USER MOD reduce.3.24.130724 H: found=0, std=0, add=619, rem=0, adj=10 USER MOD reduce.3.24.130724 removed 617 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 120 HIS : no HD1:sc= -0.308 K(o=0.55,f=-2.8!) USER MOD Set 1.2: A 189 ASN : amide:sc= 0.861 K(o=0.55,f=-1) USER MOD Set 2.1: A 175 LYS NZ :NH3+ 159:sc= 0.556 (180deg=0) USER MOD Set 2.2: A 179 THR OG1 : rot -170:sc= 0.273 USER MOD Set 3.1: A 142 LYS NZ :NH3+ -177:sc= 0.858 (180deg=-0.043) USER MOD Set 3.2: A 166 SER OG : rot 106:sc= 0.773 USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 122 SER OG : rot 180:sc= 0 USER MOD Single : A 123 ASN : amide:sc= 0.869 K(o=0.87,f=-0.078) USER MOD Single : A 135 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 136 MET CE :methyl -161:sc= -2.15 (180deg=-3.92!) USER MOD Single : A 139 GLN : amide:sc= 0.938 K(o=0.94,f=0) USER MOD Single : A 151 ASN : amide:sc= 0.385 K(o=0.39,f=-1.4) USER MOD Single : A 155 SER OG : rot 180:sc= 0.626 USER MOD Single : A 156 LYS NZ :NH3+ -169:sc= 0 (180deg=-0.00154) USER MOD Single : A 162 THR OG1 : rot 180:sc= 0 USER MOD Single : A 165 ASN : amide:sc= -0.0119 X(o=-0.012,f=-0.0077) USER MOD Single : A 177 HIS : no HD1:sc= -1.49 K(o=-1.5,f=-2.2!) USER MOD Single : A 185 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 190 ASN : amide:sc= 1.13 K(o=1.1,f=-0.022) USER MOD Single : A 192 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 108 N PRO A 116 -4.788 17.498 -7.964 1.00 0.00 N ATOM 109 CA PRO A 116 -4.666 16.179 -7.321 1.00 0.00 C ATOM 110 C PRO A 116 -4.255 16.213 -5.837 1.00 0.00 C ATOM 111 O PRO A 116 -3.297 16.886 -5.447 1.00 0.00 O ATOM 112 CB PRO A 116 -3.655 15.395 -8.163 1.00 0.00 C ATOM 113 CG PRO A 116 -3.868 15.980 -9.553 1.00 0.00 C ATOM 114 CD PRO A 116 -4.118 17.456 -9.259 1.00 0.00 C ATOM 0 HA PRO A 116 -5.648 15.707 -7.294 1.00 0.00 H new ATOM 0 HB2 PRO A 116 -2.633 15.541 -7.812 1.00 0.00 H new ATOM 0 HB3 PRO A 116 -3.850 14.323 -8.139 1.00 0.00 H new ATOM 0 HG2 PRO A 116 -2.996 15.836 -10.191 1.00 0.00 H new ATOM 0 HG3 PRO A 116 -4.715 15.519 -10.061 1.00 0.00 H new ATOM 0 HD2 PRO A 116 -3.181 18.013 -9.232 1.00 0.00 H new ATOM 0 HD3 PRO A 116 -4.737 17.909 -10.034 1.00 0.00 H new ATOM 122 N LYS A 117 -4.997 15.456 -5.019 1.00 0.00 N ATOM 123 CA LYS A 117 -4.873 15.218 -3.576 1.00 0.00 C ATOM 124 C LYS A 117 -5.762 14.020 -3.208 1.00 0.00 C ATOM 125 O LYS A 117 -6.317 13.373 -4.105 1.00 0.00 O ATOM 126 CB LYS A 117 -5.115 16.501 -2.761 1.00 0.00 C ATOM 127 CG LYS A 117 -6.471 17.193 -2.987 1.00 0.00 C ATOM 128 CD LYS A 117 -6.435 18.648 -2.495 1.00 0.00 C ATOM 129 CE LYS A 117 -5.589 19.523 -3.437 1.00 0.00 C ATOM 130 NZ LYS A 117 -4.750 20.497 -2.691 1.00 0.00 N ATOM 0 H LYS A 117 -5.789 14.936 -5.397 1.00 0.00 H new ATOM 0 HA LYS A 117 -3.851 14.949 -3.309 1.00 0.00 H new ATOM 0 HB2 LYS A 117 -5.024 16.259 -1.702 1.00 0.00 H new ATOM 0 HB3 LYS A 117 -4.322 17.212 -2.994 1.00 0.00 H new ATOM 0 HG2 LYS A 117 -6.723 17.170 -4.047 1.00 0.00 H new ATOM 0 HG3 LYS A 117 -7.254 16.647 -2.461 1.00 0.00 H new ATOM 0 HD2 LYS A 117 -7.449 19.043 -2.438 1.00 0.00 H new ATOM 0 HD3 LYS A 117 -6.021 18.686 -1.487 1.00 0.00 H new ATOM 0 HE2 LYS A 117 -4.949 18.885 -4.046 1.00 0.00 H new ATOM 0 HE3 LYS A 117 -6.247 20.060 -4.120 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 -4.197 21.065 -3.364 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 -5.361 21.123 -2.129 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 -4.104 19.985 -2.057 1.00 0.00 H new ATOM 144 N ARG A 118 -5.713 13.571 -1.956 1.00 0.00 N ATOM 145 CA ARG A 118 -5.358 12.158 -1.733 1.00 0.00 C ATOM 146 C ARG A 118 -6.420 11.272 -1.082 1.00 0.00 C ATOM 147 O ARG A 118 -7.475 11.728 -0.640 1.00 0.00 O ATOM 148 CB ARG A 118 -3.947 12.108 -1.124 1.00 0.00 C ATOM 149 CG ARG A 118 -3.808 12.781 0.245 1.00 0.00 C ATOM 150 CD ARG A 118 -2.330 12.802 0.654 1.00 0.00 C ATOM 151 NE ARG A 118 -2.104 13.703 1.795 1.00 0.00 N ATOM 152 CZ ARG A 118 -1.899 15.012 1.759 1.00 0.00 C ATOM 153 NH1 ARG A 118 -1.876 15.693 0.648 1.00 0.00 N ATOM 154 NH2 ARG A 118 -1.714 15.687 2.856 1.00 0.00 N ATOM 0 H ARG A 118 -5.901 14.122 -1.119 1.00 0.00 H new ATOM 0 HA ARG A 118 -5.332 11.658 -2.701 1.00 0.00 H new ATOM 0 HB2 ARG A 118 -3.644 11.065 -1.032 1.00 0.00 H new ATOM 0 HB3 ARG A 118 -3.252 12.581 -1.817 1.00 0.00 H new ATOM 0 HG2 ARG A 118 -4.200 13.797 0.205 1.00 0.00 H new ATOM 0 HG3 ARG A 118 -4.395 12.242 0.989 1.00 0.00 H new ATOM 0 HD2 ARG A 118 -2.008 11.794 0.915 1.00 0.00 H new ATOM 0 HD3 ARG A 118 -1.721 13.122 -0.191 1.00 0.00 H new ATOM 0 HE ARG A 118 -2.105 13.271 2.719 1.00 0.00 H new ATOM 0 HH11 ARG A 118 -2.020 15.219 -0.244 1.00 0.00 H new ATOM 0 HH12 ARG A 118 -1.715 16.700 0.670 1.00 0.00 H new ATOM 0 HH21 ARG A 118 -1.726 15.209 3.757 1.00 0.00 H new ATOM 0 HH22 ARG A 118 -1.557 16.694 2.815 1.00 0.00 H new ATOM 168 N LEU A 119 -6.148 9.971 -1.169 1.00 0.00 N ATOM 169 CA LEU A 119 -7.114 8.905 -1.408 1.00 0.00 C ATOM 170 C LEU A 119 -6.632 7.617 -0.720 1.00 0.00 C ATOM 171 O LEU A 119 -5.547 7.130 -1.030 1.00 0.00 O ATOM 172 CB LEU A 119 -7.199 8.759 -2.950 1.00 0.00 C ATOM 173 CG LEU A 119 -8.160 7.705 -3.507 1.00 0.00 C ATOM 174 CD1 LEU A 119 -9.576 7.937 -2.993 1.00 0.00 C ATOM 175 CD2 LEU A 119 -8.233 7.796 -5.027 1.00 0.00 C ATOM 0 H LEU A 119 -5.197 9.616 -1.069 1.00 0.00 H new ATOM 0 HA LEU A 119 -8.101 9.120 -0.998 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -7.483 9.726 -3.365 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -6.200 8.534 -3.322 1.00 0.00 H new ATOM 0 HG LEU A 119 -7.783 6.733 -3.187 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -10.241 7.176 -3.402 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -9.582 7.877 -1.905 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -9.919 8.924 -3.304 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -8.921 7.039 -5.404 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -8.588 8.785 -5.316 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -7.242 7.629 -5.450 1.00 0.00 H new ATOM 187 N HIS A 120 -7.398 7.094 0.242 1.00 0.00 N ATOM 188 CA HIS A 120 -7.135 5.842 0.972 1.00 0.00 C ATOM 189 C HIS A 120 -7.672 4.656 0.156 1.00 0.00 C ATOM 190 O HIS A 120 -8.702 4.755 -0.512 1.00 0.00 O ATOM 191 CB HIS A 120 -7.838 5.945 2.346 1.00 0.00 C ATOM 192 CG HIS A 120 -8.016 4.666 3.125 1.00 0.00 C ATOM 193 ND1 HIS A 120 -9.223 3.991 3.325 1.00 0.00 N ATOM 194 CD2 HIS A 120 -7.056 4.092 3.898 1.00 0.00 C ATOM 195 CE1 HIS A 120 -8.956 3.024 4.221 1.00 0.00 C ATOM 196 NE2 HIS A 120 -7.658 3.049 4.563 1.00 0.00 N ATOM 0 H HIS A 120 -8.257 7.549 0.550 1.00 0.00 H new ATOM 0 HA HIS A 120 -6.067 5.685 1.122 1.00 0.00 H new ATOM 0 HB2 HIS A 120 -7.272 6.641 2.964 1.00 0.00 H new ATOM 0 HB3 HIS A 120 -8.823 6.386 2.190 1.00 0.00 H new ATOM 0 HD2 HIS A 120 -6.022 4.396 3.975 1.00 0.00 H new ATOM 0 HE1 HIS A 120 -9.683 2.326 4.610 1.00 0.00 H new ATOM 0 HE2 HIS A 120 -7.197 2.405 5.206 1.00 0.00 H new ATOM 204 N VAL A 121 -6.956 3.533 0.179 1.00 0.00 N ATOM 205 CA VAL A 121 -7.104 2.446 -0.798 1.00 0.00 C ATOM 206 C VAL A 121 -7.117 1.113 -0.059 1.00 0.00 C ATOM 207 O VAL A 121 -6.073 0.489 0.113 1.00 0.00 O ATOM 208 CB VAL A 121 -5.976 2.531 -1.854 1.00 0.00 C ATOM 209 CG1 VAL A 121 -6.228 1.615 -3.045 1.00 0.00 C ATOM 210 CG2 VAL A 121 -5.813 3.931 -2.450 1.00 0.00 C ATOM 0 H VAL A 121 -6.245 3.346 0.886 1.00 0.00 H new ATOM 0 HA VAL A 121 -8.048 2.538 -1.335 1.00 0.00 H new ATOM 0 HB VAL A 121 -5.084 2.238 -1.300 1.00 0.00 H new ATOM 0 HG11 VAL A 121 -5.409 1.711 -3.758 1.00 0.00 H new ATOM 0 HG12 VAL A 121 -6.292 0.582 -2.703 1.00 0.00 H new ATOM 0 HG13 VAL A 121 -7.164 1.896 -3.528 1.00 0.00 H new ATOM 0 HG21 VAL A 121 -5.006 3.923 -3.183 1.00 0.00 H new ATOM 0 HG22 VAL A 121 -6.742 4.230 -2.936 1.00 0.00 H new ATOM 0 HG23 VAL A 121 -5.575 4.639 -1.656 1.00 0.00 H new ATOM 220 N SER A 122 -8.285 0.720 0.451 1.00 0.00 N ATOM 221 CA SER A 122 -8.450 -0.403 1.383 1.00 0.00 C ATOM 222 C SER A 122 -8.797 -1.732 0.709 1.00 0.00 C ATOM 223 O SER A 122 -9.196 -1.764 -0.454 1.00 0.00 O ATOM 224 CB SER A 122 -9.548 -0.087 2.406 1.00 0.00 C ATOM 225 OG SER A 122 -9.130 -0.543 3.681 1.00 0.00 O ATOM 0 H SER A 122 -9.165 1.183 0.224 1.00 0.00 H new ATOM 0 HA SER A 122 -7.478 -0.523 1.861 1.00 0.00 H new ATOM 0 HB2 SER A 122 -9.741 0.985 2.433 1.00 0.00 H new ATOM 0 HB3 SER A 122 -10.481 -0.571 2.119 1.00 0.00 H new ATOM 0 HG SER A 122 -9.824 -0.344 4.343 1.00 0.00 H new ATOM 231 N ASN A 123 -8.715 -2.827 1.471 1.00 0.00 N ATOM 232 CA ASN A 123 -9.123 -4.185 1.085 1.00 0.00 C ATOM 233 C ASN A 123 -8.483 -4.665 -0.232 1.00 0.00 C ATOM 234 O ASN A 123 -9.033 -5.495 -0.955 1.00 0.00 O ATOM 235 CB ASN A 123 -10.659 -4.280 1.122 1.00 0.00 C ATOM 236 CG ASN A 123 -11.160 -5.715 1.167 1.00 0.00 C ATOM 237 OD1 ASN A 123 -10.885 -6.459 2.099 1.00 0.00 O ATOM 238 ND2 ASN A 123 -11.921 -6.154 0.190 1.00 0.00 N ATOM 0 H ASN A 123 -8.344 -2.791 2.421 1.00 0.00 H new ATOM 0 HA ASN A 123 -8.731 -4.893 1.815 1.00 0.00 H new ATOM 0 HB2 ASN A 123 -11.031 -3.743 1.995 1.00 0.00 H new ATOM 0 HB3 ASN A 123 -11.070 -3.784 0.243 1.00 0.00 H new ATOM 0 HD21 ASN A 123 -12.278 -7.109 0.212 1.00 0.00 H new ATOM 0 HD22 ASN A 123 -12.154 -5.540 -0.590 1.00 0.00 H new ATOM 245 N ILE A 124 -7.294 -4.144 -0.534 1.00 0.00 N ATOM 246 CA ILE A 124 -6.410 -4.647 -1.586 1.00 0.00 C ATOM 247 C ILE A 124 -5.873 -6.027 -1.152 1.00 0.00 C ATOM 248 O ILE A 124 -5.902 -6.331 0.047 1.00 0.00 O ATOM 249 CB ILE A 124 -5.274 -3.629 -1.868 1.00 0.00 C ATOM 250 CG1 ILE A 124 -4.091 -3.810 -0.899 1.00 0.00 C ATOM 251 CG2 ILE A 124 -5.797 -2.181 -1.827 1.00 0.00 C ATOM 252 CD1 ILE A 124 -3.124 -2.636 -0.812 1.00 0.00 C ATOM 0 H ILE A 124 -6.908 -3.339 -0.041 1.00 0.00 H new ATOM 0 HA ILE A 124 -6.955 -4.768 -2.522 1.00 0.00 H new ATOM 0 HB ILE A 124 -4.909 -3.829 -2.875 1.00 0.00 H new ATOM 0 HG12 ILE A 124 -4.488 -4.005 0.097 1.00 0.00 H new ATOM 0 HG13 ILE A 124 -3.532 -4.696 -1.199 1.00 0.00 H new ATOM 0 HG21 ILE A 124 -4.977 -1.492 -2.028 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -6.572 -2.053 -2.582 1.00 0.00 H new ATOM 0 HG23 ILE A 124 -6.213 -1.972 -0.841 1.00 0.00 H new ATOM 0 HD11 ILE A 124 -2.331 -2.870 -0.102 1.00 0.00 H new ATOM 0 HD12 ILE A 124 -2.689 -2.449 -1.794 1.00 0.00 H new ATOM 0 HD13 ILE A 124 -3.660 -1.747 -0.478 1.00 0.00 H new ATOM 264 N PRO A 125 -5.363 -6.876 -2.057 1.00 0.00 N ATOM 265 CA PRO A 125 -4.725 -8.137 -1.671 1.00 0.00 C ATOM 266 C PRO A 125 -3.518 -7.931 -0.742 1.00 0.00 C ATOM 267 O PRO A 125 -2.838 -6.909 -0.805 1.00 0.00 O ATOM 268 CB PRO A 125 -4.268 -8.781 -2.986 1.00 0.00 C ATOM 269 CG PRO A 125 -5.113 -8.092 -4.051 1.00 0.00 C ATOM 270 CD PRO A 125 -5.345 -6.693 -3.496 1.00 0.00 C ATOM 0 HA PRO A 125 -5.425 -8.759 -1.113 1.00 0.00 H new ATOM 0 HB2 PRO A 125 -3.203 -8.623 -3.158 1.00 0.00 H new ATOM 0 HB3 PRO A 125 -4.434 -9.858 -2.981 1.00 0.00 H new ATOM 0 HG2 PRO A 125 -4.596 -8.059 -5.010 1.00 0.00 H new ATOM 0 HG3 PRO A 125 -6.054 -8.617 -4.214 1.00 0.00 H new ATOM 0 HD2 PRO A 125 -4.553 -6.008 -3.800 1.00 0.00 H new ATOM 0 HD3 PRO A 125 -6.285 -6.273 -3.855 1.00 0.00 H new ATOM 278 N PHE A 126 -3.154 -8.927 0.063 1.00 0.00 N ATOM 279 CA PHE A 126 -1.758 -9.020 0.508 1.00 0.00 C ATOM 280 C PHE A 126 -0.795 -9.331 -0.660 1.00 0.00 C ATOM 281 O PHE A 126 -1.226 -9.610 -1.780 1.00 0.00 O ATOM 282 CB PHE A 126 -1.611 -10.000 1.673 1.00 0.00 C ATOM 283 CG PHE A 126 -2.311 -9.605 2.961 1.00 0.00 C ATOM 284 CD1 PHE A 126 -2.366 -8.258 3.403 1.00 0.00 C ATOM 285 CD2 PHE A 126 -2.855 -10.627 3.764 1.00 0.00 C ATOM 286 CE1 PHE A 126 -3.016 -7.970 4.619 1.00 0.00 C ATOM 287 CE2 PHE A 126 -3.469 -10.328 4.990 1.00 0.00 C ATOM 288 CZ PHE A 126 -3.565 -8.992 5.407 1.00 0.00 C ATOM 0 H PHE A 126 -3.775 -9.657 0.412 1.00 0.00 H new ATOM 0 HA PHE A 126 -1.466 -8.039 0.882 1.00 0.00 H new ATOM 0 HB2 PHE A 126 -1.993 -10.971 1.357 1.00 0.00 H new ATOM 0 HB3 PHE A 126 -0.549 -10.128 1.883 1.00 0.00 H new ATOM 0 HD1 PHE A 126 -1.918 -7.468 2.818 1.00 0.00 H new ATOM 0 HD2 PHE A 126 -2.799 -11.653 3.432 1.00 0.00 H new ATOM 0 HE1 PHE A 126 -3.093 -6.945 4.950 1.00 0.00 H new ATOM 0 HE2 PHE A 126 -3.865 -11.121 5.608 1.00 0.00 H new ATOM 0 HZ PHE A 126 -4.062 -8.750 6.335 1.00 0.00 H new ATOM 298 N ARG A 127 0.524 -9.220 -0.421 1.00 0.00 N ATOM 299 CA ARG A 127 1.634 -9.200 -1.411 1.00 0.00 C ATOM 300 C ARG A 127 1.610 -8.014 -2.396 1.00 0.00 C ATOM 301 O ARG A 127 2.619 -7.754 -3.055 1.00 0.00 O ATOM 302 CB ARG A 127 1.745 -10.527 -2.198 1.00 0.00 C ATOM 303 CG ARG A 127 1.875 -11.827 -1.383 1.00 0.00 C ATOM 304 CD ARG A 127 0.545 -12.300 -0.774 1.00 0.00 C ATOM 305 NE ARG A 127 0.612 -13.710 -0.353 1.00 0.00 N ATOM 306 CZ ARG A 127 0.290 -14.781 -1.059 1.00 0.00 C ATOM 307 NH1 ARG A 127 -0.134 -14.695 -2.290 1.00 0.00 N ATOM 308 NH2 ARG A 127 0.388 -15.970 -0.539 1.00 0.00 N ATOM 0 H ARG A 127 0.875 -9.136 0.533 1.00 0.00 H new ATOM 0 HA ARG A 127 2.521 -9.069 -0.791 1.00 0.00 H new ATOM 0 HB2 ARG A 127 0.865 -10.615 -2.835 1.00 0.00 H new ATOM 0 HB3 ARG A 127 2.610 -10.456 -2.858 1.00 0.00 H new ATOM 0 HG2 ARG A 127 2.271 -12.613 -2.026 1.00 0.00 H new ATOM 0 HG3 ARG A 127 2.599 -11.675 -0.583 1.00 0.00 H new ATOM 0 HD2 ARG A 127 0.294 -11.675 0.083 1.00 0.00 H new ATOM 0 HD3 ARG A 127 -0.255 -12.175 -1.504 1.00 0.00 H new ATOM 0 HE ARG A 127 0.946 -13.881 0.595 1.00 0.00 H new ATOM 0 HH11 ARG A 127 -0.225 -13.782 -2.735 1.00 0.00 H new ATOM 0 HH12 ARG A 127 -0.374 -15.541 -2.807 1.00 0.00 H new ATOM 0 HH21 ARG A 127 0.715 -16.082 0.421 1.00 0.00 H new ATOM 0 HH22 ARG A 127 0.137 -16.790 -1.091 1.00 0.00 H new ATOM 322 N PHE A 128 0.489 -7.297 -2.490 1.00 0.00 N ATOM 323 CA PHE A 128 0.249 -6.156 -3.376 1.00 0.00 C ATOM 324 C PHE A 128 1.134 -4.938 -3.055 1.00 0.00 C ATOM 325 O PHE A 128 1.643 -4.806 -1.935 1.00 0.00 O ATOM 326 CB PHE A 128 -1.244 -5.810 -3.301 1.00 0.00 C ATOM 327 CG PHE A 128 -1.812 -5.331 -4.607 1.00 0.00 C ATOM 328 CD1 PHE A 128 -2.137 -6.281 -5.592 1.00 0.00 C ATOM 329 CD2 PHE A 128 -1.990 -3.960 -4.852 1.00 0.00 C ATOM 330 CE1 PHE A 128 -2.635 -5.863 -6.835 1.00 0.00 C ATOM 331 CE2 PHE A 128 -2.479 -3.543 -6.100 1.00 0.00 C ATOM 332 CZ PHE A 128 -2.795 -4.491 -7.089 1.00 0.00 C ATOM 0 H PHE A 128 -0.326 -7.510 -1.914 1.00 0.00 H new ATOM 0 HA PHE A 128 0.525 -6.436 -4.393 1.00 0.00 H new ATOM 0 HB2 PHE A 128 -1.797 -6.690 -2.974 1.00 0.00 H new ATOM 0 HB3 PHE A 128 -1.393 -5.040 -2.544 1.00 0.00 H new ATOM 0 HD1 PHE A 128 -2.003 -7.334 -5.391 1.00 0.00 H new ATOM 0 HD2 PHE A 128 -1.753 -3.234 -4.088 1.00 0.00 H new ATOM 0 HE1 PHE A 128 -2.893 -6.590 -7.590 1.00 0.00 H new ATOM 0 HE2 PHE A 128 -2.613 -2.490 -6.301 1.00 0.00 H new ATOM 0 HZ PHE A 128 -3.163 -4.162 -8.050 1.00 0.00 H new ATOM 342 N ARG A 129 1.346 -4.060 -4.049 1.00 0.00 N ATOM 343 CA ARG A 129 2.470 -3.101 -4.060 1.00 0.00 C ATOM 344 C ARG A 129 2.117 -1.707 -4.592 1.00 0.00 C ATOM 345 O ARG A 129 1.164 -1.500 -5.343 1.00 0.00 O ATOM 346 CB ARG A 129 3.666 -3.708 -4.824 1.00 0.00 C ATOM 347 CG ARG A 129 3.999 -5.154 -4.434 1.00 0.00 C ATOM 348 CD ARG A 129 5.326 -5.600 -5.037 1.00 0.00 C ATOM 349 NE ARG A 129 5.531 -7.048 -4.834 1.00 0.00 N ATOM 350 CZ ARG A 129 6.533 -7.785 -5.276 1.00 0.00 C ATOM 351 NH1 ARG A 129 7.514 -7.280 -5.967 1.00 0.00 N ATOM 352 NH2 ARG A 129 6.574 -9.062 -5.023 1.00 0.00 N ATOM 0 H ARG A 129 0.744 -3.993 -4.870 1.00 0.00 H new ATOM 0 HA ARG A 129 2.740 -2.935 -3.017 1.00 0.00 H new ATOM 0 HB2 ARG A 129 3.455 -3.672 -5.893 1.00 0.00 H new ATOM 0 HB3 ARG A 129 4.545 -3.087 -4.652 1.00 0.00 H new ATOM 0 HG2 ARG A 129 4.044 -5.239 -3.348 1.00 0.00 H new ATOM 0 HG3 ARG A 129 3.203 -5.817 -4.773 1.00 0.00 H new ATOM 0 HD2 ARG A 129 5.342 -5.371 -6.103 1.00 0.00 H new ATOM 0 HD3 ARG A 129 6.144 -5.044 -4.579 1.00 0.00 H new ATOM 0 HE ARG A 129 4.818 -7.534 -4.291 1.00 0.00 H new ATOM 0 HH11 ARG A 129 7.525 -6.283 -6.184 1.00 0.00 H new ATOM 0 HH12 ARG A 129 8.271 -7.881 -6.292 1.00 0.00 H new ATOM 0 HH21 ARG A 129 5.829 -9.499 -4.480 1.00 0.00 H new ATOM 0 HH22 ARG A 129 7.351 -9.625 -5.368 1.00 0.00 H new ATOM 366 N ASP A 130 2.985 -0.770 -4.225 1.00 0.00 N ATOM 367 CA ASP A 130 3.047 0.626 -4.670 1.00 0.00 C ATOM 368 C ASP A 130 3.033 0.785 -6.213 1.00 0.00 C ATOM 369 O ASP A 130 2.142 1.473 -6.726 1.00 0.00 O ATOM 370 CB ASP A 130 4.286 1.244 -3.997 1.00 0.00 C ATOM 371 CG ASP A 130 4.611 2.680 -4.430 1.00 0.00 C ATOM 372 OD1 ASP A 130 5.023 2.883 -5.598 1.00 0.00 O ATOM 373 OD2 ASP A 130 4.517 3.589 -3.572 1.00 0.00 O ATOM 0 H ASP A 130 3.725 -0.980 -3.555 1.00 0.00 H new ATOM 0 HA ASP A 130 2.147 1.161 -4.367 1.00 0.00 H new ATOM 0 HB2 ASP A 130 4.139 1.231 -2.917 1.00 0.00 H new ATOM 0 HB3 ASP A 130 5.149 0.613 -4.209 1.00 0.00 H new ATOM 378 N PRO A 131 3.940 0.134 -6.979 1.00 0.00 N ATOM 379 CA PRO A 131 3.934 0.220 -8.440 1.00 0.00 C ATOM 380 C PRO A 131 2.678 -0.414 -9.052 1.00 0.00 C ATOM 381 O PRO A 131 2.182 0.058 -10.077 1.00 0.00 O ATOM 382 CB PRO A 131 5.217 -0.469 -8.913 1.00 0.00 C ATOM 383 CG PRO A 131 5.542 -1.444 -7.786 1.00 0.00 C ATOM 384 CD PRO A 131 5.038 -0.718 -6.542 1.00 0.00 C ATOM 0 HA PRO A 131 3.908 1.259 -8.767 1.00 0.00 H new ATOM 0 HB2 PRO A 131 5.067 -0.988 -9.860 1.00 0.00 H new ATOM 0 HB3 PRO A 131 6.023 0.248 -9.067 1.00 0.00 H new ATOM 0 HG2 PRO A 131 5.040 -2.402 -7.925 1.00 0.00 H new ATOM 0 HG3 PRO A 131 6.611 -1.650 -7.727 1.00 0.00 H new ATOM 0 HD2 PRO A 131 4.701 -1.429 -5.787 1.00 0.00 H new ATOM 0 HD3 PRO A 131 5.833 -0.125 -6.089 1.00 0.00 H new ATOM 392 N ASP A 132 2.125 -1.443 -8.411 1.00 0.00 N ATOM 393 CA ASP A 132 0.879 -2.077 -8.832 1.00 0.00 C ATOM 394 C ASP A 132 -0.304 -1.102 -8.741 1.00 0.00 C ATOM 395 O ASP A 132 -1.035 -0.953 -9.723 1.00 0.00 O ATOM 396 CB ASP A 132 0.650 -3.378 -8.044 1.00 0.00 C ATOM 397 CG ASP A 132 0.108 -4.511 -8.935 1.00 0.00 C ATOM 398 OD1 ASP A 132 -0.829 -4.279 -9.734 1.00 0.00 O ATOM 399 OD2 ASP A 132 0.654 -5.638 -8.862 1.00 0.00 O ATOM 0 H ASP A 132 2.535 -1.863 -7.577 1.00 0.00 H new ATOM 0 HA ASP A 132 0.960 -2.350 -9.884 1.00 0.00 H new ATOM 0 HB2 ASP A 132 1.588 -3.694 -7.588 1.00 0.00 H new ATOM 0 HB3 ASP A 132 -0.052 -3.190 -7.232 1.00 0.00 H new ATOM 404 N LEU A 133 -0.463 -0.343 -7.638 1.00 0.00 N ATOM 405 CA LEU A 133 -1.454 0.718 -7.611 1.00 0.00 C ATOM 406 C LEU A 133 -1.176 1.839 -8.609 1.00 0.00 C ATOM 407 O LEU A 133 -2.112 2.243 -9.290 1.00 0.00 O ATOM 408 CB LEU A 133 -1.651 1.316 -6.213 1.00 0.00 C ATOM 409 CG LEU A 133 -2.315 0.388 -5.189 1.00 0.00 C ATOM 410 CD1 LEU A 133 -2.142 0.926 -3.767 1.00 0.00 C ATOM 411 CD2 LEU A 133 -3.810 0.364 -5.502 1.00 0.00 C ATOM 0 H LEU A 133 0.076 -0.451 -6.779 1.00 0.00 H new ATOM 0 HA LEU A 133 -2.378 0.224 -7.911 1.00 0.00 H new ATOM 0 HB2 LEU A 133 -0.678 1.620 -5.826 1.00 0.00 H new ATOM 0 HB3 LEU A 133 -2.254 2.219 -6.304 1.00 0.00 H new ATOM 0 HG LEU A 133 -1.861 -0.601 -5.248 1.00 0.00 H new ATOM 0 HD11 LEU A 133 -2.622 0.249 -3.061 1.00 0.00 H new ATOM 0 HD12 LEU A 133 -1.080 1.001 -3.533 1.00 0.00 H new ATOM 0 HD13 LEU A 133 -2.600 1.912 -3.693 1.00 0.00 H new ATOM 0 HD21 LEU A 133 -4.320 -0.288 -4.793 1.00 0.00 H new ATOM 0 HD22 LEU A 133 -4.215 1.373 -5.423 1.00 0.00 H new ATOM 0 HD23 LEU A 133 -3.964 -0.010 -6.514 1.00 0.00 H new ATOM 423 N ARG A 134 0.054 2.359 -8.730 1.00 0.00 N ATOM 424 CA ARG A 134 0.291 3.505 -9.637 1.00 0.00 C ATOM 425 C ARG A 134 0.086 3.149 -11.106 1.00 0.00 C ATOM 426 O ARG A 134 -0.245 4.024 -11.897 1.00 0.00 O ATOM 427 CB ARG A 134 1.629 4.198 -9.357 1.00 0.00 C ATOM 428 CG ARG A 134 2.869 3.557 -9.992 1.00 0.00 C ATOM 429 CD ARG A 134 4.115 3.938 -9.178 1.00 0.00 C ATOM 430 NE ARG A 134 5.357 3.449 -9.803 1.00 0.00 N ATOM 431 CZ ARG A 134 6.473 3.070 -9.202 1.00 0.00 C ATOM 432 NH1 ARG A 134 6.596 2.959 -7.906 1.00 0.00 N ATOM 433 NH2 ARG A 134 7.523 2.781 -9.918 1.00 0.00 N ATOM 0 H ARG A 134 0.878 2.023 -8.232 1.00 0.00 H new ATOM 0 HA ARG A 134 -0.479 4.244 -9.414 1.00 0.00 H new ATOM 0 HB2 ARG A 134 1.560 5.229 -9.704 1.00 0.00 H new ATOM 0 HB3 ARG A 134 1.777 4.234 -8.278 1.00 0.00 H new ATOM 0 HG2 ARG A 134 2.757 2.473 -10.020 1.00 0.00 H new ATOM 0 HG3 ARG A 134 2.978 3.893 -11.023 1.00 0.00 H new ATOM 0 HD2 ARG A 134 4.163 5.022 -9.076 1.00 0.00 H new ATOM 0 HD3 ARG A 134 4.030 3.527 -8.172 1.00 0.00 H new ATOM 0 HE ARG A 134 5.356 3.396 -10.822 1.00 0.00 H new ATOM 0 HH11 ARG A 134 5.804 3.170 -7.299 1.00 0.00 H new ATOM 0 HH12 ARG A 134 7.484 2.662 -7.502 1.00 0.00 H new ATOM 0 HH21 ARG A 134 7.481 2.848 -10.935 1.00 0.00 H new ATOM 0 HH22 ARG A 134 8.387 2.488 -9.461 1.00 0.00 H new ATOM 447 N GLN A 135 0.201 1.869 -11.457 1.00 0.00 N ATOM 448 CA GLN A 135 -0.168 1.319 -12.759 1.00 0.00 C ATOM 449 C GLN A 135 -1.699 1.156 -12.931 1.00 0.00 C ATOM 450 O GLN A 135 -2.274 1.641 -13.911 1.00 0.00 O ATOM 451 CB GLN A 135 0.594 -0.001 -12.920 1.00 0.00 C ATOM 452 CG GLN A 135 0.598 -0.473 -14.376 1.00 0.00 C ATOM 453 CD GLN A 135 1.366 -1.781 -14.546 1.00 0.00 C ATOM 454 OE1 GLN A 135 0.835 -2.873 -14.397 1.00 0.00 O ATOM 455 NE2 GLN A 135 2.640 -1.736 -14.873 1.00 0.00 N ATOM 0 H GLN A 135 0.567 1.162 -10.819 1.00 0.00 H new ATOM 0 HA GLN A 135 0.112 2.012 -13.552 1.00 0.00 H new ATOM 0 HB2 GLN A 135 1.620 0.126 -12.575 1.00 0.00 H new ATOM 0 HB3 GLN A 135 0.138 -0.765 -12.290 1.00 0.00 H new ATOM 0 HG2 GLN A 135 -0.428 -0.607 -14.717 1.00 0.00 H new ATOM 0 HG3 GLN A 135 1.045 0.296 -15.006 1.00 0.00 H new ATOM 0 HE21 GLN A 135 3.102 -0.836 -15.002 1.00 0.00 H new ATOM 0 HE22 GLN A 135 3.165 -2.601 -14.997 1.00 0.00 H new ATOM 464 N MET A 136 -2.385 0.515 -11.971 1.00 0.00 N ATOM 465 CA MET A 136 -3.844 0.369 -11.963 1.00 0.00 C ATOM 466 C MET A 136 -4.564 1.717 -11.964 1.00 0.00 C ATOM 467 O MET A 136 -5.375 1.971 -12.852 1.00 0.00 O ATOM 468 CB MET A 136 -4.288 -0.401 -10.723 1.00 0.00 C ATOM 469 CG MET A 136 -4.121 -1.917 -10.823 1.00 0.00 C ATOM 470 SD MET A 136 -5.076 -2.808 -9.562 1.00 0.00 S ATOM 471 CE MET A 136 -4.632 -1.828 -8.101 1.00 0.00 C ATOM 0 H MET A 136 -1.932 0.078 -11.168 1.00 0.00 H new ATOM 0 HA MET A 136 -4.107 -0.169 -12.874 1.00 0.00 H new ATOM 0 HB2 MET A 136 -3.720 -0.042 -9.865 1.00 0.00 H new ATOM 0 HB3 MET A 136 -5.336 -0.176 -10.528 1.00 0.00 H new ATOM 0 HG2 MET A 136 -4.434 -2.249 -11.813 1.00 0.00 H new ATOM 0 HG3 MET A 136 -3.066 -2.170 -10.721 1.00 0.00 H new ATOM 0 HE1 MET A 136 -4.840 -2.404 -7.199 1.00 0.00 H new ATOM 0 HE2 MET A 136 -3.571 -1.581 -8.137 1.00 0.00 H new ATOM 0 HE3 MET A 136 -5.218 -0.909 -8.087 1.00 0.00 H new ATOM 481 N PHE A 137 -4.256 2.595 -11.006 1.00 0.00 N ATOM 482 CA PHE A 137 -4.703 3.987 -11.028 1.00 0.00 C ATOM 483 C PHE A 137 -4.179 4.699 -12.296 1.00 0.00 C ATOM 484 O PHE A 137 -4.892 5.491 -12.908 1.00 0.00 O ATOM 485 CB PHE A 137 -4.311 4.717 -9.732 1.00 0.00 C ATOM 486 CG PHE A 137 -5.263 4.456 -8.576 1.00 0.00 C ATOM 487 CD1 PHE A 137 -5.141 3.314 -7.757 1.00 0.00 C ATOM 488 CD2 PHE A 137 -6.341 5.336 -8.368 1.00 0.00 C ATOM 489 CE1 PHE A 137 -6.082 3.082 -6.735 1.00 0.00 C ATOM 490 CE2 PHE A 137 -7.278 5.106 -7.351 1.00 0.00 C ATOM 491 CZ PHE A 137 -7.128 3.994 -6.510 1.00 0.00 C ATOM 0 H PHE A 137 -3.688 2.358 -10.192 1.00 0.00 H new ATOM 0 HA PHE A 137 -5.792 4.007 -11.073 1.00 0.00 H new ATOM 0 HB2 PHE A 137 -3.306 4.410 -9.441 1.00 0.00 H new ATOM 0 HB3 PHE A 137 -4.273 5.789 -9.926 1.00 0.00 H new ATOM 0 HD1 PHE A 137 -4.329 2.620 -7.913 1.00 0.00 H new ATOM 0 HD2 PHE A 137 -6.448 6.203 -9.003 1.00 0.00 H new ATOM 0 HE1 PHE A 137 -5.999 2.198 -6.120 1.00 0.00 H new ATOM 0 HE2 PHE A 137 -8.110 5.781 -7.216 1.00 0.00 H new ATOM 0 HZ PHE A 137 -7.815 3.838 -5.691 1.00 0.00 H new ATOM 501 N GLY A 138 -2.958 4.375 -12.744 1.00 0.00 N ATOM 502 CA GLY A 138 -2.319 4.799 -13.998 1.00 0.00 C ATOM 503 C GLY A 138 -3.110 4.567 -15.285 1.00 0.00 C ATOM 504 O GLY A 138 -2.905 5.322 -16.239 1.00 0.00 O ATOM 0 H GLY A 138 -2.347 3.766 -12.200 1.00 0.00 H new ATOM 0 HA2 GLY A 138 -2.096 5.863 -13.923 1.00 0.00 H new ATOM 0 HA3 GLY A 138 -1.365 4.279 -14.087 1.00 0.00 H new ATOM 508 N GLN A 139 -4.049 3.607 -15.327 1.00 0.00 N ATOM 509 CA GLN A 139 -5.047 3.568 -16.419 1.00 0.00 C ATOM 510 C GLN A 139 -5.796 4.900 -16.597 1.00 0.00 C ATOM 511 O GLN A 139 -6.106 5.303 -17.720 1.00 0.00 O ATOM 512 CB GLN A 139 -6.051 2.411 -16.267 1.00 0.00 C ATOM 513 CG GLN A 139 -7.255 2.662 -15.339 1.00 0.00 C ATOM 514 CD GLN A 139 -8.011 1.371 -15.035 1.00 0.00 C ATOM 515 OE1 GLN A 139 -8.977 1.005 -15.691 1.00 0.00 O ATOM 516 NE2 GLN A 139 -7.594 0.633 -14.032 1.00 0.00 N ATOM 0 H GLN A 139 -4.141 2.862 -14.637 1.00 0.00 H new ATOM 0 HA GLN A 139 -4.464 3.392 -17.323 1.00 0.00 H new ATOM 0 HB2 GLN A 139 -6.430 2.157 -17.257 1.00 0.00 H new ATOM 0 HB3 GLN A 139 -5.512 1.538 -15.898 1.00 0.00 H new ATOM 0 HG2 GLN A 139 -6.909 3.110 -14.407 1.00 0.00 H new ATOM 0 HG3 GLN A 139 -7.931 3.379 -15.805 1.00 0.00 H new ATOM 0 HE21 GLN A 139 -6.790 0.930 -13.480 1.00 0.00 H new ATOM 0 HE22 GLN A 139 -8.074 -0.238 -13.805 1.00 0.00 H new ATOM 525 N PHE A 140 -6.062 5.591 -15.482 1.00 0.00 N ATOM 526 CA PHE A 140 -6.686 6.910 -15.430 1.00 0.00 C ATOM 527 C PHE A 140 -5.647 8.048 -15.409 1.00 0.00 C ATOM 528 O PHE A 140 -5.885 9.118 -15.970 1.00 0.00 O ATOM 529 CB PHE A 140 -7.635 6.954 -14.216 1.00 0.00 C ATOM 530 CG PHE A 140 -8.884 6.117 -14.425 1.00 0.00 C ATOM 531 CD1 PHE A 140 -9.828 6.579 -15.362 1.00 0.00 C ATOM 532 CD2 PHE A 140 -9.158 4.946 -13.680 1.00 0.00 C ATOM 533 CE1 PHE A 140 -11.000 5.845 -15.614 1.00 0.00 C ATOM 534 CE2 PHE A 140 -10.319 4.203 -13.951 1.00 0.00 C ATOM 535 CZ PHE A 140 -11.237 4.646 -14.921 1.00 0.00 C ATOM 0 H PHE A 140 -5.837 5.228 -14.556 1.00 0.00 H new ATOM 0 HA PHE A 140 -7.264 7.072 -16.340 1.00 0.00 H new ATOM 0 HB2 PHE A 140 -7.106 6.597 -13.332 1.00 0.00 H new ATOM 0 HB3 PHE A 140 -7.922 7.987 -14.020 1.00 0.00 H new ATOM 0 HD1 PHE A 140 -9.650 7.504 -15.891 1.00 0.00 H new ATOM 0 HD2 PHE A 140 -8.477 4.624 -12.906 1.00 0.00 H new ATOM 0 HE1 PHE A 140 -11.717 6.202 -16.339 1.00 0.00 H new ATOM 0 HE2 PHE A 140 -10.508 3.287 -13.412 1.00 0.00 H new ATOM 0 HZ PHE A 140 -12.123 4.065 -15.133 1.00 0.00 H new ATOM 545 N GLY A 141 -4.467 7.811 -14.819 1.00 0.00 N ATOM 546 CA GLY A 141 -3.217 8.565 -15.049 1.00 0.00 C ATOM 547 C GLY A 141 -3.087 9.944 -14.395 1.00 0.00 C ATOM 548 O GLY A 141 -2.105 10.654 -14.616 1.00 0.00 O ATOM 0 H GLY A 141 -4.348 7.059 -14.140 1.00 0.00 H new ATOM 0 HA2 GLY A 141 -2.386 7.950 -14.703 1.00 0.00 H new ATOM 0 HA3 GLY A 141 -3.094 8.691 -16.125 1.00 0.00 H new ATOM 552 N LYS A 142 -4.056 10.298 -13.552 1.00 0.00 N ATOM 553 CA LYS A 142 -4.162 11.528 -12.748 1.00 0.00 C ATOM 554 C LYS A 142 -3.154 11.639 -11.596 1.00 0.00 C ATOM 555 O LYS A 142 -2.878 12.739 -11.115 1.00 0.00 O ATOM 556 CB LYS A 142 -5.586 11.500 -12.194 1.00 0.00 C ATOM 557 CG LYS A 142 -6.613 11.825 -13.284 1.00 0.00 C ATOM 558 CD LYS A 142 -6.862 13.345 -13.340 1.00 0.00 C ATOM 559 CE LYS A 142 -7.707 13.739 -14.556 1.00 0.00 C ATOM 560 NZ LYS A 142 -7.775 15.215 -14.698 1.00 0.00 N ATOM 0 H LYS A 142 -4.856 9.685 -13.397 1.00 0.00 H new ATOM 0 HA LYS A 142 -3.938 12.391 -13.375 1.00 0.00 H new ATOM 0 HB2 LYS A 142 -5.796 10.516 -11.775 1.00 0.00 H new ATOM 0 HB3 LYS A 142 -5.676 12.219 -11.380 1.00 0.00 H new ATOM 0 HG2 LYS A 142 -6.253 11.472 -14.250 1.00 0.00 H new ATOM 0 HG3 LYS A 142 -7.548 11.303 -13.081 1.00 0.00 H new ATOM 0 HD2 LYS A 142 -7.366 13.664 -12.428 1.00 0.00 H new ATOM 0 HD3 LYS A 142 -5.907 13.869 -13.376 1.00 0.00 H new ATOM 0 HE2 LYS A 142 -7.279 13.302 -15.458 1.00 0.00 H new ATOM 0 HE3 LYS A 142 -8.713 13.333 -14.452 1.00 0.00 H new ATOM 0 HZ1 LYS A 142 -8.394 15.459 -15.498 1.00 0.00 H new ATOM 0 HZ2 LYS A 142 -8.158 15.630 -13.825 1.00 0.00 H new ATOM 0 HZ3 LYS A 142 -6.821 15.591 -14.871 1.00 0.00 H new ATOM 574 N ILE A 143 -2.644 10.493 -11.148 1.00 0.00 N ATOM 575 CA ILE A 143 -1.748 10.312 -9.988 1.00 0.00 C ATOM 576 C ILE A 143 -0.548 11.276 -9.949 1.00 0.00 C ATOM 577 O ILE A 143 0.201 11.384 -10.922 1.00 0.00 O ATOM 578 CB ILE A 143 -1.207 8.861 -9.843 1.00 0.00 C ATOM 579 CG1 ILE A 143 -2.179 7.729 -10.197 1.00 0.00 C ATOM 580 CG2 ILE A 143 -0.822 8.659 -8.375 1.00 0.00 C ATOM 581 CD1 ILE A 143 -2.190 7.450 -11.701 1.00 0.00 C ATOM 0 H ILE A 143 -2.853 9.607 -11.608 1.00 0.00 H new ATOM 0 HA ILE A 143 -2.403 10.544 -9.148 1.00 0.00 H new ATOM 0 HB ILE A 143 -0.386 8.790 -10.557 1.00 0.00 H new ATOM 0 HG12 ILE A 143 -1.896 6.824 -9.660 1.00 0.00 H new ATOM 0 HG13 ILE A 143 -3.184 7.994 -9.868 1.00 0.00 H new ATOM 0 HG21 ILE A 143 -0.437 7.649 -8.235 1.00 0.00 H new ATOM 0 HG22 ILE A 143 -0.054 9.381 -8.097 1.00 0.00 H new ATOM 0 HG23 ILE A 143 -1.700 8.803 -7.745 1.00 0.00 H new ATOM 0 HD11 ILE A 143 -2.890 6.642 -11.916 1.00 0.00 H new ATOM 0 HD12 ILE A 143 -2.498 8.349 -12.236 1.00 0.00 H new ATOM 0 HD13 ILE A 143 -1.190 7.160 -12.025 1.00 0.00 H new ATOM 593 N LEU A 144 -0.315 11.893 -8.783 1.00 0.00 N ATOM 594 CA LEU A 144 0.933 12.580 -8.409 1.00 0.00 C ATOM 595 C LEU A 144 1.886 11.668 -7.616 1.00 0.00 C ATOM 596 O LEU A 144 3.085 11.629 -7.900 1.00 0.00 O ATOM 597 CB LEU A 144 0.591 13.855 -7.603 1.00 0.00 C ATOM 598 CG LEU A 144 0.544 15.155 -8.426 1.00 0.00 C ATOM 599 CD1 LEU A 144 1.941 15.643 -8.808 1.00 0.00 C ATOM 600 CD2 LEU A 144 -0.299 15.025 -9.696 1.00 0.00 C ATOM 0 H LEU A 144 -1.017 11.930 -8.044 1.00 0.00 H new ATOM 0 HA LEU A 144 1.458 12.854 -9.324 1.00 0.00 H new ATOM 0 HB2 LEU A 144 -0.377 13.713 -7.121 1.00 0.00 H new ATOM 0 HB3 LEU A 144 1.328 13.973 -6.809 1.00 0.00 H new ATOM 0 HG LEU A 144 0.072 15.887 -7.771 1.00 0.00 H new ATOM 0 HD11 LEU A 144 1.859 16.562 -9.388 1.00 0.00 H new ATOM 0 HD12 LEU A 144 2.519 15.834 -7.904 1.00 0.00 H new ATOM 0 HD13 LEU A 144 2.442 14.881 -9.405 1.00 0.00 H new ATOM 0 HD21 LEU A 144 -0.295 15.973 -10.234 1.00 0.00 H new ATOM 0 HD22 LEU A 144 0.119 14.245 -10.332 1.00 0.00 H new ATOM 0 HD23 LEU A 144 -1.323 14.765 -9.428 1.00 0.00 H new ATOM 612 N ASP A 145 1.365 10.926 -6.632 1.00 0.00 N ATOM 613 CA ASP A 145 2.101 10.003 -5.756 1.00 0.00 C ATOM 614 C ASP A 145 1.242 8.801 -5.316 1.00 0.00 C ATOM 615 O ASP A 145 0.014 8.864 -5.351 1.00 0.00 O ATOM 616 CB ASP A 145 2.582 10.766 -4.511 1.00 0.00 C ATOM 617 CG ASP A 145 3.895 11.530 -4.752 1.00 0.00 C ATOM 618 OD1 ASP A 145 4.949 10.872 -4.941 1.00 0.00 O ATOM 619 OD2 ASP A 145 3.887 12.784 -4.706 1.00 0.00 O ATOM 0 H ASP A 145 0.369 10.953 -6.413 1.00 0.00 H new ATOM 0 HA ASP A 145 2.946 9.612 -6.323 1.00 0.00 H new ATOM 0 HB2 ASP A 145 1.809 11.469 -4.200 1.00 0.00 H new ATOM 0 HB3 ASP A 145 2.721 10.062 -3.690 1.00 0.00 H new ATOM 624 N VAL A 146 1.895 7.733 -4.847 1.00 0.00 N ATOM 625 CA VAL A 146 1.307 6.534 -4.209 1.00 0.00 C ATOM 626 C VAL A 146 2.061 6.128 -2.941 1.00 0.00 C ATOM 627 O VAL A 146 3.132 6.653 -2.628 1.00 0.00 O ATOM 628 CB VAL A 146 1.270 5.302 -5.139 1.00 0.00 C ATOM 629 CG1 VAL A 146 0.125 5.342 -6.119 1.00 0.00 C ATOM 630 CG2 VAL A 146 2.586 5.124 -5.897 1.00 0.00 C ATOM 0 H VAL A 146 2.912 7.671 -4.903 1.00 0.00 H new ATOM 0 HA VAL A 146 0.287 6.832 -3.968 1.00 0.00 H new ATOM 0 HB VAL A 146 1.119 4.446 -4.482 1.00 0.00 H new ATOM 0 HG11 VAL A 146 0.151 4.450 -6.746 1.00 0.00 H new ATOM 0 HG12 VAL A 146 -0.819 5.376 -5.575 1.00 0.00 H new ATOM 0 HG13 VAL A 146 0.214 6.229 -6.746 1.00 0.00 H new ATOM 0 HG21 VAL A 146 2.520 4.247 -6.540 1.00 0.00 H new ATOM 0 HG22 VAL A 146 2.777 6.007 -6.506 1.00 0.00 H new ATOM 0 HG23 VAL A 146 3.401 4.991 -5.185 1.00 0.00 H new ATOM 640 N GLU A 147 1.469 5.187 -2.214 1.00 0.00 N ATOM 641 CA GLU A 147 1.922 4.653 -0.940 1.00 0.00 C ATOM 642 C GLU A 147 1.284 3.271 -0.676 1.00 0.00 C ATOM 643 O GLU A 147 0.142 3.024 -1.067 1.00 0.00 O ATOM 644 CB GLU A 147 1.436 5.668 0.103 1.00 0.00 C ATOM 645 CG GLU A 147 1.954 5.448 1.527 1.00 0.00 C ATOM 646 CD GLU A 147 3.410 5.939 1.649 1.00 0.00 C ATOM 647 OE1 GLU A 147 4.332 5.243 1.161 1.00 0.00 O ATOM 648 OE2 GLU A 147 3.631 7.041 2.207 1.00 0.00 O ATOM 0 H GLU A 147 0.601 4.749 -2.522 1.00 0.00 H new ATOM 0 HA GLU A 147 3.003 4.514 -0.913 1.00 0.00 H new ATOM 0 HB2 GLU A 147 1.730 6.666 -0.222 1.00 0.00 H new ATOM 0 HB3 GLU A 147 0.346 5.648 0.124 1.00 0.00 H new ATOM 0 HG2 GLU A 147 1.322 5.982 2.237 1.00 0.00 H new ATOM 0 HG3 GLU A 147 1.897 4.390 1.782 1.00 0.00 H new ATOM 655 N ILE A 148 1.970 2.395 0.067 1.00 0.00 N ATOM 656 CA ILE A 148 1.421 1.180 0.706 1.00 0.00 C ATOM 657 C ILE A 148 1.803 1.200 2.180 1.00 0.00 C ATOM 658 O ILE A 148 2.899 1.651 2.521 1.00 0.00 O ATOM 659 CB ILE A 148 1.937 -0.092 -0.004 1.00 0.00 C ATOM 660 CG1 ILE A 148 1.064 -0.368 -1.238 1.00 0.00 C ATOM 661 CG2 ILE A 148 2.003 -1.344 0.898 1.00 0.00 C ATOM 662 CD1 ILE A 148 -0.242 -1.092 -0.926 1.00 0.00 C ATOM 0 H ILE A 148 2.966 2.513 0.251 1.00 0.00 H new ATOM 0 HA ILE A 148 0.335 1.167 0.619 1.00 0.00 H new ATOM 0 HB ILE A 148 2.969 0.109 -0.293 1.00 0.00 H new ATOM 0 HG12 ILE A 148 0.835 0.579 -1.727 1.00 0.00 H new ATOM 0 HG13 ILE A 148 1.636 -0.963 -1.949 1.00 0.00 H new ATOM 0 HG21 ILE A 148 2.375 -2.190 0.320 1.00 0.00 H new ATOM 0 HG22 ILE A 148 2.674 -1.154 1.736 1.00 0.00 H new ATOM 0 HG23 ILE A 148 1.007 -1.573 1.276 1.00 0.00 H new ATOM 0 HD11 ILE A 148 -0.800 -1.249 -1.849 1.00 0.00 H new ATOM 0 HD12 ILE A 148 -0.023 -2.055 -0.466 1.00 0.00 H new ATOM 0 HD13 ILE A 148 -0.837 -0.489 -0.240 1.00 0.00 H new ATOM 674 N ILE A 149 0.938 0.704 3.073 1.00 0.00 N ATOM 675 CA ILE A 149 1.217 0.809 4.496 1.00 0.00 C ATOM 676 C ILE A 149 1.942 -0.481 4.902 1.00 0.00 C ATOM 677 O ILE A 149 1.378 -1.342 5.571 1.00 0.00 O ATOM 678 CB ILE A 149 -0.091 1.108 5.238 1.00 0.00 C ATOM 679 CG1 ILE A 149 -0.932 2.226 4.575 1.00 0.00 C ATOM 680 CG2 ILE A 149 0.280 1.559 6.649 1.00 0.00 C ATOM 681 CD1 ILE A 149 -0.190 3.468 4.062 1.00 0.00 C ATOM 0 H ILE A 149 0.062 0.238 2.837 1.00 0.00 H new ATOM 0 HA ILE A 149 1.876 1.636 4.761 1.00 0.00 H new ATOM 0 HB ILE A 149 -0.699 0.203 5.225 1.00 0.00 H new ATOM 0 HG12 ILE A 149 -1.471 1.787 3.736 1.00 0.00 H new ATOM 0 HG13 ILE A 149 -1.679 2.556 5.296 1.00 0.00 H new ATOM 0 HG21 ILE A 149 -0.627 1.782 7.210 1.00 0.00 H new ATOM 0 HG22 ILE A 149 0.832 0.765 7.152 1.00 0.00 H new ATOM 0 HG23 ILE A 149 0.901 2.453 6.594 1.00 0.00 H new ATOM 0 HD11 ILE A 149 -0.905 4.164 3.624 1.00 0.00 H new ATOM 0 HD12 ILE A 149 0.326 3.952 4.891 1.00 0.00 H new ATOM 0 HD13 ILE A 149 0.537 3.171 3.306 1.00 0.00 H new ATOM 693 N PHE A 150 3.162 -0.674 4.390 1.00 0.00 N ATOM 694 CA PHE A 150 3.886 -1.948 4.501 1.00 0.00 C ATOM 695 C PHE A 150 4.158 -2.336 5.977 1.00 0.00 C ATOM 696 O PHE A 150 4.226 -1.470 6.855 1.00 0.00 O ATOM 697 CB PHE A 150 5.225 -1.868 3.731 1.00 0.00 C ATOM 698 CG PHE A 150 5.154 -2.291 2.274 1.00 0.00 C ATOM 699 CD1 PHE A 150 4.859 -3.631 1.960 1.00 0.00 C ATOM 700 CD2 PHE A 150 5.392 -1.372 1.235 1.00 0.00 C ATOM 701 CE1 PHE A 150 4.750 -4.045 0.622 1.00 0.00 C ATOM 702 CE2 PHE A 150 5.300 -1.788 -0.107 1.00 0.00 C ATOM 703 CZ PHE A 150 4.967 -3.122 -0.413 1.00 0.00 C ATOM 0 H PHE A 150 3.677 0.048 3.886 1.00 0.00 H new ATOM 0 HA PHE A 150 3.253 -2.720 4.064 1.00 0.00 H new ATOM 0 HB2 PHE A 150 5.593 -0.843 3.779 1.00 0.00 H new ATOM 0 HB3 PHE A 150 5.958 -2.494 4.240 1.00 0.00 H new ATOM 0 HD1 PHE A 150 4.715 -4.348 2.755 1.00 0.00 H new ATOM 0 HD2 PHE A 150 5.645 -0.348 1.467 1.00 0.00 H new ATOM 0 HE1 PHE A 150 4.500 -5.070 0.391 1.00 0.00 H new ATOM 0 HE2 PHE A 150 5.485 -1.083 -0.904 1.00 0.00 H new ATOM 0 HZ PHE A 150 4.879 -3.434 -1.443 1.00 0.00 H new ATOM 713 N ASN A 151 4.387 -3.625 6.247 1.00 0.00 N ATOM 714 CA ASN A 151 4.897 -4.152 7.520 1.00 0.00 C ATOM 715 C ASN A 151 5.804 -5.379 7.295 1.00 0.00 C ATOM 716 O ASN A 151 5.990 -5.825 6.160 1.00 0.00 O ATOM 717 CB ASN A 151 3.726 -4.460 8.478 1.00 0.00 C ATOM 718 CG ASN A 151 3.044 -5.803 8.250 1.00 0.00 C ATOM 719 OD1 ASN A 151 3.001 -6.663 9.115 1.00 0.00 O ATOM 720 ND2 ASN A 151 2.509 -6.057 7.081 1.00 0.00 N ATOM 0 H ASN A 151 4.216 -4.359 5.560 1.00 0.00 H new ATOM 0 HA ASN A 151 5.518 -3.389 7.990 1.00 0.00 H new ATOM 0 HB2 ASN A 151 4.096 -4.427 9.503 1.00 0.00 H new ATOM 0 HB3 ASN A 151 2.981 -3.670 8.383 1.00 0.00 H new ATOM 0 HD21 ASN A 151 2.067 -6.960 6.908 1.00 0.00 H new ATOM 0 HD22 ASN A 151 2.534 -5.352 6.345 1.00 0.00 H new ATOM 727 N GLU A 152 6.335 -5.964 8.372 1.00 0.00 N ATOM 728 CA GLU A 152 7.227 -7.140 8.325 1.00 0.00 C ATOM 729 C GLU A 152 6.622 -8.390 7.650 1.00 0.00 C ATOM 730 O GLU A 152 7.367 -9.233 7.143 1.00 0.00 O ATOM 731 CB GLU A 152 7.735 -7.467 9.742 1.00 0.00 C ATOM 732 CG GLU A 152 6.634 -7.901 10.722 1.00 0.00 C ATOM 733 CD GLU A 152 7.211 -8.139 12.131 1.00 0.00 C ATOM 734 OE1 GLU A 152 7.279 -7.178 12.937 1.00 0.00 O ATOM 735 OE2 GLU A 152 7.599 -9.292 12.443 1.00 0.00 O ATOM 0 H GLU A 152 6.158 -5.633 9.320 1.00 0.00 H new ATOM 0 HA GLU A 152 8.060 -6.858 7.681 1.00 0.00 H new ATOM 0 HB2 GLU A 152 8.479 -8.261 9.675 1.00 0.00 H new ATOM 0 HB3 GLU A 152 8.240 -6.590 10.146 1.00 0.00 H new ATOM 0 HG2 GLU A 152 5.860 -7.135 10.767 1.00 0.00 H new ATOM 0 HG3 GLU A 152 6.159 -8.813 10.361 1.00 0.00 H new ATOM 742 N ARG A 153 5.284 -8.503 7.597 1.00 0.00 N ATOM 743 CA ARG A 153 4.551 -9.579 6.897 1.00 0.00 C ATOM 744 C ARG A 153 4.177 -9.261 5.437 1.00 0.00 C ATOM 745 O ARG A 153 3.780 -10.181 4.723 1.00 0.00 O ATOM 746 CB ARG A 153 3.307 -9.979 7.721 1.00 0.00 C ATOM 747 CG ARG A 153 3.613 -10.656 9.071 1.00 0.00 C ATOM 748 CD ARG A 153 4.183 -12.075 8.923 1.00 0.00 C ATOM 749 NE ARG A 153 3.200 -13.001 8.323 1.00 0.00 N ATOM 750 CZ ARG A 153 3.415 -14.028 7.522 1.00 0.00 C ATOM 751 NH1 ARG A 153 4.612 -14.385 7.153 1.00 0.00 N ATOM 752 NH2 ARG A 153 2.411 -14.723 7.070 1.00 0.00 N ATOM 0 H ARG A 153 4.664 -7.833 8.051 1.00 0.00 H new ATOM 0 HA ARG A 153 5.239 -10.421 6.823 1.00 0.00 H new ATOM 0 HB2 ARG A 153 2.709 -9.086 7.906 1.00 0.00 H new ATOM 0 HB3 ARG A 153 2.695 -10.654 7.123 1.00 0.00 H new ATOM 0 HG2 ARG A 153 4.324 -10.042 9.625 1.00 0.00 H new ATOM 0 HG3 ARG A 153 2.699 -10.699 9.664 1.00 0.00 H new ATOM 0 HD2 ARG A 153 5.079 -12.044 8.303 1.00 0.00 H new ATOM 0 HD3 ARG A 153 4.485 -12.449 9.901 1.00 0.00 H new ATOM 0 HE ARG A 153 2.224 -12.823 8.560 1.00 0.00 H new ATOM 0 HH11 ARG A 153 5.424 -13.865 7.484 1.00 0.00 H new ATOM 0 HH12 ARG A 153 4.737 -15.185 6.533 1.00 0.00 H new ATOM 0 HH21 ARG A 153 1.458 -14.474 7.335 1.00 0.00 H new ATOM 0 HH22 ARG A 153 2.578 -15.516 6.451 1.00 0.00 H new ATOM 766 N GLY A 154 4.314 -8.016 4.962 1.00 0.00 N ATOM 767 CA GLY A 154 3.932 -7.585 3.603 1.00 0.00 C ATOM 768 C GLY A 154 3.048 -6.332 3.607 1.00 0.00 C ATOM 769 O GLY A 154 3.192 -5.457 4.462 1.00 0.00 O ATOM 0 H GLY A 154 4.703 -7.258 5.523 1.00 0.00 H new ATOM 0 HA2 GLY A 154 4.833 -7.387 3.022 1.00 0.00 H new ATOM 0 HA3 GLY A 154 3.403 -8.397 3.104 1.00 0.00 H new ATOM 773 N SER A 155 2.122 -6.221 2.653 1.00 0.00 N ATOM 774 CA SER A 155 0.988 -5.283 2.751 1.00 0.00 C ATOM 775 C SER A 155 0.207 -5.453 4.066 1.00 0.00 C ATOM 776 O SER A 155 -0.046 -6.578 4.493 1.00 0.00 O ATOM 777 CB SER A 155 0.082 -5.462 1.535 1.00 0.00 C ATOM 778 OG SER A 155 -1.051 -4.625 1.640 1.00 0.00 O ATOM 0 H SER A 155 2.131 -6.772 1.794 1.00 0.00 H new ATOM 0 HA SER A 155 1.379 -4.266 2.761 1.00 0.00 H new ATOM 0 HB2 SER A 155 0.633 -5.227 0.625 1.00 0.00 H new ATOM 0 HB3 SER A 155 -0.232 -6.503 1.457 1.00 0.00 H new ATOM 0 HG SER A 155 -1.623 -4.748 0.854 1.00 0.00 H new ATOM 784 N LYS A 156 -0.213 -4.346 4.701 1.00 0.00 N ATOM 785 CA LYS A 156 -1.236 -4.345 5.772 1.00 0.00 C ATOM 786 C LYS A 156 -2.679 -4.413 5.247 1.00 0.00 C ATOM 787 O LYS A 156 -3.623 -4.450 6.037 1.00 0.00 O ATOM 788 CB LYS A 156 -1.051 -3.128 6.695 1.00 0.00 C ATOM 789 CG LYS A 156 0.088 -3.399 7.695 1.00 0.00 C ATOM 790 CD LYS A 156 0.087 -2.447 8.899 1.00 0.00 C ATOM 791 CE LYS A 156 0.432 -1.021 8.476 1.00 0.00 C ATOM 792 NZ LYS A 156 0.432 -0.074 9.629 1.00 0.00 N ATOM 0 H LYS A 156 0.148 -3.416 4.487 1.00 0.00 H new ATOM 0 HA LYS A 156 -1.079 -5.261 6.342 1.00 0.00 H new ATOM 0 HB2 LYS A 156 -0.824 -2.242 6.102 1.00 0.00 H new ATOM 0 HB3 LYS A 156 -1.977 -2.923 7.232 1.00 0.00 H new ATOM 0 HG2 LYS A 156 0.009 -4.425 8.054 1.00 0.00 H new ATOM 0 HG3 LYS A 156 1.043 -3.315 7.177 1.00 0.00 H new ATOM 0 HD2 LYS A 156 -0.893 -2.461 9.376 1.00 0.00 H new ATOM 0 HD3 LYS A 156 0.807 -2.793 9.640 1.00 0.00 H new ATOM 0 HE2 LYS A 156 1.413 -1.012 8.001 1.00 0.00 H new ATOM 0 HE3 LYS A 156 -0.286 -0.682 7.730 1.00 0.00 H new ATOM 0 HZ1 LYS A 156 0.485 0.903 9.276 1.00 0.00 H new ATOM 0 HZ2 LYS A 156 -0.442 -0.196 10.179 1.00 0.00 H new ATOM 0 HZ3 LYS A 156 1.253 -0.268 10.237 1.00 0.00 H new ATOM 806 N GLY A 157 -2.860 -4.468 3.927 1.00 0.00 N ATOM 807 CA GLY A 157 -4.158 -4.598 3.264 1.00 0.00 C ATOM 808 C GLY A 157 -4.732 -3.277 2.749 1.00 0.00 C ATOM 809 O GLY A 157 -5.819 -3.262 2.166 1.00 0.00 O ATOM 0 H GLY A 157 -2.082 -4.422 3.269 1.00 0.00 H new ATOM 0 HA2 GLY A 157 -4.059 -5.289 2.427 1.00 0.00 H new ATOM 0 HA3 GLY A 157 -4.867 -5.042 3.962 1.00 0.00 H new ATOM 813 N PHE A 158 -4.013 -2.169 2.950 1.00 0.00 N ATOM 814 CA PHE A 158 -4.306 -0.872 2.355 1.00 0.00 C ATOM 815 C PHE A 158 -3.040 -0.103 1.945 1.00 0.00 C ATOM 816 O PHE A 158 -1.915 -0.331 2.414 1.00 0.00 O ATOM 817 CB PHE A 158 -5.244 -0.037 3.253 1.00 0.00 C ATOM 818 CG PHE A 158 -4.647 0.802 4.357 1.00 0.00 C ATOM 819 CD1 PHE A 158 -4.341 0.208 5.594 1.00 0.00 C ATOM 820 CD2 PHE A 158 -4.520 2.197 4.190 1.00 0.00 C ATOM 821 CE1 PHE A 158 -3.910 1.010 6.659 1.00 0.00 C ATOM 822 CE2 PHE A 158 -4.115 3.013 5.264 1.00 0.00 C ATOM 823 CZ PHE A 158 -3.798 2.402 6.489 1.00 0.00 C ATOM 0 H PHE A 158 -3.188 -2.155 3.550 1.00 0.00 H new ATOM 0 HA PHE A 158 -4.842 -1.066 1.426 1.00 0.00 H new ATOM 0 HB2 PHE A 158 -5.813 0.629 2.605 1.00 0.00 H new ATOM 0 HB3 PHE A 158 -5.958 -0.722 3.710 1.00 0.00 H new ATOM 0 HD1 PHE A 158 -4.438 -0.860 5.723 1.00 0.00 H new ATOM 0 HD2 PHE A 158 -4.735 2.643 3.230 1.00 0.00 H new ATOM 0 HE1 PHE A 158 -3.664 0.560 7.609 1.00 0.00 H new ATOM 0 HE2 PHE A 158 -4.050 4.085 5.149 1.00 0.00 H new ATOM 0 HZ PHE A 158 -3.462 3.012 7.315 1.00 0.00 H new ATOM 833 N GLY A 159 -3.276 0.848 1.049 1.00 0.00 N ATOM 834 CA GLY A 159 -2.346 1.875 0.606 1.00 0.00 C ATOM 835 C GLY A 159 -3.059 3.224 0.476 1.00 0.00 C ATOM 836 O GLY A 159 -4.184 3.418 0.942 1.00 0.00 O ATOM 0 H GLY A 159 -4.180 0.926 0.584 1.00 0.00 H new ATOM 0 HA2 GLY A 159 -1.523 1.959 1.315 1.00 0.00 H new ATOM 0 HA3 GLY A 159 -1.913 1.592 -0.353 1.00 0.00 H new ATOM 840 N PHE A 160 -2.380 4.174 -0.140 1.00 0.00 N ATOM 841 CA PHE A 160 -2.777 5.564 -0.329 1.00 0.00 C ATOM 842 C PHE A 160 -2.309 6.036 -1.723 1.00 0.00 C ATOM 843 O PHE A 160 -1.316 5.534 -2.250 1.00 0.00 O ATOM 844 CB PHE A 160 -2.161 6.390 0.819 1.00 0.00 C ATOM 845 CG PHE A 160 -3.176 6.978 1.769 1.00 0.00 C ATOM 846 CD1 PHE A 160 -3.707 8.243 1.475 1.00 0.00 C ATOM 847 CD2 PHE A 160 -3.555 6.316 2.957 1.00 0.00 C ATOM 848 CE1 PHE A 160 -4.611 8.842 2.356 1.00 0.00 C ATOM 849 CE2 PHE A 160 -4.462 6.915 3.842 1.00 0.00 C ATOM 850 CZ PHE A 160 -5.001 8.172 3.531 1.00 0.00 C ATOM 0 H PHE A 160 -1.467 3.983 -0.554 1.00 0.00 H new ATOM 0 HA PHE A 160 -3.859 5.689 -0.297 1.00 0.00 H new ATOM 0 HB2 PHE A 160 -1.477 5.755 1.382 1.00 0.00 H new ATOM 0 HB3 PHE A 160 -1.567 7.199 0.392 1.00 0.00 H new ATOM 0 HD1 PHE A 160 -3.417 8.753 0.568 1.00 0.00 H new ATOM 0 HD2 PHE A 160 -3.144 5.344 3.185 1.00 0.00 H new ATOM 0 HE1 PHE A 160 -5.011 9.821 2.135 1.00 0.00 H new ATOM 0 HE2 PHE A 160 -4.743 6.413 4.756 1.00 0.00 H new ATOM 0 HZ PHE A 160 -5.719 8.628 4.196 1.00 0.00 H new ATOM 860 N VAL A 161 -3.007 6.991 -2.340 1.00 0.00 N ATOM 861 CA VAL A 161 -2.669 7.566 -3.661 1.00 0.00 C ATOM 862 C VAL A 161 -3.168 9.014 -3.786 1.00 0.00 C ATOM 863 O VAL A 161 -4.014 9.441 -3.002 1.00 0.00 O ATOM 864 CB VAL A 161 -3.105 6.586 -4.781 1.00 0.00 C ATOM 865 CG1 VAL A 161 -4.546 6.167 -4.893 1.00 0.00 C ATOM 866 CG2 VAL A 161 -2.774 7.044 -6.197 1.00 0.00 C ATOM 0 H VAL A 161 -3.846 7.402 -1.932 1.00 0.00 H new ATOM 0 HA VAL A 161 -1.590 7.667 -3.776 1.00 0.00 H new ATOM 0 HB VAL A 161 -2.514 5.745 -4.419 1.00 0.00 H new ATOM 0 HG11 VAL A 161 -4.661 5.481 -5.732 1.00 0.00 H new ATOM 0 HG12 VAL A 161 -4.853 5.669 -3.973 1.00 0.00 H new ATOM 0 HG13 VAL A 161 -5.169 7.047 -5.055 1.00 0.00 H new ATOM 0 HG21 VAL A 161 -3.116 6.295 -6.911 1.00 0.00 H new ATOM 0 HG22 VAL A 161 -3.272 7.992 -6.399 1.00 0.00 H new ATOM 0 HG23 VAL A 161 -1.696 7.173 -6.295 1.00 0.00 H new ATOM 876 N THR A 162 -2.625 9.810 -4.716 1.00 0.00 N ATOM 877 CA THR A 162 -2.769 11.288 -4.717 1.00 0.00 C ATOM 878 C THR A 162 -3.378 11.758 -6.033 1.00 0.00 C ATOM 879 O THR A 162 -2.680 11.804 -7.049 1.00 0.00 O ATOM 880 CB THR A 162 -1.414 11.956 -4.443 1.00 0.00 C ATOM 881 OG1 THR A 162 -0.905 11.497 -3.208 1.00 0.00 O ATOM 882 CG2 THR A 162 -1.484 13.479 -4.332 1.00 0.00 C ATOM 0 H THR A 162 -2.070 9.455 -5.495 1.00 0.00 H new ATOM 0 HA THR A 162 -3.448 11.583 -3.917 1.00 0.00 H new ATOM 0 HB THR A 162 -0.785 11.694 -5.294 1.00 0.00 H new ATOM 0 HG1 THR A 162 -0.039 11.921 -3.033 1.00 0.00 H new ATOM 0 HG21 THR A 162 -0.488 13.876 -4.138 1.00 0.00 H new ATOM 0 HG22 THR A 162 -1.865 13.895 -5.265 1.00 0.00 H new ATOM 0 HG23 THR A 162 -2.150 13.754 -3.514 1.00 0.00 H new ATOM 890 N PHE A 163 -4.699 11.983 -6.045 1.00 0.00 N ATOM 891 CA PHE A 163 -5.502 11.550 -7.193 1.00 0.00 C ATOM 892 C PHE A 163 -6.769 12.338 -7.554 1.00 0.00 C ATOM 893 O PHE A 163 -7.002 12.691 -8.707 1.00 0.00 O ATOM 894 CB PHE A 163 -5.871 10.091 -6.922 1.00 0.00 C ATOM 895 CG PHE A 163 -6.437 9.398 -8.136 1.00 0.00 C ATOM 896 CD1 PHE A 163 -5.573 9.064 -9.186 1.00 0.00 C ATOM 897 CD2 PHE A 163 -7.807 9.108 -8.235 1.00 0.00 C ATOM 898 CE1 PHE A 163 -6.052 8.386 -10.317 1.00 0.00 C ATOM 899 CE2 PHE A 163 -8.291 8.430 -9.364 1.00 0.00 C ATOM 900 CZ PHE A 163 -7.422 8.081 -10.414 1.00 0.00 C ATOM 0 H PHE A 163 -5.219 12.446 -5.300 1.00 0.00 H new ATOM 0 HA PHE A 163 -4.876 11.726 -8.068 1.00 0.00 H new ATOM 0 HB2 PHE A 163 -4.986 9.554 -6.582 1.00 0.00 H new ATOM 0 HB3 PHE A 163 -6.600 10.049 -6.112 1.00 0.00 H new ATOM 0 HD1 PHE A 163 -4.528 9.331 -9.125 1.00 0.00 H new ATOM 0 HD2 PHE A 163 -8.484 9.405 -7.447 1.00 0.00 H new ATOM 0 HE1 PHE A 163 -5.374 8.100 -11.108 1.00 0.00 H new ATOM 0 HE2 PHE A 163 -9.338 8.174 -9.428 1.00 0.00 H new ATOM 0 HZ PHE A 163 -7.805 7.581 -11.291 1.00 0.00 H new ATOM 910 N GLU A 164 -7.634 12.528 -6.566 1.00 0.00 N ATOM 911 CA GLU A 164 -9.105 12.411 -6.652 1.00 0.00 C ATOM 912 C GLU A 164 -9.804 13.575 -7.375 1.00 0.00 C ATOM 913 O GLU A 164 -10.981 13.497 -7.723 1.00 0.00 O ATOM 914 CB GLU A 164 -9.615 12.241 -5.202 1.00 0.00 C ATOM 915 CG GLU A 164 -11.145 12.189 -5.043 1.00 0.00 C ATOM 916 CD GLU A 164 -11.602 11.713 -3.648 1.00 0.00 C ATOM 917 OE1 GLU A 164 -10.891 11.933 -2.639 1.00 0.00 O ATOM 918 OE2 GLU A 164 -12.713 11.141 -3.556 1.00 0.00 O ATOM 0 H GLU A 164 -7.323 12.782 -5.628 1.00 0.00 H new ATOM 0 HA GLU A 164 -9.355 11.552 -7.274 1.00 0.00 H new ATOM 0 HB2 GLU A 164 -9.193 11.324 -4.791 1.00 0.00 H new ATOM 0 HB3 GLU A 164 -9.232 13.066 -4.601 1.00 0.00 H new ATOM 0 HG2 GLU A 164 -11.556 13.180 -5.233 1.00 0.00 H new ATOM 0 HG3 GLU A 164 -11.559 11.522 -5.799 1.00 0.00 H new ATOM 925 N ASN A 165 -9.086 14.670 -7.607 1.00 0.00 N ATOM 926 CA ASN A 165 -9.681 16.002 -7.726 1.00 0.00 C ATOM 927 C ASN A 165 -10.050 16.414 -9.177 1.00 0.00 C ATOM 928 O ASN A 165 -9.782 17.534 -9.619 1.00 0.00 O ATOM 929 CB ASN A 165 -8.794 16.997 -6.955 1.00 0.00 C ATOM 930 CG ASN A 165 -9.175 17.106 -5.486 1.00 0.00 C ATOM 931 OD1 ASN A 165 -9.593 18.149 -5.005 1.00 0.00 O ATOM 932 ND2 ASN A 165 -9.077 16.036 -4.725 1.00 0.00 N ATOM 0 H ASN A 165 -8.072 14.661 -7.718 1.00 0.00 H new ATOM 0 HA ASN A 165 -10.666 16.000 -7.260 1.00 0.00 H new ATOM 0 HB2 ASN A 165 -7.752 16.686 -7.034 1.00 0.00 H new ATOM 0 HB3 ASN A 165 -8.869 17.980 -7.420 1.00 0.00 H new ATOM 0 HD21 ASN A 165 -9.349 16.082 -3.743 1.00 0.00 H new ATOM 0 HD22 ASN A 165 -8.729 15.161 -5.118 1.00 0.00 H new ATOM 939 N SER A 166 -10.693 15.515 -9.926 1.00 0.00 N ATOM 940 CA SER A 166 -11.282 15.755 -11.259 1.00 0.00 C ATOM 941 C SER A 166 -12.523 14.875 -11.481 1.00 0.00 C ATOM 942 O SER A 166 -12.685 13.872 -10.788 1.00 0.00 O ATOM 943 CB SER A 166 -10.271 15.428 -12.370 1.00 0.00 C ATOM 944 OG SER A 166 -9.075 16.183 -12.280 1.00 0.00 O ATOM 0 H SER A 166 -10.827 14.554 -9.611 1.00 0.00 H new ATOM 0 HA SER A 166 -11.559 16.808 -11.298 1.00 0.00 H new ATOM 0 HB2 SER A 166 -10.026 14.367 -12.328 1.00 0.00 H new ATOM 0 HB3 SER A 166 -10.735 15.610 -13.339 1.00 0.00 H new ATOM 0 HG SER A 166 -8.350 15.610 -11.953 1.00 0.00 H new ATOM 950 N ALA A 167 -13.351 15.159 -12.495 1.00 0.00 N ATOM 951 CA ALA A 167 -14.447 14.266 -12.902 1.00 0.00 C ATOM 952 C ALA A 167 -13.948 12.864 -13.281 1.00 0.00 C ATOM 953 O ALA A 167 -14.468 11.863 -12.792 1.00 0.00 O ATOM 954 CB ALA A 167 -15.216 14.879 -14.075 1.00 0.00 C ATOM 0 H ALA A 167 -13.282 16.009 -13.054 1.00 0.00 H new ATOM 0 HA ALA A 167 -15.109 14.156 -12.043 1.00 0.00 H new ATOM 0 HB1 ALA A 167 -16.025 14.210 -14.369 1.00 0.00 H new ATOM 0 HB2 ALA A 167 -15.631 15.841 -13.775 1.00 0.00 H new ATOM 0 HB3 ALA A 167 -14.540 15.023 -14.918 1.00 0.00 H new ATOM 960 N ASP A 168 -12.909 12.790 -14.121 1.00 0.00 N ATOM 961 CA ASP A 168 -12.272 11.529 -14.513 1.00 0.00 C ATOM 962 C ASP A 168 -11.679 10.769 -13.317 1.00 0.00 C ATOM 963 O ASP A 168 -11.741 9.545 -13.282 1.00 0.00 O ATOM 964 CB ASP A 168 -11.177 11.802 -15.551 1.00 0.00 C ATOM 965 CG ASP A 168 -11.745 12.372 -16.863 1.00 0.00 C ATOM 966 OD1 ASP A 168 -12.283 11.588 -17.685 1.00 0.00 O ATOM 967 OD2 ASP A 168 -11.643 13.605 -17.076 1.00 0.00 O ATOM 0 H ASP A 168 -12.484 13.611 -14.551 1.00 0.00 H new ATOM 0 HA ASP A 168 -13.048 10.896 -14.943 1.00 0.00 H new ATOM 0 HB2 ASP A 168 -10.453 12.503 -15.136 1.00 0.00 H new ATOM 0 HB3 ASP A 168 -10.640 10.877 -15.762 1.00 0.00 H new ATOM 972 N ALA A 169 -11.140 11.480 -12.320 1.00 0.00 N ATOM 973 CA ALA A 169 -10.593 10.895 -11.093 1.00 0.00 C ATOM 974 C ALA A 169 -11.682 10.433 -10.095 1.00 0.00 C ATOM 975 O ALA A 169 -11.526 9.400 -9.448 1.00 0.00 O ATOM 976 CB ALA A 169 -9.649 11.910 -10.454 1.00 0.00 C ATOM 0 H ALA A 169 -11.071 12.497 -12.345 1.00 0.00 H new ATOM 0 HA ALA A 169 -10.050 9.988 -11.361 1.00 0.00 H new ATOM 0 HB1 ALA A 169 -9.231 11.492 -9.538 1.00 0.00 H new ATOM 0 HB2 ALA A 169 -8.841 12.143 -11.148 1.00 0.00 H new ATOM 0 HB3 ALA A 169 -10.199 12.821 -10.219 1.00 0.00 H new ATOM 982 N ASP A 170 -12.814 11.137 -9.998 1.00 0.00 N ATOM 983 CA ASP A 170 -14.002 10.668 -9.272 1.00 0.00 C ATOM 984 C ASP A 170 -14.583 9.411 -9.933 1.00 0.00 C ATOM 985 O ASP A 170 -14.761 8.392 -9.271 1.00 0.00 O ATOM 986 CB ASP A 170 -15.053 11.779 -9.198 1.00 0.00 C ATOM 987 CG ASP A 170 -16.283 11.348 -8.382 1.00 0.00 C ATOM 988 OD1 ASP A 170 -16.187 11.276 -7.135 1.00 0.00 O ATOM 989 OD2 ASP A 170 -17.356 11.105 -8.985 1.00 0.00 O ATOM 0 H ASP A 170 -12.934 12.056 -10.424 1.00 0.00 H new ATOM 0 HA ASP A 170 -13.705 10.407 -8.256 1.00 0.00 H new ATOM 0 HB2 ASP A 170 -14.611 12.668 -8.748 1.00 0.00 H new ATOM 0 HB3 ASP A 170 -15.364 12.053 -10.206 1.00 0.00 H new ATOM 994 N ARG A 171 -14.803 9.447 -11.254 1.00 0.00 N ATOM 995 CA ARG A 171 -15.216 8.311 -12.094 1.00 0.00 C ATOM 996 C ARG A 171 -14.288 7.104 -11.935 1.00 0.00 C ATOM 997 O ARG A 171 -14.747 5.977 -11.785 1.00 0.00 O ATOM 998 CB ARG A 171 -15.296 8.804 -13.547 1.00 0.00 C ATOM 999 CG ARG A 171 -15.765 7.712 -14.522 1.00 0.00 C ATOM 1000 CD ARG A 171 -15.978 8.292 -15.928 1.00 0.00 C ATOM 1001 NE ARG A 171 -16.503 7.269 -16.853 1.00 0.00 N ATOM 1002 CZ ARG A 171 -16.909 7.448 -18.098 1.00 0.00 C ATOM 1003 NH1 ARG A 171 -16.859 8.614 -18.682 1.00 0.00 N ATOM 1004 NH2 ARG A 171 -17.380 6.451 -18.791 1.00 0.00 N ATOM 0 H ARG A 171 -14.693 10.307 -11.792 1.00 0.00 H new ATOM 0 HA ARG A 171 -16.196 7.954 -11.776 1.00 0.00 H new ATOM 0 HB2 ARG A 171 -15.980 9.651 -13.601 1.00 0.00 H new ATOM 0 HB3 ARG A 171 -14.316 9.165 -13.858 1.00 0.00 H new ATOM 0 HG2 ARG A 171 -15.026 6.912 -14.562 1.00 0.00 H new ATOM 0 HG3 ARG A 171 -16.694 7.270 -14.161 1.00 0.00 H new ATOM 0 HD2 ARG A 171 -16.672 9.131 -15.877 1.00 0.00 H new ATOM 0 HD3 ARG A 171 -15.035 8.682 -16.310 1.00 0.00 H new ATOM 0 HE ARG A 171 -16.559 6.317 -16.491 1.00 0.00 H new ATOM 0 HH11 ARG A 171 -16.498 9.423 -18.176 1.00 0.00 H new ATOM 0 HH12 ARG A 171 -17.181 8.717 -19.644 1.00 0.00 H new ATOM 0 HH21 ARG A 171 -17.438 5.522 -18.374 1.00 0.00 H new ATOM 0 HH22 ARG A 171 -17.691 6.599 -19.751 1.00 0.00 H new ATOM 1018 N ALA A 172 -12.984 7.353 -11.917 1.00 0.00 N ATOM 1019 CA ALA A 172 -11.937 6.371 -11.638 1.00 0.00 C ATOM 1020 C ALA A 172 -12.048 5.724 -10.250 1.00 0.00 C ATOM 1021 O ALA A 172 -12.138 4.501 -10.169 1.00 0.00 O ATOM 1022 CB ALA A 172 -10.584 7.036 -11.813 1.00 0.00 C ATOM 0 H ALA A 172 -12.609 8.283 -12.104 1.00 0.00 H new ATOM 0 HA ALA A 172 -12.060 5.553 -12.348 1.00 0.00 H new ATOM 0 HB1 ALA A 172 -9.794 6.313 -11.608 1.00 0.00 H new ATOM 0 HB2 ALA A 172 -10.487 7.399 -12.836 1.00 0.00 H new ATOM 0 HB3 ALA A 172 -10.498 7.874 -11.121 1.00 0.00 H new ATOM 1028 N ARG A 173 -12.078 6.513 -9.165 1.00 0.00 N ATOM 1029 CA ARG A 173 -12.429 6.058 -7.804 1.00 0.00 C ATOM 1030 C ARG A 173 -13.676 5.184 -7.848 1.00 0.00 C ATOM 1031 O ARG A 173 -13.613 4.035 -7.435 1.00 0.00 O ATOM 1032 CB ARG A 173 -12.570 7.296 -6.886 1.00 0.00 C ATOM 1033 CG ARG A 173 -13.551 7.157 -5.707 1.00 0.00 C ATOM 1034 CD ARG A 173 -13.265 8.170 -4.593 1.00 0.00 C ATOM 1035 NE ARG A 173 -13.891 7.736 -3.327 1.00 0.00 N ATOM 1036 CZ ARG A 173 -14.692 8.416 -2.532 1.00 0.00 C ATOM 1037 NH1 ARG A 173 -14.856 9.700 -2.634 1.00 0.00 N ATOM 1038 NH2 ARG A 173 -15.343 7.804 -1.587 1.00 0.00 N ATOM 0 H ARG A 173 -11.855 7.507 -9.207 1.00 0.00 H new ATOM 0 HA ARG A 173 -11.641 5.432 -7.386 1.00 0.00 H new ATOM 0 HB2 ARG A 173 -11.586 7.541 -6.486 1.00 0.00 H new ATOM 0 HB3 ARG A 173 -12.885 8.142 -7.497 1.00 0.00 H new ATOM 0 HG2 ARG A 173 -14.571 7.294 -6.067 1.00 0.00 H new ATOM 0 HG3 ARG A 173 -13.489 6.147 -5.302 1.00 0.00 H new ATOM 0 HD2 ARG A 173 -12.189 8.275 -4.456 1.00 0.00 H new ATOM 0 HD3 ARG A 173 -13.647 9.150 -4.878 1.00 0.00 H new ATOM 0 HE ARG A 173 -13.675 6.785 -3.029 1.00 0.00 H new ATOM 0 HH11 ARG A 173 -14.354 10.223 -3.352 1.00 0.00 H new ATOM 0 HH12 ARG A 173 -15.487 10.186 -1.996 1.00 0.00 H new ATOM 0 HH21 ARG A 173 -15.233 6.798 -1.461 1.00 0.00 H new ATOM 0 HH22 ARG A 173 -15.963 8.330 -0.971 1.00 0.00 H new ATOM 1052 N GLU A 174 -14.777 5.668 -8.409 1.00 0.00 N ATOM 1053 CA GLU A 174 -16.031 4.925 -8.524 1.00 0.00 C ATOM 1054 C GLU A 174 -15.912 3.606 -9.304 1.00 0.00 C ATOM 1055 O GLU A 174 -16.645 2.657 -9.009 1.00 0.00 O ATOM 1056 CB GLU A 174 -17.074 5.832 -9.184 1.00 0.00 C ATOM 1057 CG GLU A 174 -17.502 7.033 -8.335 1.00 0.00 C ATOM 1058 CD GLU A 174 -18.574 6.638 -7.303 1.00 0.00 C ATOM 1059 OE1 GLU A 174 -18.211 6.161 -6.199 1.00 0.00 O ATOM 1060 OE2 GLU A 174 -19.786 6.808 -7.584 1.00 0.00 O ATOM 0 H GLU A 174 -14.827 6.606 -8.805 1.00 0.00 H new ATOM 0 HA GLU A 174 -16.329 4.641 -7.515 1.00 0.00 H new ATOM 0 HB2 GLU A 174 -16.673 6.197 -10.130 1.00 0.00 H new ATOM 0 HB3 GLU A 174 -17.956 5.237 -9.420 1.00 0.00 H new ATOM 0 HG2 GLU A 174 -16.634 7.445 -7.820 1.00 0.00 H new ATOM 0 HG3 GLU A 174 -17.891 7.819 -8.983 1.00 0.00 H new ATOM 1067 N LYS A 175 -14.975 3.507 -10.256 1.00 0.00 N ATOM 1068 CA LYS A 175 -14.600 2.263 -10.931 1.00 0.00 C ATOM 1069 C LYS A 175 -13.775 1.354 -9.994 1.00 0.00 C ATOM 1070 O LYS A 175 -14.175 0.209 -9.777 1.00 0.00 O ATOM 1071 CB LYS A 175 -13.977 2.633 -12.299 1.00 0.00 C ATOM 1072 CG LYS A 175 -12.853 1.747 -12.840 1.00 0.00 C ATOM 1073 CD LYS A 175 -13.235 0.282 -13.098 1.00 0.00 C ATOM 1074 CE LYS A 175 -12.020 -0.516 -13.586 1.00 0.00 C ATOM 1075 NZ LYS A 175 -12.167 -1.966 -13.291 1.00 0.00 N ATOM 0 H LYS A 175 -14.444 4.313 -10.585 1.00 0.00 H new ATOM 0 HA LYS A 175 -15.458 1.632 -11.163 1.00 0.00 H new ATOM 0 HB2 LYS A 175 -14.778 2.645 -13.038 1.00 0.00 H new ATOM 0 HB3 LYS A 175 -13.594 3.651 -12.227 1.00 0.00 H new ATOM 0 HG2 LYS A 175 -12.489 2.179 -13.772 1.00 0.00 H new ATOM 0 HG3 LYS A 175 -12.024 1.769 -12.133 1.00 0.00 H new ATOM 0 HD2 LYS A 175 -13.626 -0.164 -12.183 1.00 0.00 H new ATOM 0 HD3 LYS A 175 -14.031 0.234 -13.841 1.00 0.00 H new ATOM 0 HE2 LYS A 175 -11.896 -0.373 -14.659 1.00 0.00 H new ATOM 0 HE3 LYS A 175 -11.117 -0.136 -13.108 1.00 0.00 H new ATOM 0 HZ1 LYS A 175 -11.543 -2.513 -13.918 1.00 0.00 H new ATOM 0 HZ2 LYS A 175 -11.908 -2.147 -12.300 1.00 0.00 H new ATOM 0 HZ3 LYS A 175 -13.154 -2.254 -13.449 1.00 0.00 H new ATOM 1089 N LEU A 176 -12.653 1.810 -9.424 1.00 0.00 N ATOM 1090 CA LEU A 176 -11.742 0.984 -8.649 1.00 0.00 C ATOM 1091 C LEU A 176 -12.278 0.597 -7.258 1.00 0.00 C ATOM 1092 O LEU A 176 -11.892 -0.433 -6.709 1.00 0.00 O ATOM 1093 CB LEU A 176 -10.373 1.685 -8.565 1.00 0.00 C ATOM 1094 CG LEU A 176 -9.679 2.122 -9.865 1.00 0.00 C ATOM 1095 CD1 LEU A 176 -8.234 2.522 -9.609 1.00 0.00 C ATOM 1096 CD2 LEU A 176 -9.614 1.021 -10.928 1.00 0.00 C ATOM 0 H LEU A 176 -12.354 2.783 -9.495 1.00 0.00 H new ATOM 0 HA LEU A 176 -11.636 0.033 -9.172 1.00 0.00 H new ATOM 0 HB2 LEU A 176 -10.495 2.572 -7.943 1.00 0.00 H new ATOM 0 HB3 LEU A 176 -9.693 1.016 -8.037 1.00 0.00 H new ATOM 0 HG LEU A 176 -10.286 2.953 -10.224 1.00 0.00 H new ATOM 0 HD11 LEU A 176 -7.769 2.826 -10.547 1.00 0.00 H new ATOM 0 HD12 LEU A 176 -8.206 3.353 -8.904 1.00 0.00 H new ATOM 0 HD13 LEU A 176 -7.690 1.674 -9.193 1.00 0.00 H new ATOM 0 HD21 LEU A 176 -9.111 1.402 -11.817 1.00 0.00 H new ATOM 0 HD22 LEU A 176 -9.060 0.168 -10.535 1.00 0.00 H new ATOM 0 HD23 LEU A 176 -10.625 0.708 -11.189 1.00 0.00 H new ATOM 1108 N HIS A 177 -13.219 1.366 -6.711 1.00 0.00 N ATOM 1109 CA HIS A 177 -14.047 1.076 -5.533 1.00 0.00 C ATOM 1110 C HIS A 177 -15.087 -0.013 -5.866 1.00 0.00 C ATOM 1111 O HIS A 177 -16.293 0.233 -5.960 1.00 0.00 O ATOM 1112 CB HIS A 177 -14.661 2.409 -5.071 1.00 0.00 C ATOM 1113 CG HIS A 177 -15.055 2.522 -3.636 1.00 0.00 C ATOM 1114 ND1 HIS A 177 -15.100 1.484 -2.718 1.00 0.00 N ATOM 1115 CD2 HIS A 177 -15.084 3.711 -2.976 1.00 0.00 C ATOM 1116 CE1 HIS A 177 -15.147 2.077 -1.521 1.00 0.00 C ATOM 1117 NE2 HIS A 177 -15.169 3.412 -1.636 1.00 0.00 N ATOM 0 H HIS A 177 -13.442 2.279 -7.108 1.00 0.00 H new ATOM 0 HA HIS A 177 -13.462 0.666 -4.710 1.00 0.00 H new ATOM 0 HB2 HIS A 177 -13.946 3.202 -5.288 1.00 0.00 H new ATOM 0 HB3 HIS A 177 -15.545 2.602 -5.679 1.00 0.00 H new ATOM 0 HD2 HIS A 177 -15.047 4.696 -3.417 1.00 0.00 H new ATOM 0 HE1 HIS A 177 -15.165 1.547 -0.580 1.00 0.00 H new ATOM 0 HE2 HIS A 177 -15.236 4.083 -0.871 1.00 0.00 H new ATOM 1125 N GLY A 178 -14.584 -1.217 -6.139 1.00 0.00 N ATOM 1126 CA GLY A 178 -15.270 -2.295 -6.858 1.00 0.00 C ATOM 1127 C GLY A 178 -14.384 -3.116 -7.815 1.00 0.00 C ATOM 1128 O GLY A 178 -14.887 -4.035 -8.465 1.00 0.00 O ATOM 0 H GLY A 178 -13.642 -1.482 -5.852 1.00 0.00 H new ATOM 0 HA2 GLY A 178 -15.712 -2.972 -6.128 1.00 0.00 H new ATOM 0 HA3 GLY A 178 -16.091 -1.863 -7.430 1.00 0.00 H new ATOM 1132 N THR A 179 -13.079 -2.829 -7.910 1.00 0.00 N ATOM 1133 CA THR A 179 -12.110 -3.561 -8.748 1.00 0.00 C ATOM 1134 C THR A 179 -11.635 -4.801 -8.000 1.00 0.00 C ATOM 1135 O THR A 179 -10.889 -4.707 -7.021 1.00 0.00 O ATOM 1136 CB THR A 179 -10.947 -2.646 -9.191 1.00 0.00 C ATOM 1137 OG1 THR A 179 -11.329 -2.020 -10.400 1.00 0.00 O ATOM 1138 CG2 THR A 179 -9.604 -3.289 -9.520 1.00 0.00 C ATOM 0 H THR A 179 -12.653 -2.060 -7.393 1.00 0.00 H new ATOM 0 HA THR A 179 -12.596 -3.888 -9.667 1.00 0.00 H new ATOM 0 HB THR A 179 -10.789 -2.011 -8.319 1.00 0.00 H new ATOM 0 HG1 THR A 179 -10.556 -1.558 -10.787 1.00 0.00 H new ATOM 0 HG21 THR A 179 -8.893 -2.517 -9.814 1.00 0.00 H new ATOM 0 HG22 THR A 179 -9.227 -3.814 -8.642 1.00 0.00 H new ATOM 0 HG23 THR A 179 -9.730 -3.996 -10.340 1.00 0.00 H new ATOM 1146 N VAL A 180 -12.110 -5.968 -8.448 1.00 0.00 N ATOM 1147 CA VAL A 180 -11.546 -7.282 -8.105 1.00 0.00 C ATOM 1148 C VAL A 180 -10.231 -7.482 -8.872 1.00 0.00 C ATOM 1149 O VAL A 180 -10.243 -7.481 -10.104 1.00 0.00 O ATOM 1150 CB VAL A 180 -12.510 -8.453 -8.401 1.00 0.00 C ATOM 1151 CG1 VAL A 180 -11.993 -9.746 -7.755 1.00 0.00 C ATOM 1152 CG2 VAL A 180 -13.932 -8.217 -7.877 1.00 0.00 C ATOM 0 H VAL A 180 -12.914 -6.029 -9.072 1.00 0.00 H new ATOM 0 HA VAL A 180 -11.370 -7.288 -7.029 1.00 0.00 H new ATOM 0 HB VAL A 180 -12.548 -8.532 -9.487 1.00 0.00 H new ATOM 0 HG11 VAL A 180 -12.682 -10.562 -7.972 1.00 0.00 H new ATOM 0 HG12 VAL A 180 -11.009 -9.986 -8.158 1.00 0.00 H new ATOM 0 HG13 VAL A 180 -11.920 -9.610 -6.676 1.00 0.00 H new ATOM 0 HG21 VAL A 180 -14.556 -9.077 -8.119 1.00 0.00 H new ATOM 0 HG22 VAL A 180 -13.904 -8.082 -6.796 1.00 0.00 H new ATOM 0 HG23 VAL A 180 -14.348 -7.324 -8.344 1.00 0.00 H new ATOM 1162 N VAL A 181 -9.104 -7.644 -8.170 1.00 0.00 N ATOM 1163 CA VAL A 181 -7.766 -7.826 -8.770 1.00 0.00 C ATOM 1164 C VAL A 181 -7.217 -9.250 -8.569 1.00 0.00 C ATOM 1165 O VAL A 181 -7.460 -10.097 -9.431 1.00 0.00 O ATOM 1166 CB VAL A 181 -6.838 -6.632 -8.446 1.00 0.00 C ATOM 1167 CG1 VAL A 181 -6.753 -6.260 -6.961 1.00 0.00 C ATOM 1168 CG2 VAL A 181 -5.442 -6.826 -9.038 1.00 0.00 C ATOM 0 H VAL A 181 -9.090 -7.653 -7.150 1.00 0.00 H new ATOM 0 HA VAL A 181 -7.841 -7.783 -9.857 1.00 0.00 H new ATOM 0 HB VAL A 181 -7.317 -5.780 -8.929 1.00 0.00 H new ATOM 0 HG11 VAL A 181 -6.079 -5.413 -6.836 1.00 0.00 H new ATOM 0 HG12 VAL A 181 -7.744 -5.992 -6.596 1.00 0.00 H new ATOM 0 HG13 VAL A 181 -6.375 -7.111 -6.394 1.00 0.00 H new ATOM 0 HG21 VAL A 181 -4.819 -5.967 -8.789 1.00 0.00 H new ATOM 0 HG22 VAL A 181 -4.994 -7.730 -8.626 1.00 0.00 H new ATOM 0 HG23 VAL A 181 -5.516 -6.919 -10.121 1.00 0.00 H new ATOM 1178 N GLU A 182 -6.562 -9.596 -7.452 1.00 0.00 N ATOM 1179 CA GLU A 182 -6.061 -10.968 -7.179 1.00 0.00 C ATOM 1180 C GLU A 182 -7.159 -11.914 -6.634 1.00 0.00 C ATOM 1181 O GLU A 182 -6.893 -12.821 -5.840 1.00 0.00 O ATOM 1182 CB GLU A 182 -4.858 -10.935 -6.210 1.00 0.00 C ATOM 1183 CG GLU A 182 -3.617 -10.169 -6.692 1.00 0.00 C ATOM 1184 CD GLU A 182 -2.933 -10.895 -7.867 1.00 0.00 C ATOM 1185 OE1 GLU A 182 -2.069 -11.772 -7.621 1.00 0.00 O ATOM 1186 OE2 GLU A 182 -3.254 -10.599 -9.043 1.00 0.00 O ATOM 0 H GLU A 182 -6.359 -8.935 -6.703 1.00 0.00 H new ATOM 0 HA GLU A 182 -5.738 -11.371 -8.139 1.00 0.00 H new ATOM 0 HB2 GLU A 182 -5.188 -10.494 -5.269 1.00 0.00 H new ATOM 0 HB3 GLU A 182 -4.564 -11.962 -5.995 1.00 0.00 H new ATOM 0 HG2 GLU A 182 -3.904 -9.164 -7.000 1.00 0.00 H new ATOM 0 HG3 GLU A 182 -2.911 -10.060 -5.868 1.00 0.00 H new ATOM 1193 N GLY A 183 -8.425 -11.667 -6.986 1.00 0.00 N ATOM 1194 CA GLY A 183 -9.581 -12.210 -6.265 1.00 0.00 C ATOM 1195 C GLY A 183 -9.874 -11.439 -4.968 1.00 0.00 C ATOM 1196 O GLY A 183 -10.285 -12.029 -3.963 1.00 0.00 O ATOM 0 H GLY A 183 -8.678 -11.082 -7.783 1.00 0.00 H new ATOM 0 HA2 GLY A 183 -10.458 -12.176 -6.911 1.00 0.00 H new ATOM 0 HA3 GLY A 183 -9.399 -13.258 -6.029 1.00 0.00 H new ATOM 1200 N ARG A 184 -9.630 -10.120 -4.967 1.00 0.00 N ATOM 1201 CA ARG A 184 -9.856 -9.183 -3.860 1.00 0.00 C ATOM 1202 C ARG A 184 -10.370 -7.866 -4.384 1.00 0.00 C ATOM 1203 O ARG A 184 -9.820 -7.377 -5.370 1.00 0.00 O ATOM 1204 CB ARG A 184 -8.534 -8.866 -3.157 1.00 0.00 C ATOM 1205 CG ARG A 184 -8.786 -8.568 -1.680 1.00 0.00 C ATOM 1206 CD ARG A 184 -8.748 -9.802 -0.759 1.00 0.00 C ATOM 1207 NE ARG A 184 -9.554 -10.931 -1.267 1.00 0.00 N ATOM 1208 CZ ARG A 184 -10.226 -11.836 -0.583 1.00 0.00 C ATOM 1209 NH1 ARG A 184 -10.287 -11.844 0.719 1.00 0.00 N ATOM 1210 NH2 ARG A 184 -10.863 -12.767 -1.231 1.00 0.00 N ATOM 0 H ARG A 184 -9.247 -9.653 -5.789 1.00 0.00 H new ATOM 0 HA ARG A 184 -10.570 -9.650 -3.182 1.00 0.00 H new ATOM 0 HB2 ARG A 184 -7.849 -9.709 -3.255 1.00 0.00 H new ATOM 0 HB3 ARG A 184 -8.056 -8.010 -3.633 1.00 0.00 H new ATOM 0 HG2 ARG A 184 -8.040 -7.851 -1.336 1.00 0.00 H new ATOM 0 HG3 ARG A 184 -9.759 -8.088 -1.581 1.00 0.00 H new ATOM 0 HD2 ARG A 184 -7.714 -10.127 -0.639 1.00 0.00 H new ATOM 0 HD3 ARG A 184 -9.110 -9.521 0.230 1.00 0.00 H new ATOM 0 HE ARG A 184 -9.596 -11.023 -2.282 1.00 0.00 H new ATOM 0 HH11 ARG A 184 -9.800 -11.127 1.257 1.00 0.00 H new ATOM 0 HH12 ARG A 184 -10.821 -12.567 1.200 1.00 0.00 H new ATOM 0 HH21 ARG A 184 -10.837 -12.788 -2.250 1.00 0.00 H new ATOM 0 HH22 ARG A 184 -11.388 -13.476 -0.720 1.00 0.00 H new ATOM 1224 N LYS A 185 -11.361 -7.292 -3.706 1.00 0.00 N ATOM 1225 CA LYS A 185 -12.058 -6.101 -4.179 1.00 0.00 C ATOM 1226 C LYS A 185 -11.697 -4.825 -3.416 1.00 0.00 C ATOM 1227 O LYS A 185 -12.046 -4.686 -2.242 1.00 0.00 O ATOM 1228 CB LYS A 185 -13.570 -6.381 -4.230 1.00 0.00 C ATOM 1229 CG LYS A 185 -14.289 -5.469 -5.237 1.00 0.00 C ATOM 1230 CD LYS A 185 -15.801 -5.749 -5.303 1.00 0.00 C ATOM 1231 CE LYS A 185 -16.537 -5.252 -4.054 1.00 0.00 C ATOM 1232 NZ LYS A 185 -18.003 -5.499 -4.142 1.00 0.00 N ATOM 0 H LYS A 185 -11.703 -7.641 -2.811 1.00 0.00 H new ATOM 0 HA LYS A 185 -11.713 -5.890 -5.191 1.00 0.00 H new ATOM 0 HB2 LYS A 185 -13.737 -7.423 -4.501 1.00 0.00 H new ATOM 0 HB3 LYS A 185 -13.999 -6.237 -3.239 1.00 0.00 H new ATOM 0 HG2 LYS A 185 -14.126 -4.427 -4.961 1.00 0.00 H new ATOM 0 HG3 LYS A 185 -13.852 -5.608 -6.226 1.00 0.00 H new ATOM 0 HD2 LYS A 185 -16.220 -5.266 -6.186 1.00 0.00 H new ATOM 0 HD3 LYS A 185 -15.966 -6.820 -5.417 1.00 0.00 H new ATOM 0 HE2 LYS A 185 -16.136 -5.752 -3.173 1.00 0.00 H new ATOM 0 HE3 LYS A 185 -16.355 -4.185 -3.925 1.00 0.00 H new ATOM 0 HZ1 LYS A 185 -18.466 -5.149 -3.279 1.00 0.00 H new ATOM 0 HZ2 LYS A 185 -18.390 -5.001 -4.969 1.00 0.00 H new ATOM 0 HZ3 LYS A 185 -18.178 -6.520 -4.240 1.00 0.00 H new ATOM 1246 N ILE A 186 -10.985 -3.912 -4.080 1.00 0.00 N ATOM 1247 CA ILE A 186 -10.517 -2.651 -3.475 1.00 0.00 C ATOM 1248 C ILE A 186 -11.697 -1.763 -3.032 1.00 0.00 C ATOM 1249 O ILE A 186 -12.722 -1.678 -3.710 1.00 0.00 O ATOM 1250 CB ILE A 186 -9.577 -1.880 -4.432 1.00 0.00 C ATOM 1251 CG1 ILE A 186 -8.404 -2.767 -4.900 1.00 0.00 C ATOM 1252 CG2 ILE A 186 -9.047 -0.602 -3.759 1.00 0.00 C ATOM 1253 CD1 ILE A 186 -7.332 -2.016 -5.698 1.00 0.00 C ATOM 0 H ILE A 186 -10.713 -4.022 -5.057 1.00 0.00 H new ATOM 0 HA ILE A 186 -9.946 -2.914 -2.584 1.00 0.00 H new ATOM 0 HB ILE A 186 -10.157 -1.597 -5.310 1.00 0.00 H new ATOM 0 HG12 ILE A 186 -7.938 -3.225 -4.027 1.00 0.00 H new ATOM 0 HG13 ILE A 186 -8.797 -3.577 -5.514 1.00 0.00 H new ATOM 0 HG21 ILE A 186 -8.388 -0.074 -4.448 1.00 0.00 H new ATOM 0 HG22 ILE A 186 -9.884 0.043 -3.492 1.00 0.00 H new ATOM 0 HG23 ILE A 186 -8.493 -0.868 -2.859 1.00 0.00 H new ATOM 0 HD11 ILE A 186 -6.543 -2.709 -5.990 1.00 0.00 H new ATOM 0 HD12 ILE A 186 -7.781 -1.581 -6.591 1.00 0.00 H new ATOM 0 HD13 ILE A 186 -6.908 -1.223 -5.082 1.00 0.00 H new ATOM 1265 N GLU A 187 -11.515 -1.051 -1.919 1.00 0.00 N ATOM 1266 CA GLU A 187 -12.387 -0.004 -1.385 1.00 0.00 C ATOM 1267 C GLU A 187 -11.660 1.353 -1.353 1.00 0.00 C ATOM 1268 O GLU A 187 -10.856 1.588 -0.450 1.00 0.00 O ATOM 1269 CB GLU A 187 -12.882 -0.388 0.021 1.00 0.00 C ATOM 1270 CG GLU A 187 -13.696 -1.680 0.050 1.00 0.00 C ATOM 1271 CD GLU A 187 -14.341 -1.895 1.433 1.00 0.00 C ATOM 1272 OE1 GLU A 187 -13.686 -2.472 2.333 1.00 0.00 O ATOM 1273 OE2 GLU A 187 -15.514 -1.494 1.628 1.00 0.00 O ATOM 0 H GLU A 187 -10.699 -1.201 -1.326 1.00 0.00 H new ATOM 0 HA GLU A 187 -13.250 0.093 -2.043 1.00 0.00 H new ATOM 0 HB2 GLU A 187 -12.023 -0.495 0.683 1.00 0.00 H new ATOM 0 HB3 GLU A 187 -13.491 0.424 0.417 1.00 0.00 H new ATOM 0 HG2 GLU A 187 -14.471 -1.643 -0.715 1.00 0.00 H new ATOM 0 HG3 GLU A 187 -13.052 -2.526 -0.190 1.00 0.00 H new ATOM 1280 N VAL A 188 -11.890 2.244 -2.336 1.00 0.00 N ATOM 1281 CA VAL A 188 -11.156 3.527 -2.441 1.00 0.00 C ATOM 1282 C VAL A 188 -11.895 4.676 -1.741 1.00 0.00 C ATOM 1283 O VAL A 188 -12.785 5.328 -2.283 1.00 0.00 O ATOM 1284 CB VAL A 188 -10.562 3.855 -3.844 1.00 0.00 C ATOM 1285 CG1 VAL A 188 -10.175 2.605 -4.640 1.00 0.00 C ATOM 1286 CG2 VAL A 188 -11.301 4.800 -4.761 1.00 0.00 C ATOM 0 H VAL A 188 -12.580 2.101 -3.073 1.00 0.00 H new ATOM 0 HA VAL A 188 -10.240 3.384 -1.867 1.00 0.00 H new ATOM 0 HB VAL A 188 -9.688 4.422 -3.523 1.00 0.00 H new ATOM 0 HG11 VAL A 188 -9.768 2.901 -5.607 1.00 0.00 H new ATOM 0 HG12 VAL A 188 -9.424 2.040 -4.088 1.00 0.00 H new ATOM 0 HG13 VAL A 188 -11.057 1.983 -4.793 1.00 0.00 H new ATOM 0 HG21 VAL A 188 -10.745 4.913 -5.692 1.00 0.00 H new ATOM 0 HG22 VAL A 188 -12.291 4.398 -4.976 1.00 0.00 H new ATOM 0 HG23 VAL A 188 -11.401 5.772 -4.278 1.00 0.00 H new ATOM 1296 N ASN A 189 -11.579 4.889 -0.470 1.00 0.00 N ATOM 1297 CA ASN A 189 -12.224 5.896 0.367 1.00 0.00 C ATOM 1298 C ASN A 189 -11.504 7.243 0.270 1.00 0.00 C ATOM 1299 O ASN A 189 -10.275 7.306 0.266 1.00 0.00 O ATOM 1300 CB ASN A 189 -12.199 5.434 1.820 1.00 0.00 C ATOM 1301 CG ASN A 189 -12.811 4.062 2.024 1.00 0.00 C ATOM 1302 OD1 ASN A 189 -13.947 3.797 1.653 1.00 0.00 O ATOM 1303 ND2 ASN A 189 -12.073 3.142 2.600 1.00 0.00 N ATOM 0 H ASN A 189 -10.856 4.359 0.017 1.00 0.00 H new ATOM 0 HA ASN A 189 -13.249 6.020 0.018 1.00 0.00 H new ATOM 0 HB2 ASN A 189 -11.167 5.420 2.172 1.00 0.00 H new ATOM 0 HB3 ASN A 189 -12.735 6.158 2.433 1.00 0.00 H new ATOM 0 HD21 ASN A 189 -12.446 2.203 2.740 1.00 0.00 H new ATOM 0 HD22 ASN A 189 -11.127 3.366 2.908 1.00 0.00 H new ATOM 1310 N ASN A 190 -12.258 8.340 0.298 1.00 0.00 N ATOM 1311 CA ASN A 190 -11.663 9.669 0.456 1.00 0.00 C ATOM 1312 C ASN A 190 -10.861 9.738 1.785 1.00 0.00 C ATOM 1313 O ASN A 190 -11.172 9.018 2.745 1.00 0.00 O ATOM 1314 CB ASN A 190 -12.788 10.718 0.386 1.00 0.00 C ATOM 1315 CG ASN A 190 -12.332 12.120 0.757 1.00 0.00 C ATOM 1316 OD1 ASN A 190 -12.688 12.653 1.800 1.00 0.00 O ATOM 1317 ND2 ASN A 190 -11.525 12.756 -0.056 1.00 0.00 N ATOM 0 H ASN A 190 -13.275 8.338 0.214 1.00 0.00 H new ATOM 0 HA ASN A 190 -10.954 9.876 -0.346 1.00 0.00 H new ATOM 0 HB2 ASN A 190 -13.198 10.733 -0.624 1.00 0.00 H new ATOM 0 HB3 ASN A 190 -13.596 10.418 1.054 1.00 0.00 H new ATOM 0 HD21 ASN A 190 -11.196 13.692 0.181 1.00 0.00 H new ATOM 0 HD22 ASN A 190 -11.226 12.315 -0.926 1.00 0.00 H new ATOM 1324 N ALA A 191 -9.813 10.564 1.858 1.00 0.00 N ATOM 1325 CA ALA A 191 -8.894 10.544 2.997 1.00 0.00 C ATOM 1326 C ALA A 191 -9.111 11.629 4.063 1.00 0.00 C ATOM 1327 O ALA A 191 -9.808 12.629 3.867 1.00 0.00 O ATOM 1328 CB ALA A 191 -7.453 10.563 2.487 1.00 0.00 C ATOM 0 H ALA A 191 -9.581 11.253 1.143 1.00 0.00 H new ATOM 0 HA ALA A 191 -9.114 9.617 3.526 1.00 0.00 H new ATOM 0 HB1 ALA A 191 -6.767 10.548 3.334 1.00 0.00 H new ATOM 0 HB2 ALA A 191 -7.277 9.688 1.862 1.00 0.00 H new ATOM 0 HB3 ALA A 191 -7.286 11.467 1.901 1.00 0.00 H new ATOM 1334 N THR A 192 -8.418 11.422 5.181 1.00 0.00 N ATOM 1335 CA THR A 192 -8.202 12.342 6.301 1.00 0.00 C ATOM 1336 C THR A 192 -6.715 12.301 6.680 1.00 0.00 C ATOM 1337 O THR A 192 -6.043 11.341 6.305 1.00 0.00 O ATOM 1338 CB THR A 192 -9.149 11.921 7.439 1.00 0.00 C ATOM 1339 OG1 THR A 192 -9.630 13.064 8.110 1.00 0.00 O ATOM 1340 CG2 THR A 192 -8.594 10.955 8.462 1.00 0.00 C ATOM 0 H THR A 192 -7.952 10.529 5.342 1.00 0.00 H new ATOM 0 HA THR A 192 -8.432 13.378 6.053 1.00 0.00 H new ATOM 0 HB THR A 192 -9.940 11.371 6.929 1.00 0.00 H new ATOM 0 HG1 THR A 192 -10.233 12.790 8.832 1.00 0.00 H new ATOM 0 HG21 THR A 192 -9.357 10.738 9.209 1.00 0.00 H new ATOM 0 HG22 THR A 192 -8.298 10.030 7.966 1.00 0.00 H new ATOM 0 HG23 THR A 192 -7.726 11.400 8.949 1.00 0.00 H new