ATOM 0 HA GLN A 201 -0.389 13.415 4.415 1.00 0.91 H new ATOM 0 HB2 GLN A 201 -2.122 13.753 2.292 1.00 0.98 H new ATOM 0 HB3 GLN A 201 -2.254 15.271 3.158 1.00 0.98 H new ATOM 0 HG2 GLN A 201 -0.432 15.157 1.395 1.00 1.22 H new ATOM 0 HG3 GLN A 201 0.068 15.718 2.979 1.00 1.22 H new ATOM 0 HE21 GLN A 201 1.407 14.415 4.299 1.00 2.39 H new ATOM 0 HE22 GLN A 201 2.270 13.020 3.643 1.00 2.39 H new ATOM 842 N ASP A 202 -1.785 15.850 5.351 1.00 1.08 N ATOM 843 CA ASP A 202 -2.107 16.788 6.435 1.00 1.18 C ATOM 844 C ASP A 202 -3.524 16.577 6.977 1.00 1.09 C ATOM 845 O ASP A 202 -4.454 17.283 6.590 1.00 1.07 O ATOM 846 CB ASP A 202 -1.996 18.212 5.917 1.00 1.30 C ATOM 847 CG ASP A 202 -2.149 19.251 7.012 1.00 1.45 C ATOM 848 OD1 ASP A 202 -1.172 19.484 7.760 1.00 1.84 O ATOM 849 OD2 ASP A 202 -3.238 19.848 7.125 1.00 1.91 O ATOM 0 H ASP A 202 -1.511 16.303 4.479 1.00 1.08 H new ATOM 0 HA ASP A 202 -1.400 16.608 7.245 1.00 1.18 H new ATOM 0 HB2 ASP A 202 -1.029 18.343 5.432 1.00 1.30 H new ATOM 0 HB3 ASP A 202 -2.759 18.377 5.157 1.00 1.30 H new ATOM 854 N GLY A 203 -3.684 15.590 7.851 1.00 1.11 N ATOM 855 CA GLY A 203 -4.988 15.277 8.405 1.00 1.12 C ATOM 856 C GLY A 203 -5.986 14.889 7.332 1.00 0.99 C ATOM 857 O GLY A 203 -7.191 14.836 7.580 1.00 1.07 O ATOM 0 H GLY A 203 -2.926 14.996 8.188 1.00 1.11 H new ATOM 0 HA2 GLY A 203 -4.891 14.461 9.121 1.00 1.12 H new ATOM 0 HA3 GLY A 203 -5.364 16.140 8.954 1.00 1.12 H new ATOM 861 N GLU A 204 -5.489 14.630 6.128 1.00 0.86 N ATOM 862 CA GLU A 204 -6.357 14.366 5.000 1.00 0.79 C ATOM 863 C GLU A 204 -5.907 13.134 4.248 1.00 0.68 C ATOM 864 O GLU A 204 -4.941 12.486 4.620 1.00 0.67 O ATOM 865 CB GLU A 204 -6.367 15.575 4.077 1.00 0.83 C ATOM 866 CG GLU A 204 -5.057 15.781 3.346 1.00 0.82 C ATOM 867 CD GLU A 204 -5.094 16.969 2.413 1.00 0.98 C ATOM 868 OE1 GLU A 204 -5.611 16.828 1.285 1.00 1.54 O ATOM 869 OE2 GLU A 204 -4.592 18.046 2.795 1.00 1.51 O ATOM 0 H GLU A 204 -4.492 14.599 5.914 1.00 0.86 H new ATOM 0 HA GLU A 204 -7.366 14.182 5.368 1.00 0.79 H new ATOM 0 HB2 GLU A 204 -7.168 15.460 3.347 1.00 0.83 H new ATOM 0 HB3 GLU A 204 -6.594 16.467 4.661 1.00 0.83 H new ATOM 0 HG2 GLU A 204 -4.257 15.919 4.073 1.00 0.82 H new ATOM 0 HG3 GLU A 204 -4.818 14.883 2.776 1.00 0.82 H new ATOM 876 N LYS A 205 -6.609 12.825 3.184 1.00 0.69 N ATOM 877 CA LYS A 205 -6.357 11.613 2.434 1.00 0.62 C ATOM 878 C LYS A 205 -5.998 11.925 0.989 1.00 0.61 C ATOM 879 O LYS A 205 -6.621 12.770 0.350 1.00 0.71 O ATOM 880 CB LYS A 205 -7.596 10.730 2.478 1.00 0.73 C ATOM 881 CG LYS A 205 -8.163 10.584 3.869 1.00 0.90 C ATOM 882 CD LYS A 205 -9.472 9.834 3.868 1.00 1.16 C ATOM 883 CE LYS A 205 -9.306 8.417 3.356 1.00 1.29 C ATOM 884 NZ LYS A 205 -10.509 7.589 3.624 1.00 1.69 N ATOM 0 H LYS A 205 -7.366 13.400 2.814 1.00 0.69 H new ATOM 0 HA LYS A 205 -5.512 11.094 2.886 1.00 0.62 H new ATOM 0 HB2 LYS A 205 -8.359 11.150 1.822 1.00 0.73 H new ATOM 0 HB3 LYS A 205 -7.347 9.743 2.087 1.00 0.73 H new ATOM 0 HG2 LYS A 205 -7.445 10.060 4.500 1.00 0.90 H new ATOM 0 HG3 LYS A 205 -8.311 11.572 4.306 1.00 0.90 H new ATOM 0 HD2 LYS A 205 -9.879 9.810 4.879 1.00 1.16 H new ATOM 0 HD3 LYS A 205 -10.194 10.363 3.246 1.00 1.16 H new ATOM 0 HE2 LYS A 205 -9.111 8.439 2.284 1.00 1.29 H new ATOM 0 HE3 LYS A 205 -8.437 7.959 3.829 1.00 1.29 H new ATOM 0 HZ1 LYS A 205 -10.217 6.663 3.996 1.00 1.69 H new ATOM 0 HZ2 LYS A 205 -11.112 8.068 4.323 1.00 1.69 H new ATOM 0 HZ3 LYS A 205 -11.042 7.455 2.741 1.00 1.69 H new ATOM 898 N LYS A 206 -4.985 11.243 0.493 1.00 0.57 N ATOM 899 CA LYS A 206 -4.570 11.359 -0.898 1.00 0.61 C ATOM 900 C LYS A 206 -4.622 9.982 -1.550 1.00 0.57 C ATOM 901 O LYS A 206 -3.870 9.086 -1.166 1.00 0.60 O ATOM 902 CB LYS A 206 -3.140 11.907 -1.003 1.00 0.65 C ATOM 903 CG LYS A 206 -2.908 13.234 -0.295 1.00 0.84 C ATOM 904 CD LYS A 206 -3.678 14.371 -0.942 1.00 1.09 C ATOM 905 CE LYS A 206 -3.181 15.722 -0.445 1.00 1.23 C ATOM 906 NZ LYS A 206 -4.019 16.844 -0.945 1.00 1.66 N ATOM 0 H LYS A 206 -4.423 10.591 1.041 1.00 0.57 H new ATOM 0 HA LYS A 206 -5.245 12.049 -1.404 1.00 0.61 H new ATOM 0 HB2 LYS A 206 -2.452 11.168 -0.592 1.00 0.65 H new ATOM 0 HB3 LYS A 206 -2.888 12.025 -2.057 1.00 0.65 H new ATOM 0 HG2 LYS A 206 -3.206 13.144 0.750 1.00 0.84 H new ATOM 0 HG3 LYS A 206 -1.843 13.467 -0.304 1.00 0.84 H new ATOM 0 HD2 LYS A 206 -3.571 14.317 -2.025 1.00 1.09 H new ATOM 0 HD3 LYS A 206 -4.740 14.267 -0.721 1.00 1.09 H new ATOM 0 HE2 LYS A 206 -3.180 15.729 0.645 1.00 1.23 H new ATOM 0 HE3 LYS A 206 -2.150 15.869 -0.766 1.00 1.23 H new ATOM 0 HZ1 LYS A 206 -3.407 17.639 -1.218 1.00 1.66 H new ATOM 0 HZ2 LYS A 206 -4.565 16.528 -1.771 1.00 1.66 H new ATOM 0 HZ3 LYS A 206 -4.671 17.151 -0.195 1.00 1.66 H new ATOM 920 N PRO A 207 -5.530 9.773 -2.510 1.00 0.52 N ATOM 921 CA PRO A 207 -5.647 8.490 -3.199 1.00 0.47 C ATOM 922 C PRO A 207 -4.485 8.215 -4.142 1.00 0.44 C ATOM 923 O PRO A 207 -4.166 9.025 -5.017 1.00 0.53 O ATOM 924 CB PRO A 207 -6.948 8.612 -3.984 1.00 0.54 C ATOM 925 CG PRO A 207 -7.171 10.077 -4.158 1.00 0.58 C ATOM 926 CD PRO A 207 -6.522 10.755 -2.981 1.00 0.56 C ATOM 0 HA PRO A 207 -5.637 7.661 -2.492 1.00 0.47 H new ATOM 0 HB2 PRO A 207 -6.874 8.109 -4.948 1.00 0.54 H new ATOM 0 HB3 PRO A 207 -7.776 8.150 -3.446 1.00 0.54 H new ATOM 0 HG2 PRO A 207 -6.736 10.426 -5.094 1.00 0.58 H new ATOM 0 HG3 PRO A 207 -8.236 10.305 -4.197 1.00 0.58 H new ATOM 0 HD2 PRO A 207 -6.049 11.693 -3.271 1.00 0.56 H new ATOM 0 HD3 PRO A 207 -7.250 10.992 -2.205 1.00 0.56 H new ATOM 934 N ILE A 208 -3.858 7.068 -3.950 1.00 0.36 N ATOM 935 CA ILE A 208 -2.766 6.631 -4.806 1.00 0.36 C ATOM 936 C ILE A 208 -3.329 5.948 -6.042 1.00 0.32 C ATOM 937 O ILE A 208 -4.492 5.544 -6.062 1.00 0.44 O ATOM 938 CB ILE A 208 -1.837 5.628 -4.083 1.00 0.42 C ATOM 939 CG1 ILE A 208 -1.651 6.016 -2.618 1.00 0.56 C ATOM 940 CG2 ILE A 208 -0.484 5.544 -4.780 1.00 0.52 C ATOM 941 CD1 ILE A 208 -1.060 7.390 -2.414 1.00 0.90 C ATOM 0 H ILE A 208 -4.089 6.415 -3.201 1.00 0.36 H new ATOM 0 HA ILE A 208 -2.189 7.516 -5.075 1.00 0.36 H new ATOM 0 HB ILE A 208 -2.310 4.647 -4.123 1.00 0.42 H new ATOM 0 HG12 ILE A 208 -2.617 5.970 -2.116 1.00 0.56 H new ATOM 0 HG13 ILE A 208 -1.006 5.280 -2.137 1.00 0.56 H new ATOM 0 HG21 ILE A 208 0.153 4.833 -4.254 1.00 0.52 H new ATOM 0 HG22 ILE A 208 -0.625 5.213 -5.809 1.00 0.52 H new ATOM 0 HG23 ILE A 208 -0.011 6.526 -4.776 1.00 0.52 H new ATOM 0 HD11 ILE A 208 -0.961 7.589 -1.347 1.00 0.90 H new ATOM 0 HD12 ILE A 208 -0.078 7.437 -2.885 1.00 0.90 H new ATOM 0 HD13 ILE A 208 -1.714 8.138 -2.863 1.00 0.90 H new ATOM 953 N GLY A 209 -2.510 5.825 -7.063 1.00 0.34 N ATOM 954 CA GLY A 209 -2.909 5.105 -8.245 1.00 0.37 C ATOM 955 C GLY A 209 -2.361 3.699 -8.228 1.00 0.31 C ATOM 956 O GLY A 209 -1.220 3.486 -7.819 1.00 0.33 O ATOM 0 H GLY A 209 -1.568 6.214 -7.096 1.00 0.34 H new ATOM 0 HA2 GLY A 209 -3.997 5.075 -8.308 1.00 0.37 H new ATOM 0 HA3 GLY A 209 -2.553 5.628 -9.132 1.00 0.37 H new ATOM 960 N TRP A 210 -3.154 2.733 -8.667 1.00 0.29 N ATOM 961 CA TRP A 210 -2.705 1.345 -8.701 1.00 0.27 C ATOM 962 C TRP A 210 -1.602 1.161 -9.745 1.00 0.27 C ATOM 963 O TRP A 210 -0.892 0.153 -9.750 1.00 0.30 O ATOM 964 CB TRP A 210 -3.870 0.396 -9.009 1.00 0.31 C ATOM 965 CG TRP A 210 -4.813 0.165 -7.861 1.00 0.28 C ATOM 966 CD1 TRP A 210 -6.050 0.717 -7.679 1.00 0.31 C ATOM 967 CD2 TRP A 210 -4.596 -0.702 -6.743 1.00 0.26 C ATOM 968 NE1 TRP A 210 -6.613 0.237 -6.517 1.00 0.30 N ATOM 969 CE2 TRP A 210 -5.735 -0.636 -5.926 1.00 0.26 C ATOM 970 CE3 TRP A 210 -3.545 -1.529 -6.361 1.00 0.29 C ATOM 971 CZ2 TRP A 210 -5.848 -1.374 -4.748 1.00 0.26 C ATOM 972 CZ3 TRP A 210 -3.654 -2.256 -5.191 1.00 0.31 C ATOM 973 CH2 TRP A 210 -4.802 -2.176 -4.397 1.00 0.29 C ATOM 0 H TRP A 210 -4.106 2.881 -9.003 1.00 0.29 H new ATOM 0 HA TRP A 210 -2.308 1.102 -7.715 1.00 0.27 H new ATOM 0 HB2 TRP A 210 -4.435 0.797 -9.850 1.00 0.31 H new ATOM 0 HB3 TRP A 210 -3.464 -0.564 -9.327 1.00 0.31 H new ATOM 0 HD1 TRP A 210 -6.517 1.425 -8.348 1.00 0.31 H new ATOM 0 HE1 TRP A 210 -7.533 0.489 -6.155 1.00 0.30 H new ATOM 0 HE3 TRP A 210 -2.656 -1.602 -6.970 1.00 0.29 H new ATOM 0 HZ2 TRP A 210 -6.734 -1.313 -4.134 1.00 0.26 H new ATOM 0 HZ3 TRP A 210 -2.840 -2.896 -4.885 1.00 0.31 H new ATOM 0 HH2 TRP A 210 -4.862 -2.759 -3.490 1.00 0.29 H new ATOM 984 N ASP A 211 -1.460 2.153 -10.609 1.00 0.27 N ATOM 985 CA ASP A 211 -0.469 2.125 -11.674 1.00 0.29 C ATOM 986 C ASP A 211 0.758 2.934 -11.278 1.00 0.25 C ATOM 987 O ASP A 211 1.714 3.051 -12.044 1.00 0.32 O ATOM 988 CB ASP A 211 -1.065 2.701 -12.957 1.00 0.39 C ATOM 989 CG ASP A 211 -1.438 4.161 -12.807 1.00 1.49 C ATOM 990 OD1 ASP A 211 -0.799 5.012 -13.455 1.00 2.30 O ATOM 991 OD2 ASP A 211 -2.370 4.464 -12.034 1.00 2.30 O ATOM 0 H ASP A 211 -2.028 3.000 -10.592 1.00 0.27 H new ATOM 0 HA ASP A 211 -0.173 1.090 -11.844 1.00 0.29 H new ATOM 0 HB2 ASP A 211 -0.347 2.592 -13.770 1.00 0.39 H new ATOM 0 HB3 ASP A 211 -1.950 2.128 -13.234 1.00 0.39 H new ATOM 996 N THR A 212 0.716 3.492 -10.081 1.00 0.23 N ATOM 997 CA THR A 212 1.822 4.265 -9.555 1.00 0.23 C ATOM 998 C THR A 212 2.954 3.334 -9.120 1.00 0.21 C ATOM 999 O THR A 212 2.708 2.249 -8.585 1.00 0.26 O ATOM 1000 CB THR A 212 1.349 5.125 -8.367 1.00 0.25 C ATOM 1001 OG1 THR A 212 0.284 5.988 -8.796 1.00 0.30 O ATOM 1002 CG2 THR A 212 2.482 5.962 -7.790 1.00 0.31 C ATOM 0 H THR A 212 -0.083 3.421 -9.451 1.00 0.23 H new ATOM 0 HA THR A 212 2.195 4.926 -10.337 1.00 0.23 H new ATOM 0 HB THR A 212 0.998 4.453 -7.584 1.00 0.25 H new ATOM 0 HG1 THR A 212 0.196 6.736 -8.169 1.00 0.30 H new ATOM 0 HG21 THR A 212 2.108 6.554 -6.955 1.00 0.31 H new ATOM 0 HG22 THR A 212 3.279 5.305 -7.441 1.00 0.31 H new ATOM 0 HG23 THR A 212 2.872 6.627 -8.560 1.00 0.31 H new ATOM 1010 N ASP A 213 4.186 3.748 -9.382 1.00 0.23 N ATOM 1011 CA ASP A 213 5.355 2.950 -9.031 1.00 0.25 C ATOM 1012 C ASP A 213 5.599 3.007 -7.526 1.00 0.23 C ATOM 1013 O ASP A 213 5.790 4.081 -6.958 1.00 0.29 O ATOM 1014 CB ASP A 213 6.584 3.459 -9.790 1.00 0.32 C ATOM 1015 CG ASP A 213 7.802 2.579 -9.594 1.00 0.93 C ATOM 1016 OD1 ASP A 213 8.590 2.842 -8.662 1.00 1.73 O ATOM 1017 OD2 ASP A 213 7.992 1.633 -10.388 1.00 1.66 O ATOM 0 H ASP A 213 4.403 4.634 -9.838 1.00 0.23 H new ATOM 0 HA ASP A 213 5.173 1.913 -9.314 1.00 0.25 H new ATOM 0 HB2 ASP A 213 6.351 3.517 -10.853 1.00 0.32 H new ATOM 0 HB3 ASP A 213 6.816 4.471 -9.459 1.00 0.32 H new ATOM 1022 N ILE A 214 5.587 1.841 -6.887 1.00 0.23 N ATOM 1023 CA ILE A 214 5.708 1.754 -5.431 1.00 0.21 C ATOM 1024 C ILE A 214 7.095 2.175 -4.953 1.00 0.19 C ATOM 1025 O ILE A 214 7.256 2.697 -3.850 1.00 0.21 O ATOM 1026 CB ILE A 214 5.402 0.328 -4.919 1.00 0.22 C ATOM 1027 CG1 ILE A 214 5.702 0.226 -3.419 1.00 0.24 C ATOM 1028 CG2 ILE A 214 6.180 -0.717 -5.707 1.00 0.26 C ATOM 1029 CD1 ILE A 214 5.513 -1.158 -2.860 1.00 0.29 C ATOM 0 H ILE A 214 5.494 0.939 -7.354 1.00 0.23 H new ATOM 0 HA ILE A 214 4.971 2.443 -5.020 1.00 0.21 H new ATOM 0 HB ILE A 214 4.341 0.129 -5.071 1.00 0.22 H new ATOM 0 HG12 ILE A 214 6.729 0.544 -3.240 1.00 0.24 H new ATOM 0 HG13 ILE A 214 5.055 0.918 -2.880 1.00 0.24 H new ATOM 0 HG21 ILE A 214 5.945 -1.710 -5.325 1.00 0.26 H new ATOM 0 HG22 ILE A 214 5.904 -0.659 -6.760 1.00 0.26 H new ATOM 0 HG23 ILE A 214 7.249 -0.531 -5.601 1.00 0.26 H new ATOM 0 HD11 ILE A 214 5.743 -1.155 -1.795 1.00 0.29 H new ATOM 0 HD12 ILE A 214 4.480 -1.472 -3.007 1.00 0.29 H new ATOM 0 HD13 ILE A 214 6.179 -1.852 -3.373 1.00 0.29 H new ATOM 1041 N SER A 215 8.090 1.975 -5.797 1.00 0.21 N ATOM 1042 CA SER A 215 9.461 2.306 -5.453 1.00 0.23 C ATOM 1043 C SER A 215 9.659 3.828 -5.455 1.00 0.25 C ATOM 1044 O SER A 215 10.696 4.337 -5.031 1.00 0.31 O ATOM 1045 CB SER A 215 10.404 1.601 -6.431 1.00 0.31 C ATOM 1046 OG SER A 215 11.755 1.989 -6.243 1.00 1.07 O ATOM 0 H SER A 215 7.973 1.583 -6.731 1.00 0.21 H new ATOM 0 HA SER A 215 9.690 1.958 -4.446 1.00 0.23 H new ATOM 0 HB2 SER A 215 10.316 0.522 -6.304 1.00 0.31 H new ATOM 0 HB3 SER A 215 10.101 1.828 -7.453 1.00 0.31 H new ATOM 0 HG SER A 215 11.786 2.861 -5.798 1.00 1.07 H new ATOM 1052 N TRP A 216 8.649 4.553 -5.922 1.00 0.25 N ATOM 1053 CA TRP A 216 8.635 6.010 -5.824 1.00 0.33 C ATOM 1054 C TRP A 216 8.120 6.425 -4.448 1.00 0.33 C ATOM 1055 O TRP A 216 8.315 7.556 -3.998 1.00 0.45 O ATOM 1056 CB TRP A 216 7.743 6.597 -6.923 1.00 0.40 C ATOM 1057 CG TRP A 216 7.628 8.093 -6.895 1.00 1.13 C ATOM 1058 CD1 TRP A 216 8.647 9.001 -6.832 1.00 1.75 C ATOM 1059 CD2 TRP A 216 6.417 8.851 -6.941 1.00 1.92 C ATOM 1060 NE1 TRP A 216 8.139 10.279 -6.824 1.00 2.60 N ATOM 1061 CE2 TRP A 216 6.772 10.213 -6.893 1.00 2.73 C ATOM 1062 CE3 TRP A 216 5.065 8.511 -7.017 1.00 2.29 C ATOM 1063 CZ2 TRP A 216 5.822 11.229 -6.916 1.00 3.66 C ATOM 1064 CZ3 TRP A 216 4.124 9.519 -7.041 1.00 3.27 C ATOM 1065 CH2 TRP A 216 4.506 10.863 -6.991 1.00 3.87 C ATOM 0 H TRP A 216 7.826 4.155 -6.374 1.00 0.25 H new ATOM 0 HA TRP A 216 9.648 6.392 -5.954 1.00 0.33 H new ATOM 0 HB2 TRP A 216 8.135 6.293 -7.893 1.00 0.40 H new ATOM 0 HB3 TRP A 216 6.746 6.166 -6.833 1.00 0.40 H new ATOM 0 HD1 TRP A 216 9.697 8.752 -6.794 1.00 1.75 H new ATOM 0 HE1 TRP A 216 8.690 11.136 -6.775 1.00 2.60 H new ATOM 0 HE3 TRP A 216 4.761 7.475 -7.056 1.00 2.29 H new ATOM 0 HZ2 TRP A 216 6.113 12.268 -6.876 1.00 3.66 H new ATOM 0 HZ3 TRP A 216 3.076 9.266 -7.099 1.00 3.27 H new ATOM 0 HH2 TRP A 216 3.745 11.629 -7.012 1.00 3.87 H new ATOM 1076 N LEU A 217 7.475 5.484 -3.777 1.00 0.25 N ATOM 1077 CA LEU A 217 6.841 5.746 -2.495 1.00 0.26 C ATOM 1078 C LEU A 217 7.714 5.215 -1.363 1.00 0.24 C ATOM 1079 O LEU A 217 7.281 5.131 -0.216 1.00 0.25 O ATOM 1080 CB LEU A 217 5.462 5.083 -2.469 1.00 0.26 C ATOM 1081 CG LEU A 217 4.642 5.247 -3.755 1.00 0.47 C ATOM 1082 CD1 LEU A 217 3.275 4.603 -3.610 1.00 1.21 C ATOM 1083 CD2 LEU A 217 4.503 6.714 -4.124 1.00 0.92 C ATOM 0 H LEU A 217 7.376 4.523 -4.103 1.00 0.25 H new ATOM 0 HA LEU A 217 6.721 6.821 -2.358 1.00 0.26 H new ATOM 0 HB2 LEU A 217 5.590 4.019 -2.270 1.00 0.26 H new ATOM 0 HB3 LEU A 217 4.892 5.496 -1.637 1.00 0.26 H new ATOM 0 HG LEU A 217 5.175 4.741 -4.560 1.00 0.47 H new ATOM 0 HD11 LEU A 217 2.712 4.732 -4.534 1.00 1.21 H new ATOM 0 HD12 LEU A 217 3.394 3.539 -3.403 1.00 1.21 H new ATOM 0 HD13 LEU A 217 2.736 5.074 -2.788 1.00 1.21 H new ATOM 0 HD21 LEU A 217 3.918 6.805 -5.039 1.00 0.92 H new ATOM 0 HD22 LEU A 217 4.000 7.246 -3.317 1.00 0.92 H new ATOM 0 HD23 LEU A 217 5.492 7.145 -4.281 1.00 0.92 H new ATOM 1095 N THR A 218 8.933 4.821 -1.724 1.00 0.25 N ATOM 1096 CA THR A 218 9.936 4.347 -0.781 1.00 0.26 C ATOM 1097 C THR A 218 9.972 5.135 0.526 1.00 0.28 C ATOM 1098 O THR A 218 10.025 6.369 0.527 1.00 0.32 O ATOM 1099 CB THR A 218 11.338 4.419 -1.393 1.00 0.31 C ATOM 1100 OG1 THR A 218 11.396 3.679 -2.615 1.00 0.32 O ATOM 1101 CG2 THR A 218 12.332 3.871 -0.407 1.00 0.39 C ATOM 0 H THR A 218 9.253 4.823 -2.692 1.00 0.25 H new ATOM 0 HA THR A 218 9.647 3.320 -0.560 1.00 0.26 H new ATOM 0 HB THR A 218 11.577 5.458 -1.618 1.00 0.31 H new ATOM 0 HG1 THR A 218 11.138 4.259 -3.361 1.00 0.32 H new ATOM 0 HG21 THR A 218 13.333 3.919 -0.835 1.00 0.39 H new ATOM 0 HG22 THR A 218 12.300 4.462 0.508 1.00 0.39 H new ATOM 0 HG23 THR A 218 12.084 2.834 -0.178 1.00 0.39 H new ATOM 1109 N GLY A 219 9.957 4.403 1.637 1.00 0.30 N ATOM 1110 CA GLY A 219 10.119 5.013 2.940 1.00 0.37 C ATOM 1111 C GLY A 219 8.867 5.713 3.405 1.00 0.38 C ATOM 1112 O GLY A 219 8.822 6.259 4.506 1.00 0.53 O ATOM 0 H GLY A 219 9.834 3.391 1.654 1.00 0.30 H new ATOM 0 HA2 GLY A 219 10.395 4.247 3.665 1.00 0.37 H new ATOM 0 HA3 GLY A 219 10.940 5.729 2.904 1.00 0.37 H new ATOM 1116 N GLU A 220 7.848 5.687 2.568 1.00 0.29 N ATOM 1117 CA GLU A 220 6.585 6.321 2.900 1.00 0.29 C ATOM 1118 C GLU A 220 5.548 5.271 3.251 1.00 0.28 C ATOM 1119 O GLU A 220 5.488 4.214 2.629 1.00 0.40 O ATOM 1120 CB GLU A 220 6.087 7.195 1.750 1.00 0.36 C ATOM 1121 CG GLU A 220 7.014 8.355 1.441 1.00 1.26 C ATOM 1122 CD GLU A 220 6.370 9.398 0.554 1.00 1.53 C ATOM 1123 OE1 GLU A 220 6.201 10.550 1.018 1.00 2.02 O ATOM 1124 OE2 GLU A 220 6.008 9.078 -0.594 1.00 2.16 O ATOM 0 H GLU A 220 7.869 5.235 1.654 1.00 0.29 H new ATOM 0 HA GLU A 220 6.746 6.964 3.766 1.00 0.29 H new ATOM 0 HB2 GLU A 220 5.973 6.580 0.857 1.00 0.36 H new ATOM 0 HB3 GLU A 220 5.099 7.583 1.998 1.00 0.36 H new ATOM 0 HG2 GLU A 220 7.328 8.822 2.374 1.00 1.26 H new ATOM 0 HG3 GLU A 220 7.913 7.976 0.955 1.00 1.26 H new ATOM 1131 N GLU A 221 4.772 5.543 4.282 1.00 0.30 N ATOM 1132 CA GLU A 221 3.725 4.635 4.706 1.00 0.30 C ATOM 1133 C GLU A 221 2.462 4.866 3.903 1.00 0.31 C ATOM 1134 O GLU A 221 1.990 5.996 3.763 1.00 0.38 O ATOM 1135 CB GLU A 221 3.423 4.804 6.196 1.00 0.38 C ATOM 1136 CG GLU A 221 4.521 4.307 7.130 1.00 0.46 C ATOM 1137 CD GLU A 221 5.830 5.058 6.984 1.00 1.26 C ATOM 1138 OE1 GLU A 221 6.852 4.421 6.652 1.00 2.01 O ATOM 1139 OE2 GLU A 221 5.842 6.286 7.205 1.00 2.03 O ATOM 0 H GLU A 221 4.848 6.391 4.844 1.00 0.30 H new ATOM 0 HA GLU A 221 4.078 3.618 4.533 1.00 0.30 H new ATOM 0 HB2 GLU A 221 3.243 5.860 6.399 1.00 0.38 H new ATOM 0 HB3 GLU A 221 2.500 4.273 6.428 1.00 0.38 H new ATOM 0 HG2 GLU A 221 4.176 4.393 8.160 1.00 0.46 H new ATOM 0 HG3 GLU A 221 4.696 3.248 6.940 1.00 0.46 H new ATOM 1146 N LEU A 222 1.937 3.791 3.363 1.00 0.26 N ATOM 1147 CA LEU A 222 0.691 3.821 2.645 1.00 0.27 C ATOM 1148 C LEU A 222 -0.419 3.244 3.508 1.00 0.25 C ATOM 1149 O LEU A 222 -0.159 2.672 4.561 1.00 0.32 O ATOM 1150 CB LEU A 222 0.834 3.019 1.360 1.00 0.29 C ATOM 1151 CG LEU A 222 1.811 3.596 0.342 1.00 0.54 C ATOM 1152 CD1 LEU A 222 1.753 2.798 -0.949 1.00 1.19 C ATOM 1153 CD2 LEU A 222 1.512 5.065 0.093 1.00 1.19 C ATOM 0 H LEU A 222 2.367 2.867 3.412 1.00 0.26 H new ATOM 0 HA LEU A 222 0.436 4.851 2.398 1.00 0.27 H new ATOM 0 HB2 LEU A 222 1.154 2.008 1.615 1.00 0.29 H new ATOM 0 HB3 LEU A 222 -0.147 2.935 0.892 1.00 0.29 H new ATOM 0 HG LEU A 222 2.823 3.524 0.742 1.00 0.54 H new ATOM 0 HD11 LEU A 222 2.455 3.219 -1.669 1.00 1.19 H new ATOM 0 HD12 LEU A 222 2.019 1.760 -0.748 1.00 1.19 H new ATOM 0 HD13 LEU A 222 0.744 2.841 -1.358 1.00 1.19 H new ATOM 0 HD21 LEU A 222 2.219 5.462 -0.636 1.00 1.19 H new ATOM 0 HD22 LEU A 222 0.497 5.170 -0.291 1.00 1.19 H new ATOM 0 HD23 LEU A 222 1.605 5.619 1.027 1.00 1.19 H new ATOM 1165 N HIS A 223 -1.649 3.405 3.064 1.00 0.24 N ATOM 1166 CA HIS A 223 -2.800 2.896 3.783 1.00 0.26 C ATOM 1167 C HIS A 223 -3.877 2.487 2.778 1.00 0.28 C ATOM 1168 O HIS A 223 -4.134 3.202 1.819 1.00 0.46 O ATOM 1169 CB HIS A 223 -3.280 3.974 4.777 1.00 0.45 C ATOM 1170 CG HIS A 223 -4.760 4.138 4.886 1.00 0.94 C ATOM 1171 ND1 HIS A 223 -5.545 3.427 5.767 1.00 1.30 N ATOM 1172 CD2 HIS A 223 -5.593 4.963 4.219 1.00 1.85 C ATOM 1173 CE1 HIS A 223 -6.799 3.806 5.633 1.00 2.26 C ATOM 1174 NE2 HIS A 223 -6.857 4.738 4.702 1.00 2.63 N ATOM 0 H HIS A 223 -1.879 3.891 2.197 1.00 0.24 H new ATOM 0 HA HIS A 223 -2.548 2.007 4.362 1.00 0.26 H new ATOM 0 HB2 HIS A 223 -2.885 3.734 5.764 1.00 0.45 H new ATOM 0 HB3 HIS A 223 -2.847 4.931 4.485 1.00 0.45 H new ATOM 0 HD2 HIS A 223 -5.317 5.668 3.449 1.00 1.85 H new ATOM 0 HE1 HIS A 223 -7.638 3.419 6.191 1.00 2.26 H new ATOM 0 HE2 HIS A 223 -7.704 5.214 4.392 1.00 2.63 H new ATOM 1183 N VAL A 224 -4.499 1.343 2.994 1.00 0.27 N ATOM 1184 CA VAL A 224 -5.451 0.797 2.033 1.00 0.34 C ATOM 1185 C VAL A 224 -6.885 1.100 2.454 1.00 0.38 C ATOM 1186 O VAL A 224 -7.201 1.132 3.639 1.00 0.51 O ATOM 1187 CB VAL A 224 -5.273 -0.733 1.891 1.00 0.55 C ATOM 1188 CG1 VAL A 224 -6.351 -1.343 1.011 1.00 0.91 C ATOM 1189 CG2 VAL A 224 -3.916 -1.051 1.304 1.00 0.97 C ATOM 0 H VAL A 224 -4.365 0.770 3.827 1.00 0.27 H new ATOM 0 HA VAL A 224 -5.254 1.271 1.072 1.00 0.34 H new ATOM 0 HB VAL A 224 -5.356 -1.163 2.889 1.00 0.55 H new ATOM 0 HG11 VAL A 224 -6.193 -2.419 0.935 1.00 0.91 H new ATOM 0 HG12 VAL A 224 -7.330 -1.150 1.449 1.00 0.91 H new ATOM 0 HG13 VAL A 224 -6.304 -0.898 0.017 1.00 0.91 H new ATOM 0 HG21 VAL A 224 -3.804 -2.131 1.210 1.00 0.97 H new ATOM 0 HG22 VAL A 224 -3.828 -0.590 0.320 1.00 0.97 H new ATOM 0 HG23 VAL A 224 -3.136 -0.661 1.958 1.00 0.97 H new ATOM 1199 N GLU A 225 -7.731 1.337 1.467 1.00 0.38 N ATOM 1200 CA GLU A 225 -9.148 1.553 1.689 1.00 0.49 C ATOM 1201 C GLU A 225 -9.913 0.359 1.163 1.00 0.39 C ATOM 1202 O GLU A 225 -9.505 -0.250 0.181 1.00 0.46 O ATOM 1203 CB GLU A 225 -9.623 2.812 0.965 1.00 0.68 C ATOM 1204 CG GLU A 225 -9.111 4.102 1.571 1.00 0.93 C ATOM 1205 CD GLU A 225 -9.668 4.367 2.953 1.00 1.32 C ATOM 1206 OE1 GLU A 225 -9.162 5.282 3.624 1.00 1.78 O ATOM 1207 OE2 GLU A 225 -10.622 3.678 3.371 1.00 1.94 O ATOM 0 H GLU A 225 -7.453 1.385 0.487 1.00 0.38 H new ATOM 0 HA GLU A 225 -9.324 1.678 2.757 1.00 0.49 H new ATOM 0 HB2 GLU A 225 -9.306 2.761 -0.077 1.00 0.68 H new ATOM 0 HB3 GLU A 225 -10.713 2.830 0.966 1.00 0.68 H new ATOM 0 HG2 GLU A 225 -8.023 4.065 1.625 1.00 0.93 H new ATOM 0 HG3 GLU A 225 -9.370 4.933 0.915 1.00 0.93 H new ATOM 1214 N VAL A 226 -10.999 0.006 1.810 1.00 0.50 N ATOM 1215 CA VAL A 226 -11.821 -1.089 1.329 1.00 0.48 C ATOM 1216 C VAL A 226 -12.781 -0.599 0.251 1.00 0.52 C ATOM 1217 O VAL A 226 -13.674 0.206 0.507 1.00 0.69 O ATOM 1218 CB VAL A 226 -12.615 -1.773 2.449 1.00 0.64 C ATOM 1219 CG1 VAL A 226 -13.189 -3.086 1.947 1.00 1.12 C ATOM 1220 CG2 VAL A 226 -11.730 -1.997 3.661 1.00 1.12 C ATOM 0 H VAL A 226 -11.335 0.453 2.663 1.00 0.50 H new ATOM 0 HA VAL A 226 -11.138 -1.829 0.912 1.00 0.48 H new ATOM 0 HB VAL A 226 -13.440 -1.127 2.748 1.00 0.64 H new ATOM 0 HG11 VAL A 226 -13.752 -3.567 2.747 1.00 1.12 H new ATOM 0 HG12 VAL A 226 -13.851 -2.894 1.102 1.00 1.12 H new ATOM 0 HG13 VAL A 226 -12.377 -3.741 1.630 1.00 1.12 H new ATOM 0 HG21 VAL A 226 -12.307 -2.483 4.448 1.00 1.12 H new ATOM 0 HG22 VAL A 226 -10.888 -2.631 3.384 1.00 1.12 H new ATOM 0 HG23 VAL A 226 -11.359 -1.038 4.023 1.00 1.12 H new ATOM 1230 N LEU A 227 -12.579 -1.103 -0.951 1.00 0.49 N ATOM 1231 CA LEU A 227 -13.321 -0.676 -2.126 1.00 0.65 C ATOM 1232 C LEU A 227 -14.350 -1.724 -2.512 1.00 0.83 C ATOM 1233 O LEU A 227 -14.066 -2.646 -3.275 1.00 0.94 O ATOM 1234 CB LEU A 227 -12.342 -0.415 -3.259 1.00 0.71 C ATOM 1235 CG LEU A 227 -11.829 1.023 -3.323 1.00 0.58 C ATOM 1236 CD1 LEU A 227 -12.951 1.936 -3.712 1.00 1.69 C ATOM 1237 CD2 LEU A 227 -11.244 1.467 -1.993 1.00 1.23 C ATOM 0 H LEU A 227 -11.888 -1.828 -1.143 1.00 0.49 H new ATOM 0 HA LEU A 227 -13.862 0.245 -1.909 1.00 0.65 H new ATOM 0 HB2 LEU A 227 -11.491 -1.088 -3.152 1.00 0.71 H new ATOM 0 HB3 LEU A 227 -12.825 -0.659 -4.205 1.00 0.71 H new ATOM 0 HG LEU A 227 -11.035 1.068 -4.069 1.00 0.58 H new ATOM 0 HD11 LEU A 227 -12.586 2.962 -3.758 1.00 1.69 H new ATOM 0 HD12 LEU A 227 -13.336 1.644 -4.689 1.00 1.69 H new ATOM 0 HD13 LEU A 227 -13.749 1.868 -2.973 1.00 1.69 H new ATOM 0 HD21 LEU A 227 -10.889 2.494 -2.076 1.00 1.23 H new ATOM 0 HD22 LEU A 227 -12.011 1.409 -1.221 1.00 1.23 H new ATOM 0 HD23 LEU A 227 -10.411 0.816 -1.726 1.00 1.23 H new ATOM 1249 N GLU A 228 -15.543 -1.570 -1.965 1.00 0.99 N ATOM 1250 CA GLU A 228 -16.596 -2.562 -2.108 1.00 1.23 C ATOM 1251 C GLU A 228 -17.511 -2.229 -3.278 1.00 1.51 C ATOM 1252 O GLU A 228 -17.942 -1.081 -3.427 1.00 1.69 O ATOM 1253 CB GLU A 228 -17.400 -2.632 -0.812 1.00 1.37 C ATOM 1254 CG GLU A 228 -16.540 -2.927 0.404 1.00 1.33 C ATOM 1255 CD GLU A 228 -17.284 -2.750 1.707 1.00 1.66 C ATOM 1256 OE1 GLU A 228 -17.078 -1.717 2.377 1.00 2.12 O ATOM 1257 OE2 GLU A 228 -18.072 -3.647 2.074 1.00 2.12 O ATOM 0 H GLU A 228 -15.809 -0.756 -1.411 1.00 0.99 H new ATOM 0 HA GLU A 228 -16.139 -3.531 -2.310 1.00 1.23 H new ATOM 0 HB2 GLU A 228 -17.920 -1.686 -0.662 1.00 1.37 H new ATOM 0 HB3 GLU A 228 -18.164 -3.404 -0.906 1.00 1.37 H new ATOM 0 HG2 GLU A 228 -16.168 -3.949 0.340 1.00 1.33 H new ATOM 0 HG3 GLU A 228 -15.670 -2.270 0.396 1.00 1.33 H new ATOM 1264 N ASN A 229 -17.790 -3.238 -4.099 1.00 1.75 N ATOM 1265 CA ASN A 229 -18.666 -3.097 -5.261 1.00 2.12 C ATOM 1266 C ASN A 229 -18.148 -2.047 -6.224 1.00 2.52 C ATOM 1267 O ASN A 229 -18.842 -1.085 -6.568 1.00 3.17 O ATOM 1268 CB ASN A 229 -20.103 -2.793 -4.844 1.00 2.91 C ATOM 1269 CG ASN A 229 -20.770 -4.017 -4.268 1.00 3.55 C ATOM 1270 OD1 ASN A 229 -20.849 -4.194 -3.052 1.00 4.42 O ATOM 1271 ND2 ASN A 229 -21.218 -4.895 -5.146 1.00 3.65 N ATOM 0 H ASN A 229 -17.415 -4.179 -3.978 1.00 1.75 H new ATOM 0 HA ASN A 229 -18.666 -4.054 -5.782 1.00 2.12 H new ATOM 0 HB2 ASN A 229 -20.109 -1.990 -4.107 1.00 2.91 H new ATOM 0 HB3 ASN A 229 -20.668 -2.438 -5.706 1.00 2.91 H new ATOM 0 HD21 ASN A 229 -21.650 -5.761 -4.826 1.00 3.65 H new ATOM 0 HD22 ASN A 229 -21.132 -4.707 -6.145 1.00 3.65 H new ATOM 1278 N VAL A 230 -16.916 -2.250 -6.652 1.00 2.85 N ATOM 1279 CA VAL A 230 -16.285 -1.394 -7.634 1.00 3.94 C ATOM 1280 C VAL A 230 -16.991 -1.500 -8.989 1.00 4.43 C ATOM 1281 O VAL A 230 -17.030 -2.570 -9.598 1.00 4.68 O ATOM 1282 CB VAL A 230 -14.801 -1.751 -7.771 1.00 4.70 C ATOM 1283 CG1 VAL A 230 -14.226 -1.249 -9.082 1.00 5.77 C ATOM 1284 CG2 VAL A 230 -14.020 -1.197 -6.592 1.00 4.92 C ATOM 0 H VAL A 230 -16.325 -3.015 -6.327 1.00 2.85 H new ATOM 0 HA VAL A 230 -16.368 -0.362 -7.293 1.00 3.94 H new ATOM 0 HB VAL A 230 -14.713 -2.837 -7.773 1.00 4.70 H new ATOM 0 HG11 VAL A 230 -13.172 -1.520 -9.145 1.00 5.77 H new ATOM 0 HG12 VAL A 230 -14.767 -1.701 -9.913 1.00 5.77 H new ATOM 0 HG13 VAL A 230 -14.325 -0.165 -9.131 1.00 5.77 H new ATOM 0 HG21 VAL A 230 -12.967 -1.456 -6.699 1.00 4.92 H new ATOM 0 HG22 VAL A 230 -14.126 -0.113 -6.563 1.00 4.92 H new ATOM 0 HG23 VAL A 230 -14.406 -1.624 -5.667 1.00 4.92 H new ATOM 1294 N PRO A 231 -17.572 -0.388 -9.475 1.00 4.99 N ATOM 1295 CA PRO A 231 -18.300 -0.360 -10.747 1.00 5.82 C ATOM 1296 C PRO A 231 -17.378 -0.188 -11.954 1.00 6.50 C ATOM 1297 O PRO A 231 -17.820 0.219 -13.030 1.00 7.15 O ATOM 1298 CB PRO A 231 -19.202 0.860 -10.584 1.00 6.52 C ATOM 1299 CG PRO A 231 -18.414 1.793 -9.731 1.00 6.28 C ATOM 1300 CD PRO A 231 -17.580 0.933 -8.813 1.00 5.31 C ATOM 0 HA PRO A 231 -18.831 -1.292 -10.940 1.00 5.82 H new ATOM 0 HB2 PRO A 231 -19.441 1.309 -11.548 1.00 6.52 H new ATOM 0 HB3 PRO A 231 -20.148 0.594 -10.113 1.00 6.52 H new ATOM 0 HG2 PRO A 231 -17.781 2.436 -10.342 1.00 6.28 H new ATOM 0 HG3 PRO A 231 -19.073 2.446 -9.159 1.00 6.28 H new ATOM 0 HD2 PRO A 231 -16.571 1.330 -8.701 1.00 5.31 H new ATOM 0 HD3 PRO A 231 -18.013 0.877 -7.814 1.00 5.31 H new ATOM 1308 N LEU A 232 -16.101 -0.510 -11.755 1.00 6.68 N ATOM 1309 CA LEU A 232 -15.080 -0.401 -12.796 1.00 7.61 C ATOM 1310 C LEU A 232 -14.968 1.033 -13.298 1.00 8.10 C ATOM 1311 O LEU A 232 -15.508 1.335 -14.380 1.00 8.45 O ATOM 1312 CB LEU A 232 -15.385 -1.351 -13.962 1.00 8.09 C ATOM 1313 CG LEU A 232 -15.425 -2.837 -13.602 1.00 8.52 C ATOM 1314 CD1 LEU A 232 -15.825 -3.663 -14.813 1.00 9.01 C ATOM 1315 CD2 LEU A 232 -14.077 -3.298 -13.068 1.00 8.89 C ATOM 1316 OXT LEU A 232 -14.356 1.860 -12.593 1.00 8.40 O ATOM 0 H LEU A 232 -15.744 -0.855 -10.864 1.00 6.68 H new ATOM 0 HA LEU A 232 -14.124 -0.688 -12.358 1.00 7.61 H new ATOM 0 HB2 LEU A 232 -16.346 -1.073 -14.394 1.00 8.09 H new ATOM 0 HB3 LEU A 232 -14.633 -1.202 -14.737 1.00 8.09 H new ATOM 0 HG LEU A 232 -16.170 -2.980 -12.820 1.00 8.52 H new ATOM 0 HD11 LEU A 232 -15.849 -4.718 -14.542 1.00 9.01 H new ATOM 0 HD12 LEU A 232 -16.813 -3.353 -15.154 1.00 9.01 H new ATOM 0 HD13 LEU A 232 -15.100 -3.511 -15.613 1.00 9.01 H new ATOM 0 HD21 LEU A 232 -14.128 -4.358 -12.818 1.00 8.89 H new ATOM 0 HD22 LEU A 232 -13.312 -3.141 -13.828 1.00 8.89 H new ATOM 0 HD23 LEU A 232 -13.825 -2.726 -12.175 1.00 8.89 H new TER 1328 LEU A 232 HETATM 1329 C1 6FS A 301 3.225 -7.702 7.633 1.00 0.80 C HETATM 1330 C2 6FS A 301 4.610 -7.553 7.752 1.00 0.77 C HETATM 1331 C3 6FS A 301 5.462 -8.024 6.756 1.00 0.81 C HETATM 1332 C5 6FS A 301 3.528 -8.781 5.497 1.00 0.95 C HETATM 1333 C6 6FS A 301 2.679 -8.314 6.511 1.00 0.91 C HETATM 1334 C7 6FS A 301 0.880 -9.069 5.221 1.00 1.27 C HETATM 1335 C8 6FS A 301 5.156 -9.625 3.557 1.00 0.80 C HETATM 1336 C10 6FS A 301 4.220 -6.441 9.744 1.00 0.82 C HETATM 1337 C11 6FS A 301 7.611 -7.404 8.090 1.00 1.49 C HETATM 1338 C12 6FS A 301 9.483 -5.605 6.799 1.00 1.96 C HETATM 1339 C13 6FS A 301 11.372 -4.393 7.642 1.00 1.84 C HETATM 1340 C14 6FS A 301 12.690 -3.977 7.521 1.00 1.74 C HETATM 1341 C15 6FS A 301 13.473 -4.406 6.456 1.00 1.69 C HETATM 1342 C16 6FS A 301 12.902 -5.297 5.488 1.00 2.16 C HETATM 1343 C19 6FS A 301 15.509 -4.277 5.226 1.00 1.67 C HETATM 1344 C21 6FS A 301 14.075 -7.046 2.422 1.00 4.68 C HETATM 1345 O7 6FS A 301 15.264 -7.037 2.802 1.00 5.16 O HETATM 1346 S1 6FS A 301 9.311 -7.029 7.931 1.00 1.70 S HETATM 1347 C18 6FS A 301 10.819 -5.247 6.700 1.00 1.73 C HETATM 1348 O8 6FS A 301 13.675 -7.333 1.272 1.00 5.16 O HETATM 1349 O4 6FS A 301 9.922 -6.688 9.301 1.00 2.47 O HETATM 1350 O3 6FS A 301 5.194 -6.892 8.797 1.00 0.90 O HETATM 1351 O6 6FS A 301 14.757 -3.884 6.362 1.00 1.94 O HETATM 1352 C17 6FS A 301 11.576 -5.702 5.633 1.00 2.11 C HETATM 1353 C9 6FS A 301 6.849 -7.837 6.829 1.00 0.93 C HETATM 1354 O1 6FS A 301 1.312 -8.419 6.423 1.00 1.11 O HETATM 1355 C4 6FS A 301 4.915 -8.625 5.631 1.00 0.89 C HETATM 1356 C20 6FS A 301 13.012 -6.679 3.459 1.00 3.94 C HETATM 1357 O5 6FS A 301 10.057 -8.233 7.328 1.00 2.60 O HETATM 1358 N1 6FS A 301 13.610 -5.765 4.445 1.00 3.01 N HETATM 1359 O2 6FS A 301 5.813 -9.027 4.677 1.00 1.06 O