USER MOD reduce.3.24.130724 H: found=0, std=0, add=1032, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 1032 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 107 TYR OH : rot -15:sc= -2.38 USER MOD Set 1.2: A 111 CYS SG : rot 96:sc= -1 USER MOD Set 1.3: A 115 ASN : amide:sc= -0.134 K(o=-3.5,f=-6!) USER MOD Set 2.1: A 92 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: A 93 SER OG : rot 180:sc= 0 USER MOD Set 3.1: A 36 MET CE :methyl -106:sc= -3.45 (180deg=-11.1!) USER MOD Set 3.2: A 41 THR OG1 : rot 28:sc= 0.921 USER MOD Set 4.1: A 9 GLN : amide:sc= -2.33! C(o=-2.5!,f=-3.8!) USER MOD Set 4.2: A 12 GLN : amide:sc= -0.216 K(o=-2.5,f=-6.8!) USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 GLN :FLIP amide:sc= -0.329 F(o=-2.6!,f=-0.33) USER MOD Single : A 17 TYR OH : rot -74:sc= 0.594! USER MOD Single : A 20 ASN : amide:sc= -2.88! C(o=-2.9!,f=-8.3!) USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 37 GLN : amide:sc= -0.129 X(o=-0.13,f=-0.12) USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 ASN : amide:sc=-0.00295 K(o=-0.003,f=-1.2) USER MOD Single : A 49 MET CE :methyl 161:sc= -0.449 (180deg=-1.03) USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 SER OG : rot -24:sc= 1.21 USER MOD Single : A 57 TYR OH : rot 180:sc= 0 USER MOD Single : A 60 TYR OH : rot 180:sc= -0.353 USER MOD Single : A 61 ASN : amide:sc= -0.082 K(o=-0.082,f=-2.1!) USER MOD Single : A 74 ASN : amide:sc= -1.47 K(o=-1.5,f=-8.8!) USER MOD Single : A 75 LYS NZ :NH3+ -163:sc= 0 (180deg=-0.253) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 GLN : amide:sc= -0.193 X(o=-0.19,f=-0.19) USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 HIS : no HD1:sc= -0.623 X(o=-0.62,f=-0.31) USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 97 THR OG1 : rot 66:sc= 1.21 USER MOD Single : A 100 THR OG1 : rot 86:sc= 0.608 USER MOD Single : A 101 GLN : amide:sc= -1.14 K(o=-1.1,f=-6.4!) USER MOD Single : A 102 TYR OH : rot 149:sc= -0.0442! USER MOD Single : A 103 MET CE :methyl -108:sc= -9.14! (180deg=-21.9!) USER MOD Single : A 104 LYS NZ :NH3+ -166:sc= -0.28 (180deg=-0.742) USER MOD Single : A 105 TYR OH : rot 180:sc= 0 USER MOD Single : A 109 TYR OH : rot 135:sc= 0.739 USER MOD Single : A 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 SER OG : rot 95:sc= -2.25! USER MOD Single : A 118 THR OG1 : rot 180:sc= -0.743 USER MOD Single : A 123 GLN :FLIP amide:sc= -1.3 F(o=-2.7!,f=-1.3) USER MOD Single : A 129 ASN : amide:sc= -13! C(o=-13!,f=-18!) USER MOD ----------------------------------------------------------------- ATOM 93 N GLN A 9 -15.247 -2.775 -8.238 1.00 0.00 N ATOM 94 CA GLN A 9 -13.895 -2.430 -8.764 1.00 0.00 C ATOM 95 C GLN A 9 -14.016 -1.227 -9.700 1.00 0.00 C ATOM 96 O GLN A 9 -13.186 -0.340 -9.702 1.00 0.00 O ATOM 97 CB GLN A 9 -13.331 -3.627 -9.536 1.00 0.00 C ATOM 98 CG GLN A 9 -12.865 -4.713 -8.559 1.00 0.00 C ATOM 99 CD GLN A 9 -13.824 -4.806 -7.368 1.00 0.00 C ATOM 100 OE1 GLN A 9 -14.910 -5.340 -7.485 1.00 0.00 O ATOM 101 NE2 GLN A 9 -13.467 -4.299 -6.219 1.00 0.00 N ATOM 0 HA GLN A 9 -13.227 -2.186 -7.938 1.00 0.00 H new ATOM 0 HB2 GLN A 9 -14.092 -4.030 -10.204 1.00 0.00 H new ATOM 0 HB3 GLN A 9 -12.497 -3.307 -10.160 1.00 0.00 H new ATOM 0 HG2 GLN A 9 -12.816 -5.674 -9.070 1.00 0.00 H new ATOM 0 HG3 GLN A 9 -11.858 -4.487 -8.207 1.00 0.00 H new ATOM 0 HE21 GLN A 9 -12.556 -3.851 -6.120 1.00 0.00 H new ATOM 0 HE22 GLN A 9 -14.099 -4.351 -5.420 1.00 0.00 H new ATOM 110 N PHE A 10 -15.055 -1.188 -10.489 1.00 0.00 N ATOM 111 CA PHE A 10 -15.245 -0.047 -11.426 1.00 0.00 C ATOM 112 C PHE A 10 -15.246 1.263 -10.635 1.00 0.00 C ATOM 113 O PHE A 10 -14.530 2.190 -10.954 1.00 0.00 O ATOM 114 CB PHE A 10 -16.587 -0.217 -12.140 1.00 0.00 C ATOM 115 CG PHE A 10 -16.788 0.897 -13.138 1.00 0.00 C ATOM 116 CD1 PHE A 10 -16.239 0.799 -14.422 1.00 0.00 C ATOM 117 CD2 PHE A 10 -17.531 2.028 -12.778 1.00 0.00 C ATOM 118 CE1 PHE A 10 -16.434 1.833 -15.346 1.00 0.00 C ATOM 119 CE2 PHE A 10 -17.726 3.061 -13.702 1.00 0.00 C ATOM 120 CZ PHE A 10 -17.177 2.964 -14.986 1.00 0.00 C ATOM 0 H PHE A 10 -15.783 -1.901 -10.524 1.00 0.00 H new ATOM 0 HA PHE A 10 -14.437 -0.024 -12.158 1.00 0.00 H new ATOM 0 HB2 PHE A 10 -16.618 -1.181 -12.648 1.00 0.00 H new ATOM 0 HB3 PHE A 10 -17.398 -0.214 -11.412 1.00 0.00 H new ATOM 0 HD1 PHE A 10 -15.666 -0.073 -14.700 1.00 0.00 H new ATOM 0 HD2 PHE A 10 -17.954 2.103 -11.787 1.00 0.00 H new ATOM 0 HE1 PHE A 10 -16.011 1.758 -16.337 1.00 0.00 H new ATOM 0 HE2 PHE A 10 -18.300 3.933 -13.424 1.00 0.00 H new ATOM 0 HZ PHE A 10 -17.326 3.761 -15.699 1.00 0.00 H new ATOM 130 N LYS A 11 -16.033 1.347 -9.601 1.00 0.00 N ATOM 131 CA LYS A 11 -16.053 2.595 -8.796 1.00 0.00 C ATOM 132 C LYS A 11 -14.673 2.817 -8.178 1.00 0.00 C ATOM 133 O LYS A 11 -14.174 3.919 -8.135 1.00 0.00 O ATOM 134 CB LYS A 11 -17.091 2.472 -7.681 1.00 0.00 C ATOM 135 CG LYS A 11 -17.235 3.820 -6.967 1.00 0.00 C ATOM 136 CD LYS A 11 -18.035 4.808 -7.845 1.00 0.00 C ATOM 137 CE LYS A 11 -17.203 6.068 -8.116 1.00 0.00 C ATOM 138 NZ LYS A 11 -17.871 6.889 -9.166 1.00 0.00 N ATOM 0 H LYS A 11 -16.660 0.609 -9.280 1.00 0.00 H new ATOM 0 HA LYS A 11 -16.311 3.437 -9.439 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -18.051 2.163 -8.095 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -16.788 1.703 -6.971 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -17.740 3.681 -6.011 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -16.249 4.232 -6.750 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -18.305 4.332 -8.788 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -18.966 5.078 -7.346 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -17.094 6.649 -7.200 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -16.199 5.791 -8.439 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -17.307 7.743 -9.350 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -17.953 6.333 -10.041 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -18.820 7.164 -8.840 1.00 0.00 H new ATOM 152 N GLN A 12 -14.058 1.773 -7.689 1.00 0.00 N ATOM 153 CA GLN A 12 -12.717 1.934 -7.059 1.00 0.00 C ATOM 154 C GLN A 12 -11.688 2.390 -8.094 1.00 0.00 C ATOM 155 O GLN A 12 -10.958 3.333 -7.864 1.00 0.00 O ATOM 156 CB GLN A 12 -12.281 0.604 -6.439 1.00 0.00 C ATOM 157 CG GLN A 12 -13.048 0.381 -5.135 1.00 0.00 C ATOM 158 CD GLN A 12 -12.644 -0.959 -4.519 1.00 0.00 C ATOM 159 OE1 GLN A 12 -12.238 -1.865 -5.218 1.00 0.00 O ATOM 160 NE2 GLN A 12 -12.734 -1.121 -3.225 1.00 0.00 N ATOM 0 H GLN A 12 -14.424 0.821 -7.699 1.00 0.00 H new ATOM 0 HA GLN A 12 -12.782 2.694 -6.281 1.00 0.00 H new ATOM 0 HB2 GLN A 12 -12.474 -0.215 -7.133 1.00 0.00 H new ATOM 0 HB3 GLN A 12 -11.208 0.613 -6.247 1.00 0.00 H new ATOM 0 HG2 GLN A 12 -12.838 1.191 -4.436 1.00 0.00 H new ATOM 0 HG3 GLN A 12 -14.121 0.395 -5.327 1.00 0.00 H new ATOM 0 HE21 GLN A 12 -13.075 -0.360 -2.638 1.00 0.00 H new ATOM 0 HE22 GLN A 12 -12.463 -2.009 -2.802 1.00 0.00 H new ATOM 169 N VAL A 13 -11.624 1.761 -9.237 1.00 0.00 N ATOM 170 CA VAL A 13 -10.643 2.218 -10.253 1.00 0.00 C ATOM 171 C VAL A 13 -11.111 3.572 -10.777 1.00 0.00 C ATOM 172 O VAL A 13 -10.325 4.462 -11.009 1.00 0.00 O ATOM 173 CB VAL A 13 -10.524 1.185 -11.388 1.00 0.00 C ATOM 174 CG1 VAL A 13 -10.546 -0.250 -10.813 1.00 0.00 C ATOM 175 CG2 VAL A 13 -11.679 1.363 -12.386 1.00 0.00 C ATOM 0 H VAL A 13 -12.200 0.963 -9.505 1.00 0.00 H new ATOM 0 HA VAL A 13 -9.652 2.320 -9.812 1.00 0.00 H new ATOM 0 HB VAL A 13 -9.577 1.344 -11.904 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -10.461 -0.970 -11.627 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -9.710 -0.379 -10.126 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -11.483 -0.414 -10.280 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -11.586 0.628 -13.185 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -12.629 1.221 -11.872 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -11.642 2.366 -12.810 1.00 0.00 H new ATOM 185 N ARG A 14 -12.393 3.758 -10.925 1.00 0.00 N ATOM 186 CA ARG A 14 -12.885 5.080 -11.392 1.00 0.00 C ATOM 187 C ARG A 14 -12.322 6.144 -10.456 1.00 0.00 C ATOM 188 O ARG A 14 -11.873 7.187 -10.887 1.00 0.00 O ATOM 189 CB ARG A 14 -14.421 5.092 -11.352 1.00 0.00 C ATOM 190 CG ARG A 14 -14.975 6.457 -11.785 1.00 0.00 C ATOM 191 CD ARG A 14 -14.902 6.605 -13.307 1.00 0.00 C ATOM 192 NE ARG A 14 -15.490 7.916 -13.700 1.00 0.00 N ATOM 193 CZ ARG A 14 -15.273 8.400 -14.891 1.00 0.00 C ATOM 194 NH1 ARG A 14 -14.544 7.730 -15.742 1.00 0.00 N ATOM 195 NH2 ARG A 14 -15.785 9.551 -15.232 1.00 0.00 N ATOM 0 H ARG A 14 -13.113 3.059 -10.745 1.00 0.00 H new ATOM 0 HA ARG A 14 -12.564 5.277 -12.415 1.00 0.00 H new ATOM 0 HB2 ARG A 14 -14.811 4.313 -12.008 1.00 0.00 H new ATOM 0 HB3 ARG A 14 -14.763 4.861 -10.343 1.00 0.00 H new ATOM 0 HG2 ARG A 14 -16.008 6.559 -11.453 1.00 0.00 H new ATOM 0 HG3 ARG A 14 -14.406 7.255 -11.308 1.00 0.00 H new ATOM 0 HD2 ARG A 14 -13.866 6.542 -13.641 1.00 0.00 H new ATOM 0 HD3 ARG A 14 -15.443 5.791 -13.790 1.00 0.00 H new ATOM 0 HE ARG A 14 -16.064 8.436 -13.036 1.00 0.00 H new ATOM 0 HH11 ARG A 14 -14.146 6.830 -15.475 1.00 0.00 H new ATOM 0 HH12 ARG A 14 -14.373 8.107 -16.674 1.00 0.00 H new ATOM 0 HH21 ARG A 14 -16.355 10.073 -14.567 1.00 0.00 H new ATOM 0 HH22 ARG A 14 -15.615 9.929 -16.164 1.00 0.00 H new ATOM 209 N GLN A 15 -12.312 5.879 -9.179 1.00 0.00 N ATOM 210 CA GLN A 15 -11.741 6.874 -8.234 1.00 0.00 C ATOM 211 C GLN A 15 -10.280 7.130 -8.612 1.00 0.00 C ATOM 212 O GLN A 15 -9.757 8.204 -8.401 1.00 0.00 O ATOM 213 CB GLN A 15 -11.808 6.341 -6.799 1.00 0.00 C ATOM 214 CG GLN A 15 -13.258 6.331 -6.310 1.00 0.00 C ATOM 215 CD GLN A 15 -13.720 7.764 -6.037 1.00 0.00 C ATOM 216 OE1 GLN A 15 -12.865 8.746 -6.133 1.00 0.00 O flip ATOM 217 NE2 GLN A 15 -14.874 7.994 -5.734 1.00 0.00 N flip ATOM 0 H GLN A 15 -12.671 5.024 -8.754 1.00 0.00 H new ATOM 0 HA GLN A 15 -12.314 7.799 -8.293 1.00 0.00 H new ATOM 0 HB2 GLN A 15 -11.395 5.333 -6.757 1.00 0.00 H new ATOM 0 HB3 GLN A 15 -11.199 6.963 -6.143 1.00 0.00 H new ATOM 0 HG2 GLN A 15 -13.901 5.868 -7.058 1.00 0.00 H new ATOM 0 HG3 GLN A 15 -13.342 5.733 -5.403 1.00 0.00 H new ATOM 0 HE21 GLN A 15 -15.544 7.228 -5.658 1.00 0.00 H new ATOM 0 HE22 GLN A 15 -15.173 8.953 -5.555 1.00 0.00 H new ATOM 226 N LEU A 16 -9.616 6.148 -9.171 1.00 0.00 N ATOM 227 CA LEU A 16 -8.187 6.343 -9.555 1.00 0.00 C ATOM 228 C LEU A 16 -8.058 7.258 -10.781 1.00 0.00 C ATOM 229 O LEU A 16 -7.144 8.056 -10.862 1.00 0.00 O ATOM 230 CB LEU A 16 -7.517 4.991 -9.867 1.00 0.00 C ATOM 231 CG LEU A 16 -6.880 4.405 -8.607 1.00 0.00 C ATOM 232 CD1 LEU A 16 -6.612 2.917 -8.832 1.00 0.00 C ATOM 233 CD2 LEU A 16 -5.549 5.114 -8.308 1.00 0.00 C ATOM 0 H LEU A 16 -10.001 5.226 -9.376 1.00 0.00 H new ATOM 0 HA LEU A 16 -7.687 6.812 -8.708 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -8.256 4.296 -10.265 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -6.757 5.124 -10.637 1.00 0.00 H new ATOM 0 HG LEU A 16 -7.557 4.545 -7.764 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -6.157 2.490 -7.938 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -7.552 2.406 -9.041 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -5.936 2.793 -9.678 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -5.104 4.689 -7.408 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -4.868 4.979 -9.148 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -5.730 6.178 -8.155 1.00 0.00 H new ATOM 245 N TYR A 17 -8.935 7.151 -11.748 1.00 0.00 N ATOM 246 CA TYR A 17 -8.794 8.020 -12.949 1.00 0.00 C ATOM 247 C TYR A 17 -9.264 9.439 -12.639 1.00 0.00 C ATOM 248 O TYR A 17 -8.754 10.398 -13.183 1.00 0.00 O ATOM 249 CB TYR A 17 -9.618 7.452 -14.110 1.00 0.00 C ATOM 250 CG TYR A 17 -9.089 6.089 -14.492 1.00 0.00 C ATOM 251 CD1 TYR A 17 -8.076 5.962 -15.453 1.00 0.00 C ATOM 252 CD2 TYR A 17 -9.616 4.950 -13.883 1.00 0.00 C ATOM 253 CE1 TYR A 17 -7.596 4.693 -15.798 1.00 0.00 C ATOM 254 CE2 TYR A 17 -9.134 3.682 -14.228 1.00 0.00 C ATOM 255 CZ TYR A 17 -8.126 3.553 -15.185 1.00 0.00 C ATOM 256 OH TYR A 17 -7.650 2.303 -15.520 1.00 0.00 O ATOM 0 H TYR A 17 -9.728 6.510 -11.757 1.00 0.00 H new ATOM 0 HA TYR A 17 -7.742 8.048 -13.231 1.00 0.00 H new ATOM 0 HB2 TYR A 17 -10.667 7.378 -13.822 1.00 0.00 H new ATOM 0 HB3 TYR A 17 -9.569 8.125 -14.966 1.00 0.00 H new ATOM 0 HD1 TYR A 17 -7.667 6.842 -15.926 1.00 0.00 H new ATOM 0 HD2 TYR A 17 -10.397 5.047 -13.144 1.00 0.00 H new ATOM 0 HE1 TYR A 17 -6.816 4.594 -16.538 1.00 0.00 H new ATOM 0 HE2 TYR A 17 -9.543 2.802 -13.753 1.00 0.00 H new ATOM 0 HH TYR A 17 -7.992 2.049 -16.403 1.00 0.00 H new ATOM 266 N GLU A 18 -10.250 9.593 -11.797 1.00 0.00 N ATOM 267 CA GLU A 18 -10.757 10.965 -11.500 1.00 0.00 C ATOM 268 C GLU A 18 -9.685 11.783 -10.783 1.00 0.00 C ATOM 269 O GLU A 18 -9.666 12.996 -10.850 1.00 0.00 O ATOM 270 CB GLU A 18 -12.002 10.875 -10.615 1.00 0.00 C ATOM 271 CG GLU A 18 -13.145 10.230 -11.402 1.00 0.00 C ATOM 272 CD GLU A 18 -14.402 10.181 -10.530 1.00 0.00 C ATOM 273 OE1 GLU A 18 -14.282 10.413 -9.338 1.00 0.00 O ATOM 274 OE2 GLU A 18 -15.463 9.915 -11.070 1.00 0.00 O ATOM 0 H GLU A 18 -10.724 8.835 -11.305 1.00 0.00 H new ATOM 0 HA GLU A 18 -11.010 11.455 -12.440 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -11.785 10.288 -9.723 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -12.294 11.870 -10.279 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -13.342 10.799 -12.310 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -12.865 9.223 -11.711 1.00 0.00 H new ATOM 281 N ILE A 19 -8.811 11.127 -10.084 1.00 0.00 N ATOM 282 CA ILE A 19 -7.750 11.844 -9.339 1.00 0.00 C ATOM 283 C ILE A 19 -7.234 13.038 -10.148 1.00 0.00 C ATOM 284 O ILE A 19 -6.975 14.092 -9.601 1.00 0.00 O ATOM 285 CB ILE A 19 -6.633 10.856 -9.047 1.00 0.00 C ATOM 286 CG1 ILE A 19 -7.064 9.978 -7.876 1.00 0.00 C ATOM 287 CG2 ILE A 19 -5.350 11.589 -8.686 1.00 0.00 C ATOM 288 CD1 ILE A 19 -6.178 8.747 -7.817 1.00 0.00 C ATOM 0 H ILE A 19 -8.786 10.111 -9.996 1.00 0.00 H new ATOM 0 HA ILE A 19 -8.147 12.239 -8.404 1.00 0.00 H new ATOM 0 HB ILE A 19 -6.443 10.249 -9.933 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -6.992 10.536 -6.943 1.00 0.00 H new ATOM 0 HG13 ILE A 19 -8.107 9.684 -7.992 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -4.562 10.864 -8.480 1.00 0.00 H new ATOM 0 HG22 ILE A 19 -5.049 12.226 -9.517 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -5.518 12.203 -7.801 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -6.484 8.118 -6.981 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -6.272 8.186 -8.747 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -5.140 9.052 -7.681 1.00 0.00 H new ATOM 300 N ASN A 20 -7.069 12.896 -11.434 1.00 0.00 N ATOM 301 CA ASN A 20 -6.556 14.048 -12.231 1.00 0.00 C ATOM 302 C ASN A 20 -6.651 13.756 -13.728 1.00 0.00 C ATOM 303 O ASN A 20 -6.837 12.633 -14.150 1.00 0.00 O ATOM 304 CB ASN A 20 -5.091 14.297 -11.872 1.00 0.00 C ATOM 305 CG ASN A 20 -4.247 13.111 -12.343 1.00 0.00 C ATOM 306 OD1 ASN A 20 -4.770 12.046 -12.603 1.00 0.00 O ATOM 307 ND2 ASN A 20 -2.957 13.254 -12.468 1.00 0.00 N ATOM 0 H ASN A 20 -7.264 12.046 -11.962 1.00 0.00 H new ATOM 0 HA ASN A 20 -7.161 14.925 -12.000 1.00 0.00 H new ATOM 0 HB2 ASN A 20 -4.741 15.216 -12.341 1.00 0.00 H new ATOM 0 HB3 ASN A 20 -4.986 14.428 -10.795 1.00 0.00 H new ATOM 0 HD21 ASN A 20 -2.385 12.471 -12.785 1.00 0.00 H new ATOM 0 HD22 ASN A 20 -2.520 14.149 -12.249 1.00 0.00 H new ATOM 314 N ASP A 21 -6.534 14.782 -14.531 1.00 0.00 N ATOM 315 CA ASP A 21 -6.627 14.605 -16.008 1.00 0.00 C ATOM 316 C ASP A 21 -5.241 14.328 -16.583 1.00 0.00 C ATOM 317 O ASP A 21 -4.681 15.133 -17.302 1.00 0.00 O ATOM 318 CB ASP A 21 -7.197 15.877 -16.637 1.00 0.00 C ATOM 319 CG ASP A 21 -8.650 16.057 -16.195 1.00 0.00 C ATOM 320 OD1 ASP A 21 -9.184 15.137 -15.599 1.00 0.00 O ATOM 321 OD2 ASP A 21 -9.204 17.110 -16.463 1.00 0.00 O ATOM 0 H ASP A 21 -6.377 15.741 -14.223 1.00 0.00 H new ATOM 0 HA ASP A 21 -7.282 13.763 -16.230 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -6.605 16.741 -16.336 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -7.141 15.815 -17.724 1.00 0.00 H new ATOM 326 N ASP A 22 -4.689 13.190 -16.279 1.00 0.00 N ATOM 327 CA ASP A 22 -3.342 12.834 -16.808 1.00 0.00 C ATOM 328 C ASP A 22 -3.490 11.667 -17.791 1.00 0.00 C ATOM 329 O ASP A 22 -3.507 10.519 -17.390 1.00 0.00 O ATOM 330 CB ASP A 22 -2.445 12.406 -15.643 1.00 0.00 C ATOM 331 CG ASP A 22 -1.787 13.640 -15.024 1.00 0.00 C ATOM 332 OD1 ASP A 22 -2.356 14.713 -15.138 1.00 0.00 O ATOM 333 OD2 ASP A 22 -0.722 13.490 -14.446 1.00 0.00 O ATOM 0 H ASP A 22 -5.116 12.483 -15.681 1.00 0.00 H new ATOM 0 HA ASP A 22 -2.899 13.691 -17.315 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -3.034 11.879 -14.892 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -1.682 11.712 -15.994 1.00 0.00 H new ATOM 338 N PRO A 23 -3.607 11.946 -19.067 1.00 0.00 N ATOM 339 CA PRO A 23 -3.767 10.880 -20.098 1.00 0.00 C ATOM 340 C PRO A 23 -2.727 9.769 -19.939 1.00 0.00 C ATOM 341 O PRO A 23 -3.038 8.600 -20.052 1.00 0.00 O ATOM 342 CB PRO A 23 -3.571 11.617 -21.425 1.00 0.00 C ATOM 343 CG PRO A 23 -3.930 13.039 -21.143 1.00 0.00 C ATOM 344 CD PRO A 23 -3.602 13.290 -19.670 1.00 0.00 C ATOM 0 HA PRO A 23 -4.734 10.383 -20.022 1.00 0.00 H new ATOM 0 HB2 PRO A 23 -2.542 11.533 -21.773 1.00 0.00 H new ATOM 0 HB3 PRO A 23 -4.207 11.198 -22.205 1.00 0.00 H new ATOM 0 HG2 PRO A 23 -3.367 13.715 -21.786 1.00 0.00 H new ATOM 0 HG3 PRO A 23 -4.987 13.218 -21.340 1.00 0.00 H new ATOM 0 HD2 PRO A 23 -2.633 13.775 -19.554 1.00 0.00 H new ATOM 0 HD3 PRO A 23 -4.342 13.940 -19.202 1.00 0.00 H new ATOM 352 N LYS A 24 -1.498 10.117 -19.664 1.00 0.00 N ATOM 353 CA LYS A 24 -0.459 9.066 -19.483 1.00 0.00 C ATOM 354 C LYS A 24 -0.833 8.214 -18.270 1.00 0.00 C ATOM 355 O LYS A 24 -0.721 7.004 -18.286 1.00 0.00 O ATOM 356 CB LYS A 24 0.909 9.715 -19.247 1.00 0.00 C ATOM 357 CG LYS A 24 1.475 10.254 -20.567 1.00 0.00 C ATOM 358 CD LYS A 24 0.834 11.604 -20.893 1.00 0.00 C ATOM 359 CE LYS A 24 1.496 12.204 -22.138 1.00 0.00 C ATOM 360 NZ LYS A 24 0.504 13.042 -22.872 1.00 0.00 N ATOM 0 H LYS A 24 -1.172 11.078 -19.558 1.00 0.00 H new ATOM 0 HA LYS A 24 -0.405 8.446 -20.378 1.00 0.00 H new ATOM 0 HB2 LYS A 24 0.815 10.526 -18.525 1.00 0.00 H new ATOM 0 HB3 LYS A 24 1.597 8.986 -18.819 1.00 0.00 H new ATOM 0 HG2 LYS A 24 2.557 10.364 -20.492 1.00 0.00 H new ATOM 0 HG3 LYS A 24 1.282 9.545 -21.372 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -0.235 11.478 -21.063 1.00 0.00 H new ATOM 0 HD3 LYS A 24 0.944 12.283 -20.048 1.00 0.00 H new ATOM 0 HE2 LYS A 24 2.357 12.808 -21.850 1.00 0.00 H new ATOM 0 HE3 LYS A 24 1.867 11.409 -22.785 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 0.952 13.450 -23.717 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -0.304 12.453 -23.158 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 0.171 13.808 -22.253 1.00 0.00 H new ATOM 374 N ARG A 25 -1.287 8.842 -17.219 1.00 0.00 N ATOM 375 CA ARG A 25 -1.680 8.077 -16.005 1.00 0.00 C ATOM 376 C ARG A 25 -2.774 7.077 -16.371 1.00 0.00 C ATOM 377 O ARG A 25 -2.811 5.971 -15.871 1.00 0.00 O ATOM 378 CB ARG A 25 -2.206 9.040 -14.939 1.00 0.00 C ATOM 379 CG ARG A 25 -2.570 8.247 -13.684 1.00 0.00 C ATOM 380 CD ARG A 25 -3.043 9.207 -12.593 1.00 0.00 C ATOM 381 NE ARG A 25 -3.286 8.453 -11.333 1.00 0.00 N ATOM 382 CZ ARG A 25 -3.357 9.096 -10.203 1.00 0.00 C ATOM 383 NH1 ARG A 25 -3.191 10.389 -10.183 1.00 0.00 N ATOM 384 NH2 ARG A 25 -3.588 8.450 -9.094 1.00 0.00 N ATOM 0 H ARG A 25 -1.402 9.853 -17.150 1.00 0.00 H new ATOM 0 HA ARG A 25 -0.813 7.545 -15.614 1.00 0.00 H new ATOM 0 HB2 ARG A 25 -1.451 9.790 -14.704 1.00 0.00 H new ATOM 0 HB3 ARG A 25 -3.080 9.574 -15.313 1.00 0.00 H new ATOM 0 HG2 ARG A 25 -3.354 7.525 -13.912 1.00 0.00 H new ATOM 0 HG3 ARG A 25 -1.706 7.681 -13.335 1.00 0.00 H new ATOM 0 HD2 ARG A 25 -2.294 9.981 -12.426 1.00 0.00 H new ATOM 0 HD3 ARG A 25 -3.957 9.710 -12.909 1.00 0.00 H new ATOM 0 HE ARG A 25 -3.396 7.439 -11.355 1.00 0.00 H new ATOM 0 HH11 ARG A 25 -3.006 10.893 -11.050 1.00 0.00 H new ATOM 0 HH12 ARG A 25 -3.246 10.897 -9.300 1.00 0.00 H new ATOM 0 HH21 ARG A 25 -3.714 7.438 -9.110 1.00 0.00 H new ATOM 0 HH22 ARG A 25 -3.643 8.957 -8.211 1.00 0.00 H new ATOM 398 N LYS A 26 -3.671 7.461 -17.236 1.00 0.00 N ATOM 399 CA LYS A 26 -4.765 6.535 -17.628 1.00 0.00 C ATOM 400 C LYS A 26 -4.150 5.275 -18.242 1.00 0.00 C ATOM 401 O LYS A 26 -4.482 4.164 -17.879 1.00 0.00 O ATOM 402 CB LYS A 26 -5.656 7.237 -18.658 1.00 0.00 C ATOM 403 CG LYS A 26 -6.863 6.361 -18.996 1.00 0.00 C ATOM 404 CD LYS A 26 -7.723 7.078 -20.039 1.00 0.00 C ATOM 405 CE LYS A 26 -9.015 6.297 -20.274 1.00 0.00 C ATOM 406 NZ LYS A 26 -9.900 7.070 -21.190 1.00 0.00 N ATOM 0 H LYS A 26 -3.692 8.376 -17.687 1.00 0.00 H new ATOM 0 HA LYS A 26 -5.362 6.258 -16.759 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -5.992 8.196 -18.265 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -5.084 7.446 -19.562 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -6.532 5.396 -19.380 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -7.448 6.163 -18.098 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -7.955 8.088 -19.700 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -7.171 7.175 -20.974 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -8.790 5.321 -20.705 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -9.522 6.117 -19.326 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -10.780 6.540 -21.351 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -10.124 7.991 -20.761 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -9.415 7.219 -22.098 1.00 0.00 H new ATOM 420 N GLU A 27 -3.252 5.449 -19.168 1.00 0.00 N ATOM 421 CA GLU A 27 -2.606 4.270 -19.810 1.00 0.00 C ATOM 422 C GLU A 27 -1.998 3.371 -18.727 1.00 0.00 C ATOM 423 O GLU A 27 -2.032 2.159 -18.822 1.00 0.00 O ATOM 424 CB GLU A 27 -1.507 4.745 -20.766 1.00 0.00 C ATOM 425 CG GLU A 27 -2.126 5.632 -21.850 1.00 0.00 C ATOM 426 CD GLU A 27 -1.052 6.030 -22.866 1.00 0.00 C ATOM 427 OE1 GLU A 27 0.100 5.703 -22.642 1.00 0.00 O ATOM 428 OE2 GLU A 27 -1.404 6.659 -23.850 1.00 0.00 O ATOM 0 H GLU A 27 -2.936 6.357 -19.509 1.00 0.00 H new ATOM 0 HA GLU A 27 -3.351 3.706 -20.372 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -0.746 5.300 -20.217 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -1.010 3.888 -21.221 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -2.935 5.100 -22.351 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -2.562 6.523 -21.399 1.00 0.00 H new ATOM 435 N PHE A 28 -1.442 3.955 -17.700 1.00 0.00 N ATOM 436 CA PHE A 28 -0.831 3.144 -16.609 1.00 0.00 C ATOM 437 C PHE A 28 -1.895 2.318 -15.890 1.00 0.00 C ATOM 438 O PHE A 28 -1.840 1.106 -15.866 1.00 0.00 O ATOM 439 CB PHE A 28 -0.206 4.092 -15.599 1.00 0.00 C ATOM 440 CG PHE A 28 0.533 3.298 -14.562 1.00 0.00 C ATOM 441 CD1 PHE A 28 1.862 2.941 -14.797 1.00 0.00 C ATOM 442 CD2 PHE A 28 -0.091 2.944 -13.356 1.00 0.00 C ATOM 443 CE1 PHE A 28 2.573 2.230 -13.835 1.00 0.00 C ATOM 444 CE2 PHE A 28 0.622 2.225 -12.393 1.00 0.00 C ATOM 445 CZ PHE A 28 1.955 1.867 -12.630 1.00 0.00 C ATOM 0 H PHE A 28 -1.385 4.965 -17.570 1.00 0.00 H new ATOM 0 HA PHE A 28 -0.087 2.474 -17.040 1.00 0.00 H new ATOM 0 HB2 PHE A 28 0.476 4.779 -16.101 1.00 0.00 H new ATOM 0 HB3 PHE A 28 -0.979 4.699 -15.126 1.00 0.00 H new ATOM 0 HD1 PHE A 28 2.339 3.217 -15.726 1.00 0.00 H new ATOM 0 HD2 PHE A 28 -1.117 3.226 -13.173 1.00 0.00 H new ATOM 0 HE1 PHE A 28 3.602 1.957 -14.017 1.00 0.00 H new ATOM 0 HE2 PHE A 28 0.145 1.945 -11.465 1.00 0.00 H new ATOM 0 HZ PHE A 28 2.506 1.312 -11.885 1.00 0.00 H new ATOM 455 N LEU A 29 -2.858 2.965 -15.291 1.00 0.00 N ATOM 456 CA LEU A 29 -3.920 2.219 -14.560 1.00 0.00 C ATOM 457 C LEU A 29 -4.556 1.202 -15.497 1.00 0.00 C ATOM 458 O LEU A 29 -4.723 0.045 -15.162 1.00 0.00 O ATOM 459 CB LEU A 29 -4.988 3.210 -14.103 1.00 0.00 C ATOM 460 CG LEU A 29 -4.347 4.281 -13.220 1.00 0.00 C ATOM 461 CD1 LEU A 29 -5.347 5.414 -12.979 1.00 0.00 C ATOM 462 CD2 LEU A 29 -3.952 3.667 -11.875 1.00 0.00 C ATOM 0 H LEU A 29 -2.954 3.980 -15.277 1.00 0.00 H new ATOM 0 HA LEU A 29 -3.489 1.706 -13.700 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -5.463 3.673 -14.968 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -5.770 2.689 -13.551 1.00 0.00 H new ATOM 0 HG LEU A 29 -3.461 4.674 -13.719 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -4.888 6.176 -12.349 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -5.633 5.856 -13.933 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -6.233 5.018 -12.482 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -3.495 4.431 -11.246 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -4.840 3.273 -11.380 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -3.239 2.859 -12.039 1.00 0.00 H new ATOM 474 N ASP A 30 -4.902 1.625 -16.677 1.00 0.00 N ATOM 475 CA ASP A 30 -5.521 0.681 -17.651 1.00 0.00 C ATOM 476 C ASP A 30 -4.529 -0.436 -17.976 1.00 0.00 C ATOM 477 O ASP A 30 -4.874 -1.601 -17.975 1.00 0.00 O ATOM 478 CB ASP A 30 -5.891 1.430 -18.934 1.00 0.00 C ATOM 479 CG ASP A 30 -7.125 2.298 -18.682 1.00 0.00 C ATOM 480 OD1 ASP A 30 -7.862 1.988 -17.763 1.00 0.00 O ATOM 481 OD2 ASP A 30 -7.312 3.256 -19.414 1.00 0.00 O ATOM 0 H ASP A 30 -4.785 2.581 -17.012 1.00 0.00 H new ATOM 0 HA ASP A 30 -6.423 0.251 -17.215 1.00 0.00 H new ATOM 0 HB2 ASP A 30 -5.056 2.052 -19.258 1.00 0.00 H new ATOM 0 HB3 ASP A 30 -6.091 0.720 -19.737 1.00 0.00 H new ATOM 486 N ASP A 31 -3.297 -0.096 -18.242 1.00 0.00 N ATOM 487 CA ASP A 31 -2.292 -1.149 -18.549 1.00 0.00 C ATOM 488 C ASP A 31 -2.040 -1.990 -17.298 1.00 0.00 C ATOM 489 O ASP A 31 -1.964 -3.199 -17.357 1.00 0.00 O ATOM 490 CB ASP A 31 -0.982 -0.496 -18.994 1.00 0.00 C ATOM 491 CG ASP A 31 0.002 -1.579 -19.437 1.00 0.00 C ATOM 492 OD1 ASP A 31 -0.416 -2.720 -19.554 1.00 0.00 O ATOM 493 OD2 ASP A 31 1.159 -1.250 -19.650 1.00 0.00 O ATOM 0 H ASP A 31 -2.946 0.861 -18.260 1.00 0.00 H new ATOM 0 HA ASP A 31 -2.669 -1.786 -19.349 1.00 0.00 H new ATOM 0 HB2 ASP A 31 -1.169 0.198 -19.814 1.00 0.00 H new ATOM 0 HB3 ASP A 31 -0.556 0.085 -18.176 1.00 0.00 H new ATOM 498 N LEU A 32 -1.890 -1.352 -16.167 1.00 0.00 N ATOM 499 CA LEU A 32 -1.622 -2.115 -14.918 1.00 0.00 C ATOM 500 C LEU A 32 -2.713 -3.155 -14.701 1.00 0.00 C ATOM 501 O LEU A 32 -2.435 -4.317 -14.502 1.00 0.00 O ATOM 502 CB LEU A 32 -1.573 -1.155 -13.724 1.00 0.00 C ATOM 503 CG LEU A 32 -1.262 -1.934 -12.441 1.00 0.00 C ATOM 504 CD1 LEU A 32 0.132 -2.550 -12.530 1.00 0.00 C ATOM 505 CD2 LEU A 32 -1.291 -0.978 -11.253 1.00 0.00 C ATOM 0 H LEU A 32 -1.942 -0.339 -16.057 1.00 0.00 H new ATOM 0 HA LEU A 32 -0.661 -2.622 -15.009 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -0.812 -0.392 -13.890 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -2.527 -0.637 -13.623 1.00 0.00 H new ATOM 0 HG LEU A 32 -2.006 -2.721 -12.316 1.00 0.00 H new ATOM 0 HD11 LEU A 32 0.345 -3.102 -11.614 1.00 0.00 H new ATOM 0 HD12 LEU A 32 0.176 -3.229 -13.381 1.00 0.00 H new ATOM 0 HD13 LEU A 32 0.872 -1.760 -12.658 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -1.070 -1.528 -10.338 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -0.544 -0.197 -11.396 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -2.279 -0.525 -11.175 1.00 0.00 H new ATOM 517 N PHE A 33 -3.953 -2.767 -14.750 1.00 0.00 N ATOM 518 CA PHE A 33 -5.018 -3.779 -14.550 1.00 0.00 C ATOM 519 C PHE A 33 -4.885 -4.824 -15.657 1.00 0.00 C ATOM 520 O PHE A 33 -5.120 -5.999 -15.454 1.00 0.00 O ATOM 521 CB PHE A 33 -6.406 -3.130 -14.637 1.00 0.00 C ATOM 522 CG PHE A 33 -6.614 -2.131 -13.512 1.00 0.00 C ATOM 523 CD1 PHE A 33 -6.528 -2.540 -12.171 1.00 0.00 C ATOM 524 CD2 PHE A 33 -6.907 -0.792 -13.814 1.00 0.00 C ATOM 525 CE1 PHE A 33 -6.735 -1.609 -11.139 1.00 0.00 C ATOM 526 CE2 PHE A 33 -7.117 0.133 -12.783 1.00 0.00 C ATOM 527 CZ PHE A 33 -7.033 -0.272 -11.447 1.00 0.00 C ATOM 0 H PHE A 33 -4.270 -1.812 -14.917 1.00 0.00 H new ATOM 0 HA PHE A 33 -4.911 -4.233 -13.565 1.00 0.00 H new ATOM 0 HB2 PHE A 33 -6.517 -2.628 -15.598 1.00 0.00 H new ATOM 0 HB3 PHE A 33 -7.175 -3.901 -14.590 1.00 0.00 H new ATOM 0 HD1 PHE A 33 -6.303 -3.569 -11.933 1.00 0.00 H new ATOM 0 HD2 PHE A 33 -6.971 -0.474 -14.844 1.00 0.00 H new ATOM 0 HE1 PHE A 33 -6.665 -1.922 -10.108 1.00 0.00 H new ATOM 0 HE2 PHE A 33 -7.344 1.162 -13.021 1.00 0.00 H new ATOM 0 HZ PHE A 33 -7.197 0.442 -10.654 1.00 0.00 H new ATOM 537 N SER A 34 -4.495 -4.397 -16.829 1.00 0.00 N ATOM 538 CA SER A 34 -4.327 -5.351 -17.965 1.00 0.00 C ATOM 539 C SER A 34 -3.106 -6.250 -17.736 1.00 0.00 C ATOM 540 O SER A 34 -3.190 -7.460 -17.819 1.00 0.00 O ATOM 541 CB SER A 34 -4.137 -4.563 -19.261 1.00 0.00 C ATOM 542 OG SER A 34 -4.145 -5.461 -20.363 1.00 0.00 O ATOM 0 H SER A 34 -4.285 -3.424 -17.049 1.00 0.00 H new ATOM 0 HA SER A 34 -5.217 -5.977 -18.034 1.00 0.00 H new ATOM 0 HB2 SER A 34 -4.933 -3.826 -19.372 1.00 0.00 H new ATOM 0 HB3 SER A 34 -3.196 -4.014 -19.231 1.00 0.00 H new ATOM 0 HG SER A 34 -4.025 -4.958 -21.196 1.00 0.00 H new ATOM 548 N PHE A 35 -1.964 -5.664 -17.474 1.00 0.00 N ATOM 549 CA PHE A 35 -0.724 -6.461 -17.268 1.00 0.00 C ATOM 550 C PHE A 35 -0.888 -7.445 -16.112 1.00 0.00 C ATOM 551 O PHE A 35 -0.508 -8.595 -16.204 1.00 0.00 O ATOM 552 CB PHE A 35 0.403 -5.482 -16.949 1.00 0.00 C ATOM 553 CG PHE A 35 1.670 -6.224 -16.625 1.00 0.00 C ATOM 554 CD1 PHE A 35 2.357 -6.912 -17.627 1.00 0.00 C ATOM 555 CD2 PHE A 35 2.170 -6.199 -15.319 1.00 0.00 C ATOM 556 CE1 PHE A 35 3.551 -7.577 -17.323 1.00 0.00 C ATOM 557 CE2 PHE A 35 3.360 -6.863 -15.013 1.00 0.00 C ATOM 558 CZ PHE A 35 4.054 -7.551 -16.015 1.00 0.00 C ATOM 0 H PHE A 35 -1.841 -4.655 -17.394 1.00 0.00 H new ATOM 0 HA PHE A 35 -0.505 -7.039 -18.166 1.00 0.00 H new ATOM 0 HB2 PHE A 35 0.569 -4.821 -17.799 1.00 0.00 H new ATOM 0 HB3 PHE A 35 0.118 -4.852 -16.106 1.00 0.00 H new ATOM 0 HD1 PHE A 35 1.968 -6.931 -18.634 1.00 0.00 H new ATOM 0 HD2 PHE A 35 1.636 -5.666 -14.547 1.00 0.00 H new ATOM 0 HE1 PHE A 35 4.084 -8.110 -18.096 1.00 0.00 H new ATOM 0 HE2 PHE A 35 3.744 -6.846 -14.004 1.00 0.00 H new ATOM 0 HZ PHE A 35 4.976 -8.061 -15.780 1.00 0.00 H new ATOM 568 N MET A 36 -1.436 -7.002 -15.024 1.00 0.00 N ATOM 569 CA MET A 36 -1.611 -7.905 -13.855 1.00 0.00 C ATOM 570 C MET A 36 -2.456 -9.118 -14.246 1.00 0.00 C ATOM 571 O MET A 36 -2.252 -10.208 -13.751 1.00 0.00 O ATOM 572 CB MET A 36 -2.297 -7.128 -12.737 1.00 0.00 C ATOM 573 CG MET A 36 -1.356 -6.025 -12.256 1.00 0.00 C ATOM 574 SD MET A 36 -2.180 -5.019 -10.996 1.00 0.00 S ATOM 575 CE MET A 36 -2.079 -6.204 -9.634 1.00 0.00 C ATOM 0 H MET A 36 -1.773 -6.049 -14.890 1.00 0.00 H new ATOM 0 HA MET A 36 -0.638 -8.261 -13.516 1.00 0.00 H new ATOM 0 HB2 MET A 36 -3.232 -6.697 -13.095 1.00 0.00 H new ATOM 0 HB3 MET A 36 -2.549 -7.795 -11.913 1.00 0.00 H new ATOM 0 HG2 MET A 36 -0.446 -6.464 -11.846 1.00 0.00 H new ATOM 0 HG3 MET A 36 -1.057 -5.398 -13.096 1.00 0.00 H new ATOM 0 HE1 MET A 36 -3.063 -6.639 -9.456 1.00 0.00 H new ATOM 0 HE2 MET A 36 -1.374 -6.994 -9.891 1.00 0.00 H new ATOM 0 HE3 MET A 36 -1.740 -5.694 -8.732 1.00 0.00 H new ATOM 585 N GLN A 37 -3.399 -8.949 -15.133 1.00 0.00 N ATOM 586 CA GLN A 37 -4.238 -10.111 -15.542 1.00 0.00 C ATOM 587 C GLN A 37 -3.316 -11.253 -15.971 1.00 0.00 C ATOM 588 O GLN A 37 -3.558 -12.408 -15.680 1.00 0.00 O ATOM 589 CB GLN A 37 -5.135 -9.708 -16.715 1.00 0.00 C ATOM 590 CG GLN A 37 -6.177 -10.801 -16.967 1.00 0.00 C ATOM 591 CD GLN A 37 -7.281 -10.705 -15.913 1.00 0.00 C ATOM 592 OE1 GLN A 37 -7.435 -11.587 -15.093 1.00 0.00 O ATOM 593 NE2 GLN A 37 -8.065 -9.662 -15.902 1.00 0.00 N ATOM 0 H GLN A 37 -3.623 -8.064 -15.589 1.00 0.00 H new ATOM 0 HA GLN A 37 -4.864 -10.430 -14.709 1.00 0.00 H new ATOM 0 HB2 GLN A 37 -5.631 -8.762 -16.498 1.00 0.00 H new ATOM 0 HB3 GLN A 37 -4.532 -9.553 -17.610 1.00 0.00 H new ATOM 0 HG2 GLN A 37 -6.601 -10.691 -17.965 1.00 0.00 H new ATOM 0 HG3 GLN A 37 -5.706 -11.783 -16.928 1.00 0.00 H new ATOM 0 HE21 GLN A 37 -7.937 -8.920 -16.590 1.00 0.00 H new ATOM 0 HE22 GLN A 37 -8.806 -9.588 -15.205 1.00 0.00 H new ATOM 602 N LYS A 38 -2.251 -10.931 -16.650 1.00 0.00 N ATOM 603 CA LYS A 38 -1.293 -11.983 -17.095 1.00 0.00 C ATOM 604 C LYS A 38 -0.555 -12.504 -15.867 1.00 0.00 C ATOM 605 O LYS A 38 -0.241 -13.672 -15.749 1.00 0.00 O ATOM 606 CB LYS A 38 -0.269 -11.376 -18.061 1.00 0.00 C ATOM 607 CG LYS A 38 -0.942 -10.307 -18.914 1.00 0.00 C ATOM 608 CD LYS A 38 -2.148 -10.910 -19.641 1.00 0.00 C ATOM 609 CE LYS A 38 -2.753 -9.867 -20.582 1.00 0.00 C ATOM 610 NZ LYS A 38 -4.145 -10.265 -20.933 1.00 0.00 N ATOM 0 H LYS A 38 -2.001 -9.979 -16.918 1.00 0.00 H new ATOM 0 HA LYS A 38 -1.832 -12.787 -17.596 1.00 0.00 H new ATOM 0 HB2 LYS A 38 0.560 -10.941 -17.502 1.00 0.00 H new ATOM 0 HB3 LYS A 38 0.150 -12.154 -18.699 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -1.262 -9.475 -18.286 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -0.233 -9.905 -19.638 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -1.842 -11.790 -20.206 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -2.894 -11.239 -18.918 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -2.753 -8.887 -20.105 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -2.149 -9.782 -21.485 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -4.558 -9.557 -21.573 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -4.133 -11.192 -21.404 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -4.718 -10.325 -20.067 1.00 0.00 H new ATOM 624 N ARG A 39 -0.261 -11.615 -14.963 1.00 0.00 N ATOM 625 CA ARG A 39 0.482 -12.013 -13.736 1.00 0.00 C ATOM 626 C ARG A 39 -0.372 -12.962 -12.901 1.00 0.00 C ATOM 627 O ARG A 39 0.141 -13.816 -12.204 1.00 0.00 O ATOM 628 CB ARG A 39 0.812 -10.763 -12.915 1.00 0.00 C ATOM 629 CG ARG A 39 1.579 -9.765 -13.777 1.00 0.00 C ATOM 630 CD ARG A 39 2.922 -10.363 -14.204 1.00 0.00 C ATOM 631 NE ARG A 39 3.548 -11.059 -13.043 1.00 0.00 N ATOM 632 CZ ARG A 39 4.545 -11.879 -13.234 1.00 0.00 C ATOM 633 NH1 ARG A 39 5.018 -12.063 -14.435 1.00 0.00 N ATOM 634 NH2 ARG A 39 5.074 -12.513 -12.221 1.00 0.00 N ATOM 0 H ARG A 39 -0.504 -10.626 -15.020 1.00 0.00 H new ATOM 0 HA ARG A 39 1.405 -12.518 -14.020 1.00 0.00 H new ATOM 0 HB2 ARG A 39 -0.106 -10.307 -12.545 1.00 0.00 H new ATOM 0 HB3 ARG A 39 1.406 -11.036 -12.043 1.00 0.00 H new ATOM 0 HG2 ARG A 39 0.991 -9.506 -14.657 1.00 0.00 H new ATOM 0 HG3 ARG A 39 1.743 -8.842 -13.220 1.00 0.00 H new ATOM 0 HD2 ARG A 39 2.775 -11.064 -15.026 1.00 0.00 H new ATOM 0 HD3 ARG A 39 3.583 -9.577 -14.570 1.00 0.00 H new ATOM 0 HE ARG A 39 3.197 -10.894 -12.100 1.00 0.00 H new ATOM 0 HH11 ARG A 39 4.609 -11.566 -15.226 1.00 0.00 H new ATOM 0 HH12 ARG A 39 5.797 -12.704 -14.584 1.00 0.00 H new ATOM 0 HH21 ARG A 39 4.708 -12.367 -11.280 1.00 0.00 H new ATOM 0 HH22 ARG A 39 5.853 -13.154 -12.371 1.00 0.00 H new ATOM 648 N GLY A 40 -1.667 -12.828 -12.954 1.00 0.00 N ATOM 649 CA GLY A 40 -2.527 -13.733 -12.149 1.00 0.00 C ATOM 650 C GLY A 40 -2.851 -13.042 -10.832 1.00 0.00 C ATOM 651 O GLY A 40 -3.551 -13.575 -9.993 1.00 0.00 O ATOM 0 H GLY A 40 -2.163 -12.136 -13.516 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -3.444 -13.966 -12.691 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -2.016 -14.678 -11.966 1.00 0.00 H new ATOM 655 N THR A 41 -2.360 -11.841 -10.656 1.00 0.00 N ATOM 656 CA THR A 41 -2.653 -11.092 -9.401 1.00 0.00 C ATOM 657 C THR A 41 -3.432 -9.836 -9.767 1.00 0.00 C ATOM 658 O THR A 41 -2.864 -8.783 -9.928 1.00 0.00 O ATOM 659 CB THR A 41 -1.346 -10.670 -8.723 1.00 0.00 C ATOM 660 OG1 THR A 41 -0.645 -9.772 -9.573 1.00 0.00 O ATOM 661 CG2 THR A 41 -0.471 -11.891 -8.444 1.00 0.00 C ATOM 0 H THR A 41 -1.770 -11.349 -11.327 1.00 0.00 H new ATOM 0 HA THR A 41 -3.224 -11.726 -8.723 1.00 0.00 H new ATOM 0 HB THR A 41 -1.580 -10.182 -7.777 1.00 0.00 H new ATOM 0 HG1 THR A 41 -1.284 -9.293 -10.141 1.00 0.00 H new ATOM 0 HG21 THR A 41 0.454 -11.573 -7.962 1.00 0.00 H new ATOM 0 HG22 THR A 41 -1.005 -12.579 -7.788 1.00 0.00 H new ATOM 0 HG23 THR A 41 -0.237 -12.393 -9.383 1.00 0.00 H new ATOM 669 N PRO A 42 -4.722 -9.943 -9.898 1.00 0.00 N ATOM 670 CA PRO A 42 -5.586 -8.790 -10.258 1.00 0.00 C ATOM 671 C PRO A 42 -5.952 -7.958 -9.023 1.00 0.00 C ATOM 672 O PRO A 42 -6.183 -8.493 -7.957 1.00 0.00 O ATOM 673 CB PRO A 42 -6.808 -9.474 -10.863 1.00 0.00 C ATOM 674 CG PRO A 42 -6.935 -10.756 -10.110 1.00 0.00 C ATOM 675 CD PRO A 42 -5.512 -11.174 -9.719 1.00 0.00 C ATOM 0 HA PRO A 42 -5.110 -8.081 -10.935 1.00 0.00 H new ATOM 0 HB2 PRO A 42 -7.701 -8.859 -10.752 1.00 0.00 H new ATOM 0 HB3 PRO A 42 -6.674 -9.653 -11.930 1.00 0.00 H new ATOM 0 HG2 PRO A 42 -7.558 -10.626 -9.225 1.00 0.00 H new ATOM 0 HG3 PRO A 42 -7.409 -11.521 -10.724 1.00 0.00 H new ATOM 0 HD2 PRO A 42 -5.469 -11.531 -8.690 1.00 0.00 H new ATOM 0 HD3 PRO A 42 -5.144 -11.981 -10.352 1.00 0.00 H new ATOM 683 N ILE A 43 -5.988 -6.658 -9.145 1.00 0.00 N ATOM 684 CA ILE A 43 -6.319 -5.823 -7.956 1.00 0.00 C ATOM 685 C ILE A 43 -7.821 -5.883 -7.686 1.00 0.00 C ATOM 686 O ILE A 43 -8.597 -5.161 -8.278 1.00 0.00 O ATOM 687 CB ILE A 43 -5.905 -4.372 -8.209 1.00 0.00 C ATOM 688 CG1 ILE A 43 -4.487 -4.351 -8.799 1.00 0.00 C ATOM 689 CG2 ILE A 43 -5.922 -3.609 -6.880 1.00 0.00 C ATOM 690 CD1 ILE A 43 -4.004 -2.910 -9.024 1.00 0.00 C ATOM 0 H ILE A 43 -5.805 -6.143 -10.006 1.00 0.00 H new ATOM 0 HA ILE A 43 -5.779 -6.207 -7.090 1.00 0.00 H new ATOM 0 HB ILE A 43 -6.596 -3.901 -8.908 1.00 0.00 H new ATOM 0 HG12 ILE A 43 -3.802 -4.867 -8.126 1.00 0.00 H new ATOM 0 HG13 ILE A 43 -4.475 -4.894 -9.744 1.00 0.00 H new ATOM 0 HG21 ILE A 43 -5.628 -2.573 -7.051 1.00 0.00 H new ATOM 0 HG22 ILE A 43 -6.927 -3.636 -6.458 1.00 0.00 H new ATOM 0 HG23 ILE A 43 -5.224 -4.074 -6.184 1.00 0.00 H new ATOM 0 HD11 ILE A 43 -2.998 -2.925 -9.442 1.00 0.00 H new ATOM 0 HD12 ILE A 43 -4.677 -2.404 -9.716 1.00 0.00 H new ATOM 0 HD13 ILE A 43 -3.994 -2.377 -8.073 1.00 0.00 H new ATOM 702 N ASN A 44 -8.236 -6.724 -6.778 1.00 0.00 N ATOM 703 CA ASN A 44 -9.685 -6.810 -6.457 1.00 0.00 C ATOM 704 C ASN A 44 -10.088 -5.504 -5.775 1.00 0.00 C ATOM 705 O ASN A 44 -11.087 -4.894 -6.102 1.00 0.00 O ATOM 706 CB ASN A 44 -9.923 -7.988 -5.511 1.00 0.00 C ATOM 707 CG ASN A 44 -11.384 -8.431 -5.589 1.00 0.00 C ATOM 708 OD1 ASN A 44 -12.246 -7.665 -5.977 1.00 0.00 O ATOM 709 ND2 ASN A 44 -11.697 -9.648 -5.239 1.00 0.00 N ATOM 0 H ASN A 44 -7.634 -7.353 -6.247 1.00 0.00 H new ATOM 0 HA ASN A 44 -10.276 -6.962 -7.360 1.00 0.00 H new ATOM 0 HB2 ASN A 44 -9.268 -8.817 -5.777 1.00 0.00 H new ATOM 0 HB3 ASN A 44 -9.675 -7.701 -4.489 1.00 0.00 H new ATOM 0 HD21 ASN A 44 -12.667 -9.960 -5.290 1.00 0.00 H new ATOM 0 HD22 ASN A 44 -10.972 -10.288 -4.914 1.00 0.00 H new ATOM 716 N ARG A 45 -9.296 -5.065 -4.835 1.00 0.00 N ATOM 717 CA ARG A 45 -9.585 -3.793 -4.123 1.00 0.00 C ATOM 718 C ARG A 45 -8.323 -2.931 -4.131 1.00 0.00 C ATOM 719 O ARG A 45 -7.244 -3.401 -3.832 1.00 0.00 O ATOM 720 CB ARG A 45 -9.982 -4.116 -2.687 1.00 0.00 C ATOM 721 CG ARG A 45 -11.346 -4.819 -2.688 1.00 0.00 C ATOM 722 CD ARG A 45 -11.384 -5.885 -1.594 1.00 0.00 C ATOM 723 NE ARG A 45 -10.884 -7.176 -2.148 1.00 0.00 N ATOM 724 CZ ARG A 45 -10.588 -8.164 -1.350 1.00 0.00 C ATOM 725 NH1 ARG A 45 -10.735 -8.026 -0.064 1.00 0.00 N ATOM 726 NH2 ARG A 45 -10.146 -9.288 -1.837 1.00 0.00 N ATOM 0 H ARG A 45 -8.449 -5.543 -4.528 1.00 0.00 H new ATOM 0 HA ARG A 45 -10.397 -3.255 -4.612 1.00 0.00 H new ATOM 0 HB2 ARG A 45 -9.230 -4.755 -2.224 1.00 0.00 H new ATOM 0 HB3 ARG A 45 -10.031 -3.202 -2.096 1.00 0.00 H new ATOM 0 HG2 ARG A 45 -12.140 -4.090 -2.525 1.00 0.00 H new ATOM 0 HG3 ARG A 45 -11.528 -5.277 -3.660 1.00 0.00 H new ATOM 0 HD2 ARG A 45 -10.770 -5.577 -0.748 1.00 0.00 H new ATOM 0 HD3 ARG A 45 -12.402 -6.005 -1.222 1.00 0.00 H new ATOM 0 HE ARG A 45 -10.773 -7.287 -3.156 1.00 0.00 H new ATOM 0 HH11 ARG A 45 -11.081 -7.146 0.318 1.00 0.00 H new ATOM 0 HH12 ARG A 45 -10.504 -8.798 0.561 1.00 0.00 H new ATOM 0 HH21 ARG A 45 -10.031 -9.397 -2.845 1.00 0.00 H new ATOM 0 HH22 ARG A 45 -9.915 -10.059 -1.211 1.00 0.00 H new ATOM 740 N LEU A 46 -8.435 -1.679 -4.477 1.00 0.00 N ATOM 741 CA LEU A 46 -7.213 -0.817 -4.501 1.00 0.00 C ATOM 742 C LEU A 46 -6.731 -0.559 -3.074 1.00 0.00 C ATOM 743 O LEU A 46 -7.493 -0.089 -2.252 1.00 0.00 O ATOM 744 CB LEU A 46 -7.532 0.553 -5.094 1.00 0.00 C ATOM 745 CG LEU A 46 -8.311 0.425 -6.391 1.00 0.00 C ATOM 746 CD1 LEU A 46 -8.849 1.802 -6.750 1.00 0.00 C ATOM 747 CD2 LEU A 46 -7.395 -0.069 -7.521 1.00 0.00 C ATOM 0 H LEU A 46 -9.305 -1.217 -4.741 1.00 0.00 H new ATOM 0 HA LEU A 46 -6.461 -1.336 -5.095 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -8.109 1.137 -4.377 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -6.605 1.098 -5.276 1.00 0.00 H new ATOM 0 HG LEU A 46 -9.122 -0.292 -6.265 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -9.414 1.741 -7.680 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -9.501 2.157 -5.952 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -8.018 2.496 -6.876 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -7.969 -0.155 -8.443 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -6.580 0.641 -7.666 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -6.984 -1.044 -7.257 1.00 0.00 H new ATOM 759 N PRO A 47 -5.478 -0.792 -2.767 1.00 0.00 N ATOM 760 CA PRO A 47 -4.970 -0.482 -1.413 1.00 0.00 C ATOM 761 C PRO A 47 -5.300 0.975 -1.085 1.00 0.00 C ATOM 762 O PRO A 47 -4.989 1.868 -1.850 1.00 0.00 O ATOM 763 CB PRO A 47 -3.454 -0.692 -1.509 1.00 0.00 C ATOM 764 CG PRO A 47 -3.228 -1.544 -2.720 1.00 0.00 C ATOM 765 CD PRO A 47 -4.438 -1.363 -3.639 1.00 0.00 C ATOM 0 HA PRO A 47 -5.409 -1.102 -0.632 1.00 0.00 H new ATOM 0 HB2 PRO A 47 -2.934 0.261 -1.601 1.00 0.00 H new ATOM 0 HB3 PRO A 47 -3.071 -1.179 -0.613 1.00 0.00 H new ATOM 0 HG2 PRO A 47 -2.311 -1.250 -3.230 1.00 0.00 H new ATOM 0 HG3 PRO A 47 -3.114 -2.590 -2.437 1.00 0.00 H new ATOM 0 HD2 PRO A 47 -4.209 -0.698 -4.472 1.00 0.00 H new ATOM 0 HD3 PRO A 47 -4.757 -2.313 -4.068 1.00 0.00 H new ATOM 773 N ILE A 48 -5.942 1.231 0.015 1.00 0.00 N ATOM 774 CA ILE A 48 -6.305 2.639 0.343 1.00 0.00 C ATOM 775 C ILE A 48 -5.308 3.221 1.333 1.00 0.00 C ATOM 776 O ILE A 48 -4.824 2.557 2.224 1.00 0.00 O ATOM 777 CB ILE A 48 -7.729 2.676 0.913 1.00 0.00 C ATOM 778 CG1 ILE A 48 -8.705 2.387 -0.243 1.00 0.00 C ATOM 779 CG2 ILE A 48 -8.030 4.048 1.555 1.00 0.00 C ATOM 780 CD1 ILE A 48 -10.158 2.381 0.248 1.00 0.00 C ATOM 0 H ILE A 48 -6.231 0.533 0.700 1.00 0.00 H new ATOM 0 HA ILE A 48 -6.272 3.246 -0.562 1.00 0.00 H new ATOM 0 HB ILE A 48 -7.839 1.926 1.696 1.00 0.00 H new ATOM 0 HG12 ILE A 48 -8.584 3.140 -1.022 1.00 0.00 H new ATOM 0 HG13 ILE A 48 -8.466 1.423 -0.692 1.00 0.00 H new ATOM 0 HG21 ILE A 48 -9.045 4.049 1.952 1.00 0.00 H new ATOM 0 HG22 ILE A 48 -7.324 4.234 2.364 1.00 0.00 H new ATOM 0 HG23 ILE A 48 -7.934 4.831 0.803 1.00 0.00 H new ATOM 0 HD11 ILE A 48 -10.824 2.174 -0.590 1.00 0.00 H new ATOM 0 HD12 ILE A 48 -10.282 1.610 1.009 1.00 0.00 H new ATOM 0 HD13 ILE A 48 -10.402 3.354 0.674 1.00 0.00 H new ATOM 792 N MET A 49 -4.993 4.469 1.157 1.00 0.00 N ATOM 793 CA MET A 49 -4.025 5.144 2.054 1.00 0.00 C ATOM 794 C MET A 49 -4.545 6.543 2.376 1.00 0.00 C ATOM 795 O MET A 49 -4.841 7.324 1.494 1.00 0.00 O ATOM 796 CB MET A 49 -2.677 5.236 1.341 1.00 0.00 C ATOM 797 CG MET A 49 -2.056 3.842 1.257 1.00 0.00 C ATOM 798 SD MET A 49 -0.335 3.975 0.707 1.00 0.00 S ATOM 799 CE MET A 49 0.348 4.656 2.241 1.00 0.00 C ATOM 0 H MET A 49 -5.372 5.059 0.417 1.00 0.00 H new ATOM 0 HA MET A 49 -3.905 4.583 2.981 1.00 0.00 H new ATOM 0 HB2 MET A 49 -2.809 5.649 0.341 1.00 0.00 H new ATOM 0 HB3 MET A 49 -2.012 5.911 1.880 1.00 0.00 H new ATOM 0 HG2 MET A 49 -2.100 3.354 2.231 1.00 0.00 H new ATOM 0 HG3 MET A 49 -2.623 3.221 0.563 1.00 0.00 H new ATOM 0 HE1 MET A 49 1.428 4.507 2.256 1.00 0.00 H new ATOM 0 HE2 MET A 49 0.128 5.722 2.296 1.00 0.00 H new ATOM 0 HE3 MET A 49 -0.100 4.149 3.095 1.00 0.00 H new ATOM 809 N ALA A 50 -4.684 6.856 3.632 1.00 0.00 N ATOM 810 CA ALA A 50 -5.215 8.195 4.000 1.00 0.00 C ATOM 811 C ALA A 50 -6.675 8.269 3.546 1.00 0.00 C ATOM 812 O ALA A 50 -7.136 9.273 3.040 1.00 0.00 O ATOM 813 CB ALA A 50 -4.391 9.280 3.302 1.00 0.00 C ATOM 0 H ALA A 50 -4.454 6.246 4.416 1.00 0.00 H new ATOM 0 HA ALA A 50 -5.152 8.350 5.077 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -4.780 10.262 3.571 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -3.350 9.204 3.615 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -4.456 9.148 2.222 1.00 0.00 H new ATOM 819 N LYS A 51 -7.391 7.195 3.728 1.00 0.00 N ATOM 820 CA LYS A 51 -8.829 7.148 3.325 1.00 0.00 C ATOM 821 C LYS A 51 -8.973 7.465 1.835 1.00 0.00 C ATOM 822 O LYS A 51 -10.021 7.872 1.374 1.00 0.00 O ATOM 823 CB LYS A 51 -9.618 8.165 4.142 1.00 0.00 C ATOM 824 CG LYS A 51 -9.637 7.724 5.602 1.00 0.00 C ATOM 825 CD LYS A 51 -10.467 8.717 6.407 1.00 0.00 C ATOM 826 CE LYS A 51 -10.490 8.295 7.876 1.00 0.00 C ATOM 827 NZ LYS A 51 -11.271 9.291 8.663 1.00 0.00 N ATOM 0 H LYS A 51 -7.038 6.334 4.145 1.00 0.00 H new ATOM 0 HA LYS A 51 -9.217 6.146 3.511 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -9.165 9.152 4.053 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -10.636 8.246 3.760 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -10.059 6.723 5.688 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -8.621 7.676 5.995 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -10.047 9.718 6.312 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -11.483 8.759 6.015 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -10.936 7.306 7.975 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -9.473 8.226 8.262 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -11.288 9.007 9.663 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -10.826 10.227 8.577 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -12.244 9.335 8.299 1.00 0.00 H new ATOM 841 N SER A 52 -7.934 7.271 1.077 1.00 0.00 N ATOM 842 CA SER A 52 -8.009 7.547 -0.388 1.00 0.00 C ATOM 843 C SER A 52 -7.335 6.402 -1.148 1.00 0.00 C ATOM 844 O SER A 52 -6.456 5.740 -0.637 1.00 0.00 O ATOM 845 CB SER A 52 -7.282 8.856 -0.698 1.00 0.00 C ATOM 846 OG SER A 52 -5.899 8.704 -0.406 1.00 0.00 O ATOM 0 H SER A 52 -7.030 6.932 1.407 1.00 0.00 H new ATOM 0 HA SER A 52 -9.052 7.630 -0.693 1.00 0.00 H new ATOM 0 HB2 SER A 52 -7.417 9.121 -1.746 1.00 0.00 H new ATOM 0 HB3 SER A 52 -7.703 9.669 -0.106 1.00 0.00 H new ATOM 0 HG SER A 52 -5.781 7.991 0.256 1.00 0.00 H new ATOM 852 N VAL A 53 -7.730 6.166 -2.368 1.00 0.00 N ATOM 853 CA VAL A 53 -7.094 5.064 -3.142 1.00 0.00 C ATOM 854 C VAL A 53 -5.637 5.426 -3.413 1.00 0.00 C ATOM 855 O VAL A 53 -5.295 6.578 -3.589 1.00 0.00 O ATOM 856 CB VAL A 53 -7.835 4.858 -4.469 1.00 0.00 C ATOM 857 CG1 VAL A 53 -9.295 4.490 -4.191 1.00 0.00 C ATOM 858 CG2 VAL A 53 -7.787 6.149 -5.293 1.00 0.00 C ATOM 0 H VAL A 53 -8.459 6.683 -2.859 1.00 0.00 H new ATOM 0 HA VAL A 53 -7.143 4.139 -2.568 1.00 0.00 H new ATOM 0 HB VAL A 53 -7.355 4.053 -5.025 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -9.820 4.344 -5.135 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -9.334 3.570 -3.608 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -9.773 5.294 -3.631 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -8.314 5.999 -6.235 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -8.263 6.955 -4.735 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -6.749 6.413 -5.496 1.00 0.00 H new ATOM 868 N LEU A 54 -4.769 4.452 -3.428 1.00 0.00 N ATOM 869 CA LEU A 54 -3.331 4.743 -3.662 1.00 0.00 C ATOM 870 C LEU A 54 -3.072 4.932 -5.155 1.00 0.00 C ATOM 871 O LEU A 54 -3.377 4.081 -5.967 1.00 0.00 O ATOM 872 CB LEU A 54 -2.492 3.574 -3.145 1.00 0.00 C ATOM 873 CG LEU A 54 -1.005 3.910 -3.280 1.00 0.00 C ATOM 874 CD1 LEU A 54 -0.669 5.117 -2.397 1.00 0.00 C ATOM 875 CD2 LEU A 54 -0.171 2.702 -2.837 1.00 0.00 C ATOM 0 H LEU A 54 -4.996 3.467 -3.288 1.00 0.00 H new ATOM 0 HA LEU A 54 -3.058 5.657 -3.135 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -2.736 3.371 -2.102 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -2.724 2.670 -3.708 1.00 0.00 H new ATOM 0 HG LEU A 54 -0.778 4.150 -4.319 1.00 0.00 H new ATOM 0 HD11 LEU A 54 0.390 5.355 -2.494 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -1.264 5.975 -2.711 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -0.894 4.881 -1.357 1.00 0.00 H new ATOM 0 HD21 LEU A 54 0.889 2.937 -2.932 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -0.399 2.464 -1.798 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -0.410 1.845 -3.466 1.00 0.00 H new ATOM 887 N ASP A 55 -2.512 6.049 -5.516 1.00 0.00 N ATOM 888 CA ASP A 55 -2.226 6.317 -6.951 1.00 0.00 C ATOM 889 C ASP A 55 -1.206 5.291 -7.455 1.00 0.00 C ATOM 890 O ASP A 55 -0.013 5.513 -7.389 1.00 0.00 O ATOM 891 CB ASP A 55 -1.630 7.719 -7.081 1.00 0.00 C ATOM 892 CG ASP A 55 -2.607 8.745 -6.508 1.00 0.00 C ATOM 893 OD1 ASP A 55 -3.626 8.330 -5.983 1.00 0.00 O ATOM 894 OD2 ASP A 55 -2.313 9.926 -6.591 1.00 0.00 O ATOM 0 H ASP A 55 -2.238 6.794 -4.875 1.00 0.00 H new ATOM 0 HA ASP A 55 -3.143 6.246 -7.536 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -0.679 7.772 -6.551 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -1.424 7.942 -8.128 1.00 0.00 H new ATOM 899 N LEU A 56 -1.653 4.159 -7.936 1.00 0.00 N ATOM 900 CA LEU A 56 -0.687 3.134 -8.405 1.00 0.00 C ATOM 901 C LEU A 56 0.281 3.772 -9.396 1.00 0.00 C ATOM 902 O LEU A 56 1.381 3.298 -9.594 1.00 0.00 O ATOM 903 CB LEU A 56 -1.448 1.996 -9.088 1.00 0.00 C ATOM 904 CG LEU A 56 -2.578 1.521 -8.172 1.00 0.00 C ATOM 905 CD1 LEU A 56 -3.318 0.355 -8.831 1.00 0.00 C ATOM 906 CD2 LEU A 56 -2.001 1.070 -6.825 1.00 0.00 C ATOM 0 H LEU A 56 -2.637 3.906 -8.022 1.00 0.00 H new ATOM 0 HA LEU A 56 -0.129 2.737 -7.557 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -1.855 2.336 -10.040 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -0.771 1.170 -9.307 1.00 0.00 H new ATOM 0 HG LEU A 56 -3.274 2.343 -8.006 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -4.122 0.018 -8.177 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -3.737 0.681 -9.783 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -2.623 -0.466 -9.003 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -2.810 0.733 -6.177 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -1.300 0.251 -6.985 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -1.482 1.905 -6.353 1.00 0.00 H new ATOM 918 N TYR A 57 -0.125 4.829 -10.040 1.00 0.00 N ATOM 919 CA TYR A 57 0.772 5.467 -11.034 1.00 0.00 C ATOM 920 C TYR A 57 1.817 6.364 -10.368 1.00 0.00 C ATOM 921 O TYR A 57 3.002 6.180 -10.561 1.00 0.00 O ATOM 922 CB TYR A 57 -0.057 6.299 -12.004 1.00 0.00 C ATOM 923 CG TYR A 57 0.869 6.992 -12.969 1.00 0.00 C ATOM 924 CD1 TYR A 57 1.727 6.235 -13.763 1.00 0.00 C ATOM 925 CD2 TYR A 57 0.855 8.382 -13.081 1.00 0.00 C ATOM 926 CE1 TYR A 57 2.577 6.851 -14.672 1.00 0.00 C ATOM 927 CE2 TYR A 57 1.711 9.014 -13.991 1.00 0.00 C ATOM 928 CZ TYR A 57 2.576 8.247 -14.790 1.00 0.00 C ATOM 929 OH TYR A 57 3.417 8.867 -15.691 1.00 0.00 O ATOM 0 H TYR A 57 -1.035 5.275 -9.920 1.00 0.00 H new ATOM 0 HA TYR A 57 1.299 4.673 -11.564 1.00 0.00 H new ATOM 0 HB2 TYR A 57 -0.756 5.661 -12.545 1.00 0.00 H new ATOM 0 HB3 TYR A 57 -0.651 7.033 -11.459 1.00 0.00 H new ATOM 0 HD1 TYR A 57 1.731 5.159 -13.671 1.00 0.00 H new ATOM 0 HD2 TYR A 57 0.187 8.969 -12.468 1.00 0.00 H new ATOM 0 HE1 TYR A 57 3.237 6.256 -15.286 1.00 0.00 H new ATOM 0 HE2 TYR A 57 1.707 10.090 -14.079 1.00 0.00 H new ATOM 0 HH TYR A 57 3.288 9.837 -15.645 1.00 0.00 H new ATOM 939 N GLU A 58 1.413 7.349 -9.610 1.00 0.00 N ATOM 940 CA GLU A 58 2.427 8.244 -8.985 1.00 0.00 C ATOM 941 C GLU A 58 3.390 7.410 -8.151 1.00 0.00 C ATOM 942 O GLU A 58 4.578 7.651 -8.137 1.00 0.00 O ATOM 943 CB GLU A 58 1.730 9.265 -8.086 1.00 0.00 C ATOM 944 CG GLU A 58 0.823 10.155 -8.935 1.00 0.00 C ATOM 945 CD GLU A 58 0.149 11.195 -8.038 1.00 0.00 C ATOM 946 OE1 GLU A 58 0.218 11.041 -6.830 1.00 0.00 O ATOM 947 OE2 GLU A 58 -0.425 12.128 -8.576 1.00 0.00 O ATOM 0 H GLU A 58 0.440 7.570 -9.399 1.00 0.00 H new ATOM 0 HA GLU A 58 2.977 8.768 -9.767 1.00 0.00 H new ATOM 0 HB2 GLU A 58 1.144 8.753 -7.322 1.00 0.00 H new ATOM 0 HB3 GLU A 58 2.470 9.873 -7.566 1.00 0.00 H new ATOM 0 HG2 GLU A 58 1.405 10.651 -9.712 1.00 0.00 H new ATOM 0 HG3 GLU A 58 0.069 9.550 -9.439 1.00 0.00 H new ATOM 954 N LEU A 59 2.902 6.412 -7.480 1.00 0.00 N ATOM 955 CA LEU A 59 3.817 5.560 -6.682 1.00 0.00 C ATOM 956 C LEU A 59 4.857 4.970 -7.628 1.00 0.00 C ATOM 957 O LEU A 59 6.048 5.088 -7.424 1.00 0.00 O ATOM 958 CB LEU A 59 3.016 4.437 -6.025 1.00 0.00 C ATOM 959 CG LEU A 59 3.957 3.525 -5.244 1.00 0.00 C ATOM 960 CD1 LEU A 59 4.693 4.340 -4.179 1.00 0.00 C ATOM 961 CD2 LEU A 59 3.140 2.421 -4.572 1.00 0.00 C ATOM 0 H LEU A 59 1.917 6.150 -7.449 1.00 0.00 H new ATOM 0 HA LEU A 59 4.307 6.145 -5.904 1.00 0.00 H new ATOM 0 HB2 LEU A 59 2.263 4.856 -5.358 1.00 0.00 H new ATOM 0 HB3 LEU A 59 2.485 3.863 -6.785 1.00 0.00 H new ATOM 0 HG LEU A 59 4.686 3.081 -5.922 1.00 0.00 H new ATOM 0 HD11 LEU A 59 5.365 3.688 -3.622 1.00 0.00 H new ATOM 0 HD12 LEU A 59 5.270 5.130 -4.660 1.00 0.00 H new ATOM 0 HD13 LEU A 59 3.969 4.784 -3.496 1.00 0.00 H new ATOM 0 HD21 LEU A 59 3.806 1.765 -4.012 1.00 0.00 H new ATOM 0 HD22 LEU A 59 2.415 2.868 -3.892 1.00 0.00 H new ATOM 0 HD23 LEU A 59 2.616 1.842 -5.332 1.00 0.00 H new ATOM 973 N TYR A 60 4.399 4.359 -8.680 1.00 0.00 N ATOM 974 CA TYR A 60 5.326 3.765 -9.679 1.00 0.00 C ATOM 975 C TYR A 60 6.356 4.812 -10.120 1.00 0.00 C ATOM 976 O TYR A 60 7.538 4.679 -9.874 1.00 0.00 O ATOM 977 CB TYR A 60 4.483 3.334 -10.882 1.00 0.00 C ATOM 978 CG TYR A 60 5.285 2.468 -11.814 1.00 0.00 C ATOM 979 CD1 TYR A 60 5.572 1.152 -11.455 1.00 0.00 C ATOM 980 CD2 TYR A 60 5.712 2.970 -13.049 1.00 0.00 C ATOM 981 CE1 TYR A 60 6.288 0.330 -12.327 1.00 0.00 C ATOM 982 CE2 TYR A 60 6.434 2.150 -13.924 1.00 0.00 C ATOM 983 CZ TYR A 60 6.721 0.828 -13.564 1.00 0.00 C ATOM 984 OH TYR A 60 7.429 0.014 -14.426 1.00 0.00 O ATOM 0 H TYR A 60 3.408 4.244 -8.894 1.00 0.00 H new ATOM 0 HA TYR A 60 5.859 2.915 -9.253 1.00 0.00 H new ATOM 0 HB2 TYR A 60 3.603 2.789 -10.539 1.00 0.00 H new ATOM 0 HB3 TYR A 60 4.125 4.215 -11.415 1.00 0.00 H new ATOM 0 HD1 TYR A 60 5.240 0.768 -10.502 1.00 0.00 H new ATOM 0 HD2 TYR A 60 5.485 3.989 -13.326 1.00 0.00 H new ATOM 0 HE1 TYR A 60 6.508 -0.690 -12.049 1.00 0.00 H new ATOM 0 HE2 TYR A 60 6.769 2.537 -14.875 1.00 0.00 H new ATOM 0 HH TYR A 60 7.652 0.514 -15.239 1.00 0.00 H new ATOM 994 N ASN A 61 5.911 5.837 -10.791 1.00 0.00 N ATOM 995 CA ASN A 61 6.847 6.885 -11.294 1.00 0.00 C ATOM 996 C ASN A 61 7.898 7.256 -10.242 1.00 0.00 C ATOM 997 O ASN A 61 9.065 7.385 -10.555 1.00 0.00 O ATOM 998 CB ASN A 61 6.045 8.135 -11.662 1.00 0.00 C ATOM 999 CG ASN A 61 6.970 9.169 -12.304 1.00 0.00 C ATOM 1000 OD1 ASN A 61 8.075 8.852 -12.697 1.00 0.00 O ATOM 1001 ND2 ASN A 61 6.565 10.403 -12.424 1.00 0.00 N ATOM 0 H ASN A 61 4.929 5.996 -11.016 1.00 0.00 H new ATOM 0 HA ASN A 61 7.366 6.487 -12.166 1.00 0.00 H new ATOM 0 HB2 ASN A 61 5.242 7.874 -12.351 1.00 0.00 H new ATOM 0 HB3 ASN A 61 5.577 8.554 -10.771 1.00 0.00 H new ATOM 0 HD21 ASN A 61 7.176 11.101 -12.848 1.00 0.00 H new ATOM 0 HD22 ASN A 61 5.637 10.670 -12.094 1.00 0.00 H new ATOM 1008 N LEU A 62 7.522 7.414 -9.005 1.00 0.00 N ATOM 1009 CA LEU A 62 8.563 7.758 -7.991 1.00 0.00 C ATOM 1010 C LEU A 62 9.417 6.515 -7.775 1.00 0.00 C ATOM 1011 O LEU A 62 10.625 6.590 -7.662 1.00 0.00 O ATOM 1012 CB LEU A 62 7.938 8.231 -6.665 1.00 0.00 C ATOM 1013 CG LEU A 62 7.012 9.446 -6.895 1.00 0.00 C ATOM 1014 CD1 LEU A 62 6.788 10.196 -5.580 1.00 0.00 C ATOM 1015 CD2 LEU A 62 7.622 10.414 -7.916 1.00 0.00 C ATOM 0 H LEU A 62 6.568 7.324 -8.656 1.00 0.00 H new ATOM 0 HA LEU A 62 9.171 8.587 -8.354 1.00 0.00 H new ATOM 0 HB2 LEU A 62 7.371 7.416 -6.215 1.00 0.00 H new ATOM 0 HB3 LEU A 62 8.727 8.498 -5.961 1.00 0.00 H new ATOM 0 HG LEU A 62 6.062 9.072 -7.277 1.00 0.00 H new ATOM 0 HD11 LEU A 62 6.134 11.050 -5.755 1.00 0.00 H new ATOM 0 HD12 LEU A 62 6.325 9.527 -4.854 1.00 0.00 H new ATOM 0 HD13 LEU A 62 7.745 10.545 -5.193 1.00 0.00 H new ATOM 0 HD21 LEU A 62 6.951 11.261 -8.060 1.00 0.00 H new ATOM 0 HD22 LEU A 62 8.584 10.772 -7.549 1.00 0.00 H new ATOM 0 HD23 LEU A 62 7.765 9.898 -8.866 1.00 0.00 H new ATOM 1027 N VAL A 63 8.800 5.370 -7.723 1.00 0.00 N ATOM 1028 CA VAL A 63 9.583 4.122 -7.524 1.00 0.00 C ATOM 1029 C VAL A 63 10.567 3.944 -8.686 1.00 0.00 C ATOM 1030 O VAL A 63 11.729 3.653 -8.477 1.00 0.00 O ATOM 1031 CB VAL A 63 8.639 2.914 -7.446 1.00 0.00 C ATOM 1032 CG1 VAL A 63 9.464 1.636 -7.552 1.00 0.00 C ATOM 1033 CG2 VAL A 63 7.885 2.923 -6.102 1.00 0.00 C ATOM 0 H VAL A 63 7.791 5.244 -7.809 1.00 0.00 H new ATOM 0 HA VAL A 63 10.139 4.193 -6.589 1.00 0.00 H new ATOM 0 HB VAL A 63 7.917 2.963 -8.261 1.00 0.00 H new ATOM 0 HG11 VAL A 63 8.803 0.771 -7.498 1.00 0.00 H new ATOM 0 HG12 VAL A 63 9.998 1.626 -8.502 1.00 0.00 H new ATOM 0 HG13 VAL A 63 10.181 1.597 -6.732 1.00 0.00 H new ATOM 0 HG21 VAL A 63 7.217 2.063 -6.054 1.00 0.00 H new ATOM 0 HG22 VAL A 63 8.602 2.872 -5.282 1.00 0.00 H new ATOM 0 HG23 VAL A 63 7.302 3.840 -6.018 1.00 0.00 H new ATOM 1043 N ILE A 64 10.134 4.134 -9.906 1.00 0.00 N ATOM 1044 CA ILE A 64 11.088 3.988 -11.046 1.00 0.00 C ATOM 1045 C ILE A 64 12.086 5.139 -10.972 1.00 0.00 C ATOM 1046 O ILE A 64 13.281 4.958 -11.097 1.00 0.00 O ATOM 1047 CB ILE A 64 10.347 4.064 -12.386 1.00 0.00 C ATOM 1048 CG1 ILE A 64 9.103 3.185 -12.349 1.00 0.00 C ATOM 1049 CG2 ILE A 64 11.268 3.556 -13.498 1.00 0.00 C ATOM 1050 CD1 ILE A 64 9.481 1.809 -11.823 1.00 0.00 C ATOM 0 H ILE A 64 9.177 4.380 -10.160 1.00 0.00 H new ATOM 0 HA ILE A 64 11.589 3.022 -10.979 1.00 0.00 H new ATOM 0 HB ILE A 64 10.057 5.098 -12.571 1.00 0.00 H new ATOM 0 HG12 ILE A 64 8.343 3.636 -11.711 1.00 0.00 H new ATOM 0 HG13 ILE A 64 8.672 3.101 -13.347 1.00 0.00 H new ATOM 0 HG21 ILE A 64 10.747 3.607 -14.454 1.00 0.00 H new ATOM 0 HG22 ILE A 64 12.164 4.175 -13.539 1.00 0.00 H new ATOM 0 HG23 ILE A 64 11.550 2.523 -13.294 1.00 0.00 H new ATOM 0 HD11 ILE A 64 8.595 1.175 -11.794 1.00 0.00 H new ATOM 0 HD12 ILE A 64 10.227 1.361 -12.479 1.00 0.00 H new ATOM 0 HD13 ILE A 64 9.892 1.904 -10.818 1.00 0.00 H new ATOM 1062 N ALA A 65 11.589 6.326 -10.762 1.00 0.00 N ATOM 1063 CA ALA A 65 12.481 7.513 -10.669 1.00 0.00 C ATOM 1064 C ALA A 65 13.424 7.356 -9.477 1.00 0.00 C ATOM 1065 O ALA A 65 14.307 8.161 -9.265 1.00 0.00 O ATOM 1066 CB ALA A 65 11.637 8.777 -10.487 1.00 0.00 C ATOM 0 H ALA A 65 10.595 6.525 -10.650 1.00 0.00 H new ATOM 0 HA ALA A 65 13.066 7.595 -11.585 1.00 0.00 H new ATOM 0 HB1 ALA A 65 12.292 9.645 -10.419 1.00 0.00 H new ATOM 0 HB2 ALA A 65 10.968 8.893 -11.339 1.00 0.00 H new ATOM 0 HB3 ALA A 65 11.049 8.694 -9.573 1.00 0.00 H new ATOM 1072 N ARG A 66 13.257 6.316 -8.701 1.00 0.00 N ATOM 1073 CA ARG A 66 14.156 6.098 -7.533 1.00 0.00 C ATOM 1074 C ARG A 66 15.188 5.022 -7.896 1.00 0.00 C ATOM 1075 O ARG A 66 15.944 4.559 -7.066 1.00 0.00 O ATOM 1076 CB ARG A 66 13.305 5.658 -6.328 1.00 0.00 C ATOM 1077 CG ARG A 66 13.162 6.816 -5.333 1.00 0.00 C ATOM 1078 CD ARG A 66 12.409 7.979 -5.982 1.00 0.00 C ATOM 1079 NE ARG A 66 12.860 9.252 -5.361 1.00 0.00 N ATOM 1080 CZ ARG A 66 12.597 10.388 -5.945 1.00 0.00 C ATOM 1081 NH1 ARG A 66 11.946 10.403 -7.077 1.00 0.00 N ATOM 1082 NH2 ARG A 66 12.987 11.508 -5.404 1.00 0.00 N ATOM 0 H ARG A 66 12.534 5.608 -8.828 1.00 0.00 H new ATOM 0 HA ARG A 66 14.684 7.016 -7.274 1.00 0.00 H new ATOM 0 HB2 ARG A 66 12.320 5.336 -6.667 1.00 0.00 H new ATOM 0 HB3 ARG A 66 13.770 4.802 -5.838 1.00 0.00 H new ATOM 0 HG2 ARG A 66 12.628 6.478 -4.445 1.00 0.00 H new ATOM 0 HG3 ARG A 66 14.147 7.148 -5.006 1.00 0.00 H new ATOM 0 HD2 ARG A 66 12.596 7.997 -7.056 1.00 0.00 H new ATOM 0 HD3 ARG A 66 11.335 7.854 -5.848 1.00 0.00 H new ATOM 0 HE ARG A 66 13.374 9.237 -4.480 1.00 0.00 H new ATOM 0 HH11 ARG A 66 11.644 9.527 -7.503 1.00 0.00 H new ATOM 0 HH12 ARG A 66 11.740 11.291 -7.535 1.00 0.00 H new ATOM 0 HH21 ARG A 66 13.499 11.497 -4.522 1.00 0.00 H new ATOM 0 HH22 ARG A 66 12.780 12.395 -5.863 1.00 0.00 H new ATOM 1096 N GLY A 67 15.230 4.649 -9.144 1.00 0.00 N ATOM 1097 CA GLY A 67 16.222 3.629 -9.598 1.00 0.00 C ATOM 1098 C GLY A 67 15.737 2.204 -9.295 1.00 0.00 C ATOM 1099 O GLY A 67 16.472 1.254 -9.478 1.00 0.00 O ATOM 0 H GLY A 67 14.617 5.008 -9.876 1.00 0.00 H new ATOM 0 HA2 GLY A 67 16.393 3.737 -10.669 1.00 0.00 H new ATOM 0 HA3 GLY A 67 17.178 3.803 -9.103 1.00 0.00 H new ATOM 1103 N GLY A 68 14.516 2.037 -8.852 1.00 0.00 N ATOM 1104 CA GLY A 68 14.007 0.655 -8.563 1.00 0.00 C ATOM 1105 C GLY A 68 13.537 0.536 -7.111 1.00 0.00 C ATOM 1106 O GLY A 68 14.112 1.108 -6.206 1.00 0.00 O ATOM 0 H GLY A 68 13.851 2.791 -8.678 1.00 0.00 H new ATOM 0 HA2 GLY A 68 13.183 0.419 -9.236 1.00 0.00 H new ATOM 0 HA3 GLY A 68 14.794 -0.074 -8.755 1.00 0.00 H new ATOM 1110 N LEU A 69 12.476 -0.199 -6.896 1.00 0.00 N ATOM 1111 CA LEU A 69 11.925 -0.366 -5.520 1.00 0.00 C ATOM 1112 C LEU A 69 13.019 -0.817 -4.548 1.00 0.00 C ATOM 1113 O LEU A 69 13.084 -0.354 -3.426 1.00 0.00 O ATOM 1114 CB LEU A 69 10.829 -1.437 -5.554 1.00 0.00 C ATOM 1115 CG LEU A 69 10.087 -1.457 -4.210 1.00 0.00 C ATOM 1116 CD1 LEU A 69 9.090 -0.285 -4.127 1.00 0.00 C ATOM 1117 CD2 LEU A 69 9.341 -2.791 -4.057 1.00 0.00 C ATOM 0 H LEU A 69 11.963 -0.696 -7.625 1.00 0.00 H new ATOM 0 HA LEU A 69 11.525 0.590 -5.184 1.00 0.00 H new ATOM 0 HB2 LEU A 69 10.130 -1.230 -6.364 1.00 0.00 H new ATOM 0 HB3 LEU A 69 11.268 -2.415 -5.753 1.00 0.00 H new ATOM 0 HG LEU A 69 10.813 -1.351 -3.403 1.00 0.00 H new ATOM 0 HD11 LEU A 69 8.573 -0.314 -3.168 1.00 0.00 H new ATOM 0 HD12 LEU A 69 9.629 0.658 -4.220 1.00 0.00 H new ATOM 0 HD13 LEU A 69 8.362 -0.368 -4.934 1.00 0.00 H new ATOM 0 HD21 LEU A 69 8.814 -2.806 -3.103 1.00 0.00 H new ATOM 0 HD22 LEU A 69 8.623 -2.902 -4.870 1.00 0.00 H new ATOM 0 HD23 LEU A 69 10.056 -3.613 -4.090 1.00 0.00 H new ATOM 1129 N VAL A 70 13.875 -1.720 -4.949 1.00 0.00 N ATOM 1130 CA VAL A 70 14.939 -2.184 -4.013 1.00 0.00 C ATOM 1131 C VAL A 70 15.759 -0.973 -3.553 1.00 0.00 C ATOM 1132 O VAL A 70 16.097 -0.851 -2.391 1.00 0.00 O ATOM 1133 CB VAL A 70 15.841 -3.222 -4.712 1.00 0.00 C ATOM 1134 CG1 VAL A 70 17.035 -3.603 -3.803 1.00 0.00 C ATOM 1135 CG2 VAL A 70 15.009 -4.479 -5.031 1.00 0.00 C ATOM 0 H VAL A 70 13.884 -2.152 -5.873 1.00 0.00 H new ATOM 0 HA VAL A 70 14.487 -2.661 -3.143 1.00 0.00 H new ATOM 0 HB VAL A 70 16.232 -2.792 -5.634 1.00 0.00 H new ATOM 0 HG11 VAL A 70 17.661 -4.336 -4.312 1.00 0.00 H new ATOM 0 HG12 VAL A 70 17.624 -2.713 -3.584 1.00 0.00 H new ATOM 0 HG13 VAL A 70 16.662 -4.029 -2.872 1.00 0.00 H new ATOM 0 HG21 VAL A 70 15.640 -5.217 -5.525 1.00 0.00 H new ATOM 0 HG22 VAL A 70 14.616 -4.899 -4.106 1.00 0.00 H new ATOM 0 HG23 VAL A 70 14.182 -4.211 -5.688 1.00 0.00 H new ATOM 1145 N ASP A 71 16.075 -0.071 -4.442 1.00 0.00 N ATOM 1146 CA ASP A 71 16.861 1.128 -4.028 1.00 0.00 C ATOM 1147 C ASP A 71 16.091 1.892 -2.947 1.00 0.00 C ATOM 1148 O ASP A 71 16.663 2.401 -2.007 1.00 0.00 O ATOM 1149 CB ASP A 71 17.081 2.042 -5.236 1.00 0.00 C ATOM 1150 CG ASP A 71 18.034 1.366 -6.224 1.00 0.00 C ATOM 1151 OD1 ASP A 71 18.680 0.408 -5.833 1.00 0.00 O ATOM 1152 OD2 ASP A 71 18.104 1.821 -7.354 1.00 0.00 O ATOM 0 H ASP A 71 15.826 -0.111 -5.430 1.00 0.00 H new ATOM 0 HA ASP A 71 17.826 0.809 -3.635 1.00 0.00 H new ATOM 0 HB2 ASP A 71 16.129 2.255 -5.722 1.00 0.00 H new ATOM 0 HB3 ASP A 71 17.494 2.997 -4.912 1.00 0.00 H new ATOM 1157 N VAL A 72 14.796 1.974 -3.078 1.00 0.00 N ATOM 1158 CA VAL A 72 13.981 2.706 -2.064 1.00 0.00 C ATOM 1159 C VAL A 72 14.121 2.043 -0.697 1.00 0.00 C ATOM 1160 O VAL A 72 14.313 2.702 0.298 1.00 0.00 O ATOM 1161 CB VAL A 72 12.512 2.664 -2.480 1.00 0.00 C ATOM 1162 CG1 VAL A 72 11.665 3.485 -1.507 1.00 0.00 C ATOM 1163 CG2 VAL A 72 12.354 3.217 -3.897 1.00 0.00 C ATOM 0 H VAL A 72 14.264 1.565 -3.846 1.00 0.00 H new ATOM 0 HA VAL A 72 14.332 3.736 -2.004 1.00 0.00 H new ATOM 0 HB VAL A 72 12.172 1.629 -2.460 1.00 0.00 H new ATOM 0 HG11 VAL A 72 10.620 3.448 -1.814 1.00 0.00 H new ATOM 0 HG12 VAL A 72 11.763 3.074 -0.502 1.00 0.00 H new ATOM 0 HG13 VAL A 72 12.007 4.520 -1.510 1.00 0.00 H new ATOM 0 HG21 VAL A 72 11.303 3.183 -4.186 1.00 0.00 H new ATOM 0 HG22 VAL A 72 12.706 4.248 -3.926 1.00 0.00 H new ATOM 0 HG23 VAL A 72 12.940 2.614 -4.590 1.00 0.00 H new ATOM 1173 N ILE A 73 14.004 0.748 -0.633 1.00 0.00 N ATOM 1174 CA ILE A 73 14.108 0.070 0.688 1.00 0.00 C ATOM 1175 C ILE A 73 15.513 0.269 1.270 1.00 0.00 C ATOM 1176 O ILE A 73 15.684 0.840 2.329 1.00 0.00 O ATOM 1177 CB ILE A 73 13.851 -1.430 0.510 1.00 0.00 C ATOM 1178 CG1 ILE A 73 12.543 -1.645 -0.253 1.00 0.00 C ATOM 1179 CG2 ILE A 73 13.736 -2.090 1.885 1.00 0.00 C ATOM 1180 CD1 ILE A 73 12.389 -3.133 -0.579 1.00 0.00 C ATOM 0 H ILE A 73 13.842 0.133 -1.431 1.00 0.00 H new ATOM 0 HA ILE A 73 13.370 0.498 1.367 1.00 0.00 H new ATOM 0 HB ILE A 73 14.677 -1.870 -0.049 1.00 0.00 H new ATOM 0 HG12 ILE A 73 11.699 -1.302 0.345 1.00 0.00 H new ATOM 0 HG13 ILE A 73 12.543 -1.057 -1.171 1.00 0.00 H new ATOM 0 HG21 ILE A 73 13.553 -3.157 1.762 1.00 0.00 H new ATOM 0 HG22 ILE A 73 14.663 -1.942 2.438 1.00 0.00 H new ATOM 0 HG23 ILE A 73 12.909 -1.641 2.436 1.00 0.00 H new ATOM 0 HD11 ILE A 73 11.458 -3.292 -1.123 1.00 0.00 H new ATOM 0 HD12 ILE A 73 13.228 -3.460 -1.193 1.00 0.00 H new ATOM 0 HD13 ILE A 73 12.371 -3.708 0.347 1.00 0.00 H new ATOM 1192 N ASN A 74 16.513 -0.210 0.583 1.00 0.00 N ATOM 1193 CA ASN A 74 17.909 -0.075 1.076 1.00 0.00 C ATOM 1194 C ASN A 74 18.278 1.392 1.264 1.00 0.00 C ATOM 1195 O ASN A 74 18.928 1.755 2.224 1.00 0.00 O ATOM 1196 CB ASN A 74 18.867 -0.709 0.065 1.00 0.00 C ATOM 1197 CG ASN A 74 18.596 -2.213 -0.017 1.00 0.00 C ATOM 1198 OD1 ASN A 74 17.974 -2.779 0.860 1.00 0.00 O ATOM 1199 ND2 ASN A 74 19.043 -2.888 -1.041 1.00 0.00 N ATOM 0 H ASN A 74 16.419 -0.695 -0.310 1.00 0.00 H new ATOM 0 HA ASN A 74 17.988 -0.581 2.038 1.00 0.00 H new ATOM 0 HB2 ASN A 74 18.735 -0.250 -0.915 1.00 0.00 H new ATOM 0 HB3 ASN A 74 19.900 -0.530 0.364 1.00 0.00 H new ATOM 0 HD21 ASN A 74 18.870 -3.891 -1.105 1.00 0.00 H new ATOM 0 HD22 ASN A 74 19.565 -2.412 -1.777 1.00 0.00 H new ATOM 1206 N LYS A 75 17.887 2.246 0.354 1.00 0.00 N ATOM 1207 CA LYS A 75 18.246 3.683 0.499 1.00 0.00 C ATOM 1208 C LYS A 75 17.134 4.457 1.216 1.00 0.00 C ATOM 1209 O LYS A 75 17.285 5.622 1.527 1.00 0.00 O ATOM 1210 CB LYS A 75 18.498 4.298 -0.879 1.00 0.00 C ATOM 1211 CG LYS A 75 19.451 3.398 -1.673 1.00 0.00 C ATOM 1212 CD LYS A 75 20.707 3.117 -0.846 1.00 0.00 C ATOM 1213 CE LYS A 75 21.821 2.595 -1.759 1.00 0.00 C ATOM 1214 NZ LYS A 75 21.349 1.376 -2.474 1.00 0.00 N ATOM 0 H LYS A 75 17.340 2.012 -0.474 1.00 0.00 H new ATOM 0 HA LYS A 75 19.153 3.749 1.099 1.00 0.00 H new ATOM 0 HB2 LYS A 75 17.556 4.412 -1.416 1.00 0.00 H new ATOM 0 HB3 LYS A 75 18.926 5.294 -0.772 1.00 0.00 H new ATOM 0 HG2 LYS A 75 18.955 2.461 -1.927 1.00 0.00 H new ATOM 0 HG3 LYS A 75 19.723 3.880 -2.612 1.00 0.00 H new ATOM 0 HD2 LYS A 75 21.033 4.027 -0.342 1.00 0.00 H new ATOM 0 HD3 LYS A 75 20.487 2.384 -0.070 1.00 0.00 H new ATOM 0 HE2 LYS A 75 22.106 3.363 -2.478 1.00 0.00 H new ATOM 0 HE3 LYS A 75 22.709 2.363 -1.171 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 22.166 0.862 -2.860 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 20.835 0.762 -1.811 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 20.716 1.653 -3.251 1.00 0.00 H new ATOM 1228 N LYS A 76 16.013 3.834 1.458 1.00 0.00 N ATOM 1229 CA LYS A 76 14.885 4.547 2.132 1.00 0.00 C ATOM 1230 C LYS A 76 14.485 5.788 1.336 1.00 0.00 C ATOM 1231 O LYS A 76 14.462 6.883 1.863 1.00 0.00 O ATOM 1232 CB LYS A 76 15.266 4.982 3.552 1.00 0.00 C ATOM 1233 CG LYS A 76 15.215 3.791 4.515 1.00 0.00 C ATOM 1234 CD LYS A 76 15.012 4.317 5.939 1.00 0.00 C ATOM 1235 CE LYS A 76 16.232 5.140 6.367 1.00 0.00 C ATOM 1236 NZ LYS A 76 16.457 4.976 7.831 1.00 0.00 N ATOM 0 H LYS A 76 15.827 2.860 1.218 1.00 0.00 H new ATOM 0 HA LYS A 76 14.049 3.849 2.184 1.00 0.00 H new ATOM 0 HB2 LYS A 76 16.268 5.412 3.550 1.00 0.00 H new ATOM 0 HB3 LYS A 76 14.586 5.762 3.894 1.00 0.00 H new ATOM 0 HG2 LYS A 76 14.402 3.119 4.241 1.00 0.00 H new ATOM 0 HG3 LYS A 76 16.139 3.216 4.453 1.00 0.00 H new ATOM 0 HD2 LYS A 76 14.113 4.932 5.985 1.00 0.00 H new ATOM 0 HD3 LYS A 76 14.864 3.484 6.627 1.00 0.00 H new ATOM 0 HE2 LYS A 76 17.114 4.816 5.815 1.00 0.00 H new ATOM 0 HE3 LYS A 76 16.076 6.192 6.128 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 17.285 5.535 8.120 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 15.618 5.306 8.350 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 16.625 3.972 8.046 1.00 0.00 H new ATOM 1250 N LEU A 77 14.134 5.641 0.092 1.00 0.00 N ATOM 1251 CA LEU A 77 13.700 6.839 -0.677 1.00 0.00 C ATOM 1252 C LEU A 77 12.194 6.979 -0.486 1.00 0.00 C ATOM 1253 O LEU A 77 11.533 7.730 -1.173 1.00 0.00 O ATOM 1254 CB LEU A 77 14.035 6.675 -2.163 1.00 0.00 C ATOM 1255 CG LEU A 77 15.563 6.602 -2.336 1.00 0.00 C ATOM 1256 CD1 LEU A 77 15.939 5.881 -3.649 1.00 0.00 C ATOM 1257 CD2 LEU A 77 16.138 8.027 -2.355 1.00 0.00 C ATOM 0 H LEU A 77 14.128 4.759 -0.420 1.00 0.00 H new ATOM 0 HA LEU A 77 14.218 7.729 -0.321 1.00 0.00 H new ATOM 0 HB2 LEU A 77 13.570 5.770 -2.555 1.00 0.00 H new ATOM 0 HB3 LEU A 77 13.633 7.513 -2.733 1.00 0.00 H new ATOM 0 HG LEU A 77 15.980 6.037 -1.502 1.00 0.00 H new ATOM 0 HD11 LEU A 77 17.024 5.844 -3.746 1.00 0.00 H new ATOM 0 HD12 LEU A 77 15.541 4.866 -3.634 1.00 0.00 H new ATOM 0 HD13 LEU A 77 15.518 6.423 -4.495 1.00 0.00 H new ATOM 0 HD21 LEU A 77 17.220 7.981 -2.477 1.00 0.00 H new ATOM 0 HD22 LEU A 77 15.702 8.584 -3.184 1.00 0.00 H new ATOM 0 HD23 LEU A 77 15.900 8.528 -1.417 1.00 0.00 H new ATOM 1269 N TRP A 78 11.649 6.256 0.464 1.00 0.00 N ATOM 1270 CA TRP A 78 10.186 6.341 0.723 1.00 0.00 C ATOM 1271 C TRP A 78 9.831 7.758 1.154 1.00 0.00 C ATOM 1272 O TRP A 78 8.852 8.315 0.709 1.00 0.00 O ATOM 1273 CB TRP A 78 9.784 5.378 1.837 1.00 0.00 C ATOM 1274 CG TRP A 78 9.907 3.970 1.363 1.00 0.00 C ATOM 1275 CD1 TRP A 78 10.794 3.071 1.837 1.00 0.00 C ATOM 1276 CD2 TRP A 78 9.140 3.285 0.335 1.00 0.00 C ATOM 1277 NE1 TRP A 78 10.613 1.871 1.179 1.00 0.00 N ATOM 1278 CE2 TRP A 78 9.605 1.952 0.240 1.00 0.00 C ATOM 1279 CE3 TRP A 78 8.091 3.683 -0.513 1.00 0.00 C ATOM 1280 CZ2 TRP A 78 9.051 1.047 -0.663 1.00 0.00 C ATOM 1281 CZ3 TRP A 78 7.537 2.777 -1.422 1.00 0.00 C ATOM 1282 CH2 TRP A 78 8.013 1.464 -1.498 1.00 0.00 C ATOM 0 H TRP A 78 12.159 5.612 1.069 1.00 0.00 H new ATOM 0 HA TRP A 78 9.655 6.077 -0.192 1.00 0.00 H new ATOM 0 HB2 TRP A 78 10.418 5.533 2.710 1.00 0.00 H new ATOM 0 HB3 TRP A 78 8.759 5.577 2.149 1.00 0.00 H new ATOM 0 HD1 TRP A 78 11.527 3.260 2.607 1.00 0.00 H new ATOM 0 HE1 TRP A 78 11.157 1.028 1.364 1.00 0.00 H new ATOM 0 HE3 TRP A 78 7.712 4.693 -0.462 1.00 0.00 H new ATOM 0 HZ2 TRP A 78 9.421 0.034 -0.716 1.00 0.00 H new ATOM 0 HZ3 TRP A 78 6.734 3.094 -2.071 1.00 0.00 H new ATOM 0 HH2 TRP A 78 7.577 0.772 -2.203 1.00 0.00 H new ATOM 1293 N GLN A 79 10.616 8.363 2.005 1.00 0.00 N ATOM 1294 CA GLN A 79 10.282 9.750 2.425 1.00 0.00 C ATOM 1295 C GLN A 79 10.017 10.581 1.171 1.00 0.00 C ATOM 1296 O GLN A 79 9.119 11.398 1.135 1.00 0.00 O ATOM 1297 CB GLN A 79 11.456 10.339 3.212 1.00 0.00 C ATOM 1298 CG GLN A 79 11.615 9.579 4.532 1.00 0.00 C ATOM 1299 CD GLN A 79 10.435 9.901 5.450 1.00 0.00 C ATOM 1300 OE1 GLN A 79 10.275 11.025 5.883 1.00 0.00 O ATOM 1301 NE2 GLN A 79 9.591 8.956 5.768 1.00 0.00 N ATOM 0 H GLN A 79 11.458 7.964 2.420 1.00 0.00 H new ATOM 0 HA GLN A 79 9.398 9.754 3.062 1.00 0.00 H new ATOM 0 HB2 GLN A 79 12.373 10.269 2.626 1.00 0.00 H new ATOM 0 HB3 GLN A 79 11.283 11.397 3.407 1.00 0.00 H new ATOM 0 HG2 GLN A 79 11.661 8.506 4.343 1.00 0.00 H new ATOM 0 HG3 GLN A 79 12.552 9.858 5.014 1.00 0.00 H new ATOM 0 HE21 GLN A 79 9.723 8.012 5.406 1.00 0.00 H new ATOM 0 HE22 GLN A 79 8.800 9.163 6.378 1.00 0.00 H new ATOM 1310 N GLU A 80 10.770 10.357 0.129 1.00 0.00 N ATOM 1311 CA GLU A 80 10.531 11.111 -1.131 1.00 0.00 C ATOM 1312 C GLU A 80 9.198 10.644 -1.723 1.00 0.00 C ATOM 1313 O GLU A 80 8.412 11.428 -2.216 1.00 0.00 O ATOM 1314 CB GLU A 80 11.662 10.823 -2.123 1.00 0.00 C ATOM 1315 CG GLU A 80 12.989 11.346 -1.561 1.00 0.00 C ATOM 1316 CD GLU A 80 14.114 11.056 -2.557 1.00 0.00 C ATOM 1317 OE1 GLU A 80 13.855 10.364 -3.529 1.00 0.00 O ATOM 1318 OE2 GLU A 80 15.217 11.527 -2.330 1.00 0.00 O ATOM 0 H GLU A 80 11.538 9.686 0.097 1.00 0.00 H new ATOM 0 HA GLU A 80 10.500 12.182 -0.930 1.00 0.00 H new ATOM 0 HB2 GLU A 80 11.732 9.751 -2.308 1.00 0.00 H new ATOM 0 HB3 GLU A 80 11.449 11.299 -3.080 1.00 0.00 H new ATOM 0 HG2 GLU A 80 12.920 12.418 -1.375 1.00 0.00 H new ATOM 0 HG3 GLU A 80 13.204 10.870 -0.604 1.00 0.00 H new ATOM 1325 N ILE A 81 8.939 9.361 -1.665 1.00 0.00 N ATOM 1326 CA ILE A 81 7.657 8.823 -2.206 1.00 0.00 C ATOM 1327 C ILE A 81 6.513 9.219 -1.273 1.00 0.00 C ATOM 1328 O ILE A 81 5.531 9.800 -1.686 1.00 0.00 O ATOM 1329 CB ILE A 81 7.738 7.298 -2.289 1.00 0.00 C ATOM 1330 CG1 ILE A 81 8.959 6.913 -3.130 1.00 0.00 C ATOM 1331 CG2 ILE A 81 6.467 6.747 -2.944 1.00 0.00 C ATOM 1332 CD1 ILE A 81 8.845 5.461 -3.597 1.00 0.00 C ATOM 0 H ILE A 81 9.564 8.662 -1.264 1.00 0.00 H new ATOM 0 HA ILE A 81 7.480 9.232 -3.201 1.00 0.00 H new ATOM 0 HB ILE A 81 7.831 6.878 -1.287 1.00 0.00 H new ATOM 0 HG12 ILE A 81 9.038 7.575 -3.993 1.00 0.00 H new ATOM 0 HG13 ILE A 81 9.869 7.043 -2.544 1.00 0.00 H new ATOM 0 HG21 ILE A 81 6.529 5.660 -3.001 1.00 0.00 H new ATOM 0 HG22 ILE A 81 5.599 7.030 -2.349 1.00 0.00 H new ATOM 0 HG23 ILE A 81 6.368 7.158 -3.949 1.00 0.00 H new ATOM 0 HD11 ILE A 81 9.719 5.201 -4.194 1.00 0.00 H new ATOM 0 HD12 ILE A 81 8.789 4.803 -2.730 1.00 0.00 H new ATOM 0 HD13 ILE A 81 7.945 5.343 -4.201 1.00 0.00 H new ATOM 1344 N ILE A 82 6.631 8.900 -0.014 1.00 0.00 N ATOM 1345 CA ILE A 82 5.549 9.243 0.947 1.00 0.00 C ATOM 1346 C ILE A 82 5.235 10.738 0.840 1.00 0.00 C ATOM 1347 O ILE A 82 4.100 11.129 0.646 1.00 0.00 O ATOM 1348 CB ILE A 82 6.019 8.913 2.369 1.00 0.00 C ATOM 1349 CG1 ILE A 82 6.419 7.437 2.448 1.00 0.00 C ATOM 1350 CG2 ILE A 82 4.881 9.160 3.359 1.00 0.00 C ATOM 1351 CD1 ILE A 82 7.079 7.142 3.804 1.00 0.00 C ATOM 0 H ILE A 82 7.432 8.416 0.390 1.00 0.00 H new ATOM 0 HA ILE A 82 4.651 8.669 0.718 1.00 0.00 H new ATOM 0 HB ILE A 82 6.871 9.547 2.615 1.00 0.00 H new ATOM 0 HG12 ILE A 82 5.540 6.806 2.318 1.00 0.00 H new ATOM 0 HG13 ILE A 82 7.108 7.195 1.639 1.00 0.00 H new ATOM 0 HG21 ILE A 82 5.219 8.924 4.368 1.00 0.00 H new ATOM 0 HG22 ILE A 82 4.579 10.206 3.313 1.00 0.00 H new ATOM 0 HG23 ILE A 82 4.032 8.526 3.103 1.00 0.00 H new ATOM 0 HD11 ILE A 82 7.360 6.090 3.851 1.00 0.00 H new ATOM 0 HD12 ILE A 82 7.969 7.761 3.918 1.00 0.00 H new ATOM 0 HD13 ILE A 82 6.377 7.366 4.607 1.00 0.00 H new ATOM 1363 N LYS A 83 6.229 11.578 0.950 1.00 0.00 N ATOM 1364 CA LYS A 83 5.975 13.044 0.840 1.00 0.00 C ATOM 1365 C LYS A 83 5.593 13.386 -0.604 1.00 0.00 C ATOM 1366 O LYS A 83 4.719 14.194 -0.849 1.00 0.00 O ATOM 1367 CB LYS A 83 7.239 13.817 1.228 1.00 0.00 C ATOM 1368 CG LYS A 83 7.680 13.437 2.646 1.00 0.00 C ATOM 1369 CD LYS A 83 6.657 13.940 3.668 1.00 0.00 C ATOM 1370 CE LYS A 83 7.280 13.922 5.065 1.00 0.00 C ATOM 1371 NZ LYS A 83 6.200 13.897 6.091 1.00 0.00 N ATOM 0 H LYS A 83 7.201 11.315 1.110 1.00 0.00 H new ATOM 0 HA LYS A 83 5.162 13.322 1.511 1.00 0.00 H new ATOM 0 HB2 LYS A 83 8.039 13.599 0.520 1.00 0.00 H new ATOM 0 HB3 LYS A 83 7.049 14.889 1.174 1.00 0.00 H new ATOM 0 HG2 LYS A 83 7.783 12.355 2.725 1.00 0.00 H new ATOM 0 HG3 LYS A 83 8.659 13.867 2.858 1.00 0.00 H new ATOM 0 HD2 LYS A 83 6.339 14.951 3.413 1.00 0.00 H new ATOM 0 HD3 LYS A 83 5.767 13.311 3.647 1.00 0.00 H new ATOM 0 HE2 LYS A 83 7.923 13.049 5.177 1.00 0.00 H new ATOM 0 HE3 LYS A 83 7.909 14.801 5.205 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 6.624 13.885 7.041 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 5.604 14.743 5.989 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 5.617 13.045 5.961 1.00 0.00 H new ATOM 1385 N GLY A 84 6.247 12.782 -1.564 1.00 0.00 N ATOM 1386 CA GLY A 84 5.925 13.081 -2.988 1.00 0.00 C ATOM 1387 C GLY A 84 4.424 12.907 -3.217 1.00 0.00 C ATOM 1388 O GLY A 84 3.818 13.617 -3.994 1.00 0.00 O ATOM 0 H GLY A 84 6.988 12.096 -1.421 1.00 0.00 H new ATOM 0 HA2 GLY A 84 6.226 14.099 -3.234 1.00 0.00 H new ATOM 0 HA3 GLY A 84 6.484 12.416 -3.646 1.00 0.00 H new ATOM 1392 N LEU A 85 3.819 11.979 -2.534 1.00 0.00 N ATOM 1393 CA LEU A 85 2.356 11.765 -2.697 1.00 0.00 C ATOM 1394 C LEU A 85 1.612 12.685 -1.731 1.00 0.00 C ATOM 1395 O LEU A 85 0.404 12.800 -1.769 1.00 0.00 O ATOM 1396 CB LEU A 85 2.027 10.314 -2.362 1.00 0.00 C ATOM 1397 CG LEU A 85 2.832 9.381 -3.270 1.00 0.00 C ATOM 1398 CD1 LEU A 85 2.661 7.938 -2.797 1.00 0.00 C ATOM 1399 CD2 LEU A 85 2.333 9.504 -4.715 1.00 0.00 C ATOM 0 H LEU A 85 4.276 11.357 -1.867 1.00 0.00 H new ATOM 0 HA LEU A 85 2.057 11.984 -3.722 1.00 0.00 H new ATOM 0 HB2 LEU A 85 2.259 10.110 -1.317 1.00 0.00 H new ATOM 0 HB3 LEU A 85 0.960 10.133 -2.492 1.00 0.00 H new ATOM 0 HG LEU A 85 3.885 9.659 -3.227 1.00 0.00 H new ATOM 0 HD11 LEU A 85 3.234 7.273 -3.443 1.00 0.00 H new ATOM 0 HD12 LEU A 85 3.020 7.846 -1.772 1.00 0.00 H new ATOM 0 HD13 LEU A 85 1.607 7.664 -2.838 1.00 0.00 H new ATOM 0 HD21 LEU A 85 2.909 8.838 -5.357 1.00 0.00 H new ATOM 0 HD22 LEU A 85 1.279 9.230 -4.761 1.00 0.00 H new ATOM 0 HD23 LEU A 85 2.455 10.532 -5.056 1.00 0.00 H new ATOM 1411 N HIS A 86 2.335 13.331 -0.859 1.00 0.00 N ATOM 1412 CA HIS A 86 1.698 14.246 0.129 1.00 0.00 C ATOM 1413 C HIS A 86 0.815 13.433 1.073 1.00 0.00 C ATOM 1414 O HIS A 86 -0.254 13.858 1.462 1.00 0.00 O ATOM 1415 CB HIS A 86 0.849 15.293 -0.592 1.00 0.00 C ATOM 1416 CG HIS A 86 1.602 15.824 -1.780 1.00 0.00 C ATOM 1417 ND1 HIS A 86 2.589 16.790 -1.661 1.00 0.00 N ATOM 1418 CD2 HIS A 86 1.521 15.534 -3.120 1.00 0.00 C ATOM 1419 CE1 HIS A 86 3.058 17.046 -2.897 1.00 0.00 C ATOM 1420 NE2 HIS A 86 2.440 16.307 -3.823 1.00 0.00 N ATOM 0 H HIS A 86 3.350 13.263 -0.788 1.00 0.00 H new ATOM 0 HA HIS A 86 2.476 14.755 0.698 1.00 0.00 H new ATOM 0 HB2 HIS A 86 -0.094 14.852 -0.914 1.00 0.00 H new ATOM 0 HB3 HIS A 86 0.603 16.108 0.089 1.00 0.00 H new ATOM 0 HD2 HIS A 86 0.846 14.815 -3.561 1.00 0.00 H new ATOM 0 HE1 HIS A 86 3.838 17.761 -3.113 1.00 0.00 H new ATOM 0 HE2 HIS A 86 2.606 16.309 -4.829 1.00 0.00 H new ATOM 1428 N LEU A 87 1.270 12.276 1.469 1.00 0.00 N ATOM 1429 CA LEU A 87 0.472 11.451 2.416 1.00 0.00 C ATOM 1430 C LEU A 87 0.541 12.093 3.809 1.00 0.00 C ATOM 1431 O LEU A 87 1.586 12.555 4.222 1.00 0.00 O ATOM 1432 CB LEU A 87 1.045 10.033 2.475 1.00 0.00 C ATOM 1433 CG LEU A 87 0.486 9.197 1.319 1.00 0.00 C ATOM 1434 CD1 LEU A 87 1.439 8.039 1.024 1.00 0.00 C ATOM 1435 CD2 LEU A 87 -0.888 8.633 1.701 1.00 0.00 C ATOM 0 H LEU A 87 2.158 11.868 1.178 1.00 0.00 H new ATOM 0 HA LEU A 87 -0.564 11.401 2.081 1.00 0.00 H new ATOM 0 HB2 LEU A 87 2.133 10.068 2.417 1.00 0.00 H new ATOM 0 HB3 LEU A 87 0.791 9.568 3.428 1.00 0.00 H new ATOM 0 HG LEU A 87 0.385 9.828 0.436 1.00 0.00 H new ATOM 0 HD11 LEU A 87 1.043 7.443 0.202 1.00 0.00 H new ATOM 0 HD12 LEU A 87 2.417 8.434 0.748 1.00 0.00 H new ATOM 0 HD13 LEU A 87 1.537 7.414 1.911 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -1.280 8.040 0.875 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -0.790 8.004 2.585 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -1.572 9.454 1.914 1.00 0.00 H new ATOM 1447 N PRO A 88 -0.548 12.120 4.539 1.00 0.00 N ATOM 1448 CA PRO A 88 -0.567 12.716 5.907 1.00 0.00 C ATOM 1449 C PRO A 88 0.275 11.901 6.898 1.00 0.00 C ATOM 1450 O PRO A 88 0.312 10.687 6.844 1.00 0.00 O ATOM 1451 CB PRO A 88 -2.048 12.695 6.306 1.00 0.00 C ATOM 1452 CG PRO A 88 -2.684 11.657 5.443 1.00 0.00 C ATOM 1453 CD PRO A 88 -1.867 11.593 4.154 1.00 0.00 C ATOM 0 HA PRO A 88 -0.138 13.718 5.919 1.00 0.00 H new ATOM 0 HB2 PRO A 88 -2.166 12.452 7.362 1.00 0.00 H new ATOM 0 HB3 PRO A 88 -2.509 13.670 6.150 1.00 0.00 H new ATOM 0 HG2 PRO A 88 -2.691 10.689 5.944 1.00 0.00 H new ATOM 0 HG3 PRO A 88 -3.722 11.914 5.230 1.00 0.00 H new ATOM 0 HD2 PRO A 88 -1.794 10.572 3.778 1.00 0.00 H new ATOM 0 HD3 PRO A 88 -2.321 12.192 3.364 1.00 0.00 H new ATOM 1461 N SER A 89 0.956 12.561 7.797 1.00 0.00 N ATOM 1462 CA SER A 89 1.801 11.829 8.787 1.00 0.00 C ATOM 1463 C SER A 89 0.923 10.910 9.640 1.00 0.00 C ATOM 1464 O SER A 89 1.396 10.251 10.544 1.00 0.00 O ATOM 1465 CB SER A 89 2.516 12.830 9.694 1.00 0.00 C ATOM 1466 OG SER A 89 3.362 13.658 8.905 1.00 0.00 O ATOM 0 H SER A 89 0.964 13.577 7.889 1.00 0.00 H new ATOM 0 HA SER A 89 2.538 11.231 8.252 1.00 0.00 H new ATOM 0 HB2 SER A 89 1.787 13.439 10.228 1.00 0.00 H new ATOM 0 HB3 SER A 89 3.103 12.302 10.446 1.00 0.00 H new ATOM 0 HG SER A 89 3.821 14.302 9.483 1.00 0.00 H new ATOM 1472 N SER A 90 -0.355 10.881 9.380 1.00 0.00 N ATOM 1473 CA SER A 90 -1.253 10.024 10.205 1.00 0.00 C ATOM 1474 C SER A 90 -0.898 8.554 9.976 1.00 0.00 C ATOM 1475 O SER A 90 -1.129 7.716 10.824 1.00 0.00 O ATOM 1476 CB SER A 90 -2.709 10.266 9.808 1.00 0.00 C ATOM 1477 OG SER A 90 -2.951 9.702 8.524 1.00 0.00 O ATOM 0 H SER A 90 -0.814 11.409 8.638 1.00 0.00 H new ATOM 0 HA SER A 90 -1.124 10.273 11.258 1.00 0.00 H new ATOM 0 HB2 SER A 90 -3.377 9.820 10.545 1.00 0.00 H new ATOM 0 HB3 SER A 90 -2.920 11.335 9.793 1.00 0.00 H new ATOM 0 HG SER A 90 -3.885 9.856 8.270 1.00 0.00 H new ATOM 1483 N ILE A 91 -0.310 8.231 8.854 1.00 0.00 N ATOM 1484 CA ILE A 91 0.083 6.814 8.613 1.00 0.00 C ATOM 1485 C ILE A 91 1.567 6.645 8.946 1.00 0.00 C ATOM 1486 O ILE A 91 2.431 7.078 8.208 1.00 0.00 O ATOM 1487 CB ILE A 91 -0.148 6.435 7.148 1.00 0.00 C ATOM 1488 CG1 ILE A 91 -1.644 6.517 6.825 1.00 0.00 C ATOM 1489 CG2 ILE A 91 0.359 5.009 6.908 1.00 0.00 C ATOM 1490 CD1 ILE A 91 -1.863 6.278 5.329 1.00 0.00 C ATOM 0 H ILE A 91 -0.087 8.882 8.101 1.00 0.00 H new ATOM 0 HA ILE A 91 -0.524 6.166 9.245 1.00 0.00 H new ATOM 0 HB ILE A 91 0.394 7.125 6.501 1.00 0.00 H new ATOM 0 HG12 ILE A 91 -2.192 5.775 7.406 1.00 0.00 H new ATOM 0 HG13 ILE A 91 -2.034 7.495 7.108 1.00 0.00 H new ATOM 0 HG21 ILE A 91 0.196 4.736 5.866 1.00 0.00 H new ATOM 0 HG22 ILE A 91 1.424 4.959 7.134 1.00 0.00 H new ATOM 0 HG23 ILE A 91 -0.182 4.317 7.553 1.00 0.00 H new ATOM 0 HD11 ILE A 91 -2.928 6.337 5.103 1.00 0.00 H new ATOM 0 HD12 ILE A 91 -1.328 7.036 4.757 1.00 0.00 H new ATOM 0 HD13 ILE A 91 -1.489 5.290 5.060 1.00 0.00 H new ATOM 1502 N THR A 92 1.874 6.013 10.045 1.00 0.00 N ATOM 1503 CA THR A 92 3.305 5.811 10.409 1.00 0.00 C ATOM 1504 C THR A 92 3.861 4.656 9.581 1.00 0.00 C ATOM 1505 O THR A 92 5.052 4.535 9.371 1.00 0.00 O ATOM 1506 CB THR A 92 3.410 5.472 11.898 1.00 0.00 C ATOM 1507 OG1 THR A 92 2.758 4.234 12.144 1.00 0.00 O ATOM 1508 CG2 THR A 92 2.744 6.575 12.722 1.00 0.00 C ATOM 0 H THR A 92 1.198 5.629 10.705 1.00 0.00 H new ATOM 0 HA THR A 92 3.873 6.719 10.209 1.00 0.00 H new ATOM 0 HB THR A 92 4.459 5.394 12.182 1.00 0.00 H new ATOM 0 HG1 THR A 92 2.825 4.013 13.096 1.00 0.00 H new ATOM 0 HG21 THR A 92 2.819 6.333 13.782 1.00 0.00 H new ATOM 0 HG22 THR A 92 3.244 7.525 12.530 1.00 0.00 H new ATOM 0 HG23 THR A 92 1.694 6.655 12.442 1.00 0.00 H new ATOM 1516 N SER A 93 2.994 3.806 9.110 1.00 0.00 N ATOM 1517 CA SER A 93 3.433 2.646 8.290 1.00 0.00 C ATOM 1518 C SER A 93 3.320 3.006 6.808 1.00 0.00 C ATOM 1519 O SER A 93 3.007 2.174 5.980 1.00 0.00 O ATOM 1520 CB SER A 93 2.532 1.448 8.591 1.00 0.00 C ATOM 1521 OG SER A 93 2.551 1.185 9.988 1.00 0.00 O ATOM 0 H SER A 93 1.987 3.867 9.261 1.00 0.00 H new ATOM 0 HA SER A 93 4.467 2.396 8.528 1.00 0.00 H new ATOM 0 HB2 SER A 93 1.513 1.653 8.262 1.00 0.00 H new ATOM 0 HB3 SER A 93 2.875 0.573 8.040 1.00 0.00 H new ATOM 0 HG SER A 93 1.973 0.418 10.184 1.00 0.00 H new ATOM 1527 N ALA A 94 3.563 4.242 6.463 1.00 0.00 N ATOM 1528 CA ALA A 94 3.456 4.640 5.031 1.00 0.00 C ATOM 1529 C ALA A 94 4.478 3.847 4.221 1.00 0.00 C ATOM 1530 O ALA A 94 4.131 3.031 3.392 1.00 0.00 O ATOM 1531 CB ALA A 94 3.743 6.136 4.890 1.00 0.00 C ATOM 0 H ALA A 94 3.829 4.988 7.106 1.00 0.00 H new ATOM 0 HA ALA A 94 2.450 4.433 4.665 1.00 0.00 H new ATOM 0 HB1 ALA A 94 3.664 6.424 3.842 1.00 0.00 H new ATOM 0 HB2 ALA A 94 3.020 6.702 5.478 1.00 0.00 H new ATOM 0 HB3 ALA A 94 4.750 6.349 5.250 1.00 0.00 H new ATOM 1537 N ALA A 95 5.740 4.080 4.456 1.00 0.00 N ATOM 1538 CA ALA A 95 6.787 3.334 3.695 1.00 0.00 C ATOM 1539 C ALA A 95 6.480 1.832 3.739 1.00 0.00 C ATOM 1540 O ALA A 95 6.417 1.180 2.716 1.00 0.00 O ATOM 1541 CB ALA A 95 8.159 3.586 4.328 1.00 0.00 C ATOM 0 H ALA A 95 6.092 4.751 5.138 1.00 0.00 H new ATOM 0 HA ALA A 95 6.793 3.677 2.660 1.00 0.00 H new ATOM 0 HB1 ALA A 95 8.922 3.041 3.772 1.00 0.00 H new ATOM 0 HB2 ALA A 95 8.382 4.653 4.300 1.00 0.00 H new ATOM 0 HB3 ALA A 95 8.151 3.244 5.363 1.00 0.00 H new ATOM 1547 N LEU A 96 6.289 1.271 4.905 1.00 0.00 N ATOM 1548 CA LEU A 96 5.992 -0.191 4.976 1.00 0.00 C ATOM 1549 C LEU A 96 4.730 -0.483 4.167 1.00 0.00 C ATOM 1550 O LEU A 96 4.679 -1.429 3.409 1.00 0.00 O ATOM 1551 CB LEU A 96 5.763 -0.596 6.439 1.00 0.00 C ATOM 1552 CG LEU A 96 5.460 -2.106 6.548 1.00 0.00 C ATOM 1553 CD1 LEU A 96 6.757 -2.898 6.711 1.00 0.00 C ATOM 1554 CD2 LEU A 96 4.574 -2.357 7.768 1.00 0.00 C ATOM 0 H LEU A 96 6.325 1.755 5.802 1.00 0.00 H new ATOM 0 HA LEU A 96 6.831 -0.757 4.570 1.00 0.00 H new ATOM 0 HB2 LEU A 96 6.646 -0.354 7.031 1.00 0.00 H new ATOM 0 HB3 LEU A 96 4.934 -0.023 6.854 1.00 0.00 H new ATOM 0 HG LEU A 96 4.953 -2.428 5.639 1.00 0.00 H new ATOM 0 HD11 LEU A 96 6.527 -3.961 6.787 1.00 0.00 H new ATOM 0 HD12 LEU A 96 7.399 -2.726 5.847 1.00 0.00 H new ATOM 0 HD13 LEU A 96 7.271 -2.573 7.616 1.00 0.00 H new ATOM 0 HD21 LEU A 96 4.358 -3.422 7.848 1.00 0.00 H new ATOM 0 HD22 LEU A 96 5.091 -2.023 8.668 1.00 0.00 H new ATOM 0 HD23 LEU A 96 3.641 -1.805 7.660 1.00 0.00 H new ATOM 1566 N THR A 97 3.713 0.321 4.305 1.00 0.00 N ATOM 1567 CA THR A 97 2.470 0.076 3.528 1.00 0.00 C ATOM 1568 C THR A 97 2.777 0.170 2.035 1.00 0.00 C ATOM 1569 O THR A 97 2.287 -0.608 1.241 1.00 0.00 O ATOM 1570 CB THR A 97 1.425 1.130 3.910 1.00 0.00 C ATOM 1571 OG1 THR A 97 0.985 0.898 5.240 1.00 0.00 O ATOM 1572 CG2 THR A 97 0.240 1.065 2.948 1.00 0.00 C ATOM 0 H THR A 97 3.690 1.134 4.920 1.00 0.00 H new ATOM 0 HA THR A 97 2.083 -0.918 3.752 1.00 0.00 H new ATOM 0 HB THR A 97 1.873 2.122 3.846 1.00 0.00 H new ATOM 0 HG1 THR A 97 1.726 1.056 5.862 1.00 0.00 H new ATOM 0 HG21 THR A 97 -0.497 1.818 3.228 1.00 0.00 H new ATOM 0 HG22 THR A 97 0.585 1.255 1.932 1.00 0.00 H new ATOM 0 HG23 THR A 97 -0.215 0.076 2.997 1.00 0.00 H new ATOM 1580 N LEU A 98 3.579 1.121 1.647 1.00 0.00 N ATOM 1581 CA LEU A 98 3.914 1.273 0.217 1.00 0.00 C ATOM 1582 C LEU A 98 4.773 0.095 -0.256 1.00 0.00 C ATOM 1583 O LEU A 98 4.536 -0.473 -1.302 1.00 0.00 O ATOM 1584 CB LEU A 98 4.703 2.568 0.055 1.00 0.00 C ATOM 1585 CG LEU A 98 3.800 3.781 0.316 1.00 0.00 C ATOM 1586 CD1 LEU A 98 4.627 4.929 0.898 1.00 0.00 C ATOM 1587 CD2 LEU A 98 3.197 4.253 -1.003 1.00 0.00 C ATOM 0 H LEU A 98 4.017 1.801 2.269 1.00 0.00 H new ATOM 0 HA LEU A 98 3.001 1.297 -0.377 1.00 0.00 H new ATOM 0 HB2 LEU A 98 5.545 2.578 0.748 1.00 0.00 H new ATOM 0 HB3 LEU A 98 5.118 2.625 -0.951 1.00 0.00 H new ATOM 0 HG LEU A 98 3.016 3.493 1.016 1.00 0.00 H new ATOM 0 HD11 LEU A 98 3.980 5.787 1.081 1.00 0.00 H new ATOM 0 HD12 LEU A 98 5.082 4.611 1.836 1.00 0.00 H new ATOM 0 HD13 LEU A 98 5.409 5.208 0.192 1.00 0.00 H new ATOM 0 HD21 LEU A 98 2.555 5.115 -0.822 1.00 0.00 H new ATOM 0 HD22 LEU A 98 3.996 4.534 -1.689 1.00 0.00 H new ATOM 0 HD23 LEU A 98 2.608 3.448 -1.443 1.00 0.00 H new ATOM 1599 N ARG A 99 5.774 -0.273 0.502 1.00 0.00 N ATOM 1600 CA ARG A 99 6.654 -1.408 0.083 1.00 0.00 C ATOM 1601 C ARG A 99 5.864 -2.712 0.038 1.00 0.00 C ATOM 1602 O ARG A 99 5.926 -3.449 -0.924 1.00 0.00 O ATOM 1603 CB ARG A 99 7.802 -1.560 1.088 1.00 0.00 C ATOM 1604 CG ARG A 99 8.769 -2.641 0.596 1.00 0.00 C ATOM 1605 CD ARG A 99 9.800 -2.957 1.682 1.00 0.00 C ATOM 1606 NE ARG A 99 9.128 -3.571 2.859 1.00 0.00 N ATOM 1607 CZ ARG A 99 9.822 -4.274 3.711 1.00 0.00 C ATOM 1608 NH1 ARG A 99 11.089 -4.491 3.493 1.00 0.00 N ATOM 1609 NH2 ARG A 99 9.249 -4.767 4.774 1.00 0.00 N ATOM 0 H ARG A 99 6.021 0.162 1.391 1.00 0.00 H new ATOM 0 HA ARG A 99 7.046 -1.194 -0.911 1.00 0.00 H new ATOM 0 HB2 ARG A 99 8.327 -0.612 1.203 1.00 0.00 H new ATOM 0 HB3 ARG A 99 7.408 -1.828 2.069 1.00 0.00 H new ATOM 0 HG2 ARG A 99 8.216 -3.543 0.335 1.00 0.00 H new ATOM 0 HG3 ARG A 99 9.274 -2.304 -0.309 1.00 0.00 H new ATOM 0 HD2 ARG A 99 10.557 -3.636 1.290 1.00 0.00 H new ATOM 0 HD3 ARG A 99 10.315 -2.045 1.982 1.00 0.00 H new ATOM 0 HE ARG A 99 8.126 -3.442 3.000 1.00 0.00 H new ATOM 0 HH11 ARG A 99 11.535 -4.111 2.658 1.00 0.00 H new ATOM 0 HH12 ARG A 99 11.634 -5.040 4.158 1.00 0.00 H new ATOM 0 HH21 ARG A 99 8.256 -4.603 4.941 1.00 0.00 H new ATOM 0 HH22 ARG A 99 9.794 -5.316 5.439 1.00 0.00 H new ATOM 1623 N THR A 100 5.144 -3.020 1.074 1.00 0.00 N ATOM 1624 CA THR A 100 4.386 -4.296 1.082 1.00 0.00 C ATOM 1625 C THR A 100 3.460 -4.357 -0.136 1.00 0.00 C ATOM 1626 O THR A 100 3.497 -5.293 -0.908 1.00 0.00 O ATOM 1627 CB THR A 100 3.565 -4.383 2.374 1.00 0.00 C ATOM 1628 OG1 THR A 100 4.235 -3.672 3.403 1.00 0.00 O ATOM 1629 CG2 THR A 100 3.415 -5.843 2.796 1.00 0.00 C ATOM 0 H THR A 100 5.047 -2.447 1.912 1.00 0.00 H new ATOM 0 HA THR A 100 5.079 -5.136 1.036 1.00 0.00 H new ATOM 0 HB THR A 100 2.579 -3.951 2.202 1.00 0.00 H new ATOM 0 HG1 THR A 100 3.989 -2.724 3.360 1.00 0.00 H new ATOM 0 HG21 THR A 100 2.831 -5.898 3.715 1.00 0.00 H new ATOM 0 HG22 THR A 100 2.906 -6.399 2.008 1.00 0.00 H new ATOM 0 HG23 THR A 100 4.401 -6.276 2.967 1.00 0.00 H new ATOM 1637 N GLN A 101 2.623 -3.372 -0.312 1.00 0.00 N ATOM 1638 CA GLN A 101 1.691 -3.385 -1.475 1.00 0.00 C ATOM 1639 C GLN A 101 2.465 -3.357 -2.802 1.00 0.00 C ATOM 1640 O GLN A 101 2.134 -4.058 -3.733 1.00 0.00 O ATOM 1641 CB GLN A 101 0.777 -2.161 -1.402 1.00 0.00 C ATOM 1642 CG GLN A 101 0.011 -2.175 -0.078 1.00 0.00 C ATOM 1643 CD GLN A 101 -0.909 -3.395 -0.020 1.00 0.00 C ATOM 1644 OE1 GLN A 101 -1.852 -3.492 -0.777 1.00 0.00 O ATOM 1645 NE2 GLN A 101 -0.673 -4.334 0.853 1.00 0.00 N ATOM 0 H GLN A 101 2.544 -2.559 0.299 1.00 0.00 H new ATOM 0 HA GLN A 101 1.102 -4.301 -1.436 1.00 0.00 H new ATOM 0 HB2 GLN A 101 1.367 -1.248 -1.484 1.00 0.00 H new ATOM 0 HB3 GLN A 101 0.078 -2.165 -2.239 1.00 0.00 H new ATOM 0 HG2 GLN A 101 0.711 -2.197 0.757 1.00 0.00 H new ATOM 0 HG3 GLN A 101 -0.575 -1.262 0.022 1.00 0.00 H new ATOM 0 HE21 GLN A 101 0.120 -4.251 1.489 1.00 0.00 H new ATOM 0 HE22 GLN A 101 -1.281 -5.151 0.900 1.00 0.00 H new ATOM 1654 N TYR A 102 3.490 -2.556 -2.909 1.00 0.00 N ATOM 1655 CA TYR A 102 4.239 -2.507 -4.190 1.00 0.00 C ATOM 1656 C TYR A 102 4.738 -3.905 -4.540 1.00 0.00 C ATOM 1657 O TYR A 102 4.677 -4.337 -5.674 1.00 0.00 O ATOM 1658 CB TYR A 102 5.429 -1.562 -4.052 1.00 0.00 C ATOM 1659 CG TYR A 102 5.875 -1.125 -5.420 1.00 0.00 C ATOM 1660 CD1 TYR A 102 6.495 -2.033 -6.286 1.00 0.00 C ATOM 1661 CD2 TYR A 102 5.658 0.193 -5.823 1.00 0.00 C ATOM 1662 CE1 TYR A 102 6.899 -1.615 -7.561 1.00 0.00 C ATOM 1663 CE2 TYR A 102 6.059 0.612 -7.095 1.00 0.00 C ATOM 1664 CZ TYR A 102 6.679 -0.292 -7.966 1.00 0.00 C ATOM 1665 OH TYR A 102 7.075 0.119 -9.221 1.00 0.00 O ATOM 0 H TYR A 102 3.836 -1.941 -2.172 1.00 0.00 H new ATOM 0 HA TYR A 102 3.581 -2.146 -4.980 1.00 0.00 H new ATOM 0 HB2 TYR A 102 5.152 -0.695 -3.452 1.00 0.00 H new ATOM 0 HB3 TYR A 102 6.247 -2.061 -3.532 1.00 0.00 H new ATOM 0 HD1 TYR A 102 6.662 -3.053 -5.972 1.00 0.00 H new ATOM 0 HD2 TYR A 102 5.180 0.890 -5.151 1.00 0.00 H new ATOM 0 HE1 TYR A 102 7.380 -2.312 -8.231 1.00 0.00 H new ATOM 0 HE2 TYR A 102 5.891 1.633 -7.406 1.00 0.00 H new ATOM 0 HH TYR A 102 6.470 0.820 -9.542 1.00 0.00 H new ATOM 1675 N MET A 103 5.247 -4.607 -3.573 1.00 0.00 N ATOM 1676 CA MET A 103 5.771 -5.970 -3.833 1.00 0.00 C ATOM 1677 C MET A 103 4.713 -6.851 -4.507 1.00 0.00 C ATOM 1678 O MET A 103 4.960 -7.472 -5.519 1.00 0.00 O ATOM 1679 CB MET A 103 6.169 -6.610 -2.502 1.00 0.00 C ATOM 1680 CG MET A 103 7.508 -6.058 -2.031 1.00 0.00 C ATOM 1681 SD MET A 103 8.123 -7.089 -0.680 1.00 0.00 S ATOM 1682 CE MET A 103 9.525 -6.049 -0.218 1.00 0.00 C ATOM 0 H MET A 103 5.323 -4.292 -2.606 1.00 0.00 H new ATOM 0 HA MET A 103 6.631 -5.889 -4.498 1.00 0.00 H new ATOM 0 HB2 MET A 103 5.403 -6.413 -1.752 1.00 0.00 H new ATOM 0 HB3 MET A 103 6.233 -7.692 -2.616 1.00 0.00 H new ATOM 0 HG2 MET A 103 8.223 -6.049 -2.854 1.00 0.00 H new ATOM 0 HG3 MET A 103 7.394 -5.027 -1.697 1.00 0.00 H new ATOM 0 HE1 MET A 103 10.453 -6.531 -0.526 1.00 0.00 H new ATOM 0 HE2 MET A 103 9.438 -5.081 -0.712 1.00 0.00 H new ATOM 0 HE3 MET A 103 9.531 -5.906 0.863 1.00 0.00 H new ATOM 1692 N LYS A 104 3.557 -6.956 -3.926 1.00 0.00 N ATOM 1693 CA LYS A 104 2.517 -7.854 -4.511 1.00 0.00 C ATOM 1694 C LYS A 104 1.913 -7.288 -5.804 1.00 0.00 C ATOM 1695 O LYS A 104 1.867 -7.953 -6.820 1.00 0.00 O ATOM 1696 CB LYS A 104 1.373 -8.031 -3.511 1.00 0.00 C ATOM 1697 CG LYS A 104 1.928 -8.210 -2.098 1.00 0.00 C ATOM 1698 CD LYS A 104 0.777 -8.530 -1.143 1.00 0.00 C ATOM 1699 CE LYS A 104 1.272 -8.464 0.302 1.00 0.00 C ATOM 1700 NZ LYS A 104 2.704 -8.875 0.360 1.00 0.00 N ATOM 0 H LYS A 104 3.282 -6.464 -3.076 1.00 0.00 H new ATOM 0 HA LYS A 104 3.010 -8.800 -4.736 1.00 0.00 H new ATOM 0 HB2 LYS A 104 0.715 -7.163 -3.543 1.00 0.00 H new ATOM 0 HB3 LYS A 104 0.771 -8.898 -3.786 1.00 0.00 H new ATOM 0 HG2 LYS A 104 2.664 -9.014 -2.082 1.00 0.00 H new ATOM 0 HG3 LYS A 104 2.441 -7.303 -1.778 1.00 0.00 H new ATOM 0 HD2 LYS A 104 -0.038 -7.822 -1.291 1.00 0.00 H new ATOM 0 HD3 LYS A 104 0.380 -9.522 -1.356 1.00 0.00 H new ATOM 0 HE2 LYS A 104 1.158 -7.452 0.690 1.00 0.00 H new ATOM 0 HE3 LYS A 104 0.670 -9.117 0.933 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 2.973 -9.059 1.348 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 2.840 -9.739 -0.203 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 3.299 -8.114 -0.025 1.00 0.00 H new ATOM 1714 N TYR A 105 1.363 -6.107 -5.743 1.00 0.00 N ATOM 1715 CA TYR A 105 0.656 -5.534 -6.929 1.00 0.00 C ATOM 1716 C TYR A 105 1.580 -4.853 -7.956 1.00 0.00 C ATOM 1717 O TYR A 105 1.142 -4.573 -9.055 1.00 0.00 O ATOM 1718 CB TYR A 105 -0.363 -4.512 -6.415 1.00 0.00 C ATOM 1719 CG TYR A 105 -1.207 -5.156 -5.337 1.00 0.00 C ATOM 1720 CD1 TYR A 105 -2.290 -5.973 -5.682 1.00 0.00 C ATOM 1721 CD2 TYR A 105 -0.892 -4.947 -3.990 1.00 0.00 C ATOM 1722 CE1 TYR A 105 -3.059 -6.577 -4.677 1.00 0.00 C ATOM 1723 CE2 TYR A 105 -1.655 -5.551 -2.987 1.00 0.00 C ATOM 1724 CZ TYR A 105 -2.741 -6.365 -3.328 1.00 0.00 C ATOM 1725 OH TYR A 105 -3.495 -6.960 -2.337 1.00 0.00 O ATOM 0 H TYR A 105 1.372 -5.508 -4.917 1.00 0.00 H new ATOM 0 HA TYR A 105 0.189 -6.365 -7.458 1.00 0.00 H new ATOM 0 HB2 TYR A 105 0.150 -3.636 -6.018 1.00 0.00 H new ATOM 0 HB3 TYR A 105 -0.996 -4.168 -7.233 1.00 0.00 H new ATOM 0 HD1 TYR A 105 -2.533 -6.138 -6.721 1.00 0.00 H new ATOM 0 HD2 TYR A 105 -0.056 -4.317 -3.724 1.00 0.00 H new ATOM 0 HE1 TYR A 105 -3.896 -7.206 -4.942 1.00 0.00 H new ATOM 0 HE2 TYR A 105 -1.406 -5.390 -1.948 1.00 0.00 H new ATOM 0 HH TYR A 105 -3.138 -6.709 -1.459 1.00 0.00 H new ATOM 1735 N LEU A 106 2.816 -4.541 -7.641 1.00 0.00 N ATOM 1736 CA LEU A 106 3.664 -3.831 -8.667 1.00 0.00 C ATOM 1737 C LEU A 106 5.094 -4.383 -8.745 1.00 0.00 C ATOM 1738 O LEU A 106 5.966 -3.737 -9.286 1.00 0.00 O ATOM 1739 CB LEU A 106 3.717 -2.339 -8.312 1.00 0.00 C ATOM 1740 CG LEU A 106 2.465 -1.626 -8.867 1.00 0.00 C ATOM 1741 CD1 LEU A 106 1.963 -0.591 -7.851 1.00 0.00 C ATOM 1742 CD2 LEU A 106 2.802 -0.906 -10.181 1.00 0.00 C ATOM 0 H LEU A 106 3.268 -4.737 -6.748 1.00 0.00 H new ATOM 0 HA LEU A 106 3.206 -3.992 -9.643 1.00 0.00 H new ATOM 0 HB2 LEU A 106 3.768 -2.215 -7.230 1.00 0.00 H new ATOM 0 HB3 LEU A 106 4.618 -1.888 -8.728 1.00 0.00 H new ATOM 0 HG LEU A 106 1.693 -2.374 -9.049 1.00 0.00 H new ATOM 0 HD11 LEU A 106 1.079 -0.091 -8.248 1.00 0.00 H new ATOM 0 HD12 LEU A 106 1.708 -1.092 -6.917 1.00 0.00 H new ATOM 0 HD13 LEU A 106 2.745 0.146 -7.666 1.00 0.00 H new ATOM 0 HD21 LEU A 106 1.911 -0.407 -10.562 1.00 0.00 H new ATOM 0 HD22 LEU A 106 3.582 -0.167 -10.001 1.00 0.00 H new ATOM 0 HD23 LEU A 106 3.153 -1.632 -10.914 1.00 0.00 H new ATOM 1754 N TYR A 107 5.362 -5.556 -8.248 1.00 0.00 N ATOM 1755 CA TYR A 107 6.760 -6.065 -8.361 1.00 0.00 C ATOM 1756 C TYR A 107 7.077 -6.457 -9.811 1.00 0.00 C ATOM 1757 O TYR A 107 8.196 -6.300 -10.256 1.00 0.00 O ATOM 1758 CB TYR A 107 6.990 -7.273 -7.449 1.00 0.00 C ATOM 1759 CG TYR A 107 8.351 -7.859 -7.743 1.00 0.00 C ATOM 1760 CD1 TYR A 107 9.501 -7.073 -7.581 1.00 0.00 C ATOM 1761 CD2 TYR A 107 8.466 -9.184 -8.181 1.00 0.00 C ATOM 1762 CE1 TYR A 107 10.763 -7.612 -7.855 1.00 0.00 C ATOM 1763 CE2 TYR A 107 9.729 -9.723 -8.455 1.00 0.00 C ATOM 1764 CZ TYR A 107 10.877 -8.937 -8.292 1.00 0.00 C ATOM 1765 OH TYR A 107 12.122 -9.468 -8.562 1.00 0.00 O ATOM 0 H TYR A 107 4.697 -6.172 -7.780 1.00 0.00 H new ATOM 0 HA TYR A 107 7.425 -5.260 -8.048 1.00 0.00 H new ATOM 0 HB2 TYR A 107 6.927 -6.972 -6.403 1.00 0.00 H new ATOM 0 HB3 TYR A 107 6.215 -8.021 -7.613 1.00 0.00 H new ATOM 0 HD1 TYR A 107 9.413 -6.051 -7.244 1.00 0.00 H new ATOM 0 HD2 TYR A 107 7.581 -9.790 -8.307 1.00 0.00 H new ATOM 0 HE1 TYR A 107 11.648 -7.006 -7.729 1.00 0.00 H new ATOM 0 HE2 TYR A 107 9.818 -10.745 -8.792 1.00 0.00 H new ATOM 0 HH TYR A 107 12.778 -8.744 -8.633 1.00 0.00 H new ATOM 1775 N PRO A 108 6.122 -6.980 -10.550 1.00 0.00 N ATOM 1776 CA PRO A 108 6.362 -7.402 -11.952 1.00 0.00 C ATOM 1777 C PRO A 108 6.247 -6.241 -12.951 1.00 0.00 C ATOM 1778 O PRO A 108 7.020 -6.143 -13.877 1.00 0.00 O ATOM 1779 CB PRO A 108 5.294 -8.464 -12.185 1.00 0.00 C ATOM 1780 CG PRO A 108 4.151 -8.089 -11.292 1.00 0.00 C ATOM 1781 CD PRO A 108 4.722 -7.222 -10.156 1.00 0.00 C ATOM 0 HA PRO A 108 7.375 -7.773 -12.105 1.00 0.00 H new ATOM 0 HB2 PRO A 108 4.984 -8.486 -13.230 1.00 0.00 H new ATOM 0 HB3 PRO A 108 5.670 -9.458 -11.943 1.00 0.00 H new ATOM 0 HG2 PRO A 108 3.392 -7.540 -11.850 1.00 0.00 H new ATOM 0 HG3 PRO A 108 3.669 -8.980 -10.890 1.00 0.00 H new ATOM 0 HD2 PRO A 108 4.171 -6.287 -10.053 1.00 0.00 H new ATOM 0 HD3 PRO A 108 4.662 -7.735 -9.196 1.00 0.00 H new ATOM 1789 N TYR A 109 5.311 -5.348 -12.768 1.00 0.00 N ATOM 1790 CA TYR A 109 5.196 -4.199 -13.714 1.00 0.00 C ATOM 1791 C TYR A 109 6.528 -3.437 -13.693 1.00 0.00 C ATOM 1792 O TYR A 109 7.044 -3.028 -14.714 1.00 0.00 O ATOM 1793 CB TYR A 109 4.058 -3.278 -13.251 1.00 0.00 C ATOM 1794 CG TYR A 109 3.619 -2.354 -14.373 1.00 0.00 C ATOM 1795 CD1 TYR A 109 4.471 -1.342 -14.830 1.00 0.00 C ATOM 1796 CD2 TYR A 109 2.348 -2.509 -14.948 1.00 0.00 C ATOM 1797 CE1 TYR A 109 4.053 -0.488 -15.864 1.00 0.00 C ATOM 1798 CE2 TYR A 109 1.930 -1.655 -15.979 1.00 0.00 C ATOM 1799 CZ TYR A 109 2.785 -0.644 -16.436 1.00 0.00 C ATOM 1800 OH TYR A 109 2.378 0.200 -17.451 1.00 0.00 O ATOM 0 H TYR A 109 4.627 -5.363 -12.012 1.00 0.00 H new ATOM 0 HA TYR A 109 4.979 -4.547 -14.724 1.00 0.00 H new ATOM 0 HB2 TYR A 109 3.212 -3.878 -12.917 1.00 0.00 H new ATOM 0 HB3 TYR A 109 4.387 -2.688 -12.396 1.00 0.00 H new ATOM 0 HD1 TYR A 109 5.449 -1.218 -14.388 1.00 0.00 H new ATOM 0 HD2 TYR A 109 1.689 -3.289 -14.595 1.00 0.00 H new ATOM 0 HE1 TYR A 109 4.712 0.291 -16.219 1.00 0.00 H new ATOM 0 HE2 TYR A 109 0.951 -1.777 -16.419 1.00 0.00 H new ATOM 0 HH TYR A 109 1.960 -0.325 -18.165 1.00 0.00 H new ATOM 1810 N GLU A 110 7.091 -3.264 -12.525 1.00 0.00 N ATOM 1811 CA GLU A 110 8.401 -2.551 -12.396 1.00 0.00 C ATOM 1812 C GLU A 110 9.531 -3.428 -12.936 1.00 0.00 C ATOM 1813 O GLU A 110 10.347 -2.993 -13.724 1.00 0.00 O ATOM 1814 CB GLU A 110 8.665 -2.279 -10.909 1.00 0.00 C ATOM 1815 CG GLU A 110 10.002 -1.554 -10.735 1.00 0.00 C ATOM 1816 CD GLU A 110 10.300 -1.390 -9.244 1.00 0.00 C ATOM 1817 OE1 GLU A 110 9.626 -2.025 -8.450 1.00 0.00 O ATOM 1818 OE2 GLU A 110 11.194 -0.629 -8.920 1.00 0.00 O ATOM 0 H GLU A 110 6.695 -3.590 -11.643 1.00 0.00 H new ATOM 0 HA GLU A 110 8.363 -1.620 -12.961 1.00 0.00 H new ATOM 0 HB2 GLU A 110 7.858 -1.675 -10.493 1.00 0.00 H new ATOM 0 HB3 GLU A 110 8.677 -3.218 -10.356 1.00 0.00 H new ATOM 0 HG2 GLU A 110 10.800 -2.119 -11.217 1.00 0.00 H new ATOM 0 HG3 GLU A 110 9.965 -0.578 -11.219 1.00 0.00 H new ATOM 1825 N CYS A 111 9.599 -4.651 -12.491 1.00 0.00 N ATOM 1826 CA CYS A 111 10.693 -5.552 -12.945 1.00 0.00 C ATOM 1827 C CYS A 111 10.448 -6.038 -14.374 1.00 0.00 C ATOM 1828 O CYS A 111 11.353 -6.089 -15.181 1.00 0.00 O ATOM 1829 CB CYS A 111 10.775 -6.761 -12.005 1.00 0.00 C ATOM 1830 SG CYS A 111 12.478 -7.370 -11.951 1.00 0.00 S ATOM 0 H CYS A 111 8.942 -5.066 -11.831 1.00 0.00 H new ATOM 0 HA CYS A 111 11.630 -4.995 -12.927 1.00 0.00 H new ATOM 0 HB2 CYS A 111 10.446 -6.480 -11.004 1.00 0.00 H new ATOM 0 HB3 CYS A 111 10.106 -7.550 -12.350 1.00 0.00 H new ATOM 0 HG CYS A 111 13.086 -6.867 -10.918 1.00 0.00 H new ATOM 1836 N GLU A 112 9.247 -6.427 -14.691 1.00 0.00 N ATOM 1837 CA GLU A 112 8.979 -6.946 -16.060 1.00 0.00 C ATOM 1838 C GLU A 112 9.153 -5.837 -17.100 1.00 0.00 C ATOM 1839 O GLU A 112 9.784 -6.027 -18.121 1.00 0.00 O ATOM 1840 CB GLU A 112 7.539 -7.463 -16.123 1.00 0.00 C ATOM 1841 CG GLU A 112 7.338 -8.242 -17.426 1.00 0.00 C ATOM 1842 CD GLU A 112 8.073 -9.580 -17.341 1.00 0.00 C ATOM 1843 OE1 GLU A 112 8.278 -10.050 -16.235 1.00 0.00 O ATOM 1844 OE2 GLU A 112 8.416 -10.112 -18.383 1.00 0.00 O ATOM 0 H GLU A 112 8.442 -6.409 -14.065 1.00 0.00 H new ATOM 0 HA GLU A 112 9.684 -7.748 -16.277 1.00 0.00 H new ATOM 0 HB2 GLU A 112 7.333 -8.105 -15.267 1.00 0.00 H new ATOM 0 HB3 GLU A 112 6.839 -6.629 -16.072 1.00 0.00 H new ATOM 0 HG2 GLU A 112 6.275 -8.410 -17.601 1.00 0.00 H new ATOM 0 HG3 GLU A 112 7.713 -7.662 -18.270 1.00 0.00 H new ATOM 1851 N LYS A 113 8.588 -4.691 -16.862 1.00 0.00 N ATOM 1852 CA LYS A 113 8.711 -3.585 -17.853 1.00 0.00 C ATOM 1853 C LYS A 113 10.110 -2.959 -17.813 1.00 0.00 C ATOM 1854 O LYS A 113 10.608 -2.492 -18.817 1.00 0.00 O ATOM 1855 CB LYS A 113 7.678 -2.503 -17.535 1.00 0.00 C ATOM 1856 CG LYS A 113 6.278 -3.119 -17.473 1.00 0.00 C ATOM 1857 CD LYS A 113 5.873 -3.632 -18.857 1.00 0.00 C ATOM 1858 CE LYS A 113 4.358 -3.834 -18.898 1.00 0.00 C ATOM 1859 NZ LYS A 113 3.952 -4.275 -20.262 1.00 0.00 N ATOM 0 H LYS A 113 8.047 -4.469 -16.026 1.00 0.00 H new ATOM 0 HA LYS A 113 8.540 -3.998 -18.847 1.00 0.00 H new ATOM 0 HB2 LYS A 113 7.918 -2.028 -16.584 1.00 0.00 H new ATOM 0 HB3 LYS A 113 7.708 -1.724 -18.297 1.00 0.00 H new ATOM 0 HG2 LYS A 113 6.263 -3.938 -16.753 1.00 0.00 H new ATOM 0 HG3 LYS A 113 5.559 -2.376 -17.126 1.00 0.00 H new ATOM 0 HD2 LYS A 113 6.177 -2.920 -19.625 1.00 0.00 H new ATOM 0 HD3 LYS A 113 6.383 -4.571 -19.073 1.00 0.00 H new ATOM 0 HE2 LYS A 113 4.060 -4.578 -18.160 1.00 0.00 H new ATOM 0 HE3 LYS A 113 3.849 -2.906 -18.638 1.00 0.00 H new ATOM 0 HZ1 LYS A 113 2.922 -4.412 -20.290 1.00 0.00 H new ATOM 0 HZ2 LYS A 113 4.224 -3.550 -20.956 1.00 0.00 H new ATOM 0 HZ3 LYS A 113 4.427 -5.171 -20.493 1.00 0.00 H new ATOM 1873 N LYS A 114 10.726 -2.897 -16.658 1.00 0.00 N ATOM 1874 CA LYS A 114 12.065 -2.242 -16.560 1.00 0.00 C ATOM 1875 C LYS A 114 13.142 -3.214 -16.044 1.00 0.00 C ATOM 1876 O LYS A 114 14.307 -3.072 -16.359 1.00 0.00 O ATOM 1877 CB LYS A 114 11.932 -1.064 -15.599 1.00 0.00 C ATOM 1878 CG LYS A 114 13.179 -0.187 -15.669 1.00 0.00 C ATOM 1879 CD LYS A 114 13.161 0.670 -16.940 1.00 0.00 C ATOM 1880 CE LYS A 114 14.105 1.860 -16.757 1.00 0.00 C ATOM 1881 NZ LYS A 114 14.459 2.426 -18.089 1.00 0.00 N ATOM 0 H LYS A 114 10.360 -3.271 -15.782 1.00 0.00 H new ATOM 0 HA LYS A 114 12.378 -1.914 -17.551 1.00 0.00 H new ATOM 0 HB2 LYS A 114 11.050 -0.476 -15.852 1.00 0.00 H new ATOM 0 HB3 LYS A 114 11.791 -1.429 -14.582 1.00 0.00 H new ATOM 0 HG2 LYS A 114 13.229 0.456 -14.790 1.00 0.00 H new ATOM 0 HG3 LYS A 114 14.072 -0.812 -15.657 1.00 0.00 H new ATOM 0 HD2 LYS A 114 13.470 0.074 -17.799 1.00 0.00 H new ATOM 0 HD3 LYS A 114 12.149 1.021 -17.142 1.00 0.00 H new ATOM 0 HE2 LYS A 114 13.629 2.623 -16.141 1.00 0.00 H new ATOM 0 HE3 LYS A 114 15.007 1.544 -16.233 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 15.101 3.235 -17.963 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 14.929 1.697 -18.662 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 13.594 2.742 -18.573 1.00 0.00 H new ATOM 1895 N ASN A 115 12.780 -4.197 -15.264 1.00 0.00 N ATOM 1896 CA ASN A 115 13.814 -5.156 -14.756 1.00 0.00 C ATOM 1897 C ASN A 115 14.908 -4.395 -13.992 1.00 0.00 C ATOM 1898 O ASN A 115 16.084 -4.635 -14.176 1.00 0.00 O ATOM 1899 CB ASN A 115 14.444 -5.892 -15.939 1.00 0.00 C ATOM 1900 CG ASN A 115 15.156 -7.144 -15.431 1.00 0.00 C ATOM 1901 OD1 ASN A 115 15.244 -7.364 -14.238 1.00 0.00 O ATOM 1902 ND2 ASN A 115 15.666 -7.983 -16.287 1.00 0.00 N ATOM 0 H ASN A 115 11.825 -4.380 -14.957 1.00 0.00 H new ATOM 0 HA ASN A 115 13.339 -5.871 -14.084 1.00 0.00 H new ATOM 0 HB2 ASN A 115 13.677 -6.164 -16.663 1.00 0.00 H new ATOM 0 HB3 ASN A 115 15.151 -5.241 -16.453 1.00 0.00 H new ATOM 0 HD21 ASN A 115 16.139 -8.824 -15.957 1.00 0.00 H new ATOM 0 HD22 ASN A 115 15.592 -7.799 -17.288 1.00 0.00 H new ATOM 1909 N LEU A 116 14.530 -3.478 -13.145 1.00 0.00 N ATOM 1910 CA LEU A 116 15.542 -2.693 -12.373 1.00 0.00 C ATOM 1911 C LEU A 116 16.281 -3.575 -11.376 1.00 0.00 C ATOM 1912 O LEU A 116 17.418 -3.313 -11.035 1.00 0.00 O ATOM 1913 CB LEU A 116 14.837 -1.581 -11.607 1.00 0.00 C ATOM 1914 CG LEU A 116 14.223 -0.626 -12.615 1.00 0.00 C ATOM 1915 CD1 LEU A 116 13.239 0.303 -11.907 1.00 0.00 C ATOM 1916 CD2 LEU A 116 15.330 0.207 -13.289 1.00 0.00 C ATOM 0 H LEU A 116 13.558 -3.235 -12.951 1.00 0.00 H new ATOM 0 HA LEU A 116 16.262 -2.281 -13.079 1.00 0.00 H new ATOM 0 HB2 LEU A 116 14.066 -1.996 -10.958 1.00 0.00 H new ATOM 0 HB3 LEU A 116 15.544 -1.054 -10.966 1.00 0.00 H new ATOM 0 HG LEU A 116 13.695 -1.200 -13.376 1.00 0.00 H new ATOM 0 HD11 LEU A 116 12.799 0.988 -12.632 1.00 0.00 H new ATOM 0 HD12 LEU A 116 12.450 -0.289 -11.442 1.00 0.00 H new ATOM 0 HD13 LEU A 116 13.764 0.874 -11.141 1.00 0.00 H new ATOM 0 HD21 LEU A 116 14.883 0.890 -14.011 1.00 0.00 H new ATOM 0 HD22 LEU A 116 15.867 0.779 -12.532 1.00 0.00 H new ATOM 0 HD23 LEU A 116 16.025 -0.458 -13.801 1.00 0.00 H new ATOM 1928 N SER A 117 15.647 -4.589 -10.869 1.00 0.00 N ATOM 1929 CA SER A 117 16.344 -5.430 -9.851 1.00 0.00 C ATOM 1930 C SER A 117 15.809 -6.868 -9.839 1.00 0.00 C ATOM 1931 O SER A 117 15.090 -7.291 -10.721 1.00 0.00 O ATOM 1932 CB SER A 117 16.119 -4.800 -8.476 1.00 0.00 C ATOM 1933 OG SER A 117 16.422 -5.745 -7.463 1.00 0.00 O ATOM 0 H SER A 117 14.696 -4.872 -11.105 1.00 0.00 H new ATOM 0 HA SER A 117 17.405 -5.472 -10.099 1.00 0.00 H new ATOM 0 HB2 SER A 117 16.747 -3.917 -8.363 1.00 0.00 H new ATOM 0 HB3 SER A 117 15.085 -4.470 -8.381 1.00 0.00 H new ATOM 0 HG SER A 117 17.348 -5.622 -7.168 1.00 0.00 H new ATOM 1939 N THR A 118 16.194 -7.625 -8.840 1.00 0.00 N ATOM 1940 CA THR A 118 15.756 -9.054 -8.747 1.00 0.00 C ATOM 1941 C THR A 118 15.112 -9.309 -7.374 1.00 0.00 C ATOM 1942 O THR A 118 15.297 -8.534 -6.457 1.00 0.00 O ATOM 1943 CB THR A 118 16.989 -9.953 -8.895 1.00 0.00 C ATOM 1944 OG1 THR A 118 17.890 -9.688 -7.828 1.00 0.00 O ATOM 1945 CG2 THR A 118 17.677 -9.665 -10.227 1.00 0.00 C ATOM 0 H THR A 118 16.797 -7.312 -8.079 1.00 0.00 H new ATOM 0 HA THR A 118 15.031 -9.270 -9.532 1.00 0.00 H new ATOM 0 HB THR A 118 16.684 -10.999 -8.867 1.00 0.00 H new ATOM 0 HG1 THR A 118 18.680 -10.261 -7.917 1.00 0.00 H new ATOM 0 HG21 THR A 118 18.553 -10.305 -10.330 1.00 0.00 H new ATOM 0 HG22 THR A 118 16.984 -9.864 -11.045 1.00 0.00 H new ATOM 0 HG23 THR A 118 17.985 -8.620 -10.259 1.00 0.00 H new ATOM 1953 N PRO A 119 14.368 -10.390 -7.212 1.00 0.00 N ATOM 1954 CA PRO A 119 13.726 -10.708 -5.902 1.00 0.00 C ATOM 1955 C PRO A 119 14.761 -10.869 -4.779 1.00 0.00 C ATOM 1956 O PRO A 119 14.538 -10.460 -3.657 1.00 0.00 O ATOM 1957 CB PRO A 119 12.988 -12.033 -6.146 1.00 0.00 C ATOM 1958 CG PRO A 119 12.853 -12.150 -7.626 1.00 0.00 C ATOM 1959 CD PRO A 119 14.047 -11.416 -8.227 1.00 0.00 C ATOM 0 HA PRO A 119 13.063 -9.906 -5.578 1.00 0.00 H new ATOM 0 HB2 PRO A 119 13.547 -12.874 -5.736 1.00 0.00 H new ATOM 0 HB3 PRO A 119 12.011 -12.033 -5.662 1.00 0.00 H new ATOM 0 HG2 PRO A 119 12.845 -13.196 -7.934 1.00 0.00 H new ATOM 0 HG3 PRO A 119 11.915 -11.710 -7.966 1.00 0.00 H new ATOM 0 HD2 PRO A 119 14.887 -12.089 -8.397 1.00 0.00 H new ATOM 0 HD3 PRO A 119 13.799 -10.966 -9.188 1.00 0.00 H new ATOM 1967 N ALA A 120 15.894 -11.458 -5.072 1.00 0.00 N ATOM 1968 CA ALA A 120 16.932 -11.635 -4.014 1.00 0.00 C ATOM 1969 C ALA A 120 17.387 -10.267 -3.532 1.00 0.00 C ATOM 1970 O ALA A 120 17.621 -10.063 -2.357 1.00 0.00 O ATOM 1971 CB ALA A 120 18.123 -12.412 -4.580 1.00 0.00 C ATOM 0 H ALA A 120 16.143 -11.821 -5.992 1.00 0.00 H new ATOM 0 HA ALA A 120 16.513 -12.196 -3.178 1.00 0.00 H new ATOM 0 HB1 ALA A 120 18.877 -12.538 -3.803 1.00 0.00 H new ATOM 0 HB2 ALA A 120 17.789 -13.391 -4.924 1.00 0.00 H new ATOM 0 HB3 ALA A 120 18.552 -11.861 -5.417 1.00 0.00 H new ATOM 1977 N GLU A 121 17.478 -9.310 -4.410 1.00 0.00 N ATOM 1978 CA GLU A 121 17.873 -7.963 -3.943 1.00 0.00 C ATOM 1979 C GLU A 121 16.730 -7.459 -3.065 1.00 0.00 C ATOM 1980 O GLU A 121 16.932 -7.010 -1.954 1.00 0.00 O ATOM 1981 CB GLU A 121 18.087 -7.039 -5.145 1.00 0.00 C ATOM 1982 CG GLU A 121 19.302 -7.523 -5.943 1.00 0.00 C ATOM 1983 CD GLU A 121 19.555 -6.586 -7.125 1.00 0.00 C ATOM 1984 OE1 GLU A 121 18.712 -5.743 -7.381 1.00 0.00 O ATOM 1985 OE2 GLU A 121 20.591 -6.727 -7.756 1.00 0.00 O ATOM 0 H GLU A 121 17.299 -9.402 -5.410 1.00 0.00 H new ATOM 0 HA GLU A 121 18.807 -7.988 -3.382 1.00 0.00 H new ATOM 0 HB2 GLU A 121 17.200 -7.035 -5.778 1.00 0.00 H new ATOM 0 HB3 GLU A 121 18.243 -6.014 -4.808 1.00 0.00 H new ATOM 0 HG2 GLU A 121 20.181 -7.556 -5.299 1.00 0.00 H new ATOM 0 HG3 GLU A 121 19.131 -8.538 -6.302 1.00 0.00 H new ATOM 1992 N LEU A 122 15.519 -7.562 -3.552 1.00 0.00 N ATOM 1993 CA LEU A 122 14.331 -7.132 -2.766 1.00 0.00 C ATOM 1994 C LEU A 122 14.281 -7.890 -1.437 1.00 0.00 C ATOM 1995 O LEU A 122 14.297 -7.306 -0.371 1.00 0.00 O ATOM 1996 CB LEU A 122 13.091 -7.478 -3.603 1.00 0.00 C ATOM 1997 CG LEU A 122 11.806 -7.186 -2.825 1.00 0.00 C ATOM 1998 CD1 LEU A 122 11.681 -5.681 -2.578 1.00 0.00 C ATOM 1999 CD2 LEU A 122 10.605 -7.675 -3.642 1.00 0.00 C ATOM 0 H LEU A 122 15.304 -7.933 -4.478 1.00 0.00 H new ATOM 0 HA LEU A 122 14.375 -6.065 -2.549 1.00 0.00 H new ATOM 0 HB2 LEU A 122 13.100 -6.901 -4.528 1.00 0.00 H new ATOM 0 HB3 LEU A 122 13.119 -8.531 -3.884 1.00 0.00 H new ATOM 0 HG LEU A 122 11.834 -7.702 -1.865 1.00 0.00 H new ATOM 0 HD11 LEU A 122 10.765 -5.478 -2.024 1.00 0.00 H new ATOM 0 HD12 LEU A 122 12.538 -5.335 -2.001 1.00 0.00 H new ATOM 0 HD13 LEU A 122 11.651 -5.157 -3.533 1.00 0.00 H new ATOM 0 HD21 LEU A 122 9.685 -7.471 -3.094 1.00 0.00 H new ATOM 0 HD22 LEU A 122 10.580 -7.155 -4.600 1.00 0.00 H new ATOM 0 HD23 LEU A 122 10.694 -8.748 -3.814 1.00 0.00 H new ATOM 2011 N GLN A 123 14.240 -9.191 -1.500 1.00 0.00 N ATOM 2012 CA GLN A 123 14.210 -10.013 -0.255 1.00 0.00 C ATOM 2013 C GLN A 123 15.423 -9.673 0.606 1.00 0.00 C ATOM 2014 O GLN A 123 15.318 -9.476 1.799 1.00 0.00 O ATOM 2015 CB GLN A 123 14.240 -11.496 -0.628 1.00 0.00 C ATOM 2016 CG GLN A 123 12.942 -11.864 -1.345 1.00 0.00 C ATOM 2017 CD GLN A 123 11.813 -11.976 -0.316 1.00 0.00 C ATOM 2018 OE1 GLN A 123 10.878 -11.066 -0.284 1.00 0.00 O flip ATOM 2019 NE2 GLN A 123 11.788 -12.898 0.475 1.00 0.00 N flip ATOM 0 H GLN A 123 14.226 -9.726 -2.368 1.00 0.00 H new ATOM 0 HA GLN A 123 13.300 -9.799 0.305 1.00 0.00 H new ATOM 0 HB2 GLN A 123 15.095 -11.704 -1.271 1.00 0.00 H new ATOM 0 HB3 GLN A 123 14.359 -12.106 0.268 1.00 0.00 H new ATOM 0 HG2 GLN A 123 12.697 -11.107 -2.090 1.00 0.00 H new ATOM 0 HG3 GLN A 123 13.061 -12.808 -1.876 1.00 0.00 H new ATOM 0 HE21 GLN A 123 12.518 -13.610 0.451 1.00 0.00 H new ATOM 0 HE22 GLN A 123 11.037 -12.960 1.163 1.00 0.00 H new ATOM 2028 N ALA A 124 16.581 -9.595 0.017 1.00 0.00 N ATOM 2029 CA ALA A 124 17.779 -9.252 0.831 1.00 0.00 C ATOM 2030 C ALA A 124 17.558 -7.873 1.463 1.00 0.00 C ATOM 2031 O ALA A 124 17.943 -7.618 2.585 1.00 0.00 O ATOM 2032 CB ALA A 124 19.018 -9.218 -0.068 1.00 0.00 C ATOM 0 H ALA A 124 16.750 -9.751 -0.977 1.00 0.00 H new ATOM 0 HA ALA A 124 17.930 -9.999 1.611 1.00 0.00 H new ATOM 0 HB1 ALA A 124 19.894 -8.967 0.530 1.00 0.00 H new ATOM 0 HB2 ALA A 124 19.161 -10.196 -0.528 1.00 0.00 H new ATOM 0 HB3 ALA A 124 18.882 -8.467 -0.846 1.00 0.00 H new ATOM 2038 N ALA A 125 16.923 -6.990 0.740 1.00 0.00 N ATOM 2039 CA ALA A 125 16.649 -5.623 1.276 1.00 0.00 C ATOM 2040 C ALA A 125 15.606 -5.729 2.371 1.00 0.00 C ATOM 2041 O ALA A 125 15.641 -5.023 3.360 1.00 0.00 O ATOM 2042 CB ALA A 125 16.115 -4.734 0.157 1.00 0.00 C ATOM 0 H ALA A 125 16.580 -7.157 -0.206 1.00 0.00 H new ATOM 0 HA ALA A 125 17.567 -5.191 1.674 1.00 0.00 H new ATOM 0 HB1 ALA A 125 15.915 -3.737 0.549 1.00 0.00 H new ATOM 0 HB2 ALA A 125 16.855 -4.669 -0.641 1.00 0.00 H new ATOM 0 HB3 ALA A 125 15.193 -5.160 -0.238 1.00 0.00 H new ATOM 2048 N ILE A 126 14.678 -6.619 2.199 1.00 0.00 N ATOM 2049 CA ILE A 126 13.629 -6.798 3.215 1.00 0.00 C ATOM 2050 C ILE A 126 14.292 -7.190 4.531 1.00 0.00 C ATOM 2051 O ILE A 126 14.078 -6.578 5.558 1.00 0.00 O ATOM 2052 CB ILE A 126 12.704 -7.907 2.738 1.00 0.00 C ATOM 2053 CG1 ILE A 126 11.715 -7.333 1.728 1.00 0.00 C ATOM 2054 CG2 ILE A 126 11.936 -8.507 3.912 1.00 0.00 C ATOM 2055 CD1 ILE A 126 10.893 -8.466 1.110 1.00 0.00 C ATOM 0 H ILE A 126 14.605 -7.234 1.388 1.00 0.00 H new ATOM 0 HA ILE A 126 13.057 -5.882 3.365 1.00 0.00 H new ATOM 0 HB ILE A 126 13.302 -8.691 2.274 1.00 0.00 H new ATOM 0 HG12 ILE A 126 11.055 -6.617 2.218 1.00 0.00 H new ATOM 0 HG13 ILE A 126 12.250 -6.792 0.948 1.00 0.00 H new ATOM 0 HG21 ILE A 126 11.280 -9.299 3.551 1.00 0.00 H new ATOM 0 HG22 ILE A 126 12.640 -8.921 4.634 1.00 0.00 H new ATOM 0 HG23 ILE A 126 11.339 -7.731 4.391 1.00 0.00 H new ATOM 0 HD11 ILE A 126 10.188 -8.052 0.389 1.00 0.00 H new ATOM 0 HD12 ILE A 126 11.559 -9.166 0.605 1.00 0.00 H new ATOM 0 HD13 ILE A 126 10.346 -8.988 1.895 1.00 0.00 H new ATOM 2067 N ASP A 127 15.112 -8.201 4.499 1.00 0.00 N ATOM 2068 CA ASP A 127 15.811 -8.633 5.743 1.00 0.00 C ATOM 2069 C ASP A 127 16.742 -7.514 6.204 1.00 0.00 C ATOM 2070 O ASP A 127 16.897 -7.263 7.383 1.00 0.00 O ATOM 2071 CB ASP A 127 16.632 -9.893 5.458 1.00 0.00 C ATOM 2072 CG ASP A 127 15.695 -11.062 5.151 1.00 0.00 C ATOM 2073 OD1 ASP A 127 14.498 -10.896 5.319 1.00 0.00 O ATOM 2074 OD2 ASP A 127 16.192 -12.103 4.754 1.00 0.00 O ATOM 0 H ASP A 127 15.330 -8.748 3.666 1.00 0.00 H new ATOM 0 HA ASP A 127 15.078 -8.849 6.521 1.00 0.00 H new ATOM 0 HB2 ASP A 127 17.301 -9.720 4.615 1.00 0.00 H new ATOM 0 HB3 ASP A 127 17.258 -10.133 6.317 1.00 0.00 H new ATOM 2079 N GLY A 128 17.370 -6.847 5.278 1.00 0.00 N ATOM 2080 CA GLY A 128 18.304 -5.746 5.640 1.00 0.00 C ATOM 2081 C GLY A 128 17.568 -4.648 6.415 1.00 0.00 C ATOM 2082 O GLY A 128 18.152 -3.962 7.229 1.00 0.00 O ATOM 0 H GLY A 128 17.275 -7.019 4.277 1.00 0.00 H new ATOM 0 HA2 GLY A 128 19.122 -6.139 6.244 1.00 0.00 H new ATOM 0 HA3 GLY A 128 18.748 -5.326 4.737 1.00 0.00 H new ATOM 2086 N ASN A 129 16.299 -4.453 6.160 1.00 0.00 N ATOM 2087 CA ASN A 129 15.564 -3.370 6.888 1.00 0.00 C ATOM 2088 C ASN A 129 14.844 -3.930 8.123 1.00 0.00 C ATOM 2089 O ASN A 129 14.704 -3.252 9.121 1.00 0.00 O ATOM 2090 CB ASN A 129 14.546 -2.721 5.947 1.00 0.00 C ATOM 2091 CG ASN A 129 13.378 -3.674 5.697 1.00 0.00 C ATOM 2092 OD1 ASN A 129 13.090 -3.999 4.568 1.00 0.00 O ATOM 2093 ND2 ASN A 129 12.681 -4.126 6.703 1.00 0.00 N ATOM 0 H ASN A 129 15.745 -4.987 5.490 1.00 0.00 H new ATOM 0 HA ASN A 129 16.286 -2.625 7.221 1.00 0.00 H new ATOM 0 HB2 ASN A 129 14.180 -1.791 6.381 1.00 0.00 H new ATOM 0 HB3 ASN A 129 15.025 -2.465 5.002 1.00 0.00 H new ATOM 0 HD21 ASN A 129 11.894 -4.753 6.537 1.00 0.00 H new ATOM 0 HD22 ASN A 129 12.923 -3.852 7.655 1.00 0.00 H new ATOM 2100 N ARG A 130 14.379 -5.150 8.073 1.00 0.00 N ATOM 2101 CA ARG A 130 13.666 -5.713 9.259 1.00 0.00 C ATOM 2102 C ARG A 130 14.619 -5.749 10.453 1.00 0.00 C ATOM 2103 O ARG A 130 15.801 -5.993 10.314 1.00 0.00 O ATOM 2104 CB ARG A 130 13.185 -7.130 8.949 1.00 0.00 C ATOM 2105 CG ARG A 130 12.023 -7.064 7.947 1.00 0.00 C ATOM 2106 CD ARG A 130 11.521 -8.480 7.603 1.00 0.00 C ATOM 2107 NE ARG A 130 10.050 -8.611 7.888 1.00 0.00 N ATOM 2108 CZ ARG A 130 9.530 -8.252 9.034 1.00 0.00 C ATOM 2109 NH1 ARG A 130 10.287 -7.839 10.007 1.00 0.00 N ATOM 2110 NH2 ARG A 130 8.240 -8.335 9.208 1.00 0.00 N ATOM 0 H ARG A 130 14.460 -5.776 7.272 1.00 0.00 H new ATOM 0 HA ARG A 130 12.806 -5.085 9.494 1.00 0.00 H new ATOM 0 HB2 ARG A 130 14.002 -7.722 8.537 1.00 0.00 H new ATOM 0 HB3 ARG A 130 12.863 -7.626 9.865 1.00 0.00 H new ATOM 0 HG2 ARG A 130 11.207 -6.475 8.366 1.00 0.00 H new ATOM 0 HG3 ARG A 130 12.348 -6.557 7.038 1.00 0.00 H new ATOM 0 HD2 ARG A 130 11.712 -8.693 6.551 1.00 0.00 H new ATOM 0 HD3 ARG A 130 12.075 -9.218 8.183 1.00 0.00 H new ATOM 0 HE ARG A 130 9.439 -8.992 7.166 1.00 0.00 H new ATOM 0 HH11 ARG A 130 11.298 -7.792 9.882 1.00 0.00 H new ATOM 0 HH12 ARG A 130 9.870 -7.562 10.896 1.00 0.00 H new ATOM 0 HH21 ARG A 130 7.645 -8.678 8.454 1.00 0.00 H new ATOM 0 HH22 ARG A 130 7.827 -8.057 10.098 1.00 0.00 H new