USER MOD reduce.3.24.130724 H: found=0, std=0, add=900, rem=0, adj=42 USER MOD reduce.3.24.130724 removed 901 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 822 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 823 LYS NZ :NH3+ -176:sc= -2.15! (180deg=-2.18!) USER MOD Set 2.1: A 798 ASN : amide:sc= -7.33! C(o=-14!,f=-16!) USER MOD Set 2.2: A 799 CYS SG : rot -151:sc= -6.66! USER MOD Set 3.1: A 789 MET CE :methyl -147:sc= -9! (180deg=-10.2!) USER MOD Set 3.2: A 793 GLN :FLIP amide:sc= -2.23 F(o=-17!,f=-11) USER MOD Set 4.1: A 773 MET CE :methyl -123:sc= -11.1! (180deg=-12.5!) USER MOD Set 4.2: A 782 TYR OH : rot -27:sc= -6.33! USER MOD Set 5.1: A 744 SER OG : rot -44:sc= 0.209 USER MOD Set 5.2: A 812 CYS SG : rot 94:sc= 0.037! USER MOD Set 6.1: A 729 TYR OH : rot 165:sc= 0.623 USER MOD Set 6.2: A 733 LYS NZ :NH3+ -164:sc= 0.692 (180deg=0) USER MOD Single : A 727 GLN : amide:sc= -1.44 K(o=-1.4,f=-7!) USER MOD Single : A 730 SER OG : rot 180:sc= 0 USER MOD Single : A 731 THR OG1 : rot 100:sc= 1.16 USER MOD Single : A 734 SER OG : rot 180:sc= 0 USER MOD Single : A 737 GLN : amide:sc= -0.0138 K(o=-0.014,f=-0.98) USER MOD Single : A 738 GLN :FLIP amide:sc= -2.14 F(o=-6.5!,f=-2.1) USER MOD Single : A 740 LYS NZ :NH3+ -168:sc= 0 (180deg=-0.178) USER MOD Single : A 741 SER OG : rot -29:sc= 0.135 USER MOD Single : A 742 HIS : no HD1:sc= -8.87! C(o=-8.9!,f=-18!) USER MOD Single : A 743 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 749 MET CE :methyl -125:sc= -3.54! (180deg=-7.6!) USER MOD Single : A 753 LYS NZ :NH3+ 165:sc= -0.0876 (180deg=-0.428) USER MOD Single : A 755 THR OG1 : rot 180:sc= 0 USER MOD Single : A 760 TYR OH : rot 50:sc= -0.62 USER MOD Single : A 761 TYR OH : rot 180:sc= 0 USER MOD Single : A 768 MET CE :methyl 163:sc= -7.5! (180deg=-9.01!) USER MOD Single : A 771 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0339) USER MOD Single : A 772 THR OG1 : rot 180:sc= 0 USER MOD Single : A 774 SER OG : rot -13:sc= -0.499 USER MOD Single : A 778 LYS NZ :NH3+ -171:sc= -6.24! (180deg=-6.75!) USER MOD Single : A 779 ASN :FLIP amide:sc= -4.26! C(o=-8.1!,f=-4.3!) USER MOD Single : A 781 TYR OH : rot 180:sc= -0.849 USER MOD Single : A 784 SER OG : rot 46:sc= 0.308 USER MOD Single : A 785 LYS NZ :NH3+ 171:sc= -0.0131 (180deg=-0.122) USER MOD Single : A 786 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 797 THR OG1 : rot -62:sc= 1.23 USER MOD Single : A 800 LYS NZ :NH3+ -175:sc= -0.269 (180deg=-0.348) USER MOD Single : A 802 TYR OH : rot 0:sc= -1.79! USER MOD Single : A 803 ASN :FLIP amide:sc= -1.14 F(o=-1.9,f=-1.1) USER MOD Single : A 807 SER OG : rot -75:sc= 1.55 USER MOD Single : A 809 TYR OH : rot 180:sc= 0 USER MOD Single : A 810 TYR OH : rot 180:sc= 0 USER MOD Single : A 811 LYS NZ :NH3+ -118:sc= -1.35! (180deg=-3.37!) USER MOD Single : A 814 ASN :FLIP amide:sc= -0.106 F(o=-1.2!,f=-0.11) USER MOD Single : A 818 LYS NZ :NH3+ 164:sc= 0 (180deg=-0.0987) USER MOD Single : A 825 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0507) USER MOD ----------------------------------------------------------------- ATOM 142 N ASP A 724 -18.949 -5.721 0.964 1.00 0.00 N ATOM 143 CA ASP A 724 -19.034 -6.980 0.227 1.00 0.00 C ATOM 144 C ASP A 724 -17.769 -7.241 -0.580 1.00 0.00 C ATOM 145 O ASP A 724 -17.231 -6.357 -1.246 1.00 0.00 O ATOM 146 CB ASP A 724 -20.265 -7.012 -0.675 1.00 0.00 C ATOM 147 CG ASP A 724 -20.301 -8.215 -1.595 1.00 0.00 C ATOM 148 OD1 ASP A 724 -20.696 -9.305 -1.131 1.00 0.00 O ATOM 149 OD2 ASP A 724 -19.951 -8.064 -2.780 1.00 0.00 O ATOM 0 HA ASP A 724 -19.132 -7.778 0.962 1.00 0.00 H new ATOM 0 HB2 ASP A 724 -21.162 -7.010 -0.055 1.00 0.00 H new ATOM 0 HB3 ASP A 724 -20.291 -6.103 -1.276 1.00 0.00 H new ATOM 154 N PRO A 725 -17.298 -8.489 -0.513 1.00 0.00 N ATOM 155 CA PRO A 725 -16.087 -8.943 -1.190 1.00 0.00 C ATOM 156 C PRO A 725 -16.135 -8.796 -2.707 1.00 0.00 C ATOM 157 O PRO A 725 -15.094 -8.776 -3.355 1.00 0.00 O ATOM 158 CB PRO A 725 -15.981 -10.424 -0.807 1.00 0.00 C ATOM 159 CG PRO A 725 -17.325 -10.802 -0.298 1.00 0.00 C ATOM 160 CD PRO A 725 -17.932 -9.557 0.254 1.00 0.00 C ATOM 0 HA PRO A 725 -15.232 -8.340 -0.886 1.00 0.00 H new ATOM 0 HB2 PRO A 725 -15.702 -11.032 -1.667 1.00 0.00 H new ATOM 0 HB3 PRO A 725 -15.216 -10.578 -0.046 1.00 0.00 H new ATOM 0 HG2 PRO A 725 -17.941 -11.213 -1.097 1.00 0.00 H new ATOM 0 HG3 PRO A 725 -17.247 -11.570 0.471 1.00 0.00 H new ATOM 0 HD2 PRO A 725 -19.015 -9.551 0.129 1.00 0.00 H new ATOM 0 HD3 PRO A 725 -17.734 -9.455 1.321 1.00 0.00 H new ATOM 168 N ASP A 726 -17.334 -8.705 -3.272 1.00 0.00 N ATOM 169 CA ASP A 726 -17.478 -8.567 -4.719 1.00 0.00 C ATOM 170 C ASP A 726 -17.540 -7.101 -5.122 1.00 0.00 C ATOM 171 O ASP A 726 -16.804 -6.676 -6.014 1.00 0.00 O ATOM 172 CB ASP A 726 -18.722 -9.306 -5.217 1.00 0.00 C ATOM 173 CG ASP A 726 -18.924 -9.155 -6.713 1.00 0.00 C ATOM 174 OD1 ASP A 726 -18.307 -9.927 -7.476 1.00 0.00 O ATOM 175 OD2 ASP A 726 -19.699 -8.265 -7.120 1.00 0.00 O ATOM 0 H ASP A 726 -18.214 -8.724 -2.757 1.00 0.00 H new ATOM 0 HA ASP A 726 -16.600 -9.016 -5.184 1.00 0.00 H new ATOM 0 HB2 ASP A 726 -18.636 -10.364 -4.970 1.00 0.00 H new ATOM 0 HB3 ASP A 726 -19.600 -8.927 -4.694 1.00 0.00 H new ATOM 180 N GLN A 727 -18.417 -6.321 -4.481 1.00 0.00 N ATOM 181 CA GLN A 727 -18.503 -4.905 -4.806 1.00 0.00 C ATOM 182 C GLN A 727 -17.116 -4.313 -4.702 1.00 0.00 C ATOM 183 O GLN A 727 -16.684 -3.559 -5.560 1.00 0.00 O ATOM 184 CB GLN A 727 -19.466 -4.148 -3.904 1.00 0.00 C ATOM 185 CG GLN A 727 -20.805 -4.821 -3.758 1.00 0.00 C ATOM 186 CD GLN A 727 -21.703 -4.144 -2.740 1.00 0.00 C ATOM 187 OE1 GLN A 727 -21.682 -4.476 -1.556 1.00 0.00 O ATOM 188 NE2 GLN A 727 -22.504 -3.189 -3.200 1.00 0.00 N ATOM 0 H GLN A 727 -19.058 -6.640 -3.755 1.00 0.00 H new ATOM 0 HA GLN A 727 -18.896 -4.809 -5.818 1.00 0.00 H new ATOM 0 HB2 GLN A 727 -19.015 -4.035 -2.918 1.00 0.00 H new ATOM 0 HB3 GLN A 727 -19.614 -3.145 -4.304 1.00 0.00 H new ATOM 0 HG2 GLN A 727 -21.307 -4.832 -4.726 1.00 0.00 H new ATOM 0 HG3 GLN A 727 -20.653 -5.860 -3.466 1.00 0.00 H new ATOM 0 HE21 GLN A 727 -22.490 -2.944 -4.190 1.00 0.00 H new ATOM 0 HE22 GLN A 727 -23.133 -2.700 -2.563 1.00 0.00 H new ATOM 197 N LEU A 728 -16.414 -4.725 -3.652 1.00 0.00 N ATOM 198 CA LEU A 728 -15.057 -4.283 -3.389 1.00 0.00 C ATOM 199 C LEU A 728 -14.098 -4.879 -4.388 1.00 0.00 C ATOM 200 O LEU A 728 -13.400 -4.162 -5.082 1.00 0.00 O ATOM 201 CB LEU A 728 -14.678 -4.695 -1.982 1.00 0.00 C ATOM 202 CG LEU A 728 -15.379 -3.887 -0.920 1.00 0.00 C ATOM 203 CD1 LEU A 728 -15.086 -4.434 0.459 1.00 0.00 C ATOM 204 CD2 LEU A 728 -14.969 -2.446 -1.059 1.00 0.00 C ATOM 0 H LEU A 728 -16.776 -5.379 -2.958 1.00 0.00 H new ATOM 0 HA LEU A 728 -15.003 -3.199 -3.484 1.00 0.00 H new ATOM 0 HB2 LEU A 728 -14.914 -5.750 -1.843 1.00 0.00 H new ATOM 0 HB3 LEU A 728 -13.600 -4.591 -1.857 1.00 0.00 H new ATOM 0 HG LEU A 728 -16.459 -3.956 -1.053 1.00 0.00 H new ATOM 0 HD11 LEU A 728 -15.604 -3.833 1.206 1.00 0.00 H new ATOM 0 HD12 LEU A 728 -15.430 -5.466 0.522 1.00 0.00 H new ATOM 0 HD13 LEU A 728 -14.012 -4.398 0.644 1.00 0.00 H new ATOM 0 HD21 LEU A 728 -15.470 -1.850 -0.296 1.00 0.00 H new ATOM 0 HD22 LEU A 728 -13.889 -2.361 -0.935 1.00 0.00 H new ATOM 0 HD23 LEU A 728 -15.251 -2.081 -2.047 1.00 0.00 H new ATOM 216 N TYR A 729 -14.097 -6.192 -4.487 1.00 0.00 N ATOM 217 CA TYR A 729 -13.216 -6.863 -5.417 1.00 0.00 C ATOM 218 C TYR A 729 -13.056 -6.044 -6.673 1.00 0.00 C ATOM 219 O TYR A 729 -11.963 -5.574 -6.963 1.00 0.00 O ATOM 220 CB TYR A 729 -13.798 -8.231 -5.761 1.00 0.00 C ATOM 221 CG TYR A 729 -13.500 -8.719 -7.151 1.00 0.00 C ATOM 222 CD1 TYR A 729 -12.206 -8.879 -7.524 1.00 0.00 C ATOM 223 CD2 TYR A 729 -14.498 -9.040 -8.063 1.00 0.00 C ATOM 224 CE1 TYR A 729 -11.856 -9.341 -8.766 1.00 0.00 C ATOM 225 CE2 TYR A 729 -14.174 -9.505 -9.326 1.00 0.00 C ATOM 226 CZ TYR A 729 -12.846 -9.656 -9.674 1.00 0.00 C ATOM 227 OH TYR A 729 -12.510 -10.123 -10.923 1.00 0.00 O ATOM 0 H TYR A 729 -14.693 -6.812 -3.938 1.00 0.00 H new ATOM 0 HA TYR A 729 -12.236 -6.986 -4.957 1.00 0.00 H new ATOM 0 HB2 TYR A 729 -13.417 -8.961 -5.047 1.00 0.00 H new ATOM 0 HB3 TYR A 729 -14.879 -8.192 -5.630 1.00 0.00 H new ATOM 0 HD1 TYR A 729 -11.425 -8.634 -6.819 1.00 0.00 H new ATOM 0 HD2 TYR A 729 -15.535 -8.926 -7.784 1.00 0.00 H new ATOM 0 HE1 TYR A 729 -10.816 -9.457 -9.031 1.00 0.00 H new ATOM 0 HE2 TYR A 729 -14.953 -9.748 -10.033 1.00 0.00 H new ATOM 0 HH TYR A 729 -13.299 -10.520 -11.347 1.00 0.00 H new ATOM 237 N SER A 730 -14.133 -5.810 -7.391 1.00 0.00 N ATOM 238 CA SER A 730 -13.999 -5.051 -8.604 1.00 0.00 C ATOM 239 C SER A 730 -14.053 -3.546 -8.391 1.00 0.00 C ATOM 240 O SER A 730 -13.632 -2.788 -9.265 1.00 0.00 O ATOM 241 CB SER A 730 -14.904 -5.540 -9.706 1.00 0.00 C ATOM 242 OG SER A 730 -15.474 -4.463 -10.431 1.00 0.00 O ATOM 0 H SER A 730 -15.077 -6.123 -7.164 1.00 0.00 H new ATOM 0 HA SER A 730 -12.985 -5.242 -8.956 1.00 0.00 H new ATOM 0 HB2 SER A 730 -14.339 -6.178 -10.386 1.00 0.00 H new ATOM 0 HB3 SER A 730 -15.698 -6.153 -9.280 1.00 0.00 H new ATOM 0 HG SER A 730 -16.053 -4.815 -11.138 1.00 0.00 H new ATOM 248 N THR A 731 -14.570 -3.092 -7.248 1.00 0.00 N ATOM 249 CA THR A 731 -14.562 -1.658 -6.984 1.00 0.00 C ATOM 250 C THR A 731 -13.121 -1.297 -6.934 1.00 0.00 C ATOM 251 O THR A 731 -12.603 -0.523 -7.734 1.00 0.00 O ATOM 252 CB THR A 731 -15.216 -1.277 -5.638 1.00 0.00 C ATOM 253 OG1 THR A 731 -16.630 -1.118 -5.809 1.00 0.00 O ATOM 254 CG2 THR A 731 -14.629 0.015 -5.073 1.00 0.00 C ATOM 0 H THR A 731 -14.984 -3.672 -6.518 1.00 0.00 H new ATOM 0 HA THR A 731 -15.134 -1.135 -7.751 1.00 0.00 H new ATOM 0 HB THR A 731 -15.013 -2.083 -4.933 1.00 0.00 H new ATOM 0 HG1 THR A 731 -17.090 -1.928 -5.503 1.00 0.00 H new ATOM 0 HG21 THR A 731 -15.114 0.251 -4.126 1.00 0.00 H new ATOM 0 HG22 THR A 731 -13.559 -0.112 -4.911 1.00 0.00 H new ATOM 0 HG23 THR A 731 -14.795 0.829 -5.778 1.00 0.00 H new ATOM 262 N LEU A 732 -12.496 -1.939 -5.984 1.00 0.00 N ATOM 263 CA LEU A 732 -11.097 -1.838 -5.749 1.00 0.00 C ATOM 264 C LEU A 732 -10.335 -2.200 -7.017 1.00 0.00 C ATOM 265 O LEU A 732 -9.272 -1.652 -7.287 1.00 0.00 O ATOM 266 CB LEU A 732 -10.725 -2.805 -4.651 1.00 0.00 C ATOM 267 CG LEU A 732 -11.636 -2.877 -3.428 1.00 0.00 C ATOM 268 CD1 LEU A 732 -11.445 -4.209 -2.768 1.00 0.00 C ATOM 269 CD2 LEU A 732 -11.313 -1.775 -2.460 1.00 0.00 C ATOM 0 H LEU A 732 -12.971 -2.566 -5.335 1.00 0.00 H new ATOM 0 HA LEU A 732 -10.843 -0.819 -5.459 1.00 0.00 H new ATOM 0 HB2 LEU A 732 -10.670 -3.802 -5.087 1.00 0.00 H new ATOM 0 HB3 LEU A 732 -9.722 -2.552 -4.307 1.00 0.00 H new ATOM 0 HG LEU A 732 -12.673 -2.758 -3.741 1.00 0.00 H new ATOM 0 HD11 LEU A 732 -12.089 -4.277 -1.892 1.00 0.00 H new ATOM 0 HD12 LEU A 732 -11.702 -5.003 -3.469 1.00 0.00 H new ATOM 0 HD13 LEU A 732 -10.404 -4.318 -2.462 1.00 0.00 H new ATOM 0 HD21 LEU A 732 -11.974 -1.845 -1.596 1.00 0.00 H new ATOM 0 HD22 LEU A 732 -10.277 -1.869 -2.134 1.00 0.00 H new ATOM 0 HD23 LEU A 732 -11.453 -0.810 -2.947 1.00 0.00 H new ATOM 281 N LYS A 733 -10.886 -3.137 -7.794 1.00 0.00 N ATOM 282 CA LYS A 733 -10.248 -3.556 -9.041 1.00 0.00 C ATOM 283 C LYS A 733 -10.013 -2.335 -9.897 1.00 0.00 C ATOM 284 O LYS A 733 -9.077 -2.281 -10.684 1.00 0.00 O ATOM 285 CB LYS A 733 -11.115 -4.577 -9.783 1.00 0.00 C ATOM 286 CG LYS A 733 -10.536 -5.073 -11.093 1.00 0.00 C ATOM 287 CD LYS A 733 -10.921 -6.520 -11.360 1.00 0.00 C ATOM 288 CE LYS A 733 -12.359 -6.646 -11.808 1.00 0.00 C ATOM 289 NZ LYS A 733 -12.553 -7.785 -12.748 1.00 0.00 N ATOM 0 H LYS A 733 -11.763 -3.614 -7.583 1.00 0.00 H new ATOM 0 HA LYS A 733 -9.296 -4.038 -8.818 1.00 0.00 H new ATOM 0 HB2 LYS A 733 -11.283 -5.433 -9.129 1.00 0.00 H new ATOM 0 HB3 LYS A 733 -12.090 -4.130 -9.979 1.00 0.00 H new ATOM 0 HG2 LYS A 733 -10.890 -4.444 -11.910 1.00 0.00 H new ATOM 0 HG3 LYS A 733 -9.450 -4.983 -11.069 1.00 0.00 H new ATOM 0 HD2 LYS A 733 -10.265 -6.935 -12.125 1.00 0.00 H new ATOM 0 HD3 LYS A 733 -10.769 -7.109 -10.456 1.00 0.00 H new ATOM 0 HE2 LYS A 733 -13.000 -6.782 -10.937 1.00 0.00 H new ATOM 0 HE3 LYS A 733 -12.671 -5.720 -12.291 1.00 0.00 H new ATOM 0 HZ1 LYS A 733 -13.465 -7.680 -13.237 1.00 0.00 H new ATOM 0 HZ2 LYS A 733 -11.784 -7.792 -13.448 1.00 0.00 H new ATOM 0 HZ3 LYS A 733 -12.546 -8.679 -12.216 1.00 0.00 H new ATOM 303 N SER A 734 -10.858 -1.339 -9.689 1.00 0.00 N ATOM 304 CA SER A 734 -10.772 -0.092 -10.424 1.00 0.00 C ATOM 305 C SER A 734 -9.812 0.846 -9.722 1.00 0.00 C ATOM 306 O SER A 734 -8.918 1.401 -10.360 1.00 0.00 O ATOM 307 CB SER A 734 -12.151 0.551 -10.556 1.00 0.00 C ATOM 308 OG SER A 734 -12.955 -0.148 -11.490 1.00 0.00 O ATOM 0 H SER A 734 -11.618 -1.373 -9.010 1.00 0.00 H new ATOM 0 HA SER A 734 -10.399 -0.297 -11.428 1.00 0.00 H new ATOM 0 HB2 SER A 734 -12.644 0.562 -9.584 1.00 0.00 H new ATOM 0 HB3 SER A 734 -12.043 1.589 -10.871 1.00 0.00 H new ATOM 0 HG SER A 734 -13.833 0.284 -11.554 1.00 0.00 H new ATOM 314 N ILE A 735 -9.996 1.040 -8.409 1.00 0.00 N ATOM 315 CA ILE A 735 -9.082 1.884 -7.673 1.00 0.00 C ATOM 316 C ILE A 735 -7.686 1.415 -7.987 1.00 0.00 C ATOM 317 O ILE A 735 -6.917 2.133 -8.601 1.00 0.00 O ATOM 318 CB ILE A 735 -9.328 1.867 -6.155 1.00 0.00 C ATOM 319 CG1 ILE A 735 -10.708 2.426 -5.887 1.00 0.00 C ATOM 320 CG2 ILE A 735 -8.279 2.719 -5.438 1.00 0.00 C ATOM 321 CD1 ILE A 735 -11.788 1.402 -5.923 1.00 0.00 C ATOM 0 H ILE A 735 -10.751 0.631 -7.859 1.00 0.00 H new ATOM 0 HA ILE A 735 -9.236 2.918 -7.980 1.00 0.00 H new ATOM 0 HB ILE A 735 -9.255 0.845 -5.783 1.00 0.00 H new ATOM 0 HG12 ILE A 735 -10.711 2.909 -4.910 1.00 0.00 H new ATOM 0 HG13 ILE A 735 -10.927 3.198 -6.625 1.00 0.00 H new ATOM 0 HG21 ILE A 735 -8.465 2.698 -4.364 1.00 0.00 H new ATOM 0 HG22 ILE A 735 -7.285 2.320 -5.642 1.00 0.00 H new ATOM 0 HG23 ILE A 735 -8.338 3.747 -5.796 1.00 0.00 H new ATOM 0 HD11 ILE A 735 -12.748 1.878 -5.722 1.00 0.00 H new ATOM 0 HD12 ILE A 735 -11.814 0.935 -6.908 1.00 0.00 H new ATOM 0 HD13 ILE A 735 -11.594 0.642 -5.166 1.00 0.00 H new ATOM 333 N LEU A 736 -7.400 0.173 -7.612 1.00 0.00 N ATOM 334 CA LEU A 736 -6.112 -0.437 -7.891 1.00 0.00 C ATOM 335 C LEU A 736 -5.680 -0.096 -9.298 1.00 0.00 C ATOM 336 O LEU A 736 -4.654 0.539 -9.512 1.00 0.00 O ATOM 337 CB LEU A 736 -6.214 -1.958 -7.762 1.00 0.00 C ATOM 338 CG LEU A 736 -5.179 -2.588 -6.860 1.00 0.00 C ATOM 339 CD1 LEU A 736 -5.429 -4.058 -6.813 1.00 0.00 C ATOM 340 CD2 LEU A 736 -3.780 -2.257 -7.307 1.00 0.00 C ATOM 0 H LEU A 736 -8.050 -0.432 -7.111 1.00 0.00 H new ATOM 0 HA LEU A 736 -5.383 -0.056 -7.176 1.00 0.00 H new ATOM 0 HB2 LEU A 736 -7.205 -2.211 -7.386 1.00 0.00 H new ATOM 0 HB3 LEU A 736 -6.127 -2.399 -8.755 1.00 0.00 H new ATOM 0 HG LEU A 736 -5.268 -2.181 -5.853 1.00 0.00 H new ATOM 0 HD11 LEU A 736 -4.691 -4.532 -6.166 1.00 0.00 H new ATOM 0 HD12 LEU A 736 -6.429 -4.245 -6.421 1.00 0.00 H new ATOM 0 HD13 LEU A 736 -5.350 -4.473 -7.818 1.00 0.00 H new ATOM 0 HD21 LEU A 736 -3.062 -2.727 -6.635 1.00 0.00 H new ATOM 0 HD22 LEU A 736 -3.625 -2.628 -8.320 1.00 0.00 H new ATOM 0 HD23 LEU A 736 -3.639 -1.176 -7.290 1.00 0.00 H new ATOM 352 N GLN A 737 -6.504 -0.519 -10.243 1.00 0.00 N ATOM 353 CA GLN A 737 -6.268 -0.278 -11.660 1.00 0.00 C ATOM 354 C GLN A 737 -5.816 1.156 -11.914 1.00 0.00 C ATOM 355 O GLN A 737 -5.014 1.419 -12.807 1.00 0.00 O ATOM 356 CB GLN A 737 -7.553 -0.581 -12.438 1.00 0.00 C ATOM 357 CG GLN A 737 -7.600 -1.981 -13.019 1.00 0.00 C ATOM 358 CD GLN A 737 -8.779 -2.189 -13.950 1.00 0.00 C ATOM 359 OE1 GLN A 737 -9.244 -1.252 -14.600 1.00 0.00 O ATOM 360 NE2 GLN A 737 -9.268 -3.422 -14.021 1.00 0.00 N ATOM 0 H GLN A 737 -7.359 -1.041 -10.050 1.00 0.00 H new ATOM 0 HA GLN A 737 -5.467 -0.935 -12.000 1.00 0.00 H new ATOM 0 HB2 GLN A 737 -8.408 -0.443 -11.777 1.00 0.00 H new ATOM 0 HB3 GLN A 737 -7.656 0.142 -13.247 1.00 0.00 H new ATOM 0 HG2 GLN A 737 -6.675 -2.176 -13.562 1.00 0.00 H new ATOM 0 HG3 GLN A 737 -7.652 -2.706 -12.206 1.00 0.00 H new ATOM 0 HE21 GLN A 737 -8.852 -4.169 -13.465 1.00 0.00 H new ATOM 0 HE22 GLN A 737 -10.060 -3.622 -14.632 1.00 0.00 H new ATOM 369 N GLN A 738 -6.319 2.068 -11.099 1.00 0.00 N ATOM 370 CA GLN A 738 -6.000 3.485 -11.223 1.00 0.00 C ATOM 371 C GLN A 738 -4.704 3.864 -10.496 1.00 0.00 C ATOM 372 O GLN A 738 -3.791 4.430 -11.098 1.00 0.00 O ATOM 373 CB GLN A 738 -7.162 4.301 -10.667 1.00 0.00 C ATOM 374 CG GLN A 738 -8.412 4.199 -11.516 1.00 0.00 C ATOM 375 CD GLN A 738 -9.643 4.720 -10.804 1.00 0.00 C ATOM 376 OE1 GLN A 738 -9.675 4.550 -9.487 1.00 0.00 O flip ATOM 377 NE2 GLN A 738 -10.555 5.260 -11.428 1.00 0.00 N flip ATOM 0 H GLN A 738 -6.958 1.851 -10.334 1.00 0.00 H new ATOM 0 HA GLN A 738 -5.845 3.702 -12.280 1.00 0.00 H new ATOM 0 HB2 GLN A 738 -7.387 3.962 -9.656 1.00 0.00 H new ATOM 0 HB3 GLN A 738 -6.863 5.347 -10.593 1.00 0.00 H new ATOM 0 HG2 GLN A 738 -8.266 4.759 -12.439 1.00 0.00 H new ATOM 0 HG3 GLN A 738 -8.572 3.158 -11.797 1.00 0.00 H new ATOM 0 HE21 GLN A 738 -10.486 5.369 -12.440 1.00 0.00 H new ATOM 0 HE22 GLN A 738 -11.380 5.599 -10.934 1.00 0.00 H new ATOM 386 N VAL A 739 -4.637 3.553 -9.204 1.00 0.00 N ATOM 387 CA VAL A 739 -3.487 3.860 -8.377 1.00 0.00 C ATOM 388 C VAL A 739 -2.233 3.290 -8.993 1.00 0.00 C ATOM 389 O VAL A 739 -1.160 3.861 -8.866 1.00 0.00 O ATOM 390 CB VAL A 739 -3.652 3.288 -6.948 1.00 0.00 C ATOM 391 CG1 VAL A 739 -5.089 2.947 -6.630 1.00 0.00 C ATOM 392 CG2 VAL A 739 -2.752 2.097 -6.756 1.00 0.00 C ATOM 0 H VAL A 739 -5.388 3.077 -8.704 1.00 0.00 H new ATOM 0 HA VAL A 739 -3.409 4.945 -8.314 1.00 0.00 H new ATOM 0 HB VAL A 739 -3.356 4.066 -6.245 1.00 0.00 H new ATOM 0 HG11 VAL A 739 -5.153 2.550 -5.617 1.00 0.00 H new ATOM 0 HG12 VAL A 739 -5.702 3.845 -6.707 1.00 0.00 H new ATOM 0 HG13 VAL A 739 -5.451 2.200 -7.336 1.00 0.00 H new ATOM 0 HG21 VAL A 739 -2.878 1.705 -5.747 1.00 0.00 H new ATOM 0 HG22 VAL A 739 -3.011 1.325 -7.481 1.00 0.00 H new ATOM 0 HG23 VAL A 739 -1.714 2.398 -6.901 1.00 0.00 H new ATOM 402 N LYS A 740 -2.367 2.142 -9.628 1.00 0.00 N ATOM 403 CA LYS A 740 -1.233 1.526 -10.269 1.00 0.00 C ATOM 404 C LYS A 740 -1.024 2.197 -11.606 1.00 0.00 C ATOM 405 O LYS A 740 0.085 2.562 -11.951 1.00 0.00 O ATOM 406 CB LYS A 740 -1.417 0.027 -10.402 1.00 0.00 C ATOM 407 CG LYS A 740 -2.564 -0.320 -11.276 1.00 0.00 C ATOM 408 CD LYS A 740 -3.184 -1.661 -10.909 1.00 0.00 C ATOM 409 CE LYS A 740 -2.632 -2.795 -11.755 1.00 0.00 C ATOM 410 NZ LYS A 740 -3.672 -3.814 -12.060 1.00 0.00 N ATOM 0 H LYS A 740 -3.242 1.625 -9.711 1.00 0.00 H new ATOM 0 HA LYS A 740 -0.341 1.662 -9.657 1.00 0.00 H new ATOM 0 HB2 LYS A 740 -0.507 -0.415 -10.807 1.00 0.00 H new ATOM 0 HB3 LYS A 740 -1.570 -0.408 -9.414 1.00 0.00 H new ATOM 0 HG2 LYS A 740 -3.322 0.460 -11.204 1.00 0.00 H new ATOM 0 HG3 LYS A 740 -2.232 -0.347 -12.314 1.00 0.00 H new ATOM 0 HD2 LYS A 740 -2.997 -1.870 -9.856 1.00 0.00 H new ATOM 0 HD3 LYS A 740 -4.265 -1.607 -11.036 1.00 0.00 H new ATOM 0 HE2 LYS A 740 -2.233 -2.393 -12.686 1.00 0.00 H new ATOM 0 HE3 LYS A 740 -1.802 -3.269 -11.231 1.00 0.00 H new ATOM 0 HZ1 LYS A 740 -3.221 -4.662 -12.459 1.00 0.00 H new ATOM 0 HZ2 LYS A 740 -4.176 -4.068 -11.186 1.00 0.00 H new ATOM 0 HZ3 LYS A 740 -4.347 -3.425 -12.749 1.00 0.00 H new ATOM 424 N SER A 741 -2.102 2.414 -12.348 1.00 0.00 N ATOM 425 CA SER A 741 -1.977 3.098 -13.619 1.00 0.00 C ATOM 426 C SER A 741 -1.376 4.474 -13.380 1.00 0.00 C ATOM 427 O SER A 741 -0.979 5.172 -14.312 1.00 0.00 O ATOM 428 CB SER A 741 -3.330 3.227 -14.311 1.00 0.00 C ATOM 429 OG SER A 741 -3.196 3.797 -15.601 1.00 0.00 O ATOM 0 H SER A 741 -3.050 2.132 -12.096 1.00 0.00 H new ATOM 0 HA SER A 741 -1.327 2.516 -14.272 1.00 0.00 H new ATOM 0 HB2 SER A 741 -3.795 2.244 -14.392 1.00 0.00 H new ATOM 0 HB3 SER A 741 -3.993 3.844 -13.705 1.00 0.00 H new ATOM 0 HG SER A 741 -2.414 4.387 -15.618 1.00 0.00 H new ATOM 435 N HIS A 742 -1.319 4.846 -12.103 1.00 0.00 N ATOM 436 CA HIS A 742 -0.763 6.118 -11.692 1.00 0.00 C ATOM 437 C HIS A 742 0.705 6.218 -12.106 1.00 0.00 C ATOM 438 O HIS A 742 1.452 5.245 -12.057 1.00 0.00 O ATOM 439 CB HIS A 742 -0.907 6.289 -10.172 1.00 0.00 C ATOM 440 CG HIS A 742 -0.543 7.654 -9.676 1.00 0.00 C ATOM 441 ND1 HIS A 742 0.398 8.458 -10.279 1.00 0.00 N ATOM 442 CD2 HIS A 742 -1.008 8.359 -8.627 1.00 0.00 C ATOM 443 CE1 HIS A 742 0.497 9.593 -9.625 1.00 0.00 C ATOM 444 NE2 HIS A 742 -0.348 9.563 -8.614 1.00 0.00 N ATOM 0 H HIS A 742 -1.658 4.271 -11.332 1.00 0.00 H new ATOM 0 HA HIS A 742 -1.313 6.918 -12.187 1.00 0.00 H new ATOM 0 HB2 HIS A 742 -1.937 6.073 -9.888 1.00 0.00 H new ATOM 0 HB3 HIS A 742 -0.278 5.552 -9.673 1.00 0.00 H new ATOM 0 HD2 HIS A 742 -1.762 8.036 -7.924 1.00 0.00 H new ATOM 0 HE1 HIS A 742 1.158 10.411 -9.873 1.00 0.00 H new ATOM 0 HE2 HIS A 742 -0.488 10.311 -7.934 1.00 0.00 H new ATOM 453 N GLN A 743 1.086 7.406 -12.536 1.00 0.00 N ATOM 454 CA GLN A 743 2.440 7.702 -12.966 1.00 0.00 C ATOM 455 C GLN A 743 3.452 7.511 -11.842 1.00 0.00 C ATOM 456 O GLN A 743 4.653 7.434 -12.080 1.00 0.00 O ATOM 457 CB GLN A 743 2.462 9.132 -13.438 1.00 0.00 C ATOM 458 CG GLN A 743 3.700 9.484 -14.223 1.00 0.00 C ATOM 459 CD GLN A 743 3.825 10.972 -14.492 1.00 0.00 C ATOM 460 OE1 GLN A 743 3.343 11.473 -15.507 1.00 0.00 O ATOM 461 NE2 GLN A 743 4.472 11.686 -13.578 1.00 0.00 N ATOM 0 H GLN A 743 0.454 8.205 -12.597 1.00 0.00 H new ATOM 0 HA GLN A 743 2.722 7.015 -13.764 1.00 0.00 H new ATOM 0 HB2 GLN A 743 1.584 9.316 -14.057 1.00 0.00 H new ATOM 0 HB3 GLN A 743 2.388 9.793 -12.575 1.00 0.00 H new ATOM 0 HG2 GLN A 743 4.580 9.143 -13.677 1.00 0.00 H new ATOM 0 HG3 GLN A 743 3.687 8.948 -15.172 1.00 0.00 H new ATOM 0 HE21 GLN A 743 4.856 11.228 -12.751 1.00 0.00 H new ATOM 0 HE22 GLN A 743 4.585 12.692 -13.703 1.00 0.00 H new ATOM 470 N SER A 744 2.952 7.477 -10.622 1.00 0.00 N ATOM 471 CA SER A 744 3.790 7.282 -9.437 1.00 0.00 C ATOM 472 C SER A 744 3.704 5.852 -8.960 1.00 0.00 C ATOM 473 O SER A 744 4.151 5.510 -7.867 1.00 0.00 O ATOM 474 CB SER A 744 3.345 8.217 -8.310 1.00 0.00 C ATOM 475 OG SER A 744 4.006 9.468 -8.385 1.00 0.00 O ATOM 0 H SER A 744 1.959 7.583 -10.416 1.00 0.00 H new ATOM 0 HA SER A 744 4.821 7.509 -9.709 1.00 0.00 H new ATOM 0 HB2 SER A 744 2.267 8.369 -8.366 1.00 0.00 H new ATOM 0 HB3 SER A 744 3.552 7.752 -7.346 1.00 0.00 H new ATOM 0 HG SER A 744 4.959 9.324 -8.565 1.00 0.00 H new ATOM 481 N ALA A 745 3.115 5.022 -9.785 1.00 0.00 N ATOM 482 CA ALA A 745 2.917 3.635 -9.441 1.00 0.00 C ATOM 483 C ALA A 745 3.891 2.669 -10.099 1.00 0.00 C ATOM 484 O ALA A 745 3.855 1.486 -9.793 1.00 0.00 O ATOM 485 CB ALA A 745 1.514 3.255 -9.825 1.00 0.00 C ATOM 0 H ALA A 745 2.762 5.285 -10.705 1.00 0.00 H new ATOM 0 HA ALA A 745 3.097 3.550 -8.369 1.00 0.00 H new ATOM 0 HB1 ALA A 745 1.339 2.209 -9.575 1.00 0.00 H new ATOM 0 HB2 ALA A 745 0.806 3.881 -9.282 1.00 0.00 H new ATOM 0 HB3 ALA A 745 1.378 3.399 -10.897 1.00 0.00 H new ATOM 491 N TRP A 746 4.752 3.133 -10.993 1.00 0.00 N ATOM 492 CA TRP A 746 5.657 2.208 -11.669 1.00 0.00 C ATOM 493 C TRP A 746 6.562 1.413 -10.708 1.00 0.00 C ATOM 494 O TRP A 746 6.863 0.254 -10.996 1.00 0.00 O ATOM 495 CB TRP A 746 6.479 2.895 -12.753 1.00 0.00 C ATOM 496 CG TRP A 746 7.099 4.176 -12.331 1.00 0.00 C ATOM 497 CD1 TRP A 746 6.551 5.416 -12.438 1.00 0.00 C ATOM 498 CD2 TRP A 746 8.384 4.347 -11.733 1.00 0.00 C ATOM 499 NE1 TRP A 746 7.429 6.360 -11.969 1.00 0.00 N ATOM 500 CE2 TRP A 746 8.559 5.726 -11.525 1.00 0.00 C ATOM 501 CE3 TRP A 746 9.404 3.469 -11.355 1.00 0.00 C ATOM 502 CZ2 TRP A 746 9.714 6.246 -10.962 1.00 0.00 C ATOM 503 CZ3 TRP A 746 10.549 3.989 -10.787 1.00 0.00 C ATOM 504 CH2 TRP A 746 10.693 5.365 -10.599 1.00 0.00 C ATOM 0 H TRP A 746 4.845 4.112 -11.263 1.00 0.00 H new ATOM 0 HA TRP A 746 5.006 1.478 -12.151 1.00 0.00 H new ATOM 0 HB2 TRP A 746 7.265 2.215 -13.082 1.00 0.00 H new ATOM 0 HB3 TRP A 746 5.838 3.082 -13.615 1.00 0.00 H new ATOM 0 HD1 TRP A 746 5.569 5.627 -12.834 1.00 0.00 H new ATOM 0 HE1 TRP A 746 7.267 7.367 -11.954 1.00 0.00 H new ATOM 0 HE3 TRP A 746 9.298 2.405 -11.505 1.00 0.00 H new ATOM 0 HZ2 TRP A 746 9.836 7.309 -10.816 1.00 0.00 H new ATOM 0 HZ3 TRP A 746 11.344 3.323 -10.484 1.00 0.00 H new ATOM 0 HH2 TRP A 746 11.602 5.743 -10.155 1.00 0.00 H new ATOM 515 N PRO A 747 7.023 1.978 -9.562 1.00 0.00 N ATOM 516 CA PRO A 747 7.859 1.219 -8.635 1.00 0.00 C ATOM 517 C PRO A 747 7.033 0.181 -7.909 1.00 0.00 C ATOM 518 O PRO A 747 7.560 -0.755 -7.312 1.00 0.00 O ATOM 519 CB PRO A 747 8.384 2.257 -7.635 1.00 0.00 C ATOM 520 CG PRO A 747 7.823 3.575 -8.034 1.00 0.00 C ATOM 521 CD PRO A 747 6.760 3.339 -9.062 1.00 0.00 C ATOM 0 HA PRO A 747 8.662 0.692 -9.150 1.00 0.00 H new ATOM 0 HB2 PRO A 747 8.080 2.001 -6.620 1.00 0.00 H new ATOM 0 HB3 PRO A 747 9.474 2.284 -7.645 1.00 0.00 H new ATOM 0 HG2 PRO A 747 7.407 4.089 -7.168 1.00 0.00 H new ATOM 0 HG3 PRO A 747 8.607 4.215 -8.438 1.00 0.00 H new ATOM 0 HD2 PRO A 747 5.764 3.416 -8.627 1.00 0.00 H new ATOM 0 HD3 PRO A 747 6.815 4.074 -9.865 1.00 0.00 H new ATOM 529 N PHE A 748 5.718 0.350 -7.986 1.00 0.00 N ATOM 530 CA PHE A 748 4.794 -0.530 -7.297 1.00 0.00 C ATOM 531 C PHE A 748 4.024 -1.391 -8.285 1.00 0.00 C ATOM 532 O PHE A 748 3.450 -2.412 -7.926 1.00 0.00 O ATOM 533 CB PHE A 748 3.852 0.304 -6.423 1.00 0.00 C ATOM 534 CG PHE A 748 4.468 1.565 -5.882 1.00 0.00 C ATOM 535 CD1 PHE A 748 5.809 1.632 -5.618 1.00 0.00 C ATOM 536 CD2 PHE A 748 3.705 2.685 -5.648 1.00 0.00 C ATOM 537 CE1 PHE A 748 6.392 2.777 -5.132 1.00 0.00 C ATOM 538 CE2 PHE A 748 4.291 3.837 -5.153 1.00 0.00 C ATOM 539 CZ PHE A 748 5.627 3.876 -4.898 1.00 0.00 C ATOM 0 H PHE A 748 5.270 1.093 -8.522 1.00 0.00 H new ATOM 0 HA PHE A 748 5.355 -1.208 -6.654 1.00 0.00 H new ATOM 0 HB2 PHE A 748 2.969 0.566 -7.007 1.00 0.00 H new ATOM 0 HB3 PHE A 748 3.512 -0.308 -5.588 1.00 0.00 H new ATOM 0 HD1 PHE A 748 6.425 0.763 -5.796 1.00 0.00 H new ATOM 0 HD2 PHE A 748 2.644 2.666 -5.851 1.00 0.00 H new ATOM 0 HE1 PHE A 748 7.454 2.804 -4.937 1.00 0.00 H new ATOM 0 HE2 PHE A 748 3.684 4.711 -4.968 1.00 0.00 H new ATOM 0 HZ PHE A 748 6.078 4.778 -4.511 1.00 0.00 H new ATOM 549 N MET A 749 4.046 -0.970 -9.536 1.00 0.00 N ATOM 550 CA MET A 749 3.357 -1.661 -10.621 1.00 0.00 C ATOM 551 C MET A 749 3.510 -3.162 -10.533 1.00 0.00 C ATOM 552 O MET A 749 2.574 -3.915 -10.799 1.00 0.00 O ATOM 553 CB MET A 749 3.918 -1.177 -11.940 1.00 0.00 C ATOM 554 CG MET A 749 3.158 -0.013 -12.482 1.00 0.00 C ATOM 555 SD MET A 749 1.895 -0.528 -13.649 1.00 0.00 S ATOM 556 CE MET A 749 1.122 1.046 -13.878 1.00 0.00 C ATOM 0 H MET A 749 4.545 -0.132 -9.835 1.00 0.00 H new ATOM 0 HA MET A 749 2.293 -1.436 -10.542 1.00 0.00 H new ATOM 0 HB2 MET A 749 4.963 -0.897 -11.808 1.00 0.00 H new ATOM 0 HB3 MET A 749 3.896 -1.992 -12.663 1.00 0.00 H new ATOM 0 HG2 MET A 749 2.693 0.532 -11.660 1.00 0.00 H new ATOM 0 HG3 MET A 749 3.847 0.675 -12.972 1.00 0.00 H new ATOM 0 HE1 MET A 749 0.057 0.963 -13.663 1.00 0.00 H new ATOM 0 HE2 MET A 749 1.573 1.774 -13.204 1.00 0.00 H new ATOM 0 HE3 MET A 749 1.259 1.372 -14.909 1.00 0.00 H new ATOM 566 N GLU A 750 4.696 -3.582 -10.156 1.00 0.00 N ATOM 567 CA GLU A 750 5.003 -4.986 -10.044 1.00 0.00 C ATOM 568 C GLU A 750 6.080 -5.204 -8.996 1.00 0.00 C ATOM 569 O GLU A 750 7.059 -4.460 -8.942 1.00 0.00 O ATOM 570 CB GLU A 750 5.474 -5.511 -11.392 1.00 0.00 C ATOM 571 CG GLU A 750 4.346 -5.918 -12.322 1.00 0.00 C ATOM 572 CD GLU A 750 4.839 -6.302 -13.704 1.00 0.00 C ATOM 573 OE1 GLU A 750 4.943 -5.406 -14.567 1.00 0.00 O ATOM 574 OE2 GLU A 750 5.121 -7.499 -13.923 1.00 0.00 O ATOM 0 H GLU A 750 5.471 -2.962 -9.920 1.00 0.00 H new ATOM 0 HA GLU A 750 4.106 -5.526 -9.740 1.00 0.00 H new ATOM 0 HB2 GLU A 750 6.075 -4.744 -11.880 1.00 0.00 H new ATOM 0 HB3 GLU A 750 6.125 -6.370 -11.229 1.00 0.00 H new ATOM 0 HG2 GLU A 750 3.806 -6.759 -11.886 1.00 0.00 H new ATOM 0 HG3 GLU A 750 3.637 -5.095 -12.409 1.00 0.00 H new ATOM 581 N PRO A 751 5.911 -6.224 -8.145 1.00 0.00 N ATOM 582 CA PRO A 751 6.865 -6.536 -7.098 1.00 0.00 C ATOM 583 C PRO A 751 8.289 -6.557 -7.603 1.00 0.00 C ATOM 584 O PRO A 751 8.617 -7.240 -8.573 1.00 0.00 O ATOM 585 CB PRO A 751 6.449 -7.914 -6.595 1.00 0.00 C ATOM 586 CG PRO A 751 5.410 -8.376 -7.545 1.00 0.00 C ATOM 587 CD PRO A 751 4.790 -7.154 -8.126 1.00 0.00 C ATOM 0 HA PRO A 751 6.852 -5.778 -6.315 1.00 0.00 H new ATOM 0 HB2 PRO A 751 7.297 -8.599 -6.575 1.00 0.00 H new ATOM 0 HB3 PRO A 751 6.058 -7.861 -5.579 1.00 0.00 H new ATOM 0 HG2 PRO A 751 5.848 -8.997 -8.326 1.00 0.00 H new ATOM 0 HG3 PRO A 751 4.663 -8.985 -7.036 1.00 0.00 H new ATOM 0 HD2 PRO A 751 4.392 -7.334 -9.125 1.00 0.00 H new ATOM 0 HD3 PRO A 751 3.965 -6.786 -7.516 1.00 0.00 H new ATOM 595 N VAL A 752 9.121 -5.792 -6.925 1.00 0.00 N ATOM 596 CA VAL A 752 10.529 -5.685 -7.265 1.00 0.00 C ATOM 597 C VAL A 752 11.157 -7.052 -7.353 1.00 0.00 C ATOM 598 O VAL A 752 10.579 -8.060 -6.945 1.00 0.00 O ATOM 599 CB VAL A 752 11.282 -4.769 -6.269 1.00 0.00 C ATOM 600 CG1 VAL A 752 10.319 -4.078 -5.335 1.00 0.00 C ATOM 601 CG2 VAL A 752 12.344 -5.516 -5.487 1.00 0.00 C ATOM 0 H VAL A 752 8.842 -5.227 -6.123 1.00 0.00 H new ATOM 0 HA VAL A 752 10.609 -5.218 -8.247 1.00 0.00 H new ATOM 0 HB VAL A 752 11.794 -4.012 -6.863 1.00 0.00 H new ATOM 0 HG11 VAL A 752 10.874 -3.441 -4.646 1.00 0.00 H new ATOM 0 HG12 VAL A 752 9.625 -3.468 -5.914 1.00 0.00 H new ATOM 0 HG13 VAL A 752 9.761 -4.825 -4.770 1.00 0.00 H new ATOM 0 HG21 VAL A 752 12.843 -4.829 -4.803 1.00 0.00 H new ATOM 0 HG22 VAL A 752 11.878 -6.321 -4.918 1.00 0.00 H new ATOM 0 HG23 VAL A 752 13.076 -5.936 -6.177 1.00 0.00 H new ATOM 611 N LYS A 753 12.355 -7.063 -7.881 1.00 0.00 N ATOM 612 CA LYS A 753 13.076 -8.277 -8.113 1.00 0.00 C ATOM 613 C LYS A 753 13.556 -8.930 -6.823 1.00 0.00 C ATOM 614 O LYS A 753 14.352 -9.870 -6.857 1.00 0.00 O ATOM 615 CB LYS A 753 14.254 -7.931 -8.990 1.00 0.00 C ATOM 616 CG LYS A 753 14.925 -9.139 -9.518 1.00 0.00 C ATOM 617 CD LYS A 753 15.460 -8.930 -10.920 1.00 0.00 C ATOM 618 CE LYS A 753 16.141 -10.183 -11.449 1.00 0.00 C ATOM 619 NZ LYS A 753 15.243 -11.369 -11.391 1.00 0.00 N ATOM 0 H LYS A 753 12.856 -6.220 -8.162 1.00 0.00 H new ATOM 0 HA LYS A 753 12.416 -9.001 -8.590 1.00 0.00 H new ATOM 0 HB2 LYS A 753 13.918 -7.311 -9.821 1.00 0.00 H new ATOM 0 HB3 LYS A 753 14.969 -7.339 -8.419 1.00 0.00 H new ATOM 0 HG2 LYS A 753 15.745 -9.416 -8.856 1.00 0.00 H new ATOM 0 HG3 LYS A 753 14.222 -9.972 -9.520 1.00 0.00 H new ATOM 0 HD2 LYS A 753 14.643 -8.651 -11.585 1.00 0.00 H new ATOM 0 HD3 LYS A 753 16.168 -8.102 -10.921 1.00 0.00 H new ATOM 0 HE2 LYS A 753 16.457 -10.017 -12.479 1.00 0.00 H new ATOM 0 HE3 LYS A 753 17.041 -10.380 -10.867 1.00 0.00 H new ATOM 0 HZ1 LYS A 753 15.635 -12.131 -11.981 1.00 0.00 H new ATOM 0 HZ2 LYS A 753 15.165 -11.698 -10.407 1.00 0.00 H new ATOM 0 HZ3 LYS A 753 14.300 -11.108 -11.744 1.00 0.00 H new ATOM 633 N ARG A 754 13.063 -8.443 -5.690 1.00 0.00 N ATOM 634 CA ARG A 754 13.488 -8.942 -4.387 1.00 0.00 C ATOM 635 C ARG A 754 14.943 -8.566 -4.161 1.00 0.00 C ATOM 636 O ARG A 754 15.442 -8.582 -3.036 1.00 0.00 O ATOM 637 CB ARG A 754 13.316 -10.457 -4.269 1.00 0.00 C ATOM 638 CG ARG A 754 13.516 -10.984 -2.858 1.00 0.00 C ATOM 639 CD ARG A 754 13.263 -12.481 -2.779 1.00 0.00 C ATOM 640 NE ARG A 754 14.269 -13.247 -3.511 1.00 0.00 N ATOM 641 CZ ARG A 754 14.098 -14.508 -3.900 1.00 0.00 C ATOM 642 NH1 ARG A 754 12.961 -15.141 -3.638 1.00 0.00 N ATOM 643 NH2 ARG A 754 15.065 -15.137 -4.554 1.00 0.00 N ATOM 0 H ARG A 754 12.366 -7.700 -5.648 1.00 0.00 H new ATOM 0 HA ARG A 754 12.856 -8.484 -3.626 1.00 0.00 H new ATOM 0 HB2 ARG A 754 12.317 -10.729 -4.611 1.00 0.00 H new ATOM 0 HB3 ARG A 754 14.026 -10.948 -4.935 1.00 0.00 H new ATOM 0 HG2 ARG A 754 14.533 -10.768 -2.529 1.00 0.00 H new ATOM 0 HG3 ARG A 754 12.843 -10.464 -2.176 1.00 0.00 H new ATOM 0 HD2 ARG A 754 13.259 -12.793 -1.735 1.00 0.00 H new ATOM 0 HD3 ARG A 754 12.275 -12.703 -3.182 1.00 0.00 H new ATOM 0 HE ARG A 754 15.152 -12.789 -3.737 1.00 0.00 H new ATOM 0 HH11 ARG A 754 12.214 -14.661 -3.137 1.00 0.00 H new ATOM 0 HH12 ARG A 754 12.835 -16.108 -3.938 1.00 0.00 H new ATOM 0 HH21 ARG A 754 15.940 -14.654 -4.759 1.00 0.00 H new ATOM 0 HH22 ARG A 754 14.934 -16.104 -4.852 1.00 0.00 H new ATOM 657 N THR A 755 15.616 -8.227 -5.258 1.00 0.00 N ATOM 658 CA THR A 755 17.001 -7.837 -5.221 1.00 0.00 C ATOM 659 C THR A 755 17.200 -6.578 -6.051 1.00 0.00 C ATOM 660 O THR A 755 18.279 -5.984 -6.049 1.00 0.00 O ATOM 661 CB THR A 755 17.925 -8.951 -5.714 1.00 0.00 C ATOM 662 OG1 THR A 755 17.888 -9.033 -7.145 1.00 0.00 O ATOM 663 CG2 THR A 755 17.508 -10.281 -5.110 1.00 0.00 C ATOM 0 H THR A 755 15.206 -8.219 -6.192 1.00 0.00 H new ATOM 0 HA THR A 755 17.265 -7.637 -4.182 1.00 0.00 H new ATOM 0 HB THR A 755 18.943 -8.721 -5.401 1.00 0.00 H new ATOM 0 HG1 THR A 755 18.485 -9.749 -7.447 1.00 0.00 H new ATOM 0 HG21 THR A 755 18.173 -11.067 -5.468 1.00 0.00 H new ATOM 0 HG22 THR A 755 17.568 -10.222 -4.023 1.00 0.00 H new ATOM 0 HG23 THR A 755 16.484 -10.509 -5.405 1.00 0.00 H new ATOM 671 N GLU A 756 16.141 -6.181 -6.769 1.00 0.00 N ATOM 672 CA GLU A 756 16.145 -4.952 -7.516 1.00 0.00 C ATOM 673 C GLU A 756 16.406 -3.954 -6.448 1.00 0.00 C ATOM 674 O GLU A 756 17.099 -2.946 -6.575 1.00 0.00 O ATOM 675 CB GLU A 756 14.746 -4.746 -8.080 1.00 0.00 C ATOM 676 CG GLU A 756 14.524 -3.388 -8.632 1.00 0.00 C ATOM 677 CD GLU A 756 13.174 -3.234 -9.306 1.00 0.00 C ATOM 678 OE1 GLU A 756 12.995 -3.794 -10.408 1.00 0.00 O ATOM 679 OE2 GLU A 756 12.297 -2.558 -8.731 1.00 0.00 O ATOM 0 H GLU A 756 15.272 -6.710 -6.837 1.00 0.00 H new ATOM 0 HA GLU A 756 16.855 -4.907 -8.342 1.00 0.00 H new ATOM 0 HB2 GLU A 756 14.567 -5.482 -8.864 1.00 0.00 H new ATOM 0 HB3 GLU A 756 14.015 -4.934 -7.294 1.00 0.00 H new ATOM 0 HG2 GLU A 756 14.608 -2.657 -7.828 1.00 0.00 H new ATOM 0 HG3 GLU A 756 15.311 -3.161 -9.352 1.00 0.00 H new ATOM 686 N ALA A 757 15.825 -4.392 -5.366 1.00 0.00 N ATOM 687 CA ALA A 757 15.833 -3.808 -4.092 1.00 0.00 C ATOM 688 C ALA A 757 16.656 -4.743 -3.226 1.00 0.00 C ATOM 689 O ALA A 757 16.212 -5.819 -2.831 1.00 0.00 O ATOM 690 CB ALA A 757 14.408 -3.742 -3.683 1.00 0.00 C ATOM 0 H ALA A 757 15.284 -5.257 -5.377 1.00 0.00 H new ATOM 0 HA ALA A 757 16.261 -2.808 -4.029 1.00 0.00 H new ATOM 0 HB1 ALA A 757 14.334 -3.294 -2.692 1.00 0.00 H new ATOM 0 HB2 ALA A 757 13.852 -3.135 -4.398 1.00 0.00 H new ATOM 0 HB3 ALA A 757 13.989 -4.748 -3.659 1.00 0.00 H new ATOM 696 N PRO A 758 17.891 -4.349 -2.987 1.00 0.00 N ATOM 697 CA PRO A 758 18.863 -5.141 -2.240 1.00 0.00 C ATOM 698 C PRO A 758 18.314 -5.676 -0.930 1.00 0.00 C ATOM 699 O PRO A 758 17.775 -6.783 -0.891 1.00 0.00 O ATOM 700 CB PRO A 758 20.028 -4.170 -2.029 1.00 0.00 C ATOM 701 CG PRO A 758 19.505 -2.821 -2.411 1.00 0.00 C ATOM 702 CD PRO A 758 18.416 -3.058 -3.397 1.00 0.00 C ATOM 0 HA PRO A 758 19.155 -6.044 -2.776 1.00 0.00 H new ATOM 0 HB2 PRO A 758 20.364 -4.181 -0.992 1.00 0.00 H new ATOM 0 HB3 PRO A 758 20.884 -4.446 -2.644 1.00 0.00 H new ATOM 0 HG2 PRO A 758 19.129 -2.288 -1.537 1.00 0.00 H new ATOM 0 HG3 PRO A 758 20.294 -2.206 -2.844 1.00 0.00 H new ATOM 0 HD2 PRO A 758 17.655 -2.279 -3.355 1.00 0.00 H new ATOM 0 HD3 PRO A 758 18.793 -3.080 -4.419 1.00 0.00 H new ATOM 710 N GLY A 759 18.447 -4.914 0.139 1.00 0.00 N ATOM 711 CA GLY A 759 17.921 -5.366 1.407 1.00 0.00 C ATOM 712 C GLY A 759 16.419 -5.208 1.461 1.00 0.00 C ATOM 713 O GLY A 759 15.843 -5.127 2.539 1.00 0.00 O ATOM 0 H GLY A 759 18.903 -4.002 0.155 1.00 0.00 H new ATOM 0 HA2 GLY A 759 18.185 -6.412 1.562 1.00 0.00 H new ATOM 0 HA3 GLY A 759 18.379 -4.798 2.217 1.00 0.00 H new ATOM 717 N TYR A 760 15.785 -5.207 0.284 1.00 0.00 N ATOM 718 CA TYR A 760 14.344 -5.023 0.163 1.00 0.00 C ATOM 719 C TYR A 760 13.534 -5.747 1.228 1.00 0.00 C ATOM 720 O TYR A 760 12.891 -5.118 2.057 1.00 0.00 O ATOM 721 CB TYR A 760 13.960 -5.533 -1.210 1.00 0.00 C ATOM 722 CG TYR A 760 12.524 -5.364 -1.618 1.00 0.00 C ATOM 723 CD1 TYR A 760 11.777 -4.298 -1.185 1.00 0.00 C ATOM 724 CD2 TYR A 760 11.928 -6.276 -2.467 1.00 0.00 C ATOM 725 CE1 TYR A 760 10.475 -4.138 -1.585 1.00 0.00 C ATOM 726 CE2 TYR A 760 10.621 -6.124 -2.872 1.00 0.00 C ATOM 727 CZ TYR A 760 9.902 -5.050 -2.430 1.00 0.00 C ATOM 728 OH TYR A 760 8.596 -4.884 -2.834 1.00 0.00 O ATOM 0 H TYR A 760 16.261 -5.334 -0.609 1.00 0.00 H new ATOM 0 HA TYR A 760 14.116 -3.966 0.302 1.00 0.00 H new ATOM 0 HB2 TYR A 760 14.584 -5.028 -1.947 1.00 0.00 H new ATOM 0 HB3 TYR A 760 14.204 -6.594 -1.259 1.00 0.00 H new ATOM 0 HD1 TYR A 760 12.221 -3.573 -0.519 1.00 0.00 H new ATOM 0 HD2 TYR A 760 12.497 -7.123 -2.819 1.00 0.00 H new ATOM 0 HE1 TYR A 760 9.902 -3.293 -1.233 1.00 0.00 H new ATOM 0 HE2 TYR A 760 10.168 -6.848 -3.533 1.00 0.00 H new ATOM 0 HH TYR A 760 8.469 -3.970 -3.163 1.00 0.00 H new ATOM 738 N TYR A 761 13.574 -7.061 1.203 1.00 0.00 N ATOM 739 CA TYR A 761 12.808 -7.864 2.144 1.00 0.00 C ATOM 740 C TYR A 761 13.253 -7.685 3.589 1.00 0.00 C ATOM 741 O TYR A 761 12.535 -8.065 4.514 1.00 0.00 O ATOM 742 CB TYR A 761 12.828 -9.327 1.719 1.00 0.00 C ATOM 743 CG TYR A 761 11.744 -9.618 0.712 1.00 0.00 C ATOM 744 CD1 TYR A 761 11.530 -8.737 -0.330 1.00 0.00 C ATOM 745 CD2 TYR A 761 10.911 -10.722 0.824 1.00 0.00 C ATOM 746 CE1 TYR A 761 10.523 -8.936 -1.245 1.00 0.00 C ATOM 747 CE2 TYR A 761 9.899 -10.941 -0.096 1.00 0.00 C ATOM 748 CZ TYR A 761 9.708 -10.043 -1.129 1.00 0.00 C ATOM 749 OH TYR A 761 8.699 -10.250 -2.041 1.00 0.00 O ATOM 0 H TYR A 761 14.130 -7.602 0.541 1.00 0.00 H new ATOM 0 HA TYR A 761 11.779 -7.504 2.115 1.00 0.00 H new ATOM 0 HB2 TYR A 761 13.800 -9.571 1.291 1.00 0.00 H new ATOM 0 HB3 TYR A 761 12.696 -9.964 2.593 1.00 0.00 H new ATOM 0 HD1 TYR A 761 12.169 -7.872 -0.428 1.00 0.00 H new ATOM 0 HD2 TYR A 761 11.053 -11.418 1.637 1.00 0.00 H new ATOM 0 HE1 TYR A 761 10.371 -8.231 -2.049 1.00 0.00 H new ATOM 0 HE2 TYR A 761 9.263 -11.809 -0.007 1.00 0.00 H new ATOM 0 HH TYR A 761 8.220 -11.075 -1.817 1.00 0.00 H new ATOM 759 N GLU A 762 14.428 -7.112 3.784 1.00 0.00 N ATOM 760 CA GLU A 762 14.940 -6.888 5.129 1.00 0.00 C ATOM 761 C GLU A 762 14.240 -5.689 5.763 1.00 0.00 C ATOM 762 O GLU A 762 13.741 -5.756 6.886 1.00 0.00 O ATOM 763 CB GLU A 762 16.454 -6.661 5.087 1.00 0.00 C ATOM 764 CG GLU A 762 16.887 -5.315 5.648 1.00 0.00 C ATOM 765 CD GLU A 762 18.335 -5.311 6.092 1.00 0.00 C ATOM 766 OE1 GLU A 762 19.139 -6.068 5.506 1.00 0.00 O ATOM 767 OE2 GLU A 762 18.667 -4.553 7.028 1.00 0.00 O ATOM 0 H GLU A 762 15.044 -6.795 3.035 1.00 0.00 H new ATOM 0 HA GLU A 762 14.738 -7.771 5.735 1.00 0.00 H new ATOM 0 HB2 GLU A 762 16.947 -7.454 5.649 1.00 0.00 H new ATOM 0 HB3 GLU A 762 16.796 -6.741 4.055 1.00 0.00 H new ATOM 0 HG2 GLU A 762 16.740 -4.545 4.891 1.00 0.00 H new ATOM 0 HG3 GLU A 762 16.250 -5.056 6.494 1.00 0.00 H new ATOM 774 N VAL A 763 14.217 -4.595 5.014 1.00 0.00 N ATOM 775 CA VAL A 763 13.598 -3.358 5.447 1.00 0.00 C ATOM 776 C VAL A 763 12.114 -3.489 5.315 1.00 0.00 C ATOM 777 O VAL A 763 11.343 -3.114 6.200 1.00 0.00 O ATOM 778 CB VAL A 763 14.063 -2.152 4.575 1.00 0.00 C ATOM 779 CG1 VAL A 763 14.731 -2.589 3.299 1.00 0.00 C ATOM 780 CG2 VAL A 763 12.919 -1.292 4.151 1.00 0.00 C ATOM 0 H VAL A 763 14.631 -4.545 4.083 1.00 0.00 H new ATOM 0 HA VAL A 763 13.890 -3.175 6.481 1.00 0.00 H new ATOM 0 HB VAL A 763 14.757 -1.607 5.215 1.00 0.00 H new ATOM 0 HG11 VAL A 763 15.036 -1.711 2.729 1.00 0.00 H new ATOM 0 HG12 VAL A 763 15.609 -3.191 3.535 1.00 0.00 H new ATOM 0 HG13 VAL A 763 14.033 -3.182 2.708 1.00 0.00 H new ATOM 0 HG21 VAL A 763 13.290 -0.465 3.546 1.00 0.00 H new ATOM 0 HG22 VAL A 763 12.217 -1.884 3.564 1.00 0.00 H new ATOM 0 HG23 VAL A 763 12.414 -0.898 5.033 1.00 0.00 H new ATOM 790 N ILE A 764 11.739 -4.034 4.192 1.00 0.00 N ATOM 791 CA ILE A 764 10.367 -4.182 3.861 1.00 0.00 C ATOM 792 C ILE A 764 9.752 -5.471 4.371 1.00 0.00 C ATOM 793 O ILE A 764 9.756 -6.488 3.680 1.00 0.00 O ATOM 794 CB ILE A 764 10.175 -4.105 2.374 1.00 0.00 C ATOM 795 CG1 ILE A 764 10.918 -2.894 1.825 1.00 0.00 C ATOM 796 CG2 ILE A 764 8.708 -3.992 2.101 1.00 0.00 C ATOM 797 CD1 ILE A 764 10.155 -1.599 1.968 1.00 0.00 C ATOM 0 H ILE A 764 12.385 -4.386 3.485 1.00 0.00 H new ATOM 0 HA ILE A 764 9.854 -3.360 4.359 1.00 0.00 H new ATOM 0 HB ILE A 764 10.572 -4.996 1.887 1.00 0.00 H new ATOM 0 HG12 ILE A 764 11.874 -2.801 2.340 1.00 0.00 H new ATOM 0 HG13 ILE A 764 11.139 -3.061 0.771 1.00 0.00 H new ATOM 0 HG21 ILE A 764 8.541 -3.934 1.025 1.00 0.00 H new ATOM 0 HG22 ILE A 764 8.195 -4.866 2.501 1.00 0.00 H new ATOM 0 HG23 ILE A 764 8.317 -3.093 2.577 1.00 0.00 H new ATOM 0 HD11 ILE A 764 10.746 -0.781 1.556 1.00 0.00 H new ATOM 0 HD12 ILE A 764 9.210 -1.672 1.429 1.00 0.00 H new ATOM 0 HD13 ILE A 764 9.957 -1.408 3.023 1.00 0.00 H new ATOM 809 N ARG A 765 9.243 -5.426 5.585 1.00 0.00 N ATOM 810 CA ARG A 765 8.580 -6.582 6.169 1.00 0.00 C ATOM 811 C ARG A 765 7.353 -6.968 5.341 1.00 0.00 C ATOM 812 O ARG A 765 6.929 -8.125 5.349 1.00 0.00 O ATOM 813 CB ARG A 765 8.168 -6.285 7.607 1.00 0.00 C ATOM 814 CG ARG A 765 8.839 -7.165 8.637 1.00 0.00 C ATOM 815 CD ARG A 765 8.541 -8.627 8.388 1.00 0.00 C ATOM 816 NE ARG A 765 8.743 -9.443 9.581 1.00 0.00 N ATOM 817 CZ ARG A 765 8.743 -10.773 9.574 1.00 0.00 C ATOM 818 NH1 ARG A 765 8.562 -11.435 8.438 1.00 0.00 N ATOM 819 NH2 ARG A 765 8.925 -11.442 10.704 1.00 0.00 N ATOM 0 H ARG A 765 9.274 -4.604 6.189 1.00 0.00 H new ATOM 0 HA ARG A 765 9.279 -7.418 6.169 1.00 0.00 H new ATOM 0 HB2 ARG A 765 8.397 -5.243 7.831 1.00 0.00 H new ATOM 0 HB3 ARG A 765 7.088 -6.400 7.695 1.00 0.00 H new ATOM 0 HG2 ARG A 765 9.916 -7.002 8.612 1.00 0.00 H new ATOM 0 HG3 ARG A 765 8.498 -6.887 9.634 1.00 0.00 H new ATOM 0 HD2 ARG A 765 7.511 -8.733 8.048 1.00 0.00 H new ATOM 0 HD3 ARG A 765 9.181 -8.995 7.586 1.00 0.00 H new ATOM 0 HE ARG A 765 8.893 -8.966 10.470 1.00 0.00 H new ATOM 0 HH11 ARG A 765 8.422 -10.924 7.566 1.00 0.00 H new ATOM 0 HH12 ARG A 765 8.563 -12.455 8.436 1.00 0.00 H new ATOM 0 HH21 ARG A 765 9.065 -10.937 11.579 1.00 0.00 H new ATOM 0 HH22 ARG A 765 8.925 -12.462 10.698 1.00 0.00 H new ATOM 833 N PHE A 766 6.784 -5.991 4.623 1.00 0.00 N ATOM 834 CA PHE A 766 5.592 -6.237 3.799 1.00 0.00 C ATOM 835 C PHE A 766 5.710 -5.637 2.398 1.00 0.00 C ATOM 836 O PHE A 766 5.025 -4.662 2.084 1.00 0.00 O ATOM 837 CB PHE A 766 4.357 -5.626 4.453 1.00 0.00 C ATOM 838 CG PHE A 766 3.793 -6.383 5.603 1.00 0.00 C ATOM 839 CD1 PHE A 766 4.550 -6.581 6.724 1.00 0.00 C ATOM 840 CD2 PHE A 766 2.494 -6.857 5.571 1.00 0.00 C ATOM 841 CE1 PHE A 766 4.036 -7.244 7.818 1.00 0.00 C ATOM 842 CE2 PHE A 766 1.968 -7.527 6.652 1.00 0.00 C ATOM 843 CZ PHE A 766 2.739 -7.718 7.779 1.00 0.00 C ATOM 0 H PHE A 766 7.126 -5.030 4.595 1.00 0.00 H new ATOM 0 HA PHE A 766 5.504 -7.320 3.717 1.00 0.00 H new ATOM 0 HB2 PHE A 766 4.608 -4.621 4.792 1.00 0.00 H new ATOM 0 HB3 PHE A 766 3.581 -5.522 3.695 1.00 0.00 H new ATOM 0 HD1 PHE A 766 5.565 -6.213 6.753 1.00 0.00 H new ATOM 0 HD2 PHE A 766 1.888 -6.700 4.691 1.00 0.00 H new ATOM 0 HE1 PHE A 766 4.643 -7.392 8.699 1.00 0.00 H new ATOM 0 HE2 PHE A 766 0.956 -7.902 6.618 1.00 0.00 H new ATOM 0 HZ PHE A 766 2.329 -8.238 8.632 1.00 0.00 H new ATOM 853 N PRO A 767 6.569 -6.189 1.537 1.00 0.00 N ATOM 854 CA PRO A 767 6.732 -5.684 0.180 1.00 0.00 C ATOM 855 C PRO A 767 5.529 -5.957 -0.718 1.00 0.00 C ATOM 856 O PRO A 767 5.522 -6.904 -1.504 1.00 0.00 O ATOM 857 CB PRO A 767 7.997 -6.378 -0.326 1.00 0.00 C ATOM 858 CG PRO A 767 8.600 -7.031 0.851 1.00 0.00 C ATOM 859 CD PRO A 767 7.496 -7.278 1.829 1.00 0.00 C ATOM 0 HA PRO A 767 6.813 -4.597 0.167 1.00 0.00 H new ATOM 0 HB2 PRO A 767 7.759 -7.109 -1.099 1.00 0.00 H new ATOM 0 HB3 PRO A 767 8.686 -5.659 -0.769 1.00 0.00 H new ATOM 0 HG2 PRO A 767 9.081 -7.967 0.568 1.00 0.00 H new ATOM 0 HG3 PRO A 767 9.370 -6.397 1.291 1.00 0.00 H new ATOM 0 HD2 PRO A 767 7.035 -8.255 1.683 1.00 0.00 H new ATOM 0 HD3 PRO A 767 7.851 -7.244 2.859 1.00 0.00 H new ATOM 867 N MET A 768 4.510 -5.107 -0.583 1.00 0.00 N ATOM 868 CA MET A 768 3.298 -5.212 -1.383 1.00 0.00 C ATOM 869 C MET A 768 3.370 -4.252 -2.547 1.00 0.00 C ATOM 870 O MET A 768 3.925 -3.158 -2.438 1.00 0.00 O ATOM 871 CB MET A 768 2.051 -4.955 -0.533 1.00 0.00 C ATOM 872 CG MET A 768 0.807 -4.545 -1.323 1.00 0.00 C ATOM 873 SD MET A 768 0.030 -5.884 -2.235 1.00 0.00 S ATOM 874 CE MET A 768 -0.042 -7.070 -0.925 1.00 0.00 C ATOM 0 H MET A 768 4.505 -4.333 0.081 1.00 0.00 H new ATOM 0 HA MET A 768 3.222 -6.228 -1.771 1.00 0.00 H new ATOM 0 HB2 MET A 768 1.823 -5.858 0.033 1.00 0.00 H new ATOM 0 HB3 MET A 768 2.278 -4.173 0.192 1.00 0.00 H new ATOM 0 HG2 MET A 768 0.077 -4.121 -0.633 1.00 0.00 H new ATOM 0 HG3 MET A 768 1.080 -3.756 -2.023 1.00 0.00 H new ATOM 0 HE1 MET A 768 -0.751 -7.856 -1.184 1.00 0.00 H new ATOM 0 HE2 MET A 768 0.945 -7.507 -0.775 1.00 0.00 H new ATOM 0 HE3 MET A 768 -0.365 -6.579 -0.007 1.00 0.00 H new ATOM 884 N ASP A 769 2.823 -4.682 -3.662 1.00 0.00 N ATOM 885 CA ASP A 769 2.827 -3.891 -4.866 1.00 0.00 C ATOM 886 C ASP A 769 1.433 -3.817 -5.461 1.00 0.00 C ATOM 887 O ASP A 769 0.493 -4.373 -4.910 1.00 0.00 O ATOM 888 CB ASP A 769 3.792 -4.506 -5.872 1.00 0.00 C ATOM 889 CG ASP A 769 5.224 -4.062 -5.647 1.00 0.00 C ATOM 890 OD1 ASP A 769 5.805 -4.438 -4.608 1.00 0.00 O ATOM 891 OD2 ASP A 769 5.766 -3.344 -6.513 1.00 0.00 O ATOM 0 H ASP A 769 2.365 -5.588 -3.757 1.00 0.00 H new ATOM 0 HA ASP A 769 3.150 -2.879 -4.623 1.00 0.00 H new ATOM 0 HB2 ASP A 769 3.737 -5.593 -5.806 1.00 0.00 H new ATOM 0 HB3 ASP A 769 3.484 -4.232 -6.881 1.00 0.00 H new ATOM 896 N LEU A 770 1.302 -3.095 -6.559 1.00 0.00 N ATOM 897 CA LEU A 770 0.026 -2.978 -7.243 1.00 0.00 C ATOM 898 C LEU A 770 -0.310 -4.250 -7.984 1.00 0.00 C ATOM 899 O LEU A 770 -1.479 -4.541 -8.203 1.00 0.00 O ATOM 900 CB LEU A 770 0.035 -1.802 -8.189 1.00 0.00 C ATOM 901 CG LEU A 770 0.713 -0.588 -7.621 1.00 0.00 C ATOM 902 CD1 LEU A 770 1.424 0.126 -8.722 1.00 0.00 C ATOM 903 CD2 LEU A 770 -0.294 0.325 -6.971 1.00 0.00 C ATOM 0 H LEU A 770 2.065 -2.580 -6.997 1.00 0.00 H new ATOM 0 HA LEU A 770 -0.744 -2.811 -6.490 1.00 0.00 H new ATOM 0 HB2 LEU A 770 0.537 -2.091 -9.112 1.00 0.00 H new ATOM 0 HB3 LEU A 770 -0.992 -1.547 -8.451 1.00 0.00 H new ATOM 0 HG LEU A 770 1.429 -0.895 -6.859 1.00 0.00 H new ATOM 0 HD11 LEU A 770 1.920 1.010 -8.321 1.00 0.00 H new ATOM 0 HD12 LEU A 770 2.166 -0.537 -9.166 1.00 0.00 H new ATOM 0 HD13 LEU A 770 0.705 0.428 -9.484 1.00 0.00 H new ATOM 0 HD21 LEU A 770 0.216 1.199 -6.565 1.00 0.00 H new ATOM 0 HD22 LEU A 770 -1.027 0.644 -7.712 1.00 0.00 H new ATOM 0 HD23 LEU A 770 -0.800 -0.206 -6.165 1.00 0.00 H new ATOM 915 N LYS A 771 0.705 -4.985 -8.431 1.00 0.00 N ATOM 916 CA LYS A 771 0.433 -6.252 -9.078 1.00 0.00 C ATOM 917 C LYS A 771 0.051 -7.239 -8.011 1.00 0.00 C ATOM 918 O LYS A 771 -0.822 -8.069 -8.216 1.00 0.00 O ATOM 919 CB LYS A 771 1.596 -6.795 -9.877 1.00 0.00 C ATOM 920 CG LYS A 771 1.119 -7.678 -11.012 1.00 0.00 C ATOM 921 CD LYS A 771 1.056 -6.896 -12.305 1.00 0.00 C ATOM 922 CE LYS A 771 0.220 -7.616 -13.346 1.00 0.00 C ATOM 923 NZ LYS A 771 0.779 -8.954 -13.684 1.00 0.00 N ATOM 0 H LYS A 771 1.690 -4.731 -8.358 1.00 0.00 H new ATOM 0 HA LYS A 771 -0.371 -6.091 -9.796 1.00 0.00 H new ATOM 0 HB2 LYS A 771 2.182 -5.968 -10.278 1.00 0.00 H new ATOM 0 HB3 LYS A 771 2.255 -7.365 -9.222 1.00 0.00 H new ATOM 0 HG2 LYS A 771 1.793 -8.527 -11.127 1.00 0.00 H new ATOM 0 HG3 LYS A 771 0.134 -8.082 -10.777 1.00 0.00 H new ATOM 0 HD2 LYS A 771 0.633 -5.909 -12.115 1.00 0.00 H new ATOM 0 HD3 LYS A 771 2.065 -6.742 -12.689 1.00 0.00 H new ATOM 0 HE2 LYS A 771 -0.799 -7.732 -12.976 1.00 0.00 H new ATOM 0 HE3 LYS A 771 0.164 -7.008 -14.249 1.00 0.00 H new ATOM 0 HZ1 LYS A 771 0.259 -9.353 -14.492 1.00 0.00 H new ATOM 0 HZ2 LYS A 771 1.784 -8.858 -13.933 1.00 0.00 H new ATOM 0 HZ3 LYS A 771 0.684 -9.587 -12.864 1.00 0.00 H new ATOM 937 N THR A 772 0.757 -7.181 -6.883 1.00 0.00 N ATOM 938 CA THR A 772 0.403 -8.028 -5.756 1.00 0.00 C ATOM 939 C THR A 772 -1.006 -7.648 -5.369 1.00 0.00 C ATOM 940 O THR A 772 -1.877 -8.491 -5.285 1.00 0.00 O ATOM 941 CB THR A 772 1.321 -7.868 -4.533 1.00 0.00 C ATOM 942 OG1 THR A 772 2.685 -8.089 -4.910 1.00 0.00 O ATOM 943 CG2 THR A 772 0.921 -8.860 -3.436 1.00 0.00 C ATOM 0 H THR A 772 1.559 -6.570 -6.730 1.00 0.00 H new ATOM 0 HA THR A 772 0.506 -9.069 -6.063 1.00 0.00 H new ATOM 0 HB THR A 772 1.215 -6.853 -4.149 1.00 0.00 H new ATOM 0 HG1 THR A 772 3.263 -7.983 -4.125 1.00 0.00 H new ATOM 0 HG21 THR A 772 1.579 -8.736 -2.576 1.00 0.00 H new ATOM 0 HG22 THR A 772 -0.110 -8.673 -3.134 1.00 0.00 H new ATOM 0 HG23 THR A 772 1.009 -9.878 -3.816 1.00 0.00 H new ATOM 951 N MET A 773 -1.215 -6.346 -5.160 1.00 0.00 N ATOM 952 CA MET A 773 -2.539 -5.819 -4.851 1.00 0.00 C ATOM 953 C MET A 773 -3.522 -6.424 -5.845 1.00 0.00 C ATOM 954 O MET A 773 -4.484 -7.075 -5.468 1.00 0.00 O ATOM 955 CB MET A 773 -2.543 -4.297 -4.981 1.00 0.00 C ATOM 956 CG MET A 773 -2.245 -3.570 -3.688 1.00 0.00 C ATOM 957 SD MET A 773 -3.425 -3.944 -2.404 1.00 0.00 S ATOM 958 CE MET A 773 -4.861 -3.131 -3.075 1.00 0.00 C ATOM 0 H MET A 773 -0.481 -5.639 -5.200 1.00 0.00 H new ATOM 0 HA MET A 773 -2.819 -6.075 -3.829 1.00 0.00 H new ATOM 0 HB2 MET A 773 -1.806 -4.004 -5.729 1.00 0.00 H new ATOM 0 HB3 MET A 773 -3.517 -3.976 -5.350 1.00 0.00 H new ATOM 0 HG2 MET A 773 -1.245 -3.838 -3.347 1.00 0.00 H new ATOM 0 HG3 MET A 773 -2.242 -2.496 -3.872 1.00 0.00 H new ATOM 0 HE1 MET A 773 -5.235 -2.402 -2.356 1.00 0.00 H new ATOM 0 HE2 MET A 773 -4.592 -2.623 -4.001 1.00 0.00 H new ATOM 0 HE3 MET A 773 -5.636 -3.870 -3.279 1.00 0.00 H new ATOM 968 N SER A 774 -3.238 -6.224 -7.129 1.00 0.00 N ATOM 969 CA SER A 774 -4.074 -6.756 -8.203 1.00 0.00 C ATOM 970 C SER A 774 -4.099 -8.278 -8.182 1.00 0.00 C ATOM 971 O SER A 774 -5.028 -8.891 -8.675 1.00 0.00 O ATOM 972 CB SER A 774 -3.592 -6.265 -9.556 1.00 0.00 C ATOM 973 OG SER A 774 -2.413 -6.936 -9.960 1.00 0.00 O ATOM 0 H SER A 774 -2.429 -5.694 -7.453 1.00 0.00 H new ATOM 0 HA SER A 774 -5.088 -6.393 -8.037 1.00 0.00 H new ATOM 0 HB2 SER A 774 -4.373 -6.420 -10.300 1.00 0.00 H new ATOM 0 HB3 SER A 774 -3.404 -5.192 -9.509 1.00 0.00 H new ATOM 0 HG SER A 774 -2.038 -7.425 -9.198 1.00 0.00 H new ATOM 979 N GLU A 775 -3.061 -8.879 -7.625 1.00 0.00 N ATOM 980 CA GLU A 775 -2.973 -10.329 -7.509 1.00 0.00 C ATOM 981 C GLU A 775 -4.021 -10.784 -6.519 1.00 0.00 C ATOM 982 O GLU A 775 -4.770 -11.743 -6.735 1.00 0.00 O ATOM 983 CB GLU A 775 -1.580 -10.706 -7.017 1.00 0.00 C ATOM 984 CG GLU A 775 -0.788 -11.545 -7.989 1.00 0.00 C ATOM 985 CD GLU A 775 0.311 -12.344 -7.318 1.00 0.00 C ATOM 986 OE1 GLU A 775 0.024 -13.459 -6.835 1.00 0.00 O ATOM 987 OE2 GLU A 775 1.460 -11.856 -7.277 1.00 0.00 O ATOM 0 H GLU A 775 -2.258 -8.380 -7.241 1.00 0.00 H new ATOM 0 HA GLU A 775 -3.145 -10.808 -8.473 1.00 0.00 H new ATOM 0 HB2 GLU A 775 -1.023 -9.794 -6.804 1.00 0.00 H new ATOM 0 HB3 GLU A 775 -1.674 -11.250 -6.077 1.00 0.00 H new ATOM 0 HG2 GLU A 775 -1.463 -12.227 -8.506 1.00 0.00 H new ATOM 0 HG3 GLU A 775 -0.348 -10.897 -8.747 1.00 0.00 H new ATOM 994 N ARG A 776 -4.065 -10.031 -5.444 1.00 0.00 N ATOM 995 CA ARG A 776 -4.992 -10.234 -4.364 1.00 0.00 C ATOM 996 C ARG A 776 -6.382 -9.877 -4.860 1.00 0.00 C ATOM 997 O ARG A 776 -7.372 -10.528 -4.559 1.00 0.00 O ATOM 998 CB ARG A 776 -4.528 -9.351 -3.211 1.00 0.00 C ATOM 999 CG ARG A 776 -3.046 -9.537 -2.917 1.00 0.00 C ATOM 1000 CD ARG A 776 -2.666 -9.194 -1.490 1.00 0.00 C ATOM 1001 NE ARG A 776 -1.434 -9.865 -1.082 1.00 0.00 N ATOM 1002 CZ ARG A 776 -1.157 -10.203 0.173 1.00 0.00 C ATOM 1003 NH1 ARG A 776 -2.015 -9.923 1.145 1.00 0.00 N ATOM 1004 NH2 ARG A 776 -0.018 -10.818 0.459 1.00 0.00 N ATOM 0 H ARG A 776 -3.438 -9.240 -5.297 1.00 0.00 H new ATOM 0 HA ARG A 776 -5.028 -11.266 -4.016 1.00 0.00 H new ATOM 0 HB2 ARG A 776 -4.722 -8.306 -3.453 1.00 0.00 H new ATOM 0 HB3 ARG A 776 -5.108 -9.585 -2.318 1.00 0.00 H new ATOM 0 HG2 ARG A 776 -2.770 -10.572 -3.119 1.00 0.00 H new ATOM 0 HG3 ARG A 776 -2.467 -8.914 -3.599 1.00 0.00 H new ATOM 0 HD2 ARG A 776 -2.541 -8.115 -1.396 1.00 0.00 H new ATOM 0 HD3 ARG A 776 -3.476 -9.481 -0.819 1.00 0.00 H new ATOM 0 HE ARG A 776 -0.747 -10.087 -1.802 1.00 0.00 H new ATOM 0 HH11 ARG A 776 -2.891 -9.447 0.930 1.00 0.00 H new ATOM 0 HH12 ARG A 776 -1.799 -10.184 2.107 1.00 0.00 H new ATOM 0 HH21 ARG A 776 0.647 -11.032 -0.285 1.00 0.00 H new ATOM 0 HH22 ARG A 776 0.194 -11.077 1.423 1.00 0.00 H new ATOM 1018 N LEU A 777 -6.410 -8.871 -5.697 1.00 0.00 N ATOM 1019 CA LEU A 777 -7.637 -8.372 -6.292 1.00 0.00 C ATOM 1020 C LEU A 777 -8.226 -9.402 -7.215 1.00 0.00 C ATOM 1021 O LEU A 777 -9.400 -9.751 -7.116 1.00 0.00 O ATOM 1022 CB LEU A 777 -7.298 -7.101 -7.059 1.00 0.00 C ATOM 1023 CG LEU A 777 -8.447 -6.245 -7.578 1.00 0.00 C ATOM 1024 CD1 LEU A 777 -9.699 -7.019 -7.867 1.00 0.00 C ATOM 1025 CD2 LEU A 777 -8.743 -5.162 -6.578 1.00 0.00 C ATOM 0 H LEU A 777 -5.575 -8.365 -5.992 1.00 0.00 H new ATOM 0 HA LEU A 777 -8.375 -8.160 -5.519 1.00 0.00 H new ATOM 0 HB2 LEU A 777 -6.683 -6.476 -6.412 1.00 0.00 H new ATOM 0 HB3 LEU A 777 -6.680 -7.382 -7.912 1.00 0.00 H new ATOM 0 HG LEU A 777 -8.122 -5.826 -8.530 1.00 0.00 H new ATOM 0 HD11 LEU A 777 -10.470 -6.341 -8.232 1.00 0.00 H new ATOM 0 HD12 LEU A 777 -9.493 -7.775 -8.624 1.00 0.00 H new ATOM 0 HD13 LEU A 777 -10.045 -7.505 -6.955 1.00 0.00 H new ATOM 0 HD21 LEU A 777 -9.564 -4.545 -6.942 1.00 0.00 H new ATOM 0 HD22 LEU A 777 -9.022 -5.613 -5.626 1.00 0.00 H new ATOM 0 HD23 LEU A 777 -7.857 -4.542 -6.440 1.00 0.00 H new ATOM 1037 N LYS A 778 -7.398 -9.888 -8.107 1.00 0.00 N ATOM 1038 CA LYS A 778 -7.835 -10.853 -9.069 1.00 0.00 C ATOM 1039 C LYS A 778 -8.511 -12.022 -8.380 1.00 0.00 C ATOM 1040 O LYS A 778 -9.598 -12.448 -8.771 1.00 0.00 O ATOM 1041 CB LYS A 778 -6.674 -11.378 -9.881 1.00 0.00 C ATOM 1042 CG LYS A 778 -6.618 -10.815 -11.272 1.00 0.00 C ATOM 1043 CD LYS A 778 -5.845 -9.509 -11.322 1.00 0.00 C ATOM 1044 CE LYS A 778 -4.330 -9.734 -11.402 1.00 0.00 C ATOM 1045 NZ LYS A 778 -3.883 -10.865 -10.542 1.00 0.00 N ATOM 0 H LYS A 778 -6.415 -9.626 -8.182 1.00 0.00 H new ATOM 0 HA LYS A 778 -8.541 -10.353 -9.732 1.00 0.00 H new ATOM 0 HB2 LYS A 778 -5.743 -11.144 -9.364 1.00 0.00 H new ATOM 0 HB3 LYS A 778 -6.742 -12.464 -9.939 1.00 0.00 H new ATOM 0 HG2 LYS A 778 -6.150 -11.540 -11.939 1.00 0.00 H new ATOM 0 HG3 LYS A 778 -7.631 -10.652 -11.639 1.00 0.00 H new ATOM 0 HD2 LYS A 778 -6.170 -8.929 -12.186 1.00 0.00 H new ATOM 0 HD3 LYS A 778 -6.076 -8.918 -10.436 1.00 0.00 H new ATOM 0 HE2 LYS A 778 -4.048 -9.933 -12.436 1.00 0.00 H new ATOM 0 HE3 LYS A 778 -3.813 -8.823 -11.100 1.00 0.00 H new ATOM 0 HZ1 LYS A 778 -2.844 -10.885 -10.507 1.00 0.00 H new ATOM 0 HZ2 LYS A 778 -4.259 -10.740 -9.581 1.00 0.00 H new ATOM 0 HZ3 LYS A 778 -4.233 -11.761 -10.937 1.00 0.00 H new ATOM 1059 N ASN A 779 -7.847 -12.546 -7.346 1.00 0.00 N ATOM 1060 CA ASN A 779 -8.385 -13.681 -6.605 1.00 0.00 C ATOM 1061 C ASN A 779 -9.536 -13.252 -5.695 1.00 0.00 C ATOM 1062 O ASN A 779 -10.117 -14.071 -4.983 1.00 0.00 O ATOM 1063 CB ASN A 779 -7.287 -14.373 -5.794 1.00 0.00 C ATOM 1064 CG ASN A 779 -7.124 -13.808 -4.398 1.00 0.00 C ATOM 1065 OD1 ASN A 779 -6.084 -13.009 -4.211 1.00 0.00 O flip ATOM 1066 ND2 ASN A 779 -7.907 -14.103 -3.496 1.00 0.00 N flip ATOM 0 H ASN A 779 -6.947 -12.205 -7.009 1.00 0.00 H new ATOM 0 HA ASN A 779 -8.777 -14.394 -7.330 1.00 0.00 H new ATOM 0 HB2 ASN A 779 -7.514 -15.437 -5.723 1.00 0.00 H new ATOM 0 HB3 ASN A 779 -6.341 -14.283 -6.327 1.00 0.00 H new ATOM 0 HD21 ASN A 779 -8.695 -14.722 -3.687 1.00 0.00 H new ATOM 0 HD22 ASN A 779 -7.769 -13.728 -2.558 1.00 0.00 H new ATOM 1073 N ARG A 780 -9.831 -11.953 -5.722 1.00 0.00 N ATOM 1074 CA ARG A 780 -10.918 -11.349 -4.941 1.00 0.00 C ATOM 1075 C ARG A 780 -10.533 -11.206 -3.478 1.00 0.00 C ATOM 1076 O ARG A 780 -11.374 -10.901 -2.632 1.00 0.00 O ATOM 1077 CB ARG A 780 -12.208 -12.160 -5.042 1.00 0.00 C ATOM 1078 CG ARG A 780 -12.950 -11.995 -6.346 1.00 0.00 C ATOM 1079 CD ARG A 780 -12.255 -12.736 -7.469 1.00 0.00 C ATOM 1080 NE ARG A 780 -13.077 -13.813 -8.013 1.00 0.00 N ATOM 1081 CZ ARG A 780 -12.585 -14.975 -8.432 1.00 0.00 C ATOM 1082 NH1 ARG A 780 -11.284 -15.218 -8.356 1.00 0.00 N ATOM 1083 NH2 ARG A 780 -13.398 -15.899 -8.927 1.00 0.00 N ATOM 0 H ARG A 780 -9.318 -11.280 -6.292 1.00 0.00 H new ATOM 0 HA ARG A 780 -11.091 -10.360 -5.366 1.00 0.00 H new ATOM 0 HB2 ARG A 780 -11.971 -13.215 -4.904 1.00 0.00 H new ATOM 0 HB3 ARG A 780 -12.868 -11.872 -4.224 1.00 0.00 H new ATOM 0 HG2 ARG A 780 -13.969 -12.367 -6.237 1.00 0.00 H new ATOM 0 HG3 ARG A 780 -13.022 -10.936 -6.595 1.00 0.00 H new ATOM 0 HD2 ARG A 780 -12.006 -12.034 -8.265 1.00 0.00 H new ATOM 0 HD3 ARG A 780 -11.315 -13.149 -7.102 1.00 0.00 H new ATOM 0 HE ARG A 780 -14.084 -13.666 -8.075 1.00 0.00 H new ATOM 0 HH11 ARG A 780 -10.655 -14.512 -7.975 1.00 0.00 H new ATOM 0 HH12 ARG A 780 -10.912 -16.111 -8.679 1.00 0.00 H new ATOM 0 HH21 ARG A 780 -14.400 -15.718 -8.986 1.00 0.00 H new ATOM 0 HH22 ARG A 780 -13.021 -16.791 -9.249 1.00 0.00 H new ATOM 1097 N TYR A 781 -9.261 -11.444 -3.196 1.00 0.00 N ATOM 1098 CA TYR A 781 -8.722 -11.349 -1.844 1.00 0.00 C ATOM 1099 C TYR A 781 -9.362 -10.218 -1.052 1.00 0.00 C ATOM 1100 O TYR A 781 -9.702 -10.396 0.114 1.00 0.00 O ATOM 1101 CB TYR A 781 -7.211 -11.134 -1.912 1.00 0.00 C ATOM 1102 CG TYR A 781 -6.536 -10.761 -0.622 1.00 0.00 C ATOM 1103 CD1 TYR A 781 -6.485 -9.440 -0.222 1.00 0.00 C ATOM 1104 CD2 TYR A 781 -5.913 -11.717 0.169 1.00 0.00 C ATOM 1105 CE1 TYR A 781 -5.835 -9.069 0.927 1.00 0.00 C ATOM 1106 CE2 TYR A 781 -5.262 -11.357 1.333 1.00 0.00 C ATOM 1107 CZ TYR A 781 -5.222 -10.031 1.707 1.00 0.00 C ATOM 1108 OH TYR A 781 -4.560 -9.667 2.858 1.00 0.00 O ATOM 0 H TYR A 781 -8.570 -11.709 -3.898 1.00 0.00 H new ATOM 0 HA TYR A 781 -8.949 -12.283 -1.330 1.00 0.00 H new ATOM 0 HB2 TYR A 781 -6.751 -12.048 -2.288 1.00 0.00 H new ATOM 0 HB3 TYR A 781 -7.009 -10.352 -2.643 1.00 0.00 H new ATOM 0 HD1 TYR A 781 -6.966 -8.685 -0.826 1.00 0.00 H new ATOM 0 HD2 TYR A 781 -5.938 -12.755 -0.129 1.00 0.00 H new ATOM 0 HE1 TYR A 781 -5.802 -8.030 1.221 1.00 0.00 H new ATOM 0 HE2 TYR A 781 -4.788 -12.109 1.946 1.00 0.00 H new ATOM 0 HH TYR A 781 -4.187 -10.465 3.287 1.00 0.00 H new ATOM 1118 N TYR A 782 -9.525 -9.058 -1.689 1.00 0.00 N ATOM 1119 CA TYR A 782 -10.093 -7.901 -1.015 1.00 0.00 C ATOM 1120 C TYR A 782 -11.539 -8.099 -0.634 1.00 0.00 C ATOM 1121 O TYR A 782 -12.454 -7.605 -1.293 1.00 0.00 O ATOM 1122 CB TYR A 782 -9.901 -6.652 -1.860 1.00 0.00 C ATOM 1123 CG TYR A 782 -8.485 -6.516 -2.223 1.00 0.00 C ATOM 1124 CD1 TYR A 782 -7.596 -6.076 -1.295 1.00 0.00 C ATOM 1125 CD2 TYR A 782 -8.023 -6.891 -3.454 1.00 0.00 C ATOM 1126 CE1 TYR A 782 -6.273 -6.008 -1.569 1.00 0.00 C ATOM 1127 CE2 TYR A 782 -6.690 -6.804 -3.744 1.00 0.00 C ATOM 1128 CZ TYR A 782 -5.822 -6.365 -2.792 1.00 0.00 C ATOM 1129 OH TYR A 782 -4.490 -6.312 -3.052 1.00 0.00 O ATOM 0 H TYR A 782 -9.272 -8.900 -2.664 1.00 0.00 H new ATOM 0 HA TYR A 782 -9.553 -7.772 -0.077 1.00 0.00 H new ATOM 0 HB2 TYR A 782 -10.513 -6.712 -2.760 1.00 0.00 H new ATOM 0 HB3 TYR A 782 -10.231 -5.772 -1.307 1.00 0.00 H new ATOM 0 HD1 TYR A 782 -7.952 -5.775 -0.321 1.00 0.00 H new ATOM 0 HD2 TYR A 782 -8.713 -7.257 -4.200 1.00 0.00 H new ATOM 0 HE1 TYR A 782 -5.580 -5.670 -0.813 1.00 0.00 H new ATOM 0 HE2 TYR A 782 -6.328 -7.082 -4.723 1.00 0.00 H new ATOM 0 HH TYR A 782 -4.072 -5.633 -2.482 1.00 0.00 H new ATOM 1139 N VAL A 783 -11.728 -8.837 0.448 1.00 0.00 N ATOM 1140 CA VAL A 783 -13.043 -9.073 0.982 1.00 0.00 C ATOM 1141 C VAL A 783 -13.378 -7.918 1.887 1.00 0.00 C ATOM 1142 O VAL A 783 -14.343 -7.936 2.651 1.00 0.00 O ATOM 1143 CB VAL A 783 -13.111 -10.385 1.762 1.00 0.00 C ATOM 1144 CG1 VAL A 783 -12.973 -11.538 0.809 1.00 0.00 C ATOM 1145 CG2 VAL A 783 -12.037 -10.418 2.822 1.00 0.00 C ATOM 0 H VAL A 783 -10.975 -9.283 0.972 1.00 0.00 H new ATOM 0 HA VAL A 783 -13.758 -9.153 0.163 1.00 0.00 H new ATOM 0 HB VAL A 783 -14.075 -10.464 2.265 1.00 0.00 H new ATOM 0 HG11 VAL A 783 -13.021 -12.476 1.363 1.00 0.00 H new ATOM 0 HG12 VAL A 783 -13.782 -11.506 0.079 1.00 0.00 H new ATOM 0 HG13 VAL A 783 -12.016 -11.471 0.292 1.00 0.00 H new ATOM 0 HG21 VAL A 783 -12.096 -11.358 3.371 1.00 0.00 H new ATOM 0 HG22 VAL A 783 -11.058 -10.334 2.351 1.00 0.00 H new ATOM 0 HG23 VAL A 783 -12.180 -9.586 3.511 1.00 0.00 H new ATOM 1155 N SER A 784 -12.535 -6.910 1.767 1.00 0.00 N ATOM 1156 CA SER A 784 -12.631 -5.709 2.544 1.00 0.00 C ATOM 1157 C SER A 784 -11.753 -4.634 1.919 1.00 0.00 C ATOM 1158 O SER A 784 -10.562 -4.850 1.706 1.00 0.00 O ATOM 1159 CB SER A 784 -12.180 -6.007 3.958 1.00 0.00 C ATOM 1160 OG SER A 784 -13.284 -6.229 4.817 1.00 0.00 O ATOM 0 H SER A 784 -11.753 -6.912 1.112 1.00 0.00 H new ATOM 0 HA SER A 784 -13.660 -5.350 2.564 1.00 0.00 H new ATOM 0 HB2 SER A 784 -11.535 -6.885 3.958 1.00 0.00 H new ATOM 0 HB3 SER A 784 -11.586 -5.175 4.335 1.00 0.00 H new ATOM 0 HG SER A 784 -13.926 -6.825 4.377 1.00 0.00 H new ATOM 1166 N LYS A 785 -12.341 -3.486 1.602 1.00 0.00 N ATOM 1167 CA LYS A 785 -11.587 -2.393 0.997 1.00 0.00 C ATOM 1168 C LYS A 785 -10.400 -2.029 1.871 1.00 0.00 C ATOM 1169 O LYS A 785 -9.512 -1.297 1.445 1.00 0.00 O ATOM 1170 CB LYS A 785 -12.471 -1.174 0.799 1.00 0.00 C ATOM 1171 CG LYS A 785 -12.677 -0.358 2.063 1.00 0.00 C ATOM 1172 CD LYS A 785 -14.146 -0.052 2.269 1.00 0.00 C ATOM 1173 CE LYS A 785 -14.960 -1.325 2.423 1.00 0.00 C ATOM 1174 NZ LYS A 785 -14.584 -2.082 3.651 1.00 0.00 N ATOM 0 H LYS A 785 -13.330 -3.288 1.752 1.00 0.00 H new ATOM 0 HA LYS A 785 -11.228 -2.725 0.023 1.00 0.00 H new ATOM 0 HB2 LYS A 785 -12.029 -0.536 0.033 1.00 0.00 H new ATOM 0 HB3 LYS A 785 -13.442 -1.497 0.423 1.00 0.00 H new ATOM 0 HG2 LYS A 785 -12.290 -0.906 2.922 1.00 0.00 H new ATOM 0 HG3 LYS A 785 -12.112 0.572 1.998 1.00 0.00 H new ATOM 0 HD2 LYS A 785 -14.269 0.570 3.156 1.00 0.00 H new ATOM 0 HD3 LYS A 785 -14.522 0.522 1.422 1.00 0.00 H new ATOM 0 HE2 LYS A 785 -16.020 -1.075 2.461 1.00 0.00 H new ATOM 0 HE3 LYS A 785 -14.813 -1.958 1.548 1.00 0.00 H new ATOM 0 HZ1 LYS A 785 -15.260 -2.858 3.801 1.00 0.00 H new ATOM 0 HZ2 LYS A 785 -13.627 -2.474 3.538 1.00 0.00 H new ATOM 0 HZ3 LYS A 785 -14.602 -1.443 4.472 1.00 0.00 H new ATOM 1188 N LYS A 786 -10.406 -2.525 3.109 1.00 0.00 N ATOM 1189 CA LYS A 786 -9.318 -2.258 4.032 1.00 0.00 C ATOM 1190 C LYS A 786 -8.129 -3.140 3.695 1.00 0.00 C ATOM 1191 O LYS A 786 -6.988 -2.760 3.916 1.00 0.00 O ATOM 1192 CB LYS A 786 -9.766 -2.460 5.482 1.00 0.00 C ATOM 1193 CG LYS A 786 -8.700 -2.117 6.511 1.00 0.00 C ATOM 1194 CD LYS A 786 -7.891 -3.341 6.910 1.00 0.00 C ATOM 1195 CE LYS A 786 -6.880 -3.010 7.995 1.00 0.00 C ATOM 1196 NZ LYS A 786 -6.124 -4.213 8.437 1.00 0.00 N ATOM 0 H LYS A 786 -11.151 -3.110 3.488 1.00 0.00 H new ATOM 0 HA LYS A 786 -9.017 -1.216 3.928 1.00 0.00 H new ATOM 0 HB2 LYS A 786 -10.647 -1.846 5.668 1.00 0.00 H new ATOM 0 HB3 LYS A 786 -10.067 -3.499 5.617 1.00 0.00 H new ATOM 0 HG2 LYS A 786 -8.033 -1.356 6.105 1.00 0.00 H new ATOM 0 HG3 LYS A 786 -9.172 -1.688 7.395 1.00 0.00 H new ATOM 0 HD2 LYS A 786 -8.563 -4.123 7.263 1.00 0.00 H new ATOM 0 HD3 LYS A 786 -7.373 -3.737 6.037 1.00 0.00 H new ATOM 0 HE2 LYS A 786 -6.182 -2.259 7.624 1.00 0.00 H new ATOM 0 HE3 LYS A 786 -7.395 -2.571 8.849 1.00 0.00 H new ATOM 0 HZ1 LYS A 786 -5.445 -3.944 9.177 1.00 0.00 H new ATOM 0 HZ2 LYS A 786 -6.787 -4.920 8.815 1.00 0.00 H new ATOM 0 HZ3 LYS A 786 -5.611 -4.617 7.628 1.00 0.00 H new ATOM 1210 N LEU A 787 -8.398 -4.342 3.203 1.00 0.00 N ATOM 1211 CA LEU A 787 -7.334 -5.220 2.755 1.00 0.00 C ATOM 1212 C LEU A 787 -6.616 -4.485 1.687 1.00 0.00 C ATOM 1213 O LEU A 787 -5.393 -4.387 1.625 1.00 0.00 O ATOM 1214 CB LEU A 787 -7.924 -6.460 2.116 1.00 0.00 C ATOM 1215 CG LEU A 787 -8.256 -7.559 3.067 1.00 0.00 C ATOM 1216 CD1 LEU A 787 -8.942 -8.681 2.325 1.00 0.00 C ATOM 1217 CD2 LEU A 787 -6.994 -8.001 3.769 1.00 0.00 C ATOM 0 H LEU A 787 -9.338 -4.726 3.106 1.00 0.00 H new ATOM 0 HA LEU A 787 -6.694 -5.503 3.591 1.00 0.00 H new ATOM 0 HB2 LEU A 787 -8.830 -6.178 1.579 1.00 0.00 H new ATOM 0 HB3 LEU A 787 -7.220 -6.840 1.376 1.00 0.00 H new ATOM 0 HG LEU A 787 -8.952 -7.215 3.832 1.00 0.00 H new ATOM 0 HD11 LEU A 787 -9.184 -9.484 3.022 1.00 0.00 H new ATOM 0 HD12 LEU A 787 -9.859 -8.308 1.868 1.00 0.00 H new ATOM 0 HD13 LEU A 787 -8.279 -9.062 1.548 1.00 0.00 H new ATOM 0 HD21 LEU A 787 -7.228 -8.805 4.467 1.00 0.00 H new ATOM 0 HD22 LEU A 787 -6.274 -8.358 3.033 1.00 0.00 H new ATOM 0 HD23 LEU A 787 -6.568 -7.160 4.315 1.00 0.00 H new ATOM 1229 N PHE A 788 -7.468 -3.992 0.839 1.00 0.00 N ATOM 1230 CA PHE A 788 -7.117 -3.219 -0.290 1.00 0.00 C ATOM 1231 C PHE A 788 -6.411 -1.955 0.113 1.00 0.00 C ATOM 1232 O PHE A 788 -5.397 -1.581 -0.475 1.00 0.00 O ATOM 1233 CB PHE A 788 -8.377 -2.937 -1.023 1.00 0.00 C ATOM 1234 CG PHE A 788 -8.039 -2.535 -2.369 1.00 0.00 C ATOM 1235 CD1 PHE A 788 -7.738 -1.257 -2.538 1.00 0.00 C ATOM 1236 CD2 PHE A 788 -7.979 -3.400 -3.427 1.00 0.00 C ATOM 1237 CE1 PHE A 788 -7.380 -0.770 -3.733 1.00 0.00 C ATOM 1238 CE2 PHE A 788 -7.615 -2.925 -4.661 1.00 0.00 C ATOM 1239 CZ PHE A 788 -7.318 -1.600 -4.810 1.00 0.00 C ATOM 0 H PHE A 788 -8.474 -4.131 0.930 1.00 0.00 H new ATOM 0 HA PHE A 788 -6.418 -3.758 -0.929 1.00 0.00 H new ATOM 0 HB2 PHE A 788 -9.013 -3.822 -1.040 1.00 0.00 H new ATOM 0 HB3 PHE A 788 -8.940 -2.150 -0.522 1.00 0.00 H new ATOM 0 HD1 PHE A 788 -7.782 -0.590 -1.690 1.00 0.00 H new ATOM 0 HD2 PHE A 788 -8.216 -4.445 -3.292 1.00 0.00 H new ATOM 0 HE1 PHE A 788 -7.141 0.278 -3.842 1.00 0.00 H new ATOM 0 HE2 PHE A 788 -7.564 -3.593 -5.508 1.00 0.00 H new ATOM 0 HZ PHE A 788 -7.035 -1.213 -5.778 1.00 0.00 H new ATOM 1249 N MET A 789 -6.943 -1.301 1.113 1.00 0.00 N ATOM 1250 CA MET A 789 -6.339 -0.095 1.593 1.00 0.00 C ATOM 1251 C MET A 789 -4.974 -0.419 2.147 1.00 0.00 C ATOM 1252 O MET A 789 -3.972 -0.013 1.603 1.00 0.00 O ATOM 1253 CB MET A 789 -7.206 0.534 2.648 1.00 0.00 C ATOM 1254 CG MET A 789 -8.305 1.374 2.043 1.00 0.00 C ATOM 1255 SD MET A 789 -8.444 2.987 2.819 1.00 0.00 S ATOM 1256 CE MET A 789 -7.721 4.014 1.545 1.00 0.00 C ATOM 0 H MET A 789 -7.790 -1.585 1.606 1.00 0.00 H new ATOM 0 HA MET A 789 -6.235 0.617 0.775 1.00 0.00 H new ATOM 0 HB2 MET A 789 -7.645 -0.246 3.270 1.00 0.00 H new ATOM 0 HB3 MET A 789 -6.592 1.154 3.301 1.00 0.00 H new ATOM 0 HG2 MET A 789 -8.115 1.502 0.977 1.00 0.00 H new ATOM 0 HG3 MET A 789 -9.254 0.846 2.136 1.00 0.00 H new ATOM 0 HE1 MET A 789 -7.199 4.853 2.006 1.00 0.00 H new ATOM 0 HE2 MET A 789 -7.015 3.425 0.960 1.00 0.00 H new ATOM 0 HE3 MET A 789 -8.508 4.391 0.892 1.00 0.00 H new ATOM 1266 N ALA A 790 -4.970 -1.219 3.196 1.00 0.00 N ATOM 1267 CA ALA A 790 -3.752 -1.643 3.875 1.00 0.00 C ATOM 1268 C ALA A 790 -2.656 -2.108 2.928 1.00 0.00 C ATOM 1269 O ALA A 790 -1.519 -1.677 3.048 1.00 0.00 O ATOM 1270 CB ALA A 790 -4.077 -2.788 4.806 1.00 0.00 C ATOM 0 H ALA A 790 -5.821 -1.600 3.609 1.00 0.00 H new ATOM 0 HA ALA A 790 -3.378 -0.769 4.409 1.00 0.00 H new ATOM 0 HB1 ALA A 790 -3.170 -3.110 5.317 1.00 0.00 H new ATOM 0 HB2 ALA A 790 -4.812 -2.461 5.542 1.00 0.00 H new ATOM 0 HB3 ALA A 790 -4.484 -3.620 4.231 1.00 0.00 H new ATOM 1276 N ASP A 791 -3.000 -3.011 2.014 1.00 0.00 N ATOM 1277 CA ASP A 791 -2.027 -3.570 1.078 1.00 0.00 C ATOM 1278 C ASP A 791 -1.548 -2.523 0.072 1.00 0.00 C ATOM 1279 O ASP A 791 -0.355 -2.323 -0.098 1.00 0.00 O ATOM 1280 CB ASP A 791 -2.604 -4.792 0.375 1.00 0.00 C ATOM 1281 CG ASP A 791 -2.829 -5.956 1.321 1.00 0.00 C ATOM 1282 OD1 ASP A 791 -2.801 -5.739 2.551 1.00 0.00 O ATOM 1283 OD2 ASP A 791 -3.037 -7.086 0.831 1.00 0.00 O ATOM 0 H ASP A 791 -3.947 -3.372 1.901 1.00 0.00 H new ATOM 0 HA ASP A 791 -1.154 -3.886 1.649 1.00 0.00 H new ATOM 0 HB2 ASP A 791 -3.550 -4.523 -0.096 1.00 0.00 H new ATOM 0 HB3 ASP A 791 -1.928 -5.101 -0.422 1.00 0.00 H new ATOM 1288 N LEU A 792 -2.449 -1.867 -0.629 1.00 0.00 N ATOM 1289 CA LEU A 792 -2.003 -0.826 -1.541 1.00 0.00 C ATOM 1290 C LEU A 792 -1.232 0.185 -0.727 1.00 0.00 C ATOM 1291 O LEU A 792 -0.240 0.759 -1.177 1.00 0.00 O ATOM 1292 CB LEU A 792 -3.179 -0.129 -2.215 1.00 0.00 C ATOM 1293 CG LEU A 792 -3.183 -0.152 -3.719 1.00 0.00 C ATOM 1294 CD1 LEU A 792 -4.262 0.771 -4.219 1.00 0.00 C ATOM 1295 CD2 LEU A 792 -1.824 0.231 -4.255 1.00 0.00 C ATOM 0 H LEU A 792 -3.456 -2.024 -0.592 1.00 0.00 H new ATOM 0 HA LEU A 792 -1.389 -1.271 -2.324 1.00 0.00 H new ATOM 0 HB2 LEU A 792 -4.101 -0.591 -1.862 1.00 0.00 H new ATOM 0 HB3 LEU A 792 -3.197 0.910 -1.887 1.00 0.00 H new ATOM 0 HG LEU A 792 -3.395 -1.160 -4.076 1.00 0.00 H new ATOM 0 HD11 LEU A 792 -4.273 0.761 -5.309 1.00 0.00 H new ATOM 0 HD12 LEU A 792 -5.229 0.437 -3.843 1.00 0.00 H new ATOM 0 HD13 LEU A 792 -4.066 1.784 -3.867 1.00 0.00 H new ATOM 0 HD21 LEU A 792 -1.843 0.210 -5.345 1.00 0.00 H new ATOM 0 HD22 LEU A 792 -1.569 1.235 -3.916 1.00 0.00 H new ATOM 0 HD23 LEU A 792 -1.077 -0.475 -3.891 1.00 0.00 H new ATOM 1307 N GLN A 793 -1.699 0.364 0.496 1.00 0.00 N ATOM 1308 CA GLN A 793 -1.074 1.273 1.424 1.00 0.00 C ATOM 1309 C GLN A 793 0.208 0.639 1.891 1.00 0.00 C ATOM 1310 O GLN A 793 1.119 1.298 2.386 1.00 0.00 O ATOM 1311 CB GLN A 793 -1.995 1.569 2.600 1.00 0.00 C ATOM 1312 CG GLN A 793 -3.128 2.510 2.238 1.00 0.00 C ATOM 1313 CD GLN A 793 -4.132 2.684 3.366 1.00 0.00 C ATOM 1314 OE1 GLN A 793 -5.395 2.953 3.027 1.00 0.00 O flip ATOM 1315 NE2 GLN A 793 -3.776 2.582 4.540 1.00 0.00 N flip ATOM 0 H GLN A 793 -2.518 -0.117 0.867 1.00 0.00 H new ATOM 0 HA GLN A 793 -0.867 2.226 0.936 1.00 0.00 H new ATOM 0 HB2 GLN A 793 -2.411 0.634 2.974 1.00 0.00 H new ATOM 0 HB3 GLN A 793 -1.412 2.005 3.411 1.00 0.00 H new ATOM 0 HG2 GLN A 793 -2.715 3.483 1.972 1.00 0.00 H new ATOM 0 HG3 GLN A 793 -3.642 2.130 1.355 1.00 0.00 H new ATOM 0 HE21 GLN A 793 -2.802 2.375 4.761 1.00 0.00 H new ATOM 0 HE22 GLN A 793 -4.455 2.704 5.291 1.00 0.00 H new ATOM 1324 N ARG A 794 0.244 -0.672 1.716 1.00 0.00 N ATOM 1325 CA ARG A 794 1.387 -1.476 2.062 1.00 0.00 C ATOM 1326 C ARG A 794 2.482 -1.218 1.044 1.00 0.00 C ATOM 1327 O ARG A 794 3.666 -1.371 1.342 1.00 0.00 O ATOM 1328 CB ARG A 794 1.008 -2.950 2.108 1.00 0.00 C ATOM 1329 CG ARG A 794 2.074 -3.790 2.753 1.00 0.00 C ATOM 1330 CD ARG A 794 2.216 -3.469 4.220 1.00 0.00 C ATOM 1331 NE ARG A 794 3.388 -2.644 4.498 1.00 0.00 N ATOM 1332 CZ ARG A 794 3.890 -2.465 5.718 1.00 0.00 C ATOM 1333 NH1 ARG A 794 3.321 -3.049 6.764 1.00 0.00 N ATOM 1334 NH2 ARG A 794 4.960 -1.702 5.891 1.00 0.00 N ATOM 0 H ARG A 794 -0.532 -1.206 1.325 1.00 0.00 H new ATOM 0 HA ARG A 794 1.749 -1.206 3.054 1.00 0.00 H new ATOM 0 HB2 ARG A 794 0.074 -3.066 2.658 1.00 0.00 H new ATOM 0 HB3 ARG A 794 0.828 -3.309 1.095 1.00 0.00 H new ATOM 0 HG2 ARG A 794 1.830 -4.845 2.632 1.00 0.00 H new ATOM 0 HG3 ARG A 794 3.026 -3.623 2.249 1.00 0.00 H new ATOM 0 HD2 ARG A 794 1.321 -2.951 4.564 1.00 0.00 H new ATOM 0 HD3 ARG A 794 2.286 -4.397 4.787 1.00 0.00 H new ATOM 0 HE ARG A 794 3.847 -2.179 3.715 1.00 0.00 H new ATOM 0 HH11 ARG A 794 2.497 -3.637 6.635 1.00 0.00 H new ATOM 0 HH12 ARG A 794 3.707 -2.911 7.698 1.00 0.00 H new ATOM 0 HH21 ARG A 794 5.400 -1.251 5.089 1.00 0.00 H new ATOM 0 HH22 ARG A 794 5.343 -1.566 6.826 1.00 0.00 H new ATOM 1348 N VAL A 795 2.080 -0.821 -0.170 1.00 0.00 N ATOM 1349 CA VAL A 795 3.052 -0.495 -1.199 1.00 0.00 C ATOM 1350 C VAL A 795 3.597 0.895 -0.904 1.00 0.00 C ATOM 1351 O VAL A 795 4.775 1.052 -0.626 1.00 0.00 O ATOM 1352 CB VAL A 795 2.493 -0.614 -2.658 1.00 0.00 C ATOM 1353 CG1 VAL A 795 1.279 -1.514 -2.676 1.00 0.00 C ATOM 1354 CG2 VAL A 795 2.168 0.727 -3.320 1.00 0.00 C ATOM 0 H VAL A 795 1.105 -0.722 -0.452 1.00 0.00 H new ATOM 0 HA VAL A 795 3.855 -1.232 -1.164 1.00 0.00 H new ATOM 0 HB VAL A 795 3.297 -1.049 -3.252 1.00 0.00 H new ATOM 0 HG11 VAL A 795 0.898 -1.590 -3.694 1.00 0.00 H new ATOM 0 HG12 VAL A 795 1.556 -2.505 -2.317 1.00 0.00 H new ATOM 0 HG13 VAL A 795 0.507 -1.096 -2.030 1.00 0.00 H new ATOM 0 HG21 VAL A 795 1.787 0.553 -4.326 1.00 0.00 H new ATOM 0 HG22 VAL A 795 1.414 1.250 -2.732 1.00 0.00 H new ATOM 0 HG23 VAL A 795 3.071 1.335 -3.374 1.00 0.00 H new ATOM 1364 N PHE A 796 2.714 1.884 -0.863 1.00 0.00 N ATOM 1365 CA PHE A 796 3.124 3.260 -0.583 1.00 0.00 C ATOM 1366 C PHE A 796 3.986 3.315 0.673 1.00 0.00 C ATOM 1367 O PHE A 796 5.041 3.943 0.679 1.00 0.00 O ATOM 1368 CB PHE A 796 1.920 4.169 -0.379 1.00 0.00 C ATOM 1369 CG PHE A 796 0.716 3.799 -1.188 1.00 0.00 C ATOM 1370 CD1 PHE A 796 0.806 3.503 -2.533 1.00 0.00 C ATOM 1371 CD2 PHE A 796 -0.506 3.718 -0.586 1.00 0.00 C ATOM 1372 CE1 PHE A 796 -0.308 3.133 -3.251 1.00 0.00 C ATOM 1373 CE2 PHE A 796 -1.614 3.350 -1.300 1.00 0.00 C ATOM 1374 CZ PHE A 796 -1.510 3.056 -2.635 1.00 0.00 C ATOM 0 H PHE A 796 1.713 1.764 -1.019 1.00 0.00 H new ATOM 0 HA PHE A 796 3.693 3.606 -1.446 1.00 0.00 H new ATOM 0 HB2 PHE A 796 1.649 4.160 0.677 1.00 0.00 H new ATOM 0 HB3 PHE A 796 2.207 5.191 -0.625 1.00 0.00 H new ATOM 0 HD1 PHE A 796 1.764 3.563 -3.029 1.00 0.00 H new ATOM 0 HD2 PHE A 796 -0.600 3.947 0.465 1.00 0.00 H new ATOM 0 HE1 PHE A 796 -0.223 2.905 -4.303 1.00 0.00 H new ATOM 0 HE2 PHE A 796 -2.574 3.291 -0.810 1.00 0.00 H new ATOM 0 HZ PHE A 796 -2.386 2.763 -3.194 1.00 0.00 H new ATOM 1384 N THR A 797 3.528 2.649 1.737 1.00 0.00 N ATOM 1385 CA THR A 797 4.258 2.640 3.001 1.00 0.00 C ATOM 1386 C THR A 797 5.620 1.970 2.848 1.00 0.00 C ATOM 1387 O THR A 797 6.624 2.522 3.280 1.00 0.00 O ATOM 1388 CB THR A 797 3.458 1.969 4.142 1.00 0.00 C ATOM 1389 OG1 THR A 797 4.025 2.328 5.407 1.00 0.00 O ATOM 1390 CG2 THR A 797 3.450 0.456 4.010 1.00 0.00 C ATOM 0 H THR A 797 2.660 2.113 1.746 1.00 0.00 H new ATOM 0 HA THR A 797 4.408 3.684 3.276 1.00 0.00 H new ATOM 0 HB THR A 797 2.429 2.322 4.075 1.00 0.00 H new ATOM 0 HG1 THR A 797 4.946 1.997 5.458 1.00 0.00 H new ATOM 0 HG21 THR A 797 2.878 0.022 4.830 1.00 0.00 H new ATOM 0 HG22 THR A 797 2.993 0.176 3.061 1.00 0.00 H new ATOM 0 HG23 THR A 797 4.473 0.082 4.044 1.00 0.00 H new ATOM 1398 N ASN A 798 5.658 0.772 2.255 1.00 0.00 N ATOM 1399 CA ASN A 798 6.928 0.088 2.041 1.00 0.00 C ATOM 1400 C ASN A 798 7.793 0.933 1.123 1.00 0.00 C ATOM 1401 O ASN A 798 9.021 0.855 1.148 1.00 0.00 O ATOM 1402 CB ASN A 798 6.714 -1.307 1.446 1.00 0.00 C ATOM 1403 CG ASN A 798 6.828 -1.340 -0.070 1.00 0.00 C ATOM 1404 OD1 ASN A 798 5.849 -1.149 -0.780 1.00 0.00 O ATOM 1405 ND2 ASN A 798 8.028 -1.600 -0.576 1.00 0.00 N ATOM 0 H ASN A 798 4.837 0.267 1.921 1.00 0.00 H new ATOM 0 HA ASN A 798 7.428 -0.042 3.001 1.00 0.00 H new ATOM 0 HB2 ASN A 798 7.446 -1.992 1.873 1.00 0.00 H new ATOM 0 HB3 ASN A 798 5.729 -1.671 1.737 1.00 0.00 H new ATOM 0 HD21 ASN A 798 8.156 -1.646 -1.587 1.00 0.00 H new ATOM 0 HD22 ASN A 798 8.821 -1.754 0.046 1.00 0.00 H new ATOM 1412 N CYS A 799 7.133 1.766 0.327 1.00 0.00 N ATOM 1413 CA CYS A 799 7.818 2.633 -0.592 1.00 0.00 C ATOM 1414 C CYS A 799 8.307 3.867 0.147 1.00 0.00 C ATOM 1415 O CYS A 799 9.291 4.498 -0.220 1.00 0.00 O ATOM 1416 CB CYS A 799 6.898 2.943 -1.752 1.00 0.00 C ATOM 1417 SG CYS A 799 6.333 1.441 -2.571 1.00 0.00 S ATOM 0 H CYS A 799 6.117 1.851 0.309 1.00 0.00 H new ATOM 0 HA CYS A 799 8.703 2.153 -1.009 1.00 0.00 H new ATOM 0 HB2 CYS A 799 6.038 3.508 -1.394 1.00 0.00 H new ATOM 0 HB3 CYS A 799 7.418 3.576 -2.471 1.00 0.00 H new ATOM 0 HG CYS A 799 6.103 1.691 -3.826 1.00 0.00 H new ATOM 1423 N LYS A 800 7.573 4.187 1.190 1.00 0.00 N ATOM 1424 CA LYS A 800 7.872 5.284 2.090 1.00 0.00 C ATOM 1425 C LYS A 800 8.861 4.813 3.164 1.00 0.00 C ATOM 1426 O LYS A 800 9.526 5.603 3.829 1.00 0.00 O ATOM 1427 CB LYS A 800 6.573 5.688 2.742 1.00 0.00 C ATOM 1428 CG LYS A 800 5.701 6.594 1.913 1.00 0.00 C ATOM 1429 CD LYS A 800 4.246 6.401 2.287 1.00 0.00 C ATOM 1430 CE LYS A 800 3.352 7.271 1.447 1.00 0.00 C ATOM 1431 NZ LYS A 800 1.971 7.359 1.996 1.00 0.00 N ATOM 0 H LYS A 800 6.727 3.678 1.444 1.00 0.00 H new ATOM 0 HA LYS A 800 8.317 6.121 1.552 1.00 0.00 H new ATOM 0 HB2 LYS A 800 6.009 4.787 2.984 1.00 0.00 H new ATOM 0 HB3 LYS A 800 6.797 6.187 3.685 1.00 0.00 H new ATOM 0 HG2 LYS A 800 5.990 7.633 2.070 1.00 0.00 H new ATOM 0 HG3 LYS A 800 5.844 6.380 0.854 1.00 0.00 H new ATOM 0 HD2 LYS A 800 3.969 5.355 2.155 1.00 0.00 H new ATOM 0 HD3 LYS A 800 4.104 6.638 3.341 1.00 0.00 H new ATOM 0 HE2 LYS A 800 3.779 8.272 1.382 1.00 0.00 H new ATOM 0 HE3 LYS A 800 3.313 6.875 0.432 1.00 0.00 H new ATOM 0 HZ1 LYS A 800 1.370 7.898 1.340 1.00 0.00 H new ATOM 0 HZ2 LYS A 800 1.582 6.401 2.113 1.00 0.00 H new ATOM 0 HZ3 LYS A 800 1.994 7.839 2.918 1.00 0.00 H new ATOM 1445 N GLU A 801 8.912 3.493 3.326 1.00 0.00 N ATOM 1446 CA GLU A 801 9.740 2.833 4.339 1.00 0.00 C ATOM 1447 C GLU A 801 11.208 2.743 3.969 1.00 0.00 C ATOM 1448 O GLU A 801 12.080 3.308 4.627 1.00 0.00 O ATOM 1449 CB GLU A 801 9.249 1.394 4.467 1.00 0.00 C ATOM 1450 CG GLU A 801 8.651 1.035 5.817 1.00 0.00 C ATOM 1451 CD GLU A 801 7.805 2.149 6.404 1.00 0.00 C ATOM 1452 OE1 GLU A 801 6.612 2.236 6.050 1.00 0.00 O ATOM 1453 OE2 GLU A 801 8.338 2.933 7.216 1.00 0.00 O ATOM 0 H GLU A 801 8.375 2.842 2.753 1.00 0.00 H new ATOM 0 HA GLU A 801 9.653 3.424 5.251 1.00 0.00 H new ATOM 0 HB2 GLU A 801 8.501 1.212 3.696 1.00 0.00 H new ATOM 0 HB3 GLU A 801 10.084 0.722 4.267 1.00 0.00 H new ATOM 0 HG2 GLU A 801 8.040 0.139 5.711 1.00 0.00 H new ATOM 0 HG3 GLU A 801 9.455 0.792 6.512 1.00 0.00 H new ATOM 1460 N TYR A 802 11.444 2.021 2.896 1.00 0.00 N ATOM 1461 CA TYR A 802 12.772 1.753 2.393 1.00 0.00 C ATOM 1462 C TYR A 802 13.312 2.924 1.619 1.00 0.00 C ATOM 1463 O TYR A 802 14.360 3.483 1.943 1.00 0.00 O ATOM 1464 CB TYR A 802 12.650 0.523 1.502 1.00 0.00 C ATOM 1465 CG TYR A 802 13.835 0.140 0.666 1.00 0.00 C ATOM 1466 CD1 TYR A 802 15.065 0.787 0.719 1.00 0.00 C ATOM 1467 CD2 TYR A 802 13.686 -0.902 -0.207 1.00 0.00 C ATOM 1468 CE1 TYR A 802 16.109 0.388 -0.088 1.00 0.00 C ATOM 1469 CE2 TYR A 802 14.707 -1.306 -1.014 1.00 0.00 C ATOM 1470 CZ TYR A 802 15.924 -0.663 -0.956 1.00 0.00 C ATOM 1471 OH TYR A 802 16.955 -1.067 -1.768 1.00 0.00 O ATOM 0 H TYR A 802 10.703 1.596 2.338 1.00 0.00 H new ATOM 0 HA TYR A 802 13.470 1.582 3.213 1.00 0.00 H new ATOM 0 HB2 TYR A 802 12.401 -0.327 2.138 1.00 0.00 H new ATOM 0 HB3 TYR A 802 11.805 0.678 0.832 1.00 0.00 H new ATOM 0 HD1 TYR A 802 15.204 1.613 1.401 1.00 0.00 H new ATOM 0 HD2 TYR A 802 12.738 -1.416 -0.258 1.00 0.00 H new ATOM 0 HE1 TYR A 802 17.061 0.895 -0.039 1.00 0.00 H new ATOM 0 HE2 TYR A 802 14.562 -2.129 -1.698 1.00 0.00 H new ATOM 0 HH TYR A 802 17.741 -0.505 -1.603 1.00 0.00 H new ATOM 1481 N ASN A 803 12.582 3.287 0.602 1.00 0.00 N ATOM 1482 CA ASN A 803 12.986 4.387 -0.241 1.00 0.00 C ATOM 1483 C ASN A 803 13.017 5.667 0.568 1.00 0.00 C ATOM 1484 O ASN A 803 12.288 5.793 1.546 1.00 0.00 O ATOM 1485 CB ASN A 803 12.020 4.545 -1.417 1.00 0.00 C ATOM 1486 CG ASN A 803 11.907 3.283 -2.250 1.00 0.00 C ATOM 1487 OD1 ASN A 803 10.720 3.039 -2.794 1.00 0.00 O flip ATOM 1488 ND2 ASN A 803 12.873 2.534 -2.398 1.00 0.00 N flip ATOM 0 H ASN A 803 11.705 2.841 0.333 1.00 0.00 H new ATOM 0 HA ASN A 803 13.982 4.179 -0.632 1.00 0.00 H new ATOM 0 HB2 ASN A 803 11.034 4.816 -1.039 1.00 0.00 H new ATOM 0 HB3 ASN A 803 12.356 5.366 -2.051 1.00 0.00 H new ATOM 0 HD21 ASN A 803 13.766 2.761 -1.961 1.00 0.00 H new ATOM 0 HD22 ASN A 803 12.780 1.686 -2.957 1.00 0.00 H new ATOM 1495 N PRO A 804 13.948 6.574 0.244 1.00 0.00 N ATOM 1496 CA PRO A 804 14.031 7.891 0.866 1.00 0.00 C ATOM 1497 C PRO A 804 13.112 8.860 0.136 1.00 0.00 C ATOM 1498 O PRO A 804 12.885 8.705 -1.061 1.00 0.00 O ATOM 1499 CB PRO A 804 15.484 8.277 0.649 1.00 0.00 C ATOM 1500 CG PRO A 804 15.827 7.640 -0.652 1.00 0.00 C ATOM 1501 CD PRO A 804 15.055 6.350 -0.697 1.00 0.00 C ATOM 0 HA PRO A 804 13.735 7.903 1.915 1.00 0.00 H new ATOM 0 HB2 PRO A 804 15.610 9.359 0.611 1.00 0.00 H new ATOM 0 HB3 PRO A 804 16.120 7.911 1.455 1.00 0.00 H new ATOM 0 HG2 PRO A 804 15.556 8.286 -1.487 1.00 0.00 H new ATOM 0 HG3 PRO A 804 16.899 7.456 -0.726 1.00 0.00 H new ATOM 0 HD2 PRO A 804 14.690 6.137 -1.702 1.00 0.00 H new ATOM 0 HD3 PRO A 804 15.672 5.503 -0.396 1.00 0.00 H new ATOM 1509 N PRO A 805 12.578 9.877 0.824 1.00 0.00 N ATOM 1510 CA PRO A 805 11.656 10.835 0.211 1.00 0.00 C ATOM 1511 C PRO A 805 12.341 11.658 -0.854 1.00 0.00 C ATOM 1512 O PRO A 805 11.755 12.590 -1.406 1.00 0.00 O ATOM 1513 CB PRO A 805 11.220 11.735 1.366 1.00 0.00 C ATOM 1514 CG PRO A 805 11.674 11.044 2.600 1.00 0.00 C ATOM 1515 CD PRO A 805 12.858 10.207 2.219 1.00 0.00 C ATOM 0 HA PRO A 805 10.822 10.334 -0.280 1.00 0.00 H new ATOM 0 HB2 PRO A 805 11.668 12.725 1.283 1.00 0.00 H new ATOM 0 HB3 PRO A 805 10.139 11.874 1.369 1.00 0.00 H new ATOM 0 HG2 PRO A 805 11.944 11.766 3.370 1.00 0.00 H new ATOM 0 HG3 PRO A 805 10.878 10.423 3.010 1.00 0.00 H new ATOM 0 HD2 PRO A 805 13.794 10.756 2.326 1.00 0.00 H new ATOM 0 HD3 PRO A 805 12.940 9.314 2.839 1.00 0.00 H new ATOM 1523 N GLU A 806 13.589 11.311 -1.141 1.00 0.00 N ATOM 1524 CA GLU A 806 14.346 12.034 -2.131 1.00 0.00 C ATOM 1525 C GLU A 806 14.644 11.156 -3.340 1.00 0.00 C ATOM 1526 O GLU A 806 14.983 11.655 -4.414 1.00 0.00 O ATOM 1527 CB GLU A 806 15.651 12.542 -1.528 1.00 0.00 C ATOM 1528 CG GLU A 806 15.454 13.479 -0.347 1.00 0.00 C ATOM 1529 CD GLU A 806 16.767 13.962 0.237 1.00 0.00 C ATOM 1530 OE1 GLU A 806 17.369 14.889 -0.344 1.00 0.00 O ATOM 1531 OE2 GLU A 806 17.192 13.414 1.275 1.00 0.00 O ATOM 0 H GLU A 806 14.088 10.538 -0.701 1.00 0.00 H new ATOM 0 HA GLU A 806 13.747 12.883 -2.460 1.00 0.00 H new ATOM 0 HB2 GLU A 806 16.249 11.689 -1.208 1.00 0.00 H new ATOM 0 HB3 GLU A 806 16.221 13.059 -2.300 1.00 0.00 H new ATOM 0 HG2 GLU A 806 14.863 14.338 -0.664 1.00 0.00 H new ATOM 0 HG3 GLU A 806 14.882 12.967 0.427 1.00 0.00 H new ATOM 1538 N SER A 807 14.521 9.844 -3.152 1.00 0.00 N ATOM 1539 CA SER A 807 14.787 8.882 -4.220 1.00 0.00 C ATOM 1540 C SER A 807 14.010 9.212 -5.479 1.00 0.00 C ATOM 1541 O SER A 807 14.519 9.884 -6.377 1.00 0.00 O ATOM 1542 CB SER A 807 14.441 7.463 -3.776 1.00 0.00 C ATOM 1543 OG SER A 807 13.153 7.403 -3.192 1.00 0.00 O ATOM 0 H SER A 807 14.238 9.421 -2.268 1.00 0.00 H new ATOM 0 HA SER A 807 15.853 8.944 -4.441 1.00 0.00 H new ATOM 0 HB2 SER A 807 14.485 6.791 -4.633 1.00 0.00 H new ATOM 0 HB3 SER A 807 15.184 7.113 -3.059 1.00 0.00 H new ATOM 0 HG SER A 807 13.185 7.784 -2.290 1.00 0.00 H new ATOM 1549 N GLU A 808 12.769 8.741 -5.527 1.00 0.00 N ATOM 1550 CA GLU A 808 11.918 8.947 -6.683 1.00 0.00 C ATOM 1551 C GLU A 808 10.603 8.192 -6.520 1.00 0.00 C ATOM 1552 O GLU A 808 9.540 8.675 -6.910 1.00 0.00 O ATOM 1553 CB GLU A 808 12.647 8.454 -7.931 1.00 0.00 C ATOM 1554 CG GLU A 808 11.729 8.065 -9.064 1.00 0.00 C ATOM 1555 CD GLU A 808 12.446 8.018 -10.400 1.00 0.00 C ATOM 1556 OE1 GLU A 808 13.315 7.138 -10.577 1.00 0.00 O ATOM 1557 OE2 GLU A 808 12.142 8.864 -11.268 1.00 0.00 O ATOM 0 H GLU A 808 12.332 8.212 -4.772 1.00 0.00 H new ATOM 0 HA GLU A 808 11.694 10.010 -6.779 1.00 0.00 H new ATOM 0 HB2 GLU A 808 13.323 9.236 -8.277 1.00 0.00 H new ATOM 0 HB3 GLU A 808 13.263 7.595 -7.664 1.00 0.00 H new ATOM 0 HG2 GLU A 808 11.292 7.089 -8.855 1.00 0.00 H new ATOM 0 HG3 GLU A 808 10.906 8.777 -9.122 1.00 0.00 H new ATOM 1564 N TYR A 809 10.691 7.000 -5.942 1.00 0.00 N ATOM 1565 CA TYR A 809 9.518 6.163 -5.731 1.00 0.00 C ATOM 1566 C TYR A 809 8.798 6.562 -4.455 1.00 0.00 C ATOM 1567 O TYR A 809 7.572 6.492 -4.372 1.00 0.00 O ATOM 1568 CB TYR A 809 9.891 4.702 -5.652 1.00 0.00 C ATOM 1569 CG TYR A 809 11.176 4.356 -6.343 1.00 0.00 C ATOM 1570 CD1 TYR A 809 11.556 4.895 -7.560 1.00 0.00 C ATOM 1571 CD2 TYR A 809 12.012 3.489 -5.734 1.00 0.00 C ATOM 1572 CE1 TYR A 809 12.762 4.546 -8.138 1.00 0.00 C ATOM 1573 CE2 TYR A 809 13.205 3.128 -6.273 1.00 0.00 C ATOM 1574 CZ TYR A 809 13.589 3.657 -7.487 1.00 0.00 C ATOM 1575 OH TYR A 809 14.790 3.301 -8.050 1.00 0.00 O ATOM 0 H TYR A 809 11.565 6.591 -5.611 1.00 0.00 H new ATOM 0 HA TYR A 809 8.857 6.312 -6.585 1.00 0.00 H new ATOM 0 HB2 TYR A 809 9.967 4.414 -4.603 1.00 0.00 H new ATOM 0 HB3 TYR A 809 9.087 4.109 -6.088 1.00 0.00 H new ATOM 0 HD1 TYR A 809 10.904 5.595 -8.062 1.00 0.00 H new ATOM 0 HD2 TYR A 809 11.722 3.067 -4.783 1.00 0.00 H new ATOM 0 HE1 TYR A 809 13.053 4.966 -9.090 1.00 0.00 H new ATOM 0 HE2 TYR A 809 13.848 2.432 -5.755 1.00 0.00 H new ATOM 0 HH TYR A 809 15.252 2.667 -7.462 1.00 0.00 H new ATOM 1585 N TYR A 810 9.576 6.956 -3.453 1.00 0.00 N ATOM 1586 CA TYR A 810 9.020 7.374 -2.175 1.00 0.00 C ATOM 1587 C TYR A 810 7.920 8.397 -2.396 1.00 0.00 C ATOM 1588 O TYR A 810 6.782 8.202 -1.983 1.00 0.00 O ATOM 1589 CB TYR A 810 10.111 7.973 -1.286 1.00 0.00 C ATOM 1590 CG TYR A 810 9.704 8.150 0.160 1.00 0.00 C ATOM 1591 CD1 TYR A 810 8.482 8.677 0.494 1.00 0.00 C ATOM 1592 CD2 TYR A 810 10.550 7.788 1.184 1.00 0.00 C ATOM 1593 CE1 TYR A 810 8.112 8.839 1.808 1.00 0.00 C ATOM 1594 CE2 TYR A 810 10.196 7.946 2.505 1.00 0.00 C ATOM 1595 CZ TYR A 810 8.971 8.473 2.813 1.00 0.00 C ATOM 1596 OH TYR A 810 8.601 8.633 4.128 1.00 0.00 O ATOM 0 H TYR A 810 10.594 6.994 -3.503 1.00 0.00 H new ATOM 0 HA TYR A 810 8.603 6.499 -1.677 1.00 0.00 H new ATOM 0 HB2 TYR A 810 10.991 7.332 -1.328 1.00 0.00 H new ATOM 0 HB3 TYR A 810 10.403 8.942 -1.691 1.00 0.00 H new ATOM 0 HD1 TYR A 810 7.799 8.970 -0.289 1.00 0.00 H new ATOM 0 HD2 TYR A 810 11.516 7.369 0.945 1.00 0.00 H new ATOM 0 HE1 TYR A 810 7.145 9.255 2.049 1.00 0.00 H new ATOM 0 HE2 TYR A 810 10.878 7.657 3.291 1.00 0.00 H new ATOM 0 HH TYR A 810 9.325 8.323 4.712 1.00 0.00 H new ATOM 1606 N LYS A 811 8.271 9.505 -3.022 1.00 0.00 N ATOM 1607 CA LYS A 811 7.291 10.543 -3.298 1.00 0.00 C ATOM 1608 C LYS A 811 6.168 9.950 -4.110 1.00 0.00 C ATOM 1609 O LYS A 811 5.012 10.286 -3.918 1.00 0.00 O ATOM 1610 CB LYS A 811 7.911 11.702 -4.063 1.00 0.00 C ATOM 1611 CG LYS A 811 9.419 11.650 -4.093 1.00 0.00 C ATOM 1612 CD LYS A 811 10.000 12.439 -5.259 1.00 0.00 C ATOM 1613 CE LYS A 811 9.607 11.843 -6.602 1.00 0.00 C ATOM 1614 NZ LYS A 811 8.341 12.431 -7.125 1.00 0.00 N ATOM 0 H LYS A 811 9.216 9.710 -3.347 1.00 0.00 H new ATOM 0 HA LYS A 811 6.916 10.927 -2.349 1.00 0.00 H new ATOM 0 HB2 LYS A 811 7.533 11.699 -5.085 1.00 0.00 H new ATOM 0 HB3 LYS A 811 7.594 12.641 -3.609 1.00 0.00 H new ATOM 0 HG2 LYS A 811 9.813 12.046 -3.157 1.00 0.00 H new ATOM 0 HG3 LYS A 811 9.744 10.612 -4.162 1.00 0.00 H new ATOM 0 HD2 LYS A 811 9.655 13.472 -5.206 1.00 0.00 H new ATOM 0 HD3 LYS A 811 11.087 12.461 -5.176 1.00 0.00 H new ATOM 0 HE2 LYS A 811 10.409 12.010 -7.321 1.00 0.00 H new ATOM 0 HE3 LYS A 811 9.490 10.764 -6.500 1.00 0.00 H new ATOM 0 HZ1 LYS A 811 7.622 11.685 -7.214 1.00 0.00 H new ATOM 0 HZ2 LYS A 811 8.001 13.163 -6.469 1.00 0.00 H new ATOM 0 HZ3 LYS A 811 8.515 12.857 -8.058 1.00 0.00 H new ATOM 1628 N CYS A 812 6.530 9.067 -5.029 1.00 0.00 N ATOM 1629 CA CYS A 812 5.554 8.394 -5.865 1.00 0.00 C ATOM 1630 C CYS A 812 4.611 7.583 -4.995 1.00 0.00 C ATOM 1631 O CYS A 812 3.490 7.285 -5.384 1.00 0.00 O ATOM 1632 CB CYS A 812 6.261 7.480 -6.863 1.00 0.00 C ATOM 1633 SG CYS A 812 6.834 8.315 -8.361 1.00 0.00 S ATOM 0 H CYS A 812 7.497 8.801 -5.213 1.00 0.00 H new ATOM 0 HA CYS A 812 4.981 9.139 -6.417 1.00 0.00 H new ATOM 0 HB2 CYS A 812 7.115 7.016 -6.370 1.00 0.00 H new ATOM 0 HB3 CYS A 812 5.581 6.676 -7.147 1.00 0.00 H new ATOM 0 HG CYS A 812 8.074 8.674 -8.210 1.00 0.00 H new ATOM 1639 N ALA A 813 5.079 7.235 -3.809 1.00 0.00 N ATOM 1640 CA ALA A 813 4.282 6.468 -2.870 1.00 0.00 C ATOM 1641 C ALA A 813 3.253 7.366 -2.214 1.00 0.00 C ATOM 1642 O ALA A 813 2.080 7.034 -2.149 1.00 0.00 O ATOM 1643 CB ALA A 813 5.174 5.825 -1.828 1.00 0.00 C ATOM 0 H ALA A 813 6.012 7.473 -3.473 1.00 0.00 H new ATOM 0 HA ALA A 813 3.761 5.676 -3.408 1.00 0.00 H new ATOM 0 HB1 ALA A 813 4.563 5.253 -1.130 1.00 0.00 H new ATOM 0 HB2 ALA A 813 5.885 5.160 -2.318 1.00 0.00 H new ATOM 0 HB3 ALA A 813 5.716 6.599 -1.285 1.00 0.00 H new ATOM 1649 N ASN A 814 3.720 8.508 -1.736 1.00 0.00 N ATOM 1650 CA ASN A 814 2.885 9.497 -1.098 1.00 0.00 C ATOM 1651 C ASN A 814 1.912 10.084 -2.119 1.00 0.00 C ATOM 1652 O ASN A 814 0.722 10.267 -1.852 1.00 0.00 O ATOM 1653 CB ASN A 814 3.799 10.586 -0.570 1.00 0.00 C ATOM 1654 CG ASN A 814 3.164 11.449 0.507 1.00 0.00 C ATOM 1655 OD1 ASN A 814 1.846 11.607 0.451 1.00 0.00 O flip ATOM 1656 ND2 ASN A 814 3.853 11.969 1.384 1.00 0.00 N flip ATOM 0 H ASN A 814 4.704 8.772 -1.784 1.00 0.00 H new ATOM 0 HA ASN A 814 2.306 9.054 -0.288 1.00 0.00 H new ATOM 0 HB2 ASN A 814 4.702 10.127 -0.169 1.00 0.00 H new ATOM 0 HB3 ASN A 814 4.107 11.223 -1.399 1.00 0.00 H new ATOM 0 HD21 ASN A 814 4.863 11.824 1.393 1.00 0.00 H new ATOM 0 HD22 ASN A 814 3.415 12.545 2.102 1.00 0.00 H new ATOM 1663 N ILE A 815 2.455 10.352 -3.298 1.00 0.00 N ATOM 1664 CA ILE A 815 1.710 10.912 -4.413 1.00 0.00 C ATOM 1665 C ILE A 815 0.593 9.975 -4.797 1.00 0.00 C ATOM 1666 O ILE A 815 -0.575 10.353 -4.839 1.00 0.00 O ATOM 1667 CB ILE A 815 2.632 11.138 -5.620 1.00 0.00 C ATOM 1668 CG1 ILE A 815 3.364 12.460 -5.470 1.00 0.00 C ATOM 1669 CG2 ILE A 815 1.851 11.101 -6.917 1.00 0.00 C ATOM 1670 CD1 ILE A 815 4.761 12.422 -6.005 1.00 0.00 C ATOM 0 H ILE A 815 3.439 10.184 -3.508 1.00 0.00 H new ATOM 0 HA ILE A 815 1.294 11.872 -4.108 1.00 0.00 H new ATOM 0 HB ILE A 815 3.364 10.331 -5.653 1.00 0.00 H new ATOM 0 HG12 ILE A 815 2.804 13.239 -5.988 1.00 0.00 H new ATOM 0 HG13 ILE A 815 3.393 12.735 -4.416 1.00 0.00 H new ATOM 0 HG21 ILE A 815 2.529 11.264 -7.755 1.00 0.00 H new ATOM 0 HG22 ILE A 815 1.369 10.129 -7.024 1.00 0.00 H new ATOM 0 HG23 ILE A 815 1.092 11.883 -6.907 1.00 0.00 H new ATOM 0 HD11 ILE A 815 5.230 13.396 -5.868 1.00 0.00 H new ATOM 0 HD12 ILE A 815 5.335 11.665 -5.471 1.00 0.00 H new ATOM 0 HD13 ILE A 815 4.737 12.177 -7.067 1.00 0.00 H new ATOM 1682 N LEU A 816 0.978 8.753 -5.100 1.00 0.00 N ATOM 1683 CA LEU A 816 0.030 7.725 -5.440 1.00 0.00 C ATOM 1684 C LEU A 816 -0.966 7.603 -4.311 1.00 0.00 C ATOM 1685 O LEU A 816 -2.163 7.741 -4.502 1.00 0.00 O ATOM 1686 CB LEU A 816 0.759 6.408 -5.637 1.00 0.00 C ATOM 1687 CG LEU A 816 0.104 5.432 -6.584 1.00 0.00 C ATOM 1688 CD1 LEU A 816 0.900 4.165 -6.629 1.00 0.00 C ATOM 1689 CD2 LEU A 816 -1.304 5.185 -6.161 1.00 0.00 C ATOM 0 H LEU A 816 1.952 8.450 -5.116 1.00 0.00 H new ATOM 0 HA LEU A 816 -0.489 7.978 -6.364 1.00 0.00 H new ATOM 0 HB2 LEU A 816 1.764 6.621 -6.002 1.00 0.00 H new ATOM 0 HB3 LEU A 816 0.868 5.926 -4.666 1.00 0.00 H new ATOM 0 HG LEU A 816 0.080 5.850 -7.591 1.00 0.00 H new ATOM 0 HD11 LEU A 816 0.426 3.461 -7.313 1.00 0.00 H new ATOM 0 HD12 LEU A 816 1.911 4.382 -6.975 1.00 0.00 H new ATOM 0 HD13 LEU A 816 0.944 3.727 -5.632 1.00 0.00 H new ATOM 0 HD21 LEU A 816 -1.772 4.480 -6.848 1.00 0.00 H new ATOM 0 HD22 LEU A 816 -1.314 4.770 -5.153 1.00 0.00 H new ATOM 0 HD23 LEU A 816 -1.857 6.124 -6.172 1.00 0.00 H new ATOM 1701 N GLU A 817 -0.433 7.369 -3.127 1.00 0.00 N ATOM 1702 CA GLU A 817 -1.233 7.237 -1.920 1.00 0.00 C ATOM 1703 C GLU A 817 -2.294 8.343 -1.849 1.00 0.00 C ATOM 1704 O GLU A 817 -3.348 8.181 -1.250 1.00 0.00 O ATOM 1705 CB GLU A 817 -0.307 7.327 -0.711 1.00 0.00 C ATOM 1706 CG GLU A 817 -0.955 6.904 0.598 1.00 0.00 C ATOM 1707 CD GLU A 817 -1.396 8.086 1.439 1.00 0.00 C ATOM 1708 OE1 GLU A 817 -0.579 8.579 2.245 1.00 0.00 O ATOM 1709 OE2 GLU A 817 -2.558 8.519 1.293 1.00 0.00 O ATOM 0 H GLU A 817 0.570 7.264 -2.973 1.00 0.00 H new ATOM 0 HA GLU A 817 -1.747 6.276 -1.930 1.00 0.00 H new ATOM 0 HB2 GLU A 817 0.568 6.702 -0.890 1.00 0.00 H new ATOM 0 HB3 GLU A 817 0.048 8.353 -0.614 1.00 0.00 H new ATOM 0 HG2 GLU A 817 -1.818 6.273 0.385 1.00 0.00 H new ATOM 0 HG3 GLU A 817 -0.251 6.299 1.169 1.00 0.00 H new ATOM 1716 N LYS A 818 -1.985 9.473 -2.458 1.00 0.00 N ATOM 1717 CA LYS A 818 -2.863 10.613 -2.505 1.00 0.00 C ATOM 1718 C LYS A 818 -3.920 10.445 -3.607 1.00 0.00 C ATOM 1719 O LYS A 818 -5.119 10.529 -3.336 1.00 0.00 O ATOM 1720 CB LYS A 818 -1.953 11.784 -2.707 1.00 0.00 C ATOM 1721 CG LYS A 818 -2.396 12.725 -3.759 1.00 0.00 C ATOM 1722 CD LYS A 818 -1.208 13.415 -4.398 1.00 0.00 C ATOM 1723 CE LYS A 818 -1.284 13.329 -5.909 1.00 0.00 C ATOM 1724 NZ LYS A 818 -2.507 13.989 -6.445 1.00 0.00 N ATOM 0 H LYS A 818 -1.099 9.620 -2.941 1.00 0.00 H new ATOM 0 HA LYS A 818 -3.450 10.745 -1.596 1.00 0.00 H new ATOM 0 HB2 LYS A 818 -1.863 12.326 -1.766 1.00 0.00 H new ATOM 0 HB3 LYS A 818 -0.958 11.417 -2.960 1.00 0.00 H new ATOM 0 HG2 LYS A 818 -2.962 12.187 -4.519 1.00 0.00 H new ATOM 0 HG3 LYS A 818 -3.067 13.469 -3.329 1.00 0.00 H new ATOM 0 HD2 LYS A 818 -1.180 14.460 -4.090 1.00 0.00 H new ATOM 0 HD3 LYS A 818 -0.284 12.955 -4.049 1.00 0.00 H new ATOM 0 HE2 LYS A 818 -0.400 13.796 -6.344 1.00 0.00 H new ATOM 0 HE3 LYS A 818 -1.274 12.282 -6.213 1.00 0.00 H new ATOM 0 HZ1 LYS A 818 -2.395 14.150 -7.466 1.00 0.00 H new ATOM 0 HZ2 LYS A 818 -3.332 13.378 -6.279 1.00 0.00 H new ATOM 0 HZ3 LYS A 818 -2.648 14.901 -5.965 1.00 0.00 H new ATOM 1738 N PHE A 819 -3.475 10.214 -4.846 1.00 0.00 N ATOM 1739 CA PHE A 819 -4.394 9.982 -5.960 1.00 0.00 C ATOM 1740 C PHE A 819 -5.299 8.836 -5.556 1.00 0.00 C ATOM 1741 O PHE A 819 -6.526 8.948 -5.536 1.00 0.00 O ATOM 1742 CB PHE A 819 -3.580 9.635 -7.216 1.00 0.00 C ATOM 1743 CG PHE A 819 -4.312 8.888 -8.312 1.00 0.00 C ATOM 1744 CD1 PHE A 819 -4.713 7.568 -8.140 1.00 0.00 C ATOM 1745 CD2 PHE A 819 -4.550 9.494 -9.536 1.00 0.00 C ATOM 1746 CE1 PHE A 819 -5.331 6.872 -9.147 1.00 0.00 C ATOM 1747 CE2 PHE A 819 -5.180 8.802 -10.555 1.00 0.00 C ATOM 1748 CZ PHE A 819 -5.569 7.489 -10.363 1.00 0.00 C ATOM 0 H PHE A 819 -2.488 10.183 -5.100 1.00 0.00 H new ATOM 0 HA PHE A 819 -4.994 10.863 -6.186 1.00 0.00 H new ATOM 0 HB2 PHE A 819 -3.190 10.562 -7.637 1.00 0.00 H new ATOM 0 HB3 PHE A 819 -2.721 9.037 -6.911 1.00 0.00 H new ATOM 0 HD1 PHE A 819 -4.534 7.080 -7.193 1.00 0.00 H new ATOM 0 HD2 PHE A 819 -4.241 10.516 -9.696 1.00 0.00 H new ATOM 0 HE1 PHE A 819 -5.631 5.846 -8.992 1.00 0.00 H new ATOM 0 HE2 PHE A 819 -5.368 9.288 -11.501 1.00 0.00 H new ATOM 0 HZ PHE A 819 -6.057 6.947 -11.159 1.00 0.00 H new ATOM 1758 N PHE A 820 -4.645 7.729 -5.247 1.00 0.00 N ATOM 1759 CA PHE A 820 -5.297 6.537 -4.765 1.00 0.00 C ATOM 1760 C PHE A 820 -6.309 6.929 -3.706 1.00 0.00 C ATOM 1761 O PHE A 820 -7.456 6.508 -3.775 1.00 0.00 O ATOM 1762 CB PHE A 820 -4.215 5.579 -4.273 1.00 0.00 C ATOM 1763 CG PHE A 820 -4.470 4.861 -3.001 1.00 0.00 C ATOM 1764 CD1 PHE A 820 -4.125 5.370 -1.773 1.00 0.00 C ATOM 1765 CD2 PHE A 820 -5.000 3.632 -3.066 1.00 0.00 C ATOM 1766 CE1 PHE A 820 -4.341 4.626 -0.627 1.00 0.00 C ATOM 1767 CE2 PHE A 820 -5.207 2.879 -1.960 1.00 0.00 C ATOM 1768 CZ PHE A 820 -4.886 3.367 -0.727 1.00 0.00 C ATOM 0 H PHE A 820 -3.632 7.638 -5.327 1.00 0.00 H new ATOM 0 HA PHE A 820 -5.857 6.018 -5.543 1.00 0.00 H new ATOM 0 HB2 PHE A 820 -4.043 4.836 -5.051 1.00 0.00 H new ATOM 0 HB3 PHE A 820 -3.289 6.144 -4.162 1.00 0.00 H new ATOM 0 HD1 PHE A 820 -3.684 6.353 -1.702 1.00 0.00 H new ATOM 0 HD2 PHE A 820 -5.271 3.229 -4.031 1.00 0.00 H new ATOM 0 HE1 PHE A 820 -4.083 5.031 0.340 1.00 0.00 H new ATOM 0 HE2 PHE A 820 -5.628 1.889 -2.054 1.00 0.00 H new ATOM 0 HZ PHE A 820 -5.057 2.773 0.158 1.00 0.00 H new ATOM 1778 N PHE A 821 -5.912 7.795 -2.766 1.00 0.00 N ATOM 1779 CA PHE A 821 -6.835 8.230 -1.720 1.00 0.00 C ATOM 1780 C PHE A 821 -8.107 8.821 -2.290 1.00 0.00 C ATOM 1781 O PHE A 821 -9.177 8.621 -1.733 1.00 0.00 O ATOM 1782 CB PHE A 821 -6.171 9.176 -0.734 1.00 0.00 C ATOM 1783 CG PHE A 821 -6.004 8.496 0.585 1.00 0.00 C ATOM 1784 CD1 PHE A 821 -5.274 7.344 0.625 1.00 0.00 C ATOM 1785 CD2 PHE A 821 -6.628 8.939 1.738 1.00 0.00 C ATOM 1786 CE1 PHE A 821 -5.140 6.614 1.779 1.00 0.00 C ATOM 1787 CE2 PHE A 821 -6.493 8.228 2.921 1.00 0.00 C ATOM 1788 CZ PHE A 821 -5.747 7.058 2.940 1.00 0.00 C ATOM 0 H PHE A 821 -4.977 8.199 -2.710 1.00 0.00 H new ATOM 0 HA PHE A 821 -7.121 7.336 -1.166 1.00 0.00 H new ATOM 0 HB2 PHE A 821 -5.200 9.492 -1.116 1.00 0.00 H new ATOM 0 HB3 PHE A 821 -6.775 10.076 -0.616 1.00 0.00 H new ATOM 0 HD1 PHE A 821 -4.789 6.998 -0.276 1.00 0.00 H new ATOM 0 HD2 PHE A 821 -7.222 9.841 1.716 1.00 0.00 H new ATOM 0 HE1 PHE A 821 -4.565 5.700 1.781 1.00 0.00 H new ATOM 0 HE2 PHE A 821 -6.967 8.584 3.824 1.00 0.00 H new ATOM 0 HZ PHE A 821 -5.641 6.497 3.857 1.00 0.00 H new ATOM 1798 N SER A 822 -8.003 9.531 -3.399 1.00 0.00 N ATOM 1799 CA SER A 822 -9.185 10.105 -4.023 1.00 0.00 C ATOM 1800 C SER A 822 -9.988 9.011 -4.729 1.00 0.00 C ATOM 1801 O SER A 822 -11.176 9.170 -4.988 1.00 0.00 O ATOM 1802 CB SER A 822 -8.793 11.205 -5.010 1.00 0.00 C ATOM 1803 OG SER A 822 -9.931 11.723 -5.677 1.00 0.00 O ATOM 0 H SER A 822 -7.125 9.723 -3.882 1.00 0.00 H new ATOM 0 HA SER A 822 -9.807 10.551 -3.247 1.00 0.00 H new ATOM 0 HB2 SER A 822 -8.282 12.008 -4.479 1.00 0.00 H new ATOM 0 HB3 SER A 822 -8.089 10.808 -5.741 1.00 0.00 H new ATOM 0 HG SER A 822 -9.653 12.426 -6.301 1.00 0.00 H new ATOM 1809 N LYS A 823 -9.314 7.900 -5.019 1.00 0.00 N ATOM 1810 CA LYS A 823 -9.926 6.745 -5.691 1.00 0.00 C ATOM 1811 C LYS A 823 -10.723 5.892 -4.725 1.00 0.00 C ATOM 1812 O LYS A 823 -11.881 5.568 -4.966 1.00 0.00 O ATOM 1813 CB LYS A 823 -8.828 5.893 -6.312 1.00 0.00 C ATOM 1814 CG LYS A 823 -7.994 6.635 -7.327 1.00 0.00 C ATOM 1815 CD LYS A 823 -8.842 7.280 -8.389 1.00 0.00 C ATOM 1816 CE LYS A 823 -8.359 8.675 -8.688 1.00 0.00 C ATOM 1817 NZ LYS A 823 -8.487 9.572 -7.510 1.00 0.00 N ATOM 0 H LYS A 823 -8.327 7.771 -4.796 1.00 0.00 H new ATOM 0 HA LYS A 823 -10.607 7.120 -6.455 1.00 0.00 H new ATOM 0 HB2 LYS A 823 -8.177 5.520 -5.521 1.00 0.00 H new ATOM 0 HB3 LYS A 823 -9.280 5.024 -6.790 1.00 0.00 H new ATOM 0 HG2 LYS A 823 -7.403 7.399 -6.822 1.00 0.00 H new ATOM 0 HG3 LYS A 823 -7.291 5.944 -7.794 1.00 0.00 H new ATOM 0 HD2 LYS A 823 -8.814 6.679 -9.298 1.00 0.00 H new ATOM 0 HD3 LYS A 823 -9.881 7.313 -8.060 1.00 0.00 H new ATOM 0 HE2 LYS A 823 -7.316 8.638 -9.004 1.00 0.00 H new ATOM 0 HE3 LYS A 823 -8.930 9.086 -9.521 1.00 0.00 H new ATOM 0 HZ1 LYS A 823 -8.208 10.538 -7.777 1.00 0.00 H new ATOM 0 HZ2 LYS A 823 -9.474 9.575 -7.182 1.00 0.00 H new ATOM 0 HZ3 LYS A 823 -7.869 9.232 -6.746 1.00 0.00 H new ATOM 1831 N ILE A 824 -10.082 5.519 -3.643 1.00 0.00 N ATOM 1832 CA ILE A 824 -10.717 4.719 -2.625 1.00 0.00 C ATOM 1833 C ILE A 824 -11.889 5.496 -2.093 1.00 0.00 C ATOM 1834 O ILE A 824 -13.000 4.999 -1.968 1.00 0.00 O ATOM 1835 CB ILE A 824 -9.770 4.450 -1.478 1.00 0.00 C ATOM 1836 CG1 ILE A 824 -8.773 5.563 -1.307 1.00 0.00 C ATOM 1837 CG2 ILE A 824 -9.083 3.123 -1.660 1.00 0.00 C ATOM 1838 CD1 ILE A 824 -7.388 5.116 -1.521 1.00 0.00 C ATOM 0 H ILE A 824 -9.111 5.760 -3.445 1.00 0.00 H new ATOM 0 HA ILE A 824 -11.023 3.767 -3.058 1.00 0.00 H new ATOM 0 HB ILE A 824 -10.359 4.406 -0.562 1.00 0.00 H new ATOM 0 HG12 ILE A 824 -9.005 6.365 -2.008 1.00 0.00 H new ATOM 0 HG13 ILE A 824 -8.866 5.979 -0.304 1.00 0.00 H new ATOM 0 HG21 ILE A 824 -8.405 2.947 -0.825 1.00 0.00 H new ATOM 0 HG22 ILE A 824 -9.829 2.329 -1.696 1.00 0.00 H new ATOM 0 HG23 ILE A 824 -8.517 3.131 -2.591 1.00 0.00 H new ATOM 0 HD11 ILE A 824 -6.709 5.958 -1.386 1.00 0.00 H new ATOM 0 HD12 ILE A 824 -7.143 4.333 -0.803 1.00 0.00 H new ATOM 0 HD13 ILE A 824 -7.284 4.725 -2.533 1.00 0.00 H new ATOM 1850 N LYS A 825 -11.603 6.755 -1.826 1.00 0.00 N ATOM 1851 CA LYS A 825 -12.577 7.684 -1.310 1.00 0.00 C ATOM 1852 C LYS A 825 -13.803 7.653 -2.190 1.00 0.00 C ATOM 1853 O LYS A 825 -14.933 7.466 -1.741 1.00 0.00 O ATOM 1854 CB LYS A 825 -12.040 9.097 -1.337 1.00 0.00 C ATOM 1855 CG LYS A 825 -12.016 9.734 0.027 1.00 0.00 C ATOM 1856 CD LYS A 825 -11.655 11.192 -0.046 1.00 0.00 C ATOM 1857 CE LYS A 825 -10.182 11.346 -0.343 1.00 0.00 C ATOM 1858 NZ LYS A 825 -9.915 12.449 -1.306 1.00 0.00 N ATOM 0 H LYS A 825 -10.678 7.161 -1.964 1.00 0.00 H new ATOM 0 HA LYS A 825 -12.811 7.396 -0.285 1.00 0.00 H new ATOM 0 HB2 LYS A 825 -11.031 9.090 -1.748 1.00 0.00 H new ATOM 0 HB3 LYS A 825 -12.653 9.702 -2.006 1.00 0.00 H new ATOM 0 HG2 LYS A 825 -12.993 9.624 0.497 1.00 0.00 H new ATOM 0 HG3 LYS A 825 -11.298 9.213 0.660 1.00 0.00 H new ATOM 0 HD2 LYS A 825 -12.244 11.682 -0.821 1.00 0.00 H new ATOM 0 HD3 LYS A 825 -11.897 11.683 0.897 1.00 0.00 H new ATOM 0 HE2 LYS A 825 -9.644 11.538 0.585 1.00 0.00 H new ATOM 0 HE3 LYS A 825 -9.795 10.411 -0.748 1.00 0.00 H new ATOM 0 HZ1 LYS A 825 -8.906 12.453 -1.558 1.00 0.00 H new ATOM 0 HZ2 LYS A 825 -10.486 12.307 -2.164 1.00 0.00 H new ATOM 0 HZ3 LYS A 825 -10.166 13.359 -0.870 1.00 0.00 H new ATOM 1872 N GLU A 826 -13.523 7.853 -3.470 1.00 0.00 N ATOM 1873 CA GLU A 826 -14.533 7.878 -4.507 1.00 0.00 C ATOM 1874 C GLU A 826 -15.307 6.577 -4.522 1.00 0.00 C ATOM 1875 O GLU A 826 -16.511 6.555 -4.782 1.00 0.00 O ATOM 1876 CB GLU A 826 -13.857 8.109 -5.870 1.00 0.00 C ATOM 1877 CG GLU A 826 -13.762 6.865 -6.739 1.00 0.00 C ATOM 1878 CD GLU A 826 -15.052 6.553 -7.473 1.00 0.00 C ATOM 1879 OE1 GLU A 826 -15.457 7.363 -8.334 1.00 0.00 O ATOM 1880 OE2 GLU A 826 -15.657 5.497 -7.189 1.00 0.00 O ATOM 0 H GLU A 826 -12.576 8.004 -3.817 1.00 0.00 H new ATOM 0 HA GLU A 826 -15.232 8.690 -4.307 1.00 0.00 H new ATOM 0 HB2 GLU A 826 -14.411 8.875 -6.412 1.00 0.00 H new ATOM 0 HB3 GLU A 826 -12.853 8.499 -5.703 1.00 0.00 H new ATOM 0 HG2 GLU A 826 -12.960 6.997 -7.466 1.00 0.00 H new ATOM 0 HG3 GLU A 826 -13.490 6.013 -6.115 1.00 0.00 H new ATOM 1887 N ALA A 827 -14.603 5.497 -4.239 1.00 0.00 N ATOM 1888 CA ALA A 827 -15.208 4.186 -4.251 1.00 0.00 C ATOM 1889 C ALA A 827 -15.743 3.768 -2.888 1.00 0.00 C ATOM 1890 O ALA A 827 -16.048 2.600 -2.682 1.00 0.00 O ATOM 1891 CB ALA A 827 -14.207 3.173 -4.762 1.00 0.00 C ATOM 0 H ALA A 827 -13.612 5.506 -3.998 1.00 0.00 H new ATOM 0 HA ALA A 827 -16.069 4.229 -4.919 1.00 0.00 H new ATOM 0 HB1 ALA A 827 -14.663 2.183 -4.771 1.00 0.00 H new ATOM 0 HB2 ALA A 827 -13.902 3.441 -5.773 1.00 0.00 H new ATOM 0 HB3 ALA A 827 -13.334 3.164 -4.110 1.00 0.00 H new ATOM 1897 N GLY A 828 -15.868 4.715 -1.963 1.00 0.00 N ATOM 1898 CA GLY A 828 -16.381 4.389 -0.639 1.00 0.00 C ATOM 1899 C GLY A 828 -15.423 3.531 0.162 1.00 0.00 C ATOM 1900 O GLY A 828 -15.775 3.013 1.221 1.00 0.00 O ATOM 0 H GLY A 828 -15.626 5.696 -2.102 1.00 0.00 H new ATOM 0 HA2 GLY A 828 -16.580 5.311 -0.093 1.00 0.00 H new ATOM 0 HA3 GLY A 828 -17.332 3.867 -0.740 1.00 0.00 H new ATOM 1904 N LEU A 829 -14.206 3.403 -0.334 1.00 0.00 N ATOM 1905 CA LEU A 829 -13.199 2.573 0.298 1.00 0.00 C ATOM 1906 C LEU A 829 -12.782 3.110 1.658 1.00 0.00 C ATOM 1907 O LEU A 829 -13.372 2.730 2.668 1.00 0.00 O ATOM 1908 CB LEU A 829 -12.019 2.447 -0.638 1.00 0.00 C ATOM 1909 CG LEU A 829 -12.397 1.967 -2.039 1.00 0.00 C ATOM 1910 CD1 LEU A 829 -11.258 1.273 -2.714 1.00 0.00 C ATOM 1911 CD2 LEU A 829 -13.595 1.038 -2.005 1.00 0.00 C ATOM 0 H LEU A 829 -13.889 3.870 -1.184 1.00 0.00 H new ATOM 0 HA LEU A 829 -13.621 1.586 0.486 1.00 0.00 H new ATOM 0 HB2 LEU A 829 -11.523 3.415 -0.716 1.00 0.00 H new ATOM 0 HB3 LEU A 829 -11.297 1.753 -0.208 1.00 0.00 H new ATOM 0 HG LEU A 829 -12.654 2.860 -2.609 1.00 0.00 H new ATOM 0 HD11 LEU A 829 -11.567 0.947 -3.707 1.00 0.00 H new ATOM 0 HD12 LEU A 829 -10.415 1.959 -2.803 1.00 0.00 H new ATOM 0 HD13 LEU A 829 -10.959 0.406 -2.125 1.00 0.00 H new ATOM 0 HD21 LEU A 829 -13.835 0.717 -3.019 1.00 0.00 H new ATOM 0 HD22 LEU A 829 -13.362 0.166 -1.394 1.00 0.00 H new ATOM 0 HD23 LEU A 829 -14.450 1.562 -1.578 1.00 0.00 H new ATOM 1923 N ILE A 830 -11.759 3.976 1.688 1.00 0.00 N ATOM 1924 CA ILE A 830 -11.290 4.565 2.926 1.00 0.00 C ATOM 1925 C ILE A 830 -12.349 4.576 4.020 1.00 0.00 C ATOM 1926 O ILE A 830 -13.469 5.043 3.812 1.00 0.00 O ATOM 1927 CB ILE A 830 -10.818 5.988 2.696 1.00 0.00 C ATOM 1928 CG1 ILE A 830 -10.646 6.244 1.209 1.00 0.00 C ATOM 1929 CG2 ILE A 830 -9.503 6.191 3.399 1.00 0.00 C ATOM 1930 CD1 ILE A 830 -9.809 7.442 0.916 1.00 0.00 C ATOM 0 H ILE A 830 -11.246 4.278 0.859 1.00 0.00 H new ATOM 0 HA ILE A 830 -10.465 3.937 3.261 1.00 0.00 H new ATOM 0 HB ILE A 830 -11.559 6.683 3.091 1.00 0.00 H new ATOM 0 HG12 ILE A 830 -10.192 5.368 0.746 1.00 0.00 H new ATOM 0 HG13 ILE A 830 -11.627 6.373 0.752 1.00 0.00 H new ATOM 0 HG21 ILE A 830 -9.158 7.212 3.238 1.00 0.00 H new ATOM 0 HG22 ILE A 830 -9.631 6.016 4.467 1.00 0.00 H new ATOM 0 HG23 ILE A 830 -8.767 5.492 3.002 1.00 0.00 H new ATOM 0 HD11 ILE A 830 -9.724 7.571 -0.163 1.00 0.00 H new ATOM 0 HD12 ILE A 830 -10.274 8.326 1.352 1.00 0.00 H new ATOM 0 HD13 ILE A 830 -8.816 7.306 1.345 1.00 0.00 H new