USER MOD reduce.3.24.130724 H: found=0, std=0, add=1010, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1011 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 125 GLN : amide:sc= -22.9! C(o=-26!,f=-37!) USER MOD Set 1.2: A 126 HIS : no HD1:sc= -3.09 K(o=-26,f=-29!) USER MOD Set 2.1: A 54 SER OG : rot 117:sc= -0.0447! USER MOD Set 2.2: A 94 THR OG1 : rot 128:sc= -5.08! USER MOD Set 3.1: A 45 GLN : amide:sc= 0.989 K(o=1.9,f=-7.7!) USER MOD Set 3.2: A 104 LYS NZ :NH3+ -161:sc= 0.893 (180deg=-1.29) USER MOD Set 4.1: A 27 LYS NZ :NH3+ 153:sc= -0.221 (180deg=-1.53!) USER MOD Set 4.2: A 100 TYR OH : rot 180:sc= 0 USER MOD Single : A 13 SER OG : rot 81:sc= 0.463 USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 18 CYS SG : rot 76:sc= -1.35 USER MOD Single : A 21 SER OG : rot 60:sc= -2.64! USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 28 THR OG1 : rot -20:sc= 0.743! USER MOD Single : A 29 SER OG : rot -95:sc= 0.394 USER MOD Single : A 31 CYS SG : rot 180:sc= -8.94! USER MOD Single : A 40 GLN :FLIP amide:sc= -1.64 F(o=-3.9,f=-1.6) USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 51 CYS SG : rot 180:sc= -0.237 USER MOD Single : A 52 SER OG : rot 180:sc= 0 USER MOD Single : A 55 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 59 LYS NZ :NH3+ -158:sc= -0.0297 (180deg=-0.366) USER MOD Single : A 61 ASN : amide:sc= -0.109 X(o=-0.11,f=-0.011) USER MOD Single : A 62 THR OG1 : rot 180:sc= 0 USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 SER OG : rot 100:sc= -0.93 USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 79 THR OG1 : rot 180:sc= -2.99! USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 82 GLN : amide:sc= -0.469 X(o=-0.47,f=-0.71) USER MOD Single : A 85 LYS NZ :NH3+ -175:sc= -3.79! (180deg=-3.85!) USER MOD Single : A 86 THR OG1 : rot -140:sc= 0 USER MOD Single : A 87 ASN : amide:sc= -5.73! C(o=-5.7!,f=-5.6!) USER MOD Single : A 89 ASN : amide:sc= -8.73! C(o=-8.7!,f=-22!) USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 TYR OH : rot 180:sc= 0 USER MOD Single : A 96 CYS SG : rot 180:sc= -5.29! USER MOD Single : A 99 GLN : amide:sc=-0.00755 K(o=-0.0075,f=-1.7!) USER MOD Single : A 102 SER OG : rot 180:sc= 0.003 USER MOD Single : A 113 TYR OH : rot -30:sc= -0.432 USER MOD Single : A 116 TYR OH : rot 180:sc= 0 USER MOD Single : A 118 GLN :FLIP amide:sc= -1.1 F(o=-4.2!,f=-1.1) USER MOD Single : A 119 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 122 SER OG : rot 180:sc= 0 USER MOD Single : A 129 THR OG1 : rot 160:sc= 0.747 USER MOD Single : A 130 TYR OH : rot 164:sc= -1.23 USER MOD Single : A 131 ASN : amide:sc= -9.55! C(o=-9.6!,f=-11!) USER MOD ----------------------------------------------------------------- ATOM 157 N LEU A 10 -3.420 13.555 -0.639 1.00 0.00 N ATOM 158 CA LEU A 10 -2.459 13.740 0.453 1.00 0.00 C ATOM 159 C LEU A 10 -1.486 14.879 0.199 1.00 0.00 C ATOM 160 O LEU A 10 -1.269 15.713 1.076 1.00 0.00 O ATOM 161 CB LEU A 10 -1.640 12.489 0.738 1.00 0.00 C ATOM 162 CG LEU A 10 -1.573 11.563 -0.479 1.00 0.00 C ATOM 163 CD1 LEU A 10 -0.261 11.826 -1.215 1.00 0.00 C ATOM 164 CD2 LEU A 10 -1.641 10.100 -0.017 1.00 0.00 C ATOM 0 HA LEU A 10 -3.082 13.976 1.316 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -0.630 12.775 1.033 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -2.078 11.952 1.579 1.00 0.00 H new ATOM 0 HG LEU A 10 -2.413 11.754 -1.147 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -0.196 11.174 -2.086 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -0.227 12.867 -1.537 1.00 0.00 H new ATOM 0 HD13 LEU A 10 0.577 11.625 -0.548 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -1.593 9.442 -0.885 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -0.802 9.888 0.646 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -2.576 9.930 0.516 1.00 0.00 H new ATOM 176 N PHE A 11 -0.891 14.919 -0.979 1.00 0.00 N ATOM 177 CA PHE A 11 0.058 15.983 -1.264 1.00 0.00 C ATOM 178 C PHE A 11 -0.626 17.135 -1.991 1.00 0.00 C ATOM 179 O PHE A 11 -0.385 18.303 -1.684 1.00 0.00 O ATOM 180 CB PHE A 11 1.242 15.503 -2.089 1.00 0.00 C ATOM 181 CG PHE A 11 0.788 15.351 -3.504 1.00 0.00 C ATOM 182 CD1 PHE A 11 -0.222 14.455 -3.761 1.00 0.00 C ATOM 183 CD2 PHE A 11 1.337 16.118 -4.539 1.00 0.00 C ATOM 184 CE1 PHE A 11 -0.711 14.299 -5.059 1.00 0.00 C ATOM 185 CE2 PHE A 11 0.860 15.965 -5.845 1.00 0.00 C ATOM 186 CZ PHE A 11 -0.167 15.053 -6.106 1.00 0.00 C ATOM 0 H PHE A 11 -1.040 14.250 -1.734 1.00 0.00 H new ATOM 0 HA PHE A 11 0.436 16.324 -0.300 1.00 0.00 H new ATOM 0 HB2 PHE A 11 2.064 16.216 -2.027 1.00 0.00 H new ATOM 0 HB3 PHE A 11 1.615 14.554 -1.704 1.00 0.00 H new ATOM 0 HD1 PHE A 11 -0.639 13.869 -2.955 1.00 0.00 H new ATOM 0 HD2 PHE A 11 2.126 16.825 -4.330 1.00 0.00 H new ATOM 0 HE1 PHE A 11 -1.508 13.597 -5.256 1.00 0.00 H new ATOM 0 HE2 PHE A 11 1.283 16.549 -6.649 1.00 0.00 H new ATOM 0 HZ PHE A 11 -0.540 14.930 -7.112 1.00 0.00 H new ATOM 196 N GLU A 12 -1.483 16.801 -2.955 1.00 0.00 N ATOM 197 CA GLU A 12 -2.192 17.827 -3.711 1.00 0.00 C ATOM 198 C GLU A 12 -2.886 18.785 -2.754 1.00 0.00 C ATOM 199 O GLU A 12 -2.891 19.998 -2.968 1.00 0.00 O ATOM 200 CB GLU A 12 -3.226 17.181 -4.636 1.00 0.00 C ATOM 201 CG GLU A 12 -3.974 18.267 -5.407 1.00 0.00 C ATOM 202 CD GLU A 12 -2.992 19.281 -5.985 1.00 0.00 C ATOM 203 OE1 GLU A 12 -2.176 18.886 -6.803 1.00 0.00 O ATOM 204 OE2 GLU A 12 -3.070 20.436 -5.601 1.00 0.00 O ATOM 0 H GLU A 12 -1.700 15.842 -3.227 1.00 0.00 H new ATOM 0 HA GLU A 12 -1.473 18.380 -4.316 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -2.733 16.502 -5.331 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -3.929 16.586 -4.053 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -4.556 17.816 -6.211 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -4.680 18.770 -4.746 1.00 0.00 H new ATOM 211 N SER A 13 -3.455 18.235 -1.686 1.00 0.00 N ATOM 212 CA SER A 13 -4.130 19.053 -0.690 1.00 0.00 C ATOM 213 C SER A 13 -3.098 19.687 0.235 1.00 0.00 C ATOM 214 O SER A 13 -3.420 20.559 1.042 1.00 0.00 O ATOM 215 CB SER A 13 -5.100 18.200 0.127 1.00 0.00 C ATOM 216 OG SER A 13 -4.392 17.565 1.185 1.00 0.00 O ATOM 0 H SER A 13 -3.461 17.234 -1.491 1.00 0.00 H new ATOM 0 HA SER A 13 -4.693 19.836 -1.198 1.00 0.00 H new ATOM 0 HB2 SER A 13 -5.898 18.823 0.531 1.00 0.00 H new ATOM 0 HB3 SER A 13 -5.571 17.452 -0.511 1.00 0.00 H new ATOM 0 HG SER A 13 -4.272 18.197 1.924 1.00 0.00 H new ATOM 222 N ALA A 14 -1.851 19.243 0.100 1.00 0.00 N ATOM 223 CA ALA A 14 -0.767 19.766 0.909 1.00 0.00 C ATOM 224 C ALA A 14 0.051 20.744 0.098 1.00 0.00 C ATOM 225 O ALA A 14 0.076 20.674 -1.130 1.00 0.00 O ATOM 226 CB ALA A 14 0.155 18.628 1.345 1.00 0.00 C ATOM 0 H ALA A 14 -1.572 18.521 -0.564 1.00 0.00 H new ATOM 0 HA ALA A 14 -1.195 20.260 1.781 1.00 0.00 H new ATOM 0 HB1 ALA A 14 0.966 19.029 1.952 1.00 0.00 H new ATOM 0 HB2 ALA A 14 -0.412 17.904 1.930 1.00 0.00 H new ATOM 0 HB3 ALA A 14 0.569 18.138 0.464 1.00 0.00 H new ATOM 232 N SER A 15 0.751 21.630 0.779 1.00 0.00 N ATOM 233 CA SER A 15 1.590 22.568 0.076 1.00 0.00 C ATOM 234 C SER A 15 2.620 21.776 -0.714 1.00 0.00 C ATOM 235 O SER A 15 3.112 20.736 -0.252 1.00 0.00 O ATOM 236 CB SER A 15 2.291 23.500 1.064 1.00 0.00 C ATOM 237 OG SER A 15 2.459 24.779 0.466 1.00 0.00 O ATOM 0 H SER A 15 0.754 21.717 1.795 1.00 0.00 H new ATOM 0 HA SER A 15 0.986 23.180 -0.594 1.00 0.00 H new ATOM 0 HB2 SER A 15 1.704 23.588 1.978 1.00 0.00 H new ATOM 0 HB3 SER A 15 3.260 23.088 1.346 1.00 0.00 H new ATOM 0 HG SER A 15 2.907 25.379 1.098 1.00 0.00 H new ATOM 243 N ARG A 16 2.953 22.241 -1.900 1.00 0.00 N ATOM 244 CA ARG A 16 3.927 21.521 -2.684 1.00 0.00 C ATOM 245 C ARG A 16 5.083 21.168 -1.768 1.00 0.00 C ATOM 246 O ARG A 16 5.874 20.266 -2.048 1.00 0.00 O ATOM 247 CB ARG A 16 4.413 22.363 -3.865 1.00 0.00 C ATOM 248 CG ARG A 16 3.211 22.992 -4.573 1.00 0.00 C ATOM 249 CD ARG A 16 2.342 21.892 -5.184 1.00 0.00 C ATOM 250 NE ARG A 16 1.520 22.438 -6.258 1.00 0.00 N ATOM 251 CZ ARG A 16 0.758 21.651 -7.012 1.00 0.00 C ATOM 252 NH1 ARG A 16 0.737 20.364 -6.800 1.00 0.00 N ATOM 253 NH2 ARG A 16 0.030 22.167 -7.964 1.00 0.00 N ATOM 0 H ARG A 16 2.577 23.086 -2.329 1.00 0.00 H new ATOM 0 HA ARG A 16 3.479 20.618 -3.099 1.00 0.00 H new ATOM 0 HB2 ARG A 16 5.091 23.142 -3.515 1.00 0.00 H new ATOM 0 HB3 ARG A 16 4.974 21.741 -4.562 1.00 0.00 H new ATOM 0 HG2 ARG A 16 2.627 23.580 -3.866 1.00 0.00 H new ATOM 0 HG3 ARG A 16 3.551 23.675 -5.351 1.00 0.00 H new ATOM 0 HD2 ARG A 16 2.974 21.092 -5.570 1.00 0.00 H new ATOM 0 HD3 ARG A 16 1.705 21.453 -4.416 1.00 0.00 H new ATOM 0 HE ARG A 16 1.530 23.443 -6.434 1.00 0.00 H new ATOM 0 HH11 ARG A 16 1.305 19.960 -6.055 1.00 0.00 H new ATOM 0 HH12 ARG A 16 0.152 19.761 -7.379 1.00 0.00 H new ATOM 0 HH21 ARG A 16 0.046 23.173 -8.129 1.00 0.00 H new ATOM 0 HH22 ARG A 16 -0.555 21.564 -8.543 1.00 0.00 H new ATOM 267 N GLY A 17 5.151 21.888 -0.651 1.00 0.00 N ATOM 268 CA GLY A 17 6.186 21.655 0.337 1.00 0.00 C ATOM 269 C GLY A 17 6.109 20.222 0.844 1.00 0.00 C ATOM 270 O GLY A 17 7.135 19.577 1.034 1.00 0.00 O ATOM 0 H GLY A 17 4.499 22.636 -0.413 1.00 0.00 H new ATOM 0 HA2 GLY A 17 7.167 21.842 -0.101 1.00 0.00 H new ATOM 0 HA3 GLY A 17 6.070 22.350 1.168 1.00 0.00 H new ATOM 274 N CYS A 18 4.890 19.712 1.042 1.00 0.00 N ATOM 275 CA CYS A 18 4.735 18.338 1.502 1.00 0.00 C ATOM 276 C CYS A 18 5.159 17.400 0.397 1.00 0.00 C ATOM 277 O CYS A 18 5.756 16.358 0.648 1.00 0.00 O ATOM 278 CB CYS A 18 3.276 18.051 1.876 1.00 0.00 C ATOM 279 SG CYS A 18 3.215 17.263 3.503 1.00 0.00 S ATOM 0 H CYS A 18 4.018 20.219 0.894 1.00 0.00 H new ATOM 0 HA CYS A 18 5.356 18.190 2.386 1.00 0.00 H new ATOM 0 HB2 CYS A 18 2.703 18.978 1.887 1.00 0.00 H new ATOM 0 HB3 CYS A 18 2.818 17.403 1.129 1.00 0.00 H new ATOM 0 HG CYS A 18 3.416 18.157 4.426 1.00 0.00 H new ATOM 285 N LEU A 19 4.858 17.785 -0.833 1.00 0.00 N ATOM 286 CA LEU A 19 5.240 16.960 -1.967 1.00 0.00 C ATOM 287 C LEU A 19 6.760 16.869 -2.027 1.00 0.00 C ATOM 288 O LEU A 19 7.322 15.815 -2.323 1.00 0.00 O ATOM 289 CB LEU A 19 4.681 17.552 -3.256 1.00 0.00 C ATOM 290 CG LEU A 19 4.897 16.570 -4.414 1.00 0.00 C ATOM 291 CD1 LEU A 19 4.259 15.215 -4.084 1.00 0.00 C ATOM 292 CD2 LEU A 19 4.260 17.136 -5.685 1.00 0.00 C ATOM 0 H LEU A 19 4.361 18.644 -1.069 1.00 0.00 H new ATOM 0 HA LEU A 19 4.828 15.958 -1.850 1.00 0.00 H new ATOM 0 HB2 LEU A 19 3.618 17.763 -3.139 1.00 0.00 H new ATOM 0 HB3 LEU A 19 5.172 18.500 -3.475 1.00 0.00 H new ATOM 0 HG LEU A 19 5.967 16.431 -4.568 1.00 0.00 H new ATOM 0 HD11 LEU A 19 4.419 14.526 -4.913 1.00 0.00 H new ATOM 0 HD12 LEU A 19 4.715 14.808 -3.181 1.00 0.00 H new ATOM 0 HD13 LEU A 19 3.189 15.346 -3.922 1.00 0.00 H new ATOM 0 HD21 LEU A 19 4.412 16.440 -6.510 1.00 0.00 H new ATOM 0 HD22 LEU A 19 3.192 17.279 -5.524 1.00 0.00 H new ATOM 0 HD23 LEU A 19 4.722 18.093 -5.928 1.00 0.00 H new ATOM 304 N ARG A 20 7.419 17.979 -1.700 1.00 0.00 N ATOM 305 CA ARG A 20 8.876 18.017 -1.673 1.00 0.00 C ATOM 306 C ARG A 20 9.359 17.205 -0.476 1.00 0.00 C ATOM 307 O ARG A 20 10.363 16.501 -0.541 1.00 0.00 O ATOM 308 CB ARG A 20 9.353 19.472 -1.569 1.00 0.00 C ATOM 309 CG ARG A 20 9.936 19.746 -0.183 1.00 0.00 C ATOM 310 CD ARG A 20 11.284 19.039 -0.034 1.00 0.00 C ATOM 311 NE ARG A 20 11.305 18.242 1.188 1.00 0.00 N ATOM 312 CZ ARG A 20 11.626 18.789 2.355 1.00 0.00 C ATOM 313 NH1 ARG A 20 11.919 20.059 2.418 1.00 0.00 N ATOM 314 NH2 ARG A 20 11.645 18.061 3.438 1.00 0.00 N ATOM 0 H ARG A 20 6.968 18.859 -1.451 1.00 0.00 H new ATOM 0 HA ARG A 20 9.284 17.589 -2.589 1.00 0.00 H new ATOM 0 HB2 ARG A 20 10.106 19.670 -2.332 1.00 0.00 H new ATOM 0 HB3 ARG A 20 8.520 20.149 -1.760 1.00 0.00 H new ATOM 0 HG2 ARG A 20 10.061 20.819 -0.037 1.00 0.00 H new ATOM 0 HG3 ARG A 20 9.246 19.398 0.586 1.00 0.00 H new ATOM 0 HD2 ARG A 20 11.464 18.398 -0.897 1.00 0.00 H new ATOM 0 HD3 ARG A 20 12.088 19.775 -0.010 1.00 0.00 H new ATOM 0 HE ARG A 20 11.070 17.250 1.145 1.00 0.00 H new ATOM 0 HH11 ARG A 20 11.901 20.629 1.572 1.00 0.00 H new ATOM 0 HH12 ARG A 20 12.166 20.482 3.313 1.00 0.00 H new ATOM 0 HH21 ARG A 20 11.413 17.069 3.390 1.00 0.00 H new ATOM 0 HH22 ARG A 20 11.892 18.484 4.333 1.00 0.00 H new ATOM 328 N SER A 21 8.596 17.308 0.603 1.00 0.00 N ATOM 329 CA SER A 21 8.879 16.586 1.830 1.00 0.00 C ATOM 330 C SER A 21 8.904 15.106 1.510 1.00 0.00 C ATOM 331 O SER A 21 9.883 14.399 1.783 1.00 0.00 O ATOM 332 CB SER A 21 7.769 16.932 2.827 1.00 0.00 C ATOM 333 OG SER A 21 7.536 18.332 2.783 1.00 0.00 O ATOM 0 H SER A 21 7.763 17.895 0.650 1.00 0.00 H new ATOM 0 HA SER A 21 9.842 16.857 2.263 1.00 0.00 H new ATOM 0 HB2 SER A 21 6.857 16.389 2.580 1.00 0.00 H new ATOM 0 HB3 SER A 21 8.057 16.629 3.833 1.00 0.00 H new ATOM 0 HG SER A 21 7.262 18.590 1.878 1.00 0.00 H new ATOM 339 N LEU A 22 7.851 14.659 0.873 1.00 0.00 N ATOM 340 CA LEU A 22 7.761 13.269 0.476 1.00 0.00 C ATOM 341 C LEU A 22 8.894 12.920 -0.473 1.00 0.00 C ATOM 342 O LEU A 22 9.631 11.965 -0.246 1.00 0.00 O ATOM 343 CB LEU A 22 6.433 13.009 -0.219 1.00 0.00 C ATOM 344 CG LEU A 22 5.617 12.002 0.580 1.00 0.00 C ATOM 345 CD1 LEU A 22 5.272 12.575 1.955 1.00 0.00 C ATOM 346 CD2 LEU A 22 4.334 11.711 -0.178 1.00 0.00 C ATOM 0 H LEU A 22 7.046 15.231 0.617 1.00 0.00 H new ATOM 0 HA LEU A 22 7.833 12.650 1.370 1.00 0.00 H new ATOM 0 HB2 LEU A 22 5.877 13.941 -0.321 1.00 0.00 H new ATOM 0 HB3 LEU A 22 6.608 12.631 -1.226 1.00 0.00 H new ATOM 0 HG LEU A 22 6.196 11.088 0.715 1.00 0.00 H new ATOM 0 HD11 LEU A 22 4.688 11.846 2.517 1.00 0.00 H new ATOM 0 HD12 LEU A 22 6.191 12.800 2.497 1.00 0.00 H new ATOM 0 HD13 LEU A 22 4.690 13.489 1.833 1.00 0.00 H new ATOM 0 HD21 LEU A 22 3.737 10.991 0.381 1.00 0.00 H new ATOM 0 HD22 LEU A 22 3.767 12.634 -0.302 1.00 0.00 H new ATOM 0 HD23 LEU A 22 4.576 11.299 -1.158 1.00 0.00 H new ATOM 358 N SER A 23 9.019 13.696 -1.543 1.00 0.00 N ATOM 359 CA SER A 23 10.059 13.440 -2.520 1.00 0.00 C ATOM 360 C SER A 23 11.423 13.405 -1.861 1.00 0.00 C ATOM 361 O SER A 23 12.316 12.684 -2.306 1.00 0.00 O ATOM 362 CB SER A 23 9.993 14.446 -3.654 1.00 0.00 C ATOM 363 OG SER A 23 11.310 14.749 -4.099 1.00 0.00 O ATOM 0 H SER A 23 8.421 14.495 -1.751 1.00 0.00 H new ATOM 0 HA SER A 23 9.891 12.455 -2.956 1.00 0.00 H new ATOM 0 HB2 SER A 23 9.404 14.043 -4.478 1.00 0.00 H new ATOM 0 HB3 SER A 23 9.493 15.355 -3.319 1.00 0.00 H new ATOM 0 HG SER A 23 11.266 15.398 -4.832 1.00 0.00 H new ATOM 369 N LEU A 24 11.575 14.143 -0.771 1.00 0.00 N ATOM 370 CA LEU A 24 12.829 14.124 -0.048 1.00 0.00 C ATOM 371 C LEU A 24 13.092 12.702 0.428 1.00 0.00 C ATOM 372 O LEU A 24 14.240 12.267 0.522 1.00 0.00 O ATOM 373 CB LEU A 24 12.769 15.074 1.143 1.00 0.00 C ATOM 374 CG LEU A 24 13.730 16.238 0.911 1.00 0.00 C ATOM 375 CD1 LEU A 24 15.173 15.745 1.029 1.00 0.00 C ATOM 376 CD2 LEU A 24 13.506 16.827 -0.484 1.00 0.00 C ATOM 0 H LEU A 24 10.857 14.751 -0.377 1.00 0.00 H new ATOM 0 HA LEU A 24 13.636 14.452 -0.703 1.00 0.00 H new ATOM 0 HB2 LEU A 24 11.753 15.447 1.274 1.00 0.00 H new ATOM 0 HB3 LEU A 24 13.035 14.545 2.058 1.00 0.00 H new ATOM 0 HG LEU A 24 13.545 17.007 1.661 1.00 0.00 H new ATOM 0 HD11 LEU A 24 15.857 16.578 0.863 1.00 0.00 H new ATOM 0 HD12 LEU A 24 15.337 15.334 2.025 1.00 0.00 H new ATOM 0 HD13 LEU A 24 15.355 14.972 0.283 1.00 0.00 H new ATOM 0 HD21 LEU A 24 14.194 17.657 -0.643 1.00 0.00 H new ATOM 0 HD22 LEU A 24 13.684 16.058 -1.236 1.00 0.00 H new ATOM 0 HD23 LEU A 24 12.480 17.186 -0.567 1.00 0.00 H new ATOM 388 N ILE A 25 12.009 11.977 0.722 1.00 0.00 N ATOM 389 CA ILE A 25 12.135 10.594 1.182 1.00 0.00 C ATOM 390 C ILE A 25 11.382 9.607 0.283 1.00 0.00 C ATOM 391 O ILE A 25 11.020 8.518 0.727 1.00 0.00 O ATOM 392 CB ILE A 25 11.613 10.451 2.608 1.00 0.00 C ATOM 393 CG1 ILE A 25 12.215 9.186 3.225 1.00 0.00 C ATOM 394 CG2 ILE A 25 10.101 10.293 2.584 1.00 0.00 C ATOM 395 CD1 ILE A 25 13.158 9.557 4.369 1.00 0.00 C ATOM 0 H ILE A 25 11.051 12.319 0.651 1.00 0.00 H new ATOM 0 HA ILE A 25 13.198 10.354 1.143 1.00 0.00 H new ATOM 0 HB ILE A 25 11.886 11.334 3.186 1.00 0.00 H new ATOM 0 HG12 ILE A 25 11.420 8.538 3.594 1.00 0.00 H new ATOM 0 HG13 ILE A 25 12.757 8.624 2.465 1.00 0.00 H new ATOM 0 HG21 ILE A 25 9.730 10.191 3.604 1.00 0.00 H new ATOM 0 HG22 ILE A 25 9.651 11.171 2.120 1.00 0.00 H new ATOM 0 HG23 ILE A 25 9.837 9.404 2.011 1.00 0.00 H new ATOM 0 HD11 ILE A 25 13.581 8.650 4.801 1.00 0.00 H new ATOM 0 HD12 ILE A 25 13.962 10.186 3.988 1.00 0.00 H new ATOM 0 HD13 ILE A 25 12.605 10.100 5.135 1.00 0.00 H new ATOM 407 N ILE A 26 11.134 9.981 -0.968 1.00 0.00 N ATOM 408 CA ILE A 26 10.419 9.118 -1.878 1.00 0.00 C ATOM 409 C ILE A 26 11.228 7.861 -2.173 1.00 0.00 C ATOM 410 O ILE A 26 12.418 7.933 -2.480 1.00 0.00 O ATOM 411 CB ILE A 26 10.151 9.892 -3.173 1.00 0.00 C ATOM 412 CG1 ILE A 26 8.731 10.455 -3.163 1.00 0.00 C ATOM 413 CG2 ILE A 26 10.308 8.982 -4.370 1.00 0.00 C ATOM 414 CD1 ILE A 26 7.736 9.330 -3.330 1.00 0.00 C ATOM 0 H ILE A 26 11.420 10.875 -1.366 1.00 0.00 H new ATOM 0 HA ILE A 26 9.476 8.810 -1.426 1.00 0.00 H new ATOM 0 HB ILE A 26 10.870 10.708 -3.239 1.00 0.00 H new ATOM 0 HG12 ILE A 26 8.545 10.982 -2.227 1.00 0.00 H new ATOM 0 HG13 ILE A 26 8.612 11.181 -3.967 1.00 0.00 H new ATOM 0 HG21 ILE A 26 10.115 9.545 -5.283 1.00 0.00 H new ATOM 0 HG22 ILE A 26 11.323 8.587 -4.396 1.00 0.00 H new ATOM 0 HG23 ILE A 26 9.599 8.157 -4.296 1.00 0.00 H new ATOM 0 HD11 ILE A 26 6.724 9.735 -3.322 1.00 0.00 H new ATOM 0 HD12 ILE A 26 7.917 8.822 -4.277 1.00 0.00 H new ATOM 0 HD13 ILE A 26 7.849 8.620 -2.511 1.00 0.00 H new ATOM 426 N LYS A 27 10.569 6.711 -2.096 1.00 0.00 N ATOM 427 CA LYS A 27 11.246 5.450 -2.379 1.00 0.00 C ATOM 428 C LYS A 27 10.565 4.720 -3.534 1.00 0.00 C ATOM 429 O LYS A 27 9.343 4.766 -3.676 1.00 0.00 O ATOM 430 CB LYS A 27 11.267 4.570 -1.135 1.00 0.00 C ATOM 431 CG LYS A 27 12.677 4.012 -0.955 1.00 0.00 C ATOM 432 CD LYS A 27 13.615 5.123 -0.476 1.00 0.00 C ATOM 433 CE LYS A 27 14.543 4.574 0.608 1.00 0.00 C ATOM 434 NZ LYS A 27 15.032 3.225 0.203 1.00 0.00 N ATOM 0 H LYS A 27 9.584 6.624 -1.845 1.00 0.00 H new ATOM 0 HA LYS A 27 12.273 5.669 -2.670 1.00 0.00 H new ATOM 0 HB2 LYS A 27 10.974 5.148 -0.258 1.00 0.00 H new ATOM 0 HB3 LYS A 27 10.548 3.757 -1.235 1.00 0.00 H new ATOM 0 HG2 LYS A 27 12.666 3.196 -0.233 1.00 0.00 H new ATOM 0 HG3 LYS A 27 13.038 3.599 -1.897 1.00 0.00 H new ATOM 0 HD2 LYS A 27 14.201 5.505 -1.312 1.00 0.00 H new ATOM 0 HD3 LYS A 27 13.036 5.959 -0.085 1.00 0.00 H new ATOM 0 HE2 LYS A 27 15.386 5.249 0.757 1.00 0.00 H new ATOM 0 HE3 LYS A 27 14.013 4.511 1.558 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 15.956 3.044 0.645 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 14.352 2.502 0.513 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 15.130 3.187 -0.832 1.00 0.00 H new ATOM 448 N THR A 28 11.362 4.055 -4.364 1.00 0.00 N ATOM 449 CA THR A 28 10.820 3.329 -5.508 1.00 0.00 C ATOM 450 C THR A 28 11.350 1.899 -5.547 1.00 0.00 C ATOM 451 O THR A 28 12.556 1.674 -5.650 1.00 0.00 O ATOM 452 CB THR A 28 11.194 4.048 -6.805 1.00 0.00 C ATOM 453 OG1 THR A 28 12.453 3.573 -7.261 1.00 0.00 O ATOM 454 CG2 THR A 28 11.277 5.554 -6.551 1.00 0.00 C ATOM 0 H THR A 28 12.376 4.003 -4.268 1.00 0.00 H new ATOM 0 HA THR A 28 9.735 3.295 -5.407 1.00 0.00 H new ATOM 0 HB THR A 28 10.434 3.851 -7.562 1.00 0.00 H new ATOM 0 HG1 THR A 28 12.937 3.162 -6.515 1.00 0.00 H new ATOM 0 HG21 THR A 28 11.544 6.065 -7.476 1.00 0.00 H new ATOM 0 HG22 THR A 28 10.311 5.918 -6.201 1.00 0.00 H new ATOM 0 HG23 THR A 28 12.036 5.754 -5.794 1.00 0.00 H new ATOM 462 N SER A 29 10.437 0.936 -5.468 1.00 0.00 N ATOM 463 CA SER A 29 10.813 -0.474 -5.500 1.00 0.00 C ATOM 464 C SER A 29 10.280 -1.131 -6.771 1.00 0.00 C ATOM 465 O SER A 29 9.226 -0.749 -7.280 1.00 0.00 O ATOM 466 CB SER A 29 10.246 -1.194 -4.275 1.00 0.00 C ATOM 467 OG SER A 29 8.876 -0.850 -4.129 1.00 0.00 O ATOM 0 H SER A 29 9.435 1.105 -5.382 1.00 0.00 H new ATOM 0 HA SER A 29 11.901 -0.546 -5.489 1.00 0.00 H new ATOM 0 HB2 SER A 29 10.353 -2.273 -4.389 1.00 0.00 H new ATOM 0 HB3 SER A 29 10.802 -0.911 -3.381 1.00 0.00 H new ATOM 0 HG SER A 29 8.791 -0.103 -3.500 1.00 0.00 H new ATOM 473 N PHE A 30 11.011 -2.115 -7.283 1.00 0.00 N ATOM 474 CA PHE A 30 10.593 -2.808 -8.498 1.00 0.00 C ATOM 475 C PHE A 30 10.646 -4.322 -8.305 1.00 0.00 C ATOM 476 O PHE A 30 11.511 -4.834 -7.596 1.00 0.00 O ATOM 477 CB PHE A 30 11.501 -2.410 -9.664 1.00 0.00 C ATOM 478 CG PHE A 30 12.794 -3.183 -9.582 1.00 0.00 C ATOM 479 CD1 PHE A 30 12.888 -4.446 -10.173 1.00 0.00 C ATOM 480 CD2 PHE A 30 13.898 -2.637 -8.916 1.00 0.00 C ATOM 481 CE1 PHE A 30 14.086 -5.168 -10.097 1.00 0.00 C ATOM 482 CE2 PHE A 30 15.096 -3.357 -8.841 1.00 0.00 C ATOM 483 CZ PHE A 30 15.190 -4.623 -9.432 1.00 0.00 C ATOM 0 H PHE A 30 11.887 -2.449 -6.881 1.00 0.00 H new ATOM 0 HA PHE A 30 9.565 -2.520 -8.719 1.00 0.00 H new ATOM 0 HB2 PHE A 30 11.003 -2.613 -10.612 1.00 0.00 H new ATOM 0 HB3 PHE A 30 11.703 -1.339 -9.633 1.00 0.00 H new ATOM 0 HD1 PHE A 30 12.037 -4.865 -10.688 1.00 0.00 H new ATOM 0 HD2 PHE A 30 13.825 -1.661 -8.460 1.00 0.00 H new ATOM 0 HE1 PHE A 30 14.158 -6.145 -10.552 1.00 0.00 H new ATOM 0 HE2 PHE A 30 15.948 -2.936 -8.327 1.00 0.00 H new ATOM 0 HZ PHE A 30 16.114 -5.179 -9.375 1.00 0.00 H new ATOM 493 N CYS A 31 9.718 -5.032 -8.943 1.00 0.00 N ATOM 494 CA CYS A 31 9.677 -6.489 -8.833 1.00 0.00 C ATOM 495 C CYS A 31 9.629 -7.133 -10.213 1.00 0.00 C ATOM 496 O CYS A 31 9.145 -6.534 -11.175 1.00 0.00 O ATOM 497 CB CYS A 31 8.460 -6.928 -8.020 1.00 0.00 C ATOM 498 SG CYS A 31 8.406 -6.004 -6.465 1.00 0.00 S ATOM 0 H CYS A 31 8.992 -4.628 -9.535 1.00 0.00 H new ATOM 0 HA CYS A 31 10.584 -6.814 -8.324 1.00 0.00 H new ATOM 0 HB2 CYS A 31 7.547 -6.755 -8.590 1.00 0.00 H new ATOM 0 HB3 CYS A 31 8.511 -7.998 -7.818 1.00 0.00 H new ATOM 0 HG CYS A 31 7.369 -6.376 -5.775 1.00 0.00 H new ATOM 504 N ALA A 32 10.145 -8.355 -10.303 1.00 0.00 N ATOM 505 CA ALA A 32 10.174 -9.076 -11.568 1.00 0.00 C ATOM 506 C ALA A 32 9.238 -10.283 -11.531 1.00 0.00 C ATOM 507 O ALA A 32 8.770 -10.680 -10.464 1.00 0.00 O ATOM 508 CB ALA A 32 11.598 -9.554 -11.834 1.00 0.00 C ATOM 0 H ALA A 32 10.547 -8.864 -9.516 1.00 0.00 H new ATOM 0 HA ALA A 32 9.842 -8.405 -12.360 1.00 0.00 H new ATOM 0 HB1 ALA A 32 11.629 -10.095 -12.780 1.00 0.00 H new ATOM 0 HB2 ALA A 32 12.267 -8.695 -11.885 1.00 0.00 H new ATOM 0 HB3 ALA A 32 11.917 -10.214 -11.027 1.00 0.00 H new ATOM 514 N PRO A 33 8.971 -10.886 -12.667 1.00 0.00 N ATOM 515 CA PRO A 33 8.089 -12.086 -12.739 1.00 0.00 C ATOM 516 C PRO A 33 8.626 -13.219 -11.870 1.00 0.00 C ATOM 517 O PRO A 33 9.779 -13.626 -12.011 1.00 0.00 O ATOM 518 CB PRO A 33 8.107 -12.483 -14.220 1.00 0.00 C ATOM 519 CG PRO A 33 8.577 -11.275 -14.958 1.00 0.00 C ATOM 520 CD PRO A 33 9.468 -10.494 -13.996 1.00 0.00 C ATOM 0 HA PRO A 33 7.083 -11.879 -12.373 1.00 0.00 H new ATOM 0 HB2 PRO A 33 8.773 -13.329 -14.390 1.00 0.00 H new ATOM 0 HB3 PRO A 33 7.115 -12.785 -14.556 1.00 0.00 H new ATOM 0 HG2 PRO A 33 9.130 -11.559 -15.854 1.00 0.00 H new ATOM 0 HG3 PRO A 33 7.733 -10.667 -15.284 1.00 0.00 H new ATOM 0 HD2 PRO A 33 10.519 -10.753 -14.123 1.00 0.00 H new ATOM 0 HD3 PRO A 33 9.383 -9.419 -14.155 1.00 0.00 H new ATOM 528 N GLY A 34 7.790 -13.721 -10.971 1.00 0.00 N ATOM 529 CA GLY A 34 8.204 -14.803 -10.087 1.00 0.00 C ATOM 530 C GLY A 34 9.198 -14.303 -9.043 1.00 0.00 C ATOM 531 O GLY A 34 9.725 -15.086 -8.253 1.00 0.00 O ATOM 0 H GLY A 34 6.831 -13.401 -10.835 1.00 0.00 H new ATOM 0 HA2 GLY A 34 7.331 -15.226 -9.590 1.00 0.00 H new ATOM 0 HA3 GLY A 34 8.657 -15.603 -10.672 1.00 0.00 H new ATOM 535 N GLU A 35 9.462 -12.997 -9.051 1.00 0.00 N ATOM 536 CA GLU A 35 10.409 -12.415 -8.104 1.00 0.00 C ATOM 537 C GLU A 35 9.800 -12.327 -6.707 1.00 0.00 C ATOM 538 O GLU A 35 8.673 -11.875 -6.541 1.00 0.00 O ATOM 539 CB GLU A 35 10.828 -11.034 -8.586 1.00 0.00 C ATOM 540 CG GLU A 35 12.245 -10.713 -8.120 1.00 0.00 C ATOM 541 CD GLU A 35 12.200 -9.881 -6.844 1.00 0.00 C ATOM 542 OE1 GLU A 35 11.970 -10.457 -5.793 1.00 0.00 O ATOM 543 OE2 GLU A 35 12.397 -8.680 -6.936 1.00 0.00 O ATOM 0 H GLU A 35 9.038 -12.329 -9.695 1.00 0.00 H new ATOM 0 HA GLU A 35 11.286 -13.059 -8.047 1.00 0.00 H new ATOM 0 HB2 GLU A 35 10.778 -10.991 -9.674 1.00 0.00 H new ATOM 0 HB3 GLU A 35 10.135 -10.284 -8.206 1.00 0.00 H new ATOM 0 HG2 GLU A 35 12.796 -11.637 -7.942 1.00 0.00 H new ATOM 0 HG3 GLU A 35 12.778 -10.169 -8.900 1.00 0.00 H new ATOM 550 N PHE A 36 10.551 -12.782 -5.707 1.00 0.00 N ATOM 551 CA PHE A 36 10.069 -12.774 -4.323 1.00 0.00 C ATOM 552 C PHE A 36 10.515 -11.525 -3.565 1.00 0.00 C ATOM 553 O PHE A 36 11.705 -11.328 -3.323 1.00 0.00 O ATOM 554 CB PHE A 36 10.586 -14.014 -3.593 1.00 0.00 C ATOM 555 CG PHE A 36 10.823 -15.126 -4.587 1.00 0.00 C ATOM 556 CD1 PHE A 36 11.944 -15.087 -5.427 1.00 0.00 C ATOM 557 CD2 PHE A 36 9.926 -16.197 -4.668 1.00 0.00 C ATOM 558 CE1 PHE A 36 12.165 -16.118 -6.347 1.00 0.00 C ATOM 559 CE2 PHE A 36 10.148 -17.229 -5.588 1.00 0.00 C ATOM 560 CZ PHE A 36 11.268 -17.189 -6.428 1.00 0.00 C ATOM 0 H PHE A 36 11.491 -13.160 -5.825 1.00 0.00 H new ATOM 0 HA PHE A 36 8.980 -12.775 -4.356 1.00 0.00 H new ATOM 0 HB2 PHE A 36 11.512 -13.779 -3.067 1.00 0.00 H new ATOM 0 HB3 PHE A 36 9.864 -14.333 -2.841 1.00 0.00 H new ATOM 0 HD1 PHE A 36 12.637 -14.261 -5.364 1.00 0.00 H new ATOM 0 HD2 PHE A 36 9.062 -16.228 -4.021 1.00 0.00 H new ATOM 0 HE1 PHE A 36 13.028 -16.087 -6.995 1.00 0.00 H new ATOM 0 HE2 PHE A 36 9.456 -18.056 -5.650 1.00 0.00 H new ATOM 0 HZ PHE A 36 11.439 -17.985 -7.138 1.00 0.00 H new ATOM 570 N LEU A 37 9.548 -10.693 -3.170 1.00 0.00 N ATOM 571 CA LEU A 37 9.860 -9.482 -2.416 1.00 0.00 C ATOM 572 C LEU A 37 9.776 -9.753 -0.911 1.00 0.00 C ATOM 573 O LEU A 37 10.702 -9.426 -0.169 1.00 0.00 O ATOM 574 CB LEU A 37 8.902 -8.346 -2.794 1.00 0.00 C ATOM 575 CG LEU A 37 9.599 -7.370 -3.748 1.00 0.00 C ATOM 576 CD1 LEU A 37 10.858 -6.806 -3.086 1.00 0.00 C ATOM 577 CD2 LEU A 37 9.980 -8.103 -5.037 1.00 0.00 C ATOM 0 H LEU A 37 8.556 -10.835 -3.358 1.00 0.00 H new ATOM 0 HA LEU A 37 10.877 -9.180 -2.666 1.00 0.00 H new ATOM 0 HB2 LEU A 37 8.009 -8.754 -3.267 1.00 0.00 H new ATOM 0 HB3 LEU A 37 8.576 -7.820 -1.897 1.00 0.00 H new ATOM 0 HG LEU A 37 8.921 -6.549 -3.982 1.00 0.00 H new ATOM 0 HD11 LEU A 37 11.349 -6.113 -3.769 1.00 0.00 H new ATOM 0 HD12 LEU A 37 10.584 -6.281 -2.171 1.00 0.00 H new ATOM 0 HD13 LEU A 37 11.539 -7.622 -2.845 1.00 0.00 H new ATOM 0 HD21 LEU A 37 10.476 -7.410 -5.717 1.00 0.00 H new ATOM 0 HD22 LEU A 37 10.655 -8.926 -4.802 1.00 0.00 H new ATOM 0 HD23 LEU A 37 9.081 -8.496 -5.512 1.00 0.00 H new ATOM 589 N ILE A 38 8.673 -10.360 -0.460 1.00 0.00 N ATOM 590 CA ILE A 38 8.528 -10.665 0.962 1.00 0.00 C ATOM 591 C ILE A 38 8.530 -12.170 1.202 1.00 0.00 C ATOM 592 O ILE A 38 8.033 -12.944 0.389 1.00 0.00 O ATOM 593 CB ILE A 38 7.252 -10.033 1.552 1.00 0.00 C ATOM 594 CG1 ILE A 38 7.567 -9.319 2.867 1.00 0.00 C ATOM 595 CG2 ILE A 38 6.235 -11.115 1.866 1.00 0.00 C ATOM 596 CD1 ILE A 38 7.512 -7.809 2.640 1.00 0.00 C ATOM 0 H ILE A 38 7.887 -10.643 -1.045 1.00 0.00 H new ATOM 0 HA ILE A 38 9.387 -10.230 1.473 1.00 0.00 H new ATOM 0 HB ILE A 38 6.861 -9.329 0.818 1.00 0.00 H new ATOM 0 HG12 ILE A 38 6.850 -9.610 3.635 1.00 0.00 H new ATOM 0 HG13 ILE A 38 8.554 -9.610 3.226 1.00 0.00 H new ATOM 0 HG21 ILE A 38 5.336 -10.660 2.283 1.00 0.00 H new ATOM 0 HG22 ILE A 38 5.980 -11.651 0.952 1.00 0.00 H new ATOM 0 HG23 ILE A 38 6.657 -11.812 2.590 1.00 0.00 H new ATOM 0 HD11 ILE A 38 7.736 -7.292 3.573 1.00 0.00 H new ATOM 0 HD12 ILE A 38 8.246 -7.528 1.885 1.00 0.00 H new ATOM 0 HD13 ILE A 38 6.515 -7.528 2.300 1.00 0.00 H new ATOM 608 N ARG A 39 9.090 -12.571 2.333 1.00 0.00 N ATOM 609 CA ARG A 39 9.141 -13.980 2.691 1.00 0.00 C ATOM 610 C ARG A 39 8.643 -14.186 4.122 1.00 0.00 C ATOM 611 O ARG A 39 9.339 -13.882 5.089 1.00 0.00 O ATOM 612 CB ARG A 39 10.569 -14.508 2.552 1.00 0.00 C ATOM 613 CG ARG A 39 11.520 -13.352 2.248 1.00 0.00 C ATOM 614 CD ARG A 39 11.355 -12.270 3.310 1.00 0.00 C ATOM 615 NE ARG A 39 12.602 -12.085 4.041 1.00 0.00 N ATOM 616 CZ ARG A 39 12.995 -12.955 4.967 1.00 0.00 C ATOM 617 NH1 ARG A 39 12.243 -13.979 5.263 1.00 0.00 N ATOM 618 NH2 ARG A 39 14.130 -12.779 5.586 1.00 0.00 N ATOM 0 H ARG A 39 9.514 -11.943 3.016 1.00 0.00 H new ATOM 0 HA ARG A 39 8.492 -14.533 2.013 1.00 0.00 H new ATOM 0 HB2 ARG A 39 10.873 -15.009 3.471 1.00 0.00 H new ATOM 0 HB3 ARG A 39 10.616 -15.250 1.755 1.00 0.00 H new ATOM 0 HG2 ARG A 39 12.550 -13.708 2.232 1.00 0.00 H new ATOM 0 HG3 ARG A 39 11.309 -12.943 1.260 1.00 0.00 H new ATOM 0 HD2 ARG A 39 11.058 -11.332 2.840 1.00 0.00 H new ATOM 0 HD3 ARG A 39 10.558 -12.547 4.000 1.00 0.00 H new ATOM 0 HE ARG A 39 13.185 -11.273 3.839 1.00 0.00 H new ATOM 0 HH11 ARG A 39 11.352 -14.113 4.784 1.00 0.00 H new ATOM 0 HH12 ARG A 39 12.546 -14.646 5.973 1.00 0.00 H new ATOM 0 HH21 ARG A 39 14.715 -11.975 5.360 1.00 0.00 H new ATOM 0 HH22 ARG A 39 14.432 -13.446 6.296 1.00 0.00 H new ATOM 632 N GLN A 40 7.434 -14.712 4.232 1.00 0.00 N ATOM 633 CA GLN A 40 6.804 -14.980 5.527 1.00 0.00 C ATOM 634 C GLN A 40 7.771 -14.766 6.689 1.00 0.00 C ATOM 635 O GLN A 40 8.879 -15.304 6.699 1.00 0.00 O ATOM 636 CB GLN A 40 6.287 -16.418 5.559 1.00 0.00 C ATOM 637 CG GLN A 40 6.038 -16.842 7.008 1.00 0.00 C ATOM 638 CD GLN A 40 7.236 -17.618 7.542 1.00 0.00 C ATOM 639 OE1 GLN A 40 8.020 -17.064 8.426 1.00 0.00 O flip ATOM 640 NE2 GLN A 40 7.464 -18.760 7.143 1.00 0.00 N flip ATOM 0 H GLN A 40 6.857 -14.967 3.430 1.00 0.00 H new ATOM 0 HA GLN A 40 5.979 -14.277 5.643 1.00 0.00 H new ATOM 0 HB2 GLN A 40 5.365 -16.496 4.983 1.00 0.00 H new ATOM 0 HB3 GLN A 40 7.012 -17.086 5.093 1.00 0.00 H new ATOM 0 HG2 GLN A 40 5.860 -15.962 7.627 1.00 0.00 H new ATOM 0 HG3 GLN A 40 5.141 -17.459 7.065 1.00 0.00 H new ATOM 0 HE21 GLN A 40 6.850 -19.191 6.452 1.00 0.00 H new ATOM 0 HE22 GLN A 40 8.267 -19.275 7.503 1.00 0.00 H new ATOM 649 N GLY A 41 7.331 -13.989 7.673 1.00 0.00 N ATOM 650 CA GLY A 41 8.149 -13.713 8.847 1.00 0.00 C ATOM 651 C GLY A 41 8.917 -12.406 8.702 1.00 0.00 C ATOM 652 O GLY A 41 9.762 -12.081 9.535 1.00 0.00 O ATOM 0 H GLY A 41 6.415 -13.541 7.681 1.00 0.00 H new ATOM 0 HA2 GLY A 41 7.513 -13.666 9.731 1.00 0.00 H new ATOM 0 HA3 GLY A 41 8.851 -14.532 9.003 1.00 0.00 H new ATOM 656 N ASP A 42 8.626 -11.658 7.643 1.00 0.00 N ATOM 657 CA ASP A 42 9.315 -10.390 7.422 1.00 0.00 C ATOM 658 C ASP A 42 8.735 -9.301 8.315 1.00 0.00 C ATOM 659 O ASP A 42 7.852 -9.560 9.132 1.00 0.00 O ATOM 660 CB ASP A 42 9.207 -9.965 5.956 1.00 0.00 C ATOM 661 CG ASP A 42 10.547 -10.166 5.256 1.00 0.00 C ATOM 662 OD1 ASP A 42 11.322 -10.983 5.725 1.00 0.00 O ATOM 663 OD2 ASP A 42 10.779 -9.500 4.260 1.00 0.00 O ATOM 0 H ASP A 42 7.932 -11.900 6.936 1.00 0.00 H new ATOM 0 HA ASP A 42 10.366 -10.531 7.673 1.00 0.00 H new ATOM 0 HB2 ASP A 42 8.434 -10.549 5.455 1.00 0.00 H new ATOM 0 HB3 ASP A 42 8.907 -8.919 5.893 1.00 0.00 H new ATOM 668 N ALA A 43 9.248 -8.087 8.164 1.00 0.00 N ATOM 669 CA ALA A 43 8.783 -6.967 8.972 1.00 0.00 C ATOM 670 C ALA A 43 8.232 -5.852 8.088 1.00 0.00 C ATOM 671 O ALA A 43 8.743 -5.601 6.998 1.00 0.00 O ATOM 672 CB ALA A 43 9.941 -6.428 9.807 1.00 0.00 C ATOM 0 H ALA A 43 9.981 -7.853 7.494 1.00 0.00 H new ATOM 0 HA ALA A 43 7.984 -7.318 9.625 1.00 0.00 H new ATOM 0 HB1 ALA A 43 9.594 -5.590 10.412 1.00 0.00 H new ATOM 0 HB2 ALA A 43 10.316 -7.216 10.460 1.00 0.00 H new ATOM 0 HB3 ALA A 43 10.741 -6.092 9.147 1.00 0.00 H new ATOM 678 N LEU A 44 7.190 -5.182 8.572 1.00 0.00 N ATOM 679 CA LEU A 44 6.582 -4.091 7.821 1.00 0.00 C ATOM 680 C LEU A 44 7.339 -2.791 8.059 1.00 0.00 C ATOM 681 O LEU A 44 7.457 -2.329 9.193 1.00 0.00 O ATOM 682 CB LEU A 44 5.126 -3.913 8.242 1.00 0.00 C ATOM 683 CG LEU A 44 4.372 -3.168 7.138 1.00 0.00 C ATOM 684 CD1 LEU A 44 3.338 -4.096 6.502 1.00 0.00 C ATOM 685 CD2 LEU A 44 3.668 -1.953 7.739 1.00 0.00 C ATOM 0 H LEU A 44 6.753 -5.374 9.473 1.00 0.00 H new ATOM 0 HA LEU A 44 6.627 -4.339 6.761 1.00 0.00 H new ATOM 0 HB2 LEU A 44 4.665 -4.884 8.422 1.00 0.00 H new ATOM 0 HB3 LEU A 44 5.071 -3.356 9.177 1.00 0.00 H new ATOM 0 HG LEU A 44 5.077 -2.841 6.374 1.00 0.00 H new ATOM 0 HD11 LEU A 44 2.804 -3.561 5.717 1.00 0.00 H new ATOM 0 HD12 LEU A 44 3.842 -4.962 6.073 1.00 0.00 H new ATOM 0 HD13 LEU A 44 2.630 -4.427 7.262 1.00 0.00 H new ATOM 0 HD21 LEU A 44 3.130 -1.420 6.955 1.00 0.00 H new ATOM 0 HD22 LEU A 44 2.964 -2.282 8.504 1.00 0.00 H new ATOM 0 HD23 LEU A 44 4.407 -1.289 8.188 1.00 0.00 H new ATOM 697 N GLN A 45 7.857 -2.206 6.983 1.00 0.00 N ATOM 698 CA GLN A 45 8.605 -0.960 7.094 1.00 0.00 C ATOM 699 C GLN A 45 8.031 0.117 6.177 1.00 0.00 C ATOM 700 O GLN A 45 7.917 1.278 6.569 1.00 0.00 O ATOM 701 CB GLN A 45 10.074 -1.203 6.743 1.00 0.00 C ATOM 702 CG GLN A 45 10.928 -0.065 7.303 1.00 0.00 C ATOM 703 CD GLN A 45 11.358 -0.390 8.730 1.00 0.00 C ATOM 704 OE1 GLN A 45 10.556 -0.293 9.658 1.00 0.00 O ATOM 705 NE2 GLN A 45 12.584 -0.772 8.961 1.00 0.00 N ATOM 0 H GLN A 45 7.774 -2.571 6.034 1.00 0.00 H new ATOM 0 HA GLN A 45 8.524 -0.610 8.123 1.00 0.00 H new ATOM 0 HB2 GLN A 45 10.404 -2.156 7.155 1.00 0.00 H new ATOM 0 HB3 GLN A 45 10.195 -1.264 5.661 1.00 0.00 H new ATOM 0 HG2 GLN A 45 11.806 0.085 6.675 1.00 0.00 H new ATOM 0 HG3 GLN A 45 10.362 0.867 7.288 1.00 0.00 H new ATOM 0 HE21 GLN A 45 13.247 -0.852 8.190 1.00 0.00 H new ATOM 0 HE22 GLN A 45 12.879 -0.991 9.912 1.00 0.00 H new ATOM 714 N ALA A 46 7.684 -0.264 4.949 1.00 0.00 N ATOM 715 CA ALA A 46 7.142 0.699 3.994 1.00 0.00 C ATOM 716 C ALA A 46 5.885 0.167 3.304 1.00 0.00 C ATOM 717 O ALA A 46 5.568 -1.019 3.384 1.00 0.00 O ATOM 718 CB ALA A 46 8.199 1.019 2.935 1.00 0.00 C ATOM 0 H ALA A 46 7.767 -1.217 4.596 1.00 0.00 H new ATOM 0 HA ALA A 46 6.871 1.599 4.546 1.00 0.00 H new ATOM 0 HB1 ALA A 46 7.794 1.738 2.222 1.00 0.00 H new ATOM 0 HB2 ALA A 46 9.080 1.443 3.417 1.00 0.00 H new ATOM 0 HB3 ALA A 46 8.477 0.105 2.410 1.00 0.00 H new ATOM 724 N ILE A 47 5.184 1.067 2.615 1.00 0.00 N ATOM 725 CA ILE A 47 3.966 0.709 1.890 1.00 0.00 C ATOM 726 C ILE A 47 4.214 0.836 0.388 1.00 0.00 C ATOM 727 O ILE A 47 4.842 1.800 -0.055 1.00 0.00 O ATOM 728 CB ILE A 47 2.821 1.635 2.310 1.00 0.00 C ATOM 729 CG1 ILE A 47 1.481 1.033 1.873 1.00 0.00 C ATOM 730 CG2 ILE A 47 3.002 3.005 1.655 1.00 0.00 C ATOM 731 CD1 ILE A 47 0.610 0.774 3.104 1.00 0.00 C ATOM 0 H ILE A 47 5.440 2.052 2.544 1.00 0.00 H new ATOM 0 HA ILE A 47 3.693 -0.320 2.125 1.00 0.00 H new ATOM 0 HB ILE A 47 2.830 1.747 3.394 1.00 0.00 H new ATOM 0 HG12 ILE A 47 0.971 1.712 1.190 1.00 0.00 H new ATOM 0 HG13 ILE A 47 1.648 0.102 1.331 1.00 0.00 H new ATOM 0 HG21 ILE A 47 2.186 3.662 1.955 1.00 0.00 H new ATOM 0 HG22 ILE A 47 3.951 3.437 1.971 1.00 0.00 H new ATOM 0 HG23 ILE A 47 2.998 2.893 0.571 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -0.343 0.346 2.792 1.00 0.00 H new ATOM 0 HD12 ILE A 47 1.120 0.078 3.770 1.00 0.00 H new ATOM 0 HD13 ILE A 47 0.432 1.713 3.628 1.00 0.00 H new ATOM 743 N TYR A 48 3.747 -0.143 -0.389 1.00 0.00 N ATOM 744 CA TYR A 48 3.968 -0.119 -1.838 1.00 0.00 C ATOM 745 C TYR A 48 2.664 -0.021 -2.626 1.00 0.00 C ATOM 746 O TYR A 48 1.601 -0.437 -2.164 1.00 0.00 O ATOM 747 CB TYR A 48 4.705 -1.383 -2.314 1.00 0.00 C ATOM 748 CG TYR A 48 5.780 -1.812 -1.335 1.00 0.00 C ATOM 749 CD1 TYR A 48 5.462 -2.124 -0.005 1.00 0.00 C ATOM 750 CD2 TYR A 48 7.103 -1.916 -1.775 1.00 0.00 C ATOM 751 CE1 TYR A 48 6.469 -2.536 0.877 1.00 0.00 C ATOM 752 CE2 TYR A 48 8.109 -2.327 -0.893 1.00 0.00 C ATOM 753 CZ TYR A 48 7.792 -2.638 0.434 1.00 0.00 C ATOM 754 OH TYR A 48 8.784 -3.045 1.303 1.00 0.00 O ATOM 0 H TYR A 48 3.223 -0.949 -0.049 1.00 0.00 H new ATOM 0 HA TYR A 48 4.572 0.769 -2.025 1.00 0.00 H new ATOM 0 HB2 TYR A 48 3.988 -2.194 -2.445 1.00 0.00 H new ATOM 0 HB3 TYR A 48 5.155 -1.195 -3.289 1.00 0.00 H new ATOM 0 HD1 TYR A 48 4.441 -2.047 0.339 1.00 0.00 H new ATOM 0 HD2 TYR A 48 7.350 -1.678 -2.799 1.00 0.00 H new ATOM 0 HE1 TYR A 48 6.224 -2.775 1.901 1.00 0.00 H new ATOM 0 HE2 TYR A 48 9.130 -2.404 -1.237 1.00 0.00 H new ATOM 0 HH TYR A 48 9.644 -3.062 0.833 1.00 0.00 H new ATOM 764 N PHE A 49 2.787 0.497 -3.846 1.00 0.00 N ATOM 765 CA PHE A 49 1.657 0.625 -4.762 1.00 0.00 C ATOM 766 C PHE A 49 2.094 0.152 -6.137 1.00 0.00 C ATOM 767 O PHE A 49 3.181 0.495 -6.599 1.00 0.00 O ATOM 768 CB PHE A 49 1.198 2.077 -4.884 1.00 0.00 C ATOM 769 CG PHE A 49 -0.311 2.155 -4.810 1.00 0.00 C ATOM 770 CD1 PHE A 49 -1.103 1.651 -5.858 1.00 0.00 C ATOM 771 CD2 PHE A 49 -0.918 2.741 -3.694 1.00 0.00 C ATOM 772 CE1 PHE A 49 -2.499 1.736 -5.778 1.00 0.00 C ATOM 773 CE2 PHE A 49 -2.313 2.824 -3.617 1.00 0.00 C ATOM 774 CZ PHE A 49 -3.103 2.321 -4.658 1.00 0.00 C ATOM 0 H PHE A 49 3.670 0.839 -4.226 1.00 0.00 H new ATOM 0 HA PHE A 49 0.832 0.028 -4.374 1.00 0.00 H new ATOM 0 HB2 PHE A 49 1.640 2.674 -4.086 1.00 0.00 H new ATOM 0 HB3 PHE A 49 1.546 2.498 -5.827 1.00 0.00 H new ATOM 0 HD1 PHE A 49 -0.636 1.200 -6.721 1.00 0.00 H new ATOM 0 HD2 PHE A 49 -0.309 3.130 -2.891 1.00 0.00 H new ATOM 0 HE1 PHE A 49 -3.110 1.350 -6.581 1.00 0.00 H new ATOM 0 HE2 PHE A 49 -2.780 3.276 -2.755 1.00 0.00 H new ATOM 0 HZ PHE A 49 -4.179 2.384 -4.597 1.00 0.00 H new ATOM 784 N VAL A 50 1.254 -0.623 -6.791 1.00 0.00 N ATOM 785 CA VAL A 50 1.574 -1.118 -8.104 1.00 0.00 C ATOM 786 C VAL A 50 0.809 -0.315 -9.151 1.00 0.00 C ATOM 787 O VAL A 50 -0.400 -0.124 -9.036 1.00 0.00 O ATOM 788 CB VAL A 50 1.231 -2.602 -8.130 1.00 0.00 C ATOM 789 CG1 VAL A 50 0.445 -2.935 -9.380 1.00 0.00 C ATOM 790 CG2 VAL A 50 2.515 -3.433 -8.090 1.00 0.00 C ATOM 0 H VAL A 50 0.347 -0.921 -6.432 1.00 0.00 H new ATOM 0 HA VAL A 50 2.633 -1.002 -8.337 1.00 0.00 H new ATOM 0 HB VAL A 50 0.623 -2.837 -7.257 1.00 0.00 H new ATOM 0 HG11 VAL A 50 0.206 -3.998 -9.387 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -0.478 -2.355 -9.395 1.00 0.00 H new ATOM 0 HG13 VAL A 50 1.040 -2.691 -10.260 1.00 0.00 H new ATOM 0 HG21 VAL A 50 2.263 -4.493 -8.109 1.00 0.00 H new ATOM 0 HG22 VAL A 50 3.132 -3.191 -8.955 1.00 0.00 H new ATOM 0 HG23 VAL A 50 3.066 -3.207 -7.177 1.00 0.00 H new ATOM 800 N CYS A 51 1.520 0.168 -10.159 1.00 0.00 N ATOM 801 CA CYS A 51 0.887 0.958 -11.205 1.00 0.00 C ATOM 802 C CYS A 51 0.588 0.089 -12.422 1.00 0.00 C ATOM 803 O CYS A 51 -0.288 0.408 -13.225 1.00 0.00 O ATOM 804 CB CYS A 51 1.795 2.121 -11.610 1.00 0.00 C ATOM 805 SG CYS A 51 2.856 1.611 -12.984 1.00 0.00 S ATOM 0 H CYS A 51 2.524 0.029 -10.275 1.00 0.00 H new ATOM 0 HA CYS A 51 -0.051 1.355 -10.817 1.00 0.00 H new ATOM 0 HB2 CYS A 51 1.193 2.981 -11.902 1.00 0.00 H new ATOM 0 HB3 CYS A 51 2.405 2.432 -10.762 1.00 0.00 H new ATOM 0 HG CYS A 51 3.626 2.601 -13.329 1.00 0.00 H new ATOM 811 N SER A 52 1.328 -1.008 -12.549 1.00 0.00 N ATOM 812 CA SER A 52 1.144 -1.924 -13.669 1.00 0.00 C ATOM 813 C SER A 52 1.929 -3.210 -13.434 1.00 0.00 C ATOM 814 O SER A 52 3.047 -3.177 -12.925 1.00 0.00 O ATOM 815 CB SER A 52 1.614 -1.267 -14.967 1.00 0.00 C ATOM 816 OG SER A 52 2.973 -1.611 -15.202 1.00 0.00 O ATOM 0 H SER A 52 2.058 -1.284 -11.892 1.00 0.00 H new ATOM 0 HA SER A 52 0.084 -2.164 -13.751 1.00 0.00 H new ATOM 0 HB2 SER A 52 0.994 -1.597 -15.800 1.00 0.00 H new ATOM 0 HB3 SER A 52 1.507 -0.184 -14.900 1.00 0.00 H new ATOM 0 HG SER A 52 3.277 -1.193 -16.034 1.00 0.00 H new ATOM 822 N GLY A 53 1.333 -4.341 -13.802 1.00 0.00 N ATOM 823 CA GLY A 53 1.985 -5.635 -13.621 1.00 0.00 C ATOM 824 C GLY A 53 1.102 -6.568 -12.799 1.00 0.00 C ATOM 825 O GLY A 53 -0.109 -6.364 -12.713 1.00 0.00 O ATOM 0 H GLY A 53 0.406 -4.388 -14.225 1.00 0.00 H new ATOM 0 HA2 GLY A 53 2.192 -6.083 -14.593 1.00 0.00 H new ATOM 0 HA3 GLY A 53 2.944 -5.499 -13.122 1.00 0.00 H new ATOM 829 N SER A 54 1.702 -7.595 -12.198 1.00 0.00 N ATOM 830 CA SER A 54 0.919 -8.538 -11.395 1.00 0.00 C ATOM 831 C SER A 54 1.752 -9.146 -10.270 1.00 0.00 C ATOM 832 O SER A 54 2.946 -9.395 -10.432 1.00 0.00 O ATOM 833 CB SER A 54 0.379 -9.659 -12.284 1.00 0.00 C ATOM 834 OG SER A 54 0.105 -9.141 -13.579 1.00 0.00 O ATOM 0 H SER A 54 2.701 -7.794 -12.248 1.00 0.00 H new ATOM 0 HA SER A 54 0.093 -7.984 -10.949 1.00 0.00 H new ATOM 0 HB2 SER A 54 1.106 -10.469 -12.350 1.00 0.00 H new ATOM 0 HB3 SER A 54 -0.528 -10.079 -11.849 1.00 0.00 H new ATOM 0 HG SER A 54 0.685 -9.580 -14.236 1.00 0.00 H new ATOM 840 N MET A 55 1.103 -9.395 -9.129 1.00 0.00 N ATOM 841 CA MET A 55 1.788 -9.991 -7.985 1.00 0.00 C ATOM 842 C MET A 55 0.787 -10.642 -7.038 1.00 0.00 C ATOM 843 O MET A 55 -0.423 -10.433 -7.156 1.00 0.00 O ATOM 844 CB MET A 55 2.603 -8.931 -7.239 1.00 0.00 C ATOM 845 CG MET A 55 1.689 -7.799 -6.780 1.00 0.00 C ATOM 846 SD MET A 55 1.753 -7.664 -4.975 1.00 0.00 S ATOM 847 CE MET A 55 3.165 -6.536 -4.879 1.00 0.00 C ATOM 0 H MET A 55 0.115 -9.195 -8.976 1.00 0.00 H new ATOM 0 HA MET A 55 2.466 -10.760 -8.356 1.00 0.00 H new ATOM 0 HB2 MET A 55 3.099 -9.380 -6.379 1.00 0.00 H new ATOM 0 HB3 MET A 55 3.385 -8.538 -7.889 1.00 0.00 H new ATOM 0 HG2 MET A 55 1.999 -6.859 -7.237 1.00 0.00 H new ATOM 0 HG3 MET A 55 0.666 -7.989 -7.105 1.00 0.00 H new ATOM 0 HE1 MET A 55 3.383 -6.314 -3.834 1.00 0.00 H new ATOM 0 HE2 MET A 55 4.035 -7.003 -5.340 1.00 0.00 H new ATOM 0 HE3 MET A 55 2.928 -5.611 -5.405 1.00 0.00 H new ATOM 857 N GLU A 56 1.292 -11.444 -6.106 1.00 0.00 N ATOM 858 CA GLU A 56 0.421 -12.126 -5.157 1.00 0.00 C ATOM 859 C GLU A 56 1.213 -12.655 -3.963 1.00 0.00 C ATOM 860 O GLU A 56 2.418 -12.882 -4.058 1.00 0.00 O ATOM 861 CB GLU A 56 -0.289 -13.286 -5.860 1.00 0.00 C ATOM 862 CG GLU A 56 0.716 -14.107 -6.677 1.00 0.00 C ATOM 863 CD GLU A 56 1.867 -14.579 -5.792 1.00 0.00 C ATOM 864 OE1 GLU A 56 1.670 -15.522 -5.047 1.00 0.00 O ATOM 865 OE2 GLU A 56 2.933 -13.998 -5.882 1.00 0.00 O ATOM 0 H GLU A 56 2.287 -11.636 -5.988 1.00 0.00 H new ATOM 0 HA GLU A 56 -0.313 -11.410 -4.787 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -0.776 -13.924 -5.123 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -1.071 -12.900 -6.514 1.00 0.00 H new ATOM 0 HG2 GLU A 56 0.215 -14.967 -7.122 1.00 0.00 H new ATOM 0 HG3 GLU A 56 1.104 -13.504 -7.498 1.00 0.00 H new ATOM 872 N VAL A 57 0.526 -12.862 -2.841 1.00 0.00 N ATOM 873 CA VAL A 57 1.185 -13.383 -1.649 1.00 0.00 C ATOM 874 C VAL A 57 1.002 -14.899 -1.600 1.00 0.00 C ATOM 875 O VAL A 57 -0.129 -15.395 -1.702 1.00 0.00 O ATOM 876 CB VAL A 57 0.623 -12.732 -0.381 1.00 0.00 C ATOM 877 CG1 VAL A 57 0.133 -11.316 -0.697 1.00 0.00 C ATOM 878 CG2 VAL A 57 -0.535 -13.570 0.155 1.00 0.00 C ATOM 0 H VAL A 57 -0.472 -12.680 -2.734 1.00 0.00 H new ATOM 0 HA VAL A 57 2.248 -13.145 -1.697 1.00 0.00 H new ATOM 0 HB VAL A 57 1.409 -12.678 0.373 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -0.265 -10.858 0.208 1.00 0.00 H new ATOM 0 HG12 VAL A 57 0.964 -10.718 -1.070 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -0.649 -11.362 -1.455 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -0.933 -13.105 1.057 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -1.320 -13.631 -0.599 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -0.180 -14.573 0.390 1.00 0.00 H new ATOM 888 N LEU A 58 2.122 -15.625 -1.480 1.00 0.00 N ATOM 889 CA LEU A 58 2.094 -17.088 -1.472 1.00 0.00 C ATOM 890 C LEU A 58 2.305 -17.676 -0.078 1.00 0.00 C ATOM 891 O LEU A 58 3.319 -17.419 0.574 1.00 0.00 O ATOM 892 CB LEU A 58 3.199 -17.621 -2.399 1.00 0.00 C ATOM 893 CG LEU A 58 2.649 -18.685 -3.362 1.00 0.00 C ATOM 894 CD1 LEU A 58 3.806 -19.541 -3.878 1.00 0.00 C ATOM 895 CD2 LEU A 58 1.641 -19.590 -2.647 1.00 0.00 C ATOM 0 H LEU A 58 3.054 -15.222 -1.388 1.00 0.00 H new ATOM 0 HA LEU A 58 1.105 -17.391 -1.816 1.00 0.00 H new ATOM 0 HB2 LEU A 58 3.628 -16.797 -2.969 1.00 0.00 H new ATOM 0 HB3 LEU A 58 4.004 -18.048 -1.801 1.00 0.00 H new ATOM 0 HG LEU A 58 2.149 -18.183 -4.190 1.00 0.00 H new ATOM 0 HD11 LEU A 58 3.422 -20.298 -4.562 1.00 0.00 H new ATOM 0 HD12 LEU A 58 4.521 -18.908 -4.402 1.00 0.00 H new ATOM 0 HD13 LEU A 58 4.301 -20.029 -3.038 1.00 0.00 H new ATOM 0 HD21 LEU A 58 1.263 -20.337 -3.345 1.00 0.00 H new ATOM 0 HD22 LEU A 58 2.130 -20.090 -1.811 1.00 0.00 H new ATOM 0 HD23 LEU A 58 0.812 -18.988 -2.275 1.00 0.00 H new ATOM 907 N LYS A 59 1.346 -18.492 0.353 1.00 0.00 N ATOM 908 CA LYS A 59 1.429 -19.158 1.648 1.00 0.00 C ATOM 909 C LYS A 59 0.440 -20.329 1.703 1.00 0.00 C ATOM 910 O LYS A 59 -0.666 -20.241 1.173 1.00 0.00 O ATOM 911 CB LYS A 59 1.158 -18.157 2.781 1.00 0.00 C ATOM 912 CG LYS A 59 2.342 -18.122 3.757 1.00 0.00 C ATOM 913 CD LYS A 59 2.738 -19.540 4.182 1.00 0.00 C ATOM 914 CE LYS A 59 4.129 -19.895 3.637 1.00 0.00 C ATOM 915 NZ LYS A 59 5.157 -19.564 4.663 1.00 0.00 N ATOM 0 H LYS A 59 0.502 -18.707 -0.177 1.00 0.00 H new ATOM 0 HA LYS A 59 2.436 -19.554 1.779 1.00 0.00 H new ATOM 0 HB2 LYS A 59 0.992 -17.163 2.365 1.00 0.00 H new ATOM 0 HB3 LYS A 59 0.248 -18.437 3.312 1.00 0.00 H new ATOM 0 HG2 LYS A 59 3.192 -17.627 3.287 1.00 0.00 H new ATOM 0 HG3 LYS A 59 2.077 -17.534 4.636 1.00 0.00 H new ATOM 0 HD2 LYS A 59 2.737 -19.614 5.269 1.00 0.00 H new ATOM 0 HD3 LYS A 59 2.003 -20.255 3.813 1.00 0.00 H new ATOM 0 HE2 LYS A 59 4.175 -20.955 3.388 1.00 0.00 H new ATOM 0 HE3 LYS A 59 4.324 -19.343 2.718 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 6.081 -19.442 4.202 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 4.893 -18.683 5.148 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 5.216 -20.336 5.357 1.00 0.00 H new ATOM 929 N ASP A 60 0.845 -21.417 2.350 1.00 0.00 N ATOM 930 CA ASP A 60 -0.003 -22.601 2.476 1.00 0.00 C ATOM 931 C ASP A 60 -0.359 -23.209 1.118 1.00 0.00 C ATOM 932 O ASP A 60 -1.507 -23.583 0.876 1.00 0.00 O ATOM 933 CB ASP A 60 -1.289 -22.234 3.217 1.00 0.00 C ATOM 934 CG ASP A 60 -0.975 -21.887 4.668 1.00 0.00 C ATOM 935 OD1 ASP A 60 -0.309 -20.890 4.887 1.00 0.00 O ATOM 936 OD2 ASP A 60 -1.405 -22.626 5.539 1.00 0.00 O ATOM 0 H ASP A 60 1.758 -21.505 2.797 1.00 0.00 H new ATOM 0 HA ASP A 60 0.561 -23.347 3.035 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -1.771 -21.387 2.728 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -1.991 -23.067 3.178 1.00 0.00 H new ATOM 941 N ASN A 61 0.644 -23.342 0.256 1.00 0.00 N ATOM 942 CA ASN A 61 0.447 -23.952 -1.060 1.00 0.00 C ATOM 943 C ASN A 61 -0.448 -23.107 -1.964 1.00 0.00 C ATOM 944 O ASN A 61 -0.494 -23.328 -3.175 1.00 0.00 O ATOM 945 CB ASN A 61 -0.169 -25.343 -0.893 1.00 0.00 C ATOM 946 CG ASN A 61 0.135 -26.201 -2.116 1.00 0.00 C ATOM 947 OD1 ASN A 61 -0.778 -26.743 -2.739 1.00 0.00 O ATOM 948 ND2 ASN A 61 1.373 -26.358 -2.500 1.00 0.00 N ATOM 0 H ASN A 61 1.600 -23.038 0.442 1.00 0.00 H new ATOM 0 HA ASN A 61 1.425 -24.022 -1.537 1.00 0.00 H new ATOM 0 HB2 ASN A 61 0.228 -25.820 0.003 1.00 0.00 H new ATOM 0 HB3 ASN A 61 -1.247 -25.258 -0.758 1.00 0.00 H new ATOM 0 HD21 ASN A 61 1.585 -26.930 -3.317 1.00 0.00 H new ATOM 0 HD22 ASN A 61 2.128 -25.908 -1.983 1.00 0.00 H new ATOM 955 N THR A 62 -1.148 -22.138 -1.389 1.00 0.00 N ATOM 956 CA THR A 62 -2.018 -21.281 -2.189 1.00 0.00 C ATOM 957 C THR A 62 -1.752 -19.825 -1.881 1.00 0.00 C ATOM 958 O THR A 62 -1.282 -19.478 -0.799 1.00 0.00 O ATOM 959 CB THR A 62 -3.491 -21.581 -1.919 1.00 0.00 C ATOM 960 OG1 THR A 62 -3.714 -22.980 -2.026 1.00 0.00 O ATOM 961 CG2 THR A 62 -4.370 -20.837 -2.943 1.00 0.00 C ATOM 0 H THR A 62 -1.133 -21.927 -0.391 1.00 0.00 H new ATOM 0 HA THR A 62 -1.801 -21.484 -3.238 1.00 0.00 H new ATOM 0 HB THR A 62 -3.751 -21.246 -0.915 1.00 0.00 H new ATOM 0 HG1 THR A 62 -4.658 -23.175 -1.851 1.00 0.00 H new ATOM 0 HG21 THR A 62 -5.420 -21.054 -2.747 1.00 0.00 H new ATOM 0 HG22 THR A 62 -4.199 -19.764 -2.858 1.00 0.00 H new ATOM 0 HG23 THR A 62 -4.114 -21.166 -3.950 1.00 0.00 H new ATOM 969 N VAL A 63 -2.067 -18.977 -2.837 1.00 0.00 N ATOM 970 CA VAL A 63 -1.873 -17.558 -2.662 1.00 0.00 C ATOM 971 C VAL A 63 -2.960 -16.989 -1.765 1.00 0.00 C ATOM 972 O VAL A 63 -4.145 -17.070 -2.088 1.00 0.00 O ATOM 973 CB VAL A 63 -1.899 -16.878 -4.022 1.00 0.00 C ATOM 974 CG1 VAL A 63 -0.480 -16.486 -4.420 1.00 0.00 C ATOM 975 CG2 VAL A 63 -2.454 -17.863 -5.048 1.00 0.00 C ATOM 0 H VAL A 63 -2.457 -19.247 -3.740 1.00 0.00 H new ATOM 0 HA VAL A 63 -0.908 -17.378 -2.188 1.00 0.00 H new ATOM 0 HB VAL A 63 -2.523 -15.985 -3.981 1.00 0.00 H new ATOM 0 HG11 VAL A 63 -0.497 -15.998 -5.395 1.00 0.00 H new ATOM 0 HG12 VAL A 63 -0.070 -15.800 -3.678 1.00 0.00 H new ATOM 0 HG13 VAL A 63 0.143 -17.379 -4.472 1.00 0.00 H new ATOM 0 HG21 VAL A 63 -2.479 -17.390 -6.030 1.00 0.00 H new ATOM 0 HG22 VAL A 63 -1.816 -18.746 -5.087 1.00 0.00 H new ATOM 0 HG23 VAL A 63 -3.464 -18.157 -4.761 1.00 0.00 H new ATOM 985 N LEU A 64 -2.558 -16.412 -0.639 1.00 0.00 N ATOM 986 CA LEU A 64 -3.529 -15.840 0.278 1.00 0.00 C ATOM 987 C LEU A 64 -4.035 -14.528 -0.288 1.00 0.00 C ATOM 988 O LEU A 64 -5.037 -13.986 0.176 1.00 0.00 O ATOM 989 CB LEU A 64 -2.906 -15.603 1.658 1.00 0.00 C ATOM 990 CG LEU A 64 -3.049 -16.862 2.516 1.00 0.00 C ATOM 991 CD1 LEU A 64 -2.019 -17.898 2.069 1.00 0.00 C ATOM 992 CD2 LEU A 64 -2.803 -16.504 3.984 1.00 0.00 C ATOM 0 H LEU A 64 -1.585 -16.329 -0.345 1.00 0.00 H new ATOM 0 HA LEU A 64 -4.357 -16.540 0.394 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -1.853 -15.342 1.552 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -3.395 -14.761 2.148 1.00 0.00 H new ATOM 0 HG LEU A 64 -4.053 -17.271 2.402 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -2.118 -18.796 2.678 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -2.187 -18.150 1.022 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -1.016 -17.488 2.187 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -2.904 -17.399 4.599 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -1.797 -16.098 4.096 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -3.532 -15.760 4.304 1.00 0.00 H new ATOM 1004 N ALA A 65 -3.349 -14.030 -1.316 1.00 0.00 N ATOM 1005 CA ALA A 65 -3.774 -12.788 -1.947 1.00 0.00 C ATOM 1006 C ALA A 65 -3.446 -12.807 -3.431 1.00 0.00 C ATOM 1007 O ALA A 65 -2.339 -13.164 -3.829 1.00 0.00 O ATOM 1008 CB ALA A 65 -3.099 -11.585 -1.283 1.00 0.00 C ATOM 0 H ALA A 65 -2.516 -14.458 -1.720 1.00 0.00 H new ATOM 0 HA ALA A 65 -4.853 -12.698 -1.823 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -3.430 -10.668 -1.769 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -3.368 -11.554 -0.227 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -2.017 -11.676 -1.379 1.00 0.00 H new ATOM 1014 N ILE A 66 -4.415 -12.409 -4.239 1.00 0.00 N ATOM 1015 CA ILE A 66 -4.232 -12.365 -5.684 1.00 0.00 C ATOM 1016 C ILE A 66 -4.635 -10.984 -6.196 1.00 0.00 C ATOM 1017 O ILE A 66 -5.822 -10.663 -6.237 1.00 0.00 O ATOM 1018 CB ILE A 66 -5.107 -13.431 -6.353 1.00 0.00 C ATOM 1019 CG1 ILE A 66 -4.476 -14.815 -6.163 1.00 0.00 C ATOM 1020 CG2 ILE A 66 -5.224 -13.129 -7.848 1.00 0.00 C ATOM 1021 CD1 ILE A 66 -4.978 -15.430 -4.856 1.00 0.00 C ATOM 0 H ILE A 66 -5.337 -12.111 -3.921 1.00 0.00 H new ATOM 0 HA ILE A 66 -3.187 -12.560 -5.923 1.00 0.00 H new ATOM 0 HB ILE A 66 -6.097 -13.420 -5.897 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -4.731 -15.461 -7.003 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -3.389 -14.731 -6.144 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -5.846 -13.887 -8.325 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -5.677 -12.147 -7.987 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -4.232 -13.137 -8.300 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -4.529 -16.414 -4.721 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -4.700 -14.787 -4.021 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -6.063 -15.528 -4.893 1.00 0.00 H new ATOM 1033 N LEU A 67 -3.659 -10.154 -6.566 1.00 0.00 N ATOM 1034 CA LEU A 67 -3.986 -8.812 -7.040 1.00 0.00 C ATOM 1035 C LEU A 67 -3.246 -8.441 -8.325 1.00 0.00 C ATOM 1036 O LEU A 67 -2.243 -9.059 -8.696 1.00 0.00 O ATOM 1037 CB LEU A 67 -3.690 -7.777 -5.951 1.00 0.00 C ATOM 1038 CG LEU A 67 -2.684 -8.344 -4.948 1.00 0.00 C ATOM 1039 CD1 LEU A 67 -1.330 -8.486 -5.633 1.00 0.00 C ATOM 1040 CD2 LEU A 67 -2.556 -7.393 -3.758 1.00 0.00 C ATOM 0 H LEU A 67 -2.664 -10.379 -6.548 1.00 0.00 H new ATOM 0 HA LEU A 67 -5.051 -8.812 -7.271 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -3.293 -6.867 -6.401 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -4.612 -7.503 -5.438 1.00 0.00 H new ATOM 0 HG LEU A 67 -3.024 -9.317 -4.594 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -0.605 -8.890 -4.926 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -1.422 -9.161 -6.484 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -0.993 -7.509 -5.980 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -1.839 -7.798 -3.044 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -2.211 -6.419 -4.106 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -3.527 -7.283 -3.274 1.00 0.00 H new ATOM 1052 N GLY A 68 -3.757 -7.406 -8.989 1.00 0.00 N ATOM 1053 CA GLY A 68 -3.167 -6.915 -10.227 1.00 0.00 C ATOM 1054 C GLY A 68 -2.864 -5.421 -10.125 1.00 0.00 C ATOM 1055 O GLY A 68 -2.615 -4.901 -9.041 1.00 0.00 O ATOM 0 H GLY A 68 -4.583 -6.890 -8.686 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -2.250 -7.463 -10.441 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -3.849 -7.097 -11.058 1.00 0.00 H new ATOM 1059 N LYS A 69 -2.880 -4.738 -11.261 1.00 0.00 N ATOM 1060 CA LYS A 69 -2.597 -3.306 -11.298 1.00 0.00 C ATOM 1061 C LYS A 69 -3.327 -2.551 -10.183 1.00 0.00 C ATOM 1062 O LYS A 69 -4.501 -2.801 -9.909 1.00 0.00 O ATOM 1063 CB LYS A 69 -3.034 -2.742 -12.650 1.00 0.00 C ATOM 1064 CG LYS A 69 -2.478 -1.330 -12.829 1.00 0.00 C ATOM 1065 CD LYS A 69 -2.510 -0.961 -14.313 1.00 0.00 C ATOM 1066 CE LYS A 69 -3.959 -0.941 -14.803 1.00 0.00 C ATOM 1067 NZ LYS A 69 -4.099 0.049 -15.909 1.00 0.00 N ATOM 0 H LYS A 69 -3.086 -5.151 -12.171 1.00 0.00 H new ATOM 0 HA LYS A 69 -1.525 -3.173 -11.151 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -2.679 -3.386 -13.454 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -4.122 -2.724 -12.712 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -3.068 -0.618 -12.252 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -1.457 -1.278 -12.451 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -2.050 0.015 -14.466 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -1.930 -1.681 -14.890 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -4.250 -1.933 -15.150 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -4.628 -0.681 -13.982 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -5.084 0.061 -16.241 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -3.838 0.995 -15.564 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -3.472 -0.218 -16.695 1.00 0.00 H new ATOM 1081 N GLY A 70 -2.619 -1.605 -9.564 1.00 0.00 N ATOM 1082 CA GLY A 70 -3.191 -0.781 -8.500 1.00 0.00 C ATOM 1083 C GLY A 70 -3.060 -1.428 -7.121 1.00 0.00 C ATOM 1084 O GLY A 70 -3.352 -0.792 -6.107 1.00 0.00 O ATOM 0 H GLY A 70 -1.646 -1.391 -9.783 1.00 0.00 H new ATOM 0 HA2 GLY A 70 -2.695 0.190 -8.491 1.00 0.00 H new ATOM 0 HA3 GLY A 70 -4.244 -0.599 -8.713 1.00 0.00 H new ATOM 1088 N ASP A 71 -2.640 -2.687 -7.076 1.00 0.00 N ATOM 1089 CA ASP A 71 -2.504 -3.380 -5.797 1.00 0.00 C ATOM 1090 C ASP A 71 -1.688 -2.556 -4.805 1.00 0.00 C ATOM 1091 O ASP A 71 -0.876 -1.716 -5.192 1.00 0.00 O ATOM 1092 CB ASP A 71 -1.838 -4.742 -5.994 1.00 0.00 C ATOM 1093 CG ASP A 71 -0.321 -4.612 -5.905 1.00 0.00 C ATOM 1094 OD1 ASP A 71 0.157 -4.164 -4.876 1.00 0.00 O ATOM 1095 OD2 ASP A 71 0.340 -4.967 -6.866 1.00 0.00 O ATOM 0 H ASP A 71 -2.391 -3.243 -7.894 1.00 0.00 H new ATOM 0 HA ASP A 71 -3.506 -3.521 -5.392 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -2.194 -5.441 -5.237 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -2.117 -5.153 -6.964 1.00 0.00 H new ATOM 1100 N LEU A 72 -1.911 -2.818 -3.520 1.00 0.00 N ATOM 1101 CA LEU A 72 -1.196 -2.116 -2.460 1.00 0.00 C ATOM 1102 C LEU A 72 -0.828 -3.095 -1.350 1.00 0.00 C ATOM 1103 O LEU A 72 -1.621 -3.970 -0.998 1.00 0.00 O ATOM 1104 CB LEU A 72 -2.067 -0.994 -1.890 1.00 0.00 C ATOM 1105 CG LEU A 72 -1.294 -0.239 -0.804 1.00 0.00 C ATOM 1106 CD1 LEU A 72 -0.507 0.905 -1.438 1.00 0.00 C ATOM 1107 CD2 LEU A 72 -2.278 0.331 0.218 1.00 0.00 C ATOM 0 H LEU A 72 -2.581 -3.512 -3.188 1.00 0.00 H new ATOM 0 HA LEU A 72 -0.286 -1.682 -2.875 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -2.359 -0.308 -2.685 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -2.985 -1.409 -1.474 1.00 0.00 H new ATOM 0 HG LEU A 72 -0.606 -0.924 -0.308 1.00 0.00 H new ATOM 0 HD11 LEU A 72 0.042 1.441 -0.664 1.00 0.00 H new ATOM 0 HD12 LEU A 72 0.195 0.503 -2.169 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -1.195 1.589 -1.934 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -1.729 0.868 0.991 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -2.965 1.014 -0.281 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -2.842 -0.483 0.673 1.00 0.00 H new ATOM 1119 N ILE A 73 0.376 -2.948 -0.809 1.00 0.00 N ATOM 1120 CA ILE A 73 0.837 -3.836 0.253 1.00 0.00 C ATOM 1121 C ILE A 73 1.069 -3.067 1.546 1.00 0.00 C ATOM 1122 O ILE A 73 1.808 -2.079 1.575 1.00 0.00 O ATOM 1123 CB ILE A 73 2.128 -4.515 -0.179 1.00 0.00 C ATOM 1124 CG1 ILE A 73 2.999 -4.875 1.034 1.00 0.00 C ATOM 1125 CG2 ILE A 73 2.854 -3.557 -1.048 1.00 0.00 C ATOM 1126 CD1 ILE A 73 2.193 -5.704 2.037 1.00 0.00 C ATOM 0 H ILE A 73 1.046 -2.230 -1.085 1.00 0.00 H new ATOM 0 HA ILE A 73 0.067 -4.586 0.435 1.00 0.00 H new ATOM 0 HB ILE A 73 1.903 -5.442 -0.706 1.00 0.00 H new ATOM 0 HG12 ILE A 73 3.875 -5.436 0.708 1.00 0.00 H new ATOM 0 HG13 ILE A 73 3.363 -3.966 1.512 1.00 0.00 H new ATOM 0 HG21 ILE A 73 3.790 -4.005 -1.382 1.00 0.00 H new ATOM 0 HG22 ILE A 73 2.239 -3.314 -1.914 1.00 0.00 H new ATOM 0 HG23 ILE A 73 3.067 -2.647 -0.487 1.00 0.00 H new ATOM 0 HD11 ILE A 73 2.822 -5.953 2.892 1.00 0.00 H new ATOM 0 HD12 ILE A 73 1.331 -5.129 2.375 1.00 0.00 H new ATOM 0 HD13 ILE A 73 1.851 -6.622 1.559 1.00 0.00 H new ATOM 1138 N GLY A 74 0.436 -3.546 2.606 1.00 0.00 N ATOM 1139 CA GLY A 74 0.559 -2.935 3.923 1.00 0.00 C ATOM 1140 C GLY A 74 -0.811 -2.778 4.570 1.00 0.00 C ATOM 1141 O GLY A 74 -1.808 -2.559 3.884 1.00 0.00 O ATOM 0 H GLY A 74 -0.174 -4.363 2.580 1.00 0.00 H new ATOM 0 HA2 GLY A 74 1.198 -3.549 4.557 1.00 0.00 H new ATOM 0 HA3 GLY A 74 1.039 -1.961 3.835 1.00 0.00 H new ATOM 1145 N SER A 75 -0.854 -2.892 5.894 1.00 0.00 N ATOM 1146 CA SER A 75 -2.112 -2.765 6.620 1.00 0.00 C ATOM 1147 C SER A 75 -2.482 -1.299 6.822 1.00 0.00 C ATOM 1148 O SER A 75 -1.628 -0.471 7.140 1.00 0.00 O ATOM 1149 CB SER A 75 -2.001 -3.455 7.981 1.00 0.00 C ATOM 1150 OG SER A 75 -0.676 -3.309 8.473 1.00 0.00 O ATOM 0 H SER A 75 -0.039 -3.071 6.481 1.00 0.00 H new ATOM 0 HA SER A 75 -2.894 -3.242 6.029 1.00 0.00 H new ATOM 0 HB2 SER A 75 -2.712 -3.018 8.682 1.00 0.00 H new ATOM 0 HB3 SER A 75 -2.253 -4.511 7.888 1.00 0.00 H new ATOM 0 HG SER A 75 -0.649 -2.582 9.129 1.00 0.00 H new ATOM 1156 N ASP A 76 -3.762 -0.991 6.643 1.00 0.00 N ATOM 1157 CA ASP A 76 -4.243 0.374 6.813 1.00 0.00 C ATOM 1158 C ASP A 76 -3.868 0.900 8.194 1.00 0.00 C ATOM 1159 O ASP A 76 -3.083 0.281 8.910 1.00 0.00 O ATOM 1160 CB ASP A 76 -5.763 0.420 6.644 1.00 0.00 C ATOM 1161 CG ASP A 76 -6.433 -0.427 7.720 1.00 0.00 C ATOM 1162 OD1 ASP A 76 -5.764 -0.768 8.680 1.00 0.00 O ATOM 1163 OD2 ASP A 76 -7.608 -0.719 7.569 1.00 0.00 O ATOM 0 H ASP A 76 -4.482 -1.665 6.381 1.00 0.00 H new ATOM 0 HA ASP A 76 -3.776 1.002 6.054 1.00 0.00 H new ATOM 0 HB2 ASP A 76 -6.113 1.450 6.710 1.00 0.00 H new ATOM 0 HB3 ASP A 76 -6.039 0.052 5.656 1.00 0.00 H new ATOM 1168 N SER A 77 -4.432 2.046 8.562 1.00 0.00 N ATOM 1169 CA SER A 77 -4.142 2.640 9.862 1.00 0.00 C ATOM 1170 C SER A 77 -2.716 3.179 9.900 1.00 0.00 C ATOM 1171 O SER A 77 -1.997 2.988 10.881 1.00 0.00 O ATOM 1172 CB SER A 77 -4.323 1.595 10.964 1.00 0.00 C ATOM 1173 OG SER A 77 -5.113 2.147 12.008 1.00 0.00 O ATOM 0 H SER A 77 -5.085 2.577 7.986 1.00 0.00 H new ATOM 0 HA SER A 77 -4.834 3.466 10.026 1.00 0.00 H new ATOM 0 HB2 SER A 77 -4.804 0.704 10.561 1.00 0.00 H new ATOM 0 HB3 SER A 77 -3.352 1.286 11.351 1.00 0.00 H new ATOM 0 HG SER A 77 -5.233 1.480 12.716 1.00 0.00 H new ATOM 1179 N LEU A 78 -2.311 3.849 8.825 1.00 0.00 N ATOM 1180 CA LEU A 78 -0.965 4.405 8.750 1.00 0.00 C ATOM 1181 C LEU A 78 -0.639 5.179 10.023 1.00 0.00 C ATOM 1182 O LEU A 78 0.459 5.063 10.568 1.00 0.00 O ATOM 1183 CB LEU A 78 -0.851 5.341 7.542 1.00 0.00 C ATOM 1184 CG LEU A 78 0.272 4.859 6.625 1.00 0.00 C ATOM 1185 CD1 LEU A 78 -0.146 3.546 5.961 1.00 0.00 C ATOM 1186 CD2 LEU A 78 0.544 5.918 5.553 1.00 0.00 C ATOM 0 H LEU A 78 -2.889 4.019 8.002 1.00 0.00 H new ATOM 0 HA LEU A 78 -0.257 3.583 8.641 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -1.795 5.364 6.997 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -0.650 6.359 7.876 1.00 0.00 H new ATOM 0 HG LEU A 78 1.179 4.697 7.208 1.00 0.00 H new ATOM 0 HD11 LEU A 78 0.653 3.199 5.306 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -0.338 2.796 6.728 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -1.051 3.706 5.376 1.00 0.00 H new ATOM 0 HD21 LEU A 78 1.345 5.575 4.898 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -0.360 6.082 4.966 1.00 0.00 H new ATOM 0 HD23 LEU A 78 0.840 6.852 6.031 1.00 0.00 H new ATOM 1198 N THR A 79 -1.602 5.965 10.492 1.00 0.00 N ATOM 1199 CA THR A 79 -1.411 6.753 11.702 1.00 0.00 C ATOM 1200 C THR A 79 -1.185 5.838 12.901 1.00 0.00 C ATOM 1201 O THR A 79 -0.201 5.981 13.627 1.00 0.00 O ATOM 1202 CB THR A 79 -2.643 7.630 11.949 1.00 0.00 C ATOM 1203 OG1 THR A 79 -3.587 7.418 10.908 1.00 0.00 O ATOM 1204 CG2 THR A 79 -2.232 9.104 11.974 1.00 0.00 C ATOM 0 H THR A 79 -2.517 6.073 10.055 1.00 0.00 H new ATOM 0 HA THR A 79 -0.534 7.387 11.572 1.00 0.00 H new ATOM 0 HB THR A 79 -3.089 7.366 12.908 1.00 0.00 H new ATOM 0 HG1 THR A 79 -4.377 7.976 11.064 1.00 0.00 H new ATOM 0 HG21 THR A 79 -3.111 9.724 12.150 1.00 0.00 H new ATOM 0 HG22 THR A 79 -1.508 9.266 12.772 1.00 0.00 H new ATOM 0 HG23 THR A 79 -1.784 9.373 11.018 1.00 0.00 H new ATOM 1212 N LYS A 80 -2.104 4.901 13.101 1.00 0.00 N ATOM 1213 CA LYS A 80 -2.002 3.965 14.214 1.00 0.00 C ATOM 1214 C LYS A 80 -1.433 2.630 13.741 1.00 0.00 C ATOM 1215 O LYS A 80 -1.735 1.580 14.310 1.00 0.00 O ATOM 1216 CB LYS A 80 -3.381 3.740 14.834 1.00 0.00 C ATOM 1217 CG LYS A 80 -3.219 3.298 16.290 1.00 0.00 C ATOM 1218 CD LYS A 80 -4.464 2.527 16.735 1.00 0.00 C ATOM 1219 CE LYS A 80 -4.137 1.707 17.984 1.00 0.00 C ATOM 1220 NZ LYS A 80 -5.290 1.757 18.928 1.00 0.00 N ATOM 0 H LYS A 80 -2.925 4.769 12.510 1.00 0.00 H new ATOM 0 HA LYS A 80 -1.332 4.390 14.961 1.00 0.00 H new ATOM 0 HB2 LYS A 80 -3.968 4.657 14.784 1.00 0.00 H new ATOM 0 HB3 LYS A 80 -3.926 2.982 14.271 1.00 0.00 H new ATOM 0 HG2 LYS A 80 -2.334 2.670 16.394 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -3.070 4.168 16.930 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -5.278 3.220 16.945 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -4.803 1.870 15.934 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -3.924 0.674 17.708 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -3.242 2.100 18.466 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -5.068 1.199 19.777 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -5.473 2.744 19.200 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -6.134 1.363 18.466 1.00 0.00 H new ATOM 1234 N GLU A 81 -0.613 2.678 12.698 1.00 0.00 N ATOM 1235 CA GLU A 81 -0.011 1.465 12.156 1.00 0.00 C ATOM 1236 C GLU A 81 0.944 0.838 13.164 1.00 0.00 C ATOM 1237 O GLU A 81 2.110 1.224 13.255 1.00 0.00 O ATOM 1238 CB GLU A 81 0.746 1.786 10.866 1.00 0.00 C ATOM 1239 CG GLU A 81 1.634 0.600 10.487 1.00 0.00 C ATOM 1240 CD GLU A 81 1.553 0.348 8.986 1.00 0.00 C ATOM 1241 OE1 GLU A 81 0.541 -0.171 8.546 1.00 0.00 O ATOM 1242 OE2 GLU A 81 2.504 0.680 8.298 1.00 0.00 O ATOM 0 H GLU A 81 -0.351 3.536 12.213 1.00 0.00 H new ATOM 0 HA GLU A 81 -0.810 0.755 11.942 1.00 0.00 H new ATOM 0 HB2 GLU A 81 0.042 1.998 10.062 1.00 0.00 H new ATOM 0 HB3 GLU A 81 1.354 2.680 11.002 1.00 0.00 H new ATOM 0 HG2 GLU A 81 2.666 0.801 10.775 1.00 0.00 H new ATOM 0 HG3 GLU A 81 1.318 -0.290 11.031 1.00 0.00 H new ATOM 1249 N GLN A 82 0.442 -0.136 13.915 1.00 0.00 N ATOM 1250 CA GLN A 82 1.255 -0.824 14.910 1.00 0.00 C ATOM 1251 C GLN A 82 2.312 -1.684 14.229 1.00 0.00 C ATOM 1252 O GLN A 82 2.330 -1.813 13.005 1.00 0.00 O ATOM 1253 CB GLN A 82 0.373 -1.701 15.800 1.00 0.00 C ATOM 1254 CG GLN A 82 0.621 -1.366 17.268 1.00 0.00 C ATOM 1255 CD GLN A 82 0.387 0.120 17.522 1.00 0.00 C ATOM 1256 OE1 GLN A 82 -0.617 0.675 17.079 1.00 0.00 O ATOM 1257 NE2 GLN A 82 1.260 0.798 18.214 1.00 0.00 N ATOM 0 H GLN A 82 -0.521 -0.466 13.854 1.00 0.00 H new ATOM 0 HA GLN A 82 1.751 -0.074 15.527 1.00 0.00 H new ATOM 0 HB2 GLN A 82 -0.677 -1.543 15.554 1.00 0.00 H new ATOM 0 HB3 GLN A 82 0.589 -2.754 15.617 1.00 0.00 H new ATOM 0 HG2 GLN A 82 -0.041 -1.958 17.899 1.00 0.00 H new ATOM 0 HG3 GLN A 82 1.642 -1.631 17.541 1.00 0.00 H new ATOM 0 HE21 GLN A 82 2.092 0.335 18.580 1.00 0.00 H new ATOM 0 HE22 GLN A 82 1.111 1.792 18.389 1.00 0.00 H new ATOM 1266 N VAL A 83 3.195 -2.268 15.031 1.00 0.00 N ATOM 1267 CA VAL A 83 4.254 -3.110 14.493 1.00 0.00 C ATOM 1268 C VAL A 83 3.669 -4.414 13.955 1.00 0.00 C ATOM 1269 O VAL A 83 3.153 -5.235 14.711 1.00 0.00 O ATOM 1270 CB VAL A 83 5.284 -3.412 15.586 1.00 0.00 C ATOM 1271 CG1 VAL A 83 5.509 -2.158 16.434 1.00 0.00 C ATOM 1272 CG2 VAL A 83 4.771 -4.543 16.481 1.00 0.00 C ATOM 0 H VAL A 83 3.199 -2.175 16.047 1.00 0.00 H new ATOM 0 HA VAL A 83 4.744 -2.581 13.676 1.00 0.00 H new ATOM 0 HB VAL A 83 6.223 -3.715 15.122 1.00 0.00 H new ATOM 0 HG11 VAL A 83 6.242 -2.372 17.212 1.00 0.00 H new ATOM 0 HG12 VAL A 83 5.877 -1.351 15.800 1.00 0.00 H new ATOM 0 HG13 VAL A 83 4.568 -1.857 16.895 1.00 0.00 H new ATOM 0 HG21 VAL A 83 5.506 -4.755 17.257 1.00 0.00 H new ATOM 0 HG22 VAL A 83 3.831 -4.243 16.944 1.00 0.00 H new ATOM 0 HG23 VAL A 83 4.610 -5.438 15.880 1.00 0.00 H new ATOM 1282 N ILE A 84 3.739 -4.587 12.638 1.00 0.00 N ATOM 1283 CA ILE A 84 3.202 -5.786 12.003 1.00 0.00 C ATOM 1284 C ILE A 84 4.271 -6.513 11.206 1.00 0.00 C ATOM 1285 O ILE A 84 5.059 -5.897 10.488 1.00 0.00 O ATOM 1286 CB ILE A 84 2.044 -5.409 11.077 1.00 0.00 C ATOM 1287 CG1 ILE A 84 0.771 -5.221 11.905 1.00 0.00 C ATOM 1288 CG2 ILE A 84 1.827 -6.525 10.053 1.00 0.00 C ATOM 1289 CD1 ILE A 84 -0.209 -4.332 11.138 1.00 0.00 C ATOM 0 H ILE A 84 4.159 -3.917 11.994 1.00 0.00 H new ATOM 0 HA ILE A 84 2.846 -6.452 12.789 1.00 0.00 H new ATOM 0 HB ILE A 84 2.280 -4.480 10.557 1.00 0.00 H new ATOM 0 HG12 ILE A 84 0.314 -6.188 12.114 1.00 0.00 H new ATOM 0 HG13 ILE A 84 1.013 -4.768 12.867 1.00 0.00 H new ATOM 0 HG21 ILE A 84 1.002 -6.258 9.393 1.00 0.00 H new ATOM 0 HG22 ILE A 84 2.734 -6.660 9.464 1.00 0.00 H new ATOM 0 HG23 ILE A 84 1.590 -7.454 10.572 1.00 0.00 H new ATOM 0 HD11 ILE A 84 -1.116 -4.198 11.727 1.00 0.00 H new ATOM 0 HD12 ILE A 84 0.250 -3.361 10.952 1.00 0.00 H new ATOM 0 HD13 ILE A 84 -0.460 -4.803 10.188 1.00 0.00 H new ATOM 1301 N LYS A 85 4.280 -7.834 11.331 1.00 0.00 N ATOM 1302 CA LYS A 85 5.241 -8.650 10.611 1.00 0.00 C ATOM 1303 C LYS A 85 4.536 -9.423 9.508 1.00 0.00 C ATOM 1304 O LYS A 85 3.420 -9.907 9.690 1.00 0.00 O ATOM 1305 CB LYS A 85 5.940 -9.622 11.564 1.00 0.00 C ATOM 1306 CG LYS A 85 5.085 -9.825 12.810 1.00 0.00 C ATOM 1307 CD LYS A 85 5.454 -11.157 13.469 1.00 0.00 C ATOM 1308 CE LYS A 85 4.382 -11.544 14.487 1.00 0.00 C ATOM 1309 NZ LYS A 85 3.454 -10.398 14.697 1.00 0.00 N ATOM 0 H LYS A 85 3.635 -8.358 11.922 1.00 0.00 H new ATOM 0 HA LYS A 85 5.993 -7.996 10.169 1.00 0.00 H new ATOM 0 HB2 LYS A 85 6.107 -10.577 11.066 1.00 0.00 H new ATOM 0 HB3 LYS A 85 6.919 -9.232 11.843 1.00 0.00 H new ATOM 0 HG2 LYS A 85 5.242 -9.004 13.510 1.00 0.00 H new ATOM 0 HG3 LYS A 85 4.028 -9.819 12.544 1.00 0.00 H new ATOM 0 HD2 LYS A 85 5.547 -11.935 12.711 1.00 0.00 H new ATOM 0 HD3 LYS A 85 6.423 -11.074 13.961 1.00 0.00 H new ATOM 0 HE2 LYS A 85 3.828 -12.413 14.134 1.00 0.00 H new ATOM 0 HE3 LYS A 85 4.848 -11.825 15.431 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 2.777 -10.633 15.451 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 3.999 -9.556 14.971 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 2.937 -10.204 13.816 1.00 0.00 H new ATOM 1323 N THR A 86 5.191 -9.530 8.365 1.00 0.00 N ATOM 1324 CA THR A 86 4.614 -10.241 7.233 1.00 0.00 C ATOM 1325 C THR A 86 4.575 -11.735 7.517 1.00 0.00 C ATOM 1326 O THR A 86 5.614 -12.364 7.712 1.00 0.00 O ATOM 1327 CB THR A 86 5.435 -9.976 5.973 1.00 0.00 C ATOM 1328 OG1 THR A 86 5.719 -8.586 5.881 1.00 0.00 O ATOM 1329 CG2 THR A 86 4.646 -10.420 4.742 1.00 0.00 C ATOM 0 H THR A 86 6.117 -9.137 8.195 1.00 0.00 H new ATOM 0 HA THR A 86 3.597 -9.882 7.077 1.00 0.00 H new ATOM 0 HB THR A 86 6.368 -10.537 6.022 1.00 0.00 H new ATOM 0 HG1 THR A 86 5.639 -8.297 4.948 1.00 0.00 H new ATOM 0 HG21 THR A 86 5.234 -10.230 3.844 1.00 0.00 H new ATOM 0 HG22 THR A 86 4.429 -11.486 4.814 1.00 0.00 H new ATOM 0 HG23 THR A 86 3.711 -9.862 4.688 1.00 0.00 H new ATOM 1337 N ASN A 87 3.367 -12.289 7.548 1.00 0.00 N ATOM 1338 CA ASN A 87 3.188 -13.709 7.824 1.00 0.00 C ATOM 1339 C ASN A 87 3.380 -14.546 6.562 1.00 0.00 C ATOM 1340 O ASN A 87 3.946 -15.636 6.613 1.00 0.00 O ATOM 1341 CB ASN A 87 1.788 -13.949 8.390 1.00 0.00 C ATOM 1342 CG ASN A 87 1.743 -15.289 9.114 1.00 0.00 C ATOM 1343 OD1 ASN A 87 0.724 -15.979 9.082 1.00 0.00 O ATOM 1344 ND2 ASN A 87 2.793 -15.700 9.770 1.00 0.00 N ATOM 0 H ASN A 87 2.500 -11.777 7.386 1.00 0.00 H new ATOM 0 HA ASN A 87 3.940 -14.012 8.552 1.00 0.00 H new ATOM 0 HB2 ASN A 87 1.522 -13.146 9.077 1.00 0.00 H new ATOM 0 HB3 ASN A 87 1.054 -13.936 7.585 1.00 0.00 H new ATOM 0 HD21 ASN A 87 2.771 -16.595 10.258 1.00 0.00 H new ATOM 0 HD22 ASN A 87 3.636 -15.126 9.795 1.00 0.00 H new ATOM 1351 N ALA A 88 2.897 -14.040 5.432 1.00 0.00 N ATOM 1352 CA ALA A 88 3.022 -14.765 4.176 1.00 0.00 C ATOM 1353 C ALA A 88 4.204 -14.253 3.361 1.00 0.00 C ATOM 1354 O ALA A 88 5.004 -13.447 3.835 1.00 0.00 O ATOM 1355 CB ALA A 88 1.737 -14.619 3.353 1.00 0.00 C ATOM 0 H ALA A 88 2.421 -13.141 5.361 1.00 0.00 H new ATOM 0 HA ALA A 88 3.190 -15.816 4.412 1.00 0.00 H new ATOM 0 HB1 ALA A 88 1.841 -15.165 2.415 1.00 0.00 H new ATOM 0 HB2 ALA A 88 0.896 -15.023 3.917 1.00 0.00 H new ATOM 0 HB3 ALA A 88 1.559 -13.565 3.141 1.00 0.00 H new ATOM 1361 N ASN A 89 4.298 -14.728 2.127 1.00 0.00 N ATOM 1362 CA ASN A 89 5.369 -14.313 1.235 1.00 0.00 C ATOM 1363 C ASN A 89 4.762 -13.544 0.067 1.00 0.00 C ATOM 1364 O ASN A 89 3.552 -13.574 -0.123 1.00 0.00 O ATOM 1365 CB ASN A 89 6.126 -15.539 0.718 1.00 0.00 C ATOM 1366 CG ASN A 89 6.794 -16.268 1.879 1.00 0.00 C ATOM 1367 OD1 ASN A 89 6.201 -16.407 2.949 1.00 0.00 O ATOM 1368 ND2 ASN A 89 7.999 -16.745 1.731 1.00 0.00 N ATOM 0 H ASN A 89 3.646 -15.400 1.722 1.00 0.00 H new ATOM 0 HA ASN A 89 6.071 -13.675 1.773 1.00 0.00 H new ATOM 0 HB2 ASN A 89 5.439 -16.211 0.203 1.00 0.00 H new ATOM 0 HB3 ASN A 89 6.877 -15.232 -0.010 1.00 0.00 H new ATOM 0 HD21 ASN A 89 8.452 -17.234 2.503 1.00 0.00 H new ATOM 0 HD22 ASN A 89 8.488 -16.629 0.844 1.00 0.00 H new ATOM 1375 N VAL A 90 5.593 -12.836 -0.688 1.00 0.00 N ATOM 1376 CA VAL A 90 5.123 -12.047 -1.797 1.00 0.00 C ATOM 1377 C VAL A 90 5.990 -12.310 -3.010 1.00 0.00 C ATOM 1378 O VAL A 90 7.214 -12.161 -2.949 1.00 0.00 O ATOM 1379 CB VAL A 90 5.183 -10.575 -1.402 1.00 0.00 C ATOM 1380 CG1 VAL A 90 5.436 -9.729 -2.634 1.00 0.00 C ATOM 1381 CG2 VAL A 90 3.863 -10.158 -0.751 1.00 0.00 C ATOM 0 H VAL A 90 6.602 -12.799 -0.543 1.00 0.00 H new ATOM 0 HA VAL A 90 4.096 -12.313 -2.047 1.00 0.00 H new ATOM 0 HB VAL A 90 5.994 -10.427 -0.689 1.00 0.00 H new ATOM 0 HG11 VAL A 90 5.479 -8.677 -2.351 1.00 0.00 H new ATOM 0 HG12 VAL A 90 6.383 -10.021 -3.088 1.00 0.00 H new ATOM 0 HG13 VAL A 90 4.629 -9.879 -3.351 1.00 0.00 H new ATOM 0 HG21 VAL A 90 3.912 -9.106 -0.471 1.00 0.00 H new ATOM 0 HG22 VAL A 90 3.046 -10.308 -1.457 1.00 0.00 H new ATOM 0 HG23 VAL A 90 3.689 -10.763 0.139 1.00 0.00 H new ATOM 1391 N LYS A 91 5.350 -12.690 -4.108 1.00 0.00 N ATOM 1392 CA LYS A 91 6.073 -12.964 -5.334 1.00 0.00 C ATOM 1393 C LYS A 91 5.407 -12.284 -6.523 1.00 0.00 C ATOM 1394 O LYS A 91 4.260 -12.574 -6.859 1.00 0.00 O ATOM 1395 CB LYS A 91 6.142 -14.478 -5.563 1.00 0.00 C ATOM 1396 CG LYS A 91 6.243 -14.777 -7.060 1.00 0.00 C ATOM 1397 CD LYS A 91 6.814 -16.185 -7.259 1.00 0.00 C ATOM 1398 CE LYS A 91 5.937 -16.966 -8.243 1.00 0.00 C ATOM 1399 NZ LYS A 91 6.761 -18.011 -8.914 1.00 0.00 N ATOM 0 H LYS A 91 4.339 -12.814 -4.171 1.00 0.00 H new ATOM 0 HA LYS A 91 7.083 -12.565 -5.239 1.00 0.00 H new ATOM 0 HB2 LYS A 91 7.004 -14.894 -5.042 1.00 0.00 H new ATOM 0 HB3 LYS A 91 5.256 -14.958 -5.147 1.00 0.00 H new ATOM 0 HG2 LYS A 91 5.260 -14.702 -7.524 1.00 0.00 H new ATOM 0 HG3 LYS A 91 6.882 -14.041 -7.547 1.00 0.00 H new ATOM 0 HD2 LYS A 91 7.835 -16.123 -7.637 1.00 0.00 H new ATOM 0 HD3 LYS A 91 6.859 -16.708 -6.304 1.00 0.00 H new ATOM 0 HE2 LYS A 91 5.102 -17.428 -7.716 1.00 0.00 H new ATOM 0 HE3 LYS A 91 5.512 -16.290 -8.985 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 6.169 -18.543 -9.583 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 7.544 -17.559 -9.428 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 7.146 -18.661 -8.199 1.00 0.00 H new ATOM 1413 N ALA A 92 6.144 -11.391 -7.170 1.00 0.00 N ATOM 1414 CA ALA A 92 5.623 -10.698 -8.333 1.00 0.00 C ATOM 1415 C ALA A 92 5.406 -11.709 -9.450 1.00 0.00 C ATOM 1416 O ALA A 92 6.356 -12.358 -9.896 1.00 0.00 O ATOM 1417 CB ALA A 92 6.609 -9.622 -8.793 1.00 0.00 C ATOM 0 H ALA A 92 7.096 -11.133 -6.910 1.00 0.00 H new ATOM 0 HA ALA A 92 4.679 -10.217 -8.078 1.00 0.00 H new ATOM 0 HB1 ALA A 92 6.206 -9.109 -9.666 1.00 0.00 H new ATOM 0 HB2 ALA A 92 6.764 -8.902 -7.989 1.00 0.00 H new ATOM 0 HB3 ALA A 92 7.560 -10.087 -9.052 1.00 0.00 H new ATOM 1423 N LEU A 93 4.154 -11.843 -9.882 1.00 0.00 N ATOM 1424 CA LEU A 93 3.808 -12.788 -10.935 1.00 0.00 C ATOM 1425 C LEU A 93 4.326 -12.288 -12.276 1.00 0.00 C ATOM 1426 O LEU A 93 4.960 -13.026 -13.030 1.00 0.00 O ATOM 1427 CB LEU A 93 2.285 -12.943 -11.005 1.00 0.00 C ATOM 1428 CG LEU A 93 1.890 -14.377 -10.650 1.00 0.00 C ATOM 1429 CD1 LEU A 93 2.525 -14.769 -9.313 1.00 0.00 C ATOM 1430 CD2 LEU A 93 0.367 -14.467 -10.537 1.00 0.00 C ATOM 0 H LEU A 93 3.365 -11.309 -9.518 1.00 0.00 H new ATOM 0 HA LEU A 93 4.265 -13.752 -10.711 1.00 0.00 H new ATOM 0 HB2 LEU A 93 1.808 -12.245 -10.318 1.00 0.00 H new ATOM 0 HB3 LEU A 93 1.931 -12.697 -12.006 1.00 0.00 H new ATOM 0 HG LEU A 93 2.241 -15.055 -11.428 1.00 0.00 H new ATOM 0 HD11 LEU A 93 2.242 -15.791 -9.062 1.00 0.00 H new ATOM 0 HD12 LEU A 93 3.610 -14.702 -9.392 1.00 0.00 H new ATOM 0 HD13 LEU A 93 2.175 -14.094 -8.532 1.00 0.00 H new ATOM 0 HD21 LEU A 93 0.081 -15.488 -10.284 1.00 0.00 H new ATOM 0 HD22 LEU A 93 0.019 -13.789 -9.758 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -0.086 -14.189 -11.489 1.00 0.00 H new ATOM 1442 N THR A 94 4.059 -11.020 -12.552 1.00 0.00 N ATOM 1443 CA THR A 94 4.504 -10.399 -13.789 1.00 0.00 C ATOM 1444 C THR A 94 5.246 -9.113 -13.467 1.00 0.00 C ATOM 1445 O THR A 94 4.949 -8.454 -12.468 1.00 0.00 O ATOM 1446 CB THR A 94 3.305 -10.092 -14.689 1.00 0.00 C ATOM 1447 OG1 THR A 94 2.310 -9.416 -13.932 1.00 0.00 O ATOM 1448 CG2 THR A 94 2.730 -11.396 -15.243 1.00 0.00 C ATOM 0 H THR A 94 3.535 -10.400 -11.934 1.00 0.00 H new ATOM 0 HA THR A 94 5.169 -11.085 -14.314 1.00 0.00 H new ATOM 0 HB THR A 94 3.625 -9.461 -15.518 1.00 0.00 H new ATOM 0 HG1 THR A 94 2.047 -8.594 -14.397 1.00 0.00 H new ATOM 0 HG21 THR A 94 1.876 -11.174 -15.883 1.00 0.00 H new ATOM 0 HG22 THR A 94 3.494 -11.913 -15.823 1.00 0.00 H new ATOM 0 HG23 THR A 94 2.409 -12.032 -14.418 1.00 0.00 H new ATOM 1456 N TYR A 95 6.211 -8.756 -14.306 1.00 0.00 N ATOM 1457 CA TYR A 95 6.981 -7.545 -14.071 1.00 0.00 C ATOM 1458 C TYR A 95 6.046 -6.395 -13.732 1.00 0.00 C ATOM 1459 O TYR A 95 5.117 -6.092 -14.481 1.00 0.00 O ATOM 1460 CB TYR A 95 7.796 -7.185 -15.312 1.00 0.00 C ATOM 1461 CG TYR A 95 7.503 -8.170 -16.416 1.00 0.00 C ATOM 1462 CD1 TYR A 95 6.181 -8.405 -16.810 1.00 0.00 C ATOM 1463 CD2 TYR A 95 8.553 -8.847 -17.049 1.00 0.00 C ATOM 1464 CE1 TYR A 95 5.907 -9.316 -17.838 1.00 0.00 C ATOM 1465 CE2 TYR A 95 8.280 -9.759 -18.076 1.00 0.00 C ATOM 1466 CZ TYR A 95 6.958 -9.993 -18.470 1.00 0.00 C ATOM 1467 OH TYR A 95 6.688 -10.892 -19.483 1.00 0.00 O ATOM 0 H TYR A 95 6.475 -9.279 -15.141 1.00 0.00 H new ATOM 0 HA TYR A 95 7.660 -7.722 -13.237 1.00 0.00 H new ATOM 0 HB2 TYR A 95 7.551 -6.174 -15.639 1.00 0.00 H new ATOM 0 HB3 TYR A 95 8.860 -7.195 -15.076 1.00 0.00 H new ATOM 0 HD1 TYR A 95 5.371 -7.884 -16.321 1.00 0.00 H new ATOM 0 HD2 TYR A 95 9.573 -8.666 -16.745 1.00 0.00 H new ATOM 0 HE1 TYR A 95 4.887 -9.496 -18.143 1.00 0.00 H new ATOM 0 HE2 TYR A 95 9.090 -10.282 -18.564 1.00 0.00 H new ATOM 0 HH TYR A 95 7.528 -11.273 -19.815 1.00 0.00 H new ATOM 1477 N CYS A 96 6.290 -5.762 -12.591 1.00 0.00 N ATOM 1478 CA CYS A 96 5.450 -4.655 -12.165 1.00 0.00 C ATOM 1479 C CYS A 96 6.274 -3.568 -11.498 1.00 0.00 C ATOM 1480 O CYS A 96 7.257 -3.844 -10.810 1.00 0.00 O ATOM 1481 CB CYS A 96 4.392 -5.151 -11.181 1.00 0.00 C ATOM 1482 SG CYS A 96 5.065 -5.099 -9.501 1.00 0.00 S ATOM 0 H CYS A 96 7.052 -5.993 -11.954 1.00 0.00 H new ATOM 0 HA CYS A 96 4.970 -4.240 -13.051 1.00 0.00 H new ATOM 0 HB2 CYS A 96 3.499 -4.530 -11.246 1.00 0.00 H new ATOM 0 HB3 CYS A 96 4.092 -6.168 -11.434 1.00 0.00 H new ATOM 0 HG CYS A 96 4.166 -5.519 -8.660 1.00 0.00 H new ATOM 1488 N ASP A 97 5.841 -2.330 -11.686 1.00 0.00 N ATOM 1489 CA ASP A 97 6.518 -1.197 -11.077 1.00 0.00 C ATOM 1490 C ASP A 97 5.841 -0.874 -9.756 1.00 0.00 C ATOM 1491 O ASP A 97 4.621 -0.724 -9.698 1.00 0.00 O ATOM 1492 CB ASP A 97 6.455 0.018 -12.003 1.00 0.00 C ATOM 1493 CG ASP A 97 6.641 1.297 -11.194 1.00 0.00 C ATOM 1494 OD1 ASP A 97 7.777 1.704 -11.019 1.00 0.00 O ATOM 1495 OD2 ASP A 97 5.643 1.849 -10.759 1.00 0.00 O ATOM 0 H ASP A 97 5.028 -2.086 -12.252 1.00 0.00 H new ATOM 0 HA ASP A 97 7.565 -1.447 -10.907 1.00 0.00 H new ATOM 0 HB2 ASP A 97 7.229 -0.055 -12.767 1.00 0.00 H new ATOM 0 HB3 ASP A 97 5.497 0.042 -12.522 1.00 0.00 H new ATOM 1500 N LEU A 98 6.625 -0.785 -8.691 1.00 0.00 N ATOM 1501 CA LEU A 98 6.055 -0.502 -7.384 1.00 0.00 C ATOM 1502 C LEU A 98 6.656 0.750 -6.767 1.00 0.00 C ATOM 1503 O LEU A 98 7.874 0.919 -6.728 1.00 0.00 O ATOM 1504 CB LEU A 98 6.287 -1.683 -6.442 1.00 0.00 C ATOM 1505 CG LEU A 98 5.998 -2.993 -7.178 1.00 0.00 C ATOM 1506 CD1 LEU A 98 7.270 -3.491 -7.868 1.00 0.00 C ATOM 1507 CD2 LEU A 98 5.519 -4.042 -6.174 1.00 0.00 C ATOM 0 H LEU A 98 7.638 -0.902 -8.705 1.00 0.00 H new ATOM 0 HA LEU A 98 4.986 -0.339 -7.524 1.00 0.00 H new ATOM 0 HB2 LEU A 98 7.316 -1.676 -6.081 1.00 0.00 H new ATOM 0 HB3 LEU A 98 5.642 -1.596 -5.568 1.00 0.00 H new ATOM 0 HG LEU A 98 5.226 -2.823 -7.928 1.00 0.00 H new ATOM 0 HD11 LEU A 98 7.059 -4.424 -8.391 1.00 0.00 H new ATOM 0 HD12 LEU A 98 7.612 -2.744 -8.584 1.00 0.00 H new ATOM 0 HD13 LEU A 98 8.046 -3.661 -7.122 1.00 0.00 H new ATOM 0 HD21 LEU A 98 5.312 -4.977 -6.695 1.00 0.00 H new ATOM 0 HD22 LEU A 98 6.293 -4.208 -5.424 1.00 0.00 H new ATOM 0 HD23 LEU A 98 4.610 -3.690 -5.686 1.00 0.00 H new ATOM 1519 N GLN A 99 5.785 1.605 -6.253 1.00 0.00 N ATOM 1520 CA GLN A 99 6.222 2.823 -5.594 1.00 0.00 C ATOM 1521 C GLN A 99 5.996 2.654 -4.101 1.00 0.00 C ATOM 1522 O GLN A 99 4.934 2.198 -3.681 1.00 0.00 O ATOM 1523 CB GLN A 99 5.424 4.026 -6.107 1.00 0.00 C ATOM 1524 CG GLN A 99 4.956 3.765 -7.542 1.00 0.00 C ATOM 1525 CD GLN A 99 3.988 4.858 -7.980 1.00 0.00 C ATOM 1526 OE1 GLN A 99 3.595 5.701 -7.173 1.00 0.00 O ATOM 1527 NE2 GLN A 99 3.576 4.894 -9.217 1.00 0.00 N ATOM 0 H GLN A 99 4.773 1.477 -6.280 1.00 0.00 H new ATOM 0 HA GLN A 99 7.276 3.002 -5.805 1.00 0.00 H new ATOM 0 HB2 GLN A 99 4.564 4.206 -5.461 1.00 0.00 H new ATOM 0 HB3 GLN A 99 6.041 4.924 -6.074 1.00 0.00 H new ATOM 0 HG2 GLN A 99 5.814 3.737 -8.214 1.00 0.00 H new ATOM 0 HG3 GLN A 99 4.470 2.791 -7.604 1.00 0.00 H new ATOM 0 HE21 GLN A 99 3.903 4.195 -9.884 1.00 0.00 H new ATOM 0 HE22 GLN A 99 2.927 5.621 -9.517 1.00 0.00 H new ATOM 1536 N TYR A 100 6.990 2.997 -3.297 1.00 0.00 N ATOM 1537 CA TYR A 100 6.850 2.838 -1.859 1.00 0.00 C ATOM 1538 C TYR A 100 7.678 3.851 -1.089 1.00 0.00 C ATOM 1539 O TYR A 100 8.553 4.524 -1.637 1.00 0.00 O ATOM 1540 CB TYR A 100 7.240 1.412 -1.426 1.00 0.00 C ATOM 1541 CG TYR A 100 8.743 1.199 -1.478 1.00 0.00 C ATOM 1542 CD1 TYR A 100 9.548 1.879 -2.407 1.00 0.00 C ATOM 1543 CD2 TYR A 100 9.332 0.291 -0.589 1.00 0.00 C ATOM 1544 CE1 TYR A 100 10.931 1.651 -2.435 1.00 0.00 C ATOM 1545 CE2 TYR A 100 10.711 0.064 -0.624 1.00 0.00 C ATOM 1546 CZ TYR A 100 11.510 0.744 -1.545 1.00 0.00 C ATOM 1547 OH TYR A 100 12.870 0.518 -1.578 1.00 0.00 O ATOM 0 H TYR A 100 7.884 3.379 -3.607 1.00 0.00 H new ATOM 0 HA TYR A 100 5.800 3.013 -1.623 1.00 0.00 H new ATOM 0 HB2 TYR A 100 6.882 1.229 -0.413 1.00 0.00 H new ATOM 0 HB3 TYR A 100 6.747 0.687 -2.074 1.00 0.00 H new ATOM 0 HD1 TYR A 100 9.102 2.577 -3.099 1.00 0.00 H new ATOM 0 HD2 TYR A 100 8.718 -0.236 0.127 1.00 0.00 H new ATOM 0 HE1 TYR A 100 11.550 2.178 -3.146 1.00 0.00 H new ATOM 0 HE2 TYR A 100 11.159 -0.639 0.063 1.00 0.00 H new ATOM 0 HH TYR A 100 13.109 -0.140 -0.892 1.00 0.00 H new ATOM 1557 N ILE A 101 7.374 3.949 0.195 1.00 0.00 N ATOM 1558 CA ILE A 101 8.072 4.873 1.071 1.00 0.00 C ATOM 1559 C ILE A 101 8.033 4.345 2.498 1.00 0.00 C ATOM 1560 O ILE A 101 7.137 3.586 2.866 1.00 0.00 O ATOM 1561 CB ILE A 101 7.421 6.265 0.976 1.00 0.00 C ATOM 1562 CG1 ILE A 101 7.015 6.791 2.352 1.00 0.00 C ATOM 1563 CG2 ILE A 101 6.171 6.150 0.123 1.00 0.00 C ATOM 1564 CD1 ILE A 101 5.754 6.060 2.785 1.00 0.00 C ATOM 0 H ILE A 101 6.647 3.399 0.653 1.00 0.00 H new ATOM 0 HA ILE A 101 9.114 4.962 0.765 1.00 0.00 H new ATOM 0 HB ILE A 101 8.144 6.955 0.542 1.00 0.00 H new ATOM 0 HG12 ILE A 101 7.816 6.628 3.073 1.00 0.00 H new ATOM 0 HG13 ILE A 101 6.837 7.866 2.311 1.00 0.00 H new ATOM 0 HG21 ILE A 101 5.694 7.127 0.043 1.00 0.00 H new ATOM 0 HG22 ILE A 101 6.441 5.795 -0.872 1.00 0.00 H new ATOM 0 HG23 ILE A 101 5.479 5.445 0.584 1.00 0.00 H new ATOM 0 HD11 ILE A 101 5.444 6.419 3.766 1.00 0.00 H new ATOM 0 HD12 ILE A 101 4.959 6.246 2.063 1.00 0.00 H new ATOM 0 HD13 ILE A 101 5.953 4.990 2.837 1.00 0.00 H new ATOM 1576 N SER A 102 8.993 4.760 3.307 1.00 0.00 N ATOM 1577 CA SER A 102 9.020 4.327 4.689 1.00 0.00 C ATOM 1578 C SER A 102 8.006 5.137 5.483 1.00 0.00 C ATOM 1579 O SER A 102 8.028 6.368 5.460 1.00 0.00 O ATOM 1580 CB SER A 102 10.418 4.513 5.280 1.00 0.00 C ATOM 1581 OG SER A 102 10.839 5.856 5.087 1.00 0.00 O ATOM 0 H SER A 102 9.751 5.386 3.035 1.00 0.00 H new ATOM 0 HA SER A 102 8.765 3.268 4.740 1.00 0.00 H new ATOM 0 HB2 SER A 102 10.410 4.272 6.343 1.00 0.00 H new ATOM 0 HB3 SER A 102 11.120 3.829 4.804 1.00 0.00 H new ATOM 0 HG SER A 102 11.734 5.976 5.467 1.00 0.00 H new ATOM 1587 N LEU A 103 7.112 4.446 6.173 1.00 0.00 N ATOM 1588 CA LEU A 103 6.087 5.123 6.955 1.00 0.00 C ATOM 1589 C LEU A 103 6.725 6.225 7.792 1.00 0.00 C ATOM 1590 O LEU A 103 6.117 7.267 8.035 1.00 0.00 O ATOM 1591 CB LEU A 103 5.385 4.118 7.865 1.00 0.00 C ATOM 1592 CG LEU A 103 4.104 4.734 8.415 1.00 0.00 C ATOM 1593 CD1 LEU A 103 3.146 3.609 8.779 1.00 0.00 C ATOM 1594 CD2 LEU A 103 4.417 5.564 9.666 1.00 0.00 C ATOM 0 H LEU A 103 7.074 3.427 6.208 1.00 0.00 H new ATOM 0 HA LEU A 103 5.353 5.566 6.282 1.00 0.00 H new ATOM 0 HB2 LEU A 103 5.154 3.209 7.310 1.00 0.00 H new ATOM 0 HB3 LEU A 103 6.044 3.832 8.685 1.00 0.00 H new ATOM 0 HG LEU A 103 3.655 5.385 7.665 1.00 0.00 H new ATOM 0 HD11 LEU A 103 2.222 4.031 9.175 1.00 0.00 H new ATOM 0 HD12 LEU A 103 2.923 3.019 7.890 1.00 0.00 H new ATOM 0 HD13 LEU A 103 3.605 2.970 9.533 1.00 0.00 H new ATOM 0 HD21 LEU A 103 3.496 6.001 10.053 1.00 0.00 H new ATOM 0 HD22 LEU A 103 4.862 4.922 10.427 1.00 0.00 H new ATOM 0 HD23 LEU A 103 5.116 6.360 9.409 1.00 0.00 H new ATOM 1606 N LYS A 104 7.965 5.996 8.203 1.00 0.00 N ATOM 1607 CA LYS A 104 8.698 6.984 8.985 1.00 0.00 C ATOM 1608 C LYS A 104 9.032 8.192 8.112 1.00 0.00 C ATOM 1609 O LYS A 104 9.086 9.326 8.588 1.00 0.00 O ATOM 1610 CB LYS A 104 9.988 6.368 9.529 1.00 0.00 C ATOM 1611 CG LYS A 104 9.727 4.917 9.936 1.00 0.00 C ATOM 1612 CD LYS A 104 10.928 4.382 10.721 1.00 0.00 C ATOM 1613 CE LYS A 104 11.180 2.923 10.336 1.00 0.00 C ATOM 1614 NZ LYS A 104 9.881 2.193 10.273 1.00 0.00 N ATOM 0 H LYS A 104 8.483 5.139 8.009 1.00 0.00 H new ATOM 0 HA LYS A 104 8.077 7.306 9.821 1.00 0.00 H new ATOM 0 HB2 LYS A 104 10.771 6.409 8.772 1.00 0.00 H new ATOM 0 HB3 LYS A 104 10.343 6.939 10.387 1.00 0.00 H new ATOM 0 HG2 LYS A 104 8.825 4.856 10.545 1.00 0.00 H new ATOM 0 HG3 LYS A 104 9.556 4.305 9.050 1.00 0.00 H new ATOM 0 HD2 LYS A 104 11.812 4.983 10.508 1.00 0.00 H new ATOM 0 HD3 LYS A 104 10.740 4.459 11.792 1.00 0.00 H new ATOM 0 HE2 LYS A 104 11.685 2.872 9.371 1.00 0.00 H new ATOM 0 HE3 LYS A 104 11.839 2.452 11.065 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 10.055 1.169 10.333 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 9.278 2.489 11.067 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 9.404 2.411 9.375 1.00 0.00 H new ATOM 1628 N GLY A 105 9.254 7.930 6.825 1.00 0.00 N ATOM 1629 CA GLY A 105 9.583 8.984 5.872 1.00 0.00 C ATOM 1630 C GLY A 105 8.369 9.845 5.591 1.00 0.00 C ATOM 1631 O GLY A 105 8.463 11.067 5.519 1.00 0.00 O ATOM 0 H GLY A 105 9.211 6.995 6.420 1.00 0.00 H new ATOM 0 HA2 GLY A 105 10.390 9.601 6.268 1.00 0.00 H new ATOM 0 HA3 GLY A 105 9.945 8.542 4.944 1.00 0.00 H new ATOM 1635 N LEU A 106 7.239 9.177 5.409 1.00 0.00 N ATOM 1636 CA LEU A 106 5.979 9.840 5.106 1.00 0.00 C ATOM 1637 C LEU A 106 5.433 10.619 6.294 1.00 0.00 C ATOM 1638 O LEU A 106 4.954 11.740 6.142 1.00 0.00 O ATOM 1639 CB LEU A 106 4.969 8.789 4.701 1.00 0.00 C ATOM 1640 CG LEU A 106 3.806 9.454 3.971 1.00 0.00 C ATOM 1641 CD1 LEU A 106 3.744 8.958 2.528 1.00 0.00 C ATOM 1642 CD2 LEU A 106 2.505 9.108 4.694 1.00 0.00 C ATOM 0 H LEU A 106 7.170 8.161 5.467 1.00 0.00 H new ATOM 0 HA LEU A 106 6.159 10.553 4.301 1.00 0.00 H new ATOM 0 HB2 LEU A 106 5.440 8.047 4.057 1.00 0.00 H new ATOM 0 HB3 LEU A 106 4.605 8.261 5.582 1.00 0.00 H new ATOM 0 HG LEU A 106 3.948 10.535 3.964 1.00 0.00 H new ATOM 0 HD11 LEU A 106 2.911 9.438 2.014 1.00 0.00 H new ATOM 0 HD12 LEU A 106 4.675 9.204 2.018 1.00 0.00 H new ATOM 0 HD13 LEU A 106 3.601 7.877 2.521 1.00 0.00 H new ATOM 0 HD21 LEU A 106 1.667 9.579 4.180 1.00 0.00 H new ATOM 0 HD22 LEU A 106 2.367 8.027 4.698 1.00 0.00 H new ATOM 0 HD23 LEU A 106 2.551 9.471 5.721 1.00 0.00 H new ATOM 1654 N ARG A 107 5.475 10.009 7.469 1.00 0.00 N ATOM 1655 CA ARG A 107 4.958 10.657 8.665 1.00 0.00 C ATOM 1656 C ARG A 107 5.836 11.828 9.100 1.00 0.00 C ATOM 1657 O ARG A 107 5.354 12.784 9.703 1.00 0.00 O ATOM 1658 CB ARG A 107 4.783 9.652 9.800 1.00 0.00 C ATOM 1659 CG ARG A 107 3.689 10.133 10.757 1.00 0.00 C ATOM 1660 CD ARG A 107 2.325 10.016 10.077 1.00 0.00 C ATOM 1661 NE ARG A 107 1.879 8.627 10.069 1.00 0.00 N ATOM 1662 CZ ARG A 107 2.038 7.860 8.996 1.00 0.00 C ATOM 1663 NH1 ARG A 107 2.622 8.336 7.930 1.00 0.00 N ATOM 1664 NH2 ARG A 107 1.617 6.625 9.010 1.00 0.00 N ATOM 0 H ARG A 107 5.858 9.076 7.620 1.00 0.00 H new ATOM 0 HA ARG A 107 3.977 11.062 8.416 1.00 0.00 H new ATOM 0 HB2 ARG A 107 4.520 8.675 9.395 1.00 0.00 H new ATOM 0 HB3 ARG A 107 5.723 9.531 10.339 1.00 0.00 H new ATOM 0 HG2 ARG A 107 3.703 9.538 11.670 1.00 0.00 H new ATOM 0 HG3 ARG A 107 3.874 11.167 11.047 1.00 0.00 H new ATOM 0 HD2 ARG A 107 1.596 10.636 10.600 1.00 0.00 H new ATOM 0 HD3 ARG A 107 2.387 10.391 9.055 1.00 0.00 H new ATOM 0 HE ARG A 107 1.437 8.238 10.902 1.00 0.00 H new ATOM 0 HH11 ARG A 107 2.958 9.299 7.919 1.00 0.00 H new ATOM 0 HH12 ARG A 107 2.743 7.745 7.108 1.00 0.00 H new ATOM 0 HH21 ARG A 107 1.166 6.249 9.844 1.00 0.00 H new ATOM 0 HH22 ARG A 107 1.739 6.035 8.187 1.00 0.00 H new ATOM 1678 N GLU A 108 7.122 11.739 8.793 1.00 0.00 N ATOM 1679 CA GLU A 108 8.069 12.798 9.158 1.00 0.00 C ATOM 1680 C GLU A 108 7.821 14.018 8.287 1.00 0.00 C ATOM 1681 O GLU A 108 7.600 15.128 8.780 1.00 0.00 O ATOM 1682 CB GLU A 108 9.507 12.311 8.965 1.00 0.00 C ATOM 1683 CG GLU A 108 10.470 13.268 9.671 1.00 0.00 C ATOM 1684 CD GLU A 108 10.879 12.694 11.023 1.00 0.00 C ATOM 1685 OE1 GLU A 108 11.000 11.484 11.118 1.00 0.00 O ATOM 1686 OE2 GLU A 108 11.065 13.474 11.942 1.00 0.00 O ATOM 0 H GLU A 108 7.538 10.952 8.295 1.00 0.00 H new ATOM 0 HA GLU A 108 7.924 13.060 10.206 1.00 0.00 H new ATOM 0 HB2 GLU A 108 9.618 11.304 9.367 1.00 0.00 H new ATOM 0 HB3 GLU A 108 9.744 12.258 7.903 1.00 0.00 H new ATOM 0 HG2 GLU A 108 11.353 13.429 9.053 1.00 0.00 H new ATOM 0 HG3 GLU A 108 9.995 14.239 9.808 1.00 0.00 H new ATOM 1693 N VAL A 109 7.809 13.786 6.989 1.00 0.00 N ATOM 1694 CA VAL A 109 7.530 14.847 6.041 1.00 0.00 C ATOM 1695 C VAL A 109 6.192 15.442 6.436 1.00 0.00 C ATOM 1696 O VAL A 109 5.971 16.661 6.412 1.00 0.00 O ATOM 1697 CB VAL A 109 7.484 14.253 4.624 1.00 0.00 C ATOM 1698 CG1 VAL A 109 8.918 14.053 4.136 1.00 0.00 C ATOM 1699 CG2 VAL A 109 6.788 12.898 4.633 1.00 0.00 C ATOM 0 H VAL A 109 7.989 12.875 6.567 1.00 0.00 H new ATOM 0 HA VAL A 109 8.297 15.621 6.049 1.00 0.00 H new ATOM 0 HB VAL A 109 6.936 14.933 3.972 1.00 0.00 H new ATOM 0 HG11 VAL A 109 8.905 13.632 3.131 1.00 0.00 H new ATOM 0 HG12 VAL A 109 9.434 15.013 4.120 1.00 0.00 H new ATOM 0 HG13 VAL A 109 9.439 13.372 4.808 1.00 0.00 H new ATOM 0 HG21 VAL A 109 6.765 12.494 3.621 1.00 0.00 H new ATOM 0 HG22 VAL A 109 7.332 12.214 5.285 1.00 0.00 H new ATOM 0 HG23 VAL A 109 5.768 13.015 5.000 1.00 0.00 H new ATOM 1709 N LEU A 110 5.322 14.551 6.864 1.00 0.00 N ATOM 1710 CA LEU A 110 4.015 14.933 7.341 1.00 0.00 C ATOM 1711 C LEU A 110 4.157 15.755 8.615 1.00 0.00 C ATOM 1712 O LEU A 110 3.347 16.639 8.887 1.00 0.00 O ATOM 1713 CB LEU A 110 3.238 13.664 7.615 1.00 0.00 C ATOM 1714 CG LEU A 110 2.267 13.381 6.468 1.00 0.00 C ATOM 1715 CD1 LEU A 110 3.025 13.320 5.145 1.00 0.00 C ATOM 1716 CD2 LEU A 110 1.574 12.035 6.717 1.00 0.00 C ATOM 0 H LEU A 110 5.502 13.547 6.890 1.00 0.00 H new ATOM 0 HA LEU A 110 3.492 15.540 6.601 1.00 0.00 H new ATOM 0 HB2 LEU A 110 3.925 12.827 7.734 1.00 0.00 H new ATOM 0 HB3 LEU A 110 2.688 13.761 8.551 1.00 0.00 H new ATOM 0 HG LEU A 110 1.526 14.179 6.419 1.00 0.00 H new ATOM 0 HD11 LEU A 110 2.325 13.118 4.334 1.00 0.00 H new ATOM 0 HD12 LEU A 110 3.522 14.273 4.966 1.00 0.00 H new ATOM 0 HD13 LEU A 110 3.769 12.525 5.188 1.00 0.00 H new ATOM 0 HD21 LEU A 110 0.880 11.827 5.903 1.00 0.00 H new ATOM 0 HD22 LEU A 110 2.322 11.244 6.767 1.00 0.00 H new ATOM 0 HD23 LEU A 110 1.027 12.076 7.659 1.00 0.00 H new ATOM 1728 N ARG A 111 5.209 15.475 9.384 1.00 0.00 N ATOM 1729 CA ARG A 111 5.445 16.224 10.608 1.00 0.00 C ATOM 1730 C ARG A 111 5.449 17.700 10.265 1.00 0.00 C ATOM 1731 O ARG A 111 4.897 18.525 10.992 1.00 0.00 O ATOM 1732 CB ARG A 111 6.784 15.830 11.238 1.00 0.00 C ATOM 1733 CG ARG A 111 6.854 16.371 12.671 1.00 0.00 C ATOM 1734 CD ARG A 111 7.546 15.350 13.576 1.00 0.00 C ATOM 1735 NE ARG A 111 7.335 15.697 14.976 1.00 0.00 N ATOM 1736 CZ ARG A 111 7.743 14.893 15.952 1.00 0.00 C ATOM 1737 NH1 ARG A 111 8.343 13.771 15.663 1.00 0.00 N ATOM 1738 NH2 ARG A 111 7.542 15.225 17.198 1.00 0.00 N ATOM 0 H ARG A 111 5.897 14.749 9.183 1.00 0.00 H new ATOM 0 HA ARG A 111 4.659 16.002 11.330 1.00 0.00 H new ATOM 0 HB2 ARG A 111 6.891 14.745 11.242 1.00 0.00 H new ATOM 0 HB3 ARG A 111 7.608 16.229 10.647 1.00 0.00 H new ATOM 0 HG2 ARG A 111 7.400 17.314 12.687 1.00 0.00 H new ATOM 0 HG3 ARG A 111 5.850 16.577 13.041 1.00 0.00 H new ATOM 0 HD2 ARG A 111 7.154 14.352 13.378 1.00 0.00 H new ATOM 0 HD3 ARG A 111 8.613 15.323 13.357 1.00 0.00 H new ATOM 0 HE ARG A 111 6.866 16.572 15.210 1.00 0.00 H new ATOM 0 HH11 ARG A 111 8.498 13.512 14.689 1.00 0.00 H new ATOM 0 HH12 ARG A 111 8.657 13.153 16.411 1.00 0.00 H new ATOM 0 HH21 ARG A 111 7.072 16.102 17.423 1.00 0.00 H new ATOM 0 HH22 ARG A 111 7.855 14.608 17.947 1.00 0.00 H new ATOM 1752 N LEU A 112 6.046 18.019 9.120 1.00 0.00 N ATOM 1753 CA LEU A 112 6.078 19.396 8.659 1.00 0.00 C ATOM 1754 C LEU A 112 4.644 19.850 8.421 1.00 0.00 C ATOM 1755 O LEU A 112 4.281 20.990 8.709 1.00 0.00 O ATOM 1756 CB LEU A 112 6.887 19.508 7.364 1.00 0.00 C ATOM 1757 CG LEU A 112 8.089 20.427 7.589 1.00 0.00 C ATOM 1758 CD1 LEU A 112 9.091 20.249 6.446 1.00 0.00 C ATOM 1759 CD2 LEU A 112 7.616 21.882 7.627 1.00 0.00 C ATOM 0 H LEU A 112 6.508 17.350 8.504 1.00 0.00 H new ATOM 0 HA LEU A 112 6.555 20.028 9.409 1.00 0.00 H new ATOM 0 HB2 LEU A 112 7.225 18.521 7.048 1.00 0.00 H new ATOM 0 HB3 LEU A 112 6.260 19.902 6.564 1.00 0.00 H new ATOM 0 HG LEU A 112 8.568 20.173 8.535 1.00 0.00 H new ATOM 0 HD11 LEU A 112 9.947 20.904 6.607 1.00 0.00 H new ATOM 0 HD12 LEU A 112 9.428 19.213 6.415 1.00 0.00 H new ATOM 0 HD13 LEU A 112 8.613 20.503 5.500 1.00 0.00 H new ATOM 0 HD21 LEU A 112 8.471 22.539 7.787 1.00 0.00 H new ATOM 0 HD22 LEU A 112 7.138 22.134 6.681 1.00 0.00 H new ATOM 0 HD23 LEU A 112 6.902 22.011 8.440 1.00 0.00 H new ATOM 1771 N TYR A 113 3.829 18.921 7.919 1.00 0.00 N ATOM 1772 CA TYR A 113 2.412 19.198 7.672 1.00 0.00 C ATOM 1773 C TYR A 113 1.553 18.245 8.507 1.00 0.00 C ATOM 1774 O TYR A 113 1.113 17.202 8.025 1.00 0.00 O ATOM 1775 CB TYR A 113 2.090 19.027 6.186 1.00 0.00 C ATOM 1776 CG TYR A 113 2.848 20.058 5.386 1.00 0.00 C ATOM 1777 CD1 TYR A 113 4.157 19.795 4.966 1.00 0.00 C ATOM 1778 CD2 TYR A 113 2.241 21.278 5.064 1.00 0.00 C ATOM 1779 CE1 TYR A 113 4.860 20.752 4.224 1.00 0.00 C ATOM 1780 CE2 TYR A 113 2.944 22.235 4.322 1.00 0.00 C ATOM 1781 CZ TYR A 113 4.253 21.972 3.902 1.00 0.00 C ATOM 1782 OH TYR A 113 4.947 22.916 3.171 1.00 0.00 O ATOM 0 H TYR A 113 4.123 17.975 7.676 1.00 0.00 H new ATOM 0 HA TYR A 113 2.194 20.227 7.958 1.00 0.00 H new ATOM 0 HB2 TYR A 113 2.362 18.024 5.857 1.00 0.00 H new ATOM 0 HB3 TYR A 113 1.018 19.138 6.020 1.00 0.00 H new ATOM 0 HD1 TYR A 113 4.625 18.854 5.214 1.00 0.00 H new ATOM 0 HD2 TYR A 113 1.231 21.481 5.388 1.00 0.00 H new ATOM 0 HE1 TYR A 113 5.870 20.549 3.900 1.00 0.00 H new ATOM 0 HE2 TYR A 113 2.476 23.176 4.074 1.00 0.00 H new ATOM 0 HH TYR A 113 5.906 22.835 3.358 1.00 0.00 H new ATOM 1792 N PRO A 114 1.348 18.575 9.758 1.00 0.00 N ATOM 1793 CA PRO A 114 0.569 17.731 10.721 1.00 0.00 C ATOM 1794 C PRO A 114 -0.924 17.612 10.398 1.00 0.00 C ATOM 1795 O PRO A 114 -1.511 16.546 10.581 1.00 0.00 O ATOM 1796 CB PRO A 114 0.766 18.428 12.077 1.00 0.00 C ATOM 1797 CG PRO A 114 1.850 19.438 11.877 1.00 0.00 C ATOM 1798 CD PRO A 114 1.842 19.796 10.396 1.00 0.00 C ATOM 0 HA PRO A 114 0.927 16.702 10.689 1.00 0.00 H new ATOM 0 HB2 PRO A 114 -0.156 18.907 12.405 1.00 0.00 H new ATOM 0 HB3 PRO A 114 1.043 17.708 12.847 1.00 0.00 H new ATOM 0 HG2 PRO A 114 1.674 20.322 12.490 1.00 0.00 H new ATOM 0 HG3 PRO A 114 2.817 19.032 12.172 1.00 0.00 H new ATOM 0 HD2 PRO A 114 1.193 20.648 10.191 1.00 0.00 H new ATOM 0 HD3 PRO A 114 2.838 20.061 10.041 1.00 0.00 H new ATOM 1806 N GLU A 115 -1.543 18.696 9.943 1.00 0.00 N ATOM 1807 CA GLU A 115 -2.973 18.656 9.637 1.00 0.00 C ATOM 1808 C GLU A 115 -3.228 17.771 8.428 1.00 0.00 C ATOM 1809 O GLU A 115 -4.048 16.849 8.470 1.00 0.00 O ATOM 1810 CB GLU A 115 -3.487 20.068 9.358 1.00 0.00 C ATOM 1811 CG GLU A 115 -3.708 20.803 10.682 1.00 0.00 C ATOM 1812 CD GLU A 115 -4.551 22.053 10.451 1.00 0.00 C ATOM 1813 OE1 GLU A 115 -4.906 22.302 9.310 1.00 0.00 O ATOM 1814 OE2 GLU A 115 -4.828 22.744 11.417 1.00 0.00 O ATOM 0 H GLU A 115 -1.091 19.596 9.780 1.00 0.00 H new ATOM 0 HA GLU A 115 -3.502 18.244 10.496 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -2.770 20.612 8.743 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -4.419 20.022 8.795 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -4.206 20.145 11.394 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -2.748 21.078 11.120 1.00 0.00 H new ATOM 1821 N TYR A 116 -2.499 18.043 7.361 1.00 0.00 N ATOM 1822 CA TYR A 116 -2.628 17.261 6.148 1.00 0.00 C ATOM 1823 C TYR A 116 -2.227 15.820 6.430 1.00 0.00 C ATOM 1824 O TYR A 116 -2.755 14.885 5.832 1.00 0.00 O ATOM 1825 CB TYR A 116 -1.730 17.846 5.060 1.00 0.00 C ATOM 1826 CG TYR A 116 -2.307 19.156 4.582 1.00 0.00 C ATOM 1827 CD1 TYR A 116 -3.506 19.170 3.858 1.00 0.00 C ATOM 1828 CD2 TYR A 116 -1.646 20.357 4.863 1.00 0.00 C ATOM 1829 CE1 TYR A 116 -4.041 20.386 3.414 1.00 0.00 C ATOM 1830 CE2 TYR A 116 -2.180 21.573 4.420 1.00 0.00 C ATOM 1831 CZ TYR A 116 -3.379 21.587 3.695 1.00 0.00 C ATOM 1832 OH TYR A 116 -3.906 22.784 3.258 1.00 0.00 O ATOM 0 H TYR A 116 -1.814 18.797 7.311 1.00 0.00 H new ATOM 0 HA TYR A 116 -3.663 17.287 5.807 1.00 0.00 H new ATOM 0 HB2 TYR A 116 -0.723 18.000 5.448 1.00 0.00 H new ATOM 0 HB3 TYR A 116 -1.647 17.147 4.227 1.00 0.00 H new ATOM 0 HD1 TYR A 116 -4.018 18.244 3.642 1.00 0.00 H new ATOM 0 HD2 TYR A 116 -0.722 20.346 5.423 1.00 0.00 H new ATOM 0 HE1 TYR A 116 -4.965 20.397 2.855 1.00 0.00 H new ATOM 0 HE2 TYR A 116 -1.668 22.499 4.637 1.00 0.00 H new ATOM 0 HH TYR A 116 -3.323 23.520 3.538 1.00 0.00 H new ATOM 1842 N ALA A 117 -1.273 15.663 7.339 1.00 0.00 N ATOM 1843 CA ALA A 117 -0.769 14.346 7.705 1.00 0.00 C ATOM 1844 C ALA A 117 -1.866 13.446 8.234 1.00 0.00 C ATOM 1845 O ALA A 117 -2.123 12.381 7.673 1.00 0.00 O ATOM 1846 CB ALA A 117 0.320 14.499 8.759 1.00 0.00 C ATOM 0 H ALA A 117 -0.831 16.435 7.838 1.00 0.00 H new ATOM 0 HA ALA A 117 -0.365 13.880 6.807 1.00 0.00 H new ATOM 0 HB1 ALA A 117 0.700 13.515 9.035 1.00 0.00 H new ATOM 0 HB2 ALA A 117 1.134 15.102 8.356 1.00 0.00 H new ATOM 0 HB3 ALA A 117 -0.093 14.989 9.640 1.00 0.00 H new ATOM 1852 N GLN A 118 -2.525 13.867 9.296 1.00 0.00 N ATOM 1853 CA GLN A 118 -3.593 13.059 9.834 1.00 0.00 C ATOM 1854 C GLN A 118 -4.519 12.728 8.682 1.00 0.00 C ATOM 1855 O GLN A 118 -5.158 11.677 8.643 1.00 0.00 O ATOM 1856 CB GLN A 118 -4.337 13.838 10.914 1.00 0.00 C ATOM 1857 CG GLN A 118 -3.363 14.238 12.022 1.00 0.00 C ATOM 1858 CD GLN A 118 -2.490 13.048 12.408 1.00 0.00 C ATOM 1859 OE1 GLN A 118 -1.479 12.720 11.652 1.00 0.00 O flip ATOM 1860 NE2 GLN A 118 -2.737 12.401 13.425 1.00 0.00 N flip ATOM 0 H GLN A 118 -2.344 14.741 9.790 1.00 0.00 H new ATOM 0 HA GLN A 118 -3.208 12.146 10.290 1.00 0.00 H new ATOM 0 HB2 GLN A 118 -4.798 14.727 10.483 1.00 0.00 H new ATOM 0 HB3 GLN A 118 -5.142 13.229 11.326 1.00 0.00 H new ATOM 0 HG2 GLN A 118 -2.737 15.064 11.685 1.00 0.00 H new ATOM 0 HG3 GLN A 118 -3.916 14.591 12.893 1.00 0.00 H new ATOM 0 HE21 GLN A 118 -3.528 12.660 14.014 1.00 0.00 H new ATOM 0 HE22 GLN A 118 -2.150 11.606 13.679 1.00 0.00 H new ATOM 1869 N LYS A 119 -4.542 13.646 7.725 1.00 0.00 N ATOM 1870 CA LYS A 119 -5.339 13.494 6.521 1.00 0.00 C ATOM 1871 C LYS A 119 -4.721 12.466 5.565 1.00 0.00 C ATOM 1872 O LYS A 119 -5.427 11.882 4.744 1.00 0.00 O ATOM 1873 CB LYS A 119 -5.452 14.843 5.807 1.00 0.00 C ATOM 1874 CG LYS A 119 -6.907 15.096 5.410 1.00 0.00 C ATOM 1875 CD LYS A 119 -6.990 16.377 4.577 1.00 0.00 C ATOM 1876 CE LYS A 119 -8.239 17.165 4.974 1.00 0.00 C ATOM 1877 NZ LYS A 119 -8.298 18.431 4.188 1.00 0.00 N ATOM 0 H LYS A 119 -4.009 14.515 7.764 1.00 0.00 H new ATOM 0 HA LYS A 119 -6.327 13.139 6.814 1.00 0.00 H new ATOM 0 HB2 LYS A 119 -5.099 15.641 6.460 1.00 0.00 H new ATOM 0 HB3 LYS A 119 -4.817 14.851 4.921 1.00 0.00 H new ATOM 0 HG2 LYS A 119 -7.292 14.252 4.838 1.00 0.00 H new ATOM 0 HG3 LYS A 119 -7.528 15.187 6.301 1.00 0.00 H new ATOM 0 HD2 LYS A 119 -6.099 16.984 4.735 1.00 0.00 H new ATOM 0 HD3 LYS A 119 -7.024 16.131 3.516 1.00 0.00 H new ATOM 0 HE2 LYS A 119 -9.132 16.568 4.790 1.00 0.00 H new ATOM 0 HE3 LYS A 119 -8.218 17.387 6.041 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 -9.147 18.968 4.457 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 -7.451 19.002 4.385 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 -8.337 18.208 3.173 1.00 0.00 H new ATOM 1891 N PHE A 120 -3.395 12.271 5.638 1.00 0.00 N ATOM 1892 CA PHE A 120 -2.727 11.343 4.730 1.00 0.00 C ATOM 1893 C PHE A 120 -3.376 9.966 4.750 1.00 0.00 C ATOM 1894 O PHE A 120 -3.749 9.430 3.705 1.00 0.00 O ATOM 1895 CB PHE A 120 -1.264 11.209 5.134 1.00 0.00 C ATOM 1896 CG PHE A 120 -0.382 11.253 3.909 1.00 0.00 C ATOM 1897 CD1 PHE A 120 -0.305 10.145 3.056 1.00 0.00 C ATOM 1898 CD2 PHE A 120 0.385 12.394 3.645 1.00 0.00 C ATOM 1899 CE1 PHE A 120 0.543 10.180 1.943 1.00 0.00 C ATOM 1900 CE2 PHE A 120 1.225 12.429 2.527 1.00 0.00 C ATOM 1901 CZ PHE A 120 1.303 11.322 1.678 1.00 0.00 C ATOM 0 H PHE A 120 -2.779 12.736 6.305 1.00 0.00 H new ATOM 0 HA PHE A 120 -2.813 11.743 3.720 1.00 0.00 H new ATOM 0 HB2 PHE A 120 -0.992 12.014 5.817 1.00 0.00 H new ATOM 0 HB3 PHE A 120 -1.111 10.272 5.669 1.00 0.00 H new ATOM 0 HD1 PHE A 120 -0.899 9.265 3.257 1.00 0.00 H new ATOM 0 HD2 PHE A 120 0.328 13.247 4.305 1.00 0.00 H new ATOM 0 HE1 PHE A 120 0.610 9.324 1.289 1.00 0.00 H new ATOM 0 HE2 PHE A 120 1.813 13.311 2.320 1.00 0.00 H new ATOM 0 HZ PHE A 120 1.952 11.349 0.815 1.00 0.00 H new ATOM 1911 N VAL A 121 -3.486 9.390 5.935 1.00 0.00 N ATOM 1912 CA VAL A 121 -4.060 8.069 6.079 1.00 0.00 C ATOM 1913 C VAL A 121 -5.488 8.014 5.545 1.00 0.00 C ATOM 1914 O VAL A 121 -5.888 7.031 4.925 1.00 0.00 O ATOM 1915 CB VAL A 121 -4.053 7.678 7.556 1.00 0.00 C ATOM 1916 CG1 VAL A 121 -4.264 6.172 7.689 1.00 0.00 C ATOM 1917 CG2 VAL A 121 -2.709 8.065 8.174 1.00 0.00 C ATOM 0 H VAL A 121 -3.184 9.819 6.810 1.00 0.00 H new ATOM 0 HA VAL A 121 -3.458 7.371 5.497 1.00 0.00 H new ATOM 0 HB VAL A 121 -4.857 8.200 8.075 1.00 0.00 H new ATOM 0 HG11 VAL A 121 -4.259 5.896 8.743 1.00 0.00 H new ATOM 0 HG12 VAL A 121 -5.222 5.898 7.247 1.00 0.00 H new ATOM 0 HG13 VAL A 121 -3.462 5.645 7.172 1.00 0.00 H new ATOM 0 HG21 VAL A 121 -2.700 7.788 9.228 1.00 0.00 H new ATOM 0 HG22 VAL A 121 -1.906 7.543 7.654 1.00 0.00 H new ATOM 0 HG23 VAL A 121 -2.562 9.141 8.081 1.00 0.00 H new ATOM 1927 N SER A 122 -6.257 9.065 5.798 1.00 0.00 N ATOM 1928 CA SER A 122 -7.645 9.106 5.349 1.00 0.00 C ATOM 1929 C SER A 122 -7.756 8.730 3.874 1.00 0.00 C ATOM 1930 O SER A 122 -8.741 8.124 3.454 1.00 0.00 O ATOM 1931 CB SER A 122 -8.218 10.507 5.560 1.00 0.00 C ATOM 1932 OG SER A 122 -9.592 10.513 5.199 1.00 0.00 O ATOM 0 H SER A 122 -5.949 9.894 6.307 1.00 0.00 H new ATOM 0 HA SER A 122 -8.212 8.383 5.935 1.00 0.00 H new ATOM 0 HB2 SER A 122 -8.103 10.806 6.602 1.00 0.00 H new ATOM 0 HB3 SER A 122 -7.669 11.231 4.958 1.00 0.00 H new ATOM 0 HG SER A 122 -9.962 11.410 5.335 1.00 0.00 H new ATOM 1938 N GLU A 123 -6.750 9.096 3.092 1.00 0.00 N ATOM 1939 CA GLU A 123 -6.757 8.792 1.665 1.00 0.00 C ATOM 1940 C GLU A 123 -6.137 7.423 1.374 1.00 0.00 C ATOM 1941 O GLU A 123 -6.561 6.725 0.454 1.00 0.00 O ATOM 1942 CB GLU A 123 -5.988 9.873 0.903 1.00 0.00 C ATOM 1943 CG GLU A 123 -6.975 10.790 0.176 1.00 0.00 C ATOM 1944 CD GLU A 123 -7.996 11.342 1.164 1.00 0.00 C ATOM 1945 OE1 GLU A 123 -9.003 10.687 1.374 1.00 0.00 O ATOM 1946 OE2 GLU A 123 -7.756 12.414 1.697 1.00 0.00 O ATOM 0 H GLU A 123 -5.924 9.600 3.416 1.00 0.00 H new ATOM 0 HA GLU A 123 -7.796 8.769 1.335 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -5.377 10.454 1.594 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -5.308 9.413 0.186 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -6.439 11.610 -0.302 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -7.483 10.238 -0.615 1.00 0.00 H new ATOM 1953 N ILE A 124 -5.108 7.061 2.138 1.00 0.00 N ATOM 1954 CA ILE A 124 -4.411 5.795 1.926 1.00 0.00 C ATOM 1955 C ILE A 124 -5.328 4.572 2.057 1.00 0.00 C ATOM 1956 O ILE A 124 -5.286 3.680 1.210 1.00 0.00 O ATOM 1957 CB ILE A 124 -3.231 5.688 2.899 1.00 0.00 C ATOM 1958 CG1 ILE A 124 -2.058 5.027 2.175 1.00 0.00 C ATOM 1959 CG2 ILE A 124 -3.614 4.862 4.131 1.00 0.00 C ATOM 1960 CD1 ILE A 124 -1.193 4.267 3.179 1.00 0.00 C ATOM 0 H ILE A 124 -4.740 7.623 2.905 1.00 0.00 H new ATOM 0 HA ILE A 124 -4.048 5.795 0.898 1.00 0.00 H new ATOM 0 HB ILE A 124 -2.952 6.686 3.236 1.00 0.00 H new ATOM 0 HG12 ILE A 124 -2.429 4.344 1.410 1.00 0.00 H new ATOM 0 HG13 ILE A 124 -1.461 5.783 1.665 1.00 0.00 H new ATOM 0 HG21 ILE A 124 -2.761 4.800 4.807 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -4.449 5.339 4.644 1.00 0.00 H new ATOM 0 HG23 ILE A 124 -3.905 3.858 3.820 1.00 0.00 H new ATOM 0 HD11 ILE A 124 -0.358 3.798 2.658 1.00 0.00 H new ATOM 0 HD12 ILE A 124 -0.810 4.961 3.928 1.00 0.00 H new ATOM 0 HD13 ILE A 124 -1.793 3.500 3.669 1.00 0.00 H new ATOM 1972 N GLN A 125 -6.140 4.513 3.110 1.00 0.00 N ATOM 1973 CA GLN A 125 -7.026 3.362 3.298 1.00 0.00 C ATOM 1974 C GLN A 125 -8.093 3.305 2.208 1.00 0.00 C ATOM 1975 O GLN A 125 -8.425 2.229 1.712 1.00 0.00 O ATOM 1976 CB GLN A 125 -7.702 3.411 4.669 1.00 0.00 C ATOM 1977 CG GLN A 125 -7.581 4.810 5.247 1.00 0.00 C ATOM 1978 CD GLN A 125 -8.139 5.831 4.264 1.00 0.00 C ATOM 1979 OE1 GLN A 125 -7.405 6.352 3.425 1.00 0.00 O ATOM 1980 NE2 GLN A 125 -9.405 6.144 4.313 1.00 0.00 N ATOM 0 H GLN A 125 -6.205 5.230 3.833 1.00 0.00 H new ATOM 0 HA GLN A 125 -6.410 2.465 3.236 1.00 0.00 H new ATOM 0 HB2 GLN A 125 -8.752 3.134 4.578 1.00 0.00 H new ATOM 0 HB3 GLN A 125 -7.239 2.688 5.340 1.00 0.00 H new ATOM 0 HG2 GLN A 125 -8.121 4.870 6.192 1.00 0.00 H new ATOM 0 HG3 GLN A 125 -6.536 5.034 5.463 1.00 0.00 H new ATOM 0 HE21 GLN A 125 -10.011 5.710 5.010 1.00 0.00 H new ATOM 0 HE22 GLN A 125 -9.789 6.822 3.655 1.00 0.00 H new ATOM 1989 N HIS A 126 -8.632 4.462 1.846 1.00 0.00 N ATOM 1990 CA HIS A 126 -9.663 4.523 0.820 1.00 0.00 C ATOM 1991 C HIS A 126 -9.136 4.003 -0.515 1.00 0.00 C ATOM 1992 O HIS A 126 -9.908 3.752 -1.441 1.00 0.00 O ATOM 1993 CB HIS A 126 -10.145 5.964 0.655 1.00 0.00 C ATOM 1994 CG HIS A 126 -11.101 6.302 1.766 1.00 0.00 C ATOM 1995 ND1 HIS A 126 -11.476 5.373 2.725 1.00 0.00 N ATOM 1996 CD2 HIS A 126 -11.768 7.459 2.084 1.00 0.00 C ATOM 1997 CE1 HIS A 126 -12.332 5.983 3.566 1.00 0.00 C ATOM 1998 NE2 HIS A 126 -12.544 7.255 3.220 1.00 0.00 N ATOM 0 H HIS A 126 -8.374 5.365 2.245 1.00 0.00 H new ATOM 0 HA HIS A 126 -10.495 3.892 1.133 1.00 0.00 H new ATOM 0 HB2 HIS A 126 -9.296 6.647 0.671 1.00 0.00 H new ATOM 0 HB3 HIS A 126 -10.635 6.087 -0.311 1.00 0.00 H new ATOM 0 HD2 HIS A 126 -11.700 8.387 1.535 1.00 0.00 H new ATOM 0 HE1 HIS A 126 -12.791 5.502 4.417 1.00 0.00 H new ATOM 0 HE2 HIS A 126 -13.146 7.932 3.688 1.00 0.00 H new ATOM 2007 N ASP A 127 -7.820 3.847 -0.611 1.00 0.00 N ATOM 2008 CA ASP A 127 -7.209 3.359 -1.843 1.00 0.00 C ATOM 2009 C ASP A 127 -6.443 2.062 -1.593 1.00 0.00 C ATOM 2010 O ASP A 127 -5.685 1.605 -2.450 1.00 0.00 O ATOM 2011 CB ASP A 127 -6.257 4.417 -2.408 1.00 0.00 C ATOM 2012 CG ASP A 127 -6.611 4.718 -3.861 1.00 0.00 C ATOM 2013 OD1 ASP A 127 -7.790 4.847 -4.147 1.00 0.00 O ATOM 2014 OD2 ASP A 127 -5.698 4.815 -4.664 1.00 0.00 O ATOM 0 H ASP A 127 -7.161 4.049 0.141 1.00 0.00 H new ATOM 0 HA ASP A 127 -8.003 3.161 -2.563 1.00 0.00 H new ATOM 0 HB2 ASP A 127 -6.320 5.329 -1.814 1.00 0.00 H new ATOM 0 HB3 ASP A 127 -5.228 4.064 -2.342 1.00 0.00 H new ATOM 2019 N LEU A 128 -6.638 1.475 -0.418 1.00 0.00 N ATOM 2020 CA LEU A 128 -5.955 0.233 -0.072 1.00 0.00 C ATOM 2021 C LEU A 128 -6.519 -0.942 -0.869 1.00 0.00 C ATOM 2022 O LEU A 128 -7.733 -1.133 -0.934 1.00 0.00 O ATOM 2023 CB LEU A 128 -6.111 -0.045 1.425 1.00 0.00 C ATOM 2024 CG LEU A 128 -5.334 -1.312 1.795 1.00 0.00 C ATOM 2025 CD1 LEU A 128 -4.410 -1.017 2.978 1.00 0.00 C ATOM 2026 CD2 LEU A 128 -6.318 -2.418 2.183 1.00 0.00 C ATOM 0 H LEU A 128 -7.259 1.835 0.307 1.00 0.00 H new ATOM 0 HA LEU A 128 -4.899 0.345 -0.318 1.00 0.00 H new ATOM 0 HB2 LEU A 128 -5.742 0.802 2.003 1.00 0.00 H new ATOM 0 HB3 LEU A 128 -7.165 -0.166 1.675 1.00 0.00 H new ATOM 0 HG LEU A 128 -4.740 -1.636 0.941 1.00 0.00 H new ATOM 0 HD11 LEU A 128 -3.857 -1.919 3.241 1.00 0.00 H new ATOM 0 HD12 LEU A 128 -3.709 -0.228 2.704 1.00 0.00 H new ATOM 0 HD13 LEU A 128 -5.005 -0.694 3.832 1.00 0.00 H new ATOM 0 HD21 LEU A 128 -5.766 -3.320 2.446 1.00 0.00 H new ATOM 0 HD22 LEU A 128 -6.912 -2.093 3.037 1.00 0.00 H new ATOM 0 HD23 LEU A 128 -6.978 -2.629 1.342 1.00 0.00 H new ATOM 2038 N THR A 129 -5.629 -1.728 -1.470 1.00 0.00 N ATOM 2039 CA THR A 129 -6.051 -2.884 -2.255 1.00 0.00 C ATOM 2040 C THR A 129 -5.848 -4.171 -1.460 1.00 0.00 C ATOM 2041 O THR A 129 -6.757 -4.995 -1.355 1.00 0.00 O ATOM 2042 CB THR A 129 -5.255 -2.956 -3.560 1.00 0.00 C ATOM 2043 OG1 THR A 129 -5.244 -1.674 -4.176 1.00 0.00 O ATOM 2044 CG2 THR A 129 -5.901 -3.973 -4.502 1.00 0.00 C ATOM 0 H THR A 129 -4.620 -1.587 -1.429 1.00 0.00 H new ATOM 0 HA THR A 129 -7.110 -2.773 -2.486 1.00 0.00 H new ATOM 0 HB THR A 129 -4.232 -3.266 -3.345 1.00 0.00 H new ATOM 0 HG1 THR A 129 -4.501 -1.624 -4.813 1.00 0.00 H new ATOM 0 HG21 THR A 129 -5.332 -4.022 -5.430 1.00 0.00 H new ATOM 0 HG22 THR A 129 -5.908 -4.955 -4.028 1.00 0.00 H new ATOM 0 HG23 THR A 129 -6.925 -3.668 -4.720 1.00 0.00 H new ATOM 2052 N TYR A 130 -4.654 -4.335 -0.894 1.00 0.00 N ATOM 2053 CA TYR A 130 -4.356 -5.523 -0.104 1.00 0.00 C ATOM 2054 C TYR A 130 -3.685 -5.117 1.197 1.00 0.00 C ATOM 2055 O TYR A 130 -2.584 -4.566 1.202 1.00 0.00 O ATOM 2056 CB TYR A 130 -3.465 -6.465 -0.927 1.00 0.00 C ATOM 2057 CG TYR A 130 -2.308 -7.033 -0.124 1.00 0.00 C ATOM 2058 CD1 TYR A 130 -2.514 -7.714 1.091 1.00 0.00 C ATOM 2059 CD2 TYR A 130 -1.011 -6.913 -0.639 1.00 0.00 C ATOM 2060 CE1 TYR A 130 -1.422 -8.262 1.775 1.00 0.00 C ATOM 2061 CE2 TYR A 130 0.075 -7.457 0.052 1.00 0.00 C ATOM 2062 CZ TYR A 130 -0.130 -8.133 1.256 1.00 0.00 C ATOM 2063 OH TYR A 130 0.942 -8.676 1.933 1.00 0.00 O ATOM 0 H TYR A 130 -3.886 -3.667 -0.967 1.00 0.00 H new ATOM 0 HA TYR A 130 -5.276 -6.051 0.145 1.00 0.00 H new ATOM 0 HB2 TYR A 130 -4.070 -7.285 -1.313 1.00 0.00 H new ATOM 0 HB3 TYR A 130 -3.073 -5.925 -1.789 1.00 0.00 H new ATOM 0 HD1 TYR A 130 -3.511 -7.813 1.494 1.00 0.00 H new ATOM 0 HD2 TYR A 130 -0.850 -6.398 -1.574 1.00 0.00 H new ATOM 0 HE1 TYR A 130 -1.578 -8.786 2.706 1.00 0.00 H new ATOM 0 HE2 TYR A 130 1.074 -7.354 -0.346 1.00 0.00 H new ATOM 0 HH TYR A 130 1.715 -8.728 1.333 1.00 0.00 H new ATOM 2073 N ASN A 131 -4.374 -5.384 2.298 1.00 0.00 N ATOM 2074 CA ASN A 131 -3.865 -5.036 3.614 1.00 0.00 C ATOM 2075 C ASN A 131 -3.153 -6.228 4.226 1.00 0.00 C ATOM 2076 O ASN A 131 -3.765 -7.266 4.475 1.00 0.00 O ATOM 2077 CB ASN A 131 -5.024 -4.592 4.516 1.00 0.00 C ATOM 2078 CG ASN A 131 -4.779 -5.022 5.960 1.00 0.00 C ATOM 2079 OD1 ASN A 131 -4.590 -6.206 6.234 1.00 0.00 O ATOM 2080 ND2 ASN A 131 -4.775 -4.123 6.907 1.00 0.00 N ATOM 0 H ASN A 131 -5.286 -5.840 2.304 1.00 0.00 H new ATOM 0 HA ASN A 131 -3.155 -4.215 3.518 1.00 0.00 H new ATOM 0 HB2 ASN A 131 -5.135 -3.509 4.468 1.00 0.00 H new ATOM 0 HB3 ASN A 131 -5.958 -5.024 4.156 1.00 0.00 H new ATOM 0 HD21 ASN A 131 -4.615 -4.402 7.875 1.00 0.00 H new ATOM 0 HD22 ASN A 131 -4.932 -3.141 6.679 1.00 0.00 H new ATOM 2087 N LEU A 132 -1.857 -6.085 4.461 1.00 0.00 N ATOM 2088 CA LEU A 132 -1.097 -7.175 5.038 1.00 0.00 C ATOM 2089 C LEU A 132 -1.101 -7.057 6.561 1.00 0.00 C ATOM 2090 O LEU A 132 -0.559 -6.106 7.123 1.00 0.00 O ATOM 2091 CB LEU A 132 0.343 -7.133 4.502 1.00 0.00 C ATOM 2092 CG LEU A 132 1.182 -8.313 5.023 1.00 0.00 C ATOM 2093 CD1 LEU A 132 1.848 -7.930 6.345 1.00 0.00 C ATOM 2094 CD2 LEU A 132 0.307 -9.552 5.235 1.00 0.00 C ATOM 0 H LEU A 132 -1.321 -5.240 4.264 1.00 0.00 H new ATOM 0 HA LEU A 132 -1.552 -8.126 4.761 1.00 0.00 H new ATOM 0 HB2 LEU A 132 0.326 -7.153 3.412 1.00 0.00 H new ATOM 0 HB3 LEU A 132 0.813 -6.195 4.797 1.00 0.00 H new ATOM 0 HG LEU A 132 1.944 -8.546 4.279 1.00 0.00 H new ATOM 0 HD11 LEU A 132 2.441 -8.769 6.710 1.00 0.00 H new ATOM 0 HD12 LEU A 132 2.496 -7.068 6.189 1.00 0.00 H new ATOM 0 HD13 LEU A 132 1.082 -7.680 7.079 1.00 0.00 H new ATOM 0 HD21 LEU A 132 0.922 -10.373 5.603 1.00 0.00 H new ATOM 0 HD22 LEU A 132 -0.472 -9.327 5.963 1.00 0.00 H new ATOM 0 HD23 LEU A 132 -0.153 -9.839 4.289 1.00 0.00 H new ATOM 2106 N ARG A 133 -1.726 -8.026 7.220 1.00 0.00 N ATOM 2107 CA ARG A 133 -1.806 -8.028 8.676 1.00 0.00 C ATOM 2108 C ARG A 133 -0.844 -9.051 9.269 1.00 0.00 C ATOM 2109 O ARG A 133 -0.513 -10.050 8.631 1.00 0.00 O ATOM 2110 CB ARG A 133 -3.234 -8.350 9.123 1.00 0.00 C ATOM 2111 CG ARG A 133 -4.011 -7.048 9.327 1.00 0.00 C ATOM 2112 CD ARG A 133 -5.339 -7.349 10.021 1.00 0.00 C ATOM 2113 NE ARG A 133 -5.111 -8.115 11.241 1.00 0.00 N ATOM 2114 CZ ARG A 133 -6.032 -8.951 11.710 1.00 0.00 C ATOM 2115 NH1 ARG A 133 -7.161 -9.103 11.073 1.00 0.00 N ATOM 2116 NH2 ARG A 133 -5.807 -9.621 12.809 1.00 0.00 N ATOM 0 H ARG A 133 -2.184 -8.819 6.770 1.00 0.00 H new ATOM 0 HA ARG A 133 -1.528 -7.037 9.034 1.00 0.00 H new ATOM 0 HB2 ARG A 133 -3.730 -8.968 8.375 1.00 0.00 H new ATOM 0 HB3 ARG A 133 -3.216 -8.924 10.049 1.00 0.00 H new ATOM 0 HG2 ARG A 133 -3.424 -6.353 9.927 1.00 0.00 H new ATOM 0 HG3 ARG A 133 -4.192 -6.566 8.366 1.00 0.00 H new ATOM 0 HD2 ARG A 133 -5.852 -6.417 10.259 1.00 0.00 H new ATOM 0 HD3 ARG A 133 -5.990 -7.908 9.349 1.00 0.00 H new ATOM 0 HE ARG A 133 -4.230 -8.007 11.743 1.00 0.00 H new ATOM 0 HH11 ARG A 133 -7.337 -8.580 10.215 1.00 0.00 H new ATOM 0 HH12 ARG A 133 -7.867 -9.745 11.433 1.00 0.00 H new ATOM 0 HH21 ARG A 133 -4.925 -9.503 13.307 1.00 0.00 H new ATOM 0 HH22 ARG A 133 -6.514 -10.262 13.169 1.00 0.00 H new ATOM 2130 N GLU A 134 -0.407 -8.802 10.499 1.00 0.00 N ATOM 2131 CA GLU A 134 0.509 -9.717 11.172 1.00 0.00 C ATOM 2132 C GLU A 134 -0.127 -11.097 11.312 1.00 0.00 C ATOM 2133 O GLU A 134 -1.346 -11.221 11.428 1.00 0.00 O ATOM 2134 CB GLU A 134 0.863 -9.175 12.557 1.00 0.00 C ATOM 2135 CG GLU A 134 -0.378 -9.213 13.453 1.00 0.00 C ATOM 2136 CD GLU A 134 -0.255 -10.343 14.468 1.00 0.00 C ATOM 2137 OE1 GLU A 134 -0.421 -11.487 14.075 1.00 0.00 O ATOM 2138 OE2 GLU A 134 0.002 -10.050 15.625 1.00 0.00 O ATOM 0 H GLU A 134 -0.669 -7.982 11.046 1.00 0.00 H new ATOM 0 HA GLU A 134 1.416 -9.803 10.574 1.00 0.00 H new ATOM 0 HB2 GLU A 134 1.662 -9.770 12.999 1.00 0.00 H new ATOM 0 HB3 GLU A 134 1.235 -8.154 12.475 1.00 0.00 H new ATOM 0 HG2 GLU A 134 -0.493 -8.260 13.970 1.00 0.00 H new ATOM 0 HG3 GLU A 134 -1.271 -9.355 12.845 1.00 0.00 H new ATOM 2145 N GLY A 135 0.706 -12.132 11.298 1.00 0.00 N ATOM 2146 CA GLY A 135 0.212 -13.498 11.424 1.00 0.00 C ATOM 2147 C GLY A 135 -0.521 -13.931 10.159 1.00 0.00 C ATOM 2148 O GLY A 135 -1.341 -14.847 10.189 1.00 0.00 O ATOM 0 H GLY A 135 1.718 -12.053 11.201 1.00 0.00 H new ATOM 0 HA2 GLY A 135 1.045 -14.174 11.616 1.00 0.00 H new ATOM 0 HA3 GLY A 135 -0.459 -13.569 12.280 1.00 0.00 H new