USER MOD reduce.3.24.130724 H: found=0, std=0, add=852, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 853 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 147 SER OG : rot 130:sc= -1.39 USER MOD Set 1.2: A 179 MET CE :methyl 159:sc= 0 (180deg=0) USER MOD Set 2.1: A 132 TYR OH : rot 5:sc= 0.94 USER MOD Set 2.2: A 189 MET CE :methyl -167:sc= -3.78 (180deg=-4.83!) USER MOD Single : A 125 LYS NZ :NH3+ 179:sc= 0 (180deg=-0.000655) USER MOD Single : A 129 LYS NZ :NH3+ 150:sc= 1.31 (180deg=0.804) USER MOD Single : A 131 LYS NZ :NH3+ 142:sc= 1.26 (180deg=0.99) USER MOD Single : A 138 SER OG : rot -22:sc= 0.0475 USER MOD Single : A 140 SER OG : rot 180:sc= 0 USER MOD Single : A 143 ASN : amide:sc= -0.623 K(o=-0.62,f=0) USER MOD Single : A 150 LYS NZ :NH3+ -169:sc= 1.08 (180deg=0.99) USER MOD Single : A 152 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 157 ASN : amide:sc= -6.41! C(o=-6.4!,f=-9.2!) USER MOD Single : A 158 SER OG : rot -81:sc= -0.0868 USER MOD Single : A 159 LYS NZ :NH3+ -150:sc= -0.0498 (180deg=-1.13) USER MOD Single : A 172 SER OG : rot 75:sc= -0.806 USER MOD Single : A 176 HIS : no HD1:sc= -0.0419 X(o=-0.042,f=-0.016) USER MOD Single : A 193 TYR OH : rot 35:sc= -4.42! USER MOD Single : A 194 CYS SG : rot 180:sc= -1.81 USER MOD Single : A 198 LYS NZ :NH3+ 180:sc= -0.751 (180deg=-0.751) USER MOD Single : A 203 MET CE :methyl -160:sc= -0.0849 (180deg=-0.557) USER MOD Single : A 204 SER OG : rot 180:sc= 0 USER MOD Single : B 312 THR OG1 : rot -150:sc= 1.29 USER MOD Single : B 313 ASN : amide:sc= -7.81! C(o=-7.8!,f=-6!) USER MOD Single : B 317 ASN : amide:sc= -0.0861 K(o=-0.086,f=-1.5) USER MOD Single : B 326 SER OG : rot -102:sc= 1.07 USER MOD Single : B 329 ASN : amide:sc= 0.897 K(o=0.9,f=-0.42) USER MOD Single : B 332 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N PRO A 121 -14.209 11.469 -8.753 1.00 0.66 N ATOM 2 CA PRO A 121 -14.812 10.243 -8.224 1.00 0.65 C ATOM 3 C PRO A 121 -13.764 9.389 -7.543 1.00 0.54 C ATOM 4 O PRO A 121 -13.281 8.399 -8.105 1.00 0.51 O ATOM 5 CB PRO A 121 -15.288 9.569 -9.498 1.00 0.77 C ATOM 6 CG PRO A 121 -14.143 9.845 -10.389 1.00 0.76 C ATOM 7 CD PRO A 121 -13.863 11.303 -10.181 1.00 0.74 C ATOM 0 HA PRO A 121 -15.593 10.412 -7.483 1.00 0.65 H new ATOM 0 HB2 PRO A 121 -15.461 8.501 -9.363 1.00 0.77 H new ATOM 0 HB3 PRO A 121 -16.218 9.998 -9.872 1.00 0.77 H new ATOM 0 HG2 PRO A 121 -13.280 9.232 -10.130 1.00 0.76 H new ATOM 0 HG3 PRO A 121 -14.386 9.630 -11.430 1.00 0.76 H new ATOM 0 HD2 PRO A 121 -12.821 11.553 -10.382 1.00 0.74 H new ATOM 0 HD3 PRO A 121 -14.473 11.934 -10.827 1.00 0.74 H new ATOM 15 N TRP A 122 -13.421 9.774 -6.335 1.00 0.50 N ATOM 16 CA TRP A 122 -12.356 9.123 -5.616 1.00 0.43 C ATOM 17 C TRP A 122 -12.629 7.639 -5.524 1.00 0.44 C ATOM 18 O TRP A 122 -13.769 7.213 -5.309 1.00 0.49 O ATOM 19 CB TRP A 122 -12.238 9.711 -4.233 1.00 0.43 C ATOM 20 CG TRP A 122 -11.052 9.202 -3.483 1.00 0.36 C ATOM 21 CD1 TRP A 122 -9.751 9.298 -3.872 1.00 0.39 C ATOM 22 CD2 TRP A 122 -11.047 8.525 -2.222 1.00 0.29 C ATOM 23 NE1 TRP A 122 -8.935 8.714 -2.940 1.00 0.34 N ATOM 24 CE2 TRP A 122 -9.706 8.235 -1.918 1.00 0.26 C ATOM 25 CE3 TRP A 122 -12.040 8.131 -1.322 1.00 0.31 C ATOM 26 CZ2 TRP A 122 -9.334 7.577 -0.757 1.00 0.22 C ATOM 27 CZ3 TRP A 122 -11.664 7.475 -0.166 1.00 0.29 C ATOM 28 CH2 TRP A 122 -10.321 7.204 0.105 1.00 0.22 C ATOM 0 H TRP A 122 -13.868 10.539 -5.830 1.00 0.50 H new ATOM 0 HA TRP A 122 -11.418 9.279 -6.150 1.00 0.43 H new ATOM 0 HB2 TRP A 122 -12.174 10.796 -4.310 1.00 0.43 H new ATOM 0 HB3 TRP A 122 -13.143 9.484 -3.669 1.00 0.43 H new ATOM 0 HD1 TRP A 122 -9.411 9.767 -4.784 1.00 0.39 H new ATOM 0 HE1 TRP A 122 -7.919 8.647 -2.999 1.00 0.34 H new ATOM 0 HE3 TRP A 122 -13.081 8.335 -1.526 1.00 0.31 H new ATOM 0 HZ2 TRP A 122 -8.297 7.367 -0.542 1.00 0.22 H new ATOM 0 HZ3 TRP A 122 -12.421 7.167 0.540 1.00 0.29 H new ATOM 0 HH2 TRP A 122 -10.059 6.688 1.017 1.00 0.22 H new ATOM 39 N ALA A 123 -11.581 6.854 -5.715 1.00 0.44 N ATOM 40 CA ALA A 123 -11.721 5.435 -5.735 1.00 0.50 C ATOM 41 C ALA A 123 -11.863 4.929 -4.312 1.00 0.61 C ATOM 42 O ALA A 123 -12.170 5.703 -3.411 1.00 1.38 O ATOM 43 CB ALA A 123 -10.557 4.762 -6.435 1.00 0.46 C ATOM 0 H ALA A 123 -10.629 7.191 -5.857 1.00 0.44 H new ATOM 0 HA ALA A 123 -12.616 5.183 -6.303 1.00 0.50 H new ATOM 0 HB1 ALA A 123 -10.703 3.682 -6.428 1.00 0.46 H new ATOM 0 HB2 ALA A 123 -10.499 5.114 -7.465 1.00 0.46 H new ATOM 0 HB3 ALA A 123 -9.630 5.006 -5.916 1.00 0.46 H new ATOM 49 N VAL A 124 -11.581 3.652 -4.103 1.00 0.37 N ATOM 50 CA VAL A 124 -11.893 2.997 -2.840 1.00 0.35 C ATOM 51 C VAL A 124 -13.270 3.406 -2.398 1.00 0.39 C ATOM 52 O VAL A 124 -13.437 3.983 -1.321 1.00 0.71 O ATOM 53 CB VAL A 124 -10.943 3.313 -1.675 1.00 0.36 C ATOM 54 CG1 VAL A 124 -10.649 2.041 -0.914 1.00 0.53 C ATOM 55 CG2 VAL A 124 -9.675 4.000 -2.123 1.00 0.20 C ATOM 0 H VAL A 124 -11.136 3.047 -4.793 1.00 0.37 H new ATOM 0 HA VAL A 124 -11.797 1.932 -3.053 1.00 0.35 H new ATOM 0 HB VAL A 124 -11.441 4.023 -1.014 1.00 0.36 H new ATOM 0 HG11 VAL A 124 -9.975 2.260 -0.086 1.00 0.53 H new ATOM 0 HG12 VAL A 124 -11.579 1.627 -0.525 1.00 0.53 H new ATOM 0 HG13 VAL A 124 -10.181 1.318 -1.581 1.00 0.53 H new ATOM 0 HG21 VAL A 124 -9.043 4.198 -1.257 1.00 0.20 H new ATOM 0 HG22 VAL A 124 -9.141 3.357 -2.823 1.00 0.20 H new ATOM 0 HG23 VAL A 124 -9.925 4.941 -2.613 1.00 0.20 H new ATOM 65 N LYS A 125 -14.242 3.132 -3.246 1.00 0.25 N ATOM 66 CA LYS A 125 -15.596 3.510 -2.987 1.00 0.22 C ATOM 67 C LYS A 125 -15.970 3.045 -1.602 1.00 0.21 C ATOM 68 O LYS A 125 -15.524 1.996 -1.174 1.00 0.27 O ATOM 69 CB LYS A 125 -16.512 2.900 -4.045 1.00 0.33 C ATOM 70 CG LYS A 125 -16.492 3.633 -5.385 1.00 0.66 C ATOM 71 CD LYS A 125 -15.179 3.433 -6.136 1.00 0.88 C ATOM 72 CE LYS A 125 -14.964 1.977 -6.532 1.00 1.68 C ATOM 73 NZ LYS A 125 -15.853 1.562 -7.647 1.00 2.43 N ATOM 0 H LYS A 125 -14.104 2.641 -4.130 1.00 0.25 H new ATOM 0 HA LYS A 125 -15.707 4.593 -3.036 1.00 0.22 H new ATOM 0 HB2 LYS A 125 -16.222 1.862 -4.207 1.00 0.33 H new ATOM 0 HB3 LYS A 125 -17.533 2.890 -3.664 1.00 0.33 H new ATOM 0 HG2 LYS A 125 -17.318 3.280 -6.002 1.00 0.66 H new ATOM 0 HG3 LYS A 125 -16.653 4.698 -5.216 1.00 0.66 H new ATOM 0 HD2 LYS A 125 -15.174 4.056 -7.030 1.00 0.88 H new ATOM 0 HD3 LYS A 125 -14.350 3.765 -5.511 1.00 0.88 H new ATOM 0 HE2 LYS A 125 -13.924 1.832 -6.825 1.00 1.68 H new ATOM 0 HE3 LYS A 125 -15.144 1.337 -5.668 1.00 1.68 H new ATOM 0 HZ1 LYS A 125 -15.660 0.570 -7.894 1.00 2.43 H new ATOM 0 HZ2 LYS A 125 -16.846 1.659 -7.354 1.00 2.43 H new ATOM 0 HZ3 LYS A 125 -15.676 2.166 -8.475 1.00 2.43 H new ATOM 87 N PRO A 126 -16.735 3.861 -0.889 1.00 0.24 N ATOM 88 CA PRO A 126 -17.124 3.677 0.512 1.00 0.25 C ATOM 89 C PRO A 126 -17.250 2.220 0.987 1.00 0.24 C ATOM 90 O PRO A 126 -16.927 1.930 2.136 1.00 0.26 O ATOM 91 CB PRO A 126 -18.488 4.388 0.555 1.00 0.30 C ATOM 92 CG PRO A 126 -18.598 5.148 -0.743 1.00 0.32 C ATOM 93 CD PRO A 126 -17.243 5.123 -1.373 1.00 0.31 C ATOM 0 HA PRO A 126 -16.360 4.068 1.184 1.00 0.25 H new ATOM 0 HB2 PRO A 126 -19.301 3.669 0.657 1.00 0.30 H new ATOM 0 HB3 PRO A 126 -18.550 5.062 1.409 1.00 0.30 H new ATOM 0 HG2 PRO A 126 -19.338 4.689 -1.399 1.00 0.32 H new ATOM 0 HG3 PRO A 126 -18.923 6.173 -0.565 1.00 0.32 H new ATOM 0 HD2 PRO A 126 -17.294 5.156 -2.461 1.00 0.31 H new ATOM 0 HD3 PRO A 126 -16.626 5.964 -1.057 1.00 0.31 H new ATOM 101 N GLU A 127 -17.686 1.304 0.126 1.00 0.26 N ATOM 102 CA GLU A 127 -17.742 -0.110 0.496 1.00 0.27 C ATOM 103 C GLU A 127 -16.332 -0.691 0.692 1.00 0.22 C ATOM 104 O GLU A 127 -16.095 -1.468 1.616 1.00 0.20 O ATOM 105 CB GLU A 127 -18.497 -0.914 -0.559 1.00 0.35 C ATOM 106 CG GLU A 127 -18.712 -2.364 -0.165 1.00 0.42 C ATOM 107 CD GLU A 127 -19.492 -3.139 -1.198 1.00 1.32 C ATOM 108 OE1 GLU A 127 -20.735 -3.062 -1.187 1.00 1.33 O ATOM 109 OE2 GLU A 127 -18.860 -3.826 -2.031 1.00 2.22 O ATOM 0 H GLU A 127 -18.002 1.510 -0.822 1.00 0.26 H new ATOM 0 HA GLU A 127 -18.276 -0.182 1.443 1.00 0.27 H new ATOM 0 HB2 GLU A 127 -19.465 -0.446 -0.739 1.00 0.35 H new ATOM 0 HB3 GLU A 127 -17.945 -0.877 -1.498 1.00 0.35 H new ATOM 0 HG2 GLU A 127 -17.744 -2.842 -0.013 1.00 0.42 H new ATOM 0 HG3 GLU A 127 -19.240 -2.403 0.788 1.00 0.42 H new ATOM 116 N ASP A 128 -15.388 -0.274 -0.151 1.00 0.21 N ATOM 117 CA ASP A 128 -14.013 -0.747 -0.064 1.00 0.17 C ATOM 118 C ASP A 128 -13.322 0.019 1.033 1.00 0.16 C ATOM 119 O ASP A 128 -12.549 -0.538 1.802 1.00 0.17 O ATOM 120 CB ASP A 128 -13.238 -0.529 -1.374 1.00 0.22 C ATOM 121 CG ASP A 128 -13.832 -1.245 -2.568 1.00 0.39 C ATOM 122 OD1 ASP A 128 -14.029 -2.476 -2.496 1.00 0.52 O ATOM 123 OD2 ASP A 128 -14.086 -0.577 -3.596 1.00 0.51 O ATOM 0 H ASP A 128 -15.555 0.393 -0.904 1.00 0.21 H new ATOM 0 HA ASP A 128 -14.034 -1.818 0.137 1.00 0.17 H new ATOM 0 HB2 ASP A 128 -13.198 0.539 -1.587 1.00 0.22 H new ATOM 0 HB3 ASP A 128 -12.210 -0.865 -1.236 1.00 0.22 H new ATOM 128 N LYS A 129 -13.613 1.311 1.096 1.00 0.19 N ATOM 129 CA LYS A 129 -13.074 2.163 2.140 1.00 0.22 C ATOM 130 C LYS A 129 -13.443 1.645 3.514 1.00 0.22 C ATOM 131 O LYS A 129 -12.580 1.485 4.358 1.00 0.24 O ATOM 132 CB LYS A 129 -13.602 3.587 2.002 1.00 0.26 C ATOM 133 CG LYS A 129 -13.568 4.347 3.319 1.00 0.56 C ATOM 134 CD LYS A 129 -12.141 4.605 3.782 1.00 0.56 C ATOM 135 CE LYS A 129 -11.499 5.700 2.970 1.00 0.23 C ATOM 136 NZ LYS A 129 -12.016 7.051 3.327 1.00 0.45 N ATOM 0 H LYS A 129 -14.222 1.791 0.433 1.00 0.19 H new ATOM 0 HA LYS A 129 -11.990 2.158 2.030 1.00 0.22 H new ATOM 0 HB2 LYS A 129 -13.008 4.122 1.261 1.00 0.26 H new ATOM 0 HB3 LYS A 129 -14.626 3.558 1.629 1.00 0.26 H new ATOM 0 HG2 LYS A 129 -14.091 5.296 3.205 1.00 0.56 H new ATOM 0 HG3 LYS A 129 -14.101 3.779 4.081 1.00 0.56 H new ATOM 0 HD2 LYS A 129 -12.141 4.882 4.836 1.00 0.56 H new ATOM 0 HD3 LYS A 129 -11.555 3.690 3.693 1.00 0.56 H new ATOM 0 HE2 LYS A 129 -10.420 5.676 3.121 1.00 0.23 H new ATOM 0 HE3 LYS A 129 -11.677 5.515 1.911 1.00 0.23 H new ATOM 0 HZ1 LYS A 129 -11.272 7.760 3.170 1.00 0.45 H new ATOM 0 HZ2 LYS A 129 -12.840 7.276 2.733 1.00 0.45 H new ATOM 0 HZ3 LYS A 129 -12.298 7.061 4.328 1.00 0.45 H new ATOM 150 N ALA A 130 -14.723 1.397 3.737 1.00 0.22 N ATOM 151 CA ALA A 130 -15.174 0.948 5.041 1.00 0.28 C ATOM 152 C ALA A 130 -14.577 -0.416 5.346 1.00 0.22 C ATOM 153 O ALA A 130 -14.286 -0.759 6.492 1.00 0.23 O ATOM 154 CB ALA A 130 -16.693 0.901 5.113 1.00 0.37 C ATOM 0 H ALA A 130 -15.460 1.498 3.039 1.00 0.22 H new ATOM 0 HA ALA A 130 -14.834 1.662 5.791 1.00 0.28 H new ATOM 0 HB1 ALA A 130 -17.000 0.561 6.102 1.00 0.37 H new ATOM 0 HB2 ALA A 130 -17.097 1.897 4.930 1.00 0.37 H new ATOM 0 HB3 ALA A 130 -17.072 0.212 4.359 1.00 0.37 H new ATOM 160 N LYS A 131 -14.393 -1.182 4.286 1.00 0.19 N ATOM 161 CA LYS A 131 -13.731 -2.476 4.361 1.00 0.19 C ATOM 162 C LYS A 131 -12.272 -2.295 4.780 1.00 0.14 C ATOM 163 O LYS A 131 -11.741 -3.047 5.597 1.00 0.16 O ATOM 164 CB LYS A 131 -13.834 -3.153 2.989 1.00 0.23 C ATOM 165 CG LYS A 131 -12.985 -4.404 2.808 1.00 0.29 C ATOM 166 CD LYS A 131 -13.247 -5.056 1.452 1.00 0.38 C ATOM 167 CE LYS A 131 -12.996 -4.086 0.304 1.00 0.41 C ATOM 168 NZ LYS A 131 -13.459 -4.617 -1.004 1.00 0.56 N ATOM 0 H LYS A 131 -14.698 -0.926 3.347 1.00 0.19 H new ATOM 0 HA LYS A 131 -14.212 -3.106 5.109 1.00 0.19 H new ATOM 0 HB2 LYS A 131 -14.877 -3.414 2.810 1.00 0.23 H new ATOM 0 HB3 LYS A 131 -13.551 -2.430 2.224 1.00 0.23 H new ATOM 0 HG2 LYS A 131 -11.929 -4.146 2.893 1.00 0.29 H new ATOM 0 HG3 LYS A 131 -13.205 -5.114 3.605 1.00 0.29 H new ATOM 0 HD2 LYS A 131 -12.605 -5.929 1.338 1.00 0.38 H new ATOM 0 HD3 LYS A 131 -14.277 -5.410 1.411 1.00 0.38 H new ATOM 0 HE2 LYS A 131 -13.505 -3.145 0.511 1.00 0.41 H new ATOM 0 HE3 LYS A 131 -11.930 -3.866 0.246 1.00 0.41 H new ATOM 0 HZ1 LYS A 131 -13.872 -3.845 -1.566 1.00 0.56 H new ATOM 0 HZ2 LYS A 131 -12.653 -5.026 -1.518 1.00 0.56 H new ATOM 0 HZ3 LYS A 131 -14.177 -5.352 -0.846 1.00 0.56 H new ATOM 182 N TYR A 132 -11.640 -1.279 4.220 1.00 0.12 N ATOM 183 CA TYR A 132 -10.245 -0.986 4.503 1.00 0.13 C ATOM 184 C TYR A 132 -10.067 -0.335 5.860 1.00 0.14 C ATOM 185 O TYR A 132 -9.045 -0.513 6.501 1.00 0.16 O ATOM 186 CB TYR A 132 -9.649 -0.135 3.388 1.00 0.18 C ATOM 187 CG TYR A 132 -9.542 -0.923 2.113 1.00 0.22 C ATOM 188 CD1 TYR A 132 -9.636 -2.302 2.093 1.00 0.27 C ATOM 189 CD2 TYR A 132 -9.308 -0.261 0.921 1.00 0.26 C ATOM 190 CE1 TYR A 132 -9.497 -3.001 0.910 1.00 0.35 C ATOM 191 CE2 TYR A 132 -9.174 -0.940 -0.257 1.00 0.32 C ATOM 192 CZ TYR A 132 -9.424 -2.434 -0.203 1.00 0.36 C ATOM 193 OH TYR A 132 -9.119 -3.004 -1.439 1.00 0.44 O ATOM 0 H TYR A 132 -12.076 -0.636 3.559 1.00 0.12 H new ATOM 0 HA TYR A 132 -9.703 -1.931 4.540 1.00 0.13 H new ATOM 0 HB2 TYR A 132 -10.270 0.746 3.225 1.00 0.18 H new ATOM 0 HB3 TYR A 132 -8.662 0.221 3.684 1.00 0.18 H new ATOM 0 HD1 TYR A 132 -9.820 -2.838 3.012 1.00 0.27 H new ATOM 0 HD2 TYR A 132 -9.230 0.816 0.922 1.00 0.26 H new ATOM 0 HE1 TYR A 132 -9.449 -4.079 0.947 1.00 0.35 H new ATOM 0 HE2 TYR A 132 -8.905 -0.440 -1.176 1.00 0.32 H new ATOM 0 HH TYR A 132 -9.030 -3.975 -1.339 1.00 0.44 H new ATOM 203 N ASP A 133 -11.054 0.432 6.279 1.00 0.15 N ATOM 204 CA ASP A 133 -11.077 0.981 7.625 1.00 0.19 C ATOM 205 C ASP A 133 -11.227 -0.143 8.645 1.00 0.15 C ATOM 206 O ASP A 133 -10.800 -0.021 9.792 1.00 0.15 O ATOM 207 CB ASP A 133 -12.218 1.988 7.772 1.00 0.27 C ATOM 208 CG ASP A 133 -12.253 2.626 9.146 1.00 0.59 C ATOM 209 OD1 ASP A 133 -11.240 3.237 9.546 1.00 0.89 O ATOM 210 OD2 ASP A 133 -13.280 2.492 9.838 1.00 1.32 O ATOM 0 H ASP A 133 -11.856 0.692 5.705 1.00 0.15 H new ATOM 0 HA ASP A 133 -10.135 1.499 7.808 1.00 0.19 H new ATOM 0 HB2 ASP A 133 -12.112 2.766 7.016 1.00 0.27 H new ATOM 0 HB3 ASP A 133 -13.167 1.487 7.583 1.00 0.27 H new ATOM 215 N ALA A 134 -11.811 -1.254 8.207 1.00 0.15 N ATOM 216 CA ALA A 134 -11.992 -2.409 9.069 1.00 0.17 C ATOM 217 C ALA A 134 -10.657 -3.084 9.320 1.00 0.16 C ATOM 218 O ALA A 134 -10.330 -3.428 10.457 1.00 0.18 O ATOM 219 CB ALA A 134 -12.985 -3.388 8.463 1.00 0.19 C ATOM 0 H ALA A 134 -12.166 -1.375 7.259 1.00 0.15 H new ATOM 0 HA ALA A 134 -12.398 -2.070 10.022 1.00 0.17 H new ATOM 0 HB1 ALA A 134 -13.103 -4.244 9.127 1.00 0.19 H new ATOM 0 HB2 ALA A 134 -13.948 -2.895 8.332 1.00 0.19 H new ATOM 0 HB3 ALA A 134 -12.616 -3.728 7.495 1.00 0.19 H new ATOM 225 N ILE A 135 -9.872 -3.269 8.262 1.00 0.16 N ATOM 226 CA ILE A 135 -8.530 -3.789 8.442 1.00 0.17 C ATOM 227 C ILE A 135 -7.654 -2.736 9.118 1.00 0.16 C ATOM 228 O ILE A 135 -6.818 -3.060 9.953 1.00 0.19 O ATOM 229 CB ILE A 135 -7.887 -4.281 7.125 1.00 0.19 C ATOM 230 CG1 ILE A 135 -7.779 -3.175 6.077 1.00 0.17 C ATOM 231 CG2 ILE A 135 -8.672 -5.457 6.569 1.00 0.26 C ATOM 232 CD1 ILE A 135 -7.184 -3.646 4.766 1.00 0.24 C ATOM 0 H ILE A 135 -10.137 -3.071 7.297 1.00 0.16 H new ATOM 0 HA ILE A 135 -8.607 -4.667 9.084 1.00 0.17 H new ATOM 0 HB ILE A 135 -6.871 -4.597 7.361 1.00 0.19 H new ATOM 0 HG12 ILE A 135 -8.771 -2.763 5.890 1.00 0.17 H new ATOM 0 HG13 ILE A 135 -7.167 -2.365 6.475 1.00 0.17 H new ATOM 0 HG21 ILE A 135 -8.211 -5.796 5.641 1.00 0.26 H new ATOM 0 HG22 ILE A 135 -8.670 -6.271 7.294 1.00 0.26 H new ATOM 0 HG23 ILE A 135 -9.699 -5.149 6.372 1.00 0.26 H new ATOM 0 HD11 ILE A 135 -7.136 -2.811 4.067 1.00 0.24 H new ATOM 0 HD12 ILE A 135 -6.179 -4.031 4.940 1.00 0.24 H new ATOM 0 HD13 ILE A 135 -7.808 -4.435 4.346 1.00 0.24 H new ATOM 244 N PHE A 136 -7.885 -1.475 8.759 1.00 0.13 N ATOM 245 CA PHE A 136 -7.184 -0.333 9.342 1.00 0.13 C ATOM 246 C PHE A 136 -7.271 -0.356 10.866 1.00 0.16 C ATOM 247 O PHE A 136 -6.256 -0.447 11.558 1.00 0.16 O ATOM 248 CB PHE A 136 -7.828 0.961 8.822 1.00 0.13 C ATOM 249 CG PHE A 136 -6.912 2.141 8.744 1.00 0.10 C ATOM 250 CD1 PHE A 136 -6.718 2.960 9.840 1.00 0.12 C ATOM 251 CD2 PHE A 136 -6.256 2.436 7.565 1.00 0.13 C ATOM 252 CE1 PHE A 136 -5.878 4.051 9.763 1.00 0.14 C ATOM 253 CE2 PHE A 136 -5.414 3.526 7.481 1.00 0.16 C ATOM 254 CZ PHE A 136 -5.225 4.334 8.582 1.00 0.16 C ATOM 0 H PHE A 136 -8.570 -1.215 8.049 1.00 0.13 H new ATOM 0 HA PHE A 136 -6.134 -0.383 9.055 1.00 0.13 H new ATOM 0 HB2 PHE A 136 -8.236 0.771 7.829 1.00 0.13 H new ATOM 0 HB3 PHE A 136 -8.668 1.215 9.468 1.00 0.13 H new ATOM 0 HD1 PHE A 136 -7.229 2.743 10.766 1.00 0.12 H new ATOM 0 HD2 PHE A 136 -6.404 1.807 6.700 1.00 0.13 H new ATOM 0 HE1 PHE A 136 -5.732 4.683 10.627 1.00 0.14 H new ATOM 0 HE2 PHE A 136 -4.904 3.746 6.555 1.00 0.16 H new ATOM 0 HZ PHE A 136 -4.566 5.188 8.520 1.00 0.16 H new ATOM 264 N ASP A 137 -8.497 -0.304 11.374 1.00 0.20 N ATOM 265 CA ASP A 137 -8.740 -0.261 12.813 1.00 0.27 C ATOM 266 C ASP A 137 -8.304 -1.554 13.490 1.00 0.26 C ATOM 267 O ASP A 137 -7.918 -1.552 14.658 1.00 0.29 O ATOM 268 CB ASP A 137 -10.218 0.006 13.103 1.00 0.38 C ATOM 269 CG ASP A 137 -10.493 0.168 14.585 1.00 0.67 C ATOM 270 OD1 ASP A 137 -10.192 1.249 15.134 1.00 1.01 O ATOM 271 OD2 ASP A 137 -11.009 -0.785 15.210 1.00 0.99 O ATOM 0 H ASP A 137 -9.345 -0.290 10.807 1.00 0.20 H new ATOM 0 HA ASP A 137 -8.144 0.556 13.221 1.00 0.27 H new ATOM 0 HB2 ASP A 137 -10.532 0.907 12.577 1.00 0.38 H new ATOM 0 HB3 ASP A 137 -10.817 -0.817 12.712 1.00 0.38 H new ATOM 276 N SER A 138 -8.329 -2.651 12.745 1.00 0.27 N ATOM 277 CA SER A 138 -7.973 -3.951 13.293 1.00 0.33 C ATOM 278 C SER A 138 -6.483 -4.005 13.622 1.00 0.32 C ATOM 279 O SER A 138 -6.028 -4.898 14.341 1.00 0.43 O ATOM 280 CB SER A 138 -8.336 -5.060 12.301 1.00 0.38 C ATOM 281 OG SER A 138 -8.167 -6.347 12.874 1.00 0.80 O ATOM 0 H SER A 138 -8.592 -2.666 11.760 1.00 0.27 H new ATOM 0 HA SER A 138 -8.536 -4.104 14.214 1.00 0.33 H new ATOM 0 HB2 SER A 138 -9.370 -4.937 11.979 1.00 0.38 H new ATOM 0 HB3 SER A 138 -7.712 -4.972 11.411 1.00 0.38 H new ATOM 0 HG SER A 138 -7.539 -6.291 13.624 1.00 0.80 H new ATOM 287 N LEU A 139 -5.728 -3.045 13.096 1.00 0.23 N ATOM 288 CA LEU A 139 -4.293 -2.996 13.311 1.00 0.24 C ATOM 289 C LEU A 139 -3.942 -2.051 14.456 1.00 0.24 C ATOM 290 O LEU A 139 -2.768 -1.885 14.796 1.00 0.27 O ATOM 291 CB LEU A 139 -3.583 -2.530 12.040 1.00 0.25 C ATOM 292 CG LEU A 139 -3.985 -3.251 10.752 1.00 0.34 C ATOM 293 CD1 LEU A 139 -3.136 -2.770 9.587 1.00 0.57 C ATOM 294 CD2 LEU A 139 -3.863 -4.757 10.912 1.00 0.92 C ATOM 0 H LEU A 139 -6.092 -2.289 12.516 1.00 0.23 H new ATOM 0 HA LEU A 139 -3.961 -4.002 13.570 1.00 0.24 H new ATOM 0 HB2 LEU A 139 -3.771 -1.464 11.911 1.00 0.25 H new ATOM 0 HB3 LEU A 139 -2.509 -2.650 12.181 1.00 0.25 H new ATOM 0 HG LEU A 139 -5.029 -3.016 10.543 1.00 0.34 H new ATOM 0 HD11 LEU A 139 -3.435 -3.293 8.679 1.00 0.57 H new ATOM 0 HD12 LEU A 139 -3.278 -1.698 9.452 1.00 0.57 H new ATOM 0 HD13 LEU A 139 -2.085 -2.974 9.794 1.00 0.57 H new ATOM 0 HD21 LEU A 139 -4.154 -5.246 9.983 1.00 0.92 H new ATOM 0 HD22 LEU A 139 -2.831 -5.015 11.150 1.00 0.92 H new ATOM 0 HD23 LEU A 139 -4.516 -5.091 11.718 1.00 0.92 H new ATOM 306 N SER A 140 -4.971 -1.432 15.037 1.00 0.22 N ATOM 307 CA SER A 140 -4.795 -0.421 16.077 1.00 0.23 C ATOM 308 C SER A 140 -3.962 0.742 15.530 1.00 0.21 C ATOM 309 O SER A 140 -2.762 0.851 15.797 1.00 0.27 O ATOM 310 CB SER A 140 -4.135 -1.031 17.321 1.00 0.31 C ATOM 311 OG SER A 140 -4.225 -0.158 18.436 1.00 1.18 O ATOM 0 H SER A 140 -5.946 -1.617 14.800 1.00 0.22 H new ATOM 0 HA SER A 140 -5.773 -0.043 16.373 1.00 0.23 H new ATOM 0 HB2 SER A 140 -4.614 -1.980 17.561 1.00 0.31 H new ATOM 0 HB3 SER A 140 -3.088 -1.247 17.110 1.00 0.31 H new ATOM 0 HG SER A 140 -3.797 -0.575 19.213 1.00 1.18 H new ATOM 317 N PRO A 141 -4.589 1.619 14.731 1.00 0.16 N ATOM 318 CA PRO A 141 -3.896 2.706 14.037 1.00 0.14 C ATOM 319 C PRO A 141 -3.385 3.799 14.953 1.00 0.15 C ATOM 320 O PRO A 141 -3.732 3.881 16.133 1.00 0.19 O ATOM 321 CB PRO A 141 -4.960 3.281 13.100 1.00 0.12 C ATOM 322 CG PRO A 141 -6.019 2.249 13.052 1.00 0.16 C ATOM 323 CD PRO A 141 -6.018 1.618 14.411 1.00 0.18 C ATOM 0 HA PRO A 141 -3.005 2.326 13.537 1.00 0.14 H new ATOM 0 HB2 PRO A 141 -5.347 4.228 13.475 1.00 0.12 H new ATOM 0 HB3 PRO A 141 -4.551 3.474 12.108 1.00 0.12 H new ATOM 0 HG2 PRO A 141 -6.989 2.691 12.824 1.00 0.16 H new ATOM 0 HG3 PRO A 141 -5.815 1.512 12.276 1.00 0.16 H new ATOM 0 HD2 PRO A 141 -6.600 2.193 15.131 1.00 0.18 H new ATOM 0 HD3 PRO A 141 -6.435 0.611 14.396 1.00 0.18 H new ATOM 331 N VAL A 142 -2.554 4.636 14.378 1.00 0.17 N ATOM 332 CA VAL A 142 -1.985 5.772 15.056 1.00 0.21 C ATOM 333 C VAL A 142 -2.671 7.047 14.579 1.00 0.24 C ATOM 334 O VAL A 142 -2.304 7.609 13.549 1.00 0.24 O ATOM 335 CB VAL A 142 -0.476 5.857 14.749 1.00 0.21 C ATOM 336 CG1 VAL A 142 0.156 7.069 15.421 1.00 0.26 C ATOM 337 CG2 VAL A 142 0.228 4.579 15.179 1.00 0.22 C ATOM 0 H VAL A 142 -2.250 4.543 13.409 1.00 0.17 H new ATOM 0 HA VAL A 142 -2.131 5.660 16.130 1.00 0.21 H new ATOM 0 HB VAL A 142 -0.358 5.973 13.672 1.00 0.21 H new ATOM 0 HG11 VAL A 142 1.220 7.102 15.186 1.00 0.26 H new ATOM 0 HG12 VAL A 142 -0.324 7.978 15.058 1.00 0.26 H new ATOM 0 HG13 VAL A 142 0.025 6.996 16.501 1.00 0.26 H new ATOM 0 HG21 VAL A 142 1.292 4.657 14.955 1.00 0.22 H new ATOM 0 HG22 VAL A 142 0.093 4.432 16.251 1.00 0.22 H new ATOM 0 HG23 VAL A 142 -0.195 3.731 14.640 1.00 0.22 H new ATOM 347 N ASN A 143 -3.671 7.493 15.333 1.00 0.28 N ATOM 348 CA ASN A 143 -4.395 8.731 15.025 1.00 0.32 C ATOM 349 C ASN A 143 -5.060 8.683 13.647 1.00 0.29 C ATOM 350 O ASN A 143 -5.080 9.680 12.927 1.00 0.36 O ATOM 351 CB ASN A 143 -3.451 9.932 15.098 1.00 0.39 C ATOM 352 CG ASN A 143 -2.983 10.220 16.509 1.00 0.53 C ATOM 353 OD1 ASN A 143 -3.635 10.946 17.262 1.00 0.87 O ATOM 354 ND2 ASN A 143 -1.844 9.659 16.876 1.00 0.74 N ATOM 0 H ASN A 143 -4.004 7.014 16.170 1.00 0.28 H new ATOM 0 HA ASN A 143 -5.182 8.836 15.772 1.00 0.32 H new ATOM 0 HB2 ASN A 143 -2.585 9.748 14.462 1.00 0.39 H new ATOM 0 HB3 ASN A 143 -3.957 10.812 14.700 1.00 0.39 H new ATOM 0 HD21 ASN A 143 -1.474 9.821 17.813 1.00 0.74 H new ATOM 0 HD22 ASN A 143 -1.335 9.064 16.222 1.00 0.74 H new ATOM 361 N GLY A 144 -5.617 7.530 13.290 1.00 0.21 N ATOM 362 CA GLY A 144 -6.244 7.377 11.984 1.00 0.20 C ATOM 363 C GLY A 144 -5.226 7.237 10.865 1.00 0.17 C ATOM 364 O GLY A 144 -5.559 7.365 9.687 1.00 0.19 O ATOM 0 H GLY A 144 -5.647 6.698 13.879 1.00 0.21 H new ATOM 0 HA2 GLY A 144 -6.890 6.499 11.995 1.00 0.20 H new ATOM 0 HA3 GLY A 144 -6.881 8.239 11.786 1.00 0.20 H new ATOM 368 N PHE A 145 -3.987 6.999 11.254 1.00 0.15 N ATOM 369 CA PHE A 145 -2.902 6.708 10.329 1.00 0.14 C ATOM 370 C PHE A 145 -2.294 5.370 10.700 1.00 0.13 C ATOM 371 O PHE A 145 -2.199 5.035 11.875 1.00 0.18 O ATOM 372 CB PHE A 145 -1.790 7.767 10.411 1.00 0.18 C ATOM 373 CG PHE A 145 -2.214 9.174 10.111 1.00 0.27 C ATOM 374 CD1 PHE A 145 -2.669 10.005 11.120 1.00 0.38 C ATOM 375 CD2 PHE A 145 -2.131 9.673 8.825 1.00 0.43 C ATOM 376 CE1 PHE A 145 -3.040 11.307 10.850 1.00 0.47 C ATOM 377 CE2 PHE A 145 -2.502 10.975 8.548 1.00 0.51 C ATOM 378 CZ PHE A 145 -2.957 11.793 9.563 1.00 0.48 C ATOM 0 H PHE A 145 -3.700 7.002 12.233 1.00 0.15 H new ATOM 0 HA PHE A 145 -3.312 6.702 9.319 1.00 0.14 H new ATOM 0 HB2 PHE A 145 -1.361 7.741 11.413 1.00 0.18 H new ATOM 0 HB3 PHE A 145 -0.996 7.490 9.717 1.00 0.18 H new ATOM 0 HD1 PHE A 145 -2.735 9.630 12.131 1.00 0.38 H new ATOM 0 HD2 PHE A 145 -1.772 9.039 8.028 1.00 0.43 H new ATOM 0 HE1 PHE A 145 -3.395 11.944 11.647 1.00 0.47 H new ATOM 0 HE2 PHE A 145 -2.436 11.352 7.538 1.00 0.51 H new ATOM 0 HZ PHE A 145 -3.247 12.811 9.349 1.00 0.48 H new ATOM 388 N LEU A 146 -1.893 4.595 9.726 1.00 0.12 N ATOM 389 CA LEU A 146 -1.135 3.394 10.012 1.00 0.12 C ATOM 390 C LEU A 146 0.259 3.524 9.430 1.00 0.14 C ATOM 391 O LEU A 146 0.436 4.150 8.395 1.00 0.18 O ATOM 392 CB LEU A 146 -1.793 2.161 9.442 1.00 0.12 C ATOM 393 CG LEU A 146 -3.045 1.683 10.155 1.00 0.13 C ATOM 394 CD1 LEU A 146 -3.782 0.709 9.265 1.00 0.14 C ATOM 395 CD2 LEU A 146 -2.679 1.023 11.474 1.00 0.15 C ATOM 0 H LEU A 146 -2.073 4.767 8.737 1.00 0.12 H new ATOM 0 HA LEU A 146 -1.090 3.283 11.095 1.00 0.12 H new ATOM 0 HB2 LEU A 146 -2.045 2.357 8.400 1.00 0.12 H new ATOM 0 HB3 LEU A 146 -1.065 1.350 9.446 1.00 0.12 H new ATOM 0 HG LEU A 146 -3.690 2.536 10.368 1.00 0.13 H new ATOM 0 HD11 LEU A 146 -4.682 0.362 9.772 1.00 0.14 H new ATOM 0 HD12 LEU A 146 -4.058 1.204 8.334 1.00 0.14 H new ATOM 0 HD13 LEU A 146 -3.138 -0.143 9.046 1.00 0.14 H new ATOM 0 HD21 LEU A 146 -3.586 0.685 11.975 1.00 0.15 H new ATOM 0 HD22 LEU A 146 -2.028 0.169 11.285 1.00 0.15 H new ATOM 0 HD23 LEU A 146 -2.160 1.741 12.109 1.00 0.15 H new ATOM 407 N SER A 147 1.246 2.932 10.082 1.00 0.13 N ATOM 408 CA SER A 147 2.604 3.096 9.619 1.00 0.16 C ATOM 409 C SER A 147 3.230 1.811 9.141 1.00 0.13 C ATOM 410 O SER A 147 2.627 0.752 9.244 1.00 0.13 O ATOM 411 CB SER A 147 3.461 3.726 10.711 1.00 0.23 C ATOM 412 OG SER A 147 2.726 4.707 11.420 1.00 1.02 O ATOM 0 H SER A 147 1.134 2.349 10.912 1.00 0.13 H new ATOM 0 HA SER A 147 2.559 3.759 8.755 1.00 0.16 H new ATOM 0 HB2 SER A 147 3.806 2.955 11.400 1.00 0.23 H new ATOM 0 HB3 SER A 147 4.348 4.179 10.268 1.00 0.23 H new ATOM 0 HG SER A 147 2.809 4.546 12.383 1.00 1.02 H new ATOM 418 N GLY A 148 4.463 1.935 8.660 1.00 0.17 N ATOM 419 CA GLY A 148 5.122 0.891 7.906 1.00 0.21 C ATOM 420 C GLY A 148 5.110 -0.459 8.568 1.00 0.18 C ATOM 421 O GLY A 148 4.759 -1.439 7.941 1.00 0.21 O ATOM 0 H GLY A 148 5.032 2.772 8.787 1.00 0.17 H new ATOM 0 HA2 GLY A 148 4.643 0.807 6.930 1.00 0.21 H new ATOM 0 HA3 GLY A 148 6.156 1.186 7.729 1.00 0.21 H new ATOM 425 N ASP A 149 5.481 -0.527 9.830 1.00 0.20 N ATOM 426 CA ASP A 149 5.609 -1.812 10.500 1.00 0.20 C ATOM 427 C ASP A 149 4.270 -2.550 10.569 1.00 0.19 C ATOM 428 O ASP A 149 4.237 -3.771 10.708 1.00 0.23 O ATOM 429 CB ASP A 149 6.204 -1.639 11.891 1.00 0.26 C ATOM 430 CG ASP A 149 5.174 -1.245 12.933 1.00 0.64 C ATOM 431 OD1 ASP A 149 4.835 -0.048 13.008 1.00 0.98 O ATOM 432 OD2 ASP A 149 4.702 -2.129 13.682 1.00 0.97 O ATOM 0 H ASP A 149 5.698 0.283 10.411 1.00 0.20 H new ATOM 0 HA ASP A 149 6.289 -2.424 9.908 1.00 0.20 H new ATOM 0 HB2 ASP A 149 6.681 -2.571 12.194 1.00 0.26 H new ATOM 0 HB3 ASP A 149 6.984 -0.879 11.854 1.00 0.26 H new ATOM 437 N LYS A 150 3.168 -1.816 10.470 1.00 0.16 N ATOM 438 CA LYS A 150 1.846 -2.425 10.423 1.00 0.16 C ATOM 439 C LYS A 150 1.390 -2.576 8.979 1.00 0.13 C ATOM 440 O LYS A 150 0.973 -3.649 8.544 1.00 0.13 O ATOM 441 CB LYS A 150 0.834 -1.568 11.188 1.00 0.18 C ATOM 442 CG LYS A 150 1.365 -1.044 12.509 1.00 0.36 C ATOM 443 CD LYS A 150 0.270 -0.407 13.348 1.00 0.50 C ATOM 444 CE LYS A 150 0.862 0.358 14.520 1.00 0.56 C ATOM 445 NZ LYS A 150 -0.022 0.331 15.720 1.00 1.39 N ATOM 0 H LYS A 150 3.165 -0.797 10.421 1.00 0.16 H new ATOM 0 HA LYS A 150 1.905 -3.408 10.890 1.00 0.16 H new ATOM 0 HB2 LYS A 150 0.538 -0.725 10.564 1.00 0.18 H new ATOM 0 HB3 LYS A 150 -0.064 -2.158 11.374 1.00 0.18 H new ATOM 0 HG2 LYS A 150 1.820 -1.862 13.067 1.00 0.36 H new ATOM 0 HG3 LYS A 150 2.150 -0.312 12.320 1.00 0.36 H new ATOM 0 HD2 LYS A 150 -0.322 0.268 12.729 1.00 0.50 H new ATOM 0 HD3 LYS A 150 -0.407 -1.178 13.716 1.00 0.50 H new ATOM 0 HE2 LYS A 150 1.832 -0.069 14.777 1.00 0.56 H new ATOM 0 HE3 LYS A 150 1.037 1.392 14.224 1.00 0.56 H new ATOM 0 HZ1 LYS A 150 0.328 1.012 16.424 1.00 1.39 H new ATOM 0 HZ2 LYS A 150 -0.991 0.586 15.443 1.00 1.39 H new ATOM 0 HZ3 LYS A 150 -0.020 -0.624 16.131 1.00 1.39 H new ATOM 459 N VAL A 151 1.504 -1.492 8.235 1.00 0.15 N ATOM 460 CA VAL A 151 0.972 -1.431 6.893 1.00 0.14 C ATOM 461 C VAL A 151 1.727 -2.322 5.932 1.00 0.16 C ATOM 462 O VAL A 151 1.127 -2.944 5.072 1.00 0.17 O ATOM 463 CB VAL A 151 0.912 0.010 6.350 1.00 0.20 C ATOM 464 CG1 VAL A 151 1.041 0.044 4.830 1.00 0.48 C ATOM 465 CG2 VAL A 151 -0.399 0.631 6.772 1.00 0.42 C ATOM 0 H VAL A 151 1.965 -0.636 8.544 1.00 0.15 H new ATOM 0 HA VAL A 151 -0.049 -1.805 6.966 1.00 0.14 H new ATOM 0 HB VAL A 151 1.749 0.575 6.760 1.00 0.20 H new ATOM 0 HG11 VAL A 151 0.994 1.077 4.484 1.00 0.48 H new ATOM 0 HG12 VAL A 151 1.995 -0.395 4.536 1.00 0.48 H new ATOM 0 HG13 VAL A 151 0.226 -0.526 4.383 1.00 0.48 H new ATOM 0 HG21 VAL A 151 -0.456 1.652 6.395 1.00 0.42 H new ATOM 0 HG22 VAL A 151 -1.225 0.047 6.366 1.00 0.42 H new ATOM 0 HG23 VAL A 151 -0.463 0.642 7.860 1.00 0.42 H new ATOM 475 N LYS A 152 3.029 -2.394 6.098 1.00 0.23 N ATOM 476 CA LYS A 152 3.870 -3.169 5.205 1.00 0.27 C ATOM 477 C LYS A 152 3.409 -4.621 5.084 1.00 0.27 C ATOM 478 O LYS A 152 3.208 -5.121 3.985 1.00 0.29 O ATOM 479 CB LYS A 152 5.317 -3.143 5.668 1.00 0.32 C ATOM 480 CG LYS A 152 6.199 -3.957 4.775 1.00 0.41 C ATOM 481 CD LYS A 152 6.763 -5.184 5.450 1.00 0.73 C ATOM 482 CE LYS A 152 7.810 -5.820 4.560 1.00 1.20 C ATOM 483 NZ LYS A 152 8.397 -7.030 5.169 1.00 1.74 N ATOM 0 H LYS A 152 3.534 -1.922 6.848 1.00 0.23 H new ATOM 0 HA LYS A 152 3.787 -2.703 4.223 1.00 0.27 H new ATOM 0 HB2 LYS A 152 5.673 -2.113 5.691 1.00 0.32 H new ATOM 0 HB3 LYS A 152 5.380 -3.524 6.687 1.00 0.32 H new ATOM 0 HG2 LYS A 152 5.631 -4.263 3.896 1.00 0.41 H new ATOM 0 HG3 LYS A 152 7.021 -3.334 4.423 1.00 0.41 H new ATOM 0 HD2 LYS A 152 7.203 -4.913 6.410 1.00 0.73 H new ATOM 0 HD3 LYS A 152 5.965 -5.897 5.656 1.00 0.73 H new ATOM 0 HE2 LYS A 152 7.361 -6.079 3.601 1.00 1.20 H new ATOM 0 HE3 LYS A 152 8.600 -5.097 4.357 1.00 1.20 H new ATOM 0 HZ1 LYS A 152 9.108 -7.432 4.526 1.00 1.74 H new ATOM 0 HZ2 LYS A 152 8.849 -6.780 6.072 1.00 1.74 H new ATOM 0 HZ3 LYS A 152 7.648 -7.731 5.339 1.00 1.74 H new ATOM 497 N PRO A 153 3.274 -5.335 6.203 1.00 0.27 N ATOM 498 CA PRO A 153 2.813 -6.719 6.194 1.00 0.28 C ATOM 499 C PRO A 153 1.354 -6.822 5.797 1.00 0.26 C ATOM 500 O PRO A 153 0.915 -7.840 5.265 1.00 0.34 O ATOM 501 CB PRO A 153 3.026 -7.184 7.642 1.00 0.31 C ATOM 502 CG PRO A 153 3.946 -6.164 8.222 1.00 0.56 C ATOM 503 CD PRO A 153 3.597 -4.890 7.555 1.00 0.27 C ATOM 0 HA PRO A 153 3.350 -7.330 5.468 1.00 0.28 H new ATOM 0 HB2 PRO A 153 2.084 -7.228 8.189 1.00 0.31 H new ATOM 0 HB3 PRO A 153 3.463 -8.182 7.680 1.00 0.31 H new ATOM 0 HG2 PRO A 153 3.818 -6.089 9.302 1.00 0.56 H new ATOM 0 HG3 PRO A 153 4.988 -6.428 8.042 1.00 0.56 H new ATOM 0 HD2 PRO A 153 2.752 -4.396 8.035 1.00 0.27 H new ATOM 0 HD3 PRO A 153 4.427 -4.183 7.565 1.00 0.27 H new ATOM 511 N VAL A 154 0.616 -5.749 6.019 1.00 0.21 N ATOM 512 CA VAL A 154 -0.761 -5.679 5.573 1.00 0.20 C ATOM 513 C VAL A 154 -0.769 -5.018 4.186 1.00 0.34 C ATOM 514 O VAL A 154 -1.763 -4.478 3.706 1.00 0.79 O ATOM 515 CB VAL A 154 -1.634 -4.936 6.596 1.00 0.33 C ATOM 516 CG1 VAL A 154 -3.103 -5.086 6.277 1.00 0.59 C ATOM 517 CG2 VAL A 154 -1.369 -5.515 7.962 1.00 0.57 C ATOM 0 H VAL A 154 0.948 -4.916 6.505 1.00 0.21 H new ATOM 0 HA VAL A 154 -1.195 -6.676 5.491 1.00 0.20 H new ATOM 0 HB VAL A 154 -1.384 -3.876 6.564 1.00 0.33 H new ATOM 0 HG11 VAL A 154 -3.693 -4.549 7.019 1.00 0.59 H new ATOM 0 HG12 VAL A 154 -3.304 -4.676 5.287 1.00 0.59 H new ATOM 0 HG13 VAL A 154 -3.373 -6.142 6.294 1.00 0.59 H new ATOM 0 HG21 VAL A 154 -1.981 -4.998 8.701 1.00 0.57 H new ATOM 0 HG22 VAL A 154 -1.618 -6.576 7.962 1.00 0.57 H new ATOM 0 HG23 VAL A 154 -0.316 -5.390 8.212 1.00 0.57 H new ATOM 527 N LEU A 155 0.417 -5.034 3.588 1.00 0.20 N ATOM 528 CA LEU A 155 0.615 -4.765 2.177 1.00 0.21 C ATOM 529 C LEU A 155 1.116 -6.040 1.527 1.00 0.21 C ATOM 530 O LEU A 155 0.779 -6.358 0.384 1.00 0.24 O ATOM 531 CB LEU A 155 1.587 -3.609 1.964 1.00 0.25 C ATOM 532 CG LEU A 155 0.956 -2.219 2.057 1.00 0.43 C ATOM 533 CD1 LEU A 155 1.999 -1.151 1.811 1.00 1.21 C ATOM 534 CD2 LEU A 155 -0.191 -2.080 1.069 1.00 0.75 C ATOM 0 H LEU A 155 1.283 -5.239 4.085 1.00 0.20 H new ATOM 0 HA LEU A 155 -0.326 -4.461 1.719 1.00 0.21 H new ATOM 0 HB2 LEU A 155 2.384 -3.681 2.704 1.00 0.25 H new ATOM 0 HB3 LEU A 155 2.051 -3.718 0.984 1.00 0.25 H new ATOM 0 HG LEU A 155 0.556 -2.091 3.063 1.00 0.43 H new ATOM 0 HD11 LEU A 155 1.535 -0.167 1.880 1.00 1.21 H new ATOM 0 HD12 LEU A 155 2.788 -1.234 2.558 1.00 1.21 H new ATOM 0 HD13 LEU A 155 2.426 -1.282 0.817 1.00 1.21 H new ATOM 0 HD21 LEU A 155 -0.625 -1.084 1.153 1.00 0.75 H new ATOM 0 HD22 LEU A 155 0.182 -2.230 0.056 1.00 0.75 H new ATOM 0 HD23 LEU A 155 -0.953 -2.827 1.289 1.00 0.75 H new ATOM 546 N LEU A 156 1.879 -6.802 2.311 1.00 0.22 N ATOM 547 CA LEU A 156 2.200 -8.187 1.991 1.00 0.26 C ATOM 548 C LEU A 156 0.953 -9.052 2.148 1.00 0.28 C ATOM 549 O LEU A 156 1.036 -10.271 2.285 1.00 0.33 O ATOM 550 CB LEU A 156 3.316 -8.714 2.900 1.00 0.32 C ATOM 551 CG LEU A 156 4.721 -8.197 2.585 1.00 0.45 C ATOM 552 CD1 LEU A 156 5.714 -8.699 3.619 1.00 1.27 C ATOM 553 CD2 LEU A 156 5.145 -8.639 1.195 1.00 1.44 C ATOM 0 H LEU A 156 2.290 -6.474 3.185 1.00 0.22 H new ATOM 0 HA LEU A 156 2.549 -8.232 0.959 1.00 0.26 H new ATOM 0 HB2 LEU A 156 3.075 -8.454 3.931 1.00 0.32 H new ATOM 0 HB3 LEU A 156 3.326 -9.802 2.840 1.00 0.32 H new ATOM 0 HG LEU A 156 4.705 -7.108 2.617 1.00 0.45 H new ATOM 0 HD11 LEU A 156 6.709 -8.323 3.381 1.00 1.27 H new ATOM 0 HD12 LEU A 156 5.420 -8.346 4.607 1.00 1.27 H new ATOM 0 HD13 LEU A 156 5.727 -9.789 3.612 1.00 1.27 H new ATOM 0 HD21 LEU A 156 6.147 -8.264 0.984 1.00 1.44 H new ATOM 0 HD22 LEU A 156 5.147 -9.728 1.144 1.00 1.44 H new ATOM 0 HD23 LEU A 156 4.446 -8.242 0.458 1.00 1.44 H new ATOM 565 N ASN A 157 -0.199 -8.387 2.179 1.00 0.31 N ATOM 566 CA ASN A 157 -1.484 -9.045 2.068 1.00 0.39 C ATOM 567 C ASN A 157 -1.520 -9.859 0.782 1.00 0.33 C ATOM 568 O ASN A 157 -2.155 -10.906 0.703 1.00 0.33 O ATOM 569 CB ASN A 157 -2.618 -8.025 2.028 1.00 0.53 C ATOM 570 CG ASN A 157 -2.927 -7.414 3.373 1.00 1.31 C ATOM 571 OD1 ASN A 157 -2.554 -7.946 4.414 1.00 1.86 O ATOM 572 ND2 ASN A 157 -3.662 -6.315 3.359 1.00 2.26 N ATOM 0 H ASN A 157 -0.260 -7.374 2.282 1.00 0.31 H new ATOM 0 HA ASN A 157 -1.616 -9.689 2.937 1.00 0.39 H new ATOM 0 HB2 ASN A 157 -2.357 -7.231 1.329 1.00 0.53 H new ATOM 0 HB3 ASN A 157 -3.516 -8.507 1.642 1.00 0.53 H new ATOM 0 HD21 ASN A 157 -3.941 -5.877 4.237 1.00 2.26 H new ATOM 0 HD22 ASN A 157 -3.950 -5.906 2.470 1.00 2.26 H new ATOM 579 N SER A 158 -0.825 -9.344 -0.223 1.00 0.31 N ATOM 580 CA SER A 158 -0.772 -9.951 -1.537 1.00 0.30 C ATOM 581 C SER A 158 0.531 -10.732 -1.691 1.00 0.30 C ATOM 582 O SER A 158 1.376 -10.722 -0.799 1.00 0.31 O ATOM 583 CB SER A 158 -0.821 -8.853 -2.587 1.00 0.31 C ATOM 584 OG SER A 158 0.252 -7.943 -2.416 1.00 1.04 O ATOM 0 H SER A 158 -0.279 -8.486 -0.144 1.00 0.31 H new ATOM 0 HA SER A 158 -1.616 -10.629 -1.661 1.00 0.30 H new ATOM 0 HB2 SER A 158 -0.774 -9.294 -3.583 1.00 0.31 H new ATOM 0 HB3 SER A 158 -1.770 -8.320 -2.518 1.00 0.31 H new ATOM 0 HG SER A 158 0.028 -7.302 -1.710 1.00 1.04 H new ATOM 590 N LYS A 159 0.694 -11.406 -2.824 1.00 0.33 N ATOM 591 CA LYS A 159 1.950 -12.082 -3.128 1.00 0.38 C ATOM 592 C LYS A 159 2.888 -11.125 -3.864 1.00 0.33 C ATOM 593 O LYS A 159 3.910 -11.535 -4.417 1.00 0.41 O ATOM 594 CB LYS A 159 1.713 -13.356 -3.950 1.00 0.51 C ATOM 595 CG LYS A 159 2.855 -14.359 -3.835 1.00 1.37 C ATOM 596 CD LYS A 159 2.565 -15.674 -4.552 1.00 1.74 C ATOM 597 CE LYS A 159 2.946 -15.634 -6.028 1.00 2.43 C ATOM 598 NZ LYS A 159 1.936 -14.931 -6.861 1.00 2.90 N ATOM 0 H LYS A 159 -0.023 -11.499 -3.543 1.00 0.33 H new ATOM 0 HA LYS A 159 2.417 -12.383 -2.190 1.00 0.38 H new ATOM 0 HB2 LYS A 159 0.787 -13.828 -3.620 1.00 0.51 H new ATOM 0 HB3 LYS A 159 1.578 -13.086 -4.997 1.00 0.51 H new ATOM 0 HG2 LYS A 159 3.762 -13.918 -4.248 1.00 1.37 H new ATOM 0 HG3 LYS A 159 3.050 -14.561 -2.782 1.00 1.37 H new ATOM 0 HD2 LYS A 159 3.112 -16.479 -4.061 1.00 1.74 H new ATOM 0 HD3 LYS A 159 1.504 -15.907 -4.461 1.00 1.74 H new ATOM 0 HE2 LYS A 159 3.910 -15.138 -6.137 1.00 2.43 H new ATOM 0 HE3 LYS A 159 3.069 -16.653 -6.395 1.00 2.43 H new ATOM 0 HZ1 LYS A 159 1.935 -15.334 -7.820 1.00 2.90 H new ATOM 0 HZ2 LYS A 159 0.994 -15.047 -6.436 1.00 2.90 H new ATOM 0 HZ3 LYS A 159 2.171 -13.919 -6.911 1.00 2.90 H new ATOM 612 N LEU A 160 2.507 -9.853 -3.887 1.00 0.26 N ATOM 613 CA LEU A 160 3.288 -8.814 -4.543 1.00 0.26 C ATOM 614 C LEU A 160 4.548 -8.515 -3.742 1.00 0.23 C ATOM 615 O LEU A 160 4.540 -8.574 -2.513 1.00 0.28 O ATOM 616 CB LEU A 160 2.459 -7.552 -4.678 1.00 0.30 C ATOM 617 CG LEU A 160 1.098 -7.740 -5.356 1.00 0.33 C ATOM 618 CD1 LEU A 160 0.291 -6.451 -5.332 1.00 0.37 C ATOM 619 CD2 LEU A 160 1.279 -8.226 -6.786 1.00 0.32 C ATOM 0 H LEU A 160 1.649 -9.514 -3.452 1.00 0.26 H new ATOM 0 HA LEU A 160 3.574 -9.166 -5.534 1.00 0.26 H new ATOM 0 HB2 LEU A 160 2.298 -7.133 -3.685 1.00 0.30 H new ATOM 0 HB3 LEU A 160 3.032 -6.818 -5.245 1.00 0.30 H new ATOM 0 HG LEU A 160 0.545 -8.495 -4.797 1.00 0.33 H new ATOM 0 HD11 LEU A 160 -0.670 -6.614 -5.820 1.00 0.37 H new ATOM 0 HD12 LEU A 160 0.126 -6.144 -4.299 1.00 0.37 H new ATOM 0 HD13 LEU A 160 0.838 -5.670 -5.860 1.00 0.37 H new ATOM 0 HD21 LEU A 160 0.303 -8.354 -7.253 1.00 0.32 H new ATOM 0 HD22 LEU A 160 1.857 -7.493 -7.349 1.00 0.32 H new ATOM 0 HD23 LEU A 160 1.807 -9.179 -6.782 1.00 0.32 H new ATOM 631 N PRO A 161 5.641 -8.179 -4.428 1.00 0.25 N ATOM 632 CA PRO A 161 6.930 -7.927 -3.786 1.00 0.25 C ATOM 633 C PRO A 161 7.064 -6.498 -3.268 1.00 0.23 C ATOM 634 O PRO A 161 6.321 -5.599 -3.672 1.00 0.26 O ATOM 635 CB PRO A 161 7.887 -8.189 -4.934 1.00 0.34 C ATOM 636 CG PRO A 161 7.166 -7.677 -6.129 1.00 0.64 C ATOM 637 CD PRO A 161 5.720 -8.020 -5.896 1.00 0.37 C ATOM 0 HA PRO A 161 7.099 -8.539 -2.900 1.00 0.25 H new ATOM 0 HB2 PRO A 161 8.836 -7.672 -4.789 1.00 0.34 H new ATOM 0 HB3 PRO A 161 8.114 -9.251 -5.030 1.00 0.34 H new ATOM 0 HG2 PRO A 161 7.302 -6.601 -6.240 1.00 0.64 H new ATOM 0 HG3 PRO A 161 7.538 -8.141 -7.042 1.00 0.64 H new ATOM 0 HD2 PRO A 161 5.057 -7.231 -6.252 1.00 0.37 H new ATOM 0 HD3 PRO A 161 5.435 -8.935 -6.416 1.00 0.37 H new ATOM 645 N VAL A 162 8.035 -6.290 -2.382 1.00 0.22 N ATOM 646 CA VAL A 162 8.189 -5.015 -1.691 1.00 0.21 C ATOM 647 C VAL A 162 8.585 -3.893 -2.645 1.00 0.19 C ATOM 648 O VAL A 162 8.507 -2.726 -2.287 1.00 0.21 O ATOM 649 CB VAL A 162 9.222 -5.089 -0.546 1.00 0.26 C ATOM 650 CG1 VAL A 162 8.835 -6.148 0.473 1.00 0.33 C ATOM 651 CG2 VAL A 162 10.616 -5.345 -1.088 1.00 0.34 C ATOM 0 H VAL A 162 8.729 -6.992 -2.126 1.00 0.22 H new ATOM 0 HA VAL A 162 7.210 -4.793 -1.266 1.00 0.21 H new ATOM 0 HB VAL A 162 9.228 -4.123 -0.040 1.00 0.26 H new ATOM 0 HG11 VAL A 162 9.580 -6.178 1.268 1.00 0.33 H new ATOM 0 HG12 VAL A 162 7.861 -5.905 0.898 1.00 0.33 H new ATOM 0 HG13 VAL A 162 8.786 -7.121 -0.015 1.00 0.33 H new ATOM 0 HG21 VAL A 162 11.325 -5.393 -0.261 1.00 0.34 H new ATOM 0 HG22 VAL A 162 10.627 -6.290 -1.631 1.00 0.34 H new ATOM 0 HG23 VAL A 162 10.899 -4.536 -1.762 1.00 0.34 H new ATOM 661 N ASP A 163 9.033 -4.246 -3.842 1.00 0.20 N ATOM 662 CA ASP A 163 9.320 -3.251 -4.870 1.00 0.21 C ATOM 663 C ASP A 163 8.051 -2.503 -5.268 1.00 0.20 C ATOM 664 O ASP A 163 8.031 -1.274 -5.321 1.00 0.21 O ATOM 665 CB ASP A 163 9.947 -3.918 -6.093 1.00 0.26 C ATOM 666 CG ASP A 163 10.224 -2.938 -7.219 1.00 1.30 C ATOM 667 OD1 ASP A 163 11.264 -2.249 -7.173 1.00 2.15 O ATOM 668 OD2 ASP A 163 9.388 -2.833 -8.141 1.00 1.74 O ATOM 0 H ASP A 163 9.206 -5.210 -4.126 1.00 0.20 H new ATOM 0 HA ASP A 163 10.028 -2.531 -4.461 1.00 0.21 H new ATOM 0 HB2 ASP A 163 10.879 -4.401 -5.800 1.00 0.26 H new ATOM 0 HB3 ASP A 163 9.282 -4.702 -6.455 1.00 0.26 H new ATOM 673 N ILE A 164 6.980 -3.247 -5.505 1.00 0.20 N ATOM 674 CA ILE A 164 5.713 -2.638 -5.891 1.00 0.21 C ATOM 675 C ILE A 164 5.047 -2.029 -4.672 1.00 0.19 C ATOM 676 O ILE A 164 4.455 -0.960 -4.748 1.00 0.20 O ATOM 677 CB ILE A 164 4.757 -3.645 -6.593 1.00 0.26 C ATOM 678 CG1 ILE A 164 4.241 -4.724 -5.644 1.00 0.32 C ATOM 679 CG2 ILE A 164 5.447 -4.279 -7.781 1.00 0.37 C ATOM 680 CD1 ILE A 164 2.937 -4.350 -4.966 1.00 0.60 C ATOM 0 H ILE A 164 6.961 -4.265 -5.438 1.00 0.20 H new ATOM 0 HA ILE A 164 5.930 -1.856 -6.619 1.00 0.21 H new ATOM 0 HB ILE A 164 3.890 -3.079 -6.933 1.00 0.26 H new ATOM 0 HG12 ILE A 164 4.101 -5.651 -6.200 1.00 0.32 H new ATOM 0 HG13 ILE A 164 4.996 -4.920 -4.882 1.00 0.32 H new ATOM 0 HG21 ILE A 164 4.768 -4.982 -8.264 1.00 0.37 H new ATOM 0 HG22 ILE A 164 5.733 -3.504 -8.492 1.00 0.37 H new ATOM 0 HG23 ILE A 164 6.338 -4.809 -7.444 1.00 0.37 H new ATOM 0 HD11 ILE A 164 2.625 -5.159 -4.305 1.00 0.60 H new ATOM 0 HD12 ILE A 164 3.078 -3.440 -4.383 1.00 0.60 H new ATOM 0 HD13 ILE A 164 2.169 -4.182 -5.721 1.00 0.60 H new ATOM 692 N LEU A 165 5.174 -2.714 -3.548 1.00 0.19 N ATOM 693 CA LEU A 165 4.590 -2.270 -2.296 1.00 0.19 C ATOM 694 C LEU A 165 5.248 -0.982 -1.808 1.00 0.19 C ATOM 695 O LEU A 165 4.586 -0.108 -1.250 1.00 0.20 O ATOM 696 CB LEU A 165 4.733 -3.375 -1.260 1.00 0.19 C ATOM 697 CG LEU A 165 3.903 -4.630 -1.525 1.00 0.26 C ATOM 698 CD1 LEU A 165 4.342 -5.756 -0.610 1.00 0.28 C ATOM 699 CD2 LEU A 165 2.426 -4.340 -1.325 1.00 0.32 C ATOM 0 H LEU A 165 5.685 -3.594 -3.479 1.00 0.19 H new ATOM 0 HA LEU A 165 3.533 -2.055 -2.453 1.00 0.19 H new ATOM 0 HB2 LEU A 165 5.783 -3.660 -1.200 1.00 0.19 H new ATOM 0 HB3 LEU A 165 4.455 -2.975 -0.285 1.00 0.19 H new ATOM 0 HG LEU A 165 4.062 -4.937 -2.559 1.00 0.26 H new ATOM 0 HD11 LEU A 165 3.741 -6.643 -0.811 1.00 0.28 H new ATOM 0 HD12 LEU A 165 5.393 -5.981 -0.789 1.00 0.28 H new ATOM 0 HD13 LEU A 165 4.207 -5.454 0.429 1.00 0.28 H new ATOM 0 HD21 LEU A 165 1.848 -5.244 -1.518 1.00 0.32 H new ATOM 0 HD22 LEU A 165 2.255 -4.012 -0.300 1.00 0.32 H new ATOM 0 HD23 LEU A 165 2.113 -3.556 -2.014 1.00 0.32 H new ATOM 711 N GLY A 166 6.553 -0.873 -2.021 1.00 0.21 N ATOM 712 CA GLY A 166 7.275 0.328 -1.657 1.00 0.24 C ATOM 713 C GLY A 166 6.890 1.494 -2.529 1.00 0.24 C ATOM 714 O GLY A 166 6.769 2.626 -2.057 1.00 0.27 O ATOM 0 H GLY A 166 7.127 -1.603 -2.443 1.00 0.21 H new ATOM 0 HA2 GLY A 166 7.074 0.572 -0.614 1.00 0.24 H new ATOM 0 HA3 GLY A 166 8.347 0.148 -1.742 1.00 0.24 H new ATOM 718 N ARG A 167 6.684 1.214 -3.807 1.00 0.23 N ATOM 719 CA ARG A 167 6.203 2.222 -4.735 1.00 0.24 C ATOM 720 C ARG A 167 4.786 2.622 -4.368 1.00 0.20 C ATOM 721 O ARG A 167 4.424 3.794 -4.419 1.00 0.20 O ATOM 722 CB ARG A 167 6.226 1.704 -6.170 1.00 0.32 C ATOM 723 CG ARG A 167 7.616 1.509 -6.748 1.00 1.07 C ATOM 724 CD ARG A 167 7.567 1.609 -8.261 1.00 1.20 C ATOM 725 NE ARG A 167 6.953 2.871 -8.660 1.00 2.08 N ATOM 726 CZ ARG A 167 5.813 2.974 -9.340 1.00 2.69 C ATOM 727 NH1 ARG A 167 5.249 1.906 -9.893 1.00 2.67 N ATOM 728 NH2 ARG A 167 5.248 4.160 -9.485 1.00 3.80 N ATOM 0 H ARG A 167 6.843 0.297 -4.224 1.00 0.23 H new ATOM 0 HA ARG A 167 6.863 3.087 -4.668 1.00 0.24 H new ATOM 0 HB2 ARG A 167 5.694 0.753 -6.208 1.00 0.32 H new ATOM 0 HB3 ARG A 167 5.678 2.402 -6.803 1.00 0.32 H new ATOM 0 HG2 ARG A 167 8.294 2.262 -6.347 1.00 1.07 H new ATOM 0 HG3 ARG A 167 8.009 0.536 -6.452 1.00 1.07 H new ATOM 0 HD2 ARG A 167 8.575 1.540 -8.671 1.00 1.20 H new ATOM 0 HD3 ARG A 167 6.999 0.774 -8.670 1.00 1.20 H new ATOM 0 HE ARG A 167 7.430 3.734 -8.400 1.00 2.08 H new ATOM 0 HH11 ARG A 167 5.689 0.991 -9.800 1.00 2.67 H new ATOM 0 HH12 ARG A 167 4.375 2.001 -10.411 1.00 2.67 H new ATOM 0 HH21 ARG A 167 5.685 4.987 -9.078 1.00 3.80 H new ATOM 0 HH22 ARG A 167 4.375 4.249 -10.004 1.00 3.80 H new ATOM 742 N VAL A 168 3.992 1.628 -3.996 1.00 0.19 N ATOM 743 CA VAL A 168 2.636 1.853 -3.539 1.00 0.18 C ATOM 744 C VAL A 168 2.637 2.765 -2.308 1.00 0.18 C ATOM 745 O VAL A 168 1.910 3.746 -2.266 1.00 0.19 O ATOM 746 CB VAL A 168 1.927 0.505 -3.248 1.00 0.20 C ATOM 747 CG1 VAL A 168 0.789 0.667 -2.247 1.00 0.28 C ATOM 748 CG2 VAL A 168 1.396 -0.092 -4.541 1.00 0.21 C ATOM 0 H VAL A 168 4.272 0.647 -4.004 1.00 0.19 H new ATOM 0 HA VAL A 168 2.076 2.355 -4.328 1.00 0.18 H new ATOM 0 HB VAL A 168 2.664 -0.167 -2.808 1.00 0.20 H new ATOM 0 HG11 VAL A 168 0.319 -0.300 -2.071 1.00 0.28 H new ATOM 0 HG12 VAL A 168 1.183 1.055 -1.308 1.00 0.28 H new ATOM 0 HG13 VAL A 168 0.050 1.362 -2.645 1.00 0.28 H new ATOM 0 HG21 VAL A 168 0.899 -1.039 -4.328 1.00 0.21 H new ATOM 0 HG22 VAL A 168 0.684 0.597 -4.994 1.00 0.21 H new ATOM 0 HG23 VAL A 168 2.224 -0.263 -5.229 1.00 0.21 H new ATOM 758 N TRP A 169 3.485 2.454 -1.334 1.00 0.18 N ATOM 759 CA TRP A 169 3.706 3.323 -0.171 1.00 0.20 C ATOM 760 C TRP A 169 4.035 4.753 -0.611 1.00 0.20 C ATOM 761 O TRP A 169 3.547 5.717 -0.028 1.00 0.26 O ATOM 762 CB TRP A 169 4.852 2.758 0.663 1.00 0.21 C ATOM 763 CG TRP A 169 5.112 3.490 1.923 1.00 0.20 C ATOM 764 CD1 TRP A 169 6.010 4.503 2.110 1.00 0.24 C ATOM 765 CD2 TRP A 169 4.499 3.254 3.183 1.00 0.19 C ATOM 766 NE1 TRP A 169 5.985 4.903 3.406 1.00 0.24 N ATOM 767 CE2 TRP A 169 5.071 4.153 4.078 1.00 0.21 C ATOM 768 CE3 TRP A 169 3.525 2.372 3.654 1.00 0.18 C ATOM 769 CZ2 TRP A 169 4.714 4.204 5.391 1.00 0.22 C ATOM 770 CZ3 TRP A 169 3.169 2.433 4.983 1.00 0.20 C ATOM 771 CH2 TRP A 169 3.768 3.344 5.840 1.00 0.22 C ATOM 0 H TRP A 169 4.039 1.598 -1.323 1.00 0.18 H new ATOM 0 HA TRP A 169 2.794 3.355 0.425 1.00 0.20 H new ATOM 0 HB2 TRP A 169 4.633 1.717 0.901 1.00 0.21 H new ATOM 0 HB3 TRP A 169 5.760 2.763 0.060 1.00 0.21 H new ATOM 0 HD1 TRP A 169 6.644 4.922 1.342 1.00 0.24 H new ATOM 0 HE1 TRP A 169 6.557 5.644 3.810 1.00 0.24 H new ATOM 0 HE3 TRP A 169 3.061 1.657 2.991 1.00 0.18 H new ATOM 0 HZ2 TRP A 169 5.175 4.915 6.061 1.00 0.22 H new ATOM 0 HZ3 TRP A 169 2.413 1.762 5.363 1.00 0.20 H new ATOM 0 HH2 TRP A 169 3.476 3.368 6.880 1.00 0.22 H new ATOM 782 N GLU A 170 4.860 4.884 -1.640 1.00 0.17 N ATOM 783 CA GLU A 170 5.274 6.194 -2.124 1.00 0.22 C ATOM 784 C GLU A 170 4.130 6.945 -2.830 1.00 0.21 C ATOM 785 O GLU A 170 3.997 8.157 -2.672 1.00 0.27 O ATOM 786 CB GLU A 170 6.508 6.058 -3.028 1.00 0.33 C ATOM 787 CG GLU A 170 6.930 7.357 -3.697 1.00 1.17 C ATOM 788 CD GLU A 170 8.182 7.203 -4.533 1.00 1.84 C ATOM 789 OE1 GLU A 170 9.279 7.057 -3.949 1.00 2.29 O ATOM 790 OE2 GLU A 170 8.073 7.211 -5.777 1.00 2.55 O ATOM 0 H GLU A 170 5.256 4.099 -2.156 1.00 0.17 H new ATOM 0 HA GLU A 170 5.545 6.799 -1.259 1.00 0.22 H new ATOM 0 HB2 GLU A 170 7.340 5.679 -2.435 1.00 0.33 H new ATOM 0 HB3 GLU A 170 6.302 5.315 -3.798 1.00 0.33 H new ATOM 0 HG2 GLU A 170 6.118 7.716 -4.329 1.00 1.17 H new ATOM 0 HG3 GLU A 170 7.099 8.116 -2.933 1.00 1.17 H new ATOM 797 N LEU A 171 3.309 6.233 -3.597 1.00 0.20 N ATOM 798 CA LEU A 171 2.187 6.857 -4.309 1.00 0.24 C ATOM 799 C LEU A 171 0.972 7.040 -3.399 1.00 0.23 C ATOM 800 O LEU A 171 0.380 8.115 -3.344 1.00 0.31 O ATOM 801 CB LEU A 171 1.782 6.016 -5.523 1.00 0.29 C ATOM 802 CG LEU A 171 2.882 5.780 -6.561 1.00 0.45 C ATOM 803 CD1 LEU A 171 2.397 4.818 -7.635 1.00 1.06 C ATOM 804 CD2 LEU A 171 3.319 7.097 -7.185 1.00 1.14 C ATOM 0 H LEU A 171 3.395 5.227 -3.744 1.00 0.20 H new ATOM 0 HA LEU A 171 2.526 7.839 -4.639 1.00 0.24 H new ATOM 0 HB2 LEU A 171 1.427 5.048 -5.170 1.00 0.29 H new ATOM 0 HB3 LEU A 171 0.941 6.503 -6.016 1.00 0.29 H new ATOM 0 HG LEU A 171 3.742 5.336 -6.059 1.00 0.45 H new ATOM 0 HD11 LEU A 171 3.190 4.660 -8.366 1.00 1.06 H new ATOM 0 HD12 LEU A 171 2.130 3.866 -7.177 1.00 1.06 H new ATOM 0 HD13 LEU A 171 1.523 5.239 -8.132 1.00 1.06 H new ATOM 0 HD21 LEU A 171 4.101 6.909 -7.920 1.00 1.14 H new ATOM 0 HD22 LEU A 171 2.467 7.568 -7.674 1.00 1.14 H new ATOM 0 HD23 LEU A 171 3.702 7.758 -6.408 1.00 1.14 H new ATOM 816 N SER A 172 0.614 5.979 -2.685 1.00 0.20 N ATOM 817 CA SER A 172 -0.607 5.950 -1.888 1.00 0.24 C ATOM 818 C SER A 172 -0.514 6.860 -0.671 1.00 0.22 C ATOM 819 O SER A 172 -1.528 7.332 -0.168 1.00 0.28 O ATOM 820 CB SER A 172 -0.910 4.522 -1.453 1.00 0.28 C ATOM 821 OG SER A 172 -0.983 3.663 -2.578 1.00 1.12 O ATOM 0 H SER A 172 1.159 5.118 -2.642 1.00 0.20 H new ATOM 0 HA SER A 172 -1.419 6.321 -2.513 1.00 0.24 H new ATOM 0 HB2 SER A 172 -0.135 4.172 -0.771 1.00 0.28 H new ATOM 0 HB3 SER A 172 -1.852 4.495 -0.906 1.00 0.28 H new ATOM 0 HG SER A 172 -0.079 3.483 -2.911 1.00 1.12 H new ATOM 827 N ASP A 173 0.690 7.077 -0.174 1.00 0.16 N ATOM 828 CA ASP A 173 0.895 8.055 0.881 1.00 0.15 C ATOM 829 C ASP A 173 1.084 9.432 0.248 1.00 0.14 C ATOM 830 O ASP A 173 2.202 9.913 0.061 1.00 0.16 O ATOM 831 CB ASP A 173 2.073 7.630 1.769 1.00 0.16 C ATOM 832 CG ASP A 173 2.527 8.694 2.760 1.00 0.18 C ATOM 833 OD1 ASP A 173 1.667 9.391 3.351 1.00 0.20 O ATOM 834 OD2 ASP A 173 3.755 8.824 2.971 1.00 0.25 O ATOM 0 H ASP A 173 1.535 6.594 -0.480 1.00 0.16 H new ATOM 0 HA ASP A 173 0.024 8.111 1.534 1.00 0.15 H new ATOM 0 HB2 ASP A 173 1.792 6.733 2.321 1.00 0.16 H new ATOM 0 HB3 ASP A 173 2.915 7.361 1.131 1.00 0.16 H new ATOM 839 N ILE A 174 -0.055 10.039 -0.090 1.00 0.15 N ATOM 840 CA ILE A 174 -0.113 11.289 -0.844 1.00 0.19 C ATOM 841 C ILE A 174 0.590 12.431 -0.119 1.00 0.17 C ATOM 842 O ILE A 174 1.294 13.231 -0.740 1.00 0.19 O ATOM 843 CB ILE A 174 -1.583 11.702 -1.149 1.00 0.32 C ATOM 844 CG1 ILE A 174 -2.180 10.824 -2.252 1.00 0.57 C ATOM 845 CG2 ILE A 174 -1.673 13.169 -1.551 1.00 0.29 C ATOM 846 CD1 ILE A 174 -2.659 9.473 -1.779 1.00 1.00 C ATOM 0 H ILE A 174 -0.974 9.670 0.156 1.00 0.15 H new ATOM 0 HA ILE A 174 0.409 11.102 -1.782 1.00 0.19 H new ATOM 0 HB ILE A 174 -2.158 11.558 -0.234 1.00 0.32 H new ATOM 0 HG12 ILE A 174 -3.016 11.353 -2.709 1.00 0.57 H new ATOM 0 HG13 ILE A 174 -1.431 10.679 -3.030 1.00 0.57 H new ATOM 0 HG21 ILE A 174 -2.712 13.427 -1.757 1.00 0.29 H new ATOM 0 HG22 ILE A 174 -1.299 13.792 -0.739 1.00 0.29 H new ATOM 0 HG23 ILE A 174 -1.073 13.339 -2.445 1.00 0.29 H new ATOM 0 HD11 ILE A 174 -3.067 8.916 -2.622 1.00 1.00 H new ATOM 0 HD12 ILE A 174 -1.823 8.921 -1.349 1.00 1.00 H new ATOM 0 HD13 ILE A 174 -3.433 9.606 -1.023 1.00 1.00 H new ATOM 858 N ASP A 175 0.419 12.510 1.191 1.00 0.19 N ATOM 859 CA ASP A 175 0.987 13.619 1.947 1.00 0.24 C ATOM 860 C ASP A 175 2.431 13.334 2.333 1.00 0.22 C ATOM 861 O ASP A 175 3.122 14.194 2.885 1.00 0.28 O ATOM 862 CB ASP A 175 0.146 13.939 3.192 1.00 0.37 C ATOM 863 CG ASP A 175 -0.188 12.718 4.029 1.00 0.57 C ATOM 864 OD1 ASP A 175 0.642 11.788 4.091 1.00 0.62 O ATOM 865 OD2 ASP A 175 -1.278 12.674 4.635 1.00 1.29 O ATOM 0 H ASP A 175 -0.100 11.831 1.748 1.00 0.19 H new ATOM 0 HA ASP A 175 0.973 14.496 1.300 1.00 0.24 H new ATOM 0 HB2 ASP A 175 0.686 14.657 3.810 1.00 0.37 H new ATOM 0 HB3 ASP A 175 -0.781 14.420 2.880 1.00 0.37 H new ATOM 870 N HIS A 176 2.869 12.112 2.032 1.00 0.21 N ATOM 871 CA HIS A 176 4.263 11.698 2.201 1.00 0.28 C ATOM 872 C HIS A 176 4.727 11.872 3.642 1.00 0.31 C ATOM 873 O HIS A 176 5.903 12.141 3.904 1.00 0.35 O ATOM 874 CB HIS A 176 5.176 12.488 1.254 1.00 0.35 C ATOM 875 CG HIS A 176 4.790 12.371 -0.188 1.00 0.93 C ATOM 876 ND1 HIS A 176 4.451 13.453 -0.966 1.00 1.85 N ATOM 877 CD2 HIS A 176 4.698 11.290 -0.993 1.00 1.52 C ATOM 878 CE1 HIS A 176 4.169 13.044 -2.186 1.00 2.55 C ATOM 879 NE2 HIS A 176 4.310 11.734 -2.231 1.00 2.34 N ATOM 0 H HIS A 176 2.265 11.378 1.663 1.00 0.21 H new ATOM 0 HA HIS A 176 4.324 10.638 1.953 1.00 0.28 H new ATOM 0 HB2 HIS A 176 5.161 13.539 1.541 1.00 0.35 H new ATOM 0 HB3 HIS A 176 6.201 12.139 1.376 1.00 0.35 H new ATOM 0 HD2 HIS A 176 4.894 10.265 -0.713 1.00 1.52 H new ATOM 0 HE1 HIS A 176 3.872 13.675 -3.010 1.00 2.55 H new ATOM 0 HE2 HIS A 176 4.156 11.148 -3.051 1.00 2.34 H new ATOM 888 N ASP A 177 3.803 11.692 4.574 1.00 0.32 N ATOM 889 CA ASP A 177 4.082 11.912 5.988 1.00 0.35 C ATOM 890 C ASP A 177 4.760 10.697 6.616 1.00 0.32 C ATOM 891 O ASP A 177 5.167 10.736 7.776 1.00 0.35 O ATOM 892 CB ASP A 177 2.789 12.248 6.746 1.00 0.36 C ATOM 893 CG ASP A 177 1.888 11.047 6.971 1.00 0.35 C ATOM 894 OD1 ASP A 177 1.461 10.413 5.976 1.00 0.33 O ATOM 895 OD2 ASP A 177 1.586 10.746 8.137 1.00 0.52 O ATOM 0 H ASP A 177 2.848 11.393 4.376 1.00 0.32 H new ATOM 0 HA ASP A 177 4.766 12.757 6.063 1.00 0.35 H new ATOM 0 HB2 ASP A 177 3.046 12.685 7.711 1.00 0.36 H new ATOM 0 HB3 ASP A 177 2.238 13.006 6.190 1.00 0.36 H new ATOM 900 N GLY A 178 4.900 9.627 5.843 1.00 0.29 N ATOM 901 CA GLY A 178 5.524 8.420 6.357 1.00 0.29 C ATOM 902 C GLY A 178 4.514 7.483 6.978 1.00 0.22 C ATOM 903 O GLY A 178 4.862 6.419 7.488 1.00 0.22 O ATOM 0 H GLY A 178 4.594 9.572 4.872 1.00 0.29 H new ATOM 0 HA2 GLY A 178 6.045 7.908 5.548 1.00 0.29 H new ATOM 0 HA3 GLY A 178 6.275 8.688 7.100 1.00 0.29 H new ATOM 907 N MET A 179 3.262 7.901 6.950 1.00 0.19 N ATOM 908 CA MET A 179 2.161 7.086 7.425 1.00 0.20 C ATOM 909 C MET A 179 1.074 7.058 6.372 1.00 0.19 C ATOM 910 O MET A 179 1.052 7.890 5.466 1.00 0.26 O ATOM 911 CB MET A 179 1.591 7.640 8.737 1.00 0.23 C ATOM 912 CG MET A 179 2.521 7.485 9.926 1.00 0.27 C ATOM 913 SD MET A 179 1.859 8.221 11.434 1.00 0.34 S ATOM 914 CE MET A 179 3.154 7.796 12.597 1.00 1.68 C ATOM 0 H MET A 179 2.980 8.816 6.597 1.00 0.19 H new ATOM 0 HA MET A 179 2.529 6.077 7.612 1.00 0.20 H new ATOM 0 HB2 MET A 179 1.361 8.697 8.604 1.00 0.23 H new ATOM 0 HB3 MET A 179 0.651 7.134 8.955 1.00 0.23 H new ATOM 0 HG2 MET A 179 2.710 6.425 10.097 1.00 0.27 H new ATOM 0 HG3 MET A 179 3.481 7.947 9.693 1.00 0.27 H new ATOM 0 HE1 MET A 179 3.105 8.465 13.456 1.00 1.68 H new ATOM 0 HE2 MET A 179 3.020 6.767 12.930 1.00 1.68 H new ATOM 0 HE3 MET A 179 4.125 7.898 12.113 1.00 1.68 H new ATOM 924 N LEU A 180 0.175 6.111 6.481 1.00 0.13 N ATOM 925 CA LEU A 180 -0.937 6.043 5.569 1.00 0.11 C ATOM 926 C LEU A 180 -2.214 6.360 6.307 1.00 0.10 C ATOM 927 O LEU A 180 -2.635 5.627 7.204 1.00 0.12 O ATOM 928 CB LEU A 180 -1.010 4.679 4.889 1.00 0.15 C ATOM 929 CG LEU A 180 -0.109 4.542 3.664 1.00 0.16 C ATOM 930 CD1 LEU A 180 0.196 3.087 3.374 1.00 0.91 C ATOM 931 CD2 LEU A 180 -0.741 5.177 2.451 1.00 1.06 C ATOM 0 H LEU A 180 0.192 5.379 7.191 1.00 0.13 H new ATOM 0 HA LEU A 180 -0.795 6.783 4.782 1.00 0.11 H new ATOM 0 HB2 LEU A 180 -0.740 3.910 5.613 1.00 0.15 H new ATOM 0 HB3 LEU A 180 -2.041 4.489 4.591 1.00 0.15 H new ATOM 0 HG LEU A 180 0.823 5.061 3.887 1.00 0.16 H new ATOM 0 HD11 LEU A 180 0.839 3.018 2.497 1.00 0.91 H new ATOM 0 HD12 LEU A 180 0.703 2.644 4.231 1.00 0.91 H new ATOM 0 HD13 LEU A 180 -0.734 2.551 3.185 1.00 0.91 H new ATOM 0 HD21 LEU A 180 -0.077 5.064 1.594 1.00 1.06 H new ATOM 0 HD22 LEU A 180 -1.693 4.690 2.239 1.00 1.06 H new ATOM 0 HD23 LEU A 180 -0.911 6.237 2.642 1.00 1.06 H new ATOM 943 N ASP A 181 -2.803 7.478 5.935 1.00 0.14 N ATOM 944 CA ASP A 181 -4.047 7.931 6.517 1.00 0.21 C ATOM 945 C ASP A 181 -5.173 7.039 6.033 1.00 0.16 C ATOM 946 O ASP A 181 -4.991 6.309 5.066 1.00 0.14 O ATOM 947 CB ASP A 181 -4.286 9.395 6.107 1.00 0.38 C ATOM 948 CG ASP A 181 -5.651 9.933 6.483 1.00 0.49 C ATOM 949 OD1 ASP A 181 -6.599 9.751 5.695 1.00 0.64 O ATOM 950 OD2 ASP A 181 -5.772 10.566 7.550 1.00 1.33 O ATOM 0 H ASP A 181 -2.430 8.100 5.218 1.00 0.14 H new ATOM 0 HA ASP A 181 -4.005 7.876 7.605 1.00 0.21 H new ATOM 0 HB2 ASP A 181 -3.522 10.019 6.571 1.00 0.38 H new ATOM 0 HB3 ASP A 181 -4.158 9.483 5.028 1.00 0.38 H new ATOM 955 N ARG A 182 -6.305 7.067 6.704 1.00 0.16 N ATOM 956 CA ARG A 182 -7.458 6.277 6.303 1.00 0.16 C ATOM 957 C ARG A 182 -7.731 6.392 4.788 1.00 0.16 C ATOM 958 O ARG A 182 -8.023 5.389 4.129 1.00 0.17 O ATOM 959 CB ARG A 182 -8.664 6.719 7.134 1.00 0.20 C ATOM 960 CG ARG A 182 -9.933 5.924 6.870 1.00 0.36 C ATOM 961 CD ARG A 182 -11.051 6.331 7.817 1.00 0.54 C ATOM 962 NE ARG A 182 -10.858 5.797 9.164 1.00 1.31 N ATOM 963 CZ ARG A 182 -10.718 6.541 10.258 1.00 2.05 C ATOM 964 NH1 ARG A 182 -10.698 7.867 10.172 1.00 2.27 N ATOM 965 NH2 ARG A 182 -10.597 5.955 11.443 1.00 2.95 N ATOM 0 H ARG A 182 -6.455 7.634 7.539 1.00 0.16 H new ATOM 0 HA ARG A 182 -7.258 5.222 6.492 1.00 0.16 H new ATOM 0 HB2 ARG A 182 -8.411 6.637 8.191 1.00 0.20 H new ATOM 0 HB3 ARG A 182 -8.861 7.772 6.934 1.00 0.20 H new ATOM 0 HG2 ARG A 182 -10.253 6.079 5.840 1.00 0.36 H new ATOM 0 HG3 ARG A 182 -9.727 4.860 6.984 1.00 0.36 H new ATOM 0 HD2 ARG A 182 -11.107 7.419 7.864 1.00 0.54 H new ATOM 0 HD3 ARG A 182 -12.004 5.980 7.422 1.00 0.54 H new ATOM 0 HE ARG A 182 -10.829 4.783 9.273 1.00 1.31 H new ATOM 0 HH11 ARG A 182 -10.790 8.321 9.263 1.00 2.27 H new ATOM 0 HH12 ARG A 182 -10.590 8.431 11.015 1.00 2.27 H new ATOM 0 HH21 ARG A 182 -10.612 4.937 11.513 1.00 2.95 H new ATOM 0 HH22 ARG A 182 -10.489 6.522 12.284 1.00 2.95 H new ATOM 979 N ASP A 183 -7.589 7.597 4.231 1.00 0.15 N ATOM 980 CA ASP A 183 -7.753 7.795 2.787 1.00 0.17 C ATOM 981 C ASP A 183 -6.562 7.237 2.023 1.00 0.16 C ATOM 982 O ASP A 183 -6.733 6.551 1.020 1.00 0.17 O ATOM 983 CB ASP A 183 -7.938 9.274 2.430 1.00 0.21 C ATOM 984 CG ASP A 183 -9.273 9.823 2.900 1.00 0.27 C ATOM 985 OD1 ASP A 183 -10.249 9.044 2.981 1.00 0.38 O ATOM 986 OD2 ASP A 183 -9.358 11.039 3.179 1.00 0.67 O ATOM 0 H ASP A 183 -7.363 8.444 4.752 1.00 0.15 H new ATOM 0 HA ASP A 183 -8.655 7.256 2.497 1.00 0.17 H new ATOM 0 HB2 ASP A 183 -7.132 9.856 2.877 1.00 0.21 H new ATOM 0 HB3 ASP A 183 -7.858 9.396 1.350 1.00 0.21 H new ATOM 991 N GLU A 184 -5.359 7.508 2.524 1.00 0.15 N ATOM 992 CA GLU A 184 -4.131 7.117 1.829 1.00 0.16 C ATOM 993 C GLU A 184 -4.045 5.606 1.706 1.00 0.18 C ATOM 994 O GLU A 184 -3.650 5.064 0.678 1.00 0.22 O ATOM 995 CB GLU A 184 -2.883 7.609 2.571 1.00 0.14 C ATOM 996 CG GLU A 184 -2.871 9.084 2.873 1.00 0.15 C ATOM 997 CD GLU A 184 -1.517 9.587 3.322 1.00 0.20 C ATOM 998 OE1 GLU A 184 -1.120 9.357 4.486 1.00 0.21 O ATOM 999 OE2 GLU A 184 -0.834 10.232 2.526 1.00 0.32 O ATOM 0 H GLU A 184 -5.206 7.996 3.407 1.00 0.15 H new ATOM 0 HA GLU A 184 -4.167 7.575 0.841 1.00 0.16 H new ATOM 0 HB2 GLU A 184 -2.794 7.059 3.508 1.00 0.14 H new ATOM 0 HB3 GLU A 184 -2.003 7.367 1.975 1.00 0.14 H new ATOM 0 HG2 GLU A 184 -3.179 9.633 1.983 1.00 0.15 H new ATOM 0 HG3 GLU A 184 -3.606 9.296 3.649 1.00 0.15 H new ATOM 1006 N PHE A 185 -4.405 4.935 2.778 1.00 0.16 N ATOM 1007 CA PHE A 185 -4.299 3.495 2.845 1.00 0.17 C ATOM 1008 C PHE A 185 -5.381 2.834 2.031 1.00 0.17 C ATOM 1009 O PHE A 185 -5.166 1.776 1.441 1.00 0.17 O ATOM 1010 CB PHE A 185 -4.442 3.021 4.259 1.00 0.15 C ATOM 1011 CG PHE A 185 -4.133 1.559 4.409 1.00 0.16 C ATOM 1012 CD1 PHE A 185 -2.859 1.065 4.160 1.00 0.20 C ATOM 1013 CD2 PHE A 185 -5.116 0.680 4.829 1.00 0.22 C ATOM 1014 CE1 PHE A 185 -2.580 -0.275 4.329 1.00 0.26 C ATOM 1015 CE2 PHE A 185 -4.840 -0.658 5.006 1.00 0.27 C ATOM 1016 CZ PHE A 185 -3.553 -1.149 4.615 1.00 0.26 C ATOM 0 H PHE A 185 -4.777 5.369 3.623 1.00 0.16 H new ATOM 0 HA PHE A 185 -3.319 3.228 2.450 1.00 0.17 H new ATOM 0 HB2 PHE A 185 -3.776 3.598 4.901 1.00 0.15 H new ATOM 0 HB3 PHE A 185 -5.459 3.211 4.602 1.00 0.15 H new ATOM 0 HD1 PHE A 185 -2.080 1.736 3.831 1.00 0.20 H new ATOM 0 HD2 PHE A 185 -6.113 1.048 5.021 1.00 0.22 H new ATOM 0 HE1 PHE A 185 -1.563 -0.624 4.229 1.00 0.26 H new ATOM 0 HE2 PHE A 185 -5.578 -1.322 5.430 1.00 0.27 H new ATOM 0 HZ PHE A 185 -3.369 -2.211 4.552 1.00 0.26 H new ATOM 1026 N ALA A 186 -6.560 3.440 2.032 1.00 0.17 N ATOM 1027 CA ALA A 186 -7.644 2.950 1.217 1.00 0.17 C ATOM 1028 C ALA A 186 -7.166 2.915 -0.221 1.00 0.18 C ATOM 1029 O ALA A 186 -7.434 1.978 -0.963 1.00 0.20 O ATOM 1030 CB ALA A 186 -8.860 3.840 1.379 1.00 0.17 C ATOM 0 H ALA A 186 -6.782 4.266 2.587 1.00 0.17 H new ATOM 0 HA ALA A 186 -7.938 1.946 1.524 1.00 0.17 H new ATOM 0 HB1 ALA A 186 -9.673 3.462 0.759 1.00 0.17 H new ATOM 0 HB2 ALA A 186 -9.171 3.844 2.424 1.00 0.17 H new ATOM 0 HB3 ALA A 186 -8.611 4.855 1.071 1.00 0.17 H new ATOM 1036 N VAL A 187 -6.400 3.941 -0.563 1.00 0.18 N ATOM 1037 CA VAL A 187 -5.711 4.016 -1.841 1.00 0.18 C ATOM 1038 C VAL A 187 -4.740 2.844 -2.011 1.00 0.18 C ATOM 1039 O VAL A 187 -4.770 2.140 -3.021 1.00 0.18 O ATOM 1040 CB VAL A 187 -4.924 5.334 -1.945 1.00 0.21 C ATOM 1041 CG1 VAL A 187 -4.095 5.378 -3.219 1.00 0.23 C ATOM 1042 CG2 VAL A 187 -5.866 6.522 -1.888 1.00 0.22 C ATOM 0 H VAL A 187 -6.239 4.747 0.041 1.00 0.18 H new ATOM 0 HA VAL A 187 -6.465 3.971 -2.627 1.00 0.18 H new ATOM 0 HB VAL A 187 -4.243 5.386 -1.095 1.00 0.21 H new ATOM 0 HG11 VAL A 187 -3.550 6.321 -3.266 1.00 0.23 H new ATOM 0 HG12 VAL A 187 -3.387 4.549 -3.222 1.00 0.23 H new ATOM 0 HG13 VAL A 187 -4.753 5.296 -4.084 1.00 0.23 H new ATOM 0 HG21 VAL A 187 -5.292 7.446 -1.963 1.00 0.22 H new ATOM 0 HG22 VAL A 187 -6.573 6.466 -2.716 1.00 0.22 H new ATOM 0 HG23 VAL A 187 -6.411 6.509 -0.944 1.00 0.22 H new ATOM 1052 N ALA A 188 -3.896 2.639 -1.004 1.00 0.17 N ATOM 1053 CA ALA A 188 -2.864 1.606 -1.041 1.00 0.18 C ATOM 1054 C ALA A 188 -3.454 0.216 -1.238 1.00 0.18 C ATOM 1055 O ALA A 188 -3.106 -0.484 -2.185 1.00 0.20 O ATOM 1056 CB ALA A 188 -2.039 1.645 0.237 1.00 0.18 C ATOM 0 H ALA A 188 -3.907 3.183 -0.141 1.00 0.17 H new ATOM 0 HA ALA A 188 -2.222 1.815 -1.897 1.00 0.18 H new ATOM 0 HB1 ALA A 188 -1.273 0.871 0.199 1.00 0.18 H new ATOM 0 HB2 ALA A 188 -1.564 2.621 0.334 1.00 0.18 H new ATOM 0 HB3 ALA A 188 -2.689 1.471 1.095 1.00 0.18 H new ATOM 1062 N MET A 189 -4.364 -0.167 -0.354 1.00 0.19 N ATOM 1063 CA MET A 189 -4.956 -1.500 -0.390 1.00 0.23 C ATOM 1064 C MET A 189 -5.818 -1.678 -1.639 1.00 0.19 C ATOM 1065 O MET A 189 -5.981 -2.793 -2.143 1.00 0.22 O ATOM 1066 CB MET A 189 -5.766 -1.760 0.882 1.00 0.29 C ATOM 1067 CG MET A 189 -5.099 -2.723 1.847 1.00 0.61 C ATOM 1068 SD MET A 189 -5.017 -4.398 1.195 1.00 0.93 S ATOM 1069 CE MET A 189 -6.762 -4.706 0.945 1.00 0.35 C ATOM 0 H MET A 189 -4.710 0.427 0.399 1.00 0.19 H new ATOM 0 HA MET A 189 -4.151 -2.234 -0.435 1.00 0.23 H new ATOM 0 HB2 MET A 189 -5.939 -0.812 1.391 1.00 0.29 H new ATOM 0 HB3 MET A 189 -6.743 -2.156 0.605 1.00 0.29 H new ATOM 0 HG2 MET A 189 -4.091 -2.372 2.068 1.00 0.61 H new ATOM 0 HG3 MET A 189 -5.648 -2.729 2.789 1.00 0.61 H new ATOM 0 HE1 MET A 189 -6.922 -5.769 0.765 1.00 0.35 H new ATOM 0 HE2 MET A 189 -7.316 -4.401 1.833 1.00 0.35 H new ATOM 0 HE3 MET A 189 -7.113 -4.135 0.085 1.00 0.35 H new ATOM 1079 N PHE A 190 -6.367 -0.574 -2.134 1.00 0.16 N ATOM 1080 CA PHE A 190 -7.087 -0.564 -3.405 1.00 0.15 C ATOM 1081 C PHE A 190 -6.142 -0.947 -4.541 1.00 0.16 C ATOM 1082 O PHE A 190 -6.503 -1.714 -5.435 1.00 0.17 O ATOM 1083 CB PHE A 190 -7.680 0.826 -3.651 1.00 0.17 C ATOM 1084 CG PHE A 190 -8.454 0.955 -4.929 1.00 0.18 C ATOM 1085 CD1 PHE A 190 -7.801 1.277 -6.107 1.00 0.23 C ATOM 1086 CD2 PHE A 190 -9.829 0.768 -4.953 1.00 0.20 C ATOM 1087 CE1 PHE A 190 -8.498 1.406 -7.286 1.00 0.27 C ATOM 1088 CE2 PHE A 190 -10.531 0.901 -6.134 1.00 0.25 C ATOM 1089 CZ PHE A 190 -9.861 1.220 -7.300 1.00 0.28 C ATOM 0 H PHE A 190 -6.327 0.334 -1.670 1.00 0.16 H new ATOM 0 HA PHE A 190 -7.898 -1.291 -3.366 1.00 0.15 H new ATOM 0 HB2 PHE A 190 -8.335 1.081 -2.817 1.00 0.17 H new ATOM 0 HB3 PHE A 190 -6.871 1.557 -3.656 1.00 0.17 H new ATOM 0 HD1 PHE A 190 -6.732 1.429 -6.100 1.00 0.23 H new ATOM 0 HD2 PHE A 190 -10.353 0.517 -4.042 1.00 0.20 H new ATOM 0 HE1 PHE A 190 -7.976 1.653 -8.199 1.00 0.27 H new ATOM 0 HE2 PHE A 190 -11.601 0.756 -6.147 1.00 0.25 H new ATOM 0 HZ PHE A 190 -10.409 1.324 -8.225 1.00 0.28 H new ATOM 1099 N LEU A 191 -4.918 -0.437 -4.472 1.00 0.18 N ATOM 1100 CA LEU A 191 -3.916 -0.704 -5.497 1.00 0.21 C ATOM 1101 C LEU A 191 -3.392 -2.129 -5.374 1.00 0.23 C ATOM 1102 O LEU A 191 -2.907 -2.708 -6.346 1.00 0.27 O ATOM 1103 CB LEU A 191 -2.757 0.297 -5.404 1.00 0.24 C ATOM 1104 CG LEU A 191 -3.119 1.748 -5.736 1.00 0.34 C ATOM 1105 CD1 LEU A 191 -1.899 2.647 -5.597 1.00 0.57 C ATOM 1106 CD2 LEU A 191 -3.694 1.846 -7.141 1.00 0.78 C ATOM 0 H LEU A 191 -4.595 0.165 -3.715 1.00 0.18 H new ATOM 0 HA LEU A 191 -4.391 -0.589 -6.471 1.00 0.21 H new ATOM 0 HB2 LEU A 191 -2.349 0.263 -4.394 1.00 0.24 H new ATOM 0 HB3 LEU A 191 -1.964 -0.026 -6.079 1.00 0.24 H new ATOM 0 HG LEU A 191 -3.877 2.084 -5.029 1.00 0.34 H new ATOM 0 HD11 LEU A 191 -2.175 3.674 -5.837 1.00 0.57 H new ATOM 0 HD12 LEU A 191 -1.527 2.600 -4.573 1.00 0.57 H new ATOM 0 HD13 LEU A 191 -1.120 2.311 -6.281 1.00 0.57 H new ATOM 0 HD21 LEU A 191 -3.945 2.884 -7.360 1.00 0.78 H new ATOM 0 HD22 LEU A 191 -2.957 1.492 -7.861 1.00 0.78 H new ATOM 0 HD23 LEU A 191 -4.592 1.233 -7.210 1.00 0.78 H new ATOM 1118 N VAL A 192 -3.505 -2.701 -4.180 1.00 0.23 N ATOM 1119 CA VAL A 192 -3.076 -4.072 -3.953 1.00 0.26 C ATOM 1120 C VAL A 192 -4.023 -5.044 -4.656 1.00 0.28 C ATOM 1121 O VAL A 192 -3.571 -5.926 -5.384 1.00 0.33 O ATOM 1122 CB VAL A 192 -2.976 -4.397 -2.445 1.00 0.26 C ATOM 1123 CG1 VAL A 192 -2.403 -5.784 -2.229 1.00 0.25 C ATOM 1124 CG2 VAL A 192 -2.112 -3.369 -1.731 1.00 0.31 C ATOM 0 H VAL A 192 -3.889 -2.236 -3.358 1.00 0.23 H new ATOM 0 HA VAL A 192 -2.078 -4.185 -4.375 1.00 0.26 H new ATOM 0 HB VAL A 192 -3.983 -4.364 -2.030 1.00 0.26 H new ATOM 0 HG11 VAL A 192 -2.342 -5.990 -1.160 1.00 0.25 H new ATOM 0 HG12 VAL A 192 -3.048 -6.522 -2.705 1.00 0.25 H new ATOM 0 HG13 VAL A 192 -1.406 -5.838 -2.666 1.00 0.25 H new ATOM 0 HG21 VAL A 192 -2.054 -3.616 -0.671 1.00 0.31 H new ATOM 0 HG22 VAL A 192 -1.110 -3.375 -2.160 1.00 0.31 H new ATOM 0 HG23 VAL A 192 -2.552 -2.379 -1.850 1.00 0.31 H new ATOM 1134 N TYR A 193 -5.333 -4.874 -4.469 1.00 0.25 N ATOM 1135 CA TYR A 193 -6.296 -5.670 -5.233 1.00 0.27 C ATOM 1136 C TYR A 193 -6.190 -5.337 -6.708 1.00 0.28 C ATOM 1137 O TYR A 193 -6.357 -6.203 -7.558 1.00 0.34 O ATOM 1138 CB TYR A 193 -7.743 -5.433 -4.808 1.00 0.32 C ATOM 1139 CG TYR A 193 -8.212 -6.240 -3.623 1.00 0.35 C ATOM 1140 CD1 TYR A 193 -8.643 -7.547 -3.768 1.00 0.50 C ATOM 1141 CD2 TYR A 193 -8.192 -5.691 -2.350 1.00 0.37 C ATOM 1142 CE1 TYR A 193 -9.044 -8.288 -2.674 1.00 0.59 C ATOM 1143 CE2 TYR A 193 -8.594 -6.420 -1.253 1.00 0.43 C ATOM 1144 CZ TYR A 193 -9.132 -7.729 -1.471 1.00 0.53 C ATOM 1145 OH TYR A 193 -9.412 -8.444 -0.322 1.00 0.63 O ATOM 0 H TYR A 193 -5.744 -4.210 -3.813 1.00 0.25 H new ATOM 0 HA TYR A 193 -6.046 -6.713 -5.037 1.00 0.27 H new ATOM 0 HB2 TYR A 193 -7.867 -4.375 -4.577 1.00 0.32 H new ATOM 0 HB3 TYR A 193 -8.393 -5.652 -5.655 1.00 0.32 H new ATOM 0 HD1 TYR A 193 -8.666 -7.994 -4.751 1.00 0.50 H new ATOM 0 HD2 TYR A 193 -7.855 -4.674 -2.216 1.00 0.37 H new ATOM 0 HE1 TYR A 193 -9.289 -9.333 -2.797 1.00 0.59 H new ATOM 0 HE2 TYR A 193 -8.506 -6.015 -0.255 1.00 0.43 H new ATOM 0 HH TYR A 193 -9.002 -9.332 -0.381 1.00 0.63 H new ATOM 1155 N CYS A 194 -5.929 -4.068 -6.994 1.00 0.28 N ATOM 1156 CA CYS A 194 -5.799 -3.593 -8.362 1.00 0.33 C ATOM 1157 C CYS A 194 -4.747 -4.418 -9.108 1.00 0.35 C ATOM 1158 O CYS A 194 -4.998 -4.924 -10.200 1.00 0.40 O ATOM 1159 CB CYS A 194 -5.433 -2.102 -8.350 1.00 0.34 C ATOM 1160 SG CYS A 194 -5.886 -1.192 -9.843 1.00 0.58 S ATOM 0 H CYS A 194 -5.802 -3.344 -6.287 1.00 0.28 H new ATOM 0 HA CYS A 194 -6.748 -3.713 -8.885 1.00 0.33 H new ATOM 0 HB2 CYS A 194 -5.918 -1.631 -7.495 1.00 0.34 H new ATOM 0 HB3 CYS A 194 -4.358 -2.009 -8.198 1.00 0.34 H new ATOM 0 HG CYS A 194 -5.531 0.052 -9.717 1.00 0.58 H new ATOM 1166 N ALA A 195 -3.582 -4.595 -8.494 1.00 0.35 N ATOM 1167 CA ALA A 195 -2.535 -5.418 -9.082 1.00 0.40 C ATOM 1168 C ALA A 195 -2.949 -6.888 -9.100 1.00 0.43 C ATOM 1169 O ALA A 195 -2.619 -7.628 -10.034 1.00 0.49 O ATOM 1170 CB ALA A 195 -1.231 -5.236 -8.321 1.00 0.42 C ATOM 0 H ALA A 195 -3.341 -4.181 -7.593 1.00 0.35 H new ATOM 0 HA ALA A 195 -2.382 -5.098 -10.113 1.00 0.40 H new ATOM 0 HB1 ALA A 195 -0.457 -5.857 -8.772 1.00 0.42 H new ATOM 0 HB2 ALA A 195 -0.928 -4.190 -8.364 1.00 0.42 H new ATOM 0 HB3 ALA A 195 -1.373 -5.530 -7.281 1.00 0.42 H new ATOM 1176 N LEU A 196 -3.692 -7.303 -8.076 1.00 0.41 N ATOM 1177 CA LEU A 196 -4.175 -8.676 -7.983 1.00 0.44 C ATOM 1178 C LEU A 196 -5.131 -9.007 -9.127 1.00 0.46 C ATOM 1179 O LEU A 196 -5.156 -10.137 -9.611 1.00 0.52 O ATOM 1180 CB LEU A 196 -4.860 -8.939 -6.631 1.00 0.45 C ATOM 1181 CG LEU A 196 -4.003 -9.649 -5.588 1.00 0.50 C ATOM 1182 CD1 LEU A 196 -3.597 -11.010 -6.089 1.00 1.61 C ATOM 1183 CD2 LEU A 196 -2.773 -8.856 -5.230 1.00 0.99 C ATOM 0 H LEU A 196 -3.972 -6.705 -7.298 1.00 0.41 H new ATOM 0 HA LEU A 196 -3.304 -9.327 -8.061 1.00 0.44 H new ATOM 0 HB2 LEU A 196 -5.188 -7.985 -6.218 1.00 0.45 H new ATOM 0 HB3 LEU A 196 -5.755 -9.535 -6.807 1.00 0.45 H new ATOM 0 HG LEU A 196 -4.609 -9.751 -4.688 1.00 0.50 H new ATOM 0 HD11 LEU A 196 -2.986 -11.507 -5.336 1.00 1.61 H new ATOM 0 HD12 LEU A 196 -4.488 -11.606 -6.285 1.00 1.61 H new ATOM 0 HD13 LEU A 196 -3.023 -10.903 -7.009 1.00 1.61 H new ATOM 0 HD21 LEU A 196 -2.193 -9.400 -4.484 1.00 0.99 H new ATOM 0 HD22 LEU A 196 -2.165 -8.704 -6.122 1.00 0.99 H new ATOM 0 HD23 LEU A 196 -3.069 -7.889 -4.824 1.00 0.99 H new ATOM 1195 N GLU A 197 -5.895 -8.017 -9.575 1.00 0.45 N ATOM 1196 CA GLU A 197 -6.827 -8.214 -10.679 1.00 0.52 C ATOM 1197 C GLU A 197 -6.162 -7.849 -12.008 1.00 0.56 C ATOM 1198 O GLU A 197 -6.830 -7.670 -13.027 1.00 0.65 O ATOM 1199 CB GLU A 197 -8.110 -7.403 -10.470 1.00 0.58 C ATOM 1200 CG GLU A 197 -7.885 -5.906 -10.381 1.00 1.02 C ATOM 1201 CD GLU A 197 -9.177 -5.121 -10.364 1.00 1.31 C ATOM 1202 OE1 GLU A 197 -9.946 -5.204 -11.345 1.00 1.72 O ATOM 1203 OE2 GLU A 197 -9.442 -4.429 -9.361 1.00 1.48 O ATOM 0 H GLU A 197 -5.887 -7.072 -9.192 1.00 0.45 H new ATOM 0 HA GLU A 197 -7.103 -9.268 -10.708 1.00 0.52 H new ATOM 0 HB2 GLU A 197 -8.796 -7.609 -11.292 1.00 0.58 H new ATOM 0 HB3 GLU A 197 -8.597 -7.742 -9.556 1.00 0.58 H new ATOM 0 HG2 GLU A 197 -7.316 -5.681 -9.479 1.00 1.02 H new ATOM 0 HG3 GLU A 197 -7.280 -5.583 -11.228 1.00 1.02 H new ATOM 1210 N LYS A 198 -4.834 -7.716 -11.958 1.00 0.56 N ATOM 1211 CA LYS A 198 -3.985 -7.569 -13.145 1.00 0.66 C ATOM 1212 C LYS A 198 -4.012 -6.162 -13.736 1.00 0.64 C ATOM 1213 O LYS A 198 -3.684 -5.969 -14.907 1.00 0.77 O ATOM 1214 CB LYS A 198 -4.340 -8.612 -14.214 1.00 0.86 C ATOM 1215 CG LYS A 198 -4.031 -10.047 -13.801 1.00 1.17 C ATOM 1216 CD LYS A 198 -2.624 -10.483 -14.207 1.00 1.63 C ATOM 1217 CE LYS A 198 -1.525 -9.664 -13.537 1.00 2.36 C ATOM 1218 NZ LYS A 198 -1.610 -9.698 -12.050 1.00 2.96 N ATOM 0 H LYS A 198 -4.311 -7.707 -11.082 1.00 0.56 H new ATOM 0 HA LYS A 198 -2.964 -7.744 -12.807 1.00 0.66 H new ATOM 0 HB2 LYS A 198 -5.402 -8.532 -14.448 1.00 0.86 H new ATOM 0 HB3 LYS A 198 -3.794 -8.381 -15.129 1.00 0.86 H new ATOM 0 HG2 LYS A 198 -4.140 -10.142 -12.721 1.00 1.17 H new ATOM 0 HG3 LYS A 198 -4.761 -10.717 -14.255 1.00 1.17 H new ATOM 0 HD2 LYS A 198 -2.489 -11.535 -13.955 1.00 1.63 H new ATOM 0 HD3 LYS A 198 -2.523 -10.399 -15.289 1.00 1.63 H new ATOM 0 HE2 LYS A 198 -0.552 -10.043 -13.850 1.00 2.36 H new ATOM 0 HE3 LYS A 198 -1.589 -8.630 -13.877 1.00 2.36 H new ATOM 0 HZ1 LYS A 198 -0.841 -9.126 -11.645 1.00 2.96 H new ATOM 0 HZ2 LYS A 198 -2.526 -9.311 -11.746 1.00 2.96 H new ATOM 0 HZ3 LYS A 198 -1.522 -10.680 -11.720 1.00 2.96 H new ATOM 1232 N GLU A 199 -4.386 -5.184 -12.929 1.00 0.61 N ATOM 1233 CA GLU A 199 -4.234 -3.790 -13.319 1.00 0.69 C ATOM 1234 C GLU A 199 -2.787 -3.362 -13.094 1.00 0.67 C ATOM 1235 O GLU A 199 -2.230 -3.577 -12.015 1.00 0.68 O ATOM 1236 CB GLU A 199 -5.172 -2.894 -12.512 1.00 0.73 C ATOM 1237 CG GLU A 199 -6.648 -3.204 -12.700 1.00 1.03 C ATOM 1238 CD GLU A 199 -7.145 -2.858 -14.085 1.00 1.13 C ATOM 1239 OE1 GLU A 199 -7.485 -1.678 -14.322 1.00 1.46 O ATOM 1240 OE2 GLU A 199 -7.219 -3.764 -14.937 1.00 1.31 O ATOM 0 H GLU A 199 -4.795 -5.326 -12.005 1.00 0.61 H new ATOM 0 HA GLU A 199 -4.491 -3.689 -14.373 1.00 0.69 H new ATOM 0 HB2 GLU A 199 -4.925 -2.988 -11.455 1.00 0.73 H new ATOM 0 HB3 GLU A 199 -4.992 -1.856 -12.790 1.00 0.73 H new ATOM 0 HG2 GLU A 199 -6.819 -4.264 -12.511 1.00 1.03 H new ATOM 0 HG3 GLU A 199 -7.228 -2.651 -11.961 1.00 1.03 H new ATOM 1247 N PRO A 200 -2.148 -2.780 -14.118 1.00 0.78 N ATOM 1248 CA PRO A 200 -0.754 -2.343 -14.038 1.00 0.81 C ATOM 1249 C PRO A 200 -0.572 -1.162 -13.091 1.00 0.76 C ATOM 1250 O PRO A 200 -1.402 -0.251 -13.056 1.00 0.77 O ATOM 1251 CB PRO A 200 -0.411 -1.924 -15.475 1.00 0.98 C ATOM 1252 CG PRO A 200 -1.524 -2.447 -16.320 1.00 1.04 C ATOM 1253 CD PRO A 200 -2.730 -2.502 -15.433 1.00 0.99 C ATOM 0 HA PRO A 200 -0.111 -3.132 -13.649 1.00 0.81 H new ATOM 0 HB2 PRO A 200 -0.331 -0.840 -15.559 1.00 0.98 H new ATOM 0 HB3 PRO A 200 0.547 -2.340 -15.787 1.00 0.98 H new ATOM 0 HG2 PRO A 200 -1.700 -1.798 -17.177 1.00 1.04 H new ATOM 0 HG3 PRO A 200 -1.284 -3.435 -16.713 1.00 1.04 H new ATOM 0 HD2 PRO A 200 -3.282 -1.562 -15.441 1.00 0.99 H new ATOM 0 HD3 PRO A 200 -3.425 -3.283 -15.742 1.00 0.99 H new ATOM 1261 N VAL A 201 0.520 -1.177 -12.338 1.00 0.75 N ATOM 1262 CA VAL A 201 0.813 -0.110 -11.392 1.00 0.75 C ATOM 1263 C VAL A 201 1.670 0.960 -12.064 1.00 0.75 C ATOM 1264 O VAL A 201 2.841 0.727 -12.365 1.00 0.80 O ATOM 1265 CB VAL A 201 1.541 -0.643 -10.138 1.00 0.78 C ATOM 1266 CG1 VAL A 201 1.790 0.481 -9.138 1.00 1.33 C ATOM 1267 CG2 VAL A 201 0.743 -1.768 -9.493 1.00 1.19 C ATOM 0 H VAL A 201 1.219 -1.919 -12.365 1.00 0.75 H new ATOM 0 HA VAL A 201 -0.136 0.321 -11.074 1.00 0.75 H new ATOM 0 HB VAL A 201 2.507 -1.041 -10.449 1.00 0.78 H new ATOM 0 HG11 VAL A 201 2.304 0.082 -8.263 1.00 1.33 H new ATOM 0 HG12 VAL A 201 2.407 1.251 -9.602 1.00 1.33 H new ATOM 0 HG13 VAL A 201 0.837 0.915 -8.833 1.00 1.33 H new ATOM 0 HG21 VAL A 201 1.272 -2.130 -8.611 1.00 1.19 H new ATOM 0 HG22 VAL A 201 -0.239 -1.396 -9.200 1.00 1.19 H new ATOM 0 HG23 VAL A 201 0.624 -2.584 -10.205 1.00 1.19 H new ATOM 1277 N PRO A 202 1.089 2.140 -12.317 1.00 0.74 N ATOM 1278 CA PRO A 202 1.779 3.236 -13.003 1.00 0.75 C ATOM 1279 C PRO A 202 2.789 3.953 -12.107 1.00 0.73 C ATOM 1280 O PRO A 202 2.888 3.680 -10.908 1.00 0.77 O ATOM 1281 CB PRO A 202 0.636 4.176 -13.388 1.00 0.78 C ATOM 1282 CG PRO A 202 -0.421 3.938 -12.364 1.00 0.97 C ATOM 1283 CD PRO A 202 -0.296 2.498 -11.951 1.00 0.77 C ATOM 0 HA PRO A 202 2.367 2.882 -13.849 1.00 0.75 H new ATOM 0 HB2 PRO A 202 0.962 5.216 -13.384 1.00 0.78 H new ATOM 0 HB3 PRO A 202 0.269 3.961 -14.392 1.00 0.78 H new ATOM 0 HG2 PRO A 202 -0.289 4.600 -11.508 1.00 0.97 H new ATOM 0 HG3 PRO A 202 -1.411 4.140 -12.773 1.00 0.97 H new ATOM 0 HD2 PRO A 202 -0.472 2.373 -10.883 1.00 0.77 H new ATOM 0 HD3 PRO A 202 -1.021 1.870 -12.469 1.00 0.77 H new ATOM 1291 N MET A 203 3.550 4.860 -12.707 1.00 0.72 N ATOM 1292 CA MET A 203 4.550 5.632 -11.981 1.00 0.75 C ATOM 1293 C MET A 203 3.940 6.908 -11.422 1.00 0.61 C ATOM 1294 O MET A 203 4.546 7.595 -10.602 1.00 0.63 O ATOM 1295 CB MET A 203 5.748 5.953 -12.877 1.00 0.95 C ATOM 1296 CG MET A 203 6.619 4.743 -13.175 1.00 1.56 C ATOM 1297 SD MET A 203 7.981 5.120 -14.294 1.00 1.88 S ATOM 1298 CE MET A 203 7.082 5.499 -15.796 1.00 2.05 C ATOM 0 H MET A 203 3.492 5.080 -13.701 1.00 0.72 H new ATOM 0 HA MET A 203 4.905 5.027 -11.146 1.00 0.75 H new ATOM 0 HB2 MET A 203 5.388 6.373 -13.816 1.00 0.95 H new ATOM 0 HB3 MET A 203 6.356 6.720 -12.397 1.00 0.95 H new ATOM 0 HG2 MET A 203 7.021 4.351 -12.240 1.00 1.56 H new ATOM 0 HG3 MET A 203 6.003 3.957 -13.612 1.00 1.56 H new ATOM 0 HE1 MET A 203 7.749 5.405 -16.653 1.00 2.05 H new ATOM 0 HE2 MET A 203 6.249 4.805 -15.906 1.00 2.05 H new ATOM 0 HE3 MET A 203 6.700 6.519 -15.744 1.00 2.05 H new ATOM 1308 N SER A 204 2.736 7.208 -11.874 1.00 0.54 N ATOM 1309 CA SER A 204 1.964 8.318 -11.347 1.00 0.52 C ATOM 1310 C SER A 204 0.710 7.766 -10.681 1.00 0.43 C ATOM 1311 O SER A 204 0.331 6.623 -10.934 1.00 0.52 O ATOM 1312 CB SER A 204 1.581 9.271 -12.483 1.00 0.67 C ATOM 1313 OG SER A 204 2.719 9.648 -13.240 1.00 1.30 O ATOM 0 H SER A 204 2.266 6.689 -12.616 1.00 0.54 H new ATOM 0 HA SER A 204 2.556 8.870 -10.617 1.00 0.52 H new ATOM 0 HB2 SER A 204 0.851 8.791 -13.134 1.00 0.67 H new ATOM 0 HB3 SER A 204 1.104 10.160 -12.070 1.00 0.67 H new ATOM 0 HG SER A 204 2.447 10.255 -13.960 1.00 1.30 H new ATOM 1319 N LEU A 205 0.070 8.548 -9.825 1.00 0.55 N ATOM 1320 CA LEU A 205 -1.180 8.104 -9.227 1.00 0.63 C ATOM 1321 C LEU A 205 -2.375 8.593 -10.014 1.00 0.56 C ATOM 1322 O LEU A 205 -2.433 9.746 -10.446 1.00 0.56 O ATOM 1323 CB LEU A 205 -1.308 8.455 -7.731 1.00 0.93 C ATOM 1324 CG LEU A 205 -0.537 9.671 -7.215 1.00 0.84 C ATOM 1325 CD1 LEU A 205 -0.838 10.899 -8.039 1.00 1.41 C ATOM 1326 CD2 LEU A 205 -0.895 9.922 -5.760 1.00 1.24 C ATOM 0 H LEU A 205 0.386 9.473 -9.533 1.00 0.55 H new ATOM 0 HA LEU A 205 -1.162 7.015 -9.276 1.00 0.63 H new ATOM 0 HB2 LEU A 205 -2.364 8.611 -7.513 1.00 0.93 H new ATOM 0 HB3 LEU A 205 -0.988 7.587 -7.155 1.00 0.93 H new ATOM 0 HG LEU A 205 0.529 9.462 -7.299 1.00 0.84 H new ATOM 0 HD11 LEU A 205 -0.275 11.747 -7.648 1.00 1.41 H new ATOM 0 HD12 LEU A 205 -0.552 10.721 -9.076 1.00 1.41 H new ATOM 0 HD13 LEU A 205 -1.905 11.118 -7.990 1.00 1.41 H new ATOM 0 HD21 LEU A 205 -0.345 10.789 -5.394 1.00 1.24 H new ATOM 0 HD22 LEU A 205 -1.965 10.110 -5.676 1.00 1.24 H new ATOM 0 HD23 LEU A 205 -0.632 9.048 -5.165 1.00 1.24 H new ATOM 1338 N PRO A 206 -3.340 7.687 -10.224 1.00 0.55 N ATOM 1339 CA PRO A 206 -4.566 7.987 -10.935 1.00 0.50 C ATOM 1340 C PRO A 206 -5.416 8.880 -10.066 1.00 0.45 C ATOM 1341 O PRO A 206 -5.840 8.487 -8.987 1.00 0.44 O ATOM 1342 CB PRO A 206 -5.231 6.614 -11.148 1.00 0.57 C ATOM 1343 CG PRO A 206 -4.208 5.609 -10.726 1.00 0.67 C ATOM 1344 CD PRO A 206 -3.345 6.313 -9.723 1.00 0.65 C ATOM 0 HA PRO A 206 -4.414 8.504 -11.883 1.00 0.50 H new ATOM 0 HB2 PRO A 206 -6.141 6.522 -10.555 1.00 0.57 H new ATOM 0 HB3 PRO A 206 -5.515 6.472 -12.191 1.00 0.57 H new ATOM 0 HG2 PRO A 206 -4.680 4.729 -10.289 1.00 0.67 H new ATOM 0 HG3 PRO A 206 -3.620 5.266 -11.577 1.00 0.67 H new ATOM 0 HD2 PRO A 206 -3.757 6.249 -8.716 1.00 0.65 H new ATOM 0 HD3 PRO A 206 -2.341 5.891 -9.684 1.00 0.65 H new ATOM 1352 N PRO A 207 -5.650 10.106 -10.506 1.00 0.44 N ATOM 1353 CA PRO A 207 -6.237 11.147 -9.665 1.00 0.39 C ATOM 1354 C PRO A 207 -7.669 10.824 -9.257 1.00 0.38 C ATOM 1355 O PRO A 207 -8.241 11.466 -8.380 1.00 0.37 O ATOM 1356 CB PRO A 207 -6.160 12.395 -10.549 1.00 0.41 C ATOM 1357 CG PRO A 207 -5.144 12.040 -11.579 1.00 0.45 C ATOM 1358 CD PRO A 207 -5.365 10.596 -11.851 1.00 0.49 C ATOM 0 HA PRO A 207 -5.714 11.264 -8.716 1.00 0.39 H new ATOM 0 HB2 PRO A 207 -7.125 12.625 -11.001 1.00 0.41 H new ATOM 0 HB3 PRO A 207 -5.859 13.273 -9.977 1.00 0.41 H new ATOM 0 HG2 PRO A 207 -5.272 12.636 -12.482 1.00 0.45 H new ATOM 0 HG3 PRO A 207 -4.133 12.224 -11.216 1.00 0.45 H new ATOM 0 HD2 PRO A 207 -6.195 10.427 -12.537 1.00 0.49 H new ATOM 0 HD3 PRO A 207 -4.488 10.119 -12.288 1.00 0.49 H new ATOM 1366 N ALA A 208 -8.235 9.815 -9.903 1.00 0.40 N ATOM 1367 CA ALA A 208 -9.490 9.229 -9.463 1.00 0.40 C ATOM 1368 C ALA A 208 -9.350 8.658 -8.061 1.00 0.37 C ATOM 1369 O ALA A 208 -10.331 8.477 -7.376 1.00 0.38 O ATOM 1370 CB ALA A 208 -9.941 8.151 -10.437 1.00 0.47 C ATOM 0 H ALA A 208 -7.841 9.384 -10.739 1.00 0.40 H new ATOM 0 HA ALA A 208 -10.248 10.012 -9.439 1.00 0.40 H new ATOM 0 HB1 ALA A 208 -10.882 7.721 -10.094 1.00 0.47 H new ATOM 0 HB2 ALA A 208 -10.081 8.589 -11.425 1.00 0.47 H new ATOM 0 HB3 ALA A 208 -9.184 7.369 -10.491 1.00 0.47 H new ATOM 1376 N LEU A 209 -8.128 8.380 -7.629 1.00 0.36 N ATOM 1377 CA LEU A 209 -7.916 7.849 -6.288 1.00 0.36 C ATOM 1378 C LEU A 209 -6.951 8.696 -5.485 1.00 0.36 C ATOM 1379 O LEU A 209 -6.450 8.258 -4.452 1.00 0.40 O ATOM 1380 CB LEU A 209 -7.489 6.377 -6.290 1.00 0.39 C ATOM 1381 CG LEU A 209 -6.698 5.898 -7.482 1.00 0.41 C ATOM 1382 CD1 LEU A 209 -5.227 6.051 -7.185 1.00 0.47 C ATOM 1383 CD2 LEU A 209 -7.028 4.451 -7.796 1.00 0.59 C ATOM 0 H LEU A 209 -7.278 8.511 -8.178 1.00 0.36 H new ATOM 0 HA LEU A 209 -8.887 7.895 -5.795 1.00 0.36 H new ATOM 0 HB2 LEU A 209 -6.896 6.194 -5.394 1.00 0.39 H new ATOM 0 HB3 LEU A 209 -8.386 5.763 -6.209 1.00 0.39 H new ATOM 0 HG LEU A 209 -6.959 6.497 -8.355 1.00 0.41 H new ATOM 0 HD11 LEU A 209 -4.645 5.707 -8.040 1.00 0.47 H new ATOM 0 HD12 LEU A 209 -5.002 7.100 -6.991 1.00 0.47 H new ATOM 0 HD13 LEU A 209 -4.969 5.456 -6.309 1.00 0.47 H new ATOM 0 HD21 LEU A 209 -6.447 4.124 -8.659 1.00 0.59 H new ATOM 0 HD22 LEU A 209 -6.783 3.827 -6.936 1.00 0.59 H new ATOM 0 HD23 LEU A 209 -8.091 4.360 -8.019 1.00 0.59 H new ATOM 1395 N VAL A 210 -6.686 9.905 -5.944 1.00 0.35 N ATOM 1396 CA VAL A 210 -5.923 10.831 -5.137 1.00 0.39 C ATOM 1397 C VAL A 210 -6.894 11.553 -4.197 1.00 0.39 C ATOM 1398 O VAL A 210 -7.740 12.336 -4.632 1.00 0.44 O ATOM 1399 CB VAL A 210 -5.077 11.815 -5.996 1.00 0.46 C ATOM 1400 CG1 VAL A 210 -5.921 12.851 -6.721 1.00 0.80 C ATOM 1401 CG2 VAL A 210 -4.013 12.483 -5.144 1.00 0.87 C ATOM 0 H VAL A 210 -6.982 10.261 -6.853 1.00 0.35 H new ATOM 0 HA VAL A 210 -5.189 10.281 -4.547 1.00 0.39 H new ATOM 0 HB VAL A 210 -4.593 11.220 -6.770 1.00 0.46 H new ATOM 0 HG11 VAL A 210 -5.272 13.507 -7.302 1.00 0.80 H new ATOM 0 HG12 VAL A 210 -6.620 12.348 -7.389 1.00 0.80 H new ATOM 0 HG13 VAL A 210 -6.476 13.442 -5.993 1.00 0.80 H new ATOM 0 HG21 VAL A 210 -3.430 13.168 -5.760 1.00 0.87 H new ATOM 0 HG22 VAL A 210 -4.489 13.038 -4.336 1.00 0.87 H new ATOM 0 HG23 VAL A 210 -3.354 11.724 -4.723 1.00 0.87 H new ATOM 1411 N PRO A 211 -6.830 11.219 -2.895 1.00 0.40 N ATOM 1412 CA PRO A 211 -7.810 11.659 -1.898 1.00 0.46 C ATOM 1413 C PRO A 211 -8.119 13.142 -1.978 1.00 0.51 C ATOM 1414 O PRO A 211 -7.249 13.977 -1.758 1.00 0.53 O ATOM 1415 CB PRO A 211 -7.134 11.324 -0.570 1.00 0.52 C ATOM 1416 CG PRO A 211 -6.261 10.165 -0.883 1.00 0.50 C ATOM 1417 CD PRO A 211 -5.780 10.382 -2.291 1.00 0.42 C ATOM 0 HA PRO A 211 -8.774 11.172 -2.043 1.00 0.46 H new ATOM 0 HB2 PRO A 211 -6.555 12.168 -0.195 1.00 0.52 H new ATOM 0 HB3 PRO A 211 -7.867 11.074 0.197 1.00 0.52 H new ATOM 0 HG2 PRO A 211 -5.423 10.108 -0.188 1.00 0.50 H new ATOM 0 HG3 PRO A 211 -6.810 9.227 -0.798 1.00 0.50 H new ATOM 0 HD2 PRO A 211 -4.811 10.880 -2.310 1.00 0.42 H new ATOM 0 HD3 PRO A 211 -5.664 9.438 -2.824 1.00 0.42 H new ATOM 1425 N PRO A 212 -9.370 13.473 -2.341 1.00 0.55 N ATOM 1426 CA PRO A 212 -9.871 14.851 -2.362 1.00 0.63 C ATOM 1427 C PRO A 212 -9.513 15.648 -1.100 1.00 0.72 C ATOM 1428 O PRO A 212 -9.341 16.864 -1.161 1.00 0.76 O ATOM 1429 CB PRO A 212 -11.384 14.667 -2.464 1.00 0.72 C ATOM 1430 CG PRO A 212 -11.569 13.367 -3.174 1.00 0.65 C ATOM 1431 CD PRO A 212 -10.382 12.509 -2.817 1.00 0.54 C ATOM 0 HA PRO A 212 -9.431 15.424 -3.178 1.00 0.63 H new ATOM 0 HB2 PRO A 212 -11.846 14.647 -1.477 1.00 0.72 H new ATOM 0 HB3 PRO A 212 -11.845 15.487 -3.015 1.00 0.72 H new ATOM 0 HG2 PRO A 212 -12.499 12.888 -2.869 1.00 0.65 H new ATOM 0 HG3 PRO A 212 -11.627 13.519 -4.252 1.00 0.65 H new ATOM 0 HD2 PRO A 212 -10.634 11.782 -2.045 1.00 0.54 H new ATOM 0 HD3 PRO A 212 -10.023 11.947 -3.679 1.00 0.54 H new ATOM 1603 N TRP B 309 14.057 4.596 -2.246 1.00 0.60 N ATOM 1604 CA TRP B 309 12.801 5.126 -1.741 1.00 0.57 C ATOM 1605 C TRP B 309 13.021 6.235 -0.730 1.00 0.68 C ATOM 1606 O TRP B 309 14.107 6.389 -0.173 1.00 0.85 O ATOM 1607 CB TRP B 309 11.939 4.018 -1.153 1.00 0.49 C ATOM 1608 CG TRP B 309 11.195 3.262 -2.195 1.00 0.44 C ATOM 1609 CD1 TRP B 309 10.095 3.667 -2.888 1.00 0.47 C ATOM 1610 CD2 TRP B 309 11.505 1.961 -2.655 1.00 0.44 C ATOM 1611 NE1 TRP B 309 9.709 2.682 -3.761 1.00 0.51 N ATOM 1612 CE2 TRP B 309 10.564 1.620 -3.633 1.00 0.49 C ATOM 1613 CE3 TRP B 309 12.496 1.056 -2.326 1.00 0.47 C ATOM 1614 CZ2 TRP B 309 10.592 0.396 -4.291 1.00 0.55 C ATOM 1615 CZ3 TRP B 309 12.532 -0.156 -2.970 1.00 0.52 C ATOM 1616 CH2 TRP B 309 11.584 -0.483 -3.946 1.00 0.56 C ATOM 0 HA TRP B 309 12.270 5.560 -2.588 1.00 0.57 H new ATOM 0 HB2 TRP B 309 12.571 3.330 -0.591 1.00 0.49 H new ATOM 0 HB3 TRP B 309 11.230 4.450 -0.446 1.00 0.49 H new ATOM 0 HD1 TRP B 309 9.601 4.620 -2.768 1.00 0.47 H new ATOM 0 HE1 TRP B 309 8.916 2.732 -4.400 1.00 0.51 H new ATOM 0 HE3 TRP B 309 13.232 1.299 -1.573 1.00 0.47 H new ATOM 0 HZ2 TRP B 309 9.860 0.148 -5.045 1.00 0.55 H new ATOM 0 HZ3 TRP B 309 13.304 -0.868 -2.719 1.00 0.52 H new ATOM 0 HH2 TRP B 309 11.635 -1.444 -4.435 1.00 0.56 H new ATOM 1627 N ARG B 310 11.952 6.978 -0.490 1.00 0.63 N ATOM 1628 CA ARG B 310 11.986 8.223 0.277 1.00 0.75 C ATOM 1629 C ARG B 310 12.139 8.022 1.788 1.00 0.72 C ATOM 1630 O ARG B 310 11.476 8.718 2.560 1.00 0.81 O ATOM 1631 CB ARG B 310 10.717 9.042 -0.004 1.00 0.85 C ATOM 1632 CG ARG B 310 9.589 8.265 -0.687 1.00 1.11 C ATOM 1633 CD ARG B 310 8.974 7.197 0.216 1.00 1.93 C ATOM 1634 NE ARG B 310 8.270 7.775 1.367 1.00 2.75 N ATOM 1635 CZ ARG B 310 6.937 7.870 1.470 1.00 3.55 C ATOM 1636 NH1 ARG B 310 6.157 7.443 0.487 1.00 3.86 N ATOM 1637 NH2 ARG B 310 6.392 8.400 2.559 1.00 4.35 N ATOM 0 H ARG B 310 11.020 6.733 -0.826 1.00 0.63 H new ATOM 0 HA ARG B 310 12.877 8.757 -0.055 1.00 0.75 H new ATOM 0 HB2 ARG B 310 10.344 9.443 0.939 1.00 0.85 H new ATOM 0 HB3 ARG B 310 10.983 9.894 -0.630 1.00 0.85 H new ATOM 0 HG2 ARG B 310 8.811 8.962 -0.999 1.00 1.11 H new ATOM 0 HG3 ARG B 310 9.975 7.792 -1.590 1.00 1.11 H new ATOM 0 HD2 ARG B 310 8.279 6.591 -0.365 1.00 1.93 H new ATOM 0 HD3 ARG B 310 9.759 6.530 0.571 1.00 1.93 H new ATOM 0 HE ARG B 310 8.833 8.128 2.141 1.00 2.75 H new ATOM 0 HH11 ARG B 310 6.571 7.039 -0.354 1.00 3.86 H new ATOM 0 HH12 ARG B 310 5.143 7.518 0.571 1.00 3.86 H new ATOM 0 HH21 ARG B 310 6.988 8.734 3.316 1.00 4.35 H new ATOM 0 HH22 ARG B 310 5.378 8.473 2.638 1.00 4.35 H new ATOM 1651 N ALA B 311 13.016 7.097 2.193 1.00 0.69 N ATOM 1652 CA ALA B 311 13.369 6.865 3.608 1.00 0.75 C ATOM 1653 C ALA B 311 12.205 6.306 4.437 1.00 0.84 C ATOM 1654 O ALA B 311 12.340 5.274 5.092 1.00 1.41 O ATOM 1655 CB ALA B 311 13.911 8.143 4.241 1.00 0.82 C ATOM 0 H ALA B 311 13.508 6.480 1.546 1.00 0.69 H new ATOM 0 HA ALA B 311 14.147 6.101 3.612 1.00 0.75 H new ATOM 0 HB1 ALA B 311 14.166 7.953 5.284 1.00 0.82 H new ATOM 0 HB2 ALA B 311 14.802 8.466 3.703 1.00 0.82 H new ATOM 0 HB3 ALA B 311 13.153 8.924 4.189 1.00 0.82 H new ATOM 1661 N THR B 312 11.069 6.985 4.399 1.00 0.50 N ATOM 1662 CA THR B 312 9.896 6.596 5.170 1.00 0.56 C ATOM 1663 C THR B 312 9.199 5.368 4.588 1.00 0.44 C ATOM 1664 O THR B 312 8.154 4.953 5.080 1.00 0.58 O ATOM 1665 CB THR B 312 8.899 7.767 5.265 1.00 0.72 C ATOM 1666 OG1 THR B 312 8.827 8.452 4.005 1.00 0.77 O ATOM 1667 CG2 THR B 312 9.310 8.748 6.352 1.00 0.95 C ATOM 0 H THR B 312 10.933 7.822 3.833 1.00 0.50 H new ATOM 0 HA THR B 312 10.247 6.334 6.168 1.00 0.56 H new ATOM 0 HB THR B 312 7.921 7.358 5.518 1.00 0.72 H new ATOM 0 HG1 THR B 312 8.615 9.397 4.158 1.00 0.77 H new ATOM 0 HG21 THR B 312 8.589 9.564 6.397 1.00 0.95 H new ATOM 0 HG22 THR B 312 9.338 8.235 7.313 1.00 0.95 H new ATOM 0 HG23 THR B 312 10.298 9.149 6.126 1.00 0.95 H new ATOM 1675 N ASN B 313 9.784 4.786 3.549 1.00 0.34 N ATOM 1676 CA ASN B 313 9.245 3.569 2.960 1.00 0.27 C ATOM 1677 C ASN B 313 9.748 2.342 3.717 1.00 0.28 C ATOM 1678 O ASN B 313 10.946 2.084 3.766 1.00 0.46 O ATOM 1679 CB ASN B 313 9.639 3.461 1.488 1.00 0.27 C ATOM 1680 CG ASN B 313 9.081 2.211 0.832 1.00 0.54 C ATOM 1681 OD1 ASN B 313 9.809 1.455 0.195 1.00 1.33 O ATOM 1682 ND2 ASN B 313 7.780 2.007 0.958 1.00 0.38 N ATOM 0 H ASN B 313 10.629 5.136 3.098 1.00 0.34 H new ATOM 0 HA ASN B 313 8.158 3.612 3.032 1.00 0.27 H new ATOM 0 HB2 ASN B 313 9.280 4.340 0.953 1.00 0.27 H new ATOM 0 HB3 ASN B 313 10.726 3.458 1.404 1.00 0.27 H new ATOM 0 HD21 ASN B 313 7.346 1.196 0.517 1.00 0.38 H new ATOM 0 HD22 ASN B 313 7.211 2.660 1.497 1.00 0.38 H new ATOM 1689 N PRO B 314 8.835 1.562 4.299 1.00 0.22 N ATOM 1690 CA PRO B 314 9.172 0.365 5.068 1.00 0.23 C ATOM 1691 C PRO B 314 9.310 -0.869 4.165 1.00 0.25 C ATOM 1692 O PRO B 314 8.965 -1.987 4.550 1.00 0.41 O ATOM 1693 CB PRO B 314 7.963 0.272 6.008 1.00 0.23 C ATOM 1694 CG PRO B 314 6.829 0.709 5.156 1.00 0.26 C ATOM 1695 CD PRO B 314 7.381 1.787 4.264 1.00 0.31 C ATOM 0 HA PRO B 314 10.130 0.412 5.585 1.00 0.23 H new ATOM 0 HB2 PRO B 314 7.819 -0.743 6.378 1.00 0.23 H new ATOM 0 HB3 PRO B 314 8.082 0.915 6.880 1.00 0.23 H new ATOM 0 HG2 PRO B 314 6.437 -0.122 4.569 1.00 0.26 H new ATOM 0 HG3 PRO B 314 6.006 1.086 5.763 1.00 0.26 H new ATOM 0 HD2 PRO B 314 6.988 1.707 3.250 1.00 0.31 H new ATOM 0 HD3 PRO B 314 7.121 2.780 4.629 1.00 0.31 H new ATOM 1703 N PHE B 315 9.813 -0.635 2.950 1.00 0.21 N ATOM 1704 CA PHE B 315 10.017 -1.698 1.960 1.00 0.22 C ATOM 1705 C PHE B 315 11.372 -1.563 1.287 1.00 0.26 C ATOM 1706 O PHE B 315 11.889 -2.521 0.714 1.00 0.30 O ATOM 1707 CB PHE B 315 8.945 -1.647 0.871 1.00 0.23 C ATOM 1708 CG PHE B 315 7.548 -1.908 1.342 1.00 0.20 C ATOM 1709 CD1 PHE B 315 6.749 -0.870 1.785 1.00 0.22 C ATOM 1710 CD2 PHE B 315 7.031 -3.188 1.323 1.00 0.23 C ATOM 1711 CE1 PHE B 315 5.458 -1.106 2.200 1.00 0.24 C ATOM 1712 CE2 PHE B 315 5.741 -3.431 1.739 1.00 0.24 C ATOM 1713 CZ PHE B 315 4.956 -2.388 2.177 1.00 0.23 C ATOM 0 H PHE B 315 10.089 0.292 2.625 1.00 0.21 H new ATOM 0 HA PHE B 315 9.959 -2.645 2.497 1.00 0.22 H new ATOM 0 HB2 PHE B 315 8.975 -0.665 0.399 1.00 0.23 H new ATOM 0 HB3 PHE B 315 9.195 -2.378 0.102 1.00 0.23 H new ATOM 0 HD1 PHE B 315 7.142 0.136 1.806 1.00 0.22 H new ATOM 0 HD2 PHE B 315 7.645 -4.007 0.978 1.00 0.23 H new ATOM 0 HE1 PHE B 315 4.841 -0.288 2.542 1.00 0.24 H new ATOM 0 HE2 PHE B 315 5.346 -4.436 1.722 1.00 0.24 H new ATOM 0 HZ PHE B 315 3.944 -2.576 2.503 1.00 0.23 H new ATOM 1723 N LEU B 316 11.941 -0.364 1.352 1.00 0.30 N ATOM 1724 CA LEU B 316 13.244 -0.097 0.752 1.00 0.39 C ATOM 1725 C LEU B 316 14.320 -0.936 1.432 1.00 0.46 C ATOM 1726 O LEU B 316 15.445 -1.055 0.952 1.00 0.59 O ATOM 1727 CB LEU B 316 13.565 1.406 0.821 1.00 0.43 C ATOM 1728 CG LEU B 316 13.513 2.042 2.210 1.00 0.57 C ATOM 1729 CD1 LEU B 316 14.810 1.826 2.966 1.00 0.81 C ATOM 1730 CD2 LEU B 316 13.207 3.525 2.101 1.00 0.56 C ATOM 0 H LEU B 316 11.519 0.441 1.815 1.00 0.30 H new ATOM 0 HA LEU B 316 13.219 -0.381 -0.300 1.00 0.39 H new ATOM 0 HB2 LEU B 316 14.562 1.563 0.409 1.00 0.43 H new ATOM 0 HB3 LEU B 316 12.866 1.936 0.175 1.00 0.43 H new ATOM 0 HG LEU B 316 12.714 1.556 2.770 1.00 0.57 H new ATOM 0 HD11 LEU B 316 14.740 2.291 3.950 1.00 0.81 H new ATOM 0 HD12 LEU B 316 14.990 0.757 3.082 1.00 0.81 H new ATOM 0 HD13 LEU B 316 15.634 2.275 2.411 1.00 0.81 H new ATOM 0 HD21 LEU B 316 13.173 3.964 3.098 1.00 0.56 H new ATOM 0 HD22 LEU B 316 13.985 4.015 1.515 1.00 0.56 H new ATOM 0 HD23 LEU B 316 12.243 3.663 1.611 1.00 0.56 H new ATOM 1742 N ASN B 317 13.937 -1.525 2.551 1.00 0.44 N ATOM 1743 CA ASN B 317 14.804 -2.386 3.325 1.00 0.53 C ATOM 1744 C ASN B 317 14.625 -3.858 2.930 1.00 0.66 C ATOM 1745 O ASN B 317 14.489 -4.728 3.789 1.00 1.00 O ATOM 1746 CB ASN B 317 14.515 -2.180 4.818 1.00 0.80 C ATOM 1747 CG ASN B 317 13.033 -2.251 5.150 1.00 0.89 C ATOM 1748 OD1 ASN B 317 12.332 -1.240 5.114 1.00 1.53 O ATOM 1749 ND2 ASN B 317 12.548 -3.438 5.474 1.00 1.44 N ATOM 0 H ASN B 317 13.004 -1.416 2.949 1.00 0.44 H new ATOM 0 HA ASN B 317 15.841 -2.123 3.118 1.00 0.53 H new ATOM 0 HB2 ASN B 317 15.048 -2.937 5.394 1.00 0.80 H new ATOM 0 HB3 ASN B 317 14.905 -1.211 5.128 1.00 0.80 H new ATOM 0 HD21 ASN B 317 11.560 -3.539 5.706 1.00 1.44 H new ATOM 0 HD22 ASN B 317 13.162 -4.252 5.492 1.00 1.44 H new ATOM 1866 N PRO B 325 5.172 -11.293 6.514 1.00 0.72 N ATOM 1867 CA PRO B 325 3.785 -11.189 6.048 1.00 0.63 C ATOM 1868 C PRO B 325 2.802 -11.045 7.207 1.00 0.59 C ATOM 1869 O PRO B 325 3.184 -11.144 8.373 1.00 0.97 O ATOM 1870 CB PRO B 325 3.549 -12.512 5.303 1.00 0.84 C ATOM 1871 CG PRO B 325 4.898 -13.145 5.182 1.00 1.20 C ATOM 1872 CD PRO B 325 5.684 -12.657 6.360 1.00 1.03 C ATOM 0 HA PRO B 325 3.629 -10.308 5.425 1.00 0.63 H new ATOM 0 HB2 PRO B 325 2.861 -13.155 5.852 1.00 0.84 H new ATOM 0 HB3 PRO B 325 3.108 -12.337 4.322 1.00 0.84 H new ATOM 0 HG2 PRO B 325 4.822 -14.232 5.186 1.00 1.20 H new ATOM 0 HG3 PRO B 325 5.380 -12.863 4.246 1.00 1.20 H new ATOM 0 HD2 PRO B 325 5.508 -13.263 7.249 1.00 1.03 H new ATOM 0 HD3 PRO B 325 6.757 -12.672 6.171 1.00 1.03 H new ATOM 1880 N SER B 326 1.541 -10.810 6.888 1.00 0.59 N ATOM 1881 CA SER B 326 0.533 -10.608 7.911 1.00 0.57 C ATOM 1882 C SER B 326 -0.574 -11.654 7.793 1.00 0.52 C ATOM 1883 O SER B 326 -0.935 -12.070 6.688 1.00 0.59 O ATOM 1884 CB SER B 326 -0.053 -9.204 7.786 1.00 0.74 C ATOM 1885 OG SER B 326 -0.977 -9.125 6.715 1.00 1.72 O ATOM 0 H SER B 326 1.193 -10.755 5.931 1.00 0.59 H new ATOM 0 HA SER B 326 1.001 -10.716 8.889 1.00 0.57 H new ATOM 0 HB2 SER B 326 -0.549 -8.930 8.717 1.00 0.74 H new ATOM 0 HB3 SER B 326 0.751 -8.485 7.629 1.00 0.74 H new ATOM 0 HG SER B 326 -0.550 -8.694 5.945 1.00 1.72 H new ATOM 1891 N PRO B 327 -1.115 -12.116 8.932 1.00 0.59 N ATOM 1892 CA PRO B 327 -2.317 -12.950 8.961 1.00 0.67 C ATOM 1893 C PRO B 327 -3.567 -12.086 8.814 1.00 0.62 C ATOM 1894 O PRO B 327 -4.659 -12.451 9.243 1.00 0.83 O ATOM 1895 CB PRO B 327 -2.277 -13.611 10.349 1.00 0.85 C ATOM 1896 CG PRO B 327 -1.009 -13.147 10.999 1.00 0.90 C ATOM 1897 CD PRO B 327 -0.591 -11.895 10.282 1.00 0.73 C ATOM 0 HA PRO B 327 -2.347 -13.678 8.150 1.00 0.67 H new ATOM 0 HB2 PRO B 327 -3.146 -13.324 10.942 1.00 0.85 H new ATOM 0 HB3 PRO B 327 -2.295 -14.697 10.263 1.00 0.85 H new ATOM 0 HG2 PRO B 327 -1.167 -12.952 12.060 1.00 0.90 H new ATOM 0 HG3 PRO B 327 -0.235 -13.911 10.927 1.00 0.90 H new ATOM 0 HD2 PRO B 327 -1.016 -11.003 10.742 1.00 0.73 H new ATOM 0 HD3 PRO B 327 0.492 -11.769 10.282 1.00 0.73 H new ATOM 1905 N ILE B 328 -3.372 -10.932 8.192 1.00 0.44 N ATOM 1906 CA ILE B 328 -4.395 -9.911 8.058 1.00 0.43 C ATOM 1907 C ILE B 328 -4.751 -9.744 6.591 1.00 0.46 C ATOM 1908 O ILE B 328 -5.458 -8.815 6.197 1.00 0.69 O ATOM 1909 CB ILE B 328 -3.863 -8.575 8.616 1.00 0.37 C ATOM 1910 CG1 ILE B 328 -3.159 -8.818 9.950 1.00 0.40 C ATOM 1911 CG2 ILE B 328 -4.984 -7.561 8.796 1.00 0.40 C ATOM 1912 CD1 ILE B 328 -2.098 -7.793 10.248 1.00 0.32 C ATOM 0 H ILE B 328 -2.484 -10.677 7.760 1.00 0.44 H new ATOM 0 HA ILE B 328 -5.283 -10.208 8.616 1.00 0.43 H new ATOM 0 HB ILE B 328 -3.154 -8.165 7.897 1.00 0.37 H new ATOM 0 HG12 ILE B 328 -3.898 -8.812 10.751 1.00 0.40 H new ATOM 0 HG13 ILE B 328 -2.707 -9.810 9.941 1.00 0.40 H new ATOM 0 HG21 ILE B 328 -4.574 -6.631 9.191 1.00 0.40 H new ATOM 0 HG22 ILE B 328 -5.459 -7.369 7.834 1.00 0.40 H new ATOM 0 HG23 ILE B 328 -5.723 -7.956 9.493 1.00 0.40 H new ATOM 0 HD11 ILE B 328 -1.634 -8.018 11.208 1.00 0.32 H new ATOM 0 HD12 ILE B 328 -1.341 -7.815 9.465 1.00 0.32 H new ATOM 0 HD13 ILE B 328 -2.550 -6.802 10.288 1.00 0.32 H new ATOM 1924 N ASN B 329 -4.287 -10.680 5.789 1.00 0.45 N ATOM 1925 CA ASN B 329 -4.309 -10.503 4.356 1.00 0.43 C ATOM 1926 C ASN B 329 -5.604 -10.998 3.716 1.00 0.35 C ATOM 1927 O ASN B 329 -6.025 -12.143 3.882 1.00 0.38 O ATOM 1928 CB ASN B 329 -3.080 -11.143 3.717 1.00 0.54 C ATOM 1929 CG ASN B 329 -3.124 -12.656 3.659 1.00 0.65 C ATOM 1930 OD1 ASN B 329 -3.682 -13.246 2.733 1.00 1.21 O ATOM 1931 ND2 ASN B 329 -2.495 -13.290 4.634 1.00 0.81 N ATOM 0 H ASN B 329 -3.892 -11.566 6.105 1.00 0.45 H new ATOM 0 HA ASN B 329 -4.275 -9.430 4.165 1.00 0.43 H new ATOM 0 HB2 ASN B 329 -2.968 -10.755 2.704 1.00 0.54 H new ATOM 0 HB3 ASN B 329 -2.195 -10.838 4.275 1.00 0.54 H new ATOM 0 HD21 ASN B 329 -2.458 -14.309 4.639 1.00 0.81 H new ATOM 0 HD22 ASN B 329 -2.047 -12.760 5.381 1.00 0.81 H new ATOM 1938 N PRO B 330 -6.270 -10.078 3.014 1.00 0.38 N ATOM 1939 CA PRO B 330 -7.498 -10.340 2.250 1.00 0.39 C ATOM 1940 C PRO B 330 -7.251 -10.949 0.858 1.00 0.43 C ATOM 1941 O PRO B 330 -8.156 -10.980 0.023 1.00 0.57 O ATOM 1942 CB PRO B 330 -8.080 -8.934 2.094 1.00 0.42 C ATOM 1943 CG PRO B 330 -6.890 -8.052 2.043 1.00 0.49 C ATOM 1944 CD PRO B 330 -5.894 -8.658 2.972 1.00 0.54 C ATOM 0 HA PRO B 330 -8.135 -11.067 2.754 1.00 0.39 H new ATOM 0 HB2 PRO B 330 -8.678 -8.849 1.187 1.00 0.42 H new ATOM 0 HB3 PRO B 330 -8.731 -8.677 2.930 1.00 0.42 H new ATOM 0 HG2 PRO B 330 -6.492 -7.990 1.030 1.00 0.49 H new ATOM 0 HG3 PRO B 330 -7.143 -7.037 2.349 1.00 0.49 H new ATOM 0 HD2 PRO B 330 -4.875 -8.525 2.608 1.00 0.54 H new ATOM 0 HD3 PRO B 330 -5.941 -8.203 3.961 1.00 0.54 H new ATOM 1952 N PHE B 331 -6.029 -11.409 0.595 1.00 0.40 N ATOM 1953 CA PHE B 331 -5.677 -11.943 -0.721 1.00 0.43 C ATOM 1954 C PHE B 331 -5.453 -13.437 -0.660 1.00 0.52 C ATOM 1955 O PHE B 331 -4.926 -14.033 -1.591 1.00 0.60 O ATOM 1956 CB PHE B 331 -4.432 -11.242 -1.244 1.00 0.39 C ATOM 1957 CG PHE B 331 -4.677 -9.784 -1.378 1.00 0.36 C ATOM 1958 CD1 PHE B 331 -4.614 -8.972 -0.277 1.00 0.64 C ATOM 1959 CD2 PHE B 331 -5.033 -9.242 -2.585 1.00 0.77 C ATOM 1960 CE1 PHE B 331 -4.902 -7.642 -0.372 1.00 0.67 C ATOM 1961 CE2 PHE B 331 -5.315 -7.908 -2.696 1.00 0.78 C ATOM 1962 CZ PHE B 331 -5.255 -7.104 -1.582 1.00 0.42 C ATOM 0 H PHE B 331 -5.267 -11.423 1.273 1.00 0.40 H new ATOM 0 HA PHE B 331 -6.507 -11.757 -1.403 1.00 0.43 H new ATOM 0 HB2 PHE B 331 -3.597 -11.416 -0.566 1.00 0.39 H new ATOM 0 HB3 PHE B 331 -4.150 -11.660 -2.210 1.00 0.39 H new ATOM 0 HD1 PHE B 331 -4.333 -9.390 0.678 1.00 0.64 H new ATOM 0 HD2 PHE B 331 -5.092 -9.875 -3.458 1.00 0.77 H new ATOM 0 HE1 PHE B 331 -4.852 -7.014 0.505 1.00 0.67 H new ATOM 0 HE2 PHE B 331 -5.584 -7.488 -3.654 1.00 0.78 H new ATOM 0 HZ PHE B 331 -5.485 -6.052 -1.660 1.00 0.42 H new ATOM 1972 N SER B 332 -5.872 -14.032 0.441 1.00 0.56 N ATOM 1973 CA SER B 332 -5.713 -15.471 0.656 1.00 0.68 C ATOM 1974 C SER B 332 -6.311 -16.281 -0.512 1.00 0.76 C ATOM 1975 O SER B 332 -5.766 -17.314 -0.909 1.00 0.83 O ATOM 1976 CB SER B 332 -6.365 -15.880 1.982 1.00 0.73 C ATOM 1977 OG SER B 332 -6.060 -17.224 2.326 1.00 1.51 O ATOM 0 H SER B 332 -6.329 -13.542 1.210 1.00 0.56 H new ATOM 0 HA SER B 332 -4.647 -15.692 0.702 1.00 0.68 H new ATOM 0 HB2 SER B 332 -6.024 -15.215 2.775 1.00 0.73 H new ATOM 0 HB3 SER B 332 -7.446 -15.760 1.908 1.00 0.73 H new ATOM 0 HG SER B 332 -6.491 -17.450 3.177 1.00 1.51 H new