USER MOD reduce.3.24.130724 H: found=0, std=0, add=1044, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1026 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 136 HIS : no HD1:sc= -4.92! C(o=-8.2!,f=-16!) USER MOD Set 1.2: A 140 TYR OH : rot -72:sc= -3.28! USER MOD Set 2.1: A 120 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: A 121 HIS :FLIP no HD1:sc= 0.139 F(o=-1.3,f=0.14) USER MOD Set 3.1: A 116 GLN :FLIP amide:sc= 0.089 F(o=-1.1,f=-0.56) USER MOD Set 3.2: A 119 ASN : amide:sc= -0.648 K(o=-0.56,f=-3.3) USER MOD Set 4.1: A 45 SER OG : rot 86:sc= 0.932 USER MOD Set 4.2: A 48 HIS :FLIP no HD1:sc= -0.227 F(o=-2.6,f=0.057) USER MOD Set 4.3: A 56 MET CE :methyl -177:sc= -0.649 (180deg=-0.471) USER MOD Single : A 15 GLN : amide:sc= -0.041 K(o=-0.041,f=-1.7!) USER MOD Single : A 18 GLN : amide:sc= -2.31! C(o=-2.3!,f=-2.1!) USER MOD Single : A 22 ASN : amide:sc= -0.555 X(o=-0.56,f=-0.93) USER MOD Single : A 23 THR OG1 : rot 73:sc= 1.02 USER MOD Single : A 24 TYR OH : rot 180:sc= 0 USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 27 ASN :FLIP amide:sc= 1.16 F(o=-0.32,f=1.2) USER MOD Single : A 33 ASN : amide:sc= -2.32! C(o=-2.3!,f=-2.2!) USER MOD Single : A 35 THR OG1 : rot 30:sc= -1.84! USER MOD Single : A 46 GLN : amide:sc=-0.00382 K(o=-0.0038,f=-0.62) USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 GLN : amide:sc= -0.0815 X(o=-0.081,f=-0.3) USER MOD Single : A 58 GLN : amide:sc= -0.32 K(o=-0.32,f=-2.8!) USER MOD Single : A 62 THR OG1 : rot -7:sc= -0.798 USER MOD Single : A 63 LYS NZ :NH3+ 161:sc= 0.164 (180deg=-0.0963) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 LYS NZ :NH3+ 152:sc= 0 (180deg=-0.367) USER MOD Single : A 80 CYS SG : rot 49:sc= -1.61! USER MOD Single : A 83 ASN : amide:sc= -0.497 K(o=-0.5,f=-1.5) USER MOD Single : A 85 TYR OH : rot 180:sc= 0 USER MOD Single : A 86 THR OG1 : rot 99:sc= 0.962 USER MOD Single : A 87 SER OG : rot 85:sc= 0.329 USER MOD Single : A 92 THR OG1 : rot 139:sc= 0.00263 USER MOD Single : A 96 THR OG1 : rot 180:sc= 0 USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 HIS :FLIP no HD1:sc= -1.43! C(o=-3.5!,f=-1.4!) USER MOD Single : A 101 ASN :FLIP amide:sc= -1.33 F(o=-2.7!,f=-1.3) USER MOD Single : A 106 THR OG1 : rot 84:sc= -0.107 USER MOD Single : A 107 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 110 GLN :FLIP amide:sc= -0.0657 F(o=-0.65,f=-0.066) USER MOD Single : A 111 GLN : amide:sc= -0.133 X(o=-0.13,f=-0.18) USER MOD Single : A 122 TYR OH : rot -114:sc= 0.335 USER MOD Single : A 124 LYS NZ :NH3+ -168:sc= 0 (180deg=-0.12) USER MOD Single : A 125 SER OG : rot -76:sc= 1.35 USER MOD Single : A 128 MET CE :methyl -175:sc= -0.353 (180deg=-0.455) USER MOD Single : A 129 THR OG1 : rot -58:sc= 0.892 USER MOD Single : A 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 134 GLN : amide:sc= -0.478 X(o=-0.48,f=-0.017) USER MOD Single : A 141 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 142 GLN : amide:sc= -0.0168 X(o=-0.017,f=-0.021) USER MOD ----------------------------------------------------------------- ATOM 177 N ARG A 9 -0.542 5.443 -9.334 1.00 0.00 N ATOM 178 CA ARG A 9 -0.866 6.318 -8.221 1.00 0.00 C ATOM 179 C ARG A 9 -2.379 6.345 -7.990 1.00 0.00 C ATOM 180 O ARG A 9 -2.835 6.427 -6.851 1.00 0.00 O ATOM 181 CB ARG A 9 -0.371 7.743 -8.478 1.00 0.00 C ATOM 182 CG ARG A 9 -0.960 8.721 -7.459 1.00 0.00 C ATOM 183 CD ARG A 9 -0.038 9.925 -7.257 1.00 0.00 C ATOM 184 NE ARG A 9 1.109 9.547 -6.402 1.00 0.00 N ATOM 185 CZ ARG A 9 2.313 9.162 -6.876 1.00 0.00 C ATOM 186 NH1 ARG A 9 2.538 9.102 -8.206 1.00 0.00 N ATOM 187 NH2 ARG A 9 3.267 8.846 -6.020 1.00 0.00 N ATOM 0 HA ARG A 9 -0.366 5.926 -7.335 1.00 0.00 H new ATOM 0 HB2 ARG A 9 0.717 7.769 -8.425 1.00 0.00 H new ATOM 0 HB3 ARG A 9 -0.648 8.052 -9.486 1.00 0.00 H new ATOM 0 HG2 ARG A 9 -1.938 9.061 -7.799 1.00 0.00 H new ATOM 0 HG3 ARG A 9 -1.113 8.212 -6.507 1.00 0.00 H new ATOM 0 HD2 ARG A 9 0.320 10.285 -8.222 1.00 0.00 H new ATOM 0 HD3 ARG A 9 -0.591 10.744 -6.797 1.00 0.00 H new ATOM 0 HE ARG A 9 0.982 9.579 -5.390 1.00 0.00 H new ATOM 0 HH11 ARG A 9 1.796 9.349 -8.860 1.00 0.00 H new ATOM 0 HH12 ARG A 9 3.450 8.810 -8.556 1.00 0.00 H new ATOM 0 HH21 ARG A 9 3.089 8.895 -5.017 1.00 0.00 H new ATOM 0 HH22 ARG A 9 4.182 8.553 -6.362 1.00 0.00 H new ATOM 199 N ILE A 10 -3.114 6.275 -9.090 1.00 0.00 N ATOM 200 CA ILE A 10 -4.565 6.291 -9.022 1.00 0.00 C ATOM 201 C ILE A 10 -5.045 5.100 -8.189 1.00 0.00 C ATOM 202 O ILE A 10 -5.951 5.237 -7.368 1.00 0.00 O ATOM 203 CB ILE A 10 -5.167 6.341 -10.427 1.00 0.00 C ATOM 204 CG1 ILE A 10 -4.940 7.709 -11.072 1.00 0.00 C ATOM 205 CG2 ILE A 10 -6.648 5.956 -10.404 1.00 0.00 C ATOM 206 CD1 ILE A 10 -4.995 7.612 -12.598 1.00 0.00 C ATOM 0 H ILE A 10 -2.732 6.207 -10.033 1.00 0.00 H new ATOM 0 HA ILE A 10 -4.913 7.193 -8.519 1.00 0.00 H new ATOM 0 HB ILE A 10 -4.653 5.605 -11.045 1.00 0.00 H new ATOM 0 HG12 ILE A 10 -5.697 8.410 -10.721 1.00 0.00 H new ATOM 0 HG13 ILE A 10 -3.972 8.104 -10.764 1.00 0.00 H new ATOM 0 HG21 ILE A 10 -7.051 6.000 -11.416 1.00 0.00 H new ATOM 0 HG22 ILE A 10 -6.755 4.944 -10.014 1.00 0.00 H new ATOM 0 HG23 ILE A 10 -7.194 6.650 -9.765 1.00 0.00 H new ATOM 0 HD11 ILE A 10 -4.831 8.598 -13.031 1.00 0.00 H new ATOM 0 HD12 ILE A 10 -4.221 6.929 -12.947 1.00 0.00 H new ATOM 0 HD13 ILE A 10 -5.973 7.240 -12.904 1.00 0.00 H new ATOM 218 N LEU A 11 -4.417 3.959 -8.430 1.00 0.00 N ATOM 219 CA LEU A 11 -4.768 2.745 -7.712 1.00 0.00 C ATOM 220 C LEU A 11 -4.705 3.011 -6.207 1.00 0.00 C ATOM 221 O LEU A 11 -5.475 2.437 -5.439 1.00 0.00 O ATOM 222 CB LEU A 11 -3.888 1.579 -8.168 1.00 0.00 C ATOM 223 CG LEU A 11 -3.759 1.388 -9.681 1.00 0.00 C ATOM 224 CD1 LEU A 11 -3.290 -0.029 -10.016 1.00 0.00 C ATOM 225 CD2 LEU A 11 -5.066 1.743 -10.392 1.00 0.00 C ATOM 0 H LEU A 11 -3.667 3.849 -9.112 1.00 0.00 H new ATOM 0 HA LEU A 11 -5.792 2.450 -7.941 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -2.890 1.719 -7.753 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -4.286 0.660 -7.738 1.00 0.00 H new ATOM 0 HG LEU A 11 -2.997 2.075 -10.049 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -3.206 -0.139 -11.097 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -2.318 -0.209 -9.557 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -4.011 -0.751 -9.633 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -4.947 1.599 -11.466 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -5.866 1.099 -10.026 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -5.318 2.784 -10.192 1.00 0.00 H new ATOM 237 N LEU A 12 -3.780 3.882 -5.830 1.00 0.00 N ATOM 238 CA LEU A 12 -3.606 4.231 -4.431 1.00 0.00 C ATOM 239 C LEU A 12 -4.771 5.115 -3.982 1.00 0.00 C ATOM 240 O LEU A 12 -5.370 4.874 -2.934 1.00 0.00 O ATOM 241 CB LEU A 12 -2.231 4.863 -4.203 1.00 0.00 C ATOM 242 CG LEU A 12 -2.217 6.378 -3.986 1.00 0.00 C ATOM 243 CD1 LEU A 12 -2.736 6.737 -2.593 1.00 0.00 C ATOM 244 CD2 LEU A 12 -0.825 6.956 -4.246 1.00 0.00 C ATOM 0 H LEU A 12 -3.143 4.356 -6.470 1.00 0.00 H new ATOM 0 HA LEU A 12 -3.626 3.336 -3.810 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -1.774 4.387 -3.335 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -1.600 4.633 -5.062 1.00 0.00 H new ATOM 0 HG LEU A 12 -2.894 6.833 -4.709 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -2.716 7.819 -2.465 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -3.759 6.378 -2.482 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -2.104 6.270 -1.838 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -0.843 8.034 -4.085 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -0.108 6.499 -3.564 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -0.531 6.748 -5.275 1.00 0.00 H new ATOM 256 N PHE A 13 -5.059 6.119 -4.797 1.00 0.00 N ATOM 257 CA PHE A 13 -6.142 7.040 -4.496 1.00 0.00 C ATOM 258 C PHE A 13 -7.490 6.317 -4.492 1.00 0.00 C ATOM 259 O PHE A 13 -8.354 6.612 -3.667 1.00 0.00 O ATOM 260 CB PHE A 13 -6.148 8.099 -5.601 1.00 0.00 C ATOM 261 CG PHE A 13 -5.045 9.150 -5.461 1.00 0.00 C ATOM 262 CD1 PHE A 13 -4.775 9.695 -4.245 1.00 0.00 C ATOM 263 CD2 PHE A 13 -4.334 9.539 -6.554 1.00 0.00 C ATOM 264 CE1 PHE A 13 -3.751 10.670 -4.116 1.00 0.00 C ATOM 265 CE2 PHE A 13 -3.311 10.514 -6.424 1.00 0.00 C ATOM 266 CZ PHE A 13 -3.041 11.059 -5.208 1.00 0.00 C ATOM 0 H PHE A 13 -4.561 6.315 -5.665 1.00 0.00 H new ATOM 0 HA PHE A 13 -5.993 7.481 -3.510 1.00 0.00 H new ATOM 0 HB2 PHE A 13 -6.043 7.603 -6.566 1.00 0.00 H new ATOM 0 HB3 PHE A 13 -7.116 8.601 -5.604 1.00 0.00 H new ATOM 0 HD1 PHE A 13 -5.339 9.386 -3.377 1.00 0.00 H new ATOM 0 HD2 PHE A 13 -4.548 9.106 -7.520 1.00 0.00 H new ATOM 0 HE1 PHE A 13 -3.536 11.103 -3.150 1.00 0.00 H new ATOM 0 HE2 PHE A 13 -2.747 10.823 -7.291 1.00 0.00 H new ATOM 0 HZ PHE A 13 -2.262 11.801 -5.110 1.00 0.00 H new ATOM 276 N GLU A 14 -7.629 5.384 -5.422 1.00 0.00 N ATOM 277 CA GLU A 14 -8.858 4.617 -5.535 1.00 0.00 C ATOM 278 C GLU A 14 -9.166 3.910 -4.214 1.00 0.00 C ATOM 279 O GLU A 14 -10.211 4.147 -3.608 1.00 0.00 O ATOM 280 CB GLU A 14 -8.773 3.613 -6.687 1.00 0.00 C ATOM 281 CG GLU A 14 -8.647 4.330 -8.032 1.00 0.00 C ATOM 282 CD GLU A 14 -10.017 4.506 -8.690 1.00 0.00 C ATOM 283 OE1 GLU A 14 -10.737 5.466 -8.377 1.00 0.00 O ATOM 284 OE2 GLU A 14 -10.326 3.602 -9.557 1.00 0.00 O ATOM 0 H GLU A 14 -6.911 5.142 -6.104 1.00 0.00 H new ATOM 0 HA GLU A 14 -9.674 5.305 -5.755 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -7.915 2.957 -6.539 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -9.661 2.981 -6.690 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -8.182 5.305 -7.886 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -7.993 3.760 -8.692 1.00 0.00 H new ATOM 291 N GLN A 15 -8.239 3.057 -3.805 1.00 0.00 N ATOM 292 CA GLN A 15 -8.399 2.315 -2.566 1.00 0.00 C ATOM 293 C GLN A 15 -8.759 3.264 -1.421 1.00 0.00 C ATOM 294 O GLN A 15 -9.490 2.889 -0.506 1.00 0.00 O ATOM 295 CB GLN A 15 -7.135 1.516 -2.238 1.00 0.00 C ATOM 296 CG GLN A 15 -5.926 2.441 -2.086 1.00 0.00 C ATOM 297 CD GLN A 15 -4.826 1.773 -1.258 1.00 0.00 C ATOM 298 OE1 GLN A 15 -4.976 0.674 -0.751 1.00 0.00 O ATOM 299 NE2 GLN A 15 -3.715 2.497 -1.151 1.00 0.00 N ATOM 0 H GLN A 15 -7.374 2.863 -4.310 1.00 0.00 H new ATOM 0 HA GLN A 15 -9.216 1.605 -2.694 1.00 0.00 H new ATOM 0 HB2 GLN A 15 -7.285 0.953 -1.317 1.00 0.00 H new ATOM 0 HB3 GLN A 15 -6.945 0.789 -3.028 1.00 0.00 H new ATOM 0 HG2 GLN A 15 -5.537 2.702 -3.070 1.00 0.00 H new ATOM 0 HG3 GLN A 15 -6.233 3.371 -1.607 1.00 0.00 H new ATOM 0 HE21 GLN A 15 -3.656 3.410 -1.601 1.00 0.00 H new ATOM 0 HE22 GLN A 15 -2.922 2.139 -0.619 1.00 0.00 H new ATOM 308 N ILE A 16 -8.230 4.476 -1.510 1.00 0.00 N ATOM 309 CA ILE A 16 -8.487 5.481 -0.494 1.00 0.00 C ATOM 310 C ILE A 16 -9.936 5.958 -0.609 1.00 0.00 C ATOM 311 O ILE A 16 -10.680 5.937 0.371 1.00 0.00 O ATOM 312 CB ILE A 16 -7.459 6.611 -0.585 1.00 0.00 C ATOM 313 CG1 ILE A 16 -6.087 6.145 -0.092 1.00 0.00 C ATOM 314 CG2 ILE A 16 -7.943 7.855 0.161 1.00 0.00 C ATOM 315 CD1 ILE A 16 -4.964 6.909 -0.795 1.00 0.00 C ATOM 0 H ILE A 16 -7.624 4.784 -2.271 1.00 0.00 H new ATOM 0 HA ILE A 16 -8.370 5.054 0.502 1.00 0.00 H new ATOM 0 HB ILE A 16 -7.348 6.888 -1.633 1.00 0.00 H new ATOM 0 HG12 ILE A 16 -6.014 6.294 0.985 1.00 0.00 H new ATOM 0 HG13 ILE A 16 -5.975 5.076 -0.275 1.00 0.00 H new ATOM 0 HG21 ILE A 16 -7.194 8.642 0.080 1.00 0.00 H new ATOM 0 HG22 ILE A 16 -8.880 8.200 -0.276 1.00 0.00 H new ATOM 0 HG23 ILE A 16 -8.101 7.611 1.212 1.00 0.00 H new ATOM 0 HD11 ILE A 16 -4.000 6.559 -0.427 1.00 0.00 H new ATOM 0 HD12 ILE A 16 -5.025 6.739 -1.870 1.00 0.00 H new ATOM 0 HD13 ILE A 16 -5.065 7.975 -0.590 1.00 0.00 H new ATOM 327 N ARG A 17 -10.294 6.377 -1.814 1.00 0.00 N ATOM 328 CA ARG A 17 -11.641 6.858 -2.069 1.00 0.00 C ATOM 329 C ARG A 17 -12.668 5.791 -1.686 1.00 0.00 C ATOM 330 O ARG A 17 -13.732 6.109 -1.158 1.00 0.00 O ATOM 331 CB ARG A 17 -11.824 7.225 -3.543 1.00 0.00 C ATOM 332 CG ARG A 17 -13.277 7.604 -3.838 1.00 0.00 C ATOM 333 CD ARG A 17 -13.780 6.906 -5.103 1.00 0.00 C ATOM 334 NE ARG A 17 -13.781 5.439 -4.905 1.00 0.00 N ATOM 335 CZ ARG A 17 -13.697 4.540 -5.909 1.00 0.00 C ATOM 336 NH1 ARG A 17 -13.604 4.952 -7.191 1.00 0.00 N ATOM 337 NH2 ARG A 17 -13.706 3.253 -5.617 1.00 0.00 N ATOM 0 H ARG A 17 -9.675 6.393 -2.624 1.00 0.00 H new ATOM 0 HA ARG A 17 -11.795 7.750 -1.461 1.00 0.00 H new ATOM 0 HB2 ARG A 17 -11.168 8.058 -3.798 1.00 0.00 H new ATOM 0 HB3 ARG A 17 -11.529 6.384 -4.170 1.00 0.00 H new ATOM 0 HG2 ARG A 17 -13.907 7.329 -2.992 1.00 0.00 H new ATOM 0 HG3 ARG A 17 -13.358 8.684 -3.958 1.00 0.00 H new ATOM 0 HD2 ARG A 17 -14.786 7.250 -5.342 1.00 0.00 H new ATOM 0 HD3 ARG A 17 -13.144 7.167 -5.949 1.00 0.00 H new ATOM 0 HE ARG A 17 -13.849 5.085 -3.951 1.00 0.00 H new ATOM 0 HH11 ARG A 17 -13.597 5.949 -7.407 1.00 0.00 H new ATOM 0 HH12 ARG A 17 -13.541 4.267 -7.944 1.00 0.00 H new ATOM 0 HH21 ARG A 17 -13.776 2.951 -4.645 1.00 0.00 H new ATOM 0 HH22 ARG A 17 -13.643 2.560 -6.363 1.00 0.00 H new ATOM 349 N GLN A 18 -12.312 4.545 -1.965 1.00 0.00 N ATOM 350 CA GLN A 18 -13.189 3.429 -1.656 1.00 0.00 C ATOM 351 C GLN A 18 -13.319 3.260 -0.141 1.00 0.00 C ATOM 352 O GLN A 18 -14.426 3.140 0.382 1.00 0.00 O ATOM 353 CB GLN A 18 -12.689 2.140 -2.311 1.00 0.00 C ATOM 354 CG GLN A 18 -13.016 0.922 -1.445 1.00 0.00 C ATOM 355 CD GLN A 18 -14.527 0.767 -1.265 1.00 0.00 C ATOM 356 OE1 GLN A 18 -15.321 1.137 -2.115 1.00 0.00 O ATOM 357 NE2 GLN A 18 -14.880 0.199 -0.115 1.00 0.00 N ATOM 0 H GLN A 18 -11.428 4.284 -2.402 1.00 0.00 H new ATOM 0 HA GLN A 18 -14.176 3.645 -2.064 1.00 0.00 H new ATOM 0 HB2 GLN A 18 -13.147 2.026 -3.293 1.00 0.00 H new ATOM 0 HB3 GLN A 18 -11.612 2.201 -2.467 1.00 0.00 H new ATOM 0 HG2 GLN A 18 -12.607 0.023 -1.906 1.00 0.00 H new ATOM 0 HG3 GLN A 18 -12.539 1.026 -0.470 1.00 0.00 H new ATOM 0 HE21 GLN A 18 -14.164 -0.088 0.553 1.00 0.00 H new ATOM 0 HE22 GLN A 18 -15.866 0.050 0.099 1.00 0.00 H new ATOM 366 N ASP A 19 -12.172 3.255 0.522 1.00 0.00 N ATOM 367 CA ASP A 19 -12.143 3.102 1.967 1.00 0.00 C ATOM 368 C ASP A 19 -12.762 4.340 2.619 1.00 0.00 C ATOM 369 O ASP A 19 -13.544 4.224 3.561 1.00 0.00 O ATOM 370 CB ASP A 19 -10.707 2.967 2.478 1.00 0.00 C ATOM 371 CG ASP A 19 -10.461 1.777 3.408 1.00 0.00 C ATOM 372 OD1 ASP A 19 -11.363 1.597 4.313 1.00 0.00 O ATOM 373 OD2 ASP A 19 -9.459 1.059 3.275 1.00 0.00 O ATOM 0 H ASP A 19 -11.256 3.354 0.085 1.00 0.00 H new ATOM 0 HA ASP A 19 -12.703 2.202 2.222 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -10.039 2.883 1.621 1.00 0.00 H new ATOM 0 HB3 ASP A 19 -10.437 3.882 3.005 1.00 0.00 H new ATOM 378 N ALA A 20 -12.390 5.496 2.091 1.00 0.00 N ATOM 379 CA ALA A 20 -12.899 6.754 2.610 1.00 0.00 C ATOM 380 C ALA A 20 -14.399 6.848 2.326 1.00 0.00 C ATOM 381 O ALA A 20 -15.190 7.113 3.230 1.00 0.00 O ATOM 382 CB ALA A 20 -12.115 7.915 1.994 1.00 0.00 C ATOM 0 H ALA A 20 -11.742 5.588 1.309 1.00 0.00 H new ATOM 0 HA ALA A 20 -12.764 6.806 3.690 1.00 0.00 H new ATOM 0 HB1 ALA A 20 -12.497 8.859 2.383 1.00 0.00 H new ATOM 0 HB2 ALA A 20 -11.060 7.817 2.249 1.00 0.00 H new ATOM 0 HB3 ALA A 20 -12.229 7.897 0.910 1.00 0.00 H new ATOM 388 N GLU A 21 -14.746 6.626 1.067 1.00 0.00 N ATOM 389 CA GLU A 21 -16.138 6.682 0.653 1.00 0.00 C ATOM 390 C GLU A 21 -16.958 5.630 1.403 1.00 0.00 C ATOM 391 O GLU A 21 -18.078 5.902 1.833 1.00 0.00 O ATOM 392 CB GLU A 21 -16.267 6.501 -0.861 1.00 0.00 C ATOM 393 CG GLU A 21 -17.718 6.683 -1.313 1.00 0.00 C ATOM 394 CD GLU A 21 -17.783 7.206 -2.749 1.00 0.00 C ATOM 395 OE1 GLU A 21 -16.874 7.926 -3.189 1.00 0.00 O ATOM 396 OE2 GLU A 21 -18.823 6.837 -3.417 1.00 0.00 O ATOM 0 H GLU A 21 -14.087 6.407 0.320 1.00 0.00 H new ATOM 0 HA GLU A 21 -16.532 7.667 0.903 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -15.630 7.222 -1.373 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -15.916 5.508 -1.144 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -18.246 5.732 -1.244 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -18.226 7.379 -0.645 1.00 0.00 H new ATOM 403 N ASN A 22 -16.368 4.452 1.537 1.00 0.00 N ATOM 404 CA ASN A 22 -17.030 3.358 2.228 1.00 0.00 C ATOM 405 C ASN A 22 -16.982 3.609 3.736 1.00 0.00 C ATOM 406 O ASN A 22 -17.836 3.125 4.477 1.00 0.00 O ATOM 407 CB ASN A 22 -16.331 2.026 1.947 1.00 0.00 C ATOM 408 CG ASN A 22 -17.105 0.860 2.565 1.00 0.00 C ATOM 409 OD1 ASN A 22 -17.992 0.280 1.960 1.00 0.00 O ATOM 410 ND2 ASN A 22 -16.722 0.550 3.800 1.00 0.00 N ATOM 0 H ASN A 22 -15.439 4.231 1.179 1.00 0.00 H new ATOM 0 HA ASN A 22 -18.059 3.307 1.872 1.00 0.00 H new ATOM 0 HB2 ASN A 22 -16.241 1.878 0.871 1.00 0.00 H new ATOM 0 HB3 ASN A 22 -15.319 2.050 2.351 1.00 0.00 H new ATOM 0 HD21 ASN A 22 -17.178 -0.214 4.299 1.00 0.00 H new ATOM 0 HD22 ASN A 22 -15.972 1.076 4.249 1.00 0.00 H new ATOM 417 N THR A 23 -15.974 4.365 4.146 1.00 0.00 N ATOM 418 CA THR A 23 -15.802 4.686 5.552 1.00 0.00 C ATOM 419 C THR A 23 -16.953 5.567 6.042 1.00 0.00 C ATOM 420 O THR A 23 -17.261 5.587 7.233 1.00 0.00 O ATOM 421 CB THR A 23 -14.426 5.332 5.726 1.00 0.00 C ATOM 422 OG1 THR A 23 -13.552 4.230 5.956 1.00 0.00 O ATOM 423 CG2 THR A 23 -14.326 6.161 7.008 1.00 0.00 C ATOM 0 H THR A 23 -15.268 4.765 3.528 1.00 0.00 H new ATOM 0 HA THR A 23 -15.835 3.788 6.169 1.00 0.00 H new ATOM 0 HB THR A 23 -14.212 5.967 4.866 1.00 0.00 H new ATOM 0 HG1 THR A 23 -13.425 3.734 5.121 1.00 0.00 H new ATOM 0 HG21 THR A 23 -13.330 6.597 7.083 1.00 0.00 H new ATOM 0 HG22 THR A 23 -15.070 6.957 6.985 1.00 0.00 H new ATOM 0 HG23 THR A 23 -14.507 5.520 7.871 1.00 0.00 H new ATOM 431 N TYR A 24 -17.558 6.274 5.099 1.00 0.00 N ATOM 432 CA TYR A 24 -18.668 7.155 5.419 1.00 0.00 C ATOM 433 C TYR A 24 -19.752 6.408 6.200 1.00 0.00 C ATOM 434 O TYR A 24 -20.069 6.772 7.331 1.00 0.00 O ATOM 435 CB TYR A 24 -19.245 7.611 4.078 1.00 0.00 C ATOM 436 CG TYR A 24 -19.694 9.074 4.059 1.00 0.00 C ATOM 437 CD1 TYR A 24 -18.928 10.039 4.681 1.00 0.00 C ATOM 438 CD2 TYR A 24 -20.865 9.428 3.420 1.00 0.00 C ATOM 439 CE1 TYR A 24 -19.351 11.415 4.663 1.00 0.00 C ATOM 440 CE2 TYR A 24 -21.288 10.804 3.403 1.00 0.00 C ATOM 441 CZ TYR A 24 -20.510 11.730 4.025 1.00 0.00 C ATOM 442 OH TYR A 24 -20.909 13.030 4.008 1.00 0.00 O ATOM 0 H TYR A 24 -17.300 6.255 4.112 1.00 0.00 H new ATOM 0 HA TYR A 24 -18.331 7.990 6.034 1.00 0.00 H new ATOM 0 HB2 TYR A 24 -18.495 7.462 3.302 1.00 0.00 H new ATOM 0 HB3 TYR A 24 -20.095 6.977 3.826 1.00 0.00 H new ATOM 0 HD1 TYR A 24 -18.012 9.762 5.181 1.00 0.00 H new ATOM 0 HD2 TYR A 24 -21.464 8.673 2.933 1.00 0.00 H new ATOM 0 HE1 TYR A 24 -18.761 12.180 5.145 1.00 0.00 H new ATOM 0 HE2 TYR A 24 -22.203 11.094 2.907 1.00 0.00 H new ATOM 0 HH TYR A 24 -21.753 13.107 3.516 1.00 0.00 H new ATOM 452 N LYS A 25 -20.291 5.378 5.564 1.00 0.00 N ATOM 453 CA LYS A 25 -21.333 4.578 6.184 1.00 0.00 C ATOM 454 C LYS A 25 -20.764 3.877 7.419 1.00 0.00 C ATOM 455 O LYS A 25 -21.497 3.581 8.363 1.00 0.00 O ATOM 456 CB LYS A 25 -21.952 3.620 5.164 1.00 0.00 C ATOM 457 CG LYS A 25 -20.869 2.836 4.421 1.00 0.00 C ATOM 458 CD LYS A 25 -20.604 3.441 3.040 1.00 0.00 C ATOM 459 CE LYS A 25 -20.770 2.390 1.940 1.00 0.00 C ATOM 460 NZ LYS A 25 -20.910 3.041 0.619 1.00 0.00 N ATOM 0 H LYS A 25 -20.025 5.079 4.626 1.00 0.00 H new ATOM 0 HA LYS A 25 -22.150 5.214 6.525 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -22.624 2.928 5.671 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -22.553 4.182 4.450 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -19.949 2.837 5.005 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -21.177 1.796 4.313 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -21.291 4.269 2.864 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -19.595 3.852 3.006 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -19.908 1.722 1.934 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -21.647 1.776 2.144 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -21.022 2.314 -0.116 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -21.746 3.660 0.624 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -20.061 3.608 0.419 1.00 0.00 H new ATOM 473 N SER A 26 -19.463 3.630 7.374 1.00 0.00 N ATOM 474 CA SER A 26 -18.788 2.969 8.478 1.00 0.00 C ATOM 475 C SER A 26 -18.700 3.913 9.678 1.00 0.00 C ATOM 476 O SER A 26 -18.848 3.484 10.822 1.00 0.00 O ATOM 477 CB SER A 26 -17.390 2.502 8.067 1.00 0.00 C ATOM 478 OG SER A 26 -17.051 1.250 8.658 1.00 0.00 O ATOM 0 H SER A 26 -18.858 3.876 6.590 1.00 0.00 H new ATOM 0 HA SER A 26 -19.369 2.090 8.757 1.00 0.00 H new ATOM 0 HB2 SER A 26 -17.341 2.416 6.982 1.00 0.00 H new ATOM 0 HB3 SER A 26 -16.656 3.252 8.361 1.00 0.00 H new ATOM 0 HG SER A 26 -16.152 0.985 8.370 1.00 0.00 H new ATOM 484 N ASN A 27 -18.461 5.181 9.378 1.00 0.00 N ATOM 485 CA ASN A 27 -18.352 6.190 10.418 1.00 0.00 C ATOM 486 C ASN A 27 -18.341 7.579 9.777 1.00 0.00 C ATOM 487 O ASN A 27 -17.284 8.091 9.414 1.00 0.00 O ATOM 488 CB ASN A 27 -17.054 6.025 11.211 1.00 0.00 C ATOM 489 CG ASN A 27 -17.345 5.673 12.671 1.00 0.00 C ATOM 490 OD1 ASN A 27 -16.749 6.474 13.550 1.00 0.00 O flip ATOM 491 ND2 ASN A 27 -18.062 4.736 12.980 1.00 0.00 N flip ATOM 0 H ASN A 27 -18.340 5.533 8.428 1.00 0.00 H new ATOM 0 HA ASN A 27 -19.203 6.075 11.090 1.00 0.00 H new ATOM 0 HB2 ASN A 27 -16.444 5.243 10.759 1.00 0.00 H new ATOM 0 HB3 ASN A 27 -16.475 6.947 11.164 1.00 0.00 H new ATOM 0 HD21 ASN A 27 -18.489 4.160 12.255 1.00 0.00 H new ATOM 0 HD22 ASN A 27 -18.234 4.528 13.964 1.00 0.00 H new ATOM 498 N PRO A 28 -19.563 8.164 9.654 1.00 0.00 N ATOM 499 CA PRO A 28 -19.704 9.484 9.063 1.00 0.00 C ATOM 500 C PRO A 28 -19.241 10.572 10.035 1.00 0.00 C ATOM 501 O PRO A 28 -19.297 11.759 9.716 1.00 0.00 O ATOM 502 CB PRO A 28 -21.176 9.598 8.701 1.00 0.00 C ATOM 503 CG PRO A 28 -21.889 8.534 9.519 1.00 0.00 C ATOM 504 CD PRO A 28 -20.837 7.588 10.073 1.00 0.00 C ATOM 0 HA PRO A 28 -19.079 9.619 8.180 1.00 0.00 H new ATOM 0 HB2 PRO A 28 -21.560 10.592 8.933 1.00 0.00 H new ATOM 0 HB3 PRO A 28 -21.329 9.438 7.634 1.00 0.00 H new ATOM 0 HG2 PRO A 28 -22.455 8.992 10.330 1.00 0.00 H new ATOM 0 HG3 PRO A 28 -22.602 7.991 8.899 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -20.901 7.516 11.159 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -20.964 6.580 9.679 1.00 0.00 H new ATOM 512 N LEU A 29 -18.796 10.129 11.201 1.00 0.00 N ATOM 513 CA LEU A 29 -18.324 11.050 12.221 1.00 0.00 C ATOM 514 C LEU A 29 -16.831 11.315 12.012 1.00 0.00 C ATOM 515 O LEU A 29 -16.338 12.395 12.332 1.00 0.00 O ATOM 516 CB LEU A 29 -18.665 10.524 13.617 1.00 0.00 C ATOM 517 CG LEU A 29 -19.996 10.995 14.204 1.00 0.00 C ATOM 518 CD1 LEU A 29 -20.093 10.649 15.692 1.00 0.00 C ATOM 519 CD2 LEU A 29 -20.211 12.488 13.949 1.00 0.00 C ATOM 0 H LEU A 29 -18.752 9.144 11.463 1.00 0.00 H new ATOM 0 HA LEU A 29 -18.834 12.009 12.133 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -18.671 9.435 13.582 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -17.866 10.816 14.299 1.00 0.00 H new ATOM 0 HG LEU A 29 -20.800 10.462 13.696 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -21.049 10.995 16.084 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -20.018 9.569 15.820 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -19.281 11.136 16.232 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -21.165 12.797 14.377 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -19.405 13.056 14.413 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -20.217 12.677 12.875 1.00 0.00 H new ATOM 531 N ASP A 30 -16.154 10.310 11.475 1.00 0.00 N ATOM 532 CA ASP A 30 -14.728 10.422 11.219 1.00 0.00 C ATOM 533 C ASP A 30 -14.485 11.512 10.174 1.00 0.00 C ATOM 534 O ASP A 30 -14.634 11.273 8.976 1.00 0.00 O ATOM 535 CB ASP A 30 -14.163 9.109 10.673 1.00 0.00 C ATOM 536 CG ASP A 30 -13.411 8.254 11.695 1.00 0.00 C ATOM 537 OD1 ASP A 30 -12.232 8.501 11.991 1.00 0.00 O ATOM 538 OD2 ASP A 30 -14.094 7.285 12.203 1.00 0.00 O ATOM 0 H ASP A 30 -16.566 9.415 11.210 1.00 0.00 H new ATOM 0 HA ASP A 30 -14.234 10.664 12.160 1.00 0.00 H new ATOM 0 HB2 ASP A 30 -14.984 8.520 10.263 1.00 0.00 H new ATOM 0 HB3 ASP A 30 -13.490 9.336 9.846 1.00 0.00 H new ATOM 543 N ALA A 31 -14.117 12.686 10.664 1.00 0.00 N ATOM 544 CA ALA A 31 -13.852 13.814 9.788 1.00 0.00 C ATOM 545 C ALA A 31 -12.528 13.586 9.057 1.00 0.00 C ATOM 546 O ALA A 31 -12.396 13.928 7.882 1.00 0.00 O ATOM 547 CB ALA A 31 -13.852 15.108 10.605 1.00 0.00 C ATOM 0 H ALA A 31 -13.996 12.881 11.658 1.00 0.00 H new ATOM 0 HA ALA A 31 -14.634 13.906 9.034 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -13.653 15.954 9.947 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -14.824 15.239 11.080 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -13.078 15.055 11.371 1.00 0.00 H new ATOM 553 N ASP A 32 -11.580 13.010 9.781 1.00 0.00 N ATOM 554 CA ASP A 32 -10.270 12.732 9.216 1.00 0.00 C ATOM 555 C ASP A 32 -10.439 11.985 7.892 1.00 0.00 C ATOM 556 O ASP A 32 -9.923 12.416 6.862 1.00 0.00 O ATOM 557 CB ASP A 32 -9.442 11.852 10.154 1.00 0.00 C ATOM 558 CG ASP A 32 -8.151 11.297 9.547 1.00 0.00 C ATOM 559 OD1 ASP A 32 -7.461 12.147 8.865 1.00 0.00 O ATOM 560 OD2 ASP A 32 -7.822 10.114 9.719 1.00 0.00 O ATOM 0 H ASP A 32 -11.693 12.728 10.755 1.00 0.00 H new ATOM 0 HA ASP A 32 -9.757 13.682 9.067 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -9.189 12.431 11.042 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -10.060 11.016 10.484 1.00 0.00 H new ATOM 565 N ASN A 33 -11.164 10.878 7.962 1.00 0.00 N ATOM 566 CA ASN A 33 -11.407 10.067 6.781 1.00 0.00 C ATOM 567 C ASN A 33 -12.270 10.857 5.794 1.00 0.00 C ATOM 568 O ASN A 33 -12.077 10.763 4.583 1.00 0.00 O ATOM 569 CB ASN A 33 -12.156 8.782 7.140 1.00 0.00 C ATOM 570 CG ASN A 33 -11.204 7.584 7.172 1.00 0.00 C ATOM 571 OD1 ASN A 33 -11.050 6.908 8.176 1.00 0.00 O ATOM 572 ND2 ASN A 33 -10.577 7.361 6.021 1.00 0.00 N ATOM 0 H ASN A 33 -11.591 10.524 8.818 1.00 0.00 H new ATOM 0 HA ASN A 33 -10.442 9.812 6.343 1.00 0.00 H new ATOM 0 HB2 ASN A 33 -12.636 8.896 8.112 1.00 0.00 H new ATOM 0 HB3 ASN A 33 -12.948 8.603 6.413 1.00 0.00 H new ATOM 0 HD21 ASN A 33 -9.920 6.585 5.940 1.00 0.00 H new ATOM 0 HD22 ASN A 33 -10.753 7.966 5.219 1.00 0.00 H new ATOM 579 N LEU A 34 -13.203 11.616 6.349 1.00 0.00 N ATOM 580 CA LEU A 34 -14.096 12.421 5.533 1.00 0.00 C ATOM 581 C LEU A 34 -13.269 13.373 4.667 1.00 0.00 C ATOM 582 O LEU A 34 -13.393 13.370 3.443 1.00 0.00 O ATOM 583 CB LEU A 34 -15.130 13.130 6.410 1.00 0.00 C ATOM 584 CG LEU A 34 -16.589 12.999 5.966 1.00 0.00 C ATOM 585 CD1 LEU A 34 -17.531 13.654 6.977 1.00 0.00 C ATOM 586 CD2 LEU A 34 -16.784 13.558 4.555 1.00 0.00 C ATOM 0 H LEU A 34 -13.360 11.691 7.354 1.00 0.00 H new ATOM 0 HA LEU A 34 -14.668 11.787 4.855 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -15.044 12.742 7.425 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -14.877 14.189 6.451 1.00 0.00 H new ATOM 0 HG LEU A 34 -16.842 11.939 5.931 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -18.561 13.547 6.637 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -17.417 13.170 7.947 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -17.288 14.713 7.068 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -17.829 13.453 4.263 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -16.507 14.612 4.540 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -16.155 13.008 3.855 1.00 0.00 H new ATOM 598 N THR A 35 -12.443 14.164 5.335 1.00 0.00 N ATOM 599 CA THR A 35 -11.596 15.119 4.642 1.00 0.00 C ATOM 600 C THR A 35 -10.682 14.398 3.649 1.00 0.00 C ATOM 601 O THR A 35 -10.411 14.910 2.564 1.00 0.00 O ATOM 602 CB THR A 35 -10.833 15.927 5.694 1.00 0.00 C ATOM 603 OG1 THR A 35 -11.761 16.928 6.102 1.00 0.00 O ATOM 604 CG2 THR A 35 -9.669 16.719 5.095 1.00 0.00 C ATOM 0 H THR A 35 -12.342 14.163 6.350 1.00 0.00 H new ATOM 0 HA THR A 35 -12.189 15.813 4.046 1.00 0.00 H new ATOM 0 HB THR A 35 -10.455 15.254 6.464 1.00 0.00 H new ATOM 0 HG1 THR A 35 -12.674 16.583 6.015 1.00 0.00 H new ATOM 0 HG21 THR A 35 -9.162 17.274 5.884 1.00 0.00 H new ATOM 0 HG22 THR A 35 -8.965 16.032 4.625 1.00 0.00 H new ATOM 0 HG23 THR A 35 -10.049 17.416 4.348 1.00 0.00 H new ATOM 612 N ARG A 36 -10.231 13.221 4.057 1.00 0.00 N ATOM 613 CA ARG A 36 -9.353 12.424 3.217 1.00 0.00 C ATOM 614 C ARG A 36 -10.125 11.868 2.019 1.00 0.00 C ATOM 615 O ARG A 36 -9.543 11.612 0.966 1.00 0.00 O ATOM 616 CB ARG A 36 -8.742 11.263 4.005 1.00 0.00 C ATOM 617 CG ARG A 36 -7.306 10.989 3.552 1.00 0.00 C ATOM 618 CD ARG A 36 -7.236 9.731 2.683 1.00 0.00 C ATOM 619 NE ARG A 36 -5.846 9.506 2.230 1.00 0.00 N ATOM 620 CZ ARG A 36 -4.914 8.841 2.945 1.00 0.00 C ATOM 621 NH1 ARG A 36 -5.218 8.328 4.157 1.00 0.00 N ATOM 622 NH2 ARG A 36 -3.702 8.699 2.443 1.00 0.00 N ATOM 0 H ARG A 36 -10.457 12.800 4.958 1.00 0.00 H new ATOM 0 HA ARG A 36 -8.550 13.073 2.867 1.00 0.00 H new ATOM 0 HB2 ARG A 36 -8.753 11.496 5.070 1.00 0.00 H new ATOM 0 HB3 ARG A 36 -9.348 10.367 3.868 1.00 0.00 H new ATOM 0 HG2 ARG A 36 -6.928 11.844 2.991 1.00 0.00 H new ATOM 0 HG3 ARG A 36 -6.662 10.870 4.424 1.00 0.00 H new ATOM 0 HD2 ARG A 36 -7.587 8.868 3.249 1.00 0.00 H new ATOM 0 HD3 ARG A 36 -7.895 9.837 1.822 1.00 0.00 H new ATOM 0 HE ARG A 36 -5.574 9.877 1.319 1.00 0.00 H new ATOM 0 HH11 ARG A 36 -6.157 8.442 4.538 1.00 0.00 H new ATOM 0 HH12 ARG A 36 -4.508 7.827 4.691 1.00 0.00 H new ATOM 0 HH21 ARG A 36 -3.480 9.089 1.527 1.00 0.00 H new ATOM 0 HH22 ARG A 36 -2.987 8.199 2.971 1.00 0.00 H new ATOM 634 N TRP A 37 -11.423 11.697 2.220 1.00 0.00 N ATOM 635 CA TRP A 37 -12.281 11.175 1.169 1.00 0.00 C ATOM 636 C TRP A 37 -12.353 12.222 0.055 1.00 0.00 C ATOM 637 O TRP A 37 -12.572 11.882 -1.107 1.00 0.00 O ATOM 638 CB TRP A 37 -13.656 10.795 1.722 1.00 0.00 C ATOM 639 CG TRP A 37 -14.654 10.346 0.653 1.00 0.00 C ATOM 640 CD1 TRP A 37 -14.393 9.880 -0.576 1.00 0.00 C ATOM 641 CD2 TRP A 37 -16.093 10.340 0.768 1.00 0.00 C ATOM 642 NE1 TRP A 37 -15.553 9.575 -1.258 1.00 0.00 N ATOM 643 CE2 TRP A 37 -16.620 9.864 -0.415 1.00 0.00 C ATOM 644 CE3 TRP A 37 -16.921 10.724 1.837 1.00 0.00 C ATOM 645 CZ2 TRP A 37 -17.994 9.727 -0.642 1.00 0.00 C ATOM 646 CZ3 TRP A 37 -18.293 10.581 1.595 1.00 0.00 C ATOM 647 CH2 TRP A 37 -18.839 10.104 0.409 1.00 0.00 C ATOM 0 H TRP A 37 -11.902 11.911 3.095 1.00 0.00 H new ATOM 0 HA TRP A 37 -11.869 10.254 0.756 1.00 0.00 H new ATOM 0 HB2 TRP A 37 -13.534 9.993 2.451 1.00 0.00 H new ATOM 0 HB3 TRP A 37 -14.071 11.650 2.255 1.00 0.00 H new ATOM 0 HD1 TRP A 37 -13.400 9.758 -0.982 1.00 0.00 H new ATOM 0 HE1 TRP A 37 -15.616 9.205 -2.207 1.00 0.00 H new ATOM 0 HE3 TRP A 37 -16.530 11.100 2.771 1.00 0.00 H new ATOM 0 HZ2 TRP A 37 -18.382 9.351 -1.577 1.00 0.00 H new ATOM 0 HZ3 TRP A 37 -18.974 10.861 2.385 1.00 0.00 H new ATOM 0 HH2 TRP A 37 -19.910 10.025 0.299 1.00 0.00 H new ATOM 658 N GLY A 38 -12.164 13.473 0.449 1.00 0.00 N ATOM 659 CA GLY A 38 -12.205 14.571 -0.502 1.00 0.00 C ATOM 660 C GLY A 38 -10.855 14.740 -1.202 1.00 0.00 C ATOM 661 O GLY A 38 -10.774 14.670 -2.428 1.00 0.00 O ATOM 0 H GLY A 38 -11.982 13.750 1.414 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -12.982 14.386 -1.243 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -12.469 15.494 0.014 1.00 0.00 H new ATOM 665 N GLY A 39 -9.828 14.959 -0.394 1.00 0.00 N ATOM 666 CA GLY A 39 -8.486 15.138 -0.920 1.00 0.00 C ATOM 667 C GLY A 39 -8.236 14.211 -2.111 1.00 0.00 C ATOM 668 O GLY A 39 -7.703 14.638 -3.134 1.00 0.00 O ATOM 0 H GLY A 39 -9.899 15.017 0.622 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -8.347 16.175 -1.226 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -7.755 14.936 -0.137 1.00 0.00 H new ATOM 672 N VAL A 40 -8.631 12.958 -1.938 1.00 0.00 N ATOM 673 CA VAL A 40 -8.456 11.966 -2.985 1.00 0.00 C ATOM 674 C VAL A 40 -9.359 12.316 -4.169 1.00 0.00 C ATOM 675 O VAL A 40 -8.918 12.302 -5.317 1.00 0.00 O ATOM 676 CB VAL A 40 -8.717 10.565 -2.428 1.00 0.00 C ATOM 677 CG1 VAL A 40 -10.200 10.205 -2.523 1.00 0.00 C ATOM 678 CG2 VAL A 40 -7.852 9.523 -3.140 1.00 0.00 C ATOM 0 H VAL A 40 -9.072 12.607 -1.088 1.00 0.00 H new ATOM 0 HA VAL A 40 -7.428 11.971 -3.347 1.00 0.00 H new ATOM 0 HB VAL A 40 -8.440 10.566 -1.374 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -10.358 9.204 -2.120 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -10.786 10.923 -1.950 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -10.514 10.230 -3.566 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -8.057 8.536 -2.726 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -8.083 9.524 -4.205 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -6.799 9.765 -2.997 1.00 0.00 H new ATOM 688 N LEU A 41 -10.608 12.623 -3.849 1.00 0.00 N ATOM 689 CA LEU A 41 -11.578 12.976 -4.872 1.00 0.00 C ATOM 690 C LEU A 41 -10.969 14.025 -5.805 1.00 0.00 C ATOM 691 O LEU A 41 -11.101 13.928 -7.024 1.00 0.00 O ATOM 692 CB LEU A 41 -12.897 13.413 -4.232 1.00 0.00 C ATOM 693 CG LEU A 41 -13.880 12.292 -3.889 1.00 0.00 C ATOM 694 CD1 LEU A 41 -15.207 12.862 -3.386 1.00 0.00 C ATOM 695 CD2 LEU A 41 -14.075 11.350 -5.080 1.00 0.00 C ATOM 0 H LEU A 41 -10.970 12.635 -2.896 1.00 0.00 H new ATOM 0 HA LEU A 41 -11.821 12.107 -5.484 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -12.670 13.962 -3.318 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -13.393 14.110 -4.908 1.00 0.00 H new ATOM 0 HG LEU A 41 -13.455 11.701 -3.078 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -15.888 12.044 -3.149 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -15.031 13.458 -2.491 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -15.649 13.490 -4.159 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -14.778 10.562 -4.810 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -14.468 11.912 -5.928 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -13.118 10.904 -5.352 1.00 0.00 H new ATOM 707 N LEU A 42 -10.316 15.004 -5.196 1.00 0.00 N ATOM 708 CA LEU A 42 -9.687 16.070 -5.957 1.00 0.00 C ATOM 709 C LEU A 42 -8.547 15.489 -6.795 1.00 0.00 C ATOM 710 O LEU A 42 -8.334 15.904 -7.933 1.00 0.00 O ATOM 711 CB LEU A 42 -9.251 17.206 -5.029 1.00 0.00 C ATOM 712 CG LEU A 42 -10.247 17.598 -3.936 1.00 0.00 C ATOM 713 CD1 LEU A 42 -9.705 18.752 -3.089 1.00 0.00 C ATOM 714 CD2 LEU A 42 -11.618 17.920 -4.533 1.00 0.00 C ATOM 0 H LEU A 42 -10.209 15.081 -4.185 1.00 0.00 H new ATOM 0 HA LEU A 42 -10.400 16.513 -6.652 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -8.313 16.920 -4.553 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -9.044 18.086 -5.637 1.00 0.00 H new ATOM 0 HG LEU A 42 -10.378 16.744 -3.271 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -10.432 19.011 -2.319 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -8.770 18.449 -2.618 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -9.526 19.618 -3.726 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -12.307 18.196 -3.735 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -11.524 18.750 -5.234 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -12.001 17.044 -5.057 1.00 0.00 H new ATOM 726 N GLU A 43 -7.843 14.537 -6.199 1.00 0.00 N ATOM 727 CA GLU A 43 -6.729 13.895 -6.876 1.00 0.00 C ATOM 728 C GLU A 43 -7.231 13.092 -8.078 1.00 0.00 C ATOM 729 O GLU A 43 -6.818 13.339 -9.210 1.00 0.00 O ATOM 730 CB GLU A 43 -5.942 13.005 -5.913 1.00 0.00 C ATOM 731 CG GLU A 43 -5.055 13.845 -4.991 1.00 0.00 C ATOM 732 CD GLU A 43 -3.777 14.282 -5.709 1.00 0.00 C ATOM 733 OE1 GLU A 43 -3.963 14.982 -6.777 1.00 0.00 O ATOM 734 OE2 GLU A 43 -2.669 13.959 -5.255 1.00 0.00 O ATOM 0 H GLU A 43 -8.023 14.195 -5.255 1.00 0.00 H new ATOM 0 HA GLU A 43 -6.053 14.670 -7.237 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -6.633 12.410 -5.316 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -5.326 12.306 -6.479 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -5.605 14.723 -4.653 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -4.798 13.268 -4.103 1.00 0.00 H new ATOM 741 N LEU A 44 -8.115 12.148 -7.792 1.00 0.00 N ATOM 742 CA LEU A 44 -8.677 11.308 -8.835 1.00 0.00 C ATOM 743 C LEU A 44 -9.447 12.181 -9.828 1.00 0.00 C ATOM 744 O LEU A 44 -9.591 11.821 -10.995 1.00 0.00 O ATOM 745 CB LEU A 44 -9.517 10.184 -8.224 1.00 0.00 C ATOM 746 CG LEU A 44 -8.736 9.036 -7.582 1.00 0.00 C ATOM 747 CD1 LEU A 44 -9.411 8.569 -6.291 1.00 0.00 C ATOM 748 CD2 LEU A 44 -8.536 7.887 -8.572 1.00 0.00 C ATOM 0 H LEU A 44 -8.456 11.946 -6.852 1.00 0.00 H new ATOM 0 HA LEU A 44 -7.883 10.813 -9.394 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -10.174 10.617 -7.469 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -10.157 9.771 -9.004 1.00 0.00 H new ATOM 0 HG LEU A 44 -7.746 9.405 -7.313 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -8.836 7.752 -5.855 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -9.458 9.398 -5.585 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -10.421 8.224 -6.513 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -7.978 7.084 -8.090 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -9.507 7.511 -8.894 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -7.980 8.246 -9.438 1.00 0.00 H new ATOM 760 N SER A 45 -9.922 13.312 -9.327 1.00 0.00 N ATOM 761 CA SER A 45 -10.674 14.239 -10.155 1.00 0.00 C ATOM 762 C SER A 45 -9.824 14.684 -11.347 1.00 0.00 C ATOM 763 O SER A 45 -10.343 14.877 -12.446 1.00 0.00 O ATOM 764 CB SER A 45 -11.130 15.455 -9.346 1.00 0.00 C ATOM 765 OG SER A 45 -12.417 15.258 -8.766 1.00 0.00 O ATOM 0 H SER A 45 -9.801 13.607 -8.358 1.00 0.00 H new ATOM 0 HA SER A 45 -11.563 13.726 -10.522 1.00 0.00 H new ATOM 0 HB2 SER A 45 -10.405 15.659 -8.558 1.00 0.00 H new ATOM 0 HB3 SER A 45 -11.154 16.332 -9.992 1.00 0.00 H new ATOM 0 HG SER A 45 -12.321 14.796 -7.907 1.00 0.00 H new ATOM 771 N GLN A 46 -8.533 14.834 -11.090 1.00 0.00 N ATOM 772 CA GLN A 46 -7.607 15.252 -12.128 1.00 0.00 C ATOM 773 C GLN A 46 -7.462 14.155 -13.184 1.00 0.00 C ATOM 774 O GLN A 46 -7.342 14.445 -14.373 1.00 0.00 O ATOM 775 CB GLN A 46 -6.247 15.622 -11.532 1.00 0.00 C ATOM 776 CG GLN A 46 -5.339 14.395 -11.434 1.00 0.00 C ATOM 777 CD GLN A 46 -4.253 14.600 -10.376 1.00 0.00 C ATOM 778 OE1 GLN A 46 -3.942 15.709 -9.974 1.00 0.00 O ATOM 779 NE2 GLN A 46 -3.695 13.471 -9.948 1.00 0.00 N ATOM 0 H GLN A 46 -8.106 14.673 -10.177 1.00 0.00 H new ATOM 0 HA GLN A 46 -8.011 16.142 -12.611 1.00 0.00 H new ATOM 0 HB2 GLN A 46 -5.770 16.383 -12.150 1.00 0.00 H new ATOM 0 HB3 GLN A 46 -6.386 16.056 -10.542 1.00 0.00 H new ATOM 0 HG2 GLN A 46 -5.934 13.517 -11.184 1.00 0.00 H new ATOM 0 HG3 GLN A 46 -4.877 14.202 -12.402 1.00 0.00 H new ATOM 0 HE21 GLN A 46 -4.002 12.575 -10.326 1.00 0.00 H new ATOM 0 HE22 GLN A 46 -2.960 13.501 -9.241 1.00 0.00 H new ATOM 788 N PHE A 47 -7.479 12.917 -12.712 1.00 0.00 N ATOM 789 CA PHE A 47 -7.351 11.775 -13.601 1.00 0.00 C ATOM 790 C PHE A 47 -8.688 11.449 -14.270 1.00 0.00 C ATOM 791 O PHE A 47 -8.724 10.771 -15.296 1.00 0.00 O ATOM 792 CB PHE A 47 -6.921 10.585 -12.741 1.00 0.00 C ATOM 793 CG PHE A 47 -7.893 9.404 -12.782 1.00 0.00 C ATOM 794 CD1 PHE A 47 -7.927 8.589 -13.871 1.00 0.00 C ATOM 795 CD2 PHE A 47 -8.723 9.169 -11.730 1.00 0.00 C ATOM 796 CE1 PHE A 47 -8.829 7.493 -13.909 1.00 0.00 C ATOM 797 CE2 PHE A 47 -9.625 8.072 -11.769 1.00 0.00 C ATOM 798 CZ PHE A 47 -9.659 7.258 -12.857 1.00 0.00 C ATOM 0 H PHE A 47 -7.580 12.680 -11.725 1.00 0.00 H new ATOM 0 HA PHE A 47 -6.626 11.993 -14.385 1.00 0.00 H new ATOM 0 HB2 PHE A 47 -5.939 10.246 -13.073 1.00 0.00 H new ATOM 0 HB3 PHE A 47 -6.812 10.917 -11.708 1.00 0.00 H new ATOM 0 HD1 PHE A 47 -7.268 8.776 -14.706 1.00 0.00 H new ATOM 0 HD2 PHE A 47 -8.696 9.816 -10.866 1.00 0.00 H new ATOM 0 HE1 PHE A 47 -8.856 6.846 -14.773 1.00 0.00 H new ATOM 0 HE2 PHE A 47 -10.284 7.885 -10.934 1.00 0.00 H new ATOM 0 HZ PHE A 47 -10.345 6.424 -12.886 1.00 0.00 H new ATOM 808 N HIS A 48 -9.755 11.947 -13.662 1.00 0.00 N ATOM 809 CA HIS A 48 -11.090 11.717 -14.186 1.00 0.00 C ATOM 810 C HIS A 48 -11.349 12.661 -15.362 1.00 0.00 C ATOM 811 O HIS A 48 -11.028 12.337 -16.505 1.00 0.00 O ATOM 812 CB HIS A 48 -12.139 11.848 -13.079 1.00 0.00 C ATOM 813 CG HIS A 48 -12.688 10.528 -12.595 1.00 0.00 C ATOM 814 ND1 HIS A 48 -12.635 9.937 -11.366 1.00 0.00 N flip ATOM 815 CD2 HIS A 48 -13.385 9.659 -13.416 1.00 0.00 C flip ATOM 816 CE1 HIS A 48 -13.267 8.772 -11.433 1.00 0.00 C flip ATOM 817 NE2 HIS A 48 -13.732 8.597 -12.703 1.00 0.00 N flip ATOM 0 H HIS A 48 -9.722 12.509 -12.811 1.00 0.00 H new ATOM 0 HA HIS A 48 -11.167 10.696 -14.560 1.00 0.00 H new ATOM 0 HB2 HIS A 48 -11.697 12.378 -12.235 1.00 0.00 H new ATOM 0 HB3 HIS A 48 -12.963 12.461 -13.444 1.00 0.00 H new ATOM 0 HD2 HIS A 48 -13.608 9.819 -14.460 1.00 0.00 H new ATOM 0 HE1 HIS A 48 -13.392 8.077 -10.616 1.00 0.00 H new ATOM 0 HE2 HIS A 48 -14.255 7.790 -13.044 1.00 0.00 H new ATOM 825 N SER A 49 -11.928 13.809 -15.042 1.00 0.00 N ATOM 826 CA SER A 49 -12.233 14.802 -16.058 1.00 0.00 C ATOM 827 C SER A 49 -13.068 15.931 -15.451 1.00 0.00 C ATOM 828 O SER A 49 -13.845 15.706 -14.525 1.00 0.00 O ATOM 829 CB SER A 49 -12.973 14.171 -17.239 1.00 0.00 C ATOM 830 OG SER A 49 -13.562 15.154 -18.087 1.00 0.00 O ATOM 0 H SER A 49 -12.194 14.074 -14.094 1.00 0.00 H new ATOM 0 HA SER A 49 -11.294 15.212 -16.429 1.00 0.00 H new ATOM 0 HB2 SER A 49 -12.279 13.562 -17.818 1.00 0.00 H new ATOM 0 HB3 SER A 49 -13.749 13.503 -16.865 1.00 0.00 H new ATOM 0 HG SER A 49 -14.023 14.711 -18.830 1.00 0.00 H new ATOM 836 N ILE A 50 -12.878 17.123 -15.998 1.00 0.00 N ATOM 837 CA ILE A 50 -13.603 18.289 -15.522 1.00 0.00 C ATOM 838 C ILE A 50 -15.080 17.930 -15.349 1.00 0.00 C ATOM 839 O ILE A 50 -15.667 18.188 -14.299 1.00 0.00 O ATOM 840 CB ILE A 50 -13.366 19.483 -16.449 1.00 0.00 C ATOM 841 CG1 ILE A 50 -12.465 20.524 -15.782 1.00 0.00 C ATOM 842 CG2 ILE A 50 -14.692 20.087 -16.916 1.00 0.00 C ATOM 843 CD1 ILE A 50 -11.097 20.584 -16.464 1.00 0.00 C ATOM 0 H ILE A 50 -12.233 17.306 -16.766 1.00 0.00 H new ATOM 0 HA ILE A 50 -13.231 18.595 -14.544 1.00 0.00 H new ATOM 0 HB ILE A 50 -12.844 19.127 -17.337 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -12.941 21.504 -15.827 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -12.339 20.279 -14.727 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -14.495 20.934 -17.573 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -15.265 19.333 -17.457 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -15.263 20.425 -16.051 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -10.477 21.332 -15.970 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -10.614 19.609 -16.396 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -11.225 20.854 -17.512 1.00 0.00 H new ATOM 855 N SER A 51 -15.639 17.339 -16.395 1.00 0.00 N ATOM 856 CA SER A 51 -17.037 16.942 -16.372 1.00 0.00 C ATOM 857 C SER A 51 -17.373 16.287 -15.030 1.00 0.00 C ATOM 858 O SER A 51 -18.282 16.730 -14.330 1.00 0.00 O ATOM 859 CB SER A 51 -17.357 15.986 -17.523 1.00 0.00 C ATOM 860 OG SER A 51 -18.731 15.608 -17.536 1.00 0.00 O ATOM 0 H SER A 51 -15.149 17.125 -17.264 1.00 0.00 H new ATOM 0 HA SER A 51 -17.648 17.836 -16.497 1.00 0.00 H new ATOM 0 HB2 SER A 51 -17.103 16.461 -18.470 1.00 0.00 H new ATOM 0 HB3 SER A 51 -16.736 15.094 -17.437 1.00 0.00 H new ATOM 0 HG SER A 51 -18.896 14.999 -18.286 1.00 0.00 H new ATOM 866 N ASP A 52 -16.620 15.244 -14.712 1.00 0.00 N ATOM 867 CA ASP A 52 -16.827 14.524 -13.467 1.00 0.00 C ATOM 868 C ASP A 52 -16.220 15.325 -12.313 1.00 0.00 C ATOM 869 O ASP A 52 -16.832 15.454 -11.254 1.00 0.00 O ATOM 870 CB ASP A 52 -16.144 13.155 -13.503 1.00 0.00 C ATOM 871 CG ASP A 52 -16.791 12.134 -14.441 1.00 0.00 C ATOM 872 OD1 ASP A 52 -17.941 12.303 -14.874 1.00 0.00 O ATOM 873 OD2 ASP A 52 -16.055 11.115 -14.728 1.00 0.00 O ATOM 0 H ASP A 52 -15.866 14.881 -15.295 1.00 0.00 H new ATOM 0 HA ASP A 52 -17.900 14.389 -13.330 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -15.105 13.292 -13.801 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -16.135 12.744 -12.494 1.00 0.00 H new ATOM 878 N ALA A 53 -15.025 15.842 -12.558 1.00 0.00 N ATOM 879 CA ALA A 53 -14.330 16.627 -11.553 1.00 0.00 C ATOM 880 C ALA A 53 -15.306 17.623 -10.924 1.00 0.00 C ATOM 881 O ALA A 53 -15.421 17.697 -9.701 1.00 0.00 O ATOM 882 CB ALA A 53 -13.122 17.318 -12.190 1.00 0.00 C ATOM 0 H ALA A 53 -14.521 15.732 -13.438 1.00 0.00 H new ATOM 0 HA ALA A 53 -13.956 15.984 -10.756 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -12.600 17.907 -11.436 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -12.445 16.566 -12.596 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -13.459 17.973 -12.993 1.00 0.00 H new ATOM 888 N LYS A 54 -15.985 18.363 -11.787 1.00 0.00 N ATOM 889 CA LYS A 54 -16.948 19.352 -11.332 1.00 0.00 C ATOM 890 C LYS A 54 -17.876 18.713 -10.297 1.00 0.00 C ATOM 891 O LYS A 54 -18.138 19.299 -9.247 1.00 0.00 O ATOM 892 CB LYS A 54 -17.685 19.970 -12.521 1.00 0.00 C ATOM 893 CG LYS A 54 -16.734 20.803 -13.383 1.00 0.00 C ATOM 894 CD LYS A 54 -17.391 21.187 -14.710 1.00 0.00 C ATOM 895 CE LYS A 54 -17.813 19.942 -15.493 1.00 0.00 C ATOM 896 NZ LYS A 54 -19.275 19.947 -15.725 1.00 0.00 N ATOM 0 H LYS A 54 -15.888 18.298 -12.800 1.00 0.00 H new ATOM 0 HA LYS A 54 -16.440 20.180 -10.838 1.00 0.00 H new ATOM 0 HB2 LYS A 54 -18.133 19.181 -13.126 1.00 0.00 H new ATOM 0 HB3 LYS A 54 -18.500 20.598 -12.162 1.00 0.00 H new ATOM 0 HG2 LYS A 54 -16.443 21.704 -12.843 1.00 0.00 H new ATOM 0 HG3 LYS A 54 -15.822 20.238 -13.575 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -18.262 21.814 -14.521 1.00 0.00 H new ATOM 0 HD3 LYS A 54 -16.696 21.778 -15.306 1.00 0.00 H new ATOM 0 HE2 LYS A 54 -17.287 19.910 -16.447 1.00 0.00 H new ATOM 0 HE3 LYS A 54 -17.529 19.045 -14.942 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -19.545 19.095 -16.258 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -19.771 19.956 -14.811 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -19.537 20.793 -16.270 1.00 0.00 H new ATOM 909 N GLN A 55 -18.349 17.521 -10.629 1.00 0.00 N ATOM 910 CA GLN A 55 -19.243 16.797 -9.741 1.00 0.00 C ATOM 911 C GLN A 55 -18.466 16.235 -8.549 1.00 0.00 C ATOM 912 O GLN A 55 -18.860 16.430 -7.400 1.00 0.00 O ATOM 913 CB GLN A 55 -19.977 15.683 -10.491 1.00 0.00 C ATOM 914 CG GLN A 55 -21.018 16.263 -11.451 1.00 0.00 C ATOM 915 CD GLN A 55 -22.259 16.738 -10.693 1.00 0.00 C ATOM 916 OE1 GLN A 55 -22.353 17.872 -10.253 1.00 0.00 O ATOM 917 NE2 GLN A 55 -23.203 15.809 -10.564 1.00 0.00 N ATOM 0 H GLN A 55 -18.130 17.038 -11.500 1.00 0.00 H new ATOM 0 HA GLN A 55 -19.993 17.493 -9.366 1.00 0.00 H new ATOM 0 HB2 GLN A 55 -19.259 15.080 -11.048 1.00 0.00 H new ATOM 0 HB3 GLN A 55 -20.465 15.019 -9.777 1.00 0.00 H new ATOM 0 HG2 GLN A 55 -20.584 17.096 -12.003 1.00 0.00 H new ATOM 0 HG3 GLN A 55 -21.302 15.508 -12.184 1.00 0.00 H new ATOM 0 HE21 GLN A 55 -23.060 14.879 -10.957 1.00 0.00 H new ATOM 0 HE22 GLN A 55 -24.070 16.027 -10.072 1.00 0.00 H new ATOM 926 N MET A 56 -17.377 15.549 -8.863 1.00 0.00 N ATOM 927 CA MET A 56 -16.542 14.958 -7.831 1.00 0.00 C ATOM 928 C MET A 56 -16.124 16.005 -6.797 1.00 0.00 C ATOM 929 O MET A 56 -15.912 15.680 -5.630 1.00 0.00 O ATOM 930 CB MET A 56 -15.294 14.347 -8.472 1.00 0.00 C ATOM 931 CG MET A 56 -15.662 13.157 -9.361 1.00 0.00 C ATOM 932 SD MET A 56 -14.222 12.596 -10.256 1.00 0.00 S ATOM 933 CE MET A 56 -13.275 11.898 -8.914 1.00 0.00 C ATOM 0 H MET A 56 -17.054 15.389 -9.817 1.00 0.00 H new ATOM 0 HA MET A 56 -17.117 14.184 -7.324 1.00 0.00 H new ATOM 0 HB2 MET A 56 -14.778 15.102 -9.064 1.00 0.00 H new ATOM 0 HB3 MET A 56 -14.602 14.024 -7.694 1.00 0.00 H new ATOM 0 HG2 MET A 56 -16.060 12.346 -8.751 1.00 0.00 H new ATOM 0 HG3 MET A 56 -16.447 13.444 -10.061 1.00 0.00 H new ATOM 0 HE1 MET A 56 -12.314 11.547 -9.291 1.00 0.00 H new ATOM 0 HE2 MET A 56 -13.110 12.659 -8.151 1.00 0.00 H new ATOM 0 HE3 MET A 56 -13.822 11.061 -8.479 1.00 0.00 H new ATOM 943 N ILE A 57 -16.018 17.241 -7.263 1.00 0.00 N ATOM 944 CA ILE A 57 -15.629 18.338 -6.393 1.00 0.00 C ATOM 945 C ILE A 57 -16.790 18.676 -5.456 1.00 0.00 C ATOM 946 O ILE A 57 -16.607 18.761 -4.242 1.00 0.00 O ATOM 947 CB ILE A 57 -15.138 19.528 -7.220 1.00 0.00 C ATOM 948 CG1 ILE A 57 -13.857 19.178 -7.980 1.00 0.00 C ATOM 949 CG2 ILE A 57 -14.962 20.769 -6.342 1.00 0.00 C ATOM 950 CD1 ILE A 57 -13.764 19.965 -9.288 1.00 0.00 C ATOM 0 H ILE A 57 -16.195 17.507 -8.232 1.00 0.00 H new ATOM 0 HA ILE A 57 -14.787 18.047 -5.765 1.00 0.00 H new ATOM 0 HB ILE A 57 -15.899 19.764 -7.964 1.00 0.00 H new ATOM 0 HG12 ILE A 57 -12.989 19.396 -7.357 1.00 0.00 H new ATOM 0 HG13 ILE A 57 -13.836 18.109 -8.192 1.00 0.00 H new ATOM 0 HG21 ILE A 57 -14.612 21.601 -6.954 1.00 0.00 H new ATOM 0 HG22 ILE A 57 -15.917 21.030 -5.886 1.00 0.00 H new ATOM 0 HG23 ILE A 57 -14.231 20.561 -5.560 1.00 0.00 H new ATOM 0 HD11 ILE A 57 -12.845 19.698 -9.809 1.00 0.00 H new ATOM 0 HD12 ILE A 57 -14.621 19.726 -9.918 1.00 0.00 H new ATOM 0 HD13 ILE A 57 -13.760 21.033 -9.071 1.00 0.00 H new ATOM 962 N GLN A 58 -17.957 18.860 -6.054 1.00 0.00 N ATOM 963 CA GLN A 58 -19.148 19.187 -5.288 1.00 0.00 C ATOM 964 C GLN A 58 -19.252 18.283 -4.058 1.00 0.00 C ATOM 965 O GLN A 58 -19.358 18.769 -2.933 1.00 0.00 O ATOM 966 CB GLN A 58 -20.404 19.081 -6.155 1.00 0.00 C ATOM 967 CG GLN A 58 -20.336 20.047 -7.340 1.00 0.00 C ATOM 968 CD GLN A 58 -21.676 20.755 -7.548 1.00 0.00 C ATOM 969 OE1 GLN A 58 -22.645 20.525 -6.843 1.00 0.00 O ATOM 970 NE2 GLN A 58 -21.677 21.627 -8.552 1.00 0.00 N ATOM 0 H GLN A 58 -18.104 18.789 -7.061 1.00 0.00 H new ATOM 0 HA GLN A 58 -19.067 20.220 -4.950 1.00 0.00 H new ATOM 0 HB2 GLN A 58 -20.513 18.060 -6.520 1.00 0.00 H new ATOM 0 HB3 GLN A 58 -21.286 19.300 -5.553 1.00 0.00 H new ATOM 0 HG2 GLN A 58 -19.553 20.786 -7.167 1.00 0.00 H new ATOM 0 HG3 GLN A 58 -20.065 19.501 -8.244 1.00 0.00 H new ATOM 0 HE21 GLN A 58 -20.831 21.772 -9.103 1.00 0.00 H new ATOM 0 HE22 GLN A 58 -22.524 22.151 -8.771 1.00 0.00 H new ATOM 979 N GLU A 59 -19.218 16.984 -4.314 1.00 0.00 N ATOM 980 CA GLU A 59 -19.308 16.007 -3.241 1.00 0.00 C ATOM 981 C GLU A 59 -18.089 16.114 -2.323 1.00 0.00 C ATOM 982 O GLU A 59 -18.204 15.946 -1.110 1.00 0.00 O ATOM 983 CB GLU A 59 -19.451 14.590 -3.800 1.00 0.00 C ATOM 984 CG GLU A 59 -18.082 13.929 -3.974 1.00 0.00 C ATOM 985 CD GLU A 59 -18.222 12.532 -4.584 1.00 0.00 C ATOM 986 OE1 GLU A 59 -18.803 12.386 -5.670 1.00 0.00 O ATOM 987 OE2 GLU A 59 -17.700 11.579 -3.889 1.00 0.00 O ATOM 0 H GLU A 59 -19.129 16.585 -5.248 1.00 0.00 H new ATOM 0 HA GLU A 59 -20.201 16.222 -2.654 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -20.066 13.991 -3.128 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -19.967 14.624 -4.759 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -17.454 14.548 -4.614 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -17.582 13.860 -3.008 1.00 0.00 H new ATOM 994 N ALA A 60 -16.948 16.393 -2.937 1.00 0.00 N ATOM 995 CA ALA A 60 -15.709 16.524 -2.190 1.00 0.00 C ATOM 996 C ALA A 60 -15.856 17.646 -1.160 1.00 0.00 C ATOM 997 O ALA A 60 -15.216 17.618 -0.110 1.00 0.00 O ATOM 998 CB ALA A 60 -14.552 16.772 -3.159 1.00 0.00 C ATOM 0 H ALA A 60 -16.856 16.532 -3.943 1.00 0.00 H new ATOM 0 HA ALA A 60 -15.489 15.604 -1.648 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -13.622 16.870 -2.598 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -14.471 15.934 -3.851 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -14.737 17.689 -3.719 1.00 0.00 H new ATOM 1004 N ILE A 61 -16.703 18.608 -1.496 1.00 0.00 N ATOM 1005 CA ILE A 61 -16.943 19.737 -0.614 1.00 0.00 C ATOM 1006 C ILE A 61 -17.945 19.329 0.468 1.00 0.00 C ATOM 1007 O ILE A 61 -17.658 19.440 1.659 1.00 0.00 O ATOM 1008 CB ILE A 61 -17.373 20.965 -1.419 1.00 0.00 C ATOM 1009 CG1 ILE A 61 -16.179 21.877 -1.708 1.00 0.00 C ATOM 1010 CG2 ILE A 61 -18.508 21.712 -0.715 1.00 0.00 C ATOM 1011 CD1 ILE A 61 -16.181 22.337 -3.167 1.00 0.00 C ATOM 0 H ILE A 61 -17.232 18.629 -2.368 1.00 0.00 H new ATOM 0 HA ILE A 61 -16.023 20.025 -0.105 1.00 0.00 H new ATOM 0 HB ILE A 61 -17.759 20.625 -2.380 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -16.212 22.745 -1.049 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -15.251 21.347 -1.491 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -18.795 22.580 -1.308 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -19.366 21.049 -0.604 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -18.173 22.039 0.269 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -15.322 22.984 -3.346 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -16.124 21.468 -3.823 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -17.099 22.887 -3.374 1.00 0.00 H new ATOM 1023 N THR A 62 -19.101 18.865 0.015 1.00 0.00 N ATOM 1024 CA THR A 62 -20.147 18.440 0.929 1.00 0.00 C ATOM 1025 C THR A 62 -19.581 17.484 1.980 1.00 0.00 C ATOM 1026 O THR A 62 -20.119 17.376 3.081 1.00 0.00 O ATOM 1027 CB THR A 62 -21.280 17.832 0.101 1.00 0.00 C ATOM 1028 OG1 THR A 62 -20.662 16.752 -0.594 1.00 0.00 O ATOM 1029 CG2 THR A 62 -21.759 18.766 -1.013 1.00 0.00 C ATOM 0 H THR A 62 -19.336 18.774 -0.973 1.00 0.00 H new ATOM 0 HA THR A 62 -20.551 19.284 1.488 1.00 0.00 H new ATOM 0 HB THR A 62 -22.117 17.589 0.756 1.00 0.00 H new ATOM 0 HG1 THR A 62 -19.694 16.778 -0.444 1.00 0.00 H new ATOM 0 HG21 THR A 62 -22.564 18.286 -1.570 1.00 0.00 H new ATOM 0 HG22 THR A 62 -22.125 19.695 -0.576 1.00 0.00 H new ATOM 0 HG23 THR A 62 -20.930 18.983 -1.687 1.00 0.00 H new ATOM 1037 N LYS A 63 -18.503 16.812 1.603 1.00 0.00 N ATOM 1038 CA LYS A 63 -17.858 15.868 2.499 1.00 0.00 C ATOM 1039 C LYS A 63 -17.103 16.636 3.586 1.00 0.00 C ATOM 1040 O LYS A 63 -17.239 16.337 4.771 1.00 0.00 O ATOM 1041 CB LYS A 63 -16.979 14.895 1.710 1.00 0.00 C ATOM 1042 CG LYS A 63 -17.705 13.569 1.473 1.00 0.00 C ATOM 1043 CD LYS A 63 -19.036 13.794 0.753 1.00 0.00 C ATOM 1044 CE LYS A 63 -19.073 13.042 -0.579 1.00 0.00 C ATOM 1045 NZ LYS A 63 -20.440 12.547 -0.857 1.00 0.00 N ATOM 0 H LYS A 63 -18.060 16.903 0.689 1.00 0.00 H new ATOM 0 HA LYS A 63 -18.603 15.252 3.003 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -16.706 15.340 0.753 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -16.052 14.714 2.254 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -17.075 12.906 0.881 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -17.883 13.072 2.427 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -19.857 13.459 1.387 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -19.183 14.860 0.577 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -18.748 13.701 -1.384 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -18.376 12.205 -0.550 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -20.532 12.333 -1.871 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -20.616 11.684 -0.303 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -21.133 13.276 -0.593 1.00 0.00 H new ATOM 1058 N PHE A 64 -16.324 17.612 3.143 1.00 0.00 N ATOM 1059 CA PHE A 64 -15.547 18.425 4.063 1.00 0.00 C ATOM 1060 C PHE A 64 -16.449 19.085 5.107 1.00 0.00 C ATOM 1061 O PHE A 64 -16.125 19.098 6.294 1.00 0.00 O ATOM 1062 CB PHE A 64 -14.868 19.515 3.232 1.00 0.00 C ATOM 1063 CG PHE A 64 -13.903 18.979 2.172 1.00 0.00 C ATOM 1064 CD1 PHE A 64 -13.192 17.845 2.410 1.00 0.00 C ATOM 1065 CD2 PHE A 64 -13.757 19.638 0.990 1.00 0.00 C ATOM 1066 CE1 PHE A 64 -12.297 17.348 1.426 1.00 0.00 C ATOM 1067 CE2 PHE A 64 -12.862 19.140 0.007 1.00 0.00 C ATOM 1068 CZ PHE A 64 -12.151 18.006 0.245 1.00 0.00 C ATOM 0 H PHE A 64 -16.214 17.858 2.159 1.00 0.00 H new ATOM 0 HA PHE A 64 -14.823 17.803 4.589 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -15.635 20.114 2.741 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -14.323 20.181 3.901 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -13.308 17.322 3.348 1.00 0.00 H new ATOM 0 HD2 PHE A 64 -14.322 20.539 0.800 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -11.732 16.447 1.616 1.00 0.00 H new ATOM 0 HE2 PHE A 64 -12.746 19.663 -0.931 1.00 0.00 H new ATOM 0 HZ PHE A 64 -11.471 17.628 -0.504 1.00 0.00 H new ATOM 1078 N GLU A 65 -17.565 19.616 4.628 1.00 0.00 N ATOM 1079 CA GLU A 65 -18.516 20.276 5.506 1.00 0.00 C ATOM 1080 C GLU A 65 -18.856 19.374 6.695 1.00 0.00 C ATOM 1081 O GLU A 65 -18.706 19.778 7.847 1.00 0.00 O ATOM 1082 CB GLU A 65 -19.780 20.676 4.743 1.00 0.00 C ATOM 1083 CG GLU A 65 -19.731 22.151 4.336 1.00 0.00 C ATOM 1084 CD GLU A 65 -20.269 23.046 5.454 1.00 0.00 C ATOM 1085 OE1 GLU A 65 -21.555 23.092 5.544 1.00 0.00 O ATOM 1086 OE2 GLU A 65 -19.482 23.660 6.189 1.00 0.00 O ATOM 0 H GLU A 65 -17.831 19.602 3.644 1.00 0.00 H new ATOM 0 HA GLU A 65 -18.057 21.188 5.887 1.00 0.00 H new ATOM 0 HB2 GLU A 65 -19.885 20.053 3.855 1.00 0.00 H new ATOM 0 HB3 GLU A 65 -20.657 20.495 5.365 1.00 0.00 H new ATOM 0 HG2 GLU A 65 -18.705 22.433 4.101 1.00 0.00 H new ATOM 0 HG3 GLU A 65 -20.318 22.302 3.430 1.00 0.00 H new ATOM 1093 N GLU A 66 -19.308 18.171 6.373 1.00 0.00 N ATOM 1094 CA GLU A 66 -19.670 17.209 7.400 1.00 0.00 C ATOM 1095 C GLU A 66 -18.486 16.962 8.337 1.00 0.00 C ATOM 1096 O GLU A 66 -18.669 16.785 9.541 1.00 0.00 O ATOM 1097 CB GLU A 66 -20.159 15.900 6.777 1.00 0.00 C ATOM 1098 CG GLU A 66 -21.100 15.158 7.728 1.00 0.00 C ATOM 1099 CD GLU A 66 -22.562 15.384 7.339 1.00 0.00 C ATOM 1100 OE1 GLU A 66 -22.913 15.273 6.155 1.00 0.00 O ATOM 1101 OE2 GLU A 66 -23.347 15.684 8.319 1.00 0.00 O ATOM 0 H GLU A 66 -19.432 17.841 5.416 1.00 0.00 H new ATOM 0 HA GLU A 66 -20.491 17.623 7.985 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -20.674 16.109 5.840 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -19.305 15.266 6.537 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -20.876 14.092 7.709 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -20.935 15.500 8.750 1.00 0.00 H new ATOM 1108 N ALA A 67 -17.298 16.957 7.750 1.00 0.00 N ATOM 1109 CA ALA A 67 -16.085 16.734 8.517 1.00 0.00 C ATOM 1110 C ALA A 67 -15.890 17.888 9.502 1.00 0.00 C ATOM 1111 O ALA A 67 -15.602 17.665 10.677 1.00 0.00 O ATOM 1112 CB ALA A 67 -14.899 16.574 7.564 1.00 0.00 C ATOM 0 H ALA A 67 -17.150 17.104 6.752 1.00 0.00 H new ATOM 0 HA ALA A 67 -16.162 15.815 9.097 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -13.989 16.407 8.140 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -15.073 15.723 6.906 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -14.788 17.478 6.966 1.00 0.00 H new ATOM 1118 N LEU A 68 -16.054 19.098 8.987 1.00 0.00 N ATOM 1119 CA LEU A 68 -15.899 20.288 9.806 1.00 0.00 C ATOM 1120 C LEU A 68 -16.867 20.217 10.989 1.00 0.00 C ATOM 1121 O LEU A 68 -16.563 20.707 12.075 1.00 0.00 O ATOM 1122 CB LEU A 68 -16.060 21.549 8.955 1.00 0.00 C ATOM 1123 CG LEU A 68 -14.810 22.017 8.207 1.00 0.00 C ATOM 1124 CD1 LEU A 68 -15.174 22.997 7.090 1.00 0.00 C ATOM 1125 CD2 LEU A 68 -13.780 22.606 9.173 1.00 0.00 C ATOM 0 H LEU A 68 -16.293 19.280 8.012 1.00 0.00 H new ATOM 0 HA LEU A 68 -14.892 20.337 10.220 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -16.851 21.373 8.226 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -16.397 22.359 9.602 1.00 0.00 H new ATOM 0 HG LEU A 68 -14.349 21.149 7.736 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -14.267 23.314 6.574 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -15.843 22.509 6.381 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -15.671 23.868 7.518 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -12.902 22.931 8.615 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -14.215 23.459 9.693 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -13.488 21.848 9.900 1.00 0.00 H new ATOM 1137 N LEU A 69 -18.014 19.602 10.737 1.00 0.00 N ATOM 1138 CA LEU A 69 -19.028 19.460 11.768 1.00 0.00 C ATOM 1139 C LEU A 69 -18.488 18.572 12.891 1.00 0.00 C ATOM 1140 O LEU A 69 -18.816 18.773 14.059 1.00 0.00 O ATOM 1141 CB LEU A 69 -20.340 18.956 11.163 1.00 0.00 C ATOM 1142 CG LEU A 69 -21.223 20.016 10.499 1.00 0.00 C ATOM 1143 CD1 LEU A 69 -21.653 19.572 9.100 1.00 0.00 C ATOM 1144 CD2 LEU A 69 -22.421 20.364 11.384 1.00 0.00 C ATOM 0 H LEU A 69 -18.263 19.197 9.835 1.00 0.00 H new ATOM 0 HA LEU A 69 -19.259 20.429 12.211 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -20.106 18.191 10.423 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -20.918 18.471 11.950 1.00 0.00 H new ATOM 0 HG LEU A 69 -20.635 20.926 10.381 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -22.279 20.342 8.650 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -20.770 19.415 8.481 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -22.217 18.642 9.171 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -23.032 21.119 10.889 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -23.019 19.469 11.556 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -22.067 20.752 12.339 1.00 0.00 H new ATOM 1156 N ILE A 70 -17.668 17.608 12.496 1.00 0.00 N ATOM 1157 CA ILE A 70 -17.079 16.688 13.455 1.00 0.00 C ATOM 1158 C ILE A 70 -15.970 17.405 14.227 1.00 0.00 C ATOM 1159 O ILE A 70 -15.875 17.276 15.447 1.00 0.00 O ATOM 1160 CB ILE A 70 -16.614 15.410 12.754 1.00 0.00 C ATOM 1161 CG1 ILE A 70 -17.791 14.682 12.103 1.00 0.00 C ATOM 1162 CG2 ILE A 70 -15.844 14.506 13.719 1.00 0.00 C ATOM 1163 CD1 ILE A 70 -17.413 14.159 10.716 1.00 0.00 C ATOM 0 H ILE A 70 -17.398 17.444 11.526 1.00 0.00 H new ATOM 0 HA ILE A 70 -17.823 16.370 14.186 1.00 0.00 H new ATOM 0 HB ILE A 70 -15.927 15.689 11.955 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -18.104 13.852 12.736 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -18.641 15.359 12.021 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -15.524 13.604 13.196 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -14.969 15.037 14.095 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -16.489 14.232 14.554 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -18.268 13.646 10.275 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -17.123 14.994 10.079 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -16.578 13.464 10.804 1.00 0.00 H new ATOM 1175 N ASP A 71 -15.159 18.145 13.485 1.00 0.00 N ATOM 1176 CA ASP A 71 -14.060 18.882 14.085 1.00 0.00 C ATOM 1177 C ASP A 71 -13.757 20.118 13.236 1.00 0.00 C ATOM 1178 O ASP A 71 -13.288 19.999 12.105 1.00 0.00 O ATOM 1179 CB ASP A 71 -12.792 18.028 14.146 1.00 0.00 C ATOM 1180 CG ASP A 71 -11.900 18.280 15.363 1.00 0.00 C ATOM 1181 OD1 ASP A 71 -12.053 19.288 16.070 1.00 0.00 O ATOM 1182 OD2 ASP A 71 -11.004 17.378 15.579 1.00 0.00 O ATOM 0 H ASP A 71 -15.241 18.250 12.474 1.00 0.00 H new ATOM 0 HA ASP A 71 -14.355 19.163 15.096 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -13.079 16.977 14.137 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -12.208 18.207 13.243 1.00 0.00 H new ATOM 1187 N PRO A 72 -14.044 21.307 13.829 1.00 0.00 N ATOM 1188 CA PRO A 72 -13.808 22.564 13.139 1.00 0.00 C ATOM 1189 C PRO A 72 -12.315 22.901 13.109 1.00 0.00 C ATOM 1190 O PRO A 72 -11.904 23.855 12.452 1.00 0.00 O ATOM 1191 CB PRO A 72 -14.633 23.591 13.898 1.00 0.00 C ATOM 1192 CG PRO A 72 -14.929 22.968 15.253 1.00 0.00 C ATOM 1193 CD PRO A 72 -14.600 21.487 15.167 1.00 0.00 C ATOM 0 HA PRO A 72 -14.105 22.530 12.091 1.00 0.00 H new ATOM 0 HB2 PRO A 72 -14.085 24.527 14.010 1.00 0.00 H new ATOM 0 HB3 PRO A 72 -15.555 23.823 13.365 1.00 0.00 H new ATOM 0 HG2 PRO A 72 -14.334 23.447 16.031 1.00 0.00 H new ATOM 0 HG3 PRO A 72 -15.976 23.112 15.519 1.00 0.00 H new ATOM 0 HD2 PRO A 72 -13.884 21.195 15.936 1.00 0.00 H new ATOM 0 HD3 PRO A 72 -15.490 20.875 15.311 1.00 0.00 H new ATOM 1201 N LYS A 73 -11.546 22.098 13.829 1.00 0.00 N ATOM 1202 CA LYS A 73 -10.108 22.298 13.893 1.00 0.00 C ATOM 1203 C LYS A 73 -9.453 21.654 12.669 1.00 0.00 C ATOM 1204 O LYS A 73 -8.254 21.814 12.447 1.00 0.00 O ATOM 1205 CB LYS A 73 -9.555 21.790 15.226 1.00 0.00 C ATOM 1206 CG LYS A 73 -10.550 22.036 16.362 1.00 0.00 C ATOM 1207 CD LYS A 73 -9.893 21.808 17.725 1.00 0.00 C ATOM 1208 CE LYS A 73 -10.254 22.929 18.702 1.00 0.00 C ATOM 1209 NZ LYS A 73 -10.646 22.367 20.013 1.00 0.00 N ATOM 0 H LYS A 73 -11.891 21.307 14.373 1.00 0.00 H new ATOM 0 HA LYS A 73 -9.869 23.361 13.860 1.00 0.00 H new ATOM 0 HB2 LYS A 73 -9.339 20.724 15.152 1.00 0.00 H new ATOM 0 HB3 LYS A 73 -8.613 22.292 15.448 1.00 0.00 H new ATOM 0 HG2 LYS A 73 -10.930 23.056 16.303 1.00 0.00 H new ATOM 0 HG3 LYS A 73 -11.406 21.370 16.251 1.00 0.00 H new ATOM 0 HD2 LYS A 73 -10.214 20.849 18.132 1.00 0.00 H new ATOM 0 HD3 LYS A 73 -8.811 21.758 17.607 1.00 0.00 H new ATOM 0 HE2 LYS A 73 -9.403 23.599 18.827 1.00 0.00 H new ATOM 0 HE3 LYS A 73 -11.072 23.524 18.296 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 -10.888 23.141 20.664 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 -11.471 21.746 19.892 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 -9.855 21.818 20.406 1.00 0.00 H new ATOM 1222 N LYS A 74 -10.269 20.940 11.908 1.00 0.00 N ATOM 1223 CA LYS A 74 -9.784 20.271 10.713 1.00 0.00 C ATOM 1224 C LYS A 74 -9.344 21.320 9.690 1.00 0.00 C ATOM 1225 O LYS A 74 -10.040 21.561 8.704 1.00 0.00 O ATOM 1226 CB LYS A 74 -10.835 19.296 10.181 1.00 0.00 C ATOM 1227 CG LYS A 74 -10.183 18.006 9.678 1.00 0.00 C ATOM 1228 CD LYS A 74 -9.382 17.327 10.791 1.00 0.00 C ATOM 1229 CE LYS A 74 -9.499 15.805 10.700 1.00 0.00 C ATOM 1230 NZ LYS A 74 -9.258 15.187 12.023 1.00 0.00 N ATOM 0 H LYS A 74 -11.263 20.810 12.096 1.00 0.00 H new ATOM 0 HA LYS A 74 -8.909 19.664 10.945 1.00 0.00 H new ATOM 0 HB2 LYS A 74 -11.551 19.062 10.969 1.00 0.00 H new ATOM 0 HB3 LYS A 74 -11.394 19.765 9.371 1.00 0.00 H new ATOM 0 HG2 LYS A 74 -10.951 17.325 9.310 1.00 0.00 H new ATOM 0 HG3 LYS A 74 -9.527 18.230 8.837 1.00 0.00 H new ATOM 0 HD2 LYS A 74 -8.334 17.620 10.720 1.00 0.00 H new ATOM 0 HD3 LYS A 74 -9.743 17.666 11.762 1.00 0.00 H new ATOM 0 HE2 LYS A 74 -10.491 15.531 10.339 1.00 0.00 H new ATOM 0 HE3 LYS A 74 -8.780 15.422 9.976 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 -9.774 14.286 12.085 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 -8.240 15.012 12.144 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 -9.590 15.828 12.771 1.00 0.00 H new ATOM 1243 N ASP A 75 -8.191 21.916 9.958 1.00 0.00 N ATOM 1244 CA ASP A 75 -7.650 22.933 9.073 1.00 0.00 C ATOM 1245 C ASP A 75 -7.616 22.391 7.643 1.00 0.00 C ATOM 1246 O ASP A 75 -7.706 23.156 6.683 1.00 0.00 O ATOM 1247 CB ASP A 75 -6.221 23.307 9.472 1.00 0.00 C ATOM 1248 CG ASP A 75 -5.390 22.159 10.048 1.00 0.00 C ATOM 1249 OD1 ASP A 75 -5.130 21.155 9.369 1.00 0.00 O ATOM 1250 OD2 ASP A 75 -4.997 22.328 11.265 1.00 0.00 O ATOM 0 H ASP A 75 -7.616 21.714 10.776 1.00 0.00 H new ATOM 0 HA ASP A 75 -8.286 23.815 9.144 1.00 0.00 H new ATOM 0 HB2 ASP A 75 -5.707 23.704 8.596 1.00 0.00 H new ATOM 0 HB3 ASP A 75 -6.263 24.110 10.208 1.00 0.00 H new ATOM 1255 N GLU A 76 -7.484 21.077 7.544 1.00 0.00 N ATOM 1256 CA GLU A 76 -7.436 20.424 6.247 1.00 0.00 C ATOM 1257 C GLU A 76 -8.799 20.513 5.557 1.00 0.00 C ATOM 1258 O GLU A 76 -8.889 20.931 4.404 1.00 0.00 O ATOM 1259 CB GLU A 76 -6.984 18.969 6.381 1.00 0.00 C ATOM 1260 CG GLU A 76 -6.762 18.335 5.007 1.00 0.00 C ATOM 1261 CD GLU A 76 -5.880 17.089 5.114 1.00 0.00 C ATOM 1262 OE1 GLU A 76 -6.412 16.097 5.746 1.00 0.00 O ATOM 1263 OE2 GLU A 76 -4.746 17.087 4.613 1.00 0.00 O ATOM 0 H GLU A 76 -7.409 20.446 8.342 1.00 0.00 H new ATOM 0 HA GLU A 76 -6.703 20.942 5.629 1.00 0.00 H new ATOM 0 HB2 GLU A 76 -6.062 18.923 6.960 1.00 0.00 H new ATOM 0 HB3 GLU A 76 -7.734 18.401 6.931 1.00 0.00 H new ATOM 0 HG2 GLU A 76 -7.723 18.068 4.566 1.00 0.00 H new ATOM 0 HG3 GLU A 76 -6.295 19.059 4.339 1.00 0.00 H new ATOM 1270 N ALA A 77 -9.826 20.113 6.293 1.00 0.00 N ATOM 1271 CA ALA A 77 -11.180 20.143 5.767 1.00 0.00 C ATOM 1272 C ALA A 77 -11.478 21.538 5.215 1.00 0.00 C ATOM 1273 O ALA A 77 -12.230 21.681 4.252 1.00 0.00 O ATOM 1274 CB ALA A 77 -12.163 19.727 6.863 1.00 0.00 C ATOM 0 H ALA A 77 -9.747 19.767 7.249 1.00 0.00 H new ATOM 0 HA ALA A 77 -11.288 19.434 4.946 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -13.179 19.750 6.468 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -11.927 18.718 7.200 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -12.085 20.417 7.703 1.00 0.00 H new ATOM 1280 N VAL A 78 -10.873 22.532 5.849 1.00 0.00 N ATOM 1281 CA VAL A 78 -11.065 23.911 5.433 1.00 0.00 C ATOM 1282 C VAL A 78 -10.279 24.165 4.145 1.00 0.00 C ATOM 1283 O VAL A 78 -10.835 24.646 3.159 1.00 0.00 O ATOM 1284 CB VAL A 78 -10.673 24.859 6.569 1.00 0.00 C ATOM 1285 CG1 VAL A 78 -10.449 26.279 6.045 1.00 0.00 C ATOM 1286 CG2 VAL A 78 -11.723 24.844 7.682 1.00 0.00 C ATOM 0 H VAL A 78 -10.250 22.410 6.647 1.00 0.00 H new ATOM 0 HA VAL A 78 -12.116 24.102 5.215 1.00 0.00 H new ATOM 0 HB VAL A 78 -9.732 24.506 6.991 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -10.172 26.933 6.872 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -9.649 26.272 5.304 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -11.366 26.646 5.585 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -11.420 25.526 8.477 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -12.685 25.161 7.279 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -11.812 23.835 8.084 1.00 0.00 H new ATOM 1296 N TRP A 79 -8.998 23.830 4.196 1.00 0.00 N ATOM 1297 CA TRP A 79 -8.130 24.016 3.046 1.00 0.00 C ATOM 1298 C TRP A 79 -8.704 23.203 1.883 1.00 0.00 C ATOM 1299 O TRP A 79 -8.804 23.701 0.763 1.00 0.00 O ATOM 1300 CB TRP A 79 -6.686 23.639 3.382 1.00 0.00 C ATOM 1301 CG TRP A 79 -5.907 23.046 2.206 1.00 0.00 C ATOM 1302 CD1 TRP A 79 -5.159 23.693 1.302 1.00 0.00 C ATOM 1303 CD2 TRP A 79 -5.830 21.652 1.841 1.00 0.00 C ATOM 1304 NE1 TRP A 79 -4.607 22.821 0.385 1.00 0.00 N ATOM 1305 CE2 TRP A 79 -5.029 21.541 0.723 1.00 0.00 C ATOM 1306 CE3 TRP A 79 -6.419 20.522 2.436 1.00 0.00 C ATOM 1307 CZ2 TRP A 79 -4.743 20.318 0.104 1.00 0.00 C ATOM 1308 CZ3 TRP A 79 -6.123 19.308 1.805 1.00 0.00 C ATOM 1309 CH2 TRP A 79 -5.318 19.179 0.679 1.00 0.00 C ATOM 0 H TRP A 79 -8.541 23.431 5.016 1.00 0.00 H new ATOM 0 HA TRP A 79 -8.097 25.066 2.755 1.00 0.00 H new ATOM 0 HB2 TRP A 79 -6.164 24.526 3.740 1.00 0.00 H new ATOM 0 HB3 TRP A 79 -6.690 22.920 4.201 1.00 0.00 H new ATOM 0 HD1 TRP A 79 -5.007 24.762 1.292 1.00 0.00 H new ATOM 0 HE1 TRP A 79 -4.001 23.070 -0.397 1.00 0.00 H new ATOM 0 HE3 TRP A 79 -7.050 20.586 3.310 1.00 0.00 H new ATOM 0 HZ2 TRP A 79 -4.112 20.257 -0.771 1.00 0.00 H new ATOM 0 HZ3 TRP A 79 -6.550 18.408 2.222 1.00 0.00 H new ATOM 0 HH2 TRP A 79 -5.137 18.204 0.250 1.00 0.00 H new ATOM 1320 N CYS A 80 -9.068 21.967 2.190 1.00 0.00 N ATOM 1321 CA CYS A 80 -9.630 21.081 1.185 1.00 0.00 C ATOM 1322 C CYS A 80 -10.756 21.825 0.464 1.00 0.00 C ATOM 1323 O CYS A 80 -10.767 21.902 -0.763 1.00 0.00 O ATOM 1324 CB CYS A 80 -10.116 19.766 1.799 1.00 0.00 C ATOM 1325 SG CYS A 80 -9.191 18.360 1.080 1.00 0.00 S ATOM 0 H CYS A 80 -8.985 21.558 3.121 1.00 0.00 H new ATOM 0 HA CYS A 80 -8.858 20.807 0.465 1.00 0.00 H new ATOM 0 HB2 CYS A 80 -9.979 19.787 2.880 1.00 0.00 H new ATOM 0 HB3 CYS A 80 -11.183 19.642 1.615 1.00 0.00 H new ATOM 0 HG CYS A 80 -7.917 18.618 1.109 1.00 0.00 H new ATOM 1331 N ILE A 81 -11.675 22.354 1.258 1.00 0.00 N ATOM 1332 CA ILE A 81 -12.803 23.089 0.711 1.00 0.00 C ATOM 1333 C ILE A 81 -12.288 24.165 -0.248 1.00 0.00 C ATOM 1334 O ILE A 81 -12.907 24.432 -1.277 1.00 0.00 O ATOM 1335 CB ILE A 81 -13.681 23.638 1.837 1.00 0.00 C ATOM 1336 CG1 ILE A 81 -14.435 22.510 2.544 1.00 0.00 C ATOM 1337 CG2 ILE A 81 -14.628 24.721 1.315 1.00 0.00 C ATOM 1338 CD1 ILE A 81 -14.974 22.976 3.898 1.00 0.00 C ATOM 0 H ILE A 81 -11.662 22.288 2.276 1.00 0.00 H new ATOM 0 HA ILE A 81 -13.445 22.426 0.132 1.00 0.00 H new ATOM 0 HB ILE A 81 -13.033 24.106 2.578 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -15.260 22.170 1.917 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -13.771 21.657 2.687 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -15.241 25.095 2.135 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -14.046 25.541 0.894 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -15.272 24.300 0.543 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -15.506 22.156 4.380 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -14.145 23.292 4.531 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -15.656 23.813 3.749 1.00 0.00 H new ATOM 1350 N GLY A 82 -11.160 24.753 0.124 1.00 0.00 N ATOM 1351 CA GLY A 82 -10.555 25.793 -0.690 1.00 0.00 C ATOM 1352 C GLY A 82 -9.930 25.204 -1.956 1.00 0.00 C ATOM 1353 O GLY A 82 -10.078 25.762 -3.043 1.00 0.00 O ATOM 0 H GLY A 82 -10.650 24.529 0.978 1.00 0.00 H new ATOM 0 HA2 GLY A 82 -11.309 26.532 -0.962 1.00 0.00 H new ATOM 0 HA3 GLY A 82 -9.792 26.314 -0.112 1.00 0.00 H new ATOM 1357 N ASN A 83 -9.246 24.084 -1.774 1.00 0.00 N ATOM 1358 CA ASN A 83 -8.598 23.414 -2.889 1.00 0.00 C ATOM 1359 C ASN A 83 -9.663 22.928 -3.875 1.00 0.00 C ATOM 1360 O ASN A 83 -9.437 22.921 -5.084 1.00 0.00 O ATOM 1361 CB ASN A 83 -7.804 22.196 -2.413 1.00 0.00 C ATOM 1362 CG ASN A 83 -7.065 21.534 -3.577 1.00 0.00 C ATOM 1363 OD1 ASN A 83 -7.033 22.032 -4.690 1.00 0.00 O ATOM 1364 ND2 ASN A 83 -6.474 20.385 -3.259 1.00 0.00 N ATOM 0 H ASN A 83 -9.126 23.624 -0.872 1.00 0.00 H new ATOM 0 HA ASN A 83 -7.920 24.125 -3.362 1.00 0.00 H new ATOM 0 HB2 ASN A 83 -7.088 22.500 -1.649 1.00 0.00 H new ATOM 0 HB3 ASN A 83 -8.479 21.476 -1.949 1.00 0.00 H new ATOM 0 HD21 ASN A 83 -5.955 19.865 -3.967 1.00 0.00 H new ATOM 0 HD22 ASN A 83 -6.540 20.024 -2.307 1.00 0.00 H new ATOM 1371 N ALA A 84 -10.800 22.533 -3.321 1.00 0.00 N ATOM 1372 CA ALA A 84 -11.900 22.047 -4.137 1.00 0.00 C ATOM 1373 C ALA A 84 -12.496 23.212 -4.928 1.00 0.00 C ATOM 1374 O ALA A 84 -12.599 23.148 -6.152 1.00 0.00 O ATOM 1375 CB ALA A 84 -12.934 21.360 -3.242 1.00 0.00 C ATOM 0 H ALA A 84 -10.983 22.540 -2.318 1.00 0.00 H new ATOM 0 HA ALA A 84 -11.547 21.307 -4.856 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -13.759 20.995 -3.853 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -12.468 20.522 -2.725 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -13.312 22.073 -2.510 1.00 0.00 H new ATOM 1381 N TYR A 85 -12.874 24.251 -4.197 1.00 0.00 N ATOM 1382 CA TYR A 85 -13.458 25.429 -4.816 1.00 0.00 C ATOM 1383 C TYR A 85 -12.506 26.033 -5.851 1.00 0.00 C ATOM 1384 O TYR A 85 -12.918 26.360 -6.962 1.00 0.00 O ATOM 1385 CB TYR A 85 -13.670 26.437 -3.686 1.00 0.00 C ATOM 1386 CG TYR A 85 -14.954 26.212 -2.884 1.00 0.00 C ATOM 1387 CD1 TYR A 85 -16.115 25.841 -3.530 1.00 0.00 C ATOM 1388 CD2 TYR A 85 -14.950 26.380 -1.514 1.00 0.00 C ATOM 1389 CE1 TYR A 85 -17.323 25.629 -2.775 1.00 0.00 C ATOM 1390 CE2 TYR A 85 -16.158 26.168 -0.759 1.00 0.00 C ATOM 1391 CZ TYR A 85 -17.285 25.803 -1.427 1.00 0.00 C ATOM 1392 OH TYR A 85 -18.426 25.603 -0.714 1.00 0.00 O ATOM 0 H TYR A 85 -12.787 24.301 -3.182 1.00 0.00 H new ATOM 0 HA TYR A 85 -14.386 25.174 -5.328 1.00 0.00 H new ATOM 0 HB2 TYR A 85 -12.818 26.392 -3.008 1.00 0.00 H new ATOM 0 HB3 TYR A 85 -13.689 27.442 -4.108 1.00 0.00 H new ATOM 0 HD1 TYR A 85 -16.118 25.710 -4.602 1.00 0.00 H new ATOM 0 HD2 TYR A 85 -14.041 26.670 -1.008 1.00 0.00 H new ATOM 0 HE1 TYR A 85 -18.239 25.338 -3.269 1.00 0.00 H new ATOM 0 HE2 TYR A 85 -16.169 26.296 0.313 1.00 0.00 H new ATOM 0 HH TYR A 85 -18.250 25.762 0.237 1.00 0.00 H new ATOM 1402 N THR A 86 -11.251 26.163 -5.448 1.00 0.00 N ATOM 1403 CA THR A 86 -10.237 26.723 -6.326 1.00 0.00 C ATOM 1404 C THR A 86 -10.174 25.936 -7.637 1.00 0.00 C ATOM 1405 O THR A 86 -10.149 26.525 -8.717 1.00 0.00 O ATOM 1406 CB THR A 86 -8.910 26.741 -5.564 1.00 0.00 C ATOM 1407 OG1 THR A 86 -9.129 27.671 -4.507 1.00 0.00 O ATOM 1408 CG2 THR A 86 -7.776 27.365 -6.380 1.00 0.00 C ATOM 0 H THR A 86 -10.913 25.890 -4.525 1.00 0.00 H new ATOM 0 HA THR A 86 -10.480 27.747 -6.609 1.00 0.00 H new ATOM 0 HB THR A 86 -8.639 25.723 -5.283 1.00 0.00 H new ATOM 0 HG1 THR A 86 -9.337 27.185 -3.682 1.00 0.00 H new ATOM 0 HG21 THR A 86 -6.857 27.353 -5.794 1.00 0.00 H new ATOM 0 HG22 THR A 86 -7.630 26.793 -7.296 1.00 0.00 H new ATOM 0 HG23 THR A 86 -8.033 28.394 -6.632 1.00 0.00 H new ATOM 1416 N SER A 87 -10.151 24.619 -7.499 1.00 0.00 N ATOM 1417 CA SER A 87 -10.093 23.746 -8.659 1.00 0.00 C ATOM 1418 C SER A 87 -11.389 23.858 -9.464 1.00 0.00 C ATOM 1419 O SER A 87 -11.356 24.081 -10.673 1.00 0.00 O ATOM 1420 CB SER A 87 -9.849 22.294 -8.244 1.00 0.00 C ATOM 1421 OG SER A 87 -8.518 22.088 -7.778 1.00 0.00 O ATOM 0 H SER A 87 -10.171 24.135 -6.601 1.00 0.00 H new ATOM 0 HA SER A 87 -9.257 24.062 -9.283 1.00 0.00 H new ATOM 0 HB2 SER A 87 -10.554 22.018 -7.460 1.00 0.00 H new ATOM 0 HB3 SER A 87 -10.042 21.637 -9.092 1.00 0.00 H new ATOM 0 HG SER A 87 -8.466 22.313 -6.826 1.00 0.00 H new ATOM 1427 N PHE A 88 -12.500 23.697 -8.761 1.00 0.00 N ATOM 1428 CA PHE A 88 -13.805 23.777 -9.395 1.00 0.00 C ATOM 1429 C PHE A 88 -13.959 25.087 -10.170 1.00 0.00 C ATOM 1430 O PHE A 88 -14.612 25.123 -11.212 1.00 0.00 O ATOM 1431 CB PHE A 88 -14.849 23.734 -8.277 1.00 0.00 C ATOM 1432 CG PHE A 88 -16.295 23.757 -8.775 1.00 0.00 C ATOM 1433 CD1 PHE A 88 -16.864 24.931 -9.160 1.00 0.00 C ATOM 1434 CD2 PHE A 88 -17.013 22.603 -8.833 1.00 0.00 C ATOM 1435 CE1 PHE A 88 -18.206 24.952 -9.623 1.00 0.00 C ATOM 1436 CE2 PHE A 88 -18.356 22.624 -9.296 1.00 0.00 C ATOM 1437 CZ PHE A 88 -18.924 23.799 -9.681 1.00 0.00 C ATOM 0 H PHE A 88 -12.524 23.511 -7.758 1.00 0.00 H new ATOM 0 HA PHE A 88 -13.928 22.953 -10.098 1.00 0.00 H new ATOM 0 HB2 PHE A 88 -14.694 22.833 -7.684 1.00 0.00 H new ATOM 0 HB3 PHE A 88 -14.691 24.584 -7.613 1.00 0.00 H new ATOM 0 HD1 PHE A 88 -16.295 25.848 -9.113 1.00 0.00 H new ATOM 0 HD2 PHE A 88 -16.562 21.671 -8.527 1.00 0.00 H new ATOM 0 HE1 PHE A 88 -18.657 25.884 -9.929 1.00 0.00 H new ATOM 0 HE2 PHE A 88 -18.926 21.708 -9.342 1.00 0.00 H new ATOM 0 HZ PHE A 88 -19.945 23.816 -10.033 1.00 0.00 H new ATOM 1447 N ALA A 89 -13.345 26.131 -9.633 1.00 0.00 N ATOM 1448 CA ALA A 89 -13.405 27.439 -10.261 1.00 0.00 C ATOM 1449 C ALA A 89 -12.860 27.341 -11.687 1.00 0.00 C ATOM 1450 O ALA A 89 -13.502 27.794 -12.634 1.00 0.00 O ATOM 1451 CB ALA A 89 -12.634 28.450 -9.410 1.00 0.00 C ATOM 0 H ALA A 89 -12.803 26.097 -8.769 1.00 0.00 H new ATOM 0 HA ALA A 89 -14.436 27.787 -10.326 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -12.679 29.432 -9.881 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -13.079 28.504 -8.416 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -11.594 28.136 -9.325 1.00 0.00 H new ATOM 1457 N PHE A 90 -11.681 26.746 -11.796 1.00 0.00 N ATOM 1458 CA PHE A 90 -11.042 26.583 -13.091 1.00 0.00 C ATOM 1459 C PHE A 90 -11.958 25.839 -14.064 1.00 0.00 C ATOM 1460 O PHE A 90 -11.835 25.992 -15.279 1.00 0.00 O ATOM 1461 CB PHE A 90 -9.777 25.754 -12.864 1.00 0.00 C ATOM 1462 CG PHE A 90 -8.615 26.544 -12.258 1.00 0.00 C ATOM 1463 CD1 PHE A 90 -7.890 27.391 -13.037 1.00 0.00 C ATOM 1464 CD2 PHE A 90 -8.307 26.400 -10.942 1.00 0.00 C ATOM 1465 CE1 PHE A 90 -6.811 28.125 -12.475 1.00 0.00 C ATOM 1466 CE2 PHE A 90 -7.229 27.133 -10.380 1.00 0.00 C ATOM 1467 CZ PHE A 90 -6.504 27.980 -11.159 1.00 0.00 C ATOM 0 H PHE A 90 -11.152 26.371 -11.009 1.00 0.00 H new ATOM 0 HA PHE A 90 -10.817 27.559 -13.521 1.00 0.00 H new ATOM 0 HB2 PHE A 90 -10.016 24.918 -12.207 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -9.457 25.330 -13.816 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -8.134 27.506 -14.083 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -8.883 25.727 -10.323 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -6.235 28.798 -13.093 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -6.985 27.018 -9.334 1.00 0.00 H new ATOM 0 HZ PHE A 90 -5.684 28.538 -10.732 1.00 0.00 H new ATOM 1477 N LEU A 91 -12.856 25.048 -13.495 1.00 0.00 N ATOM 1478 CA LEU A 91 -13.792 24.280 -14.297 1.00 0.00 C ATOM 1479 C LEU A 91 -15.078 25.088 -14.487 1.00 0.00 C ATOM 1480 O LEU A 91 -16.113 24.536 -14.856 1.00 0.00 O ATOM 1481 CB LEU A 91 -14.020 22.899 -13.679 1.00 0.00 C ATOM 1482 CG LEU A 91 -12.869 22.342 -12.838 1.00 0.00 C ATOM 1483 CD1 LEU A 91 -13.205 20.950 -12.301 1.00 0.00 C ATOM 1484 CD2 LEU A 91 -11.559 22.350 -13.629 1.00 0.00 C ATOM 0 H LEU A 91 -12.955 24.923 -12.488 1.00 0.00 H new ATOM 0 HA LEU A 91 -13.381 24.096 -15.290 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -14.911 22.945 -13.053 1.00 0.00 H new ATOM 0 HB3 LEU A 91 -14.231 22.194 -14.483 1.00 0.00 H new ATOM 0 HG LEU A 91 -12.730 22.994 -11.976 1.00 0.00 H new ATOM 0 HD11 LEU A 91 -12.370 20.578 -11.707 1.00 0.00 H new ATOM 0 HD12 LEU A 91 -14.097 21.006 -11.678 1.00 0.00 H new ATOM 0 HD13 LEU A 91 -13.387 20.272 -13.135 1.00 0.00 H new ATOM 0 HD21 LEU A 91 -10.757 21.949 -13.009 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -11.669 21.735 -14.522 1.00 0.00 H new ATOM 0 HD23 LEU A 91 -11.316 23.372 -13.921 1.00 0.00 H new ATOM 1496 N THR A 92 -14.969 26.382 -14.226 1.00 0.00 N ATOM 1497 CA THR A 92 -16.110 27.271 -14.364 1.00 0.00 C ATOM 1498 C THR A 92 -15.708 28.542 -15.115 1.00 0.00 C ATOM 1499 O THR A 92 -14.856 29.298 -14.653 1.00 0.00 O ATOM 1500 CB THR A 92 -16.669 27.544 -12.966 1.00 0.00 C ATOM 1501 OG1 THR A 92 -17.796 26.677 -12.868 1.00 0.00 O ATOM 1502 CG2 THR A 92 -17.264 28.947 -12.836 1.00 0.00 C ATOM 0 H THR A 92 -14.109 26.836 -13.920 1.00 0.00 H new ATOM 0 HA THR A 92 -16.898 26.812 -14.962 1.00 0.00 H new ATOM 0 HB THR A 92 -15.877 27.417 -12.227 1.00 0.00 H new ATOM 0 HG1 THR A 92 -17.827 26.280 -11.972 1.00 0.00 H new ATOM 0 HG21 THR A 92 -17.646 29.088 -11.825 1.00 0.00 H new ATOM 0 HG22 THR A 92 -16.492 29.690 -13.039 1.00 0.00 H new ATOM 0 HG23 THR A 92 -18.078 29.065 -13.551 1.00 0.00 H new ATOM 1510 N PRO A 93 -16.359 28.743 -16.293 1.00 0.00 N ATOM 1511 CA PRO A 93 -16.078 29.909 -17.113 1.00 0.00 C ATOM 1512 C PRO A 93 -16.707 31.167 -16.511 1.00 0.00 C ATOM 1513 O PRO A 93 -16.239 32.278 -16.757 1.00 0.00 O ATOM 1514 CB PRO A 93 -16.632 29.567 -18.486 1.00 0.00 C ATOM 1515 CG PRO A 93 -17.610 28.423 -18.268 1.00 0.00 C ATOM 1516 CD PRO A 93 -17.374 27.869 -16.872 1.00 0.00 C ATOM 0 HA PRO A 93 -15.013 30.135 -17.173 1.00 0.00 H new ATOM 0 HB2 PRO A 93 -17.131 30.428 -18.931 1.00 0.00 H new ATOM 0 HB3 PRO A 93 -15.833 29.274 -19.167 1.00 0.00 H new ATOM 0 HG2 PRO A 93 -18.637 28.774 -18.371 1.00 0.00 H new ATOM 0 HG3 PRO A 93 -17.462 27.646 -19.018 1.00 0.00 H new ATOM 0 HD2 PRO A 93 -18.290 27.881 -16.281 1.00 0.00 H new ATOM 0 HD3 PRO A 93 -17.032 26.835 -16.909 1.00 0.00 H new ATOM 1524 N ASP A 94 -17.757 30.951 -15.734 1.00 0.00 N ATOM 1525 CA ASP A 94 -18.455 32.054 -15.095 1.00 0.00 C ATOM 1526 C ASP A 94 -17.489 32.794 -14.167 1.00 0.00 C ATOM 1527 O ASP A 94 -17.431 32.510 -12.972 1.00 0.00 O ATOM 1528 CB ASP A 94 -19.627 31.549 -14.251 1.00 0.00 C ATOM 1529 CG ASP A 94 -20.898 31.225 -15.038 1.00 0.00 C ATOM 1530 OD1 ASP A 94 -20.945 30.249 -15.803 1.00 0.00 O ATOM 1531 OD2 ASP A 94 -21.884 32.033 -14.839 1.00 0.00 O ATOM 0 H ASP A 94 -18.142 30.028 -15.532 1.00 0.00 H new ATOM 0 HA ASP A 94 -18.831 32.713 -15.877 1.00 0.00 H new ATOM 0 HB2 ASP A 94 -19.311 30.653 -13.716 1.00 0.00 H new ATOM 0 HB3 ASP A 94 -19.865 32.302 -13.499 1.00 0.00 H new ATOM 1536 N GLU A 95 -16.755 33.728 -14.753 1.00 0.00 N ATOM 1537 CA GLU A 95 -15.794 34.510 -13.995 1.00 0.00 C ATOM 1538 C GLU A 95 -16.361 34.856 -12.616 1.00 0.00 C ATOM 1539 O GLU A 95 -15.685 34.688 -11.603 1.00 0.00 O ATOM 1540 CB GLU A 95 -15.394 35.776 -14.756 1.00 0.00 C ATOM 1541 CG GLU A 95 -14.661 35.427 -16.053 1.00 0.00 C ATOM 1542 CD GLU A 95 -14.392 36.682 -16.885 1.00 0.00 C ATOM 1543 OE1 GLU A 95 -15.117 37.680 -16.755 1.00 0.00 O ATOM 1544 OE2 GLU A 95 -13.387 36.598 -17.690 1.00 0.00 O ATOM 0 H GLU A 95 -16.807 33.961 -15.745 1.00 0.00 H new ATOM 0 HA GLU A 95 -14.895 33.909 -13.857 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -16.283 36.364 -14.983 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -14.754 36.396 -14.128 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -13.718 34.932 -15.820 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -15.257 34.722 -16.633 1.00 0.00 H new ATOM 1551 N THR A 96 -17.598 35.332 -12.623 1.00 0.00 N ATOM 1552 CA THR A 96 -18.263 35.703 -11.386 1.00 0.00 C ATOM 1553 C THR A 96 -18.211 34.547 -10.385 1.00 0.00 C ATOM 1554 O THR A 96 -17.781 34.725 -9.247 1.00 0.00 O ATOM 1555 CB THR A 96 -19.687 36.145 -11.729 1.00 0.00 C ATOM 1556 OG1 THR A 96 -20.195 36.663 -10.503 1.00 0.00 O ATOM 1557 CG2 THR A 96 -20.607 34.964 -12.045 1.00 0.00 C ATOM 0 H THR A 96 -18.156 35.469 -13.465 1.00 0.00 H new ATOM 0 HA THR A 96 -17.756 36.536 -10.899 1.00 0.00 H new ATOM 0 HB THR A 96 -19.661 36.822 -12.582 1.00 0.00 H new ATOM 0 HG1 THR A 96 -21.115 36.974 -10.635 1.00 0.00 H new ATOM 0 HG21 THR A 96 -21.605 35.333 -12.282 1.00 0.00 H new ATOM 0 HG22 THR A 96 -20.212 34.413 -12.899 1.00 0.00 H new ATOM 0 HG23 THR A 96 -20.660 34.303 -11.180 1.00 0.00 H new ATOM 1565 N GLU A 97 -18.656 33.387 -10.846 1.00 0.00 N ATOM 1566 CA GLU A 97 -18.665 32.201 -10.005 1.00 0.00 C ATOM 1567 C GLU A 97 -17.234 31.742 -9.720 1.00 0.00 C ATOM 1568 O GLU A 97 -16.876 31.491 -8.570 1.00 0.00 O ATOM 1569 CB GLU A 97 -19.483 31.080 -10.649 1.00 0.00 C ATOM 1570 CG GLU A 97 -20.967 31.447 -10.706 1.00 0.00 C ATOM 1571 CD GLU A 97 -21.842 30.261 -10.293 1.00 0.00 C ATOM 1572 OE1 GLU A 97 -21.602 29.651 -9.241 1.00 0.00 O ATOM 1573 OE2 GLU A 97 -22.800 29.980 -11.109 1.00 0.00 O ATOM 0 H GLU A 97 -19.013 33.243 -11.791 1.00 0.00 H new ATOM 0 HA GLU A 97 -19.140 32.454 -9.057 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -19.113 30.888 -11.656 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -19.354 30.159 -10.081 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -21.161 32.294 -10.047 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -21.229 31.762 -11.716 1.00 0.00 H new ATOM 1580 N ALA A 98 -16.453 31.647 -10.786 1.00 0.00 N ATOM 1581 CA ALA A 98 -15.069 31.222 -10.665 1.00 0.00 C ATOM 1582 C ALA A 98 -14.358 32.105 -9.636 1.00 0.00 C ATOM 1583 O ALA A 98 -13.747 31.599 -8.696 1.00 0.00 O ATOM 1584 CB ALA A 98 -14.397 31.271 -12.038 1.00 0.00 C ATOM 0 H ALA A 98 -16.753 31.857 -11.738 1.00 0.00 H new ATOM 0 HA ALA A 98 -15.013 30.192 -10.312 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -13.359 30.952 -11.947 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -14.922 30.606 -12.724 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -14.431 32.290 -12.424 1.00 0.00 H new ATOM 1590 N LYS A 99 -14.462 33.408 -9.850 1.00 0.00 N ATOM 1591 CA LYS A 99 -13.837 34.366 -8.954 1.00 0.00 C ATOM 1592 C LYS A 99 -14.412 34.192 -7.547 1.00 0.00 C ATOM 1593 O LYS A 99 -13.666 34.050 -6.580 1.00 0.00 O ATOM 1594 CB LYS A 99 -13.977 35.786 -9.505 1.00 0.00 C ATOM 1595 CG LYS A 99 -13.112 36.769 -8.713 1.00 0.00 C ATOM 1596 CD LYS A 99 -13.334 38.205 -9.193 1.00 0.00 C ATOM 1597 CE LYS A 99 -12.070 39.047 -9.009 1.00 0.00 C ATOM 1598 NZ LYS A 99 -12.215 39.953 -7.848 1.00 0.00 N ATOM 0 H LYS A 99 -14.970 33.823 -10.631 1.00 0.00 H new ATOM 0 HA LYS A 99 -12.765 34.181 -8.886 1.00 0.00 H new ATOM 0 HB2 LYS A 99 -13.685 35.803 -10.555 1.00 0.00 H new ATOM 0 HB3 LYS A 99 -15.021 36.096 -9.460 1.00 0.00 H new ATOM 0 HG2 LYS A 99 -13.350 36.696 -7.652 1.00 0.00 H new ATOM 0 HG3 LYS A 99 -12.060 36.504 -8.823 1.00 0.00 H new ATOM 0 HD2 LYS A 99 -13.622 38.200 -10.244 1.00 0.00 H new ATOM 0 HD3 LYS A 99 -14.158 38.654 -8.639 1.00 0.00 H new ATOM 0 HE2 LYS A 99 -11.209 38.394 -8.863 1.00 0.00 H new ATOM 0 HE3 LYS A 99 -11.879 39.629 -9.911 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 -11.348 40.517 -7.737 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 -13.024 40.588 -8.002 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 -12.375 39.391 -6.987 1.00 0.00 H new ATOM 1611 N HIS A 100 -15.736 34.209 -7.477 1.00 0.00 N ATOM 1612 CA HIS A 100 -16.420 34.055 -6.205 1.00 0.00 C ATOM 1613 C HIS A 100 -15.859 32.841 -5.463 1.00 0.00 C ATOM 1614 O HIS A 100 -15.613 32.903 -4.260 1.00 0.00 O ATOM 1615 CB HIS A 100 -17.934 33.978 -6.409 1.00 0.00 C ATOM 1616 CG HIS A 100 -18.659 33.198 -5.337 1.00 0.00 C ATOM 1617 ND1 HIS A 100 -18.443 31.944 -4.848 1.00 0.00 N flip ATOM 1618 CD2 HIS A 100 -19.745 33.706 -4.646 1.00 0.00 C flip ATOM 1619 CE1 HIS A 100 -19.347 31.699 -3.907 1.00 0.00 C flip ATOM 1620 NE2 HIS A 100 -20.155 32.791 -3.780 1.00 0.00 N flip ATOM 0 H HIS A 100 -16.352 34.327 -8.281 1.00 0.00 H new ATOM 0 HA HIS A 100 -16.239 34.932 -5.583 1.00 0.00 H new ATOM 0 HB2 HIS A 100 -18.338 34.990 -6.444 1.00 0.00 H new ATOM 0 HB3 HIS A 100 -18.137 33.520 -7.377 1.00 0.00 H new ATOM 0 HD2 HIS A 100 -20.184 34.682 -4.788 1.00 0.00 H new ATOM 0 HE1 HIS A 100 -19.429 30.786 -3.336 1.00 0.00 H new ATOM 0 HE2 HIS A 100 -20.937 32.886 -3.132 1.00 0.00 H new ATOM 1628 N ASN A 101 -15.672 31.764 -6.213 1.00 0.00 N ATOM 1629 CA ASN A 101 -15.145 30.537 -5.642 1.00 0.00 C ATOM 1630 C ASN A 101 -13.730 30.790 -5.118 1.00 0.00 C ATOM 1631 O ASN A 101 -13.449 30.563 -3.942 1.00 0.00 O ATOM 1632 CB ASN A 101 -15.068 29.428 -6.693 1.00 0.00 C ATOM 1633 CG ASN A 101 -16.247 28.462 -6.559 1.00 0.00 C ATOM 1634 OD1 ASN A 101 -16.422 27.990 -5.328 1.00 0.00 O flip ATOM 1635 ND2 ASN A 101 -16.951 28.165 -7.510 1.00 0.00 N flip ATOM 0 H ASN A 101 -15.876 31.717 -7.211 1.00 0.00 H new ATOM 0 HA ASN A 101 -15.812 30.226 -4.838 1.00 0.00 H new ATOM 0 HB2 ASN A 101 -15.065 29.867 -7.691 1.00 0.00 H new ATOM 0 HB3 ASN A 101 -14.131 28.882 -6.582 1.00 0.00 H new ATOM 0 HD21 ASN A 101 -16.761 28.564 -8.429 1.00 0.00 H new ATOM 0 HD22 ASN A 101 -17.729 27.518 -7.386 1.00 0.00 H new ATOM 1642 N PHE A 102 -12.875 31.258 -6.016 1.00 0.00 N ATOM 1643 CA PHE A 102 -11.497 31.545 -5.659 1.00 0.00 C ATOM 1644 C PHE A 102 -11.426 32.428 -4.411 1.00 0.00 C ATOM 1645 O PHE A 102 -10.589 32.208 -3.538 1.00 0.00 O ATOM 1646 CB PHE A 102 -10.877 32.299 -6.838 1.00 0.00 C ATOM 1647 CG PHE A 102 -10.202 31.393 -7.870 1.00 0.00 C ATOM 1648 CD1 PHE A 102 -9.051 30.741 -7.553 1.00 0.00 C ATOM 1649 CD2 PHE A 102 -10.753 31.239 -9.104 1.00 0.00 C ATOM 1650 CE1 PHE A 102 -8.425 29.900 -8.511 1.00 0.00 C ATOM 1651 CE2 PHE A 102 -10.127 30.398 -10.061 1.00 0.00 C ATOM 1652 CZ PHE A 102 -8.976 29.746 -9.745 1.00 0.00 C ATOM 0 H PHE A 102 -13.111 31.445 -6.991 1.00 0.00 H new ATOM 0 HA PHE A 102 -10.967 30.617 -5.445 1.00 0.00 H new ATOM 0 HB2 PHE A 102 -11.654 32.881 -7.333 1.00 0.00 H new ATOM 0 HB3 PHE A 102 -10.142 33.008 -6.457 1.00 0.00 H new ATOM 0 HD1 PHE A 102 -8.613 30.863 -6.573 1.00 0.00 H new ATOM 0 HD2 PHE A 102 -11.667 31.757 -9.356 1.00 0.00 H new ATOM 0 HE1 PHE A 102 -7.511 29.382 -8.260 1.00 0.00 H new ATOM 0 HE2 PHE A 102 -10.565 30.276 -11.041 1.00 0.00 H new ATOM 0 HZ PHE A 102 -8.500 29.106 -10.473 1.00 0.00 H new ATOM 1662 N ASP A 103 -12.315 33.409 -4.368 1.00 0.00 N ATOM 1663 CA ASP A 103 -12.364 34.326 -3.242 1.00 0.00 C ATOM 1664 C ASP A 103 -12.940 33.600 -2.024 1.00 0.00 C ATOM 1665 O ASP A 103 -12.737 34.029 -0.889 1.00 0.00 O ATOM 1666 CB ASP A 103 -13.264 35.525 -3.547 1.00 0.00 C ATOM 1667 CG ASP A 103 -13.142 36.691 -2.564 1.00 0.00 C ATOM 1668 OD1 ASP A 103 -13.538 36.436 -1.363 1.00 0.00 O ATOM 1669 OD2 ASP A 103 -12.692 37.788 -2.927 1.00 0.00 O ATOM 0 H ASP A 103 -13.007 33.589 -5.095 1.00 0.00 H new ATOM 0 HA ASP A 103 -11.350 34.676 -3.048 1.00 0.00 H new ATOM 0 HB2 ASP A 103 -13.033 35.888 -4.549 1.00 0.00 H new ATOM 0 HB3 ASP A 103 -14.301 35.188 -3.561 1.00 0.00 H new ATOM 1674 N LEU A 104 -13.646 32.514 -2.301 1.00 0.00 N ATOM 1675 CA LEU A 104 -14.252 31.725 -1.242 1.00 0.00 C ATOM 1676 C LEU A 104 -13.176 30.872 -0.568 1.00 0.00 C ATOM 1677 O LEU A 104 -13.081 30.842 0.658 1.00 0.00 O ATOM 1678 CB LEU A 104 -15.429 30.913 -1.786 1.00 0.00 C ATOM 1679 CG LEU A 104 -16.580 30.663 -0.809 1.00 0.00 C ATOM 1680 CD1 LEU A 104 -17.282 29.339 -1.115 1.00 0.00 C ATOM 1681 CD2 LEU A 104 -16.094 30.733 0.640 1.00 0.00 C ATOM 0 H LEU A 104 -13.812 32.162 -3.244 1.00 0.00 H new ATOM 0 HA LEU A 104 -14.671 32.375 -0.474 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -15.826 31.428 -2.661 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -15.053 29.949 -2.127 1.00 0.00 H new ATOM 0 HG LEU A 104 -17.317 31.455 -0.940 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -18.096 29.186 -0.406 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -17.684 29.366 -2.128 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -16.568 28.520 -1.029 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -16.931 30.552 1.314 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -15.327 29.976 0.803 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -15.677 31.721 0.837 1.00 0.00 H new ATOM 1693 N ALA A 105 -12.391 30.201 -1.398 1.00 0.00 N ATOM 1694 CA ALA A 105 -11.326 29.350 -0.897 1.00 0.00 C ATOM 1695 C ALA A 105 -10.346 30.194 -0.080 1.00 0.00 C ATOM 1696 O ALA A 105 -9.646 29.673 0.787 1.00 0.00 O ATOM 1697 CB ALA A 105 -10.646 28.639 -2.069 1.00 0.00 C ATOM 0 H ALA A 105 -12.472 30.230 -2.414 1.00 0.00 H new ATOM 0 HA ALA A 105 -11.728 28.581 -0.238 1.00 0.00 H new ATOM 0 HB1 ALA A 105 -9.847 28.000 -1.693 1.00 0.00 H new ATOM 0 HB2 ALA A 105 -11.378 28.030 -2.599 1.00 0.00 H new ATOM 0 HB3 ALA A 105 -10.228 29.380 -2.751 1.00 0.00 H new ATOM 1703 N THR A 106 -10.328 31.483 -0.385 1.00 0.00 N ATOM 1704 CA THR A 106 -9.446 32.404 0.311 1.00 0.00 C ATOM 1705 C THR A 106 -9.810 32.474 1.795 1.00 0.00 C ATOM 1706 O THR A 106 -8.961 32.255 2.657 1.00 0.00 O ATOM 1707 CB THR A 106 -9.522 33.758 -0.398 1.00 0.00 C ATOM 1708 OG1 THR A 106 -8.634 33.623 -1.503 1.00 0.00 O ATOM 1709 CG2 THR A 106 -8.913 34.889 0.433 1.00 0.00 C ATOM 0 H THR A 106 -10.910 31.911 -1.105 1.00 0.00 H new ATOM 0 HA THR A 106 -8.412 32.061 0.279 1.00 0.00 H new ATOM 0 HB THR A 106 -10.563 33.992 -0.622 1.00 0.00 H new ATOM 0 HG1 THR A 106 -9.100 33.185 -2.246 1.00 0.00 H new ATOM 0 HG21 THR A 106 -8.993 35.827 -0.116 1.00 0.00 H new ATOM 0 HG22 THR A 106 -9.449 34.975 1.378 1.00 0.00 H new ATOM 0 HG23 THR A 106 -7.863 34.672 0.629 1.00 0.00 H new ATOM 1717 N GLN A 107 -11.074 32.779 2.047 1.00 0.00 N ATOM 1718 CA GLN A 107 -11.562 32.881 3.413 1.00 0.00 C ATOM 1719 C GLN A 107 -11.309 31.572 4.165 1.00 0.00 C ATOM 1720 O GLN A 107 -11.244 31.561 5.393 1.00 0.00 O ATOM 1721 CB GLN A 107 -13.046 33.250 3.439 1.00 0.00 C ATOM 1722 CG GLN A 107 -13.909 32.090 2.939 1.00 0.00 C ATOM 1723 CD GLN A 107 -15.136 31.895 3.833 1.00 0.00 C ATOM 1724 OE1 GLN A 107 -15.092 31.231 4.855 1.00 0.00 O ATOM 1725 NE2 GLN A 107 -16.230 32.509 3.391 1.00 0.00 N ATOM 0 H GLN A 107 -11.776 32.959 1.329 1.00 0.00 H new ATOM 0 HA GLN A 107 -11.015 33.678 3.916 1.00 0.00 H new ATOM 0 HB2 GLN A 107 -13.340 33.516 4.454 1.00 0.00 H new ATOM 0 HB3 GLN A 107 -13.217 34.129 2.817 1.00 0.00 H new ATOM 0 HG2 GLN A 107 -14.228 32.284 1.915 1.00 0.00 H new ATOM 0 HG3 GLN A 107 -13.318 31.174 2.921 1.00 0.00 H new ATOM 0 HE21 GLN A 107 -16.197 33.049 2.527 1.00 0.00 H new ATOM 0 HE22 GLN A 107 -17.101 32.439 3.917 1.00 0.00 H new ATOM 1734 N PHE A 108 -11.173 30.502 3.396 1.00 0.00 N ATOM 1735 CA PHE A 108 -10.929 29.192 3.974 1.00 0.00 C ATOM 1736 C PHE A 108 -9.445 29.003 4.298 1.00 0.00 C ATOM 1737 O PHE A 108 -9.096 28.568 5.394 1.00 0.00 O ATOM 1738 CB PHE A 108 -11.347 28.156 2.928 1.00 0.00 C ATOM 1739 CG PHE A 108 -12.827 27.773 2.989 1.00 0.00 C ATOM 1740 CD1 PHE A 108 -13.311 27.098 4.066 1.00 0.00 C ATOM 1741 CD2 PHE A 108 -13.658 28.106 1.965 1.00 0.00 C ATOM 1742 CE1 PHE A 108 -14.684 26.742 4.122 1.00 0.00 C ATOM 1743 CE2 PHE A 108 -15.031 27.750 2.021 1.00 0.00 C ATOM 1744 CZ PHE A 108 -15.516 27.076 3.099 1.00 0.00 C ATOM 0 H PHE A 108 -11.227 30.516 2.378 1.00 0.00 H new ATOM 0 HA PHE A 108 -11.492 29.084 4.901 1.00 0.00 H new ATOM 0 HB2 PHE A 108 -11.124 28.547 1.935 1.00 0.00 H new ATOM 0 HB3 PHE A 108 -10.744 27.258 3.060 1.00 0.00 H new ATOM 0 HD1 PHE A 108 -12.651 26.833 4.879 1.00 0.00 H new ATOM 0 HD2 PHE A 108 -13.273 28.641 1.109 1.00 0.00 H new ATOM 0 HE1 PHE A 108 -15.068 26.206 4.977 1.00 0.00 H new ATOM 0 HE2 PHE A 108 -15.691 28.014 1.208 1.00 0.00 H new ATOM 0 HZ PHE A 108 -16.561 26.806 3.142 1.00 0.00 H new ATOM 1754 N PHE A 109 -8.613 29.339 3.323 1.00 0.00 N ATOM 1755 CA PHE A 109 -7.175 29.212 3.490 1.00 0.00 C ATOM 1756 C PHE A 109 -6.702 29.947 4.746 1.00 0.00 C ATOM 1757 O PHE A 109 -5.798 29.482 5.438 1.00 0.00 O ATOM 1758 CB PHE A 109 -6.524 29.851 2.263 1.00 0.00 C ATOM 1759 CG PHE A 109 -6.914 29.194 0.937 1.00 0.00 C ATOM 1760 CD1 PHE A 109 -7.211 27.867 0.898 1.00 0.00 C ATOM 1761 CD2 PHE A 109 -6.964 29.936 -0.201 1.00 0.00 C ATOM 1762 CE1 PHE A 109 -7.573 27.257 -0.332 1.00 0.00 C ATOM 1763 CE2 PHE A 109 -7.327 29.325 -1.431 1.00 0.00 C ATOM 1764 CZ PHE A 109 -7.623 27.999 -1.470 1.00 0.00 C ATOM 0 H PHE A 109 -8.907 29.699 2.415 1.00 0.00 H new ATOM 0 HA PHE A 109 -6.904 28.161 3.593 1.00 0.00 H new ATOM 0 HB2 PHE A 109 -6.797 30.906 2.228 1.00 0.00 H new ATOM 0 HB3 PHE A 109 -5.441 29.805 2.374 1.00 0.00 H new ATOM 0 HD1 PHE A 109 -7.171 27.278 1.802 1.00 0.00 H new ATOM 0 HD2 PHE A 109 -6.728 30.989 -0.170 1.00 0.00 H new ATOM 0 HE1 PHE A 109 -7.809 26.203 -0.364 1.00 0.00 H new ATOM 0 HE2 PHE A 109 -7.368 29.914 -2.335 1.00 0.00 H new ATOM 0 HZ PHE A 109 -7.898 27.535 -2.405 1.00 0.00 H new ATOM 1774 N GLN A 110 -7.333 31.084 5.000 1.00 0.00 N ATOM 1775 CA GLN A 110 -6.988 31.889 6.160 1.00 0.00 C ATOM 1776 C GLN A 110 -7.106 31.056 7.438 1.00 0.00 C ATOM 1777 O GLN A 110 -6.393 31.300 8.410 1.00 0.00 O ATOM 1778 CB GLN A 110 -7.864 33.141 6.239 1.00 0.00 C ATOM 1779 CG GLN A 110 -7.052 34.398 5.922 1.00 0.00 C ATOM 1780 CD GLN A 110 -6.163 34.789 7.104 1.00 0.00 C ATOM 1781 OE1 GLN A 110 -4.941 34.267 7.059 1.00 0.00 O flip ATOM 1782 NE2 GLN A 110 -6.561 35.518 7.999 1.00 0.00 N flip ATOM 0 H GLN A 110 -8.081 31.467 4.422 1.00 0.00 H new ATOM 0 HA GLN A 110 -5.953 32.216 6.056 1.00 0.00 H new ATOM 0 HB2 GLN A 110 -8.694 33.053 5.538 1.00 0.00 H new ATOM 0 HB3 GLN A 110 -8.296 33.225 7.236 1.00 0.00 H new ATOM 0 HG2 GLN A 110 -6.435 34.224 5.040 1.00 0.00 H new ATOM 0 HG3 GLN A 110 -7.726 35.220 5.682 1.00 0.00 H new ATOM 0 HE21 GLN A 110 -7.512 35.885 7.973 1.00 0.00 H new ATOM 0 HE22 GLN A 110 -5.942 35.760 8.773 1.00 0.00 H new ATOM 1791 N GLN A 111 -8.010 30.089 7.395 1.00 0.00 N ATOM 1792 CA GLN A 111 -8.230 29.218 8.537 1.00 0.00 C ATOM 1793 C GLN A 111 -7.168 28.118 8.578 1.00 0.00 C ATOM 1794 O GLN A 111 -6.634 27.805 9.641 1.00 0.00 O ATOM 1795 CB GLN A 111 -9.638 28.621 8.508 1.00 0.00 C ATOM 1796 CG GLN A 111 -10.677 29.683 8.144 1.00 0.00 C ATOM 1797 CD GLN A 111 -12.076 29.070 8.041 1.00 0.00 C ATOM 1798 OE1 GLN A 111 -12.488 28.260 8.855 1.00 0.00 O ATOM 1799 NE2 GLN A 111 -12.780 29.500 6.998 1.00 0.00 N ATOM 0 H GLN A 111 -8.599 29.889 6.587 1.00 0.00 H new ATOM 0 HA GLN A 111 -8.143 29.814 9.446 1.00 0.00 H new ATOM 0 HB2 GLN A 111 -9.677 27.807 7.785 1.00 0.00 H new ATOM 0 HB3 GLN A 111 -9.876 28.194 9.482 1.00 0.00 H new ATOM 0 HG2 GLN A 111 -10.676 30.471 8.897 1.00 0.00 H new ATOM 0 HG3 GLN A 111 -10.409 30.148 7.195 1.00 0.00 H new ATOM 0 HE21 GLN A 111 -12.375 30.180 6.354 1.00 0.00 H new ATOM 0 HE22 GLN A 111 -13.725 29.150 6.842 1.00 0.00 H new ATOM 1808 N ALA A 112 -6.894 27.560 7.408 1.00 0.00 N ATOM 1809 CA ALA A 112 -5.906 26.501 7.296 1.00 0.00 C ATOM 1810 C ALA A 112 -4.540 27.037 7.730 1.00 0.00 C ATOM 1811 O ALA A 112 -3.813 26.371 8.466 1.00 0.00 O ATOM 1812 CB ALA A 112 -5.893 25.963 5.864 1.00 0.00 C ATOM 0 H ALA A 112 -7.340 27.822 6.529 1.00 0.00 H new ATOM 0 HA ALA A 112 -6.159 25.669 7.954 1.00 0.00 H new ATOM 0 HB1 ALA A 112 -5.151 25.168 5.781 1.00 0.00 H new ATOM 0 HB2 ALA A 112 -6.878 25.568 5.615 1.00 0.00 H new ATOM 0 HB3 ALA A 112 -5.640 26.769 5.175 1.00 0.00 H new ATOM 1818 N VAL A 113 -4.231 28.234 7.254 1.00 0.00 N ATOM 1819 CA VAL A 113 -2.965 28.867 7.583 1.00 0.00 C ATOM 1820 C VAL A 113 -2.987 29.312 9.047 1.00 0.00 C ATOM 1821 O VAL A 113 -1.977 29.221 9.742 1.00 0.00 O ATOM 1822 CB VAL A 113 -2.687 30.017 6.613 1.00 0.00 C ATOM 1823 CG1 VAL A 113 -2.864 29.565 5.162 1.00 0.00 C ATOM 1824 CG2 VAL A 113 -3.574 31.223 6.924 1.00 0.00 C ATOM 0 H VAL A 113 -4.836 28.783 6.643 1.00 0.00 H new ATOM 0 HA VAL A 113 -2.144 28.159 7.471 1.00 0.00 H new ATOM 0 HB VAL A 113 -1.649 30.323 6.744 1.00 0.00 H new ATOM 0 HG11 VAL A 113 -2.661 30.401 4.493 1.00 0.00 H new ATOM 0 HG12 VAL A 113 -2.171 28.752 4.947 1.00 0.00 H new ATOM 0 HG13 VAL A 113 -3.887 29.220 5.011 1.00 0.00 H new ATOM 0 HG21 VAL A 113 -3.356 32.026 6.220 1.00 0.00 H new ATOM 0 HG22 VAL A 113 -4.622 30.937 6.835 1.00 0.00 H new ATOM 0 HG23 VAL A 113 -3.377 31.567 7.939 1.00 0.00 H new ATOM 1834 N ASP A 114 -4.151 29.783 9.471 1.00 0.00 N ATOM 1835 CA ASP A 114 -4.318 30.242 10.839 1.00 0.00 C ATOM 1836 C ASP A 114 -3.697 29.222 11.795 1.00 0.00 C ATOM 1837 O ASP A 114 -2.925 29.585 12.681 1.00 0.00 O ATOM 1838 CB ASP A 114 -5.799 30.383 11.196 1.00 0.00 C ATOM 1839 CG ASP A 114 -6.203 31.749 11.756 1.00 0.00 C ATOM 1840 OD1 ASP A 114 -5.482 32.744 11.591 1.00 0.00 O ATOM 1841 OD2 ASP A 114 -7.324 31.767 12.393 1.00 0.00 O ATOM 0 H ASP A 114 -4.987 29.856 8.891 1.00 0.00 H new ATOM 0 HA ASP A 114 -3.831 31.213 10.930 1.00 0.00 H new ATOM 0 HB2 ASP A 114 -6.393 30.183 10.304 1.00 0.00 H new ATOM 0 HB3 ASP A 114 -6.055 29.617 11.928 1.00 0.00 H new ATOM 1846 N GLU A 115 -4.056 27.964 11.582 1.00 0.00 N ATOM 1847 CA GLU A 115 -3.544 26.888 12.414 1.00 0.00 C ATOM 1848 C GLU A 115 -2.030 26.753 12.233 1.00 0.00 C ATOM 1849 O GLU A 115 -1.303 26.541 13.201 1.00 0.00 O ATOM 1850 CB GLU A 115 -4.254 25.569 12.102 1.00 0.00 C ATOM 1851 CG GLU A 115 -5.772 25.755 12.081 1.00 0.00 C ATOM 1852 CD GLU A 115 -6.235 26.620 13.256 1.00 0.00 C ATOM 1853 OE1 GLU A 115 -5.990 26.130 14.424 1.00 0.00 O ATOM 1854 OE2 GLU A 115 -6.800 27.703 13.043 1.00 0.00 O ATOM 0 H GLU A 115 -4.695 27.666 10.845 1.00 0.00 H new ATOM 0 HA GLU A 115 -3.745 27.133 13.457 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -3.917 25.190 11.137 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -3.986 24.822 12.849 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -6.072 26.220 11.142 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -6.262 24.782 12.126 1.00 0.00 H new ATOM 1861 N GLN A 116 -1.602 26.880 10.986 1.00 0.00 N ATOM 1862 CA GLN A 116 -0.188 26.775 10.665 1.00 0.00 C ATOM 1863 C GLN A 116 0.099 27.428 9.312 1.00 0.00 C ATOM 1864 O GLN A 116 0.026 26.771 8.274 1.00 0.00 O ATOM 1865 CB GLN A 116 0.269 25.315 10.679 1.00 0.00 C ATOM 1866 CG GLN A 116 1.518 25.124 9.815 1.00 0.00 C ATOM 1867 CD GLN A 116 2.467 24.102 10.443 1.00 0.00 C ATOM 1868 OE1 GLN A 116 3.331 24.626 11.308 1.00 0.00 O flip ATOM 1869 NE2 GLN A 116 2.419 22.916 10.160 1.00 0.00 N flip ATOM 0 H GLN A 116 -2.209 27.055 10.185 1.00 0.00 H new ATOM 0 HA GLN A 116 0.380 27.306 11.429 1.00 0.00 H new ATOM 0 HB2 GLN A 116 0.480 25.006 11.703 1.00 0.00 H new ATOM 0 HB3 GLN A 116 -0.533 24.675 10.311 1.00 0.00 H new ATOM 0 HG2 GLN A 116 1.228 24.792 8.818 1.00 0.00 H new ATOM 0 HG3 GLN A 116 2.032 26.078 9.696 1.00 0.00 H new ATOM 0 HE21 GLN A 116 1.730 22.580 9.487 1.00 0.00 H new ATOM 0 HE22 GLN A 116 3.068 22.261 10.596 1.00 0.00 H new ATOM 1878 N PRO A 117 0.429 28.746 9.368 1.00 0.00 N ATOM 1879 CA PRO A 117 0.727 29.494 8.159 1.00 0.00 C ATOM 1880 C PRO A 117 2.114 29.135 7.620 1.00 0.00 C ATOM 1881 O PRO A 117 2.518 29.620 6.564 1.00 0.00 O ATOM 1882 CB PRO A 117 0.607 30.955 8.560 1.00 0.00 C ATOM 1883 CG PRO A 117 0.702 30.980 10.077 1.00 0.00 C ATOM 1884 CD PRO A 117 0.525 29.556 10.578 1.00 0.00 C ATOM 0 HA PRO A 117 0.044 29.261 7.342 1.00 0.00 H new ATOM 0 HB2 PRO A 117 1.401 31.550 8.109 1.00 0.00 H new ATOM 0 HB3 PRO A 117 -0.339 31.377 8.221 1.00 0.00 H new ATOM 0 HG2 PRO A 117 1.666 31.379 10.393 1.00 0.00 H new ATOM 0 HG3 PRO A 117 -0.065 31.631 10.497 1.00 0.00 H new ATOM 0 HD2 PRO A 117 1.368 29.246 11.196 1.00 0.00 H new ATOM 0 HD3 PRO A 117 -0.372 29.460 11.191 1.00 0.00 H new ATOM 1892 N ASP A 118 2.804 28.289 8.370 1.00 0.00 N ATOM 1893 CA ASP A 118 4.136 27.859 7.981 1.00 0.00 C ATOM 1894 C ASP A 118 4.028 26.623 7.087 1.00 0.00 C ATOM 1895 O ASP A 118 5.037 26.115 6.599 1.00 0.00 O ATOM 1896 CB ASP A 118 4.974 27.484 9.206 1.00 0.00 C ATOM 1897 CG ASP A 118 5.701 28.653 9.874 1.00 0.00 C ATOM 1898 OD1 ASP A 118 5.279 29.814 9.767 1.00 0.00 O ATOM 1899 OD2 ASP A 118 6.759 28.329 10.538 1.00 0.00 O ATOM 0 H ASP A 118 2.466 27.890 9.245 1.00 0.00 H new ATOM 0 HA ASP A 118 4.616 28.684 7.454 1.00 0.00 H new ATOM 0 HB2 ASP A 118 4.323 27.012 9.942 1.00 0.00 H new ATOM 0 HB3 ASP A 118 5.712 26.739 8.909 1.00 0.00 H new ATOM 1904 N ASN A 119 2.796 26.175 6.897 1.00 0.00 N ATOM 1905 CA ASN A 119 2.542 25.008 6.070 1.00 0.00 C ATOM 1906 C ASN A 119 2.716 25.384 4.597 1.00 0.00 C ATOM 1907 O ASN A 119 1.979 26.220 4.076 1.00 0.00 O ATOM 1908 CB ASN A 119 1.113 24.496 6.262 1.00 0.00 C ATOM 1909 CG ASN A 119 1.112 23.066 6.807 1.00 0.00 C ATOM 1910 OD1 ASN A 119 1.975 22.664 7.570 1.00 0.00 O ATOM 1911 ND2 ASN A 119 0.096 22.324 6.375 1.00 0.00 N ATOM 0 H ASN A 119 1.962 26.600 7.302 1.00 0.00 H new ATOM 0 HA ASN A 119 3.246 24.229 6.362 1.00 0.00 H new ATOM 0 HB2 ASN A 119 0.577 25.151 6.949 1.00 0.00 H new ATOM 0 HB3 ASN A 119 0.581 24.527 5.311 1.00 0.00 H new ATOM 0 HD21 ASN A 119 0.005 21.356 6.682 1.00 0.00 H new ATOM 0 HD22 ASN A 119 -0.592 22.723 5.737 1.00 0.00 H new ATOM 1918 N THR A 120 3.694 24.750 3.968 1.00 0.00 N ATOM 1919 CA THR A 120 3.974 25.008 2.566 1.00 0.00 C ATOM 1920 C THR A 120 2.736 24.722 1.714 1.00 0.00 C ATOM 1921 O THR A 120 2.594 25.262 0.618 1.00 0.00 O ATOM 1922 CB THR A 120 5.193 24.175 2.166 1.00 0.00 C ATOM 1923 OG1 THR A 120 4.793 22.831 2.419 1.00 0.00 O ATOM 1924 CG2 THR A 120 6.384 24.392 3.102 1.00 0.00 C ATOM 0 H THR A 120 4.303 24.058 4.404 1.00 0.00 H new ATOM 0 HA THR A 120 4.211 26.058 2.397 1.00 0.00 H new ATOM 0 HB THR A 120 5.484 24.424 1.146 1.00 0.00 H new ATOM 0 HG1 THR A 120 5.525 22.222 2.185 1.00 0.00 H new ATOM 0 HG21 THR A 120 7.222 23.777 2.773 1.00 0.00 H new ATOM 0 HG22 THR A 120 6.675 25.442 3.083 1.00 0.00 H new ATOM 0 HG23 THR A 120 6.105 24.111 4.117 1.00 0.00 H new ATOM 1932 N HIS A 121 1.871 23.874 2.250 1.00 0.00 N ATOM 1933 CA HIS A 121 0.650 23.509 1.553 1.00 0.00 C ATOM 1934 C HIS A 121 -0.318 24.695 1.558 1.00 0.00 C ATOM 1935 O HIS A 121 -0.717 25.180 0.501 1.00 0.00 O ATOM 1936 CB HIS A 121 0.038 22.242 2.154 1.00 0.00 C ATOM 1937 CG HIS A 121 1.055 21.205 2.565 1.00 0.00 C ATOM 1938 ND1 HIS A 121 1.920 21.173 3.619 1.00 0.00 N flip ATOM 1939 CD2 HIS A 121 1.262 20.036 1.854 1.00 0.00 C flip ATOM 1940 CE1 HIS A 121 2.617 20.045 3.556 1.00 0.00 C flip ATOM 1941 NE2 HIS A 121 2.211 19.339 2.462 1.00 0.00 N flip ATOM 0 H HIS A 121 1.992 23.429 3.160 1.00 0.00 H new ATOM 0 HA HIS A 121 0.878 23.274 0.513 1.00 0.00 H new ATOM 0 HB2 HIS A 121 -0.558 22.516 3.024 1.00 0.00 H new ATOM 0 HB3 HIS A 121 -0.643 21.800 1.427 1.00 0.00 H new ATOM 0 HD2 HIS A 121 0.739 19.742 0.956 1.00 0.00 H new ATOM 0 HE1 HIS A 121 3.380 19.737 4.256 1.00 0.00 H new ATOM 0 HE2 HIS A 121 2.574 18.434 2.164 1.00 0.00 H new ATOM 1949 N TYR A 122 -0.666 25.127 2.761 1.00 0.00 N ATOM 1950 CA TYR A 122 -1.579 26.247 2.918 1.00 0.00 C ATOM 1951 C TYR A 122 -1.006 27.515 2.283 1.00 0.00 C ATOM 1952 O TYR A 122 -1.747 28.328 1.733 1.00 0.00 O ATOM 1953 CB TYR A 122 -1.722 26.466 4.426 1.00 0.00 C ATOM 1954 CG TYR A 122 -2.144 25.215 5.199 1.00 0.00 C ATOM 1955 CD1 TYR A 122 -2.601 24.104 4.518 1.00 0.00 C ATOM 1956 CD2 TYR A 122 -2.068 25.197 6.577 1.00 0.00 C ATOM 1957 CE1 TYR A 122 -2.997 22.927 5.246 1.00 0.00 C ATOM 1958 CE2 TYR A 122 -2.465 24.019 7.304 1.00 0.00 C ATOM 1959 CZ TYR A 122 -2.910 22.943 6.603 1.00 0.00 C ATOM 1960 OH TYR A 122 -3.285 21.830 7.290 1.00 0.00 O ATOM 0 H TYR A 122 -0.333 24.722 3.636 1.00 0.00 H new ATOM 0 HA TYR A 122 -2.532 26.036 2.434 1.00 0.00 H new ATOM 0 HB2 TYR A 122 -0.771 26.822 4.823 1.00 0.00 H new ATOM 0 HB3 TYR A 122 -2.455 27.253 4.601 1.00 0.00 H new ATOM 0 HD1 TYR A 122 -2.661 24.118 3.440 1.00 0.00 H new ATOM 0 HD2 TYR A 122 -1.711 26.066 7.110 1.00 0.00 H new ATOM 0 HE1 TYR A 122 -3.355 22.051 4.726 1.00 0.00 H new ATOM 0 HE2 TYR A 122 -2.410 23.991 8.382 1.00 0.00 H new ATOM 0 HH TYR A 122 -4.083 22.028 7.823 1.00 0.00 H new ATOM 1970 N LEU A 123 0.309 27.645 2.380 1.00 0.00 N ATOM 1971 CA LEU A 123 0.991 28.800 1.821 1.00 0.00 C ATOM 1972 C LEU A 123 0.645 28.922 0.336 1.00 0.00 C ATOM 1973 O LEU A 123 0.329 30.010 -0.144 1.00 0.00 O ATOM 1974 CB LEU A 123 2.494 28.721 2.098 1.00 0.00 C ATOM 1975 CG LEU A 123 3.408 29.238 0.986 1.00 0.00 C ATOM 1976 CD1 LEU A 123 3.589 28.185 -0.109 1.00 0.00 C ATOM 1977 CD2 LEU A 123 2.894 30.566 0.425 1.00 0.00 C ATOM 0 H LEU A 123 0.921 26.969 2.838 1.00 0.00 H new ATOM 0 HA LEU A 123 0.649 29.715 2.305 1.00 0.00 H new ATOM 0 HB2 LEU A 123 2.706 29.284 3.007 1.00 0.00 H new ATOM 0 HB3 LEU A 123 2.752 27.681 2.300 1.00 0.00 H new ATOM 0 HG LEU A 123 4.392 29.429 1.415 1.00 0.00 H new ATOM 0 HD11 LEU A 123 4.243 28.578 -0.887 1.00 0.00 H new ATOM 0 HD12 LEU A 123 4.034 27.287 0.320 1.00 0.00 H new ATOM 0 HD13 LEU A 123 2.619 27.939 -0.541 1.00 0.00 H new ATOM 0 HD21 LEU A 123 3.562 30.911 -0.364 1.00 0.00 H new ATOM 0 HD22 LEU A 123 1.893 30.426 0.017 1.00 0.00 H new ATOM 0 HD23 LEU A 123 2.860 31.309 1.222 1.00 0.00 H new ATOM 1989 N LYS A 124 0.716 27.791 -0.351 1.00 0.00 N ATOM 1990 CA LYS A 124 0.414 27.758 -1.772 1.00 0.00 C ATOM 1991 C LYS A 124 -1.051 28.141 -1.987 1.00 0.00 C ATOM 1992 O LYS A 124 -1.374 28.878 -2.917 1.00 0.00 O ATOM 1993 CB LYS A 124 0.788 26.399 -2.367 1.00 0.00 C ATOM 1994 CG LYS A 124 1.653 26.568 -3.618 1.00 0.00 C ATOM 1995 CD LYS A 124 3.011 27.179 -3.267 1.00 0.00 C ATOM 1996 CE LYS A 124 3.974 27.093 -4.453 1.00 0.00 C ATOM 1997 NZ LYS A 124 4.457 25.705 -4.629 1.00 0.00 N ATOM 0 H LYS A 124 0.978 26.891 0.050 1.00 0.00 H new ATOM 0 HA LYS A 124 1.017 28.492 -2.307 1.00 0.00 H new ATOM 0 HB2 LYS A 124 1.326 25.809 -1.625 1.00 0.00 H new ATOM 0 HB3 LYS A 124 -0.117 25.846 -2.618 1.00 0.00 H new ATOM 0 HG2 LYS A 124 1.799 25.600 -4.097 1.00 0.00 H new ATOM 0 HG3 LYS A 124 1.138 27.205 -4.337 1.00 0.00 H new ATOM 0 HD2 LYS A 124 2.880 28.221 -2.975 1.00 0.00 H new ATOM 0 HD3 LYS A 124 3.437 26.659 -2.409 1.00 0.00 H new ATOM 0 HE2 LYS A 124 3.473 27.428 -5.361 1.00 0.00 H new ATOM 0 HE3 LYS A 124 4.820 27.761 -4.291 1.00 0.00 H new ATOM 0 HZ1 LYS A 124 5.254 25.697 -5.297 1.00 0.00 H new ATOM 0 HZ2 LYS A 124 4.770 25.327 -3.712 1.00 0.00 H new ATOM 0 HZ3 LYS A 124 3.687 25.114 -5.002 1.00 0.00 H new ATOM 2010 N SER A 125 -1.900 27.624 -1.111 1.00 0.00 N ATOM 2011 CA SER A 125 -3.324 27.902 -1.193 1.00 0.00 C ATOM 2012 C SER A 125 -3.568 29.410 -1.102 1.00 0.00 C ATOM 2013 O SER A 125 -4.413 29.949 -1.814 1.00 0.00 O ATOM 2014 CB SER A 125 -4.093 27.173 -0.090 1.00 0.00 C ATOM 2015 OG SER A 125 -4.904 26.123 -0.609 1.00 0.00 O ATOM 0 H SER A 125 -1.629 27.014 -0.340 1.00 0.00 H new ATOM 0 HA SER A 125 -3.689 27.538 -2.153 1.00 0.00 H new ATOM 0 HB2 SER A 125 -3.388 26.763 0.633 1.00 0.00 H new ATOM 0 HB3 SER A 125 -4.721 27.885 0.446 1.00 0.00 H new ATOM 0 HG SER A 125 -5.703 26.504 -1.030 1.00 0.00 H new ATOM 2021 N LEU A 126 -2.812 30.048 -0.221 1.00 0.00 N ATOM 2022 CA LEU A 126 -2.936 31.483 -0.028 1.00 0.00 C ATOM 2023 C LEU A 126 -2.336 32.208 -1.234 1.00 0.00 C ATOM 2024 O LEU A 126 -2.912 33.176 -1.729 1.00 0.00 O ATOM 2025 CB LEU A 126 -2.319 31.899 1.309 1.00 0.00 C ATOM 2026 CG LEU A 126 -2.727 33.275 1.837 1.00 0.00 C ATOM 2027 CD1 LEU A 126 -4.234 33.339 2.095 1.00 0.00 C ATOM 2028 CD2 LEU A 126 -1.916 33.649 3.079 1.00 0.00 C ATOM 0 H LEU A 126 -2.111 29.598 0.367 1.00 0.00 H new ATOM 0 HA LEU A 126 -3.986 31.771 0.028 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -2.584 31.152 2.057 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -1.234 31.878 1.208 1.00 0.00 H new ATOM 0 HG LEU A 126 -2.500 34.016 1.070 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -4.497 34.328 2.470 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -4.771 33.148 1.166 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -4.509 32.586 2.834 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -2.226 34.632 3.434 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -2.087 32.910 3.862 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -0.856 33.672 2.828 1.00 0.00 H new ATOM 2040 N GLU A 127 -1.188 31.713 -1.672 1.00 0.00 N ATOM 2041 CA GLU A 127 -0.505 32.302 -2.811 1.00 0.00 C ATOM 2042 C GLU A 127 -1.324 32.095 -4.087 1.00 0.00 C ATOM 2043 O GLU A 127 -1.308 32.938 -4.982 1.00 0.00 O ATOM 2044 CB GLU A 127 0.904 31.725 -2.964 1.00 0.00 C ATOM 2045 CG GLU A 127 1.500 32.087 -4.325 1.00 0.00 C ATOM 2046 CD GLU A 127 2.939 32.585 -4.179 1.00 0.00 C ATOM 2047 OE1 GLU A 127 3.168 33.662 -3.608 1.00 0.00 O ATOM 2048 OE2 GLU A 127 3.838 31.809 -4.682 1.00 0.00 O ATOM 0 H GLU A 127 -0.713 30.910 -1.259 1.00 0.00 H new ATOM 0 HA GLU A 127 -0.406 33.373 -2.636 1.00 0.00 H new ATOM 0 HB2 GLU A 127 1.545 32.106 -2.169 1.00 0.00 H new ATOM 0 HB3 GLU A 127 0.871 30.641 -2.854 1.00 0.00 H new ATOM 0 HG2 GLU A 127 1.478 31.215 -4.979 1.00 0.00 H new ATOM 0 HG3 GLU A 127 0.891 32.857 -4.799 1.00 0.00 H new ATOM 2055 N MET A 128 -2.020 30.968 -4.129 1.00 0.00 N ATOM 2056 CA MET A 128 -2.843 30.640 -5.280 1.00 0.00 C ATOM 2057 C MET A 128 -3.901 31.718 -5.523 1.00 0.00 C ATOM 2058 O MET A 128 -4.270 31.984 -6.666 1.00 0.00 O ATOM 2059 CB MET A 128 -3.530 29.293 -5.049 1.00 0.00 C ATOM 2060 CG MET A 128 -2.687 28.144 -5.605 1.00 0.00 C ATOM 2061 SD MET A 128 -2.521 28.310 -7.375 1.00 0.00 S ATOM 2062 CE MET A 128 -4.031 27.517 -7.903 1.00 0.00 C ATOM 0 H MET A 128 -2.031 30.271 -3.384 1.00 0.00 H new ATOM 0 HA MET A 128 -2.200 30.584 -6.159 1.00 0.00 H new ATOM 0 HB2 MET A 128 -3.696 29.144 -3.982 1.00 0.00 H new ATOM 0 HB3 MET A 128 -4.510 29.294 -5.527 1.00 0.00 H new ATOM 0 HG2 MET A 128 -1.702 28.145 -5.137 1.00 0.00 H new ATOM 0 HG3 MET A 128 -3.154 27.189 -5.363 1.00 0.00 H new ATOM 0 HE1 MET A 128 -4.047 27.453 -8.991 1.00 0.00 H new ATOM 0 HE2 MET A 128 -4.082 26.514 -7.480 1.00 0.00 H new ATOM 0 HE3 MET A 128 -4.887 28.099 -7.561 1.00 0.00 H new ATOM 2072 N THR A 129 -4.358 32.311 -4.430 1.00 0.00 N ATOM 2073 CA THR A 129 -5.366 33.354 -4.510 1.00 0.00 C ATOM 2074 C THR A 129 -4.782 34.611 -5.158 1.00 0.00 C ATOM 2075 O THR A 129 -5.484 35.332 -5.866 1.00 0.00 O ATOM 2076 CB THR A 129 -5.911 33.594 -3.100 1.00 0.00 C ATOM 2077 OG1 THR A 129 -4.878 34.331 -2.450 1.00 0.00 O ATOM 2078 CG2 THR A 129 -6.018 32.304 -2.286 1.00 0.00 C ATOM 0 H THR A 129 -4.049 32.089 -3.484 1.00 0.00 H new ATOM 0 HA THR A 129 -6.197 33.053 -5.148 1.00 0.00 H new ATOM 0 HB THR A 129 -6.893 34.064 -3.165 1.00 0.00 H new ATOM 0 HG1 THR A 129 -4.045 33.815 -2.471 1.00 0.00 H new ATOM 0 HG21 THR A 129 -6.410 32.531 -1.294 1.00 0.00 H new ATOM 0 HG22 THR A 129 -6.689 31.610 -2.791 1.00 0.00 H new ATOM 0 HG23 THR A 129 -5.031 31.851 -2.191 1.00 0.00 H new ATOM 2086 N ALA A 130 -3.504 34.835 -4.894 1.00 0.00 N ATOM 2087 CA ALA A 130 -2.817 35.992 -5.442 1.00 0.00 C ATOM 2088 C ALA A 130 -3.230 36.179 -6.904 1.00 0.00 C ATOM 2089 O ALA A 130 -3.427 37.305 -7.358 1.00 0.00 O ATOM 2090 CB ALA A 130 -1.306 35.814 -5.281 1.00 0.00 C ATOM 0 H ALA A 130 -2.925 34.234 -4.307 1.00 0.00 H new ATOM 0 HA ALA A 130 -3.097 36.896 -4.901 1.00 0.00 H new ATOM 0 HB1 ALA A 130 -0.791 36.682 -5.692 1.00 0.00 H new ATOM 0 HB2 ALA A 130 -1.062 35.715 -4.223 1.00 0.00 H new ATOM 0 HB3 ALA A 130 -0.987 34.918 -5.812 1.00 0.00 H new ATOM 2096 N LYS A 131 -3.347 35.058 -7.600 1.00 0.00 N ATOM 2097 CA LYS A 131 -3.732 35.084 -9.001 1.00 0.00 C ATOM 2098 C LYS A 131 -4.954 34.186 -9.206 1.00 0.00 C ATOM 2099 O LYS A 131 -5.004 33.407 -10.156 1.00 0.00 O ATOM 2100 CB LYS A 131 -2.543 34.716 -9.890 1.00 0.00 C ATOM 2101 CG LYS A 131 -1.687 35.946 -10.198 1.00 0.00 C ATOM 2102 CD LYS A 131 -0.241 35.735 -9.746 1.00 0.00 C ATOM 2103 CE LYS A 131 0.645 36.905 -10.178 1.00 0.00 C ATOM 2104 NZ LYS A 131 1.974 36.815 -9.533 1.00 0.00 N ATOM 0 H LYS A 131 -3.182 34.126 -7.220 1.00 0.00 H new ATOM 0 HA LYS A 131 -4.023 36.092 -9.298 1.00 0.00 H new ATOM 0 HB2 LYS A 131 -1.934 33.960 -9.394 1.00 0.00 H new ATOM 0 HB3 LYS A 131 -2.902 34.276 -10.820 1.00 0.00 H new ATOM 0 HG2 LYS A 131 -1.711 36.151 -11.268 1.00 0.00 H new ATOM 0 HG3 LYS A 131 -2.105 36.819 -9.697 1.00 0.00 H new ATOM 0 HD2 LYS A 131 -0.207 35.630 -8.662 1.00 0.00 H new ATOM 0 HD3 LYS A 131 0.144 34.807 -10.169 1.00 0.00 H new ATOM 0 HE2 LYS A 131 0.759 36.901 -11.262 1.00 0.00 H new ATOM 0 HE3 LYS A 131 0.168 37.848 -9.911 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 2.563 37.617 -9.837 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 1.861 36.841 -8.500 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 2.434 35.924 -9.808 1.00 0.00 H new ATOM 2117 N ALA A 132 -5.910 34.326 -8.299 1.00 0.00 N ATOM 2118 CA ALA A 132 -7.129 33.538 -8.368 1.00 0.00 C ATOM 2119 C ALA A 132 -7.897 33.905 -9.639 1.00 0.00 C ATOM 2120 O ALA A 132 -8.280 33.029 -10.413 1.00 0.00 O ATOM 2121 CB ALA A 132 -7.956 33.764 -7.101 1.00 0.00 C ATOM 0 H ALA A 132 -5.865 34.974 -7.512 1.00 0.00 H new ATOM 0 HA ALA A 132 -6.896 32.474 -8.419 1.00 0.00 H new ATOM 0 HB1 ALA A 132 -8.870 33.173 -7.153 1.00 0.00 H new ATOM 0 HB2 ALA A 132 -7.377 33.460 -6.229 1.00 0.00 H new ATOM 0 HB3 ALA A 132 -8.211 34.820 -7.017 1.00 0.00 H new ATOM 2127 N PRO A 133 -8.104 35.237 -9.821 1.00 0.00 N ATOM 2128 CA PRO A 133 -8.820 35.732 -10.985 1.00 0.00 C ATOM 2129 C PRO A 133 -7.944 35.662 -12.237 1.00 0.00 C ATOM 2130 O PRO A 133 -8.455 35.588 -13.353 1.00 0.00 O ATOM 2131 CB PRO A 133 -9.227 37.151 -10.622 1.00 0.00 C ATOM 2132 CG PRO A 133 -8.330 37.559 -9.465 1.00 0.00 C ATOM 2133 CD PRO A 133 -7.664 36.304 -8.926 1.00 0.00 C ATOM 0 HA PRO A 133 -9.696 35.131 -11.228 1.00 0.00 H new ATOM 0 HB2 PRO A 133 -9.100 37.823 -11.471 1.00 0.00 H new ATOM 0 HB3 PRO A 133 -10.278 37.195 -10.336 1.00 0.00 H new ATOM 0 HG2 PRO A 133 -7.580 38.276 -9.798 1.00 0.00 H new ATOM 0 HG3 PRO A 133 -8.913 38.047 -8.684 1.00 0.00 H new ATOM 0 HD2 PRO A 133 -6.578 36.400 -8.928 1.00 0.00 H new ATOM 0 HD3 PRO A 133 -7.965 36.107 -7.897 1.00 0.00 H new ATOM 2141 N GLN A 134 -6.638 35.690 -12.010 1.00 0.00 N ATOM 2142 CA GLN A 134 -5.687 35.631 -13.106 1.00 0.00 C ATOM 2143 C GLN A 134 -5.508 34.186 -13.576 1.00 0.00 C ATOM 2144 O GLN A 134 -5.609 33.900 -14.768 1.00 0.00 O ATOM 2145 CB GLN A 134 -4.345 36.246 -12.701 1.00 0.00 C ATOM 2146 CG GLN A 134 -4.551 37.551 -11.931 1.00 0.00 C ATOM 2147 CD GLN A 134 -5.201 38.615 -12.818 1.00 0.00 C ATOM 2148 OE1 GLN A 134 -4.708 38.962 -13.878 1.00 0.00 O ATOM 2149 NE2 GLN A 134 -6.333 39.111 -12.326 1.00 0.00 N ATOM 0 H GLN A 134 -6.217 35.753 -11.083 1.00 0.00 H new ATOM 0 HA GLN A 134 -6.082 36.216 -13.936 1.00 0.00 H new ATOM 0 HB2 GLN A 134 -3.788 35.540 -12.085 1.00 0.00 H new ATOM 0 HB3 GLN A 134 -3.744 36.435 -13.591 1.00 0.00 H new ATOM 0 HG2 GLN A 134 -5.178 37.367 -11.059 1.00 0.00 H new ATOM 0 HG3 GLN A 134 -3.592 37.916 -11.563 1.00 0.00 H new ATOM 0 HE21 GLN A 134 -6.691 38.776 -11.432 1.00 0.00 H new ATOM 0 HE22 GLN A 134 -6.844 39.827 -12.843 1.00 0.00 H new ATOM 2158 N LEU A 135 -5.245 33.312 -12.615 1.00 0.00 N ATOM 2159 CA LEU A 135 -5.051 31.904 -12.916 1.00 0.00 C ATOM 2160 C LEU A 135 -6.194 31.416 -13.808 1.00 0.00 C ATOM 2161 O LEU A 135 -5.975 30.629 -14.728 1.00 0.00 O ATOM 2162 CB LEU A 135 -4.891 31.098 -11.625 1.00 0.00 C ATOM 2163 CG LEU A 135 -3.544 31.235 -10.912 1.00 0.00 C ATOM 2164 CD1 LEU A 135 -3.639 30.749 -9.464 1.00 0.00 C ATOM 2165 CD2 LEU A 135 -2.438 30.517 -11.687 1.00 0.00 C ATOM 0 H LEU A 135 -5.162 33.552 -11.627 1.00 0.00 H new ATOM 0 HA LEU A 135 -4.126 31.757 -13.473 1.00 0.00 H new ATOM 0 HB2 LEU A 135 -5.678 31.398 -10.933 1.00 0.00 H new ATOM 0 HB3 LEU A 135 -5.053 30.045 -11.855 1.00 0.00 H new ATOM 0 HG LEU A 135 -3.280 32.292 -10.880 1.00 0.00 H new ATOM 0 HD11 LEU A 135 -2.669 30.857 -8.980 1.00 0.00 H new ATOM 0 HD12 LEU A 135 -4.380 31.343 -8.929 1.00 0.00 H new ATOM 0 HD13 LEU A 135 -3.936 29.700 -9.451 1.00 0.00 H new ATOM 0 HD21 LEU A 135 -1.491 30.630 -11.159 1.00 0.00 H new ATOM 0 HD22 LEU A 135 -2.682 29.458 -11.772 1.00 0.00 H new ATOM 0 HD23 LEU A 135 -2.351 30.951 -12.683 1.00 0.00 H new ATOM 2177 N HIS A 136 -7.389 31.902 -13.505 1.00 0.00 N ATOM 2178 CA HIS A 136 -8.566 31.524 -14.268 1.00 0.00 C ATOM 2179 C HIS A 136 -8.495 32.149 -15.663 1.00 0.00 C ATOM 2180 O HIS A 136 -8.769 31.482 -16.660 1.00 0.00 O ATOM 2181 CB HIS A 136 -9.844 31.899 -13.515 1.00 0.00 C ATOM 2182 CG HIS A 136 -11.114 31.619 -14.283 1.00 0.00 C ATOM 2183 ND1 HIS A 136 -11.780 32.590 -15.010 1.00 0.00 N ATOM 2184 CD2 HIS A 136 -11.831 30.468 -14.430 1.00 0.00 C ATOM 2185 CE1 HIS A 136 -12.849 32.037 -15.565 1.00 0.00 C ATOM 2186 NE2 HIS A 136 -12.879 30.722 -15.204 1.00 0.00 N ATOM 0 H HIS A 136 -7.567 32.554 -12.741 1.00 0.00 H new ATOM 0 HA HIS A 136 -8.591 30.442 -14.393 1.00 0.00 H new ATOM 0 HB2 HIS A 136 -9.873 31.351 -12.573 1.00 0.00 H new ATOM 0 HB3 HIS A 136 -9.809 32.960 -13.266 1.00 0.00 H new ATOM 0 HD2 HIS A 136 -11.587 29.512 -13.991 1.00 0.00 H new ATOM 0 HE1 HIS A 136 -13.570 32.539 -16.193 1.00 0.00 H new ATOM 0 HE2 HIS A 136 -13.590 30.045 -15.483 1.00 0.00 H new ATOM 2194 N ALA A 137 -8.127 33.421 -15.689 1.00 0.00 N ATOM 2195 CA ALA A 137 -8.015 34.142 -16.945 1.00 0.00 C ATOM 2196 C ALA A 137 -6.948 33.478 -17.817 1.00 0.00 C ATOM 2197 O ALA A 137 -7.200 33.158 -18.978 1.00 0.00 O ATOM 2198 CB ALA A 137 -7.705 35.614 -16.663 1.00 0.00 C ATOM 0 H ALA A 137 -7.902 33.971 -14.860 1.00 0.00 H new ATOM 0 HA ALA A 137 -8.957 34.106 -17.493 1.00 0.00 H new ATOM 0 HB1 ALA A 137 -7.621 36.155 -17.605 1.00 0.00 H new ATOM 0 HB2 ALA A 137 -8.508 36.047 -16.066 1.00 0.00 H new ATOM 0 HB3 ALA A 137 -6.765 35.690 -16.116 1.00 0.00 H new ATOM 2204 N GLU A 138 -5.778 33.290 -17.224 1.00 0.00 N ATOM 2205 CA GLU A 138 -4.671 32.669 -17.932 1.00 0.00 C ATOM 2206 C GLU A 138 -4.974 31.194 -18.201 1.00 0.00 C ATOM 2207 O GLU A 138 -4.472 30.620 -19.166 1.00 0.00 O ATOM 2208 CB GLU A 138 -3.364 32.828 -17.152 1.00 0.00 C ATOM 2209 CG GLU A 138 -3.561 32.479 -15.676 1.00 0.00 C ATOM 2210 CD GLU A 138 -2.537 31.439 -15.217 1.00 0.00 C ATOM 2211 OE1 GLU A 138 -2.720 30.237 -15.464 1.00 0.00 O ATOM 2212 OE2 GLU A 138 -1.520 31.917 -14.584 1.00 0.00 O ATOM 0 H GLU A 138 -5.572 33.557 -16.261 1.00 0.00 H new ATOM 0 HA GLU A 138 -4.548 33.174 -18.890 1.00 0.00 H new ATOM 0 HB2 GLU A 138 -2.598 32.183 -17.583 1.00 0.00 H new ATOM 0 HB3 GLU A 138 -3.005 33.853 -17.242 1.00 0.00 H new ATOM 0 HG2 GLU A 138 -3.466 33.380 -15.070 1.00 0.00 H new ATOM 0 HG3 GLU A 138 -4.569 32.095 -15.521 1.00 0.00 H new ATOM 2219 N ALA A 139 -5.793 30.622 -17.331 1.00 0.00 N ATOM 2220 CA ALA A 139 -6.169 29.225 -17.463 1.00 0.00 C ATOM 2221 C ALA A 139 -7.013 29.045 -18.726 1.00 0.00 C ATOM 2222 O ALA A 139 -6.735 28.169 -19.543 1.00 0.00 O ATOM 2223 CB ALA A 139 -6.905 28.773 -16.200 1.00 0.00 C ATOM 0 H ALA A 139 -6.207 31.101 -16.531 1.00 0.00 H new ATOM 0 HA ALA A 139 -5.284 28.598 -17.567 1.00 0.00 H new ATOM 0 HB1 ALA A 139 -7.187 27.725 -16.299 1.00 0.00 H new ATOM 0 HB2 ALA A 139 -6.252 28.893 -15.336 1.00 0.00 H new ATOM 0 HB3 ALA A 139 -7.801 29.379 -16.065 1.00 0.00 H new ATOM 2229 N TYR A 140 -8.027 29.890 -18.846 1.00 0.00 N ATOM 2230 CA TYR A 140 -8.914 29.835 -19.996 1.00 0.00 C ATOM 2231 C TYR A 140 -8.300 30.559 -21.196 1.00 0.00 C ATOM 2232 O TYR A 140 -8.480 30.138 -22.338 1.00 0.00 O ATOM 2233 CB TYR A 140 -10.193 30.562 -19.577 1.00 0.00 C ATOM 2234 CG TYR A 140 -11.070 29.769 -18.606 1.00 0.00 C ATOM 2235 CD1 TYR A 140 -10.541 29.309 -17.417 1.00 0.00 C ATOM 2236 CD2 TYR A 140 -12.390 29.514 -18.918 1.00 0.00 C ATOM 2237 CE1 TYR A 140 -11.366 28.563 -16.503 1.00 0.00 C ATOM 2238 CE2 TYR A 140 -13.215 28.768 -18.004 1.00 0.00 C ATOM 2239 CZ TYR A 140 -12.663 28.329 -16.842 1.00 0.00 C ATOM 2240 OH TYR A 140 -13.442 27.624 -15.978 1.00 0.00 O ATOM 0 H TYR A 140 -8.254 30.616 -18.166 1.00 0.00 H new ATOM 0 HA TYR A 140 -9.098 28.802 -20.290 1.00 0.00 H new ATOM 0 HB2 TYR A 140 -9.924 31.512 -19.115 1.00 0.00 H new ATOM 0 HB3 TYR A 140 -10.775 30.795 -20.469 1.00 0.00 H new ATOM 0 HD1 TYR A 140 -9.508 29.509 -17.172 1.00 0.00 H new ATOM 0 HD2 TYR A 140 -12.804 29.874 -19.848 1.00 0.00 H new ATOM 0 HE1 TYR A 140 -10.965 28.197 -15.569 1.00 0.00 H new ATOM 0 HE2 TYR A 140 -14.249 28.562 -18.236 1.00 0.00 H new ATOM 0 HH TYR A 140 -13.167 26.683 -15.983 1.00 0.00 H new ATOM 2250 N LYS A 141 -7.588 31.635 -20.897 1.00 0.00 N ATOM 2251 CA LYS A 141 -6.946 32.421 -21.937 1.00 0.00 C ATOM 2252 C LYS A 141 -5.916 31.554 -22.663 1.00 0.00 C ATOM 2253 O LYS A 141 -5.879 31.525 -23.892 1.00 0.00 O ATOM 2254 CB LYS A 141 -6.363 33.709 -21.353 1.00 0.00 C ATOM 2255 CG LYS A 141 -5.710 34.560 -22.444 1.00 0.00 C ATOM 2256 CD LYS A 141 -4.246 34.850 -22.110 1.00 0.00 C ATOM 2257 CE LYS A 141 -3.324 33.795 -22.726 1.00 0.00 C ATOM 2258 NZ LYS A 141 -2.211 34.442 -23.456 1.00 0.00 N ATOM 0 H LYS A 141 -7.441 31.981 -19.949 1.00 0.00 H new ATOM 0 HA LYS A 141 -7.677 32.738 -22.680 1.00 0.00 H new ATOM 0 HB2 LYS A 141 -7.152 34.281 -20.865 1.00 0.00 H new ATOM 0 HB3 LYS A 141 -5.626 33.465 -20.588 1.00 0.00 H new ATOM 0 HG2 LYS A 141 -5.773 34.042 -23.401 1.00 0.00 H new ATOM 0 HG3 LYS A 141 -6.254 35.498 -22.553 1.00 0.00 H new ATOM 0 HD2 LYS A 141 -3.973 35.838 -22.481 1.00 0.00 H new ATOM 0 HD3 LYS A 141 -4.113 34.868 -21.028 1.00 0.00 H new ATOM 0 HE2 LYS A 141 -2.926 33.149 -21.943 1.00 0.00 H new ATOM 0 HE3 LYS A 141 -3.892 33.160 -23.406 1.00 0.00 H new ATOM 0 HZ1 LYS A 141 -1.595 33.712 -23.868 1.00 0.00 H new ATOM 0 HZ2 LYS A 141 -2.595 35.040 -24.216 1.00 0.00 H new ATOM 0 HZ3 LYS A 141 -1.660 35.030 -22.798 1.00 0.00 H new ATOM 2271 N GLN A 142 -5.104 30.868 -21.872 1.00 0.00 N ATOM 2272 CA GLN A 142 -4.076 30.003 -22.424 1.00 0.00 C ATOM 2273 C GLN A 142 -4.656 28.622 -22.736 1.00 0.00 C ATOM 2274 O GLN A 142 -5.203 27.960 -21.855 1.00 0.00 O ATOM 2275 CB GLN A 142 -2.882 29.894 -21.473 1.00 0.00 C ATOM 2276 CG GLN A 142 -1.561 29.993 -22.238 1.00 0.00 C ATOM 2277 CD GLN A 142 -0.367 29.917 -21.283 1.00 0.00 C ATOM 2278 OE1 GLN A 142 -0.275 30.639 -20.305 1.00 0.00 O ATOM 2279 NE2 GLN A 142 0.538 29.003 -21.621 1.00 0.00 N ATOM 0 H GLN A 142 -5.137 30.894 -20.853 1.00 0.00 H new ATOM 0 HA GLN A 142 -3.718 30.444 -23.354 1.00 0.00 H new ATOM 0 HB2 GLN A 142 -2.934 30.686 -20.726 1.00 0.00 H new ATOM 0 HB3 GLN A 142 -2.925 28.946 -20.936 1.00 0.00 H new ATOM 0 HG2 GLN A 142 -1.499 29.187 -22.969 1.00 0.00 H new ATOM 0 HG3 GLN A 142 -1.528 30.930 -22.794 1.00 0.00 H new ATOM 0 HE21 GLN A 142 0.399 28.431 -22.454 1.00 0.00 H new ATOM 0 HE22 GLN A 142 1.371 28.874 -21.047 1.00 0.00 H new