USER MOD reduce.3.24.130724 H: found=0, std=0, add=1230, rem=0, adj=40 USER MOD reduce.3.24.130724 removed 1230 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 135 CYS SG : rot -74:sc= 0.34! USER MOD Set 1.2: A 151 LYS NZ :NH3+ -169:sc= -2.41! (180deg=-2.96!) USER MOD Set 2.1: A 80 CYS SG : rot -171:sc= -3.08! USER MOD Set 2.2: A 113 SER OG : rot -59:sc= -4.13! USER MOD Single : A 3 SER OG : rot 8:sc= 0.326 USER MOD Single : A 6 GLN :FLIP amide:sc= -3.63! C(o=-7.8!,f=-3.6!) USER MOD Single : A 12 CYS SG : rot -48:sc= -2.07 USER MOD Single : A 16 TYR OH : rot 180:sc= 0 USER MOD Single : A 18 MET CE :methyl -141:sc= -20.3! (180deg=-25.9!) USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 LYS NZ :NH3+ 176:sc= -1.39 (180deg=-1.49) USER MOD Single : A 39 CYS SG : rot 80:sc= -2.78! USER MOD Single : A 41 SER OG : rot 180:sc= -0.058 USER MOD Single : A 44 LYS NZ :NH3+ -166:sc= 0 (180deg=-0.106) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 CYS SG : rot -82:sc= -2.51 USER MOD Single : A 53 LYS NZ :NH3+ -161:sc= 0.504 (180deg=0.0795) USER MOD Single : A 63 THR OG1 : rot 180:sc= 0 USER MOD Single : A 65 THR OG1 : rot 180:sc= 0 USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 HIS :FLIP no HD1:sc= -21.7! C(o=-23!,f=-22!) USER MOD Single : A 74 MET CE :methyl 170:sc= -17.5! (180deg=-18.8!) USER MOD Single : A 78 LYS NZ :NH3+ -133:sc= -0.27 (180deg=-2.69!) USER MOD Single : A 82 TYR OH : rot 121:sc= -1.65! USER MOD Single : A 85 TYR OH : rot 104:sc= 0.0273 USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 91 THR OG1 : rot 180:sc= -3.28! USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 SER OG : rot 107:sc= 0.429 USER MOD Single : A 96 LYS NZ :NH3+ -152:sc= -0.388 (180deg=-0.77) USER MOD Single : A 100 MET CE :methyl -177:sc= -10.1! (180deg=-10.1!) USER MOD Single : A 112 LYS NZ :NH3+ -119:sc= -1.58! (180deg=-3.94!) USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 MET CE :methyl 145:sc= -0.465 (180deg=-2.35!) USER MOD Single : A 117 TYR OH : rot 30:sc= -2.49 USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD Single : A 120 SER OG : rot -20:sc= -0.963 USER MOD Single : A 121 LYS NZ :NH3+ -163:sc= 0 (180deg=-0.202) USER MOD Single : A 125 LYS NZ :NH3+ -106:sc= 0.146 (180deg=-0.596) USER MOD Single : A 126 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 129 GLN : amide:sc= -1.97 K(o=-2,f=-6.2!) USER MOD Single : A 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 133 HIS : no HE2:sc= -17.2! C(o=-17!,f=-22!) USER MOD Single : A 136 GLN :FLIP amide:sc= -0.284 F(o=-2.7!,f=-0.28) USER MOD Single : A 138 ASN :FLIP amide:sc= -0.338 F(o=-2.5!,f=-0.34) USER MOD Single : A 144 ASN : amide:sc= -7.1! C(o=-7.1!,f=-8.8!) USER MOD Single : A 147 CYS SG : rot 180:sc= -0.0264 USER MOD Single : A 155 SER OG : rot 180:sc= -0.0108 USER MOD Single : A 163 CYS SG : rot 180:sc= -2.12! USER MOD ----------------------------------------------------------------- ATOM 145 N SER A 3 9.143 18.833 6.578 1.00 1.18 N ATOM 146 CA SER A 3 10.081 19.903 7.038 1.00 1.23 C ATOM 147 C SER A 3 9.600 20.429 8.392 1.00 2.54 C ATOM 148 O SER A 3 9.787 21.581 8.708 1.00 3.70 O ATOM 149 CB SER A 3 10.109 21.047 6.026 1.00 2.08 C ATOM 150 OG SER A 3 9.700 20.564 4.754 1.00 1.74 O ATOM 0 HA SER A 3 11.086 19.492 7.131 1.00 1.23 H new ATOM 0 HB2 SER A 3 9.448 21.851 6.351 1.00 2.08 H new ATOM 0 HB3 SER A 3 11.113 21.466 5.962 1.00 2.08 H new ATOM 0 HG SER A 3 9.371 19.645 4.843 1.00 1.74 H new ATOM 156 N GLY A 4 8.963 19.589 9.175 1.00 2.88 N ATOM 157 CA GLY A 4 8.443 20.010 10.511 1.00 4.31 C ATOM 158 C GLY A 4 9.517 20.753 11.303 1.00 3.65 C ATOM 159 O GLY A 4 10.161 20.181 12.161 1.00 5.15 O ATOM 0 H GLY A 4 8.780 18.614 8.938 1.00 2.88 H new ATOM 0 HA2 GLY A 4 7.572 20.652 10.381 1.00 4.31 H new ATOM 0 HA3 GLY A 4 8.113 19.134 11.070 1.00 4.31 H new ATOM 163 N VAL A 5 9.707 22.026 11.060 1.00 1.96 N ATOM 164 CA VAL A 5 10.716 22.763 11.845 1.00 1.28 C ATOM 165 C VAL A 5 10.290 24.206 12.052 1.00 1.32 C ATOM 166 O VAL A 5 9.625 24.809 11.234 1.00 1.35 O ATOM 167 CB VAL A 5 12.073 22.799 11.167 1.00 0.44 C ATOM 168 CG1 VAL A 5 13.146 22.476 12.200 1.00 1.94 C ATOM 169 CG2 VAL A 5 12.128 21.803 10.008 1.00 2.17 C ATOM 0 H VAL A 5 9.208 22.573 10.358 1.00 1.96 H new ATOM 0 HA VAL A 5 10.795 22.230 12.792 1.00 1.28 H new ATOM 0 HB VAL A 5 12.246 23.794 10.756 1.00 0.44 H new ATOM 0 HG11 VAL A 5 14.127 22.499 11.725 1.00 1.94 H new ATOM 0 HG12 VAL A 5 13.114 23.214 13.001 1.00 1.94 H new ATOM 0 HG13 VAL A 5 12.966 21.484 12.614 1.00 1.94 H new ATOM 0 HG21 VAL A 5 13.110 21.847 9.537 1.00 2.17 H new ATOM 0 HG22 VAL A 5 11.951 20.796 10.385 1.00 2.17 H new ATOM 0 HG23 VAL A 5 11.362 22.056 9.274 1.00 2.17 H new ATOM 179 N GLN A 6 10.684 24.749 13.156 1.00 1.36 N ATOM 180 CA GLN A 6 10.348 26.142 13.486 1.00 1.49 C ATOM 181 C GLN A 6 11.610 26.895 13.931 1.00 1.08 C ATOM 182 O GLN A 6 11.521 27.971 14.487 1.00 1.08 O ATOM 183 CB GLN A 6 9.337 26.140 14.628 1.00 1.80 C ATOM 184 CG GLN A 6 9.143 24.713 15.128 1.00 2.06 C ATOM 185 CD GLN A 6 7.922 24.097 14.445 1.00 2.57 C ATOM 186 OE1 GLN A 6 8.088 23.136 13.580 1.00 2.95 O flip ATOM 187 NE2 GLN A 6 6.803 24.491 14.706 1.00 2.66 N flip ATOM 0 H GLN A 6 11.241 24.269 13.862 1.00 1.36 H new ATOM 0 HA GLN A 6 9.930 26.636 12.609 1.00 1.49 H new ATOM 0 HB2 GLN A 6 9.687 26.777 15.440 1.00 1.80 H new ATOM 0 HB3 GLN A 6 8.386 26.551 14.288 1.00 1.80 H new ATOM 0 HG2 GLN A 6 10.031 24.118 14.916 1.00 2.06 H new ATOM 0 HG3 GLN A 6 9.008 24.710 16.210 1.00 2.06 H new ATOM 0 HE21 GLN A 6 6.672 25.243 15.383 1.00 2.66 H new ATOM 0 HE22 GLN A 6 5.994 24.070 14.249 1.00 2.66 H new ATOM 196 N VAL A 7 12.782 26.339 13.711 1.00 0.77 N ATOM 197 CA VAL A 7 14.021 27.029 14.166 1.00 0.50 C ATOM 198 C VAL A 7 13.863 27.304 15.647 1.00 0.43 C ATOM 199 O VAL A 7 12.784 27.245 16.202 1.00 0.61 O ATOM 200 CB VAL A 7 14.188 28.323 13.387 1.00 0.95 C ATOM 201 CG1 VAL A 7 15.603 28.896 13.593 1.00 2.23 C ATOM 202 CG2 VAL A 7 13.962 28.048 11.897 1.00 2.79 C ATOM 0 H VAL A 7 12.927 25.446 13.240 1.00 0.77 H new ATOM 0 HA VAL A 7 14.907 26.418 13.995 1.00 0.50 H new ATOM 0 HB VAL A 7 13.459 29.049 13.747 1.00 0.95 H new ATOM 0 HG11 VAL A 7 15.706 29.823 13.028 1.00 2.23 H new ATOM 0 HG12 VAL A 7 15.764 29.097 14.652 1.00 2.23 H new ATOM 0 HG13 VAL A 7 16.342 28.175 13.244 1.00 2.23 H new ATOM 0 HG21 VAL A 7 14.081 28.974 11.334 1.00 2.79 H new ATOM 0 HG22 VAL A 7 14.689 27.315 11.548 1.00 2.79 H new ATOM 0 HG23 VAL A 7 12.955 27.659 11.747 1.00 2.79 H new ATOM 212 N ALA A 8 14.935 27.533 16.306 1.00 0.28 N ATOM 213 CA ALA A 8 14.866 27.738 17.756 1.00 0.48 C ATOM 214 C ALA A 8 15.408 29.118 18.112 1.00 0.27 C ATOM 215 O ALA A 8 15.293 29.567 19.235 1.00 0.26 O ATOM 216 CB ALA A 8 15.741 26.647 18.355 1.00 0.70 C ATOM 0 H ALA A 8 15.870 27.588 15.901 1.00 0.28 H new ATOM 0 HA ALA A 8 13.845 27.688 18.134 1.00 0.48 H new ATOM 0 HB1 ALA A 8 15.740 26.735 19.441 1.00 0.70 H new ATOM 0 HB2 ALA A 8 15.351 25.670 18.070 1.00 0.70 H new ATOM 0 HB3 ALA A 8 16.760 26.753 17.984 1.00 0.70 H new ATOM 222 N ASP A 9 16.041 29.766 17.171 1.00 0.19 N ATOM 223 CA ASP A 9 16.667 31.094 17.432 1.00 0.22 C ATOM 224 C ASP A 9 18.036 30.815 18.008 1.00 0.32 C ATOM 225 O ASP A 9 19.017 31.440 17.664 1.00 0.44 O ATOM 226 CB ASP A 9 15.871 31.906 18.432 1.00 0.25 C ATOM 227 CG ASP A 9 14.379 31.830 18.101 1.00 0.16 C ATOM 228 OD1 ASP A 9 14.054 31.815 16.925 1.00 0.35 O ATOM 229 OD2 ASP A 9 13.588 31.787 19.029 1.00 0.19 O ATOM 0 H ASP A 9 16.152 29.425 16.216 1.00 0.19 H new ATOM 0 HA ASP A 9 16.709 31.669 16.507 1.00 0.22 H new ATOM 0 HB2 ASP A 9 16.048 31.531 19.440 1.00 0.25 H new ATOM 0 HB3 ASP A 9 16.203 32.944 18.416 1.00 0.25 H new ATOM 234 N GLU A 10 18.110 29.831 18.855 1.00 0.34 N ATOM 235 CA GLU A 10 19.395 29.436 19.415 1.00 0.44 C ATOM 236 C GLU A 10 20.239 28.972 18.232 1.00 0.27 C ATOM 237 O GLU A 10 21.440 28.861 18.331 1.00 0.26 O ATOM 238 CB GLU A 10 19.156 28.298 20.416 1.00 0.54 C ATOM 239 CG GLU A 10 20.294 27.285 20.359 1.00 0.99 C ATOM 240 CD GLU A 10 21.494 27.813 21.147 1.00 2.98 C ATOM 241 OE1 GLU A 10 22.267 28.567 20.577 1.00 3.79 O ATOM 242 OE2 GLU A 10 21.622 27.454 22.306 1.00 4.26 O ATOM 0 H GLU A 10 17.312 29.284 19.179 1.00 0.34 H new ATOM 0 HA GLU A 10 19.901 30.244 19.944 1.00 0.44 H new ATOM 0 HB2 GLU A 10 19.074 28.704 21.424 1.00 0.54 H new ATOM 0 HB3 GLU A 10 18.210 27.804 20.194 1.00 0.54 H new ATOM 0 HG2 GLU A 10 19.966 26.331 20.773 1.00 0.99 H new ATOM 0 HG3 GLU A 10 20.579 27.102 19.323 1.00 0.99 H new ATOM 249 N VAL A 11 19.614 28.721 17.089 1.00 0.22 N ATOM 250 CA VAL A 11 20.410 28.301 15.901 1.00 0.19 C ATOM 251 C VAL A 11 21.233 29.491 15.483 1.00 0.39 C ATOM 252 O VAL A 11 22.387 29.380 15.123 1.00 0.49 O ATOM 253 CB VAL A 11 19.516 27.880 14.735 1.00 0.24 C ATOM 254 CG1 VAL A 11 18.085 27.639 15.212 1.00 1.56 C ATOM 255 CG2 VAL A 11 19.535 28.975 13.668 1.00 1.32 C ATOM 0 H VAL A 11 18.607 28.791 16.942 1.00 0.22 H new ATOM 0 HA VAL A 11 21.027 27.442 16.163 1.00 0.19 H new ATOM 0 HB VAL A 11 19.895 26.949 14.314 1.00 0.24 H new ATOM 0 HG11 VAL A 11 17.465 27.340 14.367 1.00 1.56 H new ATOM 0 HG12 VAL A 11 18.080 26.849 15.963 1.00 1.56 H new ATOM 0 HG13 VAL A 11 17.687 28.556 15.647 1.00 1.56 H new ATOM 0 HG21 VAL A 11 18.899 28.681 12.833 1.00 1.32 H new ATOM 0 HG22 VAL A 11 19.164 29.906 14.096 1.00 1.32 H new ATOM 0 HG23 VAL A 11 20.555 29.120 13.313 1.00 1.32 H new ATOM 265 N CYS A 12 20.654 30.647 15.586 1.00 0.44 N ATOM 266 CA CYS A 12 21.409 31.880 15.251 1.00 0.58 C ATOM 267 C CYS A 12 22.265 32.253 16.461 1.00 0.27 C ATOM 268 O CYS A 12 22.732 33.366 16.593 1.00 0.26 O ATOM 269 CB CYS A 12 20.433 33.011 14.969 1.00 0.88 C ATOM 270 SG CYS A 12 21.282 34.343 14.084 1.00 1.09 S ATOM 0 H CYS A 12 19.691 30.793 15.888 1.00 0.44 H new ATOM 0 HA CYS A 12 22.033 31.714 14.373 1.00 0.58 H new ATOM 0 HB2 CYS A 12 19.596 32.643 14.376 1.00 0.88 H new ATOM 0 HB3 CYS A 12 20.019 33.389 15.904 1.00 0.88 H new ATOM 0 HG CYS A 12 22.404 34.614 14.681 1.00 1.09 H new ATOM 276 N ARG A 13 22.494 31.307 17.328 1.00 0.48 N ATOM 277 CA ARG A 13 23.341 31.545 18.519 1.00 0.22 C ATOM 278 C ARG A 13 24.447 30.513 18.466 1.00 0.30 C ATOM 279 O ARG A 13 25.268 30.396 19.355 1.00 0.34 O ATOM 280 CB ARG A 13 22.537 31.349 19.801 1.00 0.34 C ATOM 281 CG ARG A 13 21.729 32.612 20.104 1.00 0.36 C ATOM 282 CD ARG A 13 22.507 33.486 21.089 1.00 0.77 C ATOM 283 NE ARG A 13 21.559 34.152 22.026 1.00 1.23 N ATOM 284 CZ ARG A 13 21.993 34.650 23.151 1.00 1.14 C ATOM 285 NH1 ARG A 13 23.277 34.709 23.391 1.00 2.46 N ATOM 286 NH2 ARG A 13 21.144 35.094 24.037 1.00 0.40 N ATOM 0 H ARG A 13 22.120 30.361 17.255 1.00 0.48 H new ATOM 0 HA ARG A 13 23.728 32.564 18.518 1.00 0.22 H new ATOM 0 HB2 ARG A 13 21.868 30.495 19.695 1.00 0.34 H new ATOM 0 HB3 ARG A 13 23.207 31.127 20.631 1.00 0.34 H new ATOM 0 HG2 ARG A 13 21.537 33.164 19.184 1.00 0.36 H new ATOM 0 HG3 ARG A 13 20.759 32.345 20.524 1.00 0.36 H new ATOM 0 HD2 ARG A 13 23.218 32.877 21.647 1.00 0.77 H new ATOM 0 HD3 ARG A 13 23.085 34.235 20.548 1.00 0.77 H new ATOM 0 HE ARG A 13 20.570 34.219 21.788 1.00 1.23 H new ATOM 0 HH11 ARG A 13 23.942 34.365 22.698 1.00 2.46 H new ATOM 0 HH12 ARG A 13 23.614 35.099 24.271 1.00 2.46 H new ATOM 0 HH21 ARG A 13 20.142 35.051 23.850 1.00 0.40 H new ATOM 0 HH22 ARG A 13 21.482 35.484 24.917 1.00 0.40 H new ATOM 300 N ILE A 14 24.470 29.761 17.404 1.00 0.83 N ATOM 301 CA ILE A 14 25.503 28.744 17.239 1.00 0.97 C ATOM 302 C ILE A 14 26.419 29.212 16.134 1.00 0.91 C ATOM 303 O ILE A 14 27.542 29.600 16.343 1.00 1.17 O ATOM 304 CB ILE A 14 24.877 27.448 16.799 1.00 1.06 C ATOM 305 CG1 ILE A 14 23.432 27.324 17.216 1.00 1.22 C ATOM 306 CG2 ILE A 14 25.663 26.325 17.405 1.00 1.19 C ATOM 307 CD1 ILE A 14 22.797 26.281 16.288 1.00 1.51 C ATOM 0 H ILE A 14 23.799 29.821 16.639 1.00 0.83 H new ATOM 0 HA ILE A 14 26.036 28.594 18.178 1.00 0.97 H new ATOM 0 HB ILE A 14 24.896 27.415 15.710 1.00 1.06 H new ATOM 0 HG12 ILE A 14 23.355 27.014 18.258 1.00 1.22 H new ATOM 0 HG13 ILE A 14 22.920 28.282 17.130 1.00 1.22 H new ATOM 0 HG21 ILE A 14 25.229 25.372 17.101 1.00 1.19 H new ATOM 0 HG22 ILE A 14 26.697 26.379 17.063 1.00 1.19 H new ATOM 0 HG23 ILE A 14 25.635 26.406 18.492 1.00 1.19 H new ATOM 0 HD11 ILE A 14 21.746 26.153 16.549 1.00 1.51 H new ATOM 0 HD12 ILE A 14 22.876 26.618 15.254 1.00 1.51 H new ATOM 0 HD13 ILE A 14 23.317 25.330 16.400 1.00 1.51 H new ATOM 319 N PHE A 15 25.904 29.223 14.953 1.00 0.76 N ATOM 320 CA PHE A 15 26.689 29.743 13.824 1.00 0.70 C ATOM 321 C PHE A 15 27.118 31.135 14.262 1.00 0.77 C ATOM 322 O PHE A 15 28.125 31.677 13.845 1.00 0.76 O ATOM 323 CB PHE A 15 25.774 29.856 12.607 1.00 0.78 C ATOM 324 CG PHE A 15 25.779 31.278 12.127 1.00 1.01 C ATOM 325 CD1 PHE A 15 25.004 32.239 12.781 1.00 1.21 C ATOM 326 CD2 PHE A 15 26.565 31.635 11.034 1.00 1.16 C ATOM 327 CE1 PHE A 15 25.015 33.564 12.340 1.00 1.60 C ATOM 328 CE2 PHE A 15 26.579 32.962 10.585 1.00 1.53 C ATOM 329 CZ PHE A 15 25.802 33.929 11.239 1.00 1.77 C ATOM 0 H PHE A 15 24.968 28.892 14.720 1.00 0.76 H new ATOM 0 HA PHE A 15 27.538 29.109 13.566 1.00 0.70 H new ATOM 0 HB2 PHE A 15 26.116 29.189 11.815 1.00 0.78 H new ATOM 0 HB3 PHE A 15 24.761 29.549 12.867 1.00 0.78 H new ATOM 0 HD1 PHE A 15 24.396 31.957 13.628 1.00 1.21 H new ATOM 0 HD2 PHE A 15 27.164 30.889 10.533 1.00 1.16 H new ATOM 0 HE1 PHE A 15 24.417 34.307 12.847 1.00 1.60 H new ATOM 0 HE2 PHE A 15 27.187 33.240 9.737 1.00 1.53 H new ATOM 0 HZ PHE A 15 25.810 34.953 10.895 1.00 1.77 H new ATOM 339 N TYR A 16 26.312 31.699 15.124 1.00 1.00 N ATOM 340 CA TYR A 16 26.540 33.042 15.673 1.00 1.35 C ATOM 341 C TYR A 16 27.689 33.043 16.675 1.00 1.68 C ATOM 342 O TYR A 16 28.376 34.032 16.832 1.00 2.19 O ATOM 343 CB TYR A 16 25.276 33.420 16.439 1.00 1.14 C ATOM 344 CG TYR A 16 25.671 34.026 17.763 1.00 1.22 C ATOM 345 CD1 TYR A 16 26.067 33.190 18.808 1.00 1.00 C ATOM 346 CD2 TYR A 16 25.662 35.412 17.942 1.00 1.94 C ATOM 347 CE1 TYR A 16 26.462 33.719 20.025 1.00 1.13 C ATOM 348 CE2 TYR A 16 26.054 35.954 19.173 1.00 2.07 C ATOM 349 CZ TYR A 16 26.454 35.107 20.216 1.00 1.51 C ATOM 350 OH TYR A 16 26.845 35.640 21.425 1.00 1.69 O ATOM 0 H TYR A 16 25.468 31.249 15.477 1.00 1.00 H new ATOM 0 HA TYR A 16 26.778 33.730 14.862 1.00 1.35 H new ATOM 0 HB2 TYR A 16 24.683 34.129 15.862 1.00 1.14 H new ATOM 0 HB3 TYR A 16 24.654 32.539 16.598 1.00 1.14 H new ATOM 0 HD1 TYR A 16 26.065 32.119 18.666 1.00 1.00 H new ATOM 0 HD2 TYR A 16 25.355 36.062 17.136 1.00 1.94 H new ATOM 0 HE1 TYR A 16 26.775 33.064 20.824 1.00 1.13 H new ATOM 0 HE2 TYR A 16 26.048 37.024 19.318 1.00 2.07 H new ATOM 0 HH TYR A 16 26.781 36.617 21.388 1.00 1.69 H new ATOM 360 N ASP A 17 27.868 31.975 17.415 1.00 1.55 N ATOM 361 CA ASP A 17 28.936 32.005 18.453 1.00 2.15 C ATOM 362 C ASP A 17 30.240 31.572 17.829 1.00 2.17 C ATOM 363 O ASP A 17 31.071 32.371 17.448 1.00 3.57 O ATOM 364 CB ASP A 17 28.551 31.053 19.592 1.00 2.28 C ATOM 365 CG ASP A 17 29.682 30.984 20.621 1.00 3.17 C ATOM 366 OD1 ASP A 17 30.752 31.494 20.334 1.00 3.80 O ATOM 367 OD2 ASP A 17 29.455 30.426 21.680 1.00 3.72 O ATOM 0 H ASP A 17 27.335 31.108 17.347 1.00 1.55 H new ATOM 0 HA ASP A 17 29.049 33.013 18.852 1.00 2.15 H new ATOM 0 HB2 ASP A 17 27.634 31.397 20.070 1.00 2.28 H new ATOM 0 HB3 ASP A 17 28.349 30.059 19.194 1.00 2.28 H new ATOM 372 N MET A 18 30.399 30.310 17.706 1.00 0.77 N ATOM 373 CA MET A 18 31.618 29.761 17.085 1.00 0.60 C ATOM 374 C MET A 18 31.993 30.584 15.844 1.00 0.60 C ATOM 375 O MET A 18 33.140 30.618 15.447 1.00 0.75 O ATOM 376 CB MET A 18 31.313 28.348 16.691 1.00 0.40 C ATOM 377 CG MET A 18 29.911 28.306 16.079 1.00 0.57 C ATOM 378 SD MET A 18 28.865 27.355 17.166 1.00 0.50 S ATOM 379 CE MET A 18 30.048 26.007 17.211 1.00 0.70 C ATOM 0 H MET A 18 29.723 29.611 18.015 1.00 0.77 H new ATOM 0 HA MET A 18 32.458 29.798 17.779 1.00 0.60 H new ATOM 0 HB2 MET A 18 32.050 27.987 15.974 1.00 0.40 H new ATOM 0 HB3 MET A 18 31.367 27.692 17.560 1.00 0.40 H new ATOM 0 HG2 MET A 18 29.517 29.315 15.958 1.00 0.57 H new ATOM 0 HG3 MET A 18 29.941 27.854 15.087 1.00 0.57 H new ATOM 0 HE1 MET A 18 29.516 25.056 17.194 1.00 0.70 H new ATOM 0 HE2 MET A 18 30.706 26.071 16.344 1.00 0.70 H new ATOM 0 HE3 MET A 18 30.642 26.074 18.123 1.00 0.70 H new ATOM 553 N ILE A 29 35.422 30.560 27.336 1.00 1.03 N ATOM 554 CA ILE A 29 34.466 30.465 26.258 1.00 0.84 C ATOM 555 C ILE A 29 34.302 29.016 25.798 1.00 0.62 C ATOM 556 O ILE A 29 33.257 28.615 25.344 1.00 0.52 O ATOM 557 CB ILE A 29 35.124 31.230 25.195 1.00 0.96 C ATOM 558 CG1 ILE A 29 34.494 32.627 25.132 1.00 1.10 C ATOM 559 CG2 ILE A 29 35.013 30.425 23.943 1.00 0.83 C ATOM 560 CD1 ILE A 29 34.265 33.114 26.552 1.00 1.16 C ATOM 0 HA ILE A 29 33.473 30.821 26.534 1.00 0.84 H new ATOM 0 HB ILE A 29 36.186 31.401 25.371 1.00 0.96 H new ATOM 0 HG12 ILE A 29 35.149 33.314 24.596 1.00 1.10 H new ATOM 0 HG13 ILE A 29 33.551 32.594 24.586 1.00 1.10 H new ATOM 0 HG21 ILE A 29 35.492 30.960 23.123 1.00 0.83 H new ATOM 0 HG22 ILE A 29 35.505 29.462 24.085 1.00 0.83 H new ATOM 0 HG23 ILE A 29 33.961 30.264 23.706 1.00 0.83 H new ATOM 0 HD11 ILE A 29 33.817 34.107 26.528 1.00 1.16 H new ATOM 0 HD12 ILE A 29 33.596 32.426 27.069 1.00 1.16 H new ATOM 0 HD13 ILE A 29 35.218 33.158 27.080 1.00 1.16 H new ATOM 572 N LYS A 30 35.355 28.240 25.878 1.00 0.62 N ATOM 573 CA LYS A 30 35.282 26.819 25.436 1.00 0.55 C ATOM 574 C LYS A 30 34.214 26.121 26.262 1.00 0.51 C ATOM 575 O LYS A 30 33.651 25.111 25.886 1.00 0.68 O ATOM 576 CB LYS A 30 36.619 26.091 25.688 1.00 0.55 C ATOM 577 CG LYS A 30 37.771 27.060 25.958 1.00 0.69 C ATOM 578 CD LYS A 30 39.038 26.242 26.229 1.00 0.53 C ATOM 579 CE LYS A 30 40.281 27.062 25.887 1.00 2.88 C ATOM 580 NZ LYS A 30 41.374 26.708 26.836 1.00 2.69 N ATOM 0 H LYS A 30 36.265 28.534 26.233 1.00 0.62 H new ATOM 0 HA LYS A 30 35.056 26.795 24.370 1.00 0.55 H new ATOM 0 HB2 LYS A 30 36.508 25.418 26.538 1.00 0.55 H new ATOM 0 HB3 LYS A 30 36.862 25.474 24.823 1.00 0.55 H new ATOM 0 HG2 LYS A 30 37.921 27.719 25.103 1.00 0.69 H new ATOM 0 HG3 LYS A 30 37.540 27.695 26.813 1.00 0.69 H new ATOM 0 HD2 LYS A 30 39.069 25.942 27.277 1.00 0.53 H new ATOM 0 HD3 LYS A 30 39.023 25.328 25.636 1.00 0.53 H new ATOM 0 HE2 LYS A 30 40.593 26.862 24.862 1.00 2.88 H new ATOM 0 HE3 LYS A 30 40.058 28.127 25.950 1.00 2.88 H new ATOM 0 HZ1 LYS A 30 42.224 27.263 26.609 1.00 2.69 H new ATOM 0 HZ2 LYS A 30 41.072 26.920 27.808 1.00 2.69 H new ATOM 0 HZ3 LYS A 30 41.590 25.694 26.754 1.00 2.69 H new ATOM 594 N LYS A 31 33.953 26.672 27.398 1.00 0.53 N ATOM 595 CA LYS A 31 32.934 26.093 28.322 1.00 0.60 C ATOM 596 C LYS A 31 31.670 26.945 28.250 1.00 0.77 C ATOM 597 O LYS A 31 30.877 26.994 29.170 1.00 1.27 O ATOM 598 CB LYS A 31 33.481 26.110 29.750 1.00 0.56 C ATOM 599 CG LYS A 31 32.754 25.058 30.589 1.00 0.84 C ATOM 600 CD LYS A 31 33.679 23.862 30.820 1.00 0.91 C ATOM 601 CE LYS A 31 33.066 22.939 31.873 1.00 2.19 C ATOM 602 NZ LYS A 31 34.131 22.485 32.812 1.00 1.48 N ATOM 0 H LYS A 31 34.407 27.518 27.742 1.00 0.53 H new ATOM 0 HA LYS A 31 32.706 25.066 28.035 1.00 0.60 H new ATOM 0 HB2 LYS A 31 34.552 25.908 29.743 1.00 0.56 H new ATOM 0 HB3 LYS A 31 33.346 27.098 30.190 1.00 0.56 H new ATOM 0 HG2 LYS A 31 32.450 25.486 31.544 1.00 0.84 H new ATOM 0 HG3 LYS A 31 31.845 24.736 30.080 1.00 0.84 H new ATOM 0 HD2 LYS A 31 33.828 23.318 29.887 1.00 0.91 H new ATOM 0 HD3 LYS A 31 34.660 24.205 31.149 1.00 0.91 H new ATOM 0 HE2 LYS A 31 32.282 23.463 32.420 1.00 2.19 H new ATOM 0 HE3 LYS A 31 32.599 22.080 31.392 1.00 2.19 H new ATOM 0 HZ1 LYS A 31 33.716 21.857 33.530 1.00 1.48 H new ATOM 0 HZ2 LYS A 31 34.864 21.970 32.283 1.00 1.48 H new ATOM 0 HZ3 LYS A 31 34.557 23.311 33.279 1.00 1.48 H new ATOM 616 N ARG A 32 31.485 27.613 27.151 1.00 0.57 N ATOM 617 CA ARG A 32 30.288 28.476 26.979 1.00 0.68 C ATOM 618 C ARG A 32 29.304 27.796 26.025 1.00 0.70 C ATOM 619 O ARG A 32 28.204 28.262 25.805 1.00 0.74 O ATOM 620 CB ARG A 32 30.716 29.836 26.413 1.00 0.74 C ATOM 621 CG ARG A 32 31.209 30.747 27.550 1.00 0.84 C ATOM 622 CD ARG A 32 32.464 30.147 28.202 1.00 0.84 C ATOM 623 NE ARG A 32 32.135 29.688 29.582 1.00 0.95 N ATOM 624 CZ ARG A 32 32.406 30.450 30.608 1.00 1.42 C ATOM 625 NH1 ARG A 32 32.577 31.734 30.443 1.00 1.86 N ATOM 626 NH2 ARG A 32 32.497 29.926 31.799 1.00 1.50 N ATOM 0 H ARG A 32 32.121 27.598 26.353 1.00 0.57 H new ATOM 0 HA ARG A 32 29.803 28.629 27.943 1.00 0.68 H new ATOM 0 HB2 ARG A 32 31.507 29.700 25.676 1.00 0.74 H new ATOM 0 HB3 ARG A 32 29.878 30.305 25.898 1.00 0.74 H new ATOM 0 HG2 ARG A 32 31.432 31.740 27.160 1.00 0.84 H new ATOM 0 HG3 ARG A 32 30.424 30.867 28.297 1.00 0.84 H new ATOM 0 HD2 ARG A 32 32.832 29.311 27.607 1.00 0.84 H new ATOM 0 HD3 ARG A 32 33.261 30.890 28.234 1.00 0.84 H new ATOM 0 HE ARG A 32 31.698 28.778 29.725 1.00 0.95 H new ATOM 0 HH11 ARG A 32 32.499 32.143 29.512 1.00 1.86 H new ATOM 0 HH12 ARG A 32 32.789 32.328 31.245 1.00 1.86 H new ATOM 0 HH21 ARG A 32 32.357 28.924 31.927 1.00 1.50 H new ATOM 0 HH22 ARG A 32 32.708 30.518 32.602 1.00 1.50 H new ATOM 640 N LYS A 33 29.695 26.682 25.478 1.00 0.71 N ATOM 641 CA LYS A 33 28.802 25.924 24.552 1.00 0.79 C ATOM 642 C LYS A 33 28.725 26.593 23.179 1.00 0.75 C ATOM 643 O LYS A 33 28.182 27.669 23.028 1.00 0.91 O ATOM 644 CB LYS A 33 27.398 25.845 25.151 1.00 1.07 C ATOM 645 CG LYS A 33 26.637 24.682 24.508 1.00 0.60 C ATOM 646 CD LYS A 33 25.163 24.760 24.904 1.00 0.54 C ATOM 647 CE LYS A 33 24.428 25.704 23.953 1.00 0.99 C ATOM 648 NZ LYS A 33 23.880 26.851 24.730 1.00 1.51 N ATOM 0 H LYS A 33 30.608 26.256 25.634 1.00 0.71 H new ATOM 0 HA LYS A 33 29.217 24.924 24.424 1.00 0.79 H new ATOM 0 HB2 LYS A 33 27.458 25.703 26.230 1.00 1.07 H new ATOM 0 HB3 LYS A 33 26.865 26.781 24.982 1.00 1.07 H new ATOM 0 HG2 LYS A 33 26.736 24.723 23.423 1.00 0.60 H new ATOM 0 HG3 LYS A 33 27.062 23.732 24.831 1.00 0.60 H new ATOM 0 HD2 LYS A 33 24.713 23.768 24.868 1.00 0.54 H new ATOM 0 HD3 LYS A 33 25.070 25.115 25.930 1.00 0.54 H new ATOM 0 HE2 LYS A 33 25.108 26.064 23.181 1.00 0.99 H new ATOM 0 HE3 LYS A 33 23.622 25.174 23.446 1.00 0.99 H new ATOM 0 HZ1 LYS A 33 23.378 27.497 24.088 1.00 1.51 H new ATOM 0 HZ2 LYS A 33 23.219 26.498 25.451 1.00 1.51 H new ATOM 0 HZ3 LYS A 33 24.659 27.360 25.194 1.00 1.51 H new ATOM 662 N LYS A 34 29.237 25.940 22.167 1.00 0.63 N ATOM 663 CA LYS A 34 29.160 26.511 20.801 1.00 0.61 C ATOM 664 C LYS A 34 29.090 25.365 19.790 1.00 0.66 C ATOM 665 O LYS A 34 28.274 25.376 18.892 1.00 0.87 O ATOM 666 CB LYS A 34 30.383 27.383 20.517 1.00 0.60 C ATOM 667 CG LYS A 34 31.586 26.862 21.295 1.00 1.08 C ATOM 668 CD LYS A 34 32.755 27.827 21.106 1.00 0.71 C ATOM 669 CE LYS A 34 33.098 28.475 22.446 1.00 0.76 C ATOM 670 NZ LYS A 34 31.999 29.398 22.849 1.00 1.52 N ATOM 0 H LYS A 34 29.704 25.036 22.234 1.00 0.63 H new ATOM 0 HA LYS A 34 28.269 27.134 20.718 1.00 0.61 H new ATOM 0 HB2 LYS A 34 30.601 27.381 19.449 1.00 0.60 H new ATOM 0 HB3 LYS A 34 30.177 28.416 20.798 1.00 0.60 H new ATOM 0 HG2 LYS A 34 31.340 26.771 22.353 1.00 1.08 H new ATOM 0 HG3 LYS A 34 31.859 25.867 20.945 1.00 1.08 H new ATOM 0 HD2 LYS A 34 33.622 27.294 20.715 1.00 0.71 H new ATOM 0 HD3 LYS A 34 32.495 28.593 20.375 1.00 0.71 H new ATOM 0 HE2 LYS A 34 33.240 27.708 23.207 1.00 0.76 H new ATOM 0 HE3 LYS A 34 34.037 29.023 22.367 1.00 0.76 H new ATOM 0 HZ1 LYS A 34 32.201 29.787 23.792 1.00 1.52 H new ATOM 0 HZ2 LYS A 34 31.929 30.175 22.162 1.00 1.52 H new ATOM 0 HZ3 LYS A 34 31.100 28.876 22.875 1.00 1.52 H new ATOM 684 N ALA A 35 29.889 24.339 19.954 1.00 0.49 N ATOM 685 CA ALA A 35 29.809 23.212 19.033 1.00 0.57 C ATOM 686 C ALA A 35 28.560 22.508 19.408 1.00 0.48 C ATOM 687 O ALA A 35 28.152 22.518 20.550 1.00 0.50 O ATOM 688 CB ALA A 35 31.011 22.308 19.187 1.00 0.78 C ATOM 0 H ALA A 35 30.587 24.252 20.693 1.00 0.49 H new ATOM 0 HA ALA A 35 29.801 23.529 17.990 1.00 0.57 H new ATOM 0 HB1 ALA A 35 30.930 21.474 18.490 1.00 0.78 H new ATOM 0 HB2 ALA A 35 31.920 22.872 18.975 1.00 0.78 H new ATOM 0 HB3 ALA A 35 31.051 21.926 20.207 1.00 0.78 H new ATOM 694 N VAL A 36 27.903 21.983 18.470 1.00 0.44 N ATOM 695 CA VAL A 36 26.611 21.398 18.790 1.00 0.50 C ATOM 696 C VAL A 36 26.021 20.638 17.633 1.00 0.59 C ATOM 697 O VAL A 36 26.450 20.716 16.497 1.00 0.82 O ATOM 698 CB VAL A 36 25.673 22.574 18.960 1.00 0.45 C ATOM 699 CG1 VAL A 36 25.849 23.293 20.302 1.00 0.44 C ATOM 700 CG2 VAL A 36 25.979 23.523 17.819 1.00 0.51 C ATOM 0 H VAL A 36 28.194 21.928 17.494 1.00 0.44 H new ATOM 0 HA VAL A 36 26.732 20.738 19.649 1.00 0.50 H new ATOM 0 HB VAL A 36 24.641 22.223 18.949 1.00 0.45 H new ATOM 0 HG11 VAL A 36 25.149 24.126 20.363 1.00 0.44 H new ATOM 0 HG12 VAL A 36 25.655 22.595 21.117 1.00 0.44 H new ATOM 0 HG13 VAL A 36 26.869 23.670 20.382 1.00 0.44 H new ATOM 0 HG21 VAL A 36 25.330 24.396 17.888 1.00 0.51 H new ATOM 0 HG22 VAL A 36 27.020 23.839 17.878 1.00 0.51 H new ATOM 0 HG23 VAL A 36 25.807 23.017 16.869 1.00 0.51 H new ATOM 710 N ILE A 37 24.929 20.044 17.931 1.00 0.46 N ATOM 711 CA ILE A 37 24.099 19.400 16.943 1.00 0.44 C ATOM 712 C ILE A 37 22.799 20.179 17.156 1.00 0.88 C ATOM 713 O ILE A 37 22.769 21.020 18.014 1.00 2.05 O ATOM 714 CB ILE A 37 23.933 17.917 17.283 1.00 0.10 C ATOM 715 CG1 ILE A 37 25.020 17.087 16.590 1.00 0.34 C ATOM 716 CG2 ILE A 37 22.570 17.465 16.803 1.00 0.32 C ATOM 717 CD1 ILE A 37 25.918 16.406 17.638 1.00 0.21 C ATOM 0 H ILE A 37 24.565 19.981 18.882 1.00 0.46 H new ATOM 0 HA ILE A 37 24.473 19.413 15.919 1.00 0.44 H new ATOM 0 HB ILE A 37 24.023 17.777 18.360 1.00 0.10 H new ATOM 0 HG12 ILE A 37 24.560 16.334 15.950 1.00 0.34 H new ATOM 0 HG13 ILE A 37 25.622 17.728 15.946 1.00 0.34 H new ATOM 0 HG21 ILE A 37 22.434 16.409 17.037 1.00 0.32 H new ATOM 0 HG22 ILE A 37 21.797 18.050 17.301 1.00 0.32 H new ATOM 0 HG23 ILE A 37 22.497 17.610 15.725 1.00 0.32 H new ATOM 0 HD11 ILE A 37 26.686 15.820 17.133 1.00 0.21 H new ATOM 0 HD12 ILE A 37 26.392 17.166 18.260 1.00 0.21 H new ATOM 0 HD13 ILE A 37 25.313 15.750 18.264 1.00 0.21 H new ATOM 729 N PHE A 38 21.757 19.940 16.451 1.00 0.40 N ATOM 730 CA PHE A 38 20.497 20.680 16.687 1.00 0.65 C ATOM 731 C PHE A 38 19.441 19.761 16.082 1.00 0.71 C ATOM 732 O PHE A 38 19.763 19.042 15.163 1.00 1.31 O ATOM 733 CB PHE A 38 20.541 22.064 15.985 1.00 1.11 C ATOM 734 CG PHE A 38 20.962 23.174 16.971 1.00 1.39 C ATOM 735 CD1 PHE A 38 22.319 23.356 17.335 1.00 1.11 C ATOM 736 CD2 PHE A 38 19.991 24.019 17.544 1.00 3.36 C ATOM 737 CE1 PHE A 38 22.677 24.351 18.251 1.00 2.69 C ATOM 738 CE2 PHE A 38 20.358 25.004 18.458 1.00 5.08 C ATOM 739 CZ PHE A 38 21.701 25.169 18.818 1.00 4.76 C ATOM 0 H PHE A 38 21.714 19.249 15.702 1.00 0.40 H new ATOM 0 HA PHE A 38 20.302 20.900 17.737 1.00 0.65 H new ATOM 0 HB2 PHE A 38 21.241 22.030 15.150 1.00 1.11 H new ATOM 0 HB3 PHE A 38 19.560 22.296 15.569 1.00 1.11 H new ATOM 0 HD1 PHE A 38 23.081 22.724 16.903 1.00 1.11 H new ATOM 0 HD2 PHE A 38 18.952 23.902 17.272 1.00 3.36 H new ATOM 0 HE1 PHE A 38 23.714 24.486 18.520 1.00 2.69 H new ATOM 0 HE2 PHE A 38 19.603 25.643 18.891 1.00 5.08 H new ATOM 0 HZ PHE A 38 21.980 25.928 19.533 1.00 4.76 H new ATOM 749 N CYS A 39 18.209 19.689 16.533 1.00 0.49 N ATOM 750 CA CYS A 39 17.350 18.686 15.813 1.00 0.56 C ATOM 751 C CYS A 39 15.896 18.653 16.197 1.00 0.50 C ATOM 752 O CYS A 39 15.425 17.660 16.709 1.00 0.91 O ATOM 753 CB CYS A 39 17.871 17.285 16.073 1.00 0.62 C ATOM 754 SG CYS A 39 18.173 17.079 17.845 1.00 0.58 S ATOM 0 H CYS A 39 17.788 20.223 17.293 1.00 0.49 H new ATOM 0 HA CYS A 39 17.410 19.006 14.773 1.00 0.56 H new ATOM 0 HB2 CYS A 39 17.148 16.546 15.727 1.00 0.62 H new ATOM 0 HB3 CYS A 39 18.791 17.117 15.514 1.00 0.62 H new ATOM 0 HG CYS A 39 17.049 16.838 18.452 1.00 0.58 H new ATOM 760 N LEU A 40 15.150 19.636 15.857 1.00 0.15 N ATOM 761 CA LEU A 40 13.693 19.516 16.126 1.00 0.33 C ATOM 762 C LEU A 40 13.435 19.271 17.624 1.00 0.61 C ATOM 763 O LEU A 40 14.175 18.594 18.302 1.00 1.01 O ATOM 764 CB LEU A 40 13.207 18.324 15.290 1.00 0.51 C ATOM 765 CG LEU A 40 13.659 18.491 13.830 1.00 0.38 C ATOM 766 CD1 LEU A 40 12.672 17.783 12.898 1.00 0.65 C ATOM 767 CD2 LEU A 40 13.703 19.971 13.462 1.00 0.75 C ATOM 0 H LEU A 40 15.460 20.502 15.415 1.00 0.15 H new ATOM 0 HA LEU A 40 13.162 20.431 15.861 1.00 0.33 H new ATOM 0 HB2 LEU A 40 13.605 17.395 15.699 1.00 0.51 H new ATOM 0 HB3 LEU A 40 12.120 18.254 15.338 1.00 0.51 H new ATOM 0 HG LEU A 40 14.652 18.055 13.721 1.00 0.38 H new ATOM 0 HD11 LEU A 40 12.997 17.904 11.865 1.00 0.65 H new ATOM 0 HD12 LEU A 40 12.636 16.722 13.145 1.00 0.65 H new ATOM 0 HD13 LEU A 40 11.680 18.218 13.020 1.00 0.65 H new ATOM 0 HD21 LEU A 40 14.024 20.079 12.426 1.00 0.75 H new ATOM 0 HD22 LEU A 40 12.710 20.405 13.581 1.00 0.75 H new ATOM 0 HD23 LEU A 40 14.406 20.488 14.116 1.00 0.75 H new ATOM 779 N SER A 41 12.395 19.855 18.138 1.00 1.00 N ATOM 780 CA SER A 41 12.071 19.727 19.591 1.00 1.29 C ATOM 781 C SER A 41 11.585 18.321 19.948 1.00 1.67 C ATOM 782 O SER A 41 11.482 17.451 19.105 1.00 1.32 O ATOM 783 CB SER A 41 10.977 20.734 19.941 1.00 1.67 C ATOM 784 OG SER A 41 11.422 21.552 21.015 1.00 1.31 O ATOM 0 H SER A 41 11.740 20.428 17.606 1.00 1.00 H new ATOM 0 HA SER A 41 12.981 19.921 20.159 1.00 1.29 H new ATOM 0 HB2 SER A 41 10.741 21.349 19.073 1.00 1.67 H new ATOM 0 HB3 SER A 41 10.062 20.212 20.220 1.00 1.67 H new ATOM 0 HG SER A 41 10.724 22.201 21.243 1.00 1.31 H new ATOM 790 N ALA A 42 11.261 18.100 21.205 1.00 2.45 N ATOM 791 CA ALA A 42 10.752 16.760 21.611 1.00 2.93 C ATOM 792 C ALA A 42 9.652 16.394 20.631 1.00 3.04 C ATOM 793 O ALA A 42 8.734 17.160 20.417 1.00 3.17 O ATOM 794 CB ALA A 42 10.198 16.820 23.035 1.00 3.40 C ATOM 0 H ALA A 42 11.329 18.787 21.956 1.00 2.45 H new ATOM 0 HA ALA A 42 11.548 16.015 21.597 1.00 2.93 H new ATOM 0 HB1 ALA A 42 9.828 15.836 23.323 1.00 3.40 H new ATOM 0 HB2 ALA A 42 10.989 17.126 23.720 1.00 3.40 H new ATOM 0 HB3 ALA A 42 9.382 17.541 23.078 1.00 3.40 H new ATOM 800 N ASP A 43 9.784 15.270 19.981 1.00 3.10 N ATOM 801 CA ASP A 43 8.802 14.878 18.934 1.00 3.16 C ATOM 802 C ASP A 43 9.329 15.485 17.637 1.00 2.54 C ATOM 803 O ASP A 43 9.514 14.796 16.657 1.00 3.09 O ATOM 804 CB ASP A 43 7.402 15.422 19.246 1.00 3.56 C ATOM 805 CG ASP A 43 6.349 14.406 18.798 1.00 3.92 C ATOM 806 OD1 ASP A 43 6.156 14.274 17.600 1.00 4.59 O ATOM 807 OD2 ASP A 43 5.755 13.779 19.659 1.00 3.60 O ATOM 0 H ASP A 43 10.539 14.601 20.133 1.00 3.10 H new ATOM 0 HA ASP A 43 8.703 13.794 18.873 1.00 3.16 H new ATOM 0 HB2 ASP A 43 7.305 15.615 20.314 1.00 3.56 H new ATOM 0 HB3 ASP A 43 7.247 16.372 18.735 1.00 3.56 H new ATOM 812 N LYS A 44 9.626 16.774 17.680 1.00 1.55 N ATOM 813 CA LYS A 44 10.216 17.510 16.515 1.00 1.17 C ATOM 814 C LYS A 44 9.568 18.881 16.362 1.00 1.89 C ATOM 815 O LYS A 44 8.428 19.086 16.715 1.00 3.14 O ATOM 816 CB LYS A 44 10.080 16.716 15.207 1.00 0.74 C ATOM 817 CG LYS A 44 11.243 15.701 15.015 1.00 0.53 C ATOM 818 CD LYS A 44 12.052 15.451 16.309 1.00 0.49 C ATOM 819 CE LYS A 44 12.139 13.945 16.563 1.00 0.57 C ATOM 820 NZ LYS A 44 12.583 13.708 17.967 1.00 1.18 N ATOM 0 H LYS A 44 9.476 17.357 18.503 1.00 1.55 H new ATOM 0 HA LYS A 44 11.279 17.637 16.720 1.00 1.17 H new ATOM 0 HB2 LYS A 44 9.130 16.182 15.205 1.00 0.74 H new ATOM 0 HB3 LYS A 44 10.060 17.407 14.364 1.00 0.74 H new ATOM 0 HG2 LYS A 44 10.836 14.754 14.660 1.00 0.53 H new ATOM 0 HG3 LYS A 44 11.915 16.070 14.240 1.00 0.53 H new ATOM 0 HD2 LYS A 44 13.052 15.875 16.215 1.00 0.49 H new ATOM 0 HD3 LYS A 44 11.574 15.948 17.153 1.00 0.49 H new ATOM 0 HE2 LYS A 44 11.169 13.479 16.393 1.00 0.57 H new ATOM 0 HE3 LYS A 44 12.840 13.487 15.865 1.00 0.57 H new ATOM 0 HZ1 LYS A 44 12.871 12.715 18.077 1.00 1.18 H new ATOM 0 HZ2 LYS A 44 13.389 14.328 18.186 1.00 1.18 H new ATOM 0 HZ3 LYS A 44 11.799 13.915 18.619 1.00 1.18 H new ATOM 834 N LYS A 45 10.338 19.809 15.842 1.00 1.18 N ATOM 835 CA LYS A 45 9.902 21.210 15.625 1.00 1.78 C ATOM 836 C LYS A 45 11.001 22.133 16.085 1.00 2.09 C ATOM 837 O LYS A 45 11.207 22.300 17.266 1.00 3.87 O ATOM 838 CB LYS A 45 8.725 21.572 16.458 1.00 2.07 C ATOM 839 CG LYS A 45 7.441 21.165 15.746 1.00 1.96 C ATOM 840 CD LYS A 45 6.345 20.895 16.776 1.00 2.95 C ATOM 841 CE LYS A 45 5.177 20.184 16.094 1.00 2.44 C ATOM 842 NZ LYS A 45 4.408 21.167 15.281 1.00 0.63 N ATOM 0 H LYS A 45 11.298 19.632 15.548 1.00 1.18 H new ATOM 0 HA LYS A 45 9.660 21.303 14.566 1.00 1.78 H new ATOM 0 HB2 LYS A 45 8.787 21.075 17.426 1.00 2.07 H new ATOM 0 HB3 LYS A 45 8.720 22.645 16.650 1.00 2.07 H new ATOM 0 HG2 LYS A 45 7.126 21.955 15.064 1.00 1.96 H new ATOM 0 HG3 LYS A 45 7.615 20.274 15.143 1.00 1.96 H new ATOM 0 HD2 LYS A 45 6.736 20.281 17.588 1.00 2.95 H new ATOM 0 HD3 LYS A 45 6.007 21.832 17.219 1.00 2.95 H new ATOM 0 HE2 LYS A 45 5.547 19.380 15.458 1.00 2.44 H new ATOM 0 HE3 LYS A 45 4.529 19.727 16.841 1.00 2.44 H new ATOM 0 HZ1 LYS A 45 3.612 20.686 14.816 1.00 0.63 H new ATOM 0 HZ2 LYS A 45 4.044 21.919 15.900 1.00 0.63 H new ATOM 0 HZ3 LYS A 45 5.031 21.583 14.559 1.00 0.63 H new ATOM 856 N CYS A 46 11.653 22.740 15.158 1.00 0.93 N ATOM 857 CA CYS A 46 12.744 23.707 15.435 1.00 0.95 C ATOM 858 C CYS A 46 14.063 23.076 15.068 1.00 0.73 C ATOM 859 O CYS A 46 14.219 21.885 15.089 1.00 1.15 O ATOM 860 CB CYS A 46 12.809 24.106 16.917 1.00 1.33 C ATOM 861 SG CYS A 46 11.355 25.096 17.351 1.00 1.70 S ATOM 0 H CYS A 46 11.469 22.602 14.164 1.00 0.93 H new ATOM 0 HA CYS A 46 12.543 24.601 14.845 1.00 0.95 H new ATOM 0 HB2 CYS A 46 12.852 23.214 17.542 1.00 1.33 H new ATOM 0 HB3 CYS A 46 13.718 24.675 17.110 1.00 1.33 H new ATOM 0 HG CYS A 46 11.552 26.332 17.001 1.00 1.70 H new ATOM 867 N ILE A 47 15.029 23.869 14.789 1.00 0.88 N ATOM 868 CA ILE A 47 16.354 23.318 14.492 1.00 0.63 C ATOM 869 C ILE A 47 16.801 22.614 15.785 1.00 1.07 C ATOM 870 O ILE A 47 17.622 21.740 15.782 1.00 3.33 O ATOM 871 CB ILE A 47 17.243 24.501 14.118 1.00 0.74 C ATOM 872 CG1 ILE A 47 18.016 24.220 12.839 1.00 0.80 C ATOM 873 CG2 ILE A 47 18.210 24.801 15.233 1.00 1.04 C ATOM 874 CD1 ILE A 47 17.088 23.615 11.801 1.00 0.49 C ATOM 0 H ILE A 47 14.960 24.886 14.753 1.00 0.88 H new ATOM 0 HA ILE A 47 16.386 22.603 13.670 1.00 0.63 H new ATOM 0 HB ILE A 47 16.598 25.364 13.954 1.00 0.74 H new ATOM 0 HG12 ILE A 47 18.452 25.143 12.457 1.00 0.80 H new ATOM 0 HG13 ILE A 47 18.841 23.538 13.044 1.00 0.80 H new ATOM 0 HG21 ILE A 47 18.838 25.647 14.953 1.00 1.04 H new ATOM 0 HG22 ILE A 47 17.656 25.045 16.139 1.00 1.04 H new ATOM 0 HG23 ILE A 47 18.837 23.928 15.415 1.00 1.04 H new ATOM 0 HD11 ILE A 47 17.646 23.415 10.886 1.00 0.49 H new ATOM 0 HD12 ILE A 47 16.673 22.683 12.184 1.00 0.49 H new ATOM 0 HD13 ILE A 47 16.278 24.312 11.587 1.00 0.49 H new ATOM 886 N ILE A 48 16.181 23.013 16.868 1.00 0.93 N ATOM 887 CA ILE A 48 16.382 22.479 18.232 1.00 0.48 C ATOM 888 C ILE A 48 17.806 22.149 18.585 1.00 0.63 C ATOM 889 O ILE A 48 18.680 21.993 17.781 1.00 2.01 O ATOM 890 CB ILE A 48 15.422 21.329 18.504 1.00 0.83 C ATOM 891 CG1 ILE A 48 14.332 21.866 19.421 1.00 1.32 C ATOM 892 CG2 ILE A 48 16.110 20.161 19.209 1.00 1.11 C ATOM 893 CD1 ILE A 48 14.628 21.394 20.838 1.00 0.88 C ATOM 0 H ILE A 48 15.483 23.756 16.842 1.00 0.93 H new ATOM 0 HA ILE A 48 16.141 23.297 18.911 1.00 0.48 H new ATOM 0 HB ILE A 48 15.031 20.961 17.555 1.00 0.83 H new ATOM 0 HG12 ILE A 48 14.304 22.955 19.381 1.00 1.32 H new ATOM 0 HG13 ILE A 48 13.354 21.510 19.098 1.00 1.32 H new ATOM 0 HG21 ILE A 48 15.387 19.364 19.383 1.00 1.11 H new ATOM 0 HG22 ILE A 48 16.921 19.786 18.585 1.00 1.11 H new ATOM 0 HG23 ILE A 48 16.514 20.499 20.163 1.00 1.11 H new ATOM 0 HD11 ILE A 48 13.859 21.767 21.514 1.00 0.88 H new ATOM 0 HD12 ILE A 48 14.636 20.304 20.864 1.00 0.88 H new ATOM 0 HD13 ILE A 48 15.601 21.772 21.152 1.00 0.88 H new ATOM 905 N VAL A 49 17.987 22.147 19.844 1.00 0.53 N ATOM 906 CA VAL A 49 19.293 21.964 20.503 1.00 0.67 C ATOM 907 C VAL A 49 20.181 20.820 20.021 1.00 2.15 C ATOM 908 O VAL A 49 21.205 21.079 19.452 1.00 4.29 O ATOM 909 CB VAL A 49 19.008 21.846 21.971 1.00 1.39 C ATOM 910 CG1 VAL A 49 20.290 21.491 22.696 1.00 0.50 C ATOM 911 CG2 VAL A 49 18.457 23.196 22.425 1.00 3.46 C ATOM 0 H VAL A 49 17.222 22.275 20.506 1.00 0.53 H new ATOM 0 HA VAL A 49 19.900 22.829 20.238 1.00 0.67 H new ATOM 0 HB VAL A 49 18.282 21.063 22.189 1.00 1.39 H new ATOM 0 HG11 VAL A 49 20.092 21.403 23.764 1.00 0.50 H new ATOM 0 HG12 VAL A 49 20.671 20.542 22.318 1.00 0.50 H new ATOM 0 HG13 VAL A 49 21.031 22.272 22.528 1.00 0.50 H new ATOM 0 HG21 VAL A 49 18.234 23.158 23.491 1.00 3.46 H new ATOM 0 HG22 VAL A 49 19.198 23.973 22.237 1.00 3.46 H new ATOM 0 HG23 VAL A 49 17.545 23.422 21.872 1.00 3.46 H new ATOM 921 N GLU A 50 19.871 19.588 20.278 1.00 1.81 N ATOM 922 CA GLU A 50 20.786 18.500 19.834 1.00 3.94 C ATOM 923 C GLU A 50 20.434 17.194 20.514 1.00 3.04 C ATOM 924 O GLU A 50 21.263 16.326 20.638 1.00 4.40 O ATOM 925 CB GLU A 50 22.253 18.851 20.140 1.00 6.51 C ATOM 926 CG GLU A 50 22.372 19.437 21.550 1.00 7.58 C ATOM 927 CD GLU A 50 23.173 20.742 21.514 1.00 10.03 C ATOM 928 OE1 GLU A 50 23.773 21.022 20.492 1.00 10.81 O ATOM 929 OE2 GLU A 50 23.171 21.441 22.515 1.00 11.17 O ATOM 0 H GLU A 50 19.032 19.284 20.772 1.00 1.81 H new ATOM 0 HA GLU A 50 20.665 18.391 18.756 1.00 3.94 H new ATOM 0 HB2 GLU A 50 22.874 17.959 20.055 1.00 6.51 H new ATOM 0 HB3 GLU A 50 22.624 19.568 19.407 1.00 6.51 H new ATOM 0 HG2 GLU A 50 21.379 19.622 21.960 1.00 7.58 H new ATOM 0 HG3 GLU A 50 22.860 18.720 22.210 1.00 7.58 H new ATOM 936 N GLU A 51 19.205 17.023 20.898 1.00 1.55 N ATOM 937 CA GLU A 51 18.769 15.724 21.486 1.00 0.94 C ATOM 938 C GLU A 51 19.795 15.105 22.435 1.00 0.77 C ATOM 939 O GLU A 51 19.763 13.925 22.729 1.00 0.84 O ATOM 940 CB GLU A 51 18.575 14.817 20.306 1.00 0.56 C ATOM 941 CG GLU A 51 19.920 14.525 19.657 1.00 0.92 C ATOM 942 CD GLU A 51 19.798 13.302 18.745 1.00 2.29 C ATOM 943 OE1 GLU A 51 18.957 12.462 19.022 1.00 2.09 O ATOM 944 OE2 GLU A 51 20.547 13.226 17.786 1.00 4.03 O ATOM 0 H GLU A 51 18.474 17.732 20.831 1.00 1.55 H new ATOM 0 HA GLU A 51 17.872 15.872 22.088 1.00 0.94 H new ATOM 0 HB2 GLU A 51 18.104 13.887 20.624 1.00 0.56 H new ATOM 0 HB3 GLU A 51 17.905 15.283 19.583 1.00 0.56 H new ATOM 0 HG2 GLU A 51 20.252 15.389 19.081 1.00 0.92 H new ATOM 0 HG3 GLU A 51 20.673 14.345 20.424 1.00 0.92 H new ATOM 951 N GLY A 52 20.673 15.891 22.921 1.00 0.59 N ATOM 952 CA GLY A 52 21.708 15.382 23.878 1.00 0.47 C ATOM 953 C GLY A 52 23.067 15.184 23.183 1.00 0.32 C ATOM 954 O GLY A 52 23.708 14.164 23.342 1.00 0.42 O ATOM 0 H GLY A 52 20.739 16.886 22.707 1.00 0.59 H new ATOM 0 HA2 GLY A 52 21.819 16.085 24.704 1.00 0.47 H new ATOM 0 HA3 GLY A 52 21.376 14.436 24.307 1.00 0.47 H new ATOM 958 N LYS A 53 23.520 16.153 22.433 1.00 0.25 N ATOM 959 CA LYS A 53 24.833 16.037 21.751 1.00 0.11 C ATOM 960 C LYS A 53 25.636 17.310 22.069 1.00 0.13 C ATOM 961 O LYS A 53 25.510 17.871 23.134 1.00 0.38 O ATOM 962 CB LYS A 53 24.594 15.968 20.233 1.00 0.15 C ATOM 963 CG LYS A 53 23.344 15.144 19.902 1.00 0.29 C ATOM 964 CD LYS A 53 23.758 13.835 19.243 1.00 0.39 C ATOM 965 CE LYS A 53 24.505 13.005 20.287 1.00 0.34 C ATOM 966 NZ LYS A 53 23.949 11.625 20.314 1.00 0.70 N ATOM 0 H LYS A 53 23.026 17.030 22.264 1.00 0.25 H new ATOM 0 HA LYS A 53 25.368 15.147 22.082 1.00 0.11 H new ATOM 0 HB2 LYS A 53 24.483 16.976 19.834 1.00 0.15 H new ATOM 0 HB3 LYS A 53 25.463 15.526 19.746 1.00 0.15 H new ATOM 0 HG2 LYS A 53 22.777 14.942 20.811 1.00 0.29 H new ATOM 0 HG3 LYS A 53 22.690 15.707 19.237 1.00 0.29 H new ATOM 0 HD2 LYS A 53 22.883 13.296 18.881 1.00 0.39 H new ATOM 0 HD3 LYS A 53 24.395 14.026 18.379 1.00 0.39 H new ATOM 0 HE2 LYS A 53 25.569 12.975 20.051 1.00 0.34 H new ATOM 0 HE3 LYS A 53 24.410 13.466 21.270 1.00 0.34 H new ATOM 0 HZ1 LYS A 53 24.211 11.163 21.208 1.00 0.70 H new ATOM 0 HZ2 LYS A 53 22.913 11.667 20.236 1.00 0.70 H new ATOM 0 HZ3 LYS A 53 24.334 11.080 19.516 1.00 0.70 H new ATOM 980 N GLU A 54 26.396 17.781 21.109 1.00 0.20 N ATOM 981 CA GLU A 54 27.176 19.065 21.227 1.00 0.26 C ATOM 982 C GLU A 54 28.564 18.943 21.849 1.00 0.25 C ATOM 983 O GLU A 54 28.804 18.233 22.804 1.00 0.29 O ATOM 984 CB GLU A 54 26.391 20.128 22.021 1.00 0.32 C ATOM 985 CG GLU A 54 27.343 20.916 22.950 1.00 0.28 C ATOM 986 CD GLU A 54 27.625 20.098 24.215 1.00 0.94 C ATOM 987 OE1 GLU A 54 26.948 19.107 24.420 1.00 2.37 O ATOM 988 OE2 GLU A 54 28.514 20.480 24.956 1.00 0.75 O ATOM 0 H GLU A 54 26.515 17.312 20.211 1.00 0.20 H new ATOM 0 HA GLU A 54 27.320 19.363 20.189 1.00 0.26 H new ATOM 0 HB2 GLU A 54 25.895 20.812 21.333 1.00 0.32 H new ATOM 0 HB3 GLU A 54 25.611 19.648 22.612 1.00 0.32 H new ATOM 0 HG2 GLU A 54 28.276 21.133 22.430 1.00 0.28 H new ATOM 0 HG3 GLU A 54 26.896 21.874 23.217 1.00 0.28 H new ATOM 995 N ILE A 55 29.449 19.754 21.316 1.00 0.28 N ATOM 996 CA ILE A 55 30.820 19.889 21.806 1.00 0.43 C ATOM 997 C ILE A 55 30.979 21.383 22.035 1.00 0.91 C ATOM 998 O ILE A 55 30.119 22.150 21.663 1.00 1.22 O ATOM 999 CB ILE A 55 31.762 19.458 20.720 1.00 0.26 C ATOM 1000 CG1 ILE A 55 32.308 18.113 21.044 1.00 0.15 C ATOM 1001 CG2 ILE A 55 32.970 20.382 20.597 1.00 0.33 C ATOM 1002 CD1 ILE A 55 33.121 17.783 19.854 1.00 0.18 C ATOM 0 H ILE A 55 29.242 20.352 20.516 1.00 0.28 H new ATOM 0 HA ILE A 55 31.022 19.296 22.698 1.00 0.43 H new ATOM 0 HB ILE A 55 31.190 19.470 19.792 1.00 0.26 H new ATOM 0 HG12 ILE A 55 32.911 18.131 21.952 1.00 0.15 H new ATOM 0 HG13 ILE A 55 31.514 17.384 21.204 1.00 0.15 H new ATOM 0 HG21 ILE A 55 33.620 20.026 19.798 1.00 0.33 H new ATOM 0 HG22 ILE A 55 32.633 21.393 20.368 1.00 0.33 H new ATOM 0 HG23 ILE A 55 33.521 20.388 21.537 1.00 0.33 H new ATOM 0 HD11 ILE A 55 33.576 16.801 19.985 1.00 0.18 H new ATOM 0 HD12 ILE A 55 32.484 17.773 18.970 1.00 0.18 H new ATOM 0 HD13 ILE A 55 33.903 18.532 19.729 1.00 0.18 H new ATOM 1014 N LEU A 56 32.048 21.833 22.565 1.00 1.12 N ATOM 1015 CA LEU A 56 32.189 23.301 22.700 1.00 1.70 C ATOM 1016 C LEU A 56 33.645 23.684 22.690 1.00 0.91 C ATOM 1017 O LEU A 56 34.021 24.661 23.290 1.00 0.75 O ATOM 1018 CB LEU A 56 31.520 23.795 23.966 1.00 2.64 C ATOM 1019 CG LEU A 56 31.345 22.634 24.920 1.00 1.97 C ATOM 1020 CD1 LEU A 56 32.722 22.083 25.253 1.00 2.52 C ATOM 1021 CD2 LEU A 56 30.652 23.139 26.178 1.00 3.36 C ATOM 0 H LEU A 56 32.827 21.272 22.910 1.00 1.12 H new ATOM 0 HA LEU A 56 31.694 23.773 21.851 1.00 1.70 H new ATOM 0 HB2 LEU A 56 32.123 24.575 24.430 1.00 2.64 H new ATOM 0 HB3 LEU A 56 30.552 24.238 23.731 1.00 2.64 H new ATOM 0 HG LEU A 56 30.738 21.845 24.476 1.00 1.97 H new ATOM 0 HD11 LEU A 56 32.621 21.243 25.941 1.00 2.52 H new ATOM 0 HD12 LEU A 56 33.210 21.746 24.338 1.00 2.52 H new ATOM 0 HD13 LEU A 56 33.323 22.864 25.719 1.00 2.52 H new ATOM 0 HD21 LEU A 56 30.518 22.313 26.876 1.00 3.36 H new ATOM 0 HD22 LEU A 56 31.262 23.913 26.644 1.00 3.36 H new ATOM 0 HD23 LEU A 56 29.679 23.553 25.916 1.00 3.36 H new ATOM 1033 N VAL A 57 34.460 22.942 21.975 1.00 0.66 N ATOM 1034 CA VAL A 57 35.909 23.263 21.900 1.00 0.87 C ATOM 1035 C VAL A 57 36.579 22.997 23.261 1.00 0.81 C ATOM 1036 O VAL A 57 37.527 22.246 23.345 1.00 1.40 O ATOM 1037 CB VAL A 57 36.120 24.707 21.423 1.00 1.44 C ATOM 1038 CG1 VAL A 57 34.834 25.269 20.801 1.00 1.80 C ATOM 1039 CG2 VAL A 57 36.582 25.612 22.574 1.00 1.26 C ATOM 0 H VAL A 57 34.174 22.123 21.439 1.00 0.66 H new ATOM 0 HA VAL A 57 36.384 22.613 21.165 1.00 0.87 H new ATOM 0 HB VAL A 57 36.902 24.690 20.663 1.00 1.44 H new ATOM 0 HG11 VAL A 57 35.007 26.293 20.470 1.00 1.80 H new ATOM 0 HG12 VAL A 57 34.545 24.656 19.947 1.00 1.80 H new ATOM 0 HG13 VAL A 57 34.036 25.258 21.543 1.00 1.80 H new ATOM 0 HG21 VAL A 57 36.723 26.628 22.204 1.00 1.26 H new ATOM 0 HG22 VAL A 57 35.828 25.613 23.361 1.00 1.26 H new ATOM 0 HG23 VAL A 57 37.524 25.238 22.975 1.00 1.26 H new ATOM 1049 N GLY A 58 36.102 23.573 24.331 1.00 0.59 N ATOM 1050 CA GLY A 58 36.729 23.300 25.653 1.00 1.30 C ATOM 1051 C GLY A 58 36.878 21.791 25.822 1.00 1.18 C ATOM 1052 O GLY A 58 37.969 21.278 25.976 1.00 1.23 O ATOM 0 H GLY A 58 35.311 24.216 24.346 1.00 0.59 H new ATOM 0 HA2 GLY A 58 37.703 23.785 25.717 1.00 1.30 H new ATOM 0 HA3 GLY A 58 36.115 23.711 26.454 1.00 1.30 H new ATOM 1056 N ASP A 59 35.789 21.072 25.782 1.00 1.05 N ATOM 1057 CA ASP A 59 35.882 19.597 25.928 1.00 1.00 C ATOM 1058 C ASP A 59 36.993 19.098 25.021 1.00 0.94 C ATOM 1059 O ASP A 59 37.807 18.309 25.415 1.00 1.11 O ATOM 1060 CB ASP A 59 34.571 18.932 25.511 1.00 0.91 C ATOM 1061 CG ASP A 59 33.555 19.034 26.651 1.00 1.01 C ATOM 1062 OD1 ASP A 59 33.692 19.933 27.463 1.00 1.09 O ATOM 1063 OD2 ASP A 59 32.656 18.209 26.692 1.00 1.02 O ATOM 0 H ASP A 59 34.847 21.442 25.655 1.00 1.05 H new ATOM 0 HA ASP A 59 36.085 19.350 26.970 1.00 1.00 H new ATOM 0 HB2 ASP A 59 34.177 19.413 24.616 1.00 0.91 H new ATOM 0 HB3 ASP A 59 34.746 17.886 25.260 1.00 0.91 H new ATOM 1068 N VAL A 60 37.033 19.558 23.804 1.00 0.75 N ATOM 1069 CA VAL A 60 38.105 19.104 22.878 1.00 0.76 C ATOM 1070 C VAL A 60 39.440 19.131 23.626 1.00 0.90 C ATOM 1071 O VAL A 60 40.101 20.147 23.718 1.00 0.98 O ATOM 1072 CB VAL A 60 38.153 20.030 21.658 1.00 0.67 C ATOM 1073 CG1 VAL A 60 39.186 19.517 20.668 1.00 0.78 C ATOM 1074 CG2 VAL A 60 36.782 20.053 20.973 1.00 0.61 C ATOM 0 H VAL A 60 36.371 20.227 23.411 1.00 0.75 H new ATOM 0 HA VAL A 60 37.905 18.090 22.533 1.00 0.76 H new ATOM 0 HB VAL A 60 38.420 21.035 21.986 1.00 0.67 H new ATOM 0 HG11 VAL A 60 39.218 20.177 19.801 1.00 0.78 H new ATOM 0 HG12 VAL A 60 40.166 19.495 21.144 1.00 0.78 H new ATOM 0 HG13 VAL A 60 38.915 18.511 20.348 1.00 0.78 H new ATOM 0 HG21 VAL A 60 36.820 20.712 20.106 1.00 0.61 H new ATOM 0 HG22 VAL A 60 36.519 19.045 20.651 1.00 0.61 H new ATOM 0 HG23 VAL A 60 36.031 20.418 21.674 1.00 0.61 H new ATOM 1084 N GLY A 61 39.826 18.012 24.176 1.00 0.95 N ATOM 1085 CA GLY A 61 41.106 17.939 24.941 1.00 1.10 C ATOM 1086 C GLY A 61 40.903 17.135 26.233 1.00 1.21 C ATOM 1087 O GLY A 61 41.825 16.919 26.995 1.00 1.44 O ATOM 0 H GLY A 61 39.305 17.136 24.128 1.00 0.95 H new ATOM 0 HA2 GLY A 61 41.878 17.471 24.330 1.00 1.10 H new ATOM 0 HA3 GLY A 61 41.454 18.944 25.180 1.00 1.10 H new ATOM 1091 N VAL A 62 39.710 16.667 26.462 1.00 1.09 N ATOM 1092 CA VAL A 62 39.421 15.844 27.669 1.00 1.18 C ATOM 1093 C VAL A 62 38.786 14.569 27.157 1.00 1.18 C ATOM 1094 O VAL A 62 39.453 13.600 26.853 1.00 1.31 O ATOM 1095 CB VAL A 62 38.421 16.550 28.586 1.00 1.17 C ATOM 1096 CG1 VAL A 62 39.109 16.965 29.886 1.00 1.76 C ATOM 1097 CG2 VAL A 62 37.846 17.785 27.894 1.00 2.38 C ATOM 0 H VAL A 62 38.907 16.823 25.852 1.00 1.09 H new ATOM 0 HA VAL A 62 40.333 15.666 28.239 1.00 1.18 H new ATOM 0 HB VAL A 62 37.608 15.860 28.811 1.00 1.17 H new ATOM 0 HG11 VAL A 62 38.390 17.467 30.534 1.00 1.76 H new ATOM 0 HG12 VAL A 62 39.496 16.080 30.391 1.00 1.76 H new ATOM 0 HG13 VAL A 62 39.932 17.644 29.662 1.00 1.76 H new ATOM 0 HG21 VAL A 62 37.136 18.277 28.559 1.00 2.38 H new ATOM 0 HG22 VAL A 62 38.654 18.475 27.651 1.00 2.38 H new ATOM 0 HG23 VAL A 62 37.337 17.485 26.978 1.00 2.38 H new ATOM 1107 N THR A 63 37.499 14.593 26.978 1.00 1.06 N ATOM 1108 CA THR A 63 36.826 13.428 26.395 1.00 1.07 C ATOM 1109 C THR A 63 37.247 13.401 24.933 1.00 0.95 C ATOM 1110 O THR A 63 37.107 12.413 24.240 1.00 0.95 O ATOM 1111 CB THR A 63 35.319 13.626 26.486 1.00 0.99 C ATOM 1112 OG1 THR A 63 34.907 13.562 27.845 1.00 1.16 O ATOM 1113 CG2 THR A 63 34.622 12.538 25.679 1.00 0.98 C ATOM 0 H THR A 63 36.890 15.377 27.214 1.00 1.06 H new ATOM 0 HA THR A 63 37.085 12.502 26.909 1.00 1.07 H new ATOM 0 HB THR A 63 35.053 14.603 26.083 1.00 0.99 H new ATOM 0 HG1 THR A 63 33.937 13.692 27.899 1.00 1.16 H new ATOM 0 HG21 THR A 63 33.542 12.675 25.740 1.00 0.98 H new ATOM 0 HG22 THR A 63 34.937 12.600 24.637 1.00 0.98 H new ATOM 0 HG23 THR A 63 34.887 11.560 26.081 1.00 0.98 H new ATOM 1121 N ILE A 64 37.766 14.514 24.466 1.00 0.89 N ATOM 1122 CA ILE A 64 38.210 14.610 23.055 1.00 0.83 C ATOM 1123 C ILE A 64 39.662 15.113 23.046 1.00 0.97 C ATOM 1124 O ILE A 64 40.241 15.326 24.094 1.00 1.20 O ATOM 1125 CB ILE A 64 37.278 15.575 22.321 1.00 0.72 C ATOM 1126 CG1 ILE A 64 36.435 16.366 23.330 1.00 0.71 C ATOM 1127 CG2 ILE A 64 36.323 14.771 21.450 1.00 0.70 C ATOM 1128 CD1 ILE A 64 35.268 17.033 22.594 1.00 0.55 C ATOM 0 H ILE A 64 37.898 15.363 25.015 1.00 0.89 H new ATOM 0 HA ILE A 64 38.171 13.644 22.551 1.00 0.83 H new ATOM 0 HB ILE A 64 37.880 16.258 21.721 1.00 0.72 H new ATOM 0 HG12 ILE A 64 36.059 15.702 24.108 1.00 0.71 H new ATOM 0 HG13 ILE A 64 37.048 17.120 23.824 1.00 0.71 H new ATOM 0 HG21 ILE A 64 35.653 15.450 20.922 1.00 0.70 H new ATOM 0 HG22 ILE A 64 36.893 14.188 20.727 1.00 0.70 H new ATOM 0 HG23 ILE A 64 35.737 14.099 22.077 1.00 0.70 H new ATOM 0 HD11 ILE A 64 34.664 17.597 23.305 1.00 0.55 H new ATOM 0 HD12 ILE A 64 35.657 17.708 21.832 1.00 0.55 H new ATOM 0 HD13 ILE A 64 34.652 16.269 22.121 1.00 0.55 H new ATOM 1140 N THR A 65 40.285 15.281 21.904 1.00 1.00 N ATOM 1141 CA THR A 65 41.711 15.737 21.936 1.00 1.15 C ATOM 1142 C THR A 65 42.081 16.608 20.740 1.00 1.16 C ATOM 1143 O THR A 65 43.198 16.542 20.270 1.00 1.24 O ATOM 1144 CB THR A 65 42.627 14.512 21.979 1.00 1.28 C ATOM 1145 OG1 THR A 65 42.517 13.796 20.755 1.00 0.68 O ATOM 1146 CG2 THR A 65 42.213 13.609 23.141 1.00 1.90 C ATOM 0 H THR A 65 39.884 15.128 20.979 1.00 1.00 H new ATOM 0 HA THR A 65 41.838 16.350 22.828 1.00 1.15 H new ATOM 0 HB THR A 65 43.659 14.832 22.119 1.00 1.28 H new ATOM 0 HG1 THR A 65 43.105 13.012 20.781 1.00 0.68 H new ATOM 0 HG21 THR A 65 42.864 12.736 23.173 1.00 1.90 H new ATOM 0 HG22 THR A 65 42.298 14.160 24.078 1.00 1.90 H new ATOM 0 HG23 THR A 65 41.181 13.287 23.002 1.00 1.90 H new ATOM 1154 N ASP A 66 41.178 17.447 20.278 1.00 1.10 N ATOM 1155 CA ASP A 66 41.500 18.386 19.145 1.00 1.14 C ATOM 1156 C ASP A 66 41.021 17.941 17.740 1.00 1.08 C ATOM 1157 O ASP A 66 40.973 18.774 16.857 1.00 1.12 O ATOM 1158 CB ASP A 66 43.002 18.651 19.123 1.00 1.26 C ATOM 1159 CG ASP A 66 43.270 20.052 18.567 1.00 1.33 C ATOM 1160 OD1 ASP A 66 42.395 20.894 18.689 1.00 1.80 O ATOM 1161 OD2 ASP A 66 44.345 20.261 18.031 1.00 1.07 O ATOM 0 H ASP A 66 40.227 17.523 20.638 1.00 1.10 H new ATOM 0 HA ASP A 66 40.932 19.293 19.353 1.00 1.14 H new ATOM 0 HB2 ASP A 66 43.411 18.564 20.130 1.00 1.26 H new ATOM 0 HB3 ASP A 66 43.504 17.903 18.509 1.00 1.26 H new ATOM 1166 N PRO A 67 40.665 16.694 17.528 1.00 1.00 N ATOM 1167 CA PRO A 67 40.196 16.265 16.207 1.00 0.96 C ATOM 1168 C PRO A 67 38.748 16.743 16.041 1.00 0.95 C ATOM 1169 O PRO A 67 38.452 17.905 16.240 1.00 1.18 O ATOM 1170 CB PRO A 67 40.315 14.735 16.261 1.00 0.89 C ATOM 1171 CG PRO A 67 40.275 14.358 17.754 1.00 0.89 C ATOM 1172 CD PRO A 67 40.682 15.621 18.530 1.00 0.98 C ATOM 0 HA PRO A 67 40.754 16.666 15.361 1.00 0.96 H new ATOM 0 HB2 PRO A 67 39.498 14.261 15.717 1.00 0.89 H new ATOM 0 HB3 PRO A 67 41.243 14.399 15.799 1.00 0.89 H new ATOM 0 HG2 PRO A 67 39.278 14.028 18.045 1.00 0.89 H new ATOM 0 HG3 PRO A 67 40.958 13.535 17.965 1.00 0.89 H new ATOM 0 HD2 PRO A 67 39.987 15.828 19.344 1.00 0.98 H new ATOM 0 HD3 PRO A 67 41.671 15.511 18.976 1.00 0.98 H new ATOM 1180 N PHE A 68 37.844 15.881 15.686 1.00 0.71 N ATOM 1181 CA PHE A 68 36.435 16.330 15.523 1.00 0.74 C ATOM 1182 C PHE A 68 35.500 15.112 15.409 1.00 0.51 C ATOM 1183 O PHE A 68 34.331 15.185 15.734 1.00 0.47 O ATOM 1184 CB PHE A 68 36.331 17.136 14.239 1.00 1.02 C ATOM 1185 CG PHE A 68 35.876 16.192 13.181 1.00 1.03 C ATOM 1186 CD1 PHE A 68 36.737 15.188 12.753 1.00 0.84 C ATOM 1187 CD2 PHE A 68 34.586 16.281 12.672 1.00 1.40 C ATOM 1188 CE1 PHE A 68 36.313 14.265 11.811 1.00 1.01 C ATOM 1189 CE2 PHE A 68 34.154 15.355 11.730 1.00 1.59 C ATOM 1190 CZ PHE A 68 35.015 14.341 11.296 1.00 1.40 C ATOM 0 H PHE A 68 38.015 14.892 15.502 1.00 0.71 H new ATOM 0 HA PHE A 68 36.146 16.930 16.386 1.00 0.74 H new ATOM 0 HB2 PHE A 68 35.625 17.959 14.354 1.00 1.02 H new ATOM 0 HB3 PHE A 68 37.294 17.576 13.978 1.00 1.02 H new ATOM 0 HD1 PHE A 68 37.737 15.128 13.155 1.00 0.84 H new ATOM 0 HD2 PHE A 68 33.923 17.065 13.006 1.00 1.40 H new ATOM 0 HE1 PHE A 68 36.984 13.488 11.475 1.00 1.01 H new ATOM 0 HE2 PHE A 68 33.152 15.418 11.332 1.00 1.59 H new ATOM 0 HZ PHE A 68 34.678 13.620 10.566 1.00 1.40 H new ATOM 1200 N LYS A 69 35.998 14.003 14.921 1.00 0.47 N ATOM 1201 CA LYS A 69 35.140 12.799 14.753 1.00 0.51 C ATOM 1202 C LYS A 69 34.476 12.453 16.074 1.00 0.32 C ATOM 1203 O LYS A 69 33.439 11.844 16.104 1.00 0.23 O ATOM 1204 CB LYS A 69 35.992 11.623 14.280 1.00 0.63 C ATOM 1205 CG LYS A 69 36.702 10.995 15.480 1.00 0.95 C ATOM 1206 CD LYS A 69 35.986 9.702 15.878 1.00 1.88 C ATOM 1207 CE LYS A 69 35.866 8.789 14.657 1.00 2.01 C ATOM 1208 NZ LYS A 69 35.803 7.370 15.101 1.00 3.12 N ATOM 0 H LYS A 69 36.969 13.883 14.631 1.00 0.47 H new ATOM 0 HA LYS A 69 34.370 13.007 14.010 1.00 0.51 H new ATOM 0 HB2 LYS A 69 35.365 10.881 13.785 1.00 0.63 H new ATOM 0 HB3 LYS A 69 36.724 11.962 13.547 1.00 0.63 H new ATOM 0 HG2 LYS A 69 37.742 10.785 15.232 1.00 0.95 H new ATOM 0 HG3 LYS A 69 36.709 11.692 16.318 1.00 0.95 H new ATOM 0 HD2 LYS A 69 36.539 9.197 16.670 1.00 1.88 H new ATOM 0 HD3 LYS A 69 34.996 9.929 16.274 1.00 1.88 H new ATOM 0 HE2 LYS A 69 34.972 9.043 14.087 1.00 2.01 H new ATOM 0 HE3 LYS A 69 36.719 8.936 13.995 1.00 2.01 H new ATOM 0 HZ1 LYS A 69 35.721 6.750 14.270 1.00 3.12 H new ATOM 0 HZ2 LYS A 69 36.668 7.132 15.627 1.00 3.12 H new ATOM 0 HZ3 LYS A 69 34.975 7.235 15.716 1.00 3.12 H new ATOM 1222 N HIS A 70 35.031 12.839 17.176 1.00 0.31 N ATOM 1223 CA HIS A 70 34.336 12.511 18.437 1.00 0.25 C ATOM 1224 C HIS A 70 32.932 13.100 18.343 1.00 0.24 C ATOM 1225 O HIS A 70 31.946 12.455 18.637 1.00 0.26 O ATOM 1226 CB HIS A 70 35.035 13.137 19.622 1.00 0.32 C ATOM 1227 CG HIS A 70 33.980 13.767 20.473 1.00 0.38 C ATOM 1228 ND1 HIS A 70 33.645 15.073 20.686 1.00 0.50 N flip ATOM 1229 CD2 HIS A 70 33.100 13.024 21.231 1.00 0.46 C flip ATOM 1230 CE1 HIS A 70 32.575 15.151 21.559 1.00 0.50 C flip ATOM 1231 NE2 HIS A 70 32.287 13.889 21.855 1.00 0.49 N flip ATOM 0 H HIS A 70 35.909 13.352 17.261 1.00 0.31 H new ATOM 0 HA HIS A 70 34.323 11.430 18.576 1.00 0.25 H new ATOM 0 HB2 HIS A 70 35.586 12.384 20.186 1.00 0.32 H new ATOM 0 HB3 HIS A 70 35.759 13.882 19.292 1.00 0.32 H new ATOM 0 HD2 HIS A 70 33.071 11.947 21.308 1.00 0.46 H new ATOM 0 HE1 HIS A 70 32.082 16.042 21.920 1.00 0.50 H new ATOM 0 HE2 HIS A 70 31.534 13.610 22.484 1.00 0.49 H new ATOM 1239 N PHE A 71 32.848 14.339 17.925 1.00 0.26 N ATOM 1240 CA PHE A 71 31.529 15.006 17.793 1.00 0.29 C ATOM 1241 C PHE A 71 30.707 14.279 16.735 1.00 0.28 C ATOM 1242 O PHE A 71 29.504 14.165 16.848 1.00 0.22 O ATOM 1243 CB PHE A 71 31.747 16.480 17.404 1.00 0.46 C ATOM 1244 CG PHE A 71 30.684 16.986 16.470 1.00 0.39 C ATOM 1245 CD1 PHE A 71 30.640 16.558 15.140 1.00 0.37 C ATOM 1246 CD2 PHE A 71 29.742 17.908 16.944 1.00 0.37 C ATOM 1247 CE1 PHE A 71 29.653 17.055 14.282 1.00 0.36 C ATOM 1248 CE2 PHE A 71 28.759 18.400 16.092 1.00 0.36 C ATOM 1249 CZ PHE A 71 28.711 17.976 14.757 1.00 0.36 C ATOM 0 H PHE A 71 33.648 14.917 17.669 1.00 0.26 H new ATOM 0 HA PHE A 71 30.988 14.972 18.738 1.00 0.29 H new ATOM 0 HB2 PHE A 71 31.758 17.093 18.305 1.00 0.46 H new ATOM 0 HB3 PHE A 71 32.724 16.588 16.932 1.00 0.46 H new ATOM 0 HD1 PHE A 71 31.366 15.846 14.776 1.00 0.37 H new ATOM 0 HD2 PHE A 71 29.779 18.237 17.972 1.00 0.37 H new ATOM 0 HE1 PHE A 71 29.618 16.728 13.253 1.00 0.36 H new ATOM 0 HE2 PHE A 71 28.032 19.109 16.459 1.00 0.36 H new ATOM 0 HZ PHE A 71 27.948 18.359 14.095 1.00 0.36 H new ATOM 1259 N VAL A 72 31.334 13.744 15.720 1.00 0.44 N ATOM 1260 CA VAL A 72 30.548 12.998 14.723 1.00 0.59 C ATOM 1261 C VAL A 72 29.935 11.830 15.472 1.00 0.54 C ATOM 1262 O VAL A 72 28.834 11.388 15.212 1.00 0.62 O ATOM 1263 CB VAL A 72 31.445 12.517 13.579 1.00 0.77 C ATOM 1264 CG1 VAL A 72 32.361 13.649 13.114 1.00 0.85 C ATOM 1265 CG2 VAL A 72 32.283 11.289 13.970 1.00 0.80 C ATOM 0 H VAL A 72 32.338 13.795 15.549 1.00 0.44 H new ATOM 0 HA VAL A 72 29.778 13.620 14.267 1.00 0.59 H new ATOM 0 HB VAL A 72 30.790 12.217 12.761 1.00 0.77 H new ATOM 0 HG11 VAL A 72 32.994 13.294 12.300 1.00 0.85 H new ATOM 0 HG12 VAL A 72 31.756 14.486 12.765 1.00 0.85 H new ATOM 0 HG13 VAL A 72 32.987 13.975 13.945 1.00 0.85 H new ATOM 0 HG21 VAL A 72 32.902 10.987 13.125 1.00 0.80 H new ATOM 0 HG22 VAL A 72 32.922 11.539 14.817 1.00 0.80 H new ATOM 0 HG23 VAL A 72 31.620 10.469 14.246 1.00 0.80 H new ATOM 1275 N GLY A 73 30.656 11.374 16.445 1.00 0.48 N ATOM 1276 CA GLY A 73 30.172 10.272 17.303 1.00 0.53 C ATOM 1277 C GLY A 73 28.921 10.781 17.995 1.00 0.38 C ATOM 1278 O GLY A 73 27.949 10.069 18.141 1.00 0.44 O ATOM 0 H GLY A 73 31.582 11.727 16.687 1.00 0.48 H new ATOM 0 HA2 GLY A 73 29.953 9.385 16.708 1.00 0.53 H new ATOM 0 HA3 GLY A 73 30.930 9.987 18.033 1.00 0.53 H new ATOM 1282 N MET A 74 28.908 12.037 18.378 1.00 0.17 N ATOM 1283 CA MET A 74 27.680 12.575 18.992 1.00 0.12 C ATOM 1284 C MET A 74 26.590 12.338 17.966 1.00 0.28 C ATOM 1285 O MET A 74 25.495 11.933 18.270 1.00 1.02 O ATOM 1286 CB MET A 74 27.851 14.067 19.284 1.00 0.10 C ATOM 1287 CG MET A 74 28.917 14.253 20.373 1.00 0.25 C ATOM 1288 SD MET A 74 28.852 15.943 20.999 1.00 0.47 S ATOM 1289 CE MET A 74 29.825 16.679 19.667 1.00 0.20 C ATOM 0 H MET A 74 29.685 12.692 18.289 1.00 0.17 H new ATOM 0 HA MET A 74 27.443 12.097 19.942 1.00 0.12 H new ATOM 0 HB2 MET A 74 28.145 14.595 18.377 1.00 0.10 H new ATOM 0 HB3 MET A 74 26.903 14.496 19.610 1.00 0.10 H new ATOM 0 HG2 MET A 74 28.748 13.546 21.186 1.00 0.25 H new ATOM 0 HG3 MET A 74 29.907 14.042 19.967 1.00 0.25 H new ATOM 0 HE1 MET A 74 29.777 17.766 19.739 1.00 0.20 H new ATOM 0 HE2 MET A 74 30.862 16.356 19.753 1.00 0.20 H new ATOM 0 HE3 MET A 74 29.424 16.361 18.705 1.00 0.20 H new ATOM 1299 N LEU A 75 26.928 12.531 16.730 1.00 0.39 N ATOM 1300 CA LEU A 75 25.965 12.281 15.632 1.00 0.31 C ATOM 1301 C LEU A 75 25.734 10.767 15.509 1.00 0.36 C ATOM 1302 O LEU A 75 26.621 10.056 15.079 1.00 0.48 O ATOM 1303 CB LEU A 75 26.580 12.776 14.326 1.00 0.30 C ATOM 1304 CG LEU A 75 27.284 14.105 14.536 1.00 0.18 C ATOM 1305 CD1 LEU A 75 27.728 14.617 13.177 1.00 0.50 C ATOM 1306 CD2 LEU A 75 26.313 15.100 15.151 1.00 0.26 C ATOM 0 H LEU A 75 27.846 12.857 16.428 1.00 0.39 H new ATOM 0 HA LEU A 75 25.025 12.794 15.835 1.00 0.31 H new ATOM 0 HB2 LEU A 75 27.289 12.039 13.949 1.00 0.30 H new ATOM 0 HB3 LEU A 75 25.802 12.886 13.570 1.00 0.30 H new ATOM 0 HG LEU A 75 28.140 13.982 15.200 1.00 0.18 H new ATOM 0 HD11 LEU A 75 28.238 15.573 13.297 1.00 0.50 H new ATOM 0 HD12 LEU A 75 28.408 13.897 12.722 1.00 0.50 H new ATOM 0 HD13 LEU A 75 26.857 14.749 12.535 1.00 0.50 H new ATOM 0 HD21 LEU A 75 26.817 16.054 15.302 1.00 0.26 H new ATOM 0 HD22 LEU A 75 25.464 15.240 14.482 1.00 0.26 H new ATOM 0 HD23 LEU A 75 25.961 14.720 16.110 1.00 0.26 H new ATOM 1318 N PRO A 76 24.564 10.307 15.883 1.00 0.38 N ATOM 1319 CA PRO A 76 24.233 8.877 15.808 1.00 0.40 C ATOM 1320 C PRO A 76 23.712 8.544 14.406 1.00 0.30 C ATOM 1321 O PRO A 76 23.961 9.246 13.457 1.00 0.20 O ATOM 1322 CB PRO A 76 23.119 8.721 16.842 1.00 0.50 C ATOM 1323 CG PRO A 76 22.479 10.122 17.014 1.00 0.54 C ATOM 1324 CD PRO A 76 23.467 11.143 16.414 1.00 0.52 C ATOM 0 HA PRO A 76 25.082 8.220 15.996 1.00 0.40 H new ATOM 0 HB2 PRO A 76 22.378 7.995 16.508 1.00 0.50 H new ATOM 0 HB3 PRO A 76 23.517 8.357 17.789 1.00 0.50 H new ATOM 0 HG2 PRO A 76 21.516 10.172 16.505 1.00 0.54 H new ATOM 0 HG3 PRO A 76 22.295 10.336 18.067 1.00 0.54 H new ATOM 0 HD2 PRO A 76 23.000 11.736 15.628 1.00 0.52 H new ATOM 0 HD3 PRO A 76 23.827 11.842 17.169 1.00 0.52 H new ATOM 1332 N GLU A 77 22.975 7.488 14.268 1.00 0.42 N ATOM 1333 CA GLU A 77 22.432 7.148 12.932 1.00 0.37 C ATOM 1334 C GLU A 77 20.904 7.201 13.006 1.00 0.38 C ATOM 1335 O GLU A 77 20.214 7.168 12.007 1.00 0.35 O ATOM 1336 CB GLU A 77 22.882 5.743 12.559 1.00 0.38 C ATOM 1337 CG GLU A 77 24.315 5.520 13.042 1.00 0.41 C ATOM 1338 CD GLU A 77 24.649 4.029 12.970 1.00 0.51 C ATOM 1339 OE1 GLU A 77 24.077 3.277 13.743 1.00 0.67 O ATOM 1340 OE2 GLU A 77 25.467 3.664 12.143 1.00 0.60 O ATOM 0 H GLU A 77 22.724 6.846 15.020 1.00 0.42 H new ATOM 0 HA GLU A 77 22.790 7.851 12.180 1.00 0.37 H new ATOM 0 HB2 GLU A 77 22.217 5.006 13.008 1.00 0.38 H new ATOM 0 HB3 GLU A 77 22.826 5.607 11.479 1.00 0.38 H new ATOM 0 HG2 GLU A 77 25.011 6.090 12.426 1.00 0.41 H new ATOM 0 HG3 GLU A 77 24.426 5.880 14.065 1.00 0.41 H new ATOM 1347 N LYS A 78 20.382 7.272 14.198 1.00 0.44 N ATOM 1348 CA LYS A 78 18.905 7.320 14.392 1.00 0.49 C ATOM 1349 C LYS A 78 18.430 8.768 14.554 1.00 0.47 C ATOM 1350 O LYS A 78 17.332 9.019 15.010 1.00 0.49 O ATOM 1351 CB LYS A 78 18.547 6.521 15.651 1.00 0.52 C ATOM 1352 CG LYS A 78 18.692 7.400 16.901 1.00 0.35 C ATOM 1353 CD LYS A 78 20.171 7.679 17.187 1.00 0.19 C ATOM 1354 CE LYS A 78 20.938 6.354 17.239 1.00 0.58 C ATOM 1355 NZ LYS A 78 21.844 6.349 18.422 1.00 1.52 N ATOM 0 H LYS A 78 20.925 7.299 15.061 1.00 0.44 H new ATOM 0 HA LYS A 78 18.414 6.891 13.519 1.00 0.49 H new ATOM 0 HB2 LYS A 78 17.525 6.150 15.576 1.00 0.52 H new ATOM 0 HB3 LYS A 78 19.197 5.650 15.734 1.00 0.52 H new ATOM 0 HG2 LYS A 78 18.159 8.340 16.757 1.00 0.35 H new ATOM 0 HG3 LYS A 78 18.236 6.903 17.758 1.00 0.35 H new ATOM 0 HD2 LYS A 78 20.587 8.323 16.412 1.00 0.19 H new ATOM 0 HD3 LYS A 78 20.276 8.210 18.133 1.00 0.19 H new ATOM 0 HE2 LYS A 78 20.239 5.520 17.299 1.00 0.58 H new ATOM 0 HE3 LYS A 78 21.516 6.220 16.325 1.00 0.58 H new ATOM 0 HZ1 LYS A 78 22.788 6.022 18.135 1.00 1.52 H new ATOM 0 HZ2 LYS A 78 21.914 7.312 18.810 1.00 1.52 H new ATOM 0 HZ3 LYS A 78 21.463 5.710 19.149 1.00 1.52 H new ATOM 1369 N ASP A 79 19.232 9.726 14.187 1.00 0.42 N ATOM 1370 CA ASP A 79 18.814 11.132 14.331 1.00 0.43 C ATOM 1371 C ASP A 79 19.656 11.955 13.377 1.00 0.36 C ATOM 1372 O ASP A 79 20.861 11.813 13.310 1.00 0.42 O ATOM 1373 CB ASP A 79 19.040 11.599 15.777 1.00 0.41 C ATOM 1374 CG ASP A 79 18.038 10.899 16.697 1.00 0.53 C ATOM 1375 OD1 ASP A 79 16.868 10.882 16.356 1.00 0.73 O ATOM 1376 OD2 ASP A 79 18.457 10.394 17.726 1.00 0.98 O ATOM 0 H ASP A 79 20.162 9.588 13.792 1.00 0.42 H new ATOM 0 HA ASP A 79 17.755 11.247 14.101 1.00 0.43 H new ATOM 0 HB2 ASP A 79 20.059 11.371 16.090 1.00 0.41 H new ATOM 0 HB3 ASP A 79 18.920 12.680 15.845 1.00 0.41 H new ATOM 1381 N CYS A 80 19.041 12.826 12.657 1.00 0.32 N ATOM 1382 CA CYS A 80 19.812 13.675 11.727 1.00 0.29 C ATOM 1383 C CYS A 80 20.405 14.792 12.570 1.00 0.70 C ATOM 1384 O CYS A 80 21.477 14.676 13.114 1.00 2.31 O ATOM 1385 CB CYS A 80 18.883 14.253 10.647 1.00 0.64 C ATOM 1386 SG CYS A 80 18.137 12.912 9.686 1.00 1.05 S ATOM 0 H CYS A 80 18.034 12.991 12.669 1.00 0.32 H new ATOM 0 HA CYS A 80 20.591 13.108 11.217 1.00 0.29 H new ATOM 0 HB2 CYS A 80 18.103 14.855 11.112 1.00 0.64 H new ATOM 0 HB3 CYS A 80 19.446 14.914 9.988 1.00 0.64 H new ATOM 0 HG CYS A 80 17.502 13.410 8.667 1.00 1.05 H new ATOM 1392 N ARG A 81 19.674 15.842 12.731 1.00 0.89 N ATOM 1393 CA ARG A 81 20.117 16.955 13.593 1.00 0.97 C ATOM 1394 C ARG A 81 21.126 17.836 12.867 1.00 0.95 C ATOM 1395 O ARG A 81 22.171 17.379 12.447 1.00 1.34 O ATOM 1396 CB ARG A 81 20.775 16.416 14.880 1.00 1.01 C ATOM 1397 CG ARG A 81 20.192 15.057 15.347 1.00 2.26 C ATOM 1398 CD ARG A 81 18.723 14.878 14.945 1.00 2.78 C ATOM 1399 NE ARG A 81 17.912 14.606 16.160 1.00 2.71 N ATOM 1400 CZ ARG A 81 16.670 14.228 16.040 1.00 3.12 C ATOM 1401 NH1 ARG A 81 16.330 13.388 15.101 1.00 4.55 N ATOM 1402 NH2 ARG A 81 15.766 14.699 16.855 1.00 2.85 N ATOM 0 H ARG A 81 18.764 15.981 12.291 1.00 0.89 H new ATOM 0 HA ARG A 81 19.235 17.543 13.846 1.00 0.97 H new ATOM 0 HB2 ARG A 81 21.846 16.305 14.712 1.00 1.01 H new ATOM 0 HB3 ARG A 81 20.651 17.149 15.677 1.00 1.01 H new ATOM 0 HG2 ARG A 81 20.783 14.246 14.921 1.00 2.26 H new ATOM 0 HG3 ARG A 81 20.281 14.981 16.431 1.00 2.26 H new ATOM 0 HD2 ARG A 81 18.359 15.775 14.444 1.00 2.78 H new ATOM 0 HD3 ARG A 81 18.625 14.055 14.237 1.00 2.78 H new ATOM 0 HE ARG A 81 18.326 14.715 17.086 1.00 2.71 H new ATOM 0 HH11 ARG A 81 17.036 13.026 14.460 1.00 4.55 H new ATOM 0 HH12 ARG A 81 15.358 13.093 15.008 1.00 4.55 H new ATOM 0 HH21 ARG A 81 16.032 15.361 17.584 1.00 2.85 H new ATOM 0 HH22 ARG A 81 14.794 14.405 16.763 1.00 2.85 H new ATOM 1416 N TYR A 82 20.855 19.113 12.760 1.00 0.52 N ATOM 1417 CA TYR A 82 21.851 19.998 12.115 1.00 0.54 C ATOM 1418 C TYR A 82 22.976 20.151 13.130 1.00 0.65 C ATOM 1419 O TYR A 82 22.802 19.818 14.271 1.00 1.25 O ATOM 1420 CB TYR A 82 21.219 21.361 11.790 1.00 0.49 C ATOM 1421 CG TYR A 82 20.501 21.302 10.451 1.00 0.37 C ATOM 1422 CD1 TYR A 82 20.919 20.400 9.471 1.00 0.16 C ATOM 1423 CD2 TYR A 82 19.421 22.154 10.190 1.00 0.54 C ATOM 1424 CE1 TYR A 82 20.269 20.345 8.234 1.00 0.27 C ATOM 1425 CE2 TYR A 82 18.767 22.102 8.948 1.00 0.53 C ATOM 1426 CZ TYR A 82 19.193 21.196 7.971 1.00 0.42 C ATOM 1427 OH TYR A 82 18.553 21.145 6.749 1.00 0.55 O ATOM 0 H TYR A 82 20.002 19.567 13.087 1.00 0.52 H new ATOM 0 HA TYR A 82 22.216 19.587 11.174 1.00 0.54 H new ATOM 0 HB2 TYR A 82 20.517 21.641 12.575 1.00 0.49 H new ATOM 0 HB3 TYR A 82 21.990 22.131 11.763 1.00 0.49 H new ATOM 0 HD1 TYR A 82 21.750 19.740 9.670 1.00 0.16 H new ATOM 0 HD2 TYR A 82 19.090 22.852 10.945 1.00 0.54 H new ATOM 0 HE1 TYR A 82 20.599 19.644 7.482 1.00 0.27 H new ATOM 0 HE2 TYR A 82 17.935 22.761 8.747 1.00 0.53 H new ATOM 0 HH TYR A 82 17.607 20.926 6.884 1.00 0.55 H new ATOM 1437 N ALA A 83 24.127 20.625 12.781 1.00 0.13 N ATOM 1438 CA ALA A 83 25.151 20.726 13.844 1.00 0.32 C ATOM 1439 C ALA A 83 26.190 21.771 13.514 1.00 0.24 C ATOM 1440 O ALA A 83 26.768 21.803 12.447 1.00 0.26 O ATOM 1441 CB ALA A 83 25.844 19.386 14.069 1.00 0.49 C ATOM 0 H ALA A 83 24.399 20.936 11.848 1.00 0.13 H new ATOM 0 HA ALA A 83 24.631 21.020 14.756 1.00 0.32 H new ATOM 0 HB1 ALA A 83 26.591 19.490 14.856 1.00 0.49 H new ATOM 0 HB2 ALA A 83 25.107 18.640 14.366 1.00 0.49 H new ATOM 0 HB3 ALA A 83 26.330 19.068 13.147 1.00 0.49 H new ATOM 1447 N LEU A 84 26.424 22.620 14.449 1.00 0.24 N ATOM 1448 CA LEU A 84 27.422 23.690 14.273 1.00 0.24 C ATOM 1449 C LEU A 84 28.506 23.451 15.296 1.00 0.24 C ATOM 1450 O LEU A 84 28.346 23.726 16.459 1.00 0.28 O ATOM 1451 CB LEU A 84 26.743 25.043 14.479 1.00 0.41 C ATOM 1452 CG LEU A 84 25.877 25.355 13.259 1.00 0.41 C ATOM 1453 CD1 LEU A 84 26.771 25.504 12.033 1.00 2.04 C ATOM 1454 CD2 LEU A 84 24.869 24.217 13.055 1.00 1.90 C ATOM 0 H LEU A 84 25.954 22.620 15.354 1.00 0.24 H new ATOM 0 HA LEU A 84 27.855 23.689 13.273 1.00 0.24 H new ATOM 0 HB2 LEU A 84 26.131 25.024 15.381 1.00 0.41 H new ATOM 0 HB3 LEU A 84 27.492 25.823 14.619 1.00 0.41 H new ATOM 0 HG LEU A 84 25.332 26.287 13.412 1.00 0.41 H new ATOM 0 HD11 LEU A 84 26.157 25.727 11.160 1.00 2.04 H new ATOM 0 HD12 LEU A 84 27.479 26.317 12.196 1.00 2.04 H new ATOM 0 HD13 LEU A 84 27.317 24.575 11.866 1.00 2.04 H new ATOM 0 HD21 LEU A 84 24.247 24.433 12.186 1.00 1.90 H new ATOM 0 HD22 LEU A 84 25.404 23.281 12.895 1.00 1.90 H new ATOM 0 HD23 LEU A 84 24.238 24.127 13.939 1.00 1.90 H new ATOM 1466 N TYR A 85 29.591 22.884 14.869 1.00 0.22 N ATOM 1467 CA TYR A 85 30.679 22.557 15.819 1.00 0.20 C ATOM 1468 C TYR A 85 31.872 23.488 15.616 1.00 0.26 C ATOM 1469 O TYR A 85 32.534 23.446 14.602 1.00 0.31 O ATOM 1470 CB TYR A 85 31.103 21.116 15.572 1.00 0.21 C ATOM 1471 CG TYR A 85 32.568 20.972 15.860 1.00 0.29 C ATOM 1472 CD1 TYR A 85 33.006 20.838 17.184 1.00 0.33 C ATOM 1473 CD2 TYR A 85 33.489 20.965 14.805 1.00 0.40 C ATOM 1474 CE1 TYR A 85 34.375 20.693 17.452 1.00 0.47 C ATOM 1475 CE2 TYR A 85 34.851 20.820 15.076 1.00 0.50 C ATOM 1476 CZ TYR A 85 35.296 20.682 16.396 1.00 0.54 C ATOM 1477 OH TYR A 85 36.646 20.543 16.656 1.00 0.67 O ATOM 0 H TYR A 85 29.772 22.631 13.898 1.00 0.22 H new ATOM 0 HA TYR A 85 30.324 22.684 16.842 1.00 0.20 H new ATOM 0 HB2 TYR A 85 30.528 20.442 16.207 1.00 0.21 H new ATOM 0 HB3 TYR A 85 30.895 20.836 14.539 1.00 0.21 H new ATOM 0 HD1 TYR A 85 32.293 20.846 17.995 1.00 0.33 H new ATOM 0 HD2 TYR A 85 33.147 21.071 13.786 1.00 0.40 H new ATOM 0 HE1 TYR A 85 34.719 20.590 18.471 1.00 0.47 H new ATOM 0 HE2 TYR A 85 35.564 20.814 14.264 1.00 0.50 H new ATOM 0 HH TYR A 85 36.929 19.631 16.437 1.00 0.67 H new ATOM 1487 N ASP A 86 32.168 24.318 16.585 1.00 0.31 N ATOM 1488 CA ASP A 86 33.336 25.224 16.433 1.00 0.40 C ATOM 1489 C ASP A 86 34.522 24.375 15.998 1.00 0.31 C ATOM 1490 O ASP A 86 35.049 23.587 16.759 1.00 0.30 O ATOM 1491 CB ASP A 86 33.648 25.913 17.763 1.00 0.48 C ATOM 1492 CG ASP A 86 34.317 27.264 17.492 1.00 0.65 C ATOM 1493 OD1 ASP A 86 34.507 27.587 16.331 1.00 0.70 O ATOM 1494 OD2 ASP A 86 34.627 27.953 18.451 1.00 0.77 O ATOM 0 H ASP A 86 31.656 24.404 17.463 1.00 0.31 H new ATOM 0 HA ASP A 86 33.124 25.997 15.694 1.00 0.40 H new ATOM 0 HB2 ASP A 86 32.731 26.057 18.334 1.00 0.48 H new ATOM 0 HB3 ASP A 86 34.304 25.285 18.366 1.00 0.48 H new ATOM 1499 N ALA A 87 34.926 24.506 14.773 1.00 0.37 N ATOM 1500 CA ALA A 87 36.061 23.673 14.280 1.00 0.41 C ATOM 1501 C ALA A 87 37.389 24.323 14.623 1.00 0.49 C ATOM 1502 O ALA A 87 37.585 25.483 14.391 1.00 0.52 O ATOM 1503 CB ALA A 87 35.967 23.518 12.763 1.00 0.53 C ATOM 0 H ALA A 87 34.526 25.149 14.090 1.00 0.37 H new ATOM 0 HA ALA A 87 36.003 22.697 14.761 1.00 0.41 H new ATOM 0 HB1 ALA A 87 36.798 22.909 12.407 1.00 0.53 H new ATOM 0 HB2 ALA A 87 35.025 23.034 12.504 1.00 0.53 H new ATOM 0 HB3 ALA A 87 36.010 24.501 12.293 1.00 0.53 H new ATOM 1509 N SER A 88 38.311 23.566 15.147 1.00 0.56 N ATOM 1510 CA SER A 88 39.646 24.136 15.469 1.00 0.66 C ATOM 1511 C SER A 88 40.632 23.629 14.424 1.00 0.59 C ATOM 1512 O SER A 88 41.147 22.534 14.520 1.00 0.66 O ATOM 1513 CB SER A 88 40.099 23.678 16.851 1.00 0.82 C ATOM 1514 OG SER A 88 39.122 24.044 17.817 1.00 0.76 O ATOM 0 H SER A 88 38.197 22.576 15.366 1.00 0.56 H new ATOM 0 HA SER A 88 39.596 25.225 15.465 1.00 0.66 H new ATOM 0 HB2 SER A 88 40.245 22.598 16.858 1.00 0.82 H new ATOM 0 HB3 SER A 88 41.059 24.131 17.099 1.00 0.82 H new ATOM 0 HG SER A 88 39.413 23.748 18.705 1.00 0.76 H new ATOM 1520 N PHE A 89 40.867 24.398 13.403 1.00 0.50 N ATOM 1521 CA PHE A 89 41.788 23.933 12.327 1.00 0.45 C ATOM 1522 C PHE A 89 42.584 25.098 11.744 1.00 0.46 C ATOM 1523 O PHE A 89 42.084 26.198 11.614 1.00 0.46 O ATOM 1524 CB PHE A 89 40.944 23.353 11.205 1.00 0.33 C ATOM 1525 CG PHE A 89 40.192 24.492 10.565 1.00 0.28 C ATOM 1526 CD1 PHE A 89 38.951 24.874 11.077 1.00 0.31 C ATOM 1527 CD2 PHE A 89 40.742 25.175 9.475 1.00 0.32 C ATOM 1528 CE1 PHE A 89 38.253 25.940 10.498 1.00 0.27 C ATOM 1529 CE2 PHE A 89 40.047 26.241 8.894 1.00 0.39 C ATOM 1530 CZ PHE A 89 38.800 26.622 9.404 1.00 0.34 C ATOM 0 H PHE A 89 40.465 25.325 13.264 1.00 0.50 H new ATOM 0 HA PHE A 89 42.477 23.201 12.748 1.00 0.45 H new ATOM 0 HB2 PHE A 89 41.575 22.851 10.472 1.00 0.33 H new ATOM 0 HB3 PHE A 89 40.251 22.607 11.594 1.00 0.33 H new ATOM 0 HD1 PHE A 89 38.529 24.347 11.920 1.00 0.31 H new ATOM 0 HD2 PHE A 89 41.703 24.879 9.082 1.00 0.32 H new ATOM 0 HE1 PHE A 89 37.293 26.236 10.895 1.00 0.27 H new ATOM 0 HE2 PHE A 89 40.472 26.769 8.053 1.00 0.39 H new ATOM 0 HZ PHE A 89 38.260 27.442 8.954 1.00 0.34 H new ATOM 1540 N GLU A 90 43.801 24.856 11.338 1.00 0.49 N ATOM 1541 CA GLU A 90 44.585 25.949 10.705 1.00 0.52 C ATOM 1542 C GLU A 90 44.266 25.954 9.230 1.00 0.70 C ATOM 1543 O GLU A 90 43.646 25.054 8.709 1.00 1.64 O ATOM 1544 CB GLU A 90 46.083 25.748 10.877 1.00 0.46 C ATOM 1545 CG GLU A 90 46.413 25.736 12.360 1.00 0.41 C ATOM 1546 CD GLU A 90 47.031 24.392 12.741 1.00 0.64 C ATOM 1547 OE1 GLU A 90 47.963 23.978 12.068 1.00 1.32 O ATOM 1548 OE2 GLU A 90 46.566 23.797 13.698 1.00 1.09 O ATOM 0 H GLU A 90 44.280 23.959 11.417 1.00 0.49 H new ATOM 0 HA GLU A 90 44.317 26.891 11.183 1.00 0.52 H new ATOM 0 HB2 GLU A 90 46.393 24.811 10.415 1.00 0.46 H new ATOM 0 HB3 GLU A 90 46.630 26.547 10.376 1.00 0.46 H new ATOM 0 HG2 GLU A 90 47.105 26.545 12.595 1.00 0.41 H new ATOM 0 HG3 GLU A 90 45.510 25.910 12.945 1.00 0.41 H new ATOM 1555 N THR A 91 44.668 26.965 8.555 1.00 0.24 N ATOM 1556 CA THR A 91 44.351 27.037 7.115 1.00 0.16 C ATOM 1557 C THR A 91 45.435 27.874 6.419 1.00 0.19 C ATOM 1558 O THR A 91 46.387 28.284 7.053 1.00 0.22 O ATOM 1559 CB THR A 91 42.996 27.760 7.004 1.00 0.13 C ATOM 1560 OG1 THR A 91 42.912 28.482 5.783 1.00 0.24 O ATOM 1561 CG2 THR A 91 42.855 28.745 8.172 1.00 0.22 C ATOM 0 H THR A 91 45.203 27.749 8.929 1.00 0.24 H new ATOM 0 HA THR A 91 44.310 26.050 6.655 1.00 0.16 H new ATOM 0 HB THR A 91 42.200 27.016 7.032 1.00 0.13 H new ATOM 0 HG1 THR A 91 42.044 28.933 5.729 1.00 0.24 H new ATOM 0 HG21 THR A 91 41.897 29.261 8.100 1.00 0.22 H new ATOM 0 HG22 THR A 91 42.904 28.201 9.115 1.00 0.22 H new ATOM 0 HG23 THR A 91 43.664 29.475 8.132 1.00 0.22 H new ATOM 1569 N LYS A 92 45.299 28.219 5.159 1.00 0.23 N ATOM 1570 CA LYS A 92 46.318 29.126 4.605 1.00 0.28 C ATOM 1571 C LYS A 92 46.233 30.374 5.492 1.00 0.35 C ATOM 1572 O LYS A 92 47.146 31.170 5.576 1.00 0.38 O ATOM 1573 CB LYS A 92 45.980 29.478 3.154 1.00 0.34 C ATOM 1574 CG LYS A 92 46.060 28.219 2.287 1.00 0.29 C ATOM 1575 CD LYS A 92 46.143 28.623 0.813 1.00 0.51 C ATOM 1576 CE LYS A 92 47.239 27.810 0.123 1.00 0.65 C ATOM 1577 NZ LYS A 92 48.248 28.736 -0.466 1.00 1.20 N ATOM 0 H LYS A 92 44.557 27.921 4.526 1.00 0.23 H new ATOM 0 HA LYS A 92 47.315 28.686 4.598 1.00 0.28 H new ATOM 0 HB2 LYS A 92 44.980 29.908 3.097 1.00 0.34 H new ATOM 0 HB3 LYS A 92 46.673 30.233 2.782 1.00 0.34 H new ATOM 0 HG2 LYS A 92 46.933 27.628 2.564 1.00 0.29 H new ATOM 0 HG3 LYS A 92 45.185 27.592 2.455 1.00 0.29 H new ATOM 0 HD2 LYS A 92 45.185 28.451 0.323 1.00 0.51 H new ATOM 0 HD3 LYS A 92 46.358 29.688 0.728 1.00 0.51 H new ATOM 0 HE2 LYS A 92 47.717 27.142 0.840 1.00 0.65 H new ATOM 0 HE3 LYS A 92 46.806 27.183 -0.657 1.00 0.65 H new ATOM 0 HZ1 LYS A 92 48.994 28.184 -0.935 1.00 1.20 H new ATOM 0 HZ2 LYS A 92 47.786 29.356 -1.162 1.00 1.20 H new ATOM 0 HZ3 LYS A 92 48.669 29.316 0.288 1.00 1.20 H new ATOM 1591 N GLU A 93 45.112 30.514 6.183 1.00 0.38 N ATOM 1592 CA GLU A 93 44.891 31.642 7.096 1.00 0.43 C ATOM 1593 C GLU A 93 45.507 31.300 8.461 1.00 0.45 C ATOM 1594 O GLU A 93 45.930 32.174 9.188 1.00 0.51 O ATOM 1595 CB GLU A 93 43.380 31.847 7.204 1.00 0.39 C ATOM 1596 CG GLU A 93 43.050 32.630 8.451 1.00 3.10 C ATOM 1597 CD GLU A 93 42.148 33.806 8.077 1.00 3.27 C ATOM 1598 OE1 GLU A 93 40.989 33.567 7.777 1.00 2.22 O ATOM 1599 OE2 GLU A 93 42.629 34.927 8.095 1.00 4.49 O ATOM 0 H GLU A 93 44.332 29.859 6.133 1.00 0.38 H new ATOM 0 HA GLU A 93 45.358 32.558 6.735 1.00 0.43 H new ATOM 0 HB2 GLU A 93 43.013 32.377 6.325 1.00 0.39 H new ATOM 0 HB3 GLU A 93 42.875 30.881 7.227 1.00 0.39 H new ATOM 0 HG2 GLU A 93 42.550 31.989 9.177 1.00 3.10 H new ATOM 0 HG3 GLU A 93 43.964 32.992 8.921 1.00 3.10 H new ATOM 1606 N SER A 94 45.573 30.015 8.769 1.00 0.40 N ATOM 1607 CA SER A 94 46.174 29.505 10.039 1.00 0.42 C ATOM 1608 C SER A 94 45.101 29.119 11.055 1.00 0.47 C ATOM 1609 O SER A 94 43.942 29.455 10.912 1.00 0.44 O ATOM 1610 CB SER A 94 47.034 30.562 10.670 1.00 0.48 C ATOM 1611 OG SER A 94 47.953 31.072 9.714 1.00 0.48 O ATOM 0 H SER A 94 45.218 29.278 8.160 1.00 0.40 H new ATOM 0 HA SER A 94 46.764 28.626 9.778 1.00 0.42 H new ATOM 0 HB2 SER A 94 46.410 31.369 11.054 1.00 0.48 H new ATOM 0 HB3 SER A 94 47.574 30.144 11.520 1.00 0.48 H new ATOM 0 HG SER A 94 47.678 31.973 9.444 1.00 0.48 H new ATOM 1617 N ARG A 95 45.508 28.438 12.104 1.00 0.74 N ATOM 1618 CA ARG A 95 44.552 28.046 13.177 1.00 0.82 C ATOM 1619 C ARG A 95 43.653 29.226 13.418 1.00 0.80 C ATOM 1620 O ARG A 95 44.039 30.226 13.990 1.00 1.07 O ATOM 1621 CB ARG A 95 45.286 27.722 14.462 1.00 1.24 C ATOM 1622 CG ARG A 95 44.311 27.094 15.457 1.00 1.36 C ATOM 1623 CD ARG A 95 44.265 25.582 15.238 1.00 1.37 C ATOM 1624 NE ARG A 95 43.727 24.924 16.461 1.00 1.62 N ATOM 1625 CZ ARG A 95 44.284 25.154 17.617 1.00 1.56 C ATOM 1626 NH1 ARG A 95 45.307 24.440 18.000 1.00 2.86 N ATOM 1627 NH2 ARG A 95 43.823 26.102 18.387 1.00 1.42 N ATOM 0 H ARG A 95 46.471 28.138 12.258 1.00 0.74 H new ATOM 0 HA ARG A 95 43.992 27.162 12.872 1.00 0.82 H new ATOM 0 HB2 ARG A 95 46.110 27.037 14.261 1.00 1.24 H new ATOM 0 HB3 ARG A 95 45.721 28.628 14.884 1.00 1.24 H new ATOM 0 HG2 ARG A 95 44.623 27.315 16.478 1.00 1.36 H new ATOM 0 HG3 ARG A 95 43.317 27.522 15.328 1.00 1.36 H new ATOM 0 HD2 ARG A 95 43.638 25.346 14.378 1.00 1.37 H new ATOM 0 HD3 ARG A 95 45.263 25.204 15.017 1.00 1.37 H new ATOM 0 HE ARG A 95 42.926 24.296 16.394 1.00 1.62 H new ATOM 0 HH11 ARG A 95 45.670 23.703 17.395 1.00 2.86 H new ATOM 0 HH12 ARG A 95 45.744 24.619 18.904 1.00 2.86 H new ATOM 0 HH21 ARG A 95 43.027 26.663 18.084 1.00 1.42 H new ATOM 0 HH22 ARG A 95 44.259 26.282 19.291 1.00 1.42 H new ATOM 1641 N LYS A 96 42.479 29.123 12.936 1.00 0.58 N ATOM 1642 CA LYS A 96 41.526 30.253 13.056 1.00 0.79 C ATOM 1643 C LYS A 96 40.115 29.755 13.347 1.00 0.78 C ATOM 1644 O LYS A 96 39.145 30.398 13.018 1.00 1.99 O ATOM 1645 CB LYS A 96 41.555 31.009 11.739 1.00 0.96 C ATOM 1646 CG LYS A 96 42.888 31.755 11.629 1.00 1.23 C ATOM 1647 CD LYS A 96 42.653 33.255 11.766 1.00 1.36 C ATOM 1648 CE LYS A 96 41.526 33.678 10.827 1.00 1.57 C ATOM 1649 NZ LYS A 96 40.337 34.096 11.627 1.00 2.28 N ATOM 0 H LYS A 96 42.118 28.300 12.454 1.00 0.58 H new ATOM 0 HA LYS A 96 41.815 30.900 13.885 1.00 0.79 H new ATOM 0 HB2 LYS A 96 41.439 30.318 10.904 1.00 0.96 H new ATOM 0 HB3 LYS A 96 40.724 31.712 11.689 1.00 0.96 H new ATOM 0 HG2 LYS A 96 43.572 31.412 12.405 1.00 1.23 H new ATOM 0 HG3 LYS A 96 43.359 31.537 10.670 1.00 1.23 H new ATOM 0 HD2 LYS A 96 42.395 33.502 12.796 1.00 1.36 H new ATOM 0 HD3 LYS A 96 43.565 33.801 11.526 1.00 1.36 H new ATOM 0 HE2 LYS A 96 41.857 34.500 10.193 1.00 1.57 H new ATOM 0 HE3 LYS A 96 41.260 32.853 10.166 1.00 1.57 H new ATOM 0 HZ1 LYS A 96 39.471 33.929 11.076 1.00 2.28 H new ATOM 0 HZ2 LYS A 96 40.299 33.543 12.507 1.00 2.28 H new ATOM 0 HZ3 LYS A 96 40.411 35.108 11.856 1.00 2.28 H new ATOM 1663 N GLU A 97 40.026 28.622 13.973 1.00 1.00 N ATOM 1664 CA GLU A 97 38.731 28.004 14.350 1.00 0.75 C ATOM 1665 C GLU A 97 37.544 28.497 13.528 1.00 0.69 C ATOM 1666 O GLU A 97 37.134 29.639 13.604 1.00 0.77 O ATOM 1667 CB GLU A 97 38.446 28.278 15.811 1.00 0.73 C ATOM 1668 CG GLU A 97 37.682 27.093 16.363 1.00 0.57 C ATOM 1669 CD GLU A 97 37.403 27.302 17.853 1.00 0.55 C ATOM 1670 OE1 GLU A 97 37.646 28.398 18.331 1.00 1.33 O ATOM 1671 OE2 GLU A 97 36.954 26.364 18.490 1.00 0.56 O ATOM 0 H GLU A 97 40.839 28.073 14.252 1.00 1.00 H new ATOM 0 HA GLU A 97 38.839 26.938 14.150 1.00 0.75 H new ATOM 0 HB2 GLU A 97 39.376 28.423 16.361 1.00 0.73 H new ATOM 0 HB3 GLU A 97 37.864 29.193 15.922 1.00 0.73 H new ATOM 0 HG2 GLU A 97 36.744 26.970 15.822 1.00 0.57 H new ATOM 0 HG3 GLU A 97 38.257 26.178 16.216 1.00 0.57 H new ATOM 1678 N GLU A 98 36.956 27.616 12.782 1.00 0.55 N ATOM 1679 CA GLU A 98 35.764 28.000 11.985 1.00 0.47 C ATOM 1680 C GLU A 98 34.730 26.865 11.983 1.00 0.34 C ATOM 1681 O GLU A 98 34.824 25.902 11.250 1.00 0.27 O ATOM 1682 CB GLU A 98 36.191 28.356 10.561 1.00 0.45 C ATOM 1683 CG GLU A 98 35.273 27.684 9.539 1.00 0.36 C ATOM 1684 CD GLU A 98 35.413 28.391 8.190 1.00 0.46 C ATOM 1685 OE1 GLU A 98 36.536 28.670 7.804 1.00 1.14 O ATOM 1686 OE2 GLU A 98 34.395 28.642 7.567 1.00 0.81 O ATOM 0 H GLU A 98 37.248 26.643 12.688 1.00 0.55 H new ATOM 0 HA GLU A 98 35.297 28.875 12.438 1.00 0.47 H new ATOM 0 HB2 GLU A 98 36.163 29.437 10.427 1.00 0.45 H new ATOM 0 HB3 GLU A 98 37.221 28.041 10.395 1.00 0.45 H new ATOM 0 HG2 GLU A 98 35.532 26.630 9.438 1.00 0.36 H new ATOM 0 HG3 GLU A 98 34.238 27.727 9.879 1.00 0.36 H new ATOM 1693 N LEU A 99 33.742 26.998 12.815 1.00 0.31 N ATOM 1694 CA LEU A 99 32.649 25.969 12.902 1.00 0.21 C ATOM 1695 C LEU A 99 32.153 25.617 11.520 1.00 0.17 C ATOM 1696 O LEU A 99 32.542 26.202 10.530 1.00 0.20 O ATOM 1697 CB LEU A 99 31.456 26.557 13.623 1.00 0.23 C ATOM 1698 CG LEU A 99 30.958 27.740 12.795 1.00 0.24 C ATOM 1699 CD1 LEU A 99 29.514 27.493 12.352 1.00 0.26 C ATOM 1700 CD2 LEU A 99 31.060 29.000 13.646 1.00 0.65 C ATOM 0 H LEU A 99 33.634 27.786 13.454 1.00 0.31 H new ATOM 0 HA LEU A 99 33.054 25.098 13.417 1.00 0.21 H new ATOM 0 HB2 LEU A 99 30.670 25.810 13.736 1.00 0.23 H new ATOM 0 HB3 LEU A 99 31.735 26.881 14.626 1.00 0.23 H new ATOM 0 HG LEU A 99 31.566 27.861 11.899 1.00 0.24 H new ATOM 0 HD11 LEU A 99 29.164 28.340 11.762 1.00 0.26 H new ATOM 0 HD12 LEU A 99 29.469 26.587 11.748 1.00 0.26 H new ATOM 0 HD13 LEU A 99 28.879 27.376 13.230 1.00 0.26 H new ATOM 0 HD21 LEU A 99 30.708 29.857 13.071 1.00 0.65 H new ATOM 0 HD22 LEU A 99 30.446 28.886 14.540 1.00 0.65 H new ATOM 0 HD23 LEU A 99 32.098 29.160 13.937 1.00 0.65 H new ATOM 1712 N MET A 100 31.278 24.658 11.456 1.00 0.13 N ATOM 1713 CA MET A 100 30.733 24.249 10.152 1.00 0.17 C ATOM 1714 C MET A 100 29.354 23.639 10.302 1.00 0.20 C ATOM 1715 O MET A 100 29.112 22.770 11.116 1.00 0.20 O ATOM 1716 CB MET A 100 31.667 23.238 9.569 1.00 0.20 C ATOM 1717 CG MET A 100 33.074 23.830 9.564 1.00 0.18 C ATOM 1718 SD MET A 100 34.189 22.722 8.677 1.00 0.32 S ATOM 1719 CE MET A 100 33.052 21.332 8.704 1.00 0.38 C ATOM 0 H MET A 100 30.919 24.141 12.259 1.00 0.13 H new ATOM 0 HA MET A 100 30.640 25.121 9.504 1.00 0.17 H new ATOM 0 HB2 MET A 100 31.644 22.319 10.154 1.00 0.20 H new ATOM 0 HB3 MET A 100 31.361 22.979 8.556 1.00 0.20 H new ATOM 0 HG2 MET A 100 33.066 24.811 9.090 1.00 0.18 H new ATOM 0 HG3 MET A 100 33.424 23.973 10.586 1.00 0.18 H new ATOM 0 HE1 MET A 100 33.528 20.463 8.249 1.00 0.38 H new ATOM 0 HE2 MET A 100 32.784 21.101 9.735 1.00 0.38 H new ATOM 0 HE3 MET A 100 32.152 21.587 8.144 1.00 0.38 H new ATOM 1729 N PHE A 101 28.456 24.099 9.496 1.00 0.23 N ATOM 1730 CA PHE A 101 27.077 23.587 9.523 1.00 0.27 C ATOM 1731 C PHE A 101 27.090 22.087 9.279 1.00 0.29 C ATOM 1732 O PHE A 101 27.839 21.596 8.459 1.00 0.30 O ATOM 1733 CB PHE A 101 26.320 24.265 8.395 1.00 0.40 C ATOM 1734 CG PHE A 101 24.842 24.167 8.600 1.00 0.15 C ATOM 1735 CD1 PHE A 101 24.317 23.989 9.877 1.00 0.11 C ATOM 1736 CD2 PHE A 101 23.997 24.218 7.490 1.00 0.10 C ATOM 1737 CE1 PHE A 101 22.938 23.858 10.047 1.00 0.25 C ATOM 1738 CE2 PHE A 101 22.617 24.099 7.659 1.00 0.35 C ATOM 1739 CZ PHE A 101 22.087 23.917 8.937 1.00 0.43 C ATOM 0 H PHE A 101 28.626 24.827 8.802 1.00 0.23 H new ATOM 0 HA PHE A 101 26.609 23.788 10.487 1.00 0.27 H new ATOM 0 HB2 PHE A 101 26.613 25.313 8.336 1.00 0.40 H new ATOM 0 HB3 PHE A 101 26.589 23.804 7.444 1.00 0.40 H new ATOM 0 HD1 PHE A 101 24.974 23.952 10.733 1.00 0.11 H new ATOM 0 HD2 PHE A 101 24.411 24.349 6.501 1.00 0.10 H new ATOM 0 HE1 PHE A 101 22.527 23.711 11.035 1.00 0.25 H new ATOM 0 HE2 PHE A 101 21.961 24.148 6.803 1.00 0.35 H new ATOM 0 HZ PHE A 101 21.019 23.822 9.070 1.00 0.43 H new ATOM 1749 N PHE A 102 26.280 21.341 9.972 1.00 0.31 N ATOM 1750 CA PHE A 102 26.303 19.884 9.732 1.00 0.36 C ATOM 1751 C PHE A 102 24.907 19.337 9.516 1.00 0.35 C ATOM 1752 O PHE A 102 24.095 19.309 10.414 1.00 0.37 O ATOM 1753 CB PHE A 102 26.947 19.195 10.922 1.00 0.35 C ATOM 1754 CG PHE A 102 28.366 18.916 10.556 1.00 0.36 C ATOM 1755 CD1 PHE A 102 28.653 17.922 9.618 1.00 0.40 C ATOM 1756 CD2 PHE A 102 29.388 19.676 11.125 1.00 0.35 C ATOM 1757 CE1 PHE A 102 29.984 17.688 9.248 1.00 0.44 C ATOM 1758 CE2 PHE A 102 30.713 19.451 10.759 1.00 0.38 C ATOM 1759 CZ PHE A 102 31.016 18.454 9.818 1.00 0.42 C ATOM 0 H PHE A 102 25.620 21.670 10.676 1.00 0.31 H new ATOM 0 HA PHE A 102 26.880 19.691 8.828 1.00 0.36 H new ATOM 0 HB2 PHE A 102 26.896 19.829 11.807 1.00 0.35 H new ATOM 0 HB3 PHE A 102 26.422 18.270 11.161 1.00 0.35 H new ATOM 0 HD1 PHE A 102 27.856 17.339 9.181 1.00 0.40 H new ATOM 0 HD2 PHE A 102 29.152 20.440 11.851 1.00 0.35 H new ATOM 0 HE1 PHE A 102 30.217 16.920 8.526 1.00 0.44 H new ATOM 0 HE2 PHE A 102 31.504 20.041 11.197 1.00 0.38 H new ATOM 0 HZ PHE A 102 32.042 18.275 9.532 1.00 0.42 H new ATOM 1769 N LEU A 103 24.637 18.882 8.324 1.00 0.33 N ATOM 1770 CA LEU A 103 23.305 18.300 8.037 1.00 0.33 C ATOM 1771 C LEU A 103 23.359 16.839 8.401 1.00 0.33 C ATOM 1772 O LEU A 103 23.071 15.967 7.607 1.00 0.31 O ATOM 1773 CB LEU A 103 22.937 18.451 6.567 1.00 0.32 C ATOM 1774 CG LEU A 103 22.739 19.934 6.225 1.00 0.55 C ATOM 1775 CD1 LEU A 103 23.277 20.839 7.343 1.00 0.34 C ATOM 1776 CD2 LEU A 103 23.474 20.266 4.927 1.00 1.10 C ATOM 0 H LEU A 103 25.286 18.890 7.537 1.00 0.33 H new ATOM 0 HA LEU A 103 22.545 18.823 8.618 1.00 0.33 H new ATOM 0 HB2 LEU A 103 23.723 18.027 5.942 1.00 0.32 H new ATOM 0 HB3 LEU A 103 22.024 17.895 6.353 1.00 0.32 H new ATOM 0 HG LEU A 103 21.670 20.112 6.112 1.00 0.55 H new ATOM 0 HD11 LEU A 103 23.122 21.883 7.072 1.00 0.34 H new ATOM 0 HD12 LEU A 103 22.749 20.623 8.272 1.00 0.34 H new ATOM 0 HD13 LEU A 103 24.342 20.654 7.480 1.00 0.34 H new ATOM 0 HD21 LEU A 103 23.331 21.320 4.687 1.00 1.10 H new ATOM 0 HD22 LEU A 103 24.538 20.063 5.049 1.00 1.10 H new ATOM 0 HD23 LEU A 103 23.078 19.653 4.118 1.00 1.10 H new ATOM 1788 N TRP A 104 23.738 16.579 9.612 1.00 0.42 N ATOM 1789 CA TRP A 104 23.831 15.179 10.073 1.00 0.45 C ATOM 1790 C TRP A 104 22.599 14.438 9.560 1.00 0.47 C ATOM 1791 O TRP A 104 21.534 14.538 10.122 1.00 0.59 O ATOM 1792 CB TRP A 104 23.842 15.117 11.604 1.00 0.57 C ATOM 1793 CG TRP A 104 24.107 13.699 12.032 1.00 0.46 C ATOM 1794 CD1 TRP A 104 23.617 13.101 13.157 1.00 0.39 C ATOM 1795 CD2 TRP A 104 24.932 12.689 11.358 1.00 0.40 C ATOM 1796 NE1 TRP A 104 24.057 11.788 13.189 1.00 0.33 N ATOM 1797 CE2 TRP A 104 24.883 11.488 12.106 1.00 0.34 C ATOM 1798 CE3 TRP A 104 25.706 12.688 10.174 1.00 0.41 C ATOM 1799 CZ2 TRP A 104 25.586 10.346 11.683 1.00 0.33 C ATOM 1800 CZ3 TRP A 104 26.388 11.560 9.766 1.00 0.38 C ATOM 1801 CH2 TRP A 104 26.333 10.388 10.512 1.00 0.36 C ATOM 0 H TRP A 104 23.989 17.282 10.307 1.00 0.42 H new ATOM 0 HA TRP A 104 24.751 14.729 9.699 1.00 0.45 H new ATOM 0 HB2 TRP A 104 24.609 15.781 12.003 1.00 0.57 H new ATOM 0 HB3 TRP A 104 22.887 15.459 12.002 1.00 0.57 H new ATOM 0 HD1 TRP A 104 22.990 13.573 13.899 1.00 0.39 H new ATOM 0 HE1 TRP A 104 23.807 11.120 13.918 1.00 0.33 H new ATOM 0 HE3 TRP A 104 25.764 13.587 9.578 1.00 0.41 H new ATOM 0 HZ2 TRP A 104 25.545 9.438 12.267 1.00 0.33 H new ATOM 0 HZ3 TRP A 104 26.971 11.588 8.857 1.00 0.38 H new ATOM 0 HH2 TRP A 104 26.870 9.511 10.182 1.00 0.36 H new ATOM 1812 N ALA A 105 22.729 13.722 8.490 1.00 0.38 N ATOM 1813 CA ALA A 105 21.555 12.987 7.930 1.00 0.44 C ATOM 1814 C ALA A 105 21.981 11.544 7.658 1.00 0.35 C ATOM 1815 O ALA A 105 22.550 11.271 6.636 1.00 0.32 O ATOM 1816 CB ALA A 105 21.122 13.664 6.617 1.00 0.47 C ATOM 0 H ALA A 105 23.599 13.608 7.970 1.00 0.38 H new ATOM 0 HA ALA A 105 20.719 13.000 8.630 1.00 0.44 H new ATOM 0 HB1 ALA A 105 20.265 13.135 6.200 1.00 0.47 H new ATOM 0 HB2 ALA A 105 20.847 14.700 6.815 1.00 0.47 H new ATOM 0 HB3 ALA A 105 21.947 13.637 5.905 1.00 0.47 H new ATOM 1822 N PRO A 106 21.715 10.662 8.591 1.00 0.32 N ATOM 1823 CA PRO A 106 22.112 9.249 8.474 1.00 0.27 C ATOM 1824 C PRO A 106 21.266 8.519 7.440 1.00 0.14 C ATOM 1825 O PRO A 106 20.073 8.721 7.332 1.00 0.06 O ATOM 1826 CB PRO A 106 21.887 8.686 9.882 1.00 0.39 C ATOM 1827 CG PRO A 106 20.878 9.632 10.569 1.00 0.40 C ATOM 1828 CD PRO A 106 20.963 10.975 9.819 1.00 0.38 C ATOM 0 HA PRO A 106 23.141 9.129 8.136 1.00 0.27 H new ATOM 0 HB2 PRO A 106 21.498 7.669 9.837 1.00 0.39 H new ATOM 0 HB3 PRO A 106 22.823 8.645 10.439 1.00 0.39 H new ATOM 0 HG2 PRO A 106 19.868 9.224 10.522 1.00 0.40 H new ATOM 0 HG3 PRO A 106 21.121 9.760 11.624 1.00 0.40 H new ATOM 0 HD2 PRO A 106 19.972 11.365 9.589 1.00 0.38 H new ATOM 0 HD3 PRO A 106 21.473 11.732 10.415 1.00 0.38 H new ATOM 1836 N GLU A 107 21.890 7.671 6.676 1.00 0.23 N ATOM 1837 CA GLU A 107 21.159 6.911 5.631 1.00 0.32 C ATOM 1838 C GLU A 107 20.070 6.032 6.265 1.00 0.28 C ATOM 1839 O GLU A 107 19.309 5.392 5.565 1.00 0.30 O ATOM 1840 CB GLU A 107 22.151 6.013 4.891 1.00 0.57 C ATOM 1841 CG GLU A 107 22.565 6.681 3.579 1.00 0.54 C ATOM 1842 CD GLU A 107 22.164 5.790 2.403 1.00 1.41 C ATOM 1843 OE1 GLU A 107 22.462 4.607 2.453 1.00 2.41 O ATOM 1844 OE2 GLU A 107 21.567 6.303 1.472 1.00 1.46 O ATOM 0 H GLU A 107 22.888 7.470 6.733 1.00 0.23 H new ATOM 0 HA GLU A 107 20.689 7.615 4.944 1.00 0.32 H new ATOM 0 HB2 GLU A 107 23.028 5.833 5.512 1.00 0.57 H new ATOM 0 HB3 GLU A 107 21.699 5.042 4.690 1.00 0.57 H new ATOM 0 HG2 GLU A 107 22.087 7.657 3.489 1.00 0.54 H new ATOM 0 HG3 GLU A 107 23.642 6.851 3.569 1.00 0.54 H new ATOM 1851 N LEU A 108 19.988 5.964 7.574 1.00 0.25 N ATOM 1852 CA LEU A 108 18.954 5.099 8.198 1.00 0.22 C ATOM 1853 C LEU A 108 17.929 5.958 8.927 1.00 0.23 C ATOM 1854 O LEU A 108 16.849 5.502 9.245 1.00 0.28 O ATOM 1855 CB LEU A 108 19.590 4.146 9.202 1.00 0.28 C ATOM 1856 CG LEU A 108 20.910 4.716 9.685 1.00 1.67 C ATOM 1857 CD1 LEU A 108 21.367 3.948 10.925 1.00 3.28 C ATOM 1858 CD2 LEU A 108 21.924 4.563 8.561 1.00 3.15 C ATOM 0 H LEU A 108 20.590 6.468 8.226 1.00 0.25 H new ATOM 0 HA LEU A 108 18.469 4.526 7.408 1.00 0.22 H new ATOM 0 HB2 LEU A 108 18.919 3.992 10.047 1.00 0.28 H new ATOM 0 HB3 LEU A 108 19.751 3.171 8.741 1.00 0.28 H new ATOM 0 HG LEU A 108 20.808 5.768 9.949 1.00 1.67 H new ATOM 0 HD11 LEU A 108 22.316 4.354 11.276 1.00 3.28 H new ATOM 0 HD12 LEU A 108 20.618 4.046 11.710 1.00 3.28 H new ATOM 0 HD13 LEU A 108 21.494 2.895 10.674 1.00 3.28 H new ATOM 0 HD21 LEU A 108 22.885 4.965 8.881 1.00 3.15 H new ATOM 0 HD22 LEU A 108 22.037 3.507 8.314 1.00 3.15 H new ATOM 0 HD23 LEU A 108 21.578 5.106 7.682 1.00 3.15 H new ATOM 1870 N ALA A 109 18.268 7.188 9.216 1.00 0.25 N ATOM 1871 CA ALA A 109 17.306 8.068 9.944 1.00 0.32 C ATOM 1872 C ALA A 109 15.903 7.863 9.387 1.00 0.22 C ATOM 1873 O ALA A 109 15.716 7.265 8.346 1.00 0.13 O ATOM 1874 CB ALA A 109 17.689 9.541 9.779 1.00 0.38 C ATOM 0 H ALA A 109 19.162 7.618 8.981 1.00 0.25 H new ATOM 0 HA ALA A 109 17.335 7.806 11.002 1.00 0.32 H new ATOM 0 HB1 ALA A 109 16.975 10.165 10.317 1.00 0.38 H new ATOM 0 HB2 ALA A 109 18.689 9.704 10.181 1.00 0.38 H new ATOM 0 HB3 ALA A 109 17.676 9.804 8.721 1.00 0.38 H new ATOM 1880 N PRO A 110 14.963 8.379 10.110 1.00 0.23 N ATOM 1881 CA PRO A 110 13.543 8.293 9.748 1.00 0.16 C ATOM 1882 C PRO A 110 13.246 9.236 8.580 1.00 0.08 C ATOM 1883 O PRO A 110 13.666 10.370 8.566 1.00 0.14 O ATOM 1884 CB PRO A 110 12.825 8.727 11.031 1.00 0.23 C ATOM 1885 CG PRO A 110 13.850 9.556 11.842 1.00 0.32 C ATOM 1886 CD PRO A 110 15.242 9.117 11.356 1.00 0.35 C ATOM 0 HA PRO A 110 13.228 7.303 9.417 1.00 0.16 H new ATOM 0 HB2 PRO A 110 11.940 9.320 10.800 1.00 0.23 H new ATOM 0 HB3 PRO A 110 12.488 7.861 11.600 1.00 0.23 H new ATOM 0 HG2 PRO A 110 13.701 10.624 11.681 1.00 0.32 H new ATOM 0 HG3 PRO A 110 13.737 9.376 12.911 1.00 0.32 H new ATOM 0 HD2 PRO A 110 15.892 9.974 11.177 1.00 0.35 H new ATOM 0 HD3 PRO A 110 15.742 8.486 12.091 1.00 0.35 H new ATOM 1894 N LEU A 111 12.542 8.764 7.592 1.00 0.15 N ATOM 1895 CA LEU A 111 12.227 9.622 6.413 1.00 0.24 C ATOM 1896 C LEU A 111 11.856 11.033 6.864 1.00 0.18 C ATOM 1897 O LEU A 111 12.162 11.996 6.205 1.00 0.09 O ATOM 1898 CB LEU A 111 11.045 9.015 5.652 1.00 0.38 C ATOM 1899 CG LEU A 111 11.500 8.569 4.263 1.00 0.93 C ATOM 1900 CD1 LEU A 111 11.964 9.787 3.464 1.00 3.79 C ATOM 1901 CD2 LEU A 111 12.658 7.577 4.401 1.00 1.69 C ATOM 0 H LEU A 111 12.168 7.816 7.548 1.00 0.15 H new ATOM 0 HA LEU A 111 13.105 9.674 5.770 1.00 0.24 H new ATOM 0 HB2 LEU A 111 10.643 8.165 6.204 1.00 0.38 H new ATOM 0 HB3 LEU A 111 10.242 9.747 5.564 1.00 0.38 H new ATOM 0 HG LEU A 111 10.670 8.089 3.744 1.00 0.93 H new ATOM 0 HD11 LEU A 111 12.289 9.470 2.473 1.00 3.79 H new ATOM 0 HD12 LEU A 111 11.140 10.494 3.367 1.00 3.79 H new ATOM 0 HD13 LEU A 111 12.795 10.267 3.982 1.00 3.79 H new ATOM 0 HD21 LEU A 111 12.984 7.258 3.411 1.00 1.69 H new ATOM 0 HD22 LEU A 111 13.488 8.057 4.919 1.00 1.69 H new ATOM 0 HD23 LEU A 111 12.327 6.709 4.971 1.00 1.69 H new ATOM 1913 N LYS A 112 11.179 11.167 7.959 1.00 0.32 N ATOM 1914 CA LYS A 112 10.760 12.525 8.415 1.00 0.31 C ATOM 1915 C LYS A 112 11.956 13.455 8.692 1.00 0.31 C ATOM 1916 O LYS A 112 11.884 14.625 8.402 1.00 0.33 O ATOM 1917 CB LYS A 112 9.925 12.398 9.687 1.00 0.34 C ATOM 1918 CG LYS A 112 10.522 11.322 10.593 1.00 0.38 C ATOM 1919 CD LYS A 112 10.905 11.950 11.930 1.00 0.34 C ATOM 1920 CE LYS A 112 12.106 12.872 11.726 1.00 0.35 C ATOM 1921 NZ LYS A 112 12.487 13.487 13.031 1.00 0.37 N ATOM 0 H LYS A 112 10.893 10.398 8.565 1.00 0.32 H new ATOM 0 HA LYS A 112 10.178 12.969 7.608 1.00 0.31 H new ATOM 0 HB2 LYS A 112 9.897 13.353 10.211 1.00 0.34 H new ATOM 0 HB3 LYS A 112 8.896 12.143 9.434 1.00 0.34 H new ATOM 0 HG2 LYS A 112 9.802 10.519 10.748 1.00 0.38 H new ATOM 0 HG3 LYS A 112 11.399 10.878 10.122 1.00 0.38 H new ATOM 0 HD2 LYS A 112 10.064 12.513 12.335 1.00 0.34 H new ATOM 0 HD3 LYS A 112 11.147 11.173 12.655 1.00 0.34 H new ATOM 0 HE2 LYS A 112 12.945 12.309 11.318 1.00 0.35 H new ATOM 0 HE3 LYS A 112 11.862 13.650 11.002 1.00 0.35 H new ATOM 0 HZ1 LYS A 112 12.399 14.521 12.966 1.00 0.37 H new ATOM 0 HZ2 LYS A 112 11.858 13.132 13.779 1.00 0.37 H new ATOM 0 HZ3 LYS A 112 13.470 13.237 13.259 1.00 0.37 H new ATOM 1935 N SER A 113 13.034 12.980 9.268 1.00 0.31 N ATOM 1936 CA SER A 113 14.179 13.900 9.566 1.00 0.30 C ATOM 1937 C SER A 113 15.143 13.931 8.386 1.00 0.30 C ATOM 1938 O SER A 113 16.232 14.464 8.468 1.00 0.35 O ATOM 1939 CB SER A 113 14.920 13.427 10.818 1.00 0.31 C ATOM 1940 OG SER A 113 16.107 14.191 10.974 1.00 0.29 O ATOM 0 H SER A 113 13.171 12.007 9.542 1.00 0.31 H new ATOM 0 HA SER A 113 13.787 14.902 9.738 1.00 0.30 H new ATOM 0 HB2 SER A 113 14.283 13.538 11.696 1.00 0.31 H new ATOM 0 HB3 SER A 113 15.163 12.368 10.733 1.00 0.31 H new ATOM 0 HG SER A 113 16.672 14.083 10.181 1.00 0.29 H new ATOM 1946 N LYS A 114 14.745 13.381 7.286 1.00 0.25 N ATOM 1947 CA LYS A 114 15.614 13.388 6.086 1.00 0.26 C ATOM 1948 C LYS A 114 14.944 14.288 5.057 1.00 0.27 C ATOM 1949 O LYS A 114 15.579 15.040 4.344 1.00 0.40 O ATOM 1950 CB LYS A 114 15.727 11.963 5.559 1.00 0.36 C ATOM 1951 CG LYS A 114 15.223 10.996 6.636 1.00 0.34 C ATOM 1952 CD LYS A 114 15.783 9.599 6.360 1.00 0.45 C ATOM 1953 CE LYS A 114 15.953 9.413 4.852 1.00 0.60 C ATOM 1954 NZ LYS A 114 16.356 8.007 4.567 1.00 0.53 N ATOM 0 H LYS A 114 13.843 12.920 7.162 1.00 0.25 H new ATOM 0 HA LYS A 114 16.616 13.755 6.309 1.00 0.26 H new ATOM 0 HB2 LYS A 114 15.141 11.851 4.647 1.00 0.36 H new ATOM 0 HB3 LYS A 114 16.762 11.736 5.303 1.00 0.36 H new ATOM 0 HG2 LYS A 114 15.535 11.337 7.623 1.00 0.34 H new ATOM 0 HG3 LYS A 114 14.133 10.970 6.637 1.00 0.34 H new ATOM 0 HD2 LYS A 114 16.741 9.472 6.864 1.00 0.45 H new ATOM 0 HD3 LYS A 114 15.110 8.839 6.758 1.00 0.45 H new ATOM 0 HE2 LYS A 114 15.020 9.646 4.339 1.00 0.60 H new ATOM 0 HE3 LYS A 114 16.707 10.103 4.472 1.00 0.60 H new ATOM 0 HZ1 LYS A 114 16.472 7.880 3.541 1.00 0.53 H new ATOM 0 HZ2 LYS A 114 17.256 7.800 5.045 1.00 0.53 H new ATOM 0 HZ3 LYS A 114 15.622 7.358 4.915 1.00 0.53 H new ATOM 1968 N MET A 115 13.644 14.232 5.017 1.00 0.24 N ATOM 1969 CA MET A 115 12.867 15.092 4.086 1.00 0.26 C ATOM 1970 C MET A 115 12.646 16.432 4.746 1.00 0.20 C ATOM 1971 O MET A 115 12.339 17.415 4.104 1.00 0.22 O ATOM 1972 CB MET A 115 11.469 14.518 3.891 1.00 0.33 C ATOM 1973 CG MET A 115 11.529 13.001 3.698 1.00 0.40 C ATOM 1974 SD MET A 115 10.567 12.532 2.237 1.00 1.08 S ATOM 1975 CE MET A 115 11.433 13.574 1.038 1.00 2.80 C ATOM 0 H MET A 115 13.078 13.616 5.600 1.00 0.24 H new ATOM 0 HA MET A 115 13.412 15.160 3.144 1.00 0.26 H new ATOM 0 HB2 MET A 115 10.849 14.755 4.756 1.00 0.33 H new ATOM 0 HB3 MET A 115 10.998 14.981 3.024 1.00 0.33 H new ATOM 0 HG2 MET A 115 12.564 12.680 3.582 1.00 0.40 H new ATOM 0 HG3 MET A 115 11.136 12.497 4.581 1.00 0.40 H new ATOM 0 HE1 MET A 115 11.481 13.061 0.078 1.00 2.80 H new ATOM 0 HE2 MET A 115 10.897 14.516 0.920 1.00 2.80 H new ATOM 0 HE3 MET A 115 12.444 13.774 1.393 1.00 2.80 H new ATOM 1985 N ILE A 116 12.723 16.454 6.041 1.00 0.22 N ATOM 1986 CA ILE A 116 12.436 17.667 6.773 1.00 0.21 C ATOM 1987 C ILE A 116 13.580 18.635 6.697 1.00 0.28 C ATOM 1988 O ILE A 116 13.435 19.787 6.360 1.00 0.33 O ATOM 1989 CB ILE A 116 12.297 17.271 8.215 1.00 0.33 C ATOM 1990 CG1 ILE A 116 10.827 17.098 8.568 1.00 0.41 C ATOM 1991 CG2 ILE A 116 12.913 18.343 9.066 1.00 0.34 C ATOM 1992 CD1 ILE A 116 10.681 16.832 10.070 1.00 0.64 C ATOM 0 H ILE A 116 12.980 15.654 6.619 1.00 0.22 H new ATOM 0 HA ILE A 116 11.544 18.137 6.359 1.00 0.21 H new ATOM 0 HB ILE A 116 12.805 16.323 8.392 1.00 0.33 H new ATOM 0 HG12 ILE A 116 10.270 17.993 8.292 1.00 0.41 H new ATOM 0 HG13 ILE A 116 10.402 16.270 8.000 1.00 0.41 H new ATOM 0 HG21 ILE A 116 12.821 18.071 10.117 1.00 0.34 H new ATOM 0 HG22 ILE A 116 13.967 18.450 8.810 1.00 0.34 H new ATOM 0 HG23 ILE A 116 12.399 19.288 8.889 1.00 0.34 H new ATOM 0 HD11 ILE A 116 9.626 16.709 10.317 1.00 0.64 H new ATOM 0 HD12 ILE A 116 11.224 15.924 10.333 1.00 0.64 H new ATOM 0 HD13 ILE A 116 11.089 17.674 10.630 1.00 0.64 H new ATOM 2004 N TYR A 117 14.704 18.149 7.069 1.00 0.36 N ATOM 2005 CA TYR A 117 15.922 18.970 7.099 1.00 0.51 C ATOM 2006 C TYR A 117 16.165 19.464 5.694 1.00 0.52 C ATOM 2007 O TYR A 117 16.683 20.534 5.461 1.00 0.64 O ATOM 2008 CB TYR A 117 17.044 18.082 7.561 1.00 0.59 C ATOM 2009 CG TYR A 117 16.997 17.963 9.065 1.00 0.68 C ATOM 2010 CD1 TYR A 117 16.163 17.005 9.655 1.00 1.31 C ATOM 2011 CD2 TYR A 117 17.776 18.802 9.868 1.00 1.10 C ATOM 2012 CE1 TYR A 117 16.108 16.885 11.047 1.00 1.37 C ATOM 2013 CE2 TYR A 117 17.721 18.681 11.263 1.00 1.17 C ATOM 2014 CZ TYR A 117 16.886 17.722 11.852 1.00 0.87 C ATOM 2015 OH TYR A 117 16.831 17.604 13.225 1.00 0.98 O ATOM 0 H TYR A 117 14.838 17.182 7.365 1.00 0.36 H new ATOM 0 HA TYR A 117 15.841 19.826 7.769 1.00 0.51 H new ATOM 0 HB2 TYR A 117 16.956 17.097 7.104 1.00 0.59 H new ATOM 0 HB3 TYR A 117 18.003 18.494 7.247 1.00 0.59 H new ATOM 0 HD1 TYR A 117 15.561 16.358 9.034 1.00 1.31 H new ATOM 0 HD2 TYR A 117 18.419 19.542 9.414 1.00 1.10 H new ATOM 0 HE1 TYR A 117 15.464 16.146 11.500 1.00 1.37 H new ATOM 0 HE2 TYR A 117 18.323 19.327 11.885 1.00 1.17 H new ATOM 0 HH TYR A 117 16.629 16.676 13.466 1.00 0.98 H new ATOM 2025 N ALA A 118 15.732 18.691 4.760 1.00 0.43 N ATOM 2026 CA ALA A 118 15.848 19.080 3.349 1.00 0.53 C ATOM 2027 C ALA A 118 15.331 20.509 3.220 1.00 0.53 C ATOM 2028 O ALA A 118 15.922 21.350 2.569 1.00 0.67 O ATOM 2029 CB ALA A 118 14.949 18.148 2.569 1.00 0.51 C ATOM 0 H ALA A 118 15.292 17.785 4.920 1.00 0.43 H new ATOM 0 HA ALA A 118 16.874 19.024 2.984 1.00 0.53 H new ATOM 0 HB1 ALA A 118 14.999 18.396 1.509 1.00 0.51 H new ATOM 0 HB2 ALA A 118 15.276 17.119 2.716 1.00 0.51 H new ATOM 0 HB3 ALA A 118 13.922 18.256 2.919 1.00 0.51 H new ATOM 2035 N SER A 119 14.221 20.777 3.858 1.00 0.41 N ATOM 2036 CA SER A 119 13.629 22.140 3.813 1.00 0.49 C ATOM 2037 C SER A 119 14.000 22.893 5.094 1.00 0.46 C ATOM 2038 O SER A 119 13.803 24.088 5.197 1.00 0.45 O ATOM 2039 CB SER A 119 12.111 22.030 3.708 1.00 0.69 C ATOM 2040 OG SER A 119 11.686 22.567 2.461 1.00 0.89 O ATOM 0 H SER A 119 13.697 20.100 4.413 1.00 0.41 H new ATOM 0 HA SER A 119 14.014 22.679 2.947 1.00 0.49 H new ATOM 0 HB2 SER A 119 11.804 20.988 3.792 1.00 0.69 H new ATOM 0 HB3 SER A 119 11.638 22.569 4.529 1.00 0.69 H new ATOM 0 HG SER A 119 10.711 22.496 2.390 1.00 0.89 H new ATOM 2046 N SER A 120 14.562 22.214 6.063 1.00 0.45 N ATOM 2047 CA SER A 120 14.965 22.933 7.313 1.00 0.41 C ATOM 2048 C SER A 120 16.117 23.826 6.940 1.00 0.21 C ATOM 2049 O SER A 120 16.311 24.872 7.503 1.00 0.16 O ATOM 2050 CB SER A 120 15.407 21.970 8.413 1.00 0.52 C ATOM 2051 OG SER A 120 15.309 22.626 9.669 1.00 0.96 O ATOM 0 H SER A 120 14.757 21.213 6.046 1.00 0.45 H new ATOM 0 HA SER A 120 14.115 23.492 7.705 1.00 0.41 H new ATOM 0 HB2 SER A 120 14.782 21.077 8.405 1.00 0.52 H new ATOM 0 HB3 SER A 120 16.432 21.643 8.238 1.00 0.52 H new ATOM 0 HG SER A 120 15.299 23.596 9.531 1.00 0.96 H new ATOM 2057 N LYS A 121 16.856 23.416 5.959 1.00 0.19 N ATOM 2058 CA LYS A 121 17.978 24.231 5.467 1.00 0.23 C ATOM 2059 C LYS A 121 17.387 25.275 4.553 1.00 0.44 C ATOM 2060 O LYS A 121 17.369 25.189 3.341 1.00 0.65 O ATOM 2061 CB LYS A 121 18.954 23.381 4.727 1.00 0.33 C ATOM 2062 CG LYS A 121 20.212 23.291 5.565 1.00 0.35 C ATOM 2063 CD LYS A 121 20.987 22.054 5.134 1.00 0.58 C ATOM 2064 CE LYS A 121 21.215 22.097 3.621 1.00 1.46 C ATOM 2065 NZ LYS A 121 20.720 20.830 3.011 1.00 1.53 N ATOM 0 H LYS A 121 16.724 22.531 5.470 1.00 0.19 H new ATOM 0 HA LYS A 121 18.516 24.696 6.293 1.00 0.23 H new ATOM 0 HB2 LYS A 121 18.540 22.388 4.550 1.00 0.33 H new ATOM 0 HB3 LYS A 121 19.175 23.813 3.751 1.00 0.33 H new ATOM 0 HG2 LYS A 121 20.821 24.185 5.433 1.00 0.35 H new ATOM 0 HG3 LYS A 121 19.959 23.231 6.624 1.00 0.35 H new ATOM 0 HD2 LYS A 121 21.943 22.011 5.656 1.00 0.58 H new ATOM 0 HD3 LYS A 121 20.435 21.154 5.404 1.00 0.58 H new ATOM 0 HE2 LYS A 121 20.694 22.951 3.187 1.00 1.46 H new ATOM 0 HE3 LYS A 121 22.275 22.228 3.405 1.00 1.46 H new ATOM 0 HZ1 LYS A 121 21.121 20.724 2.057 1.00 1.53 H new ATOM 0 HZ2 LYS A 121 21.011 20.024 3.600 1.00 1.53 H new ATOM 0 HZ3 LYS A 121 19.682 20.857 2.949 1.00 1.53 H new ATOM 2079 N ASP A 122 16.874 26.222 5.203 1.00 0.41 N ATOM 2080 CA ASP A 122 16.175 27.375 4.594 1.00 0.61 C ATOM 2081 C ASP A 122 15.676 28.153 5.788 1.00 0.54 C ATOM 2082 O ASP A 122 15.760 29.362 5.868 1.00 0.64 O ATOM 2083 CB ASP A 122 14.983 26.890 3.769 1.00 0.76 C ATOM 2084 CG ASP A 122 14.905 27.679 2.460 1.00 0.87 C ATOM 2085 OD1 ASP A 122 15.615 28.663 2.339 1.00 0.81 O ATOM 2086 OD2 ASP A 122 14.135 27.284 1.599 1.00 1.50 O ATOM 0 H ASP A 122 16.903 26.266 6.222 1.00 0.41 H new ATOM 0 HA ASP A 122 16.814 27.957 3.930 1.00 0.61 H new ATOM 0 HB2 ASP A 122 15.084 25.826 3.557 1.00 0.76 H new ATOM 0 HB3 ASP A 122 14.061 27.016 4.336 1.00 0.76 H new ATOM 2091 N ALA A 123 15.221 27.411 6.756 1.00 0.40 N ATOM 2092 CA ALA A 123 14.770 28.019 8.029 1.00 0.35 C ATOM 2093 C ALA A 123 16.038 28.361 8.793 1.00 0.16 C ATOM 2094 O ALA A 123 16.283 29.489 9.171 1.00 0.09 O ATOM 2095 CB ALA A 123 13.975 26.983 8.811 1.00 0.41 C ATOM 0 H ALA A 123 15.143 26.395 6.715 1.00 0.40 H new ATOM 0 HA ALA A 123 14.144 28.897 7.870 1.00 0.35 H new ATOM 0 HB1 ALA A 123 13.637 27.418 9.751 1.00 0.41 H new ATOM 0 HB2 ALA A 123 13.111 26.669 8.225 1.00 0.41 H new ATOM 0 HB3 ALA A 123 14.607 26.119 9.017 1.00 0.41 H new ATOM 2101 N ILE A 124 16.872 27.374 8.958 1.00 0.11 N ATOM 2102 CA ILE A 124 18.169 27.569 9.620 1.00 0.13 C ATOM 2103 C ILE A 124 18.976 28.499 8.741 1.00 0.37 C ATOM 2104 O ILE A 124 19.640 29.385 9.212 1.00 0.55 O ATOM 2105 CB ILE A 124 18.867 26.235 9.707 1.00 0.09 C ATOM 2106 CG1 ILE A 124 20.192 26.432 10.412 1.00 0.09 C ATOM 2107 CG2 ILE A 124 19.089 25.704 8.299 1.00 0.09 C ATOM 2108 CD1 ILE A 124 20.546 25.170 11.178 1.00 0.26 C ATOM 0 H ILE A 124 16.694 26.418 8.649 1.00 0.11 H new ATOM 0 HA ILE A 124 18.052 27.983 10.622 1.00 0.13 H new ATOM 0 HB ILE A 124 18.265 25.518 10.265 1.00 0.09 H new ATOM 0 HG12 ILE A 124 20.972 26.662 9.686 1.00 0.09 H new ATOM 0 HG13 ILE A 124 20.131 27.280 11.094 1.00 0.09 H new ATOM 0 HG21 ILE A 124 19.593 24.739 8.349 1.00 0.09 H new ATOM 0 HG22 ILE A 124 18.128 25.585 7.799 1.00 0.09 H new ATOM 0 HG23 ILE A 124 19.705 26.407 7.738 1.00 0.09 H new ATOM 0 HD11 ILE A 124 21.500 25.309 11.687 1.00 0.26 H new ATOM 0 HD12 ILE A 124 19.769 24.961 11.914 1.00 0.26 H new ATOM 0 HD13 ILE A 124 20.623 24.333 10.484 1.00 0.26 H new ATOM 2120 N LYS A 125 18.896 28.286 7.452 1.00 0.47 N ATOM 2121 CA LYS A 125 19.616 29.142 6.473 1.00 0.74 C ATOM 2122 C LYS A 125 19.206 30.609 6.651 1.00 0.77 C ATOM 2123 O LYS A 125 20.007 31.509 6.494 1.00 0.86 O ATOM 2124 CB LYS A 125 19.226 28.688 5.070 1.00 0.91 C ATOM 2125 CG LYS A 125 20.386 27.928 4.441 1.00 1.23 C ATOM 2126 CD LYS A 125 20.625 26.627 5.206 1.00 0.75 C ATOM 2127 CE LYS A 125 22.014 26.664 5.841 1.00 0.54 C ATOM 2128 NZ LYS A 125 22.989 25.985 4.941 1.00 1.32 N ATOM 0 H LYS A 125 18.348 27.536 7.032 1.00 0.47 H new ATOM 0 HA LYS A 125 20.691 29.053 6.628 1.00 0.74 H new ATOM 0 HB2 LYS A 125 18.342 28.052 5.115 1.00 0.91 H new ATOM 0 HB3 LYS A 125 18.967 29.551 4.456 1.00 0.91 H new ATOM 0 HG2 LYS A 125 20.167 27.711 3.395 1.00 1.23 H new ATOM 0 HG3 LYS A 125 21.287 28.542 4.457 1.00 1.23 H new ATOM 0 HD2 LYS A 125 19.864 26.499 5.976 1.00 0.75 H new ATOM 0 HD3 LYS A 125 20.543 25.775 4.532 1.00 0.75 H new ATOM 0 HE2 LYS A 125 22.319 27.696 6.014 1.00 0.54 H new ATOM 0 HE3 LYS A 125 21.995 26.171 6.813 1.00 0.54 H new ATOM 0 HZ1 LYS A 125 23.240 25.057 5.338 1.00 1.32 H new ATOM 0 HZ2 LYS A 125 22.563 25.856 4.001 1.00 1.32 H new ATOM 0 HZ3 LYS A 125 23.846 26.568 4.855 1.00 1.32 H new ATOM 2142 N LYS A 126 17.960 30.861 6.962 1.00 0.73 N ATOM 2143 CA LYS A 126 17.507 32.279 7.128 1.00 0.80 C ATOM 2144 C LYS A 126 18.393 32.985 8.151 1.00 0.92 C ATOM 2145 O LYS A 126 18.492 34.195 8.181 1.00 1.08 O ATOM 2146 CB LYS A 126 16.048 32.310 7.596 1.00 0.62 C ATOM 2147 CG LYS A 126 15.949 33.068 8.925 1.00 2.29 C ATOM 2148 CD LYS A 126 14.478 33.308 9.278 1.00 2.47 C ATOM 2149 CE LYS A 126 13.660 32.046 8.994 1.00 2.53 C ATOM 2150 NZ LYS A 126 12.526 31.965 9.961 1.00 4.18 N ATOM 0 H LYS A 126 17.240 30.153 7.108 1.00 0.73 H new ATOM 0 HA LYS A 126 17.584 32.793 6.170 1.00 0.80 H new ATOM 0 HB2 LYS A 126 15.425 32.793 6.843 1.00 0.62 H new ATOM 0 HB3 LYS A 126 15.673 31.294 7.717 1.00 0.62 H new ATOM 0 HG2 LYS A 126 16.434 32.497 9.717 1.00 2.29 H new ATOM 0 HG3 LYS A 126 16.475 34.020 8.851 1.00 2.29 H new ATOM 0 HD2 LYS A 126 14.387 33.581 10.329 1.00 2.47 H new ATOM 0 HD3 LYS A 126 14.087 34.143 8.697 1.00 2.47 H new ATOM 0 HE2 LYS A 126 13.281 32.067 7.972 1.00 2.53 H new ATOM 0 HE3 LYS A 126 14.292 31.162 9.082 1.00 2.53 H new ATOM 0 HZ1 LYS A 126 11.968 31.108 9.771 1.00 4.18 H new ATOM 0 HZ2 LYS A 126 12.899 31.927 10.931 1.00 4.18 H new ATOM 0 HZ3 LYS A 126 11.920 32.803 9.856 1.00 4.18 H new ATOM 2164 N LYS A 127 19.049 32.232 8.968 1.00 0.92 N ATOM 2165 CA LYS A 127 19.957 32.815 9.982 1.00 1.16 C ATOM 2166 C LYS A 127 21.343 32.230 9.747 1.00 1.21 C ATOM 2167 O LYS A 127 22.328 32.698 10.283 1.00 1.42 O ATOM 2168 CB LYS A 127 19.472 32.449 11.386 1.00 1.16 C ATOM 2169 CG LYS A 127 18.273 33.323 11.755 1.00 1.41 C ATOM 2170 CD LYS A 127 18.752 34.752 12.015 1.00 1.62 C ATOM 2171 CE LYS A 127 17.664 35.740 11.596 1.00 2.00 C ATOM 2172 NZ LYS A 127 17.396 36.681 12.718 1.00 3.31 N ATOM 0 H LYS A 127 18.996 31.213 8.979 1.00 0.92 H new ATOM 0 HA LYS A 127 19.978 33.902 9.898 1.00 1.16 H new ATOM 0 HB2 LYS A 127 19.193 31.396 11.423 1.00 1.16 H new ATOM 0 HB3 LYS A 127 20.276 32.591 12.109 1.00 1.16 H new ATOM 0 HG2 LYS A 127 17.540 33.314 10.949 1.00 1.41 H new ATOM 0 HG3 LYS A 127 17.778 32.926 12.641 1.00 1.41 H new ATOM 0 HD2 LYS A 127 18.988 34.881 13.071 1.00 1.62 H new ATOM 0 HD3 LYS A 127 19.668 34.946 11.458 1.00 1.62 H new ATOM 0 HE2 LYS A 127 17.979 36.292 10.711 1.00 2.00 H new ATOM 0 HE3 LYS A 127 16.753 35.204 11.330 1.00 2.00 H new ATOM 0 HZ1 LYS A 127 16.656 37.355 12.436 1.00 3.31 H new ATOM 0 HZ2 LYS A 127 17.078 36.146 13.551 1.00 3.31 H new ATOM 0 HZ3 LYS A 127 18.266 37.200 12.951 1.00 3.31 H new ATOM 2186 N PHE A 128 21.428 31.210 8.926 1.00 1.02 N ATOM 2187 CA PHE A 128 22.748 30.595 8.632 1.00 1.04 C ATOM 2188 C PHE A 128 23.306 31.240 7.391 1.00 1.19 C ATOM 2189 O PHE A 128 23.806 30.606 6.484 1.00 1.31 O ATOM 2190 CB PHE A 128 22.578 29.102 8.448 1.00 0.85 C ATOM 2191 CG PHE A 128 22.769 28.495 9.795 1.00 0.80 C ATOM 2192 CD1 PHE A 128 22.442 29.264 10.911 1.00 0.95 C ATOM 2193 CD2 PHE A 128 23.253 27.195 9.945 1.00 0.65 C ATOM 2194 CE1 PHE A 128 22.596 28.743 12.185 1.00 0.98 C ATOM 2195 CE2 PHE A 128 23.404 26.666 11.229 1.00 0.69 C ATOM 2196 CZ PHE A 128 23.075 27.442 12.353 1.00 0.86 C ATOM 0 H PHE A 128 20.635 30.781 8.449 1.00 1.02 H new ATOM 0 HA PHE A 128 23.443 30.754 9.457 1.00 1.04 H new ATOM 0 HB2 PHE A 128 21.590 28.868 8.052 1.00 0.85 H new ATOM 0 HB3 PHE A 128 23.307 28.711 7.738 1.00 0.85 H new ATOM 0 HD1 PHE A 128 22.068 30.269 10.782 1.00 0.95 H new ATOM 0 HD2 PHE A 128 23.508 26.604 9.078 1.00 0.65 H new ATOM 0 HE1 PHE A 128 22.346 29.342 13.048 1.00 0.98 H new ATOM 0 HE2 PHE A 128 23.774 25.660 11.358 1.00 0.69 H new ATOM 0 HZ PHE A 128 23.192 27.033 13.346 1.00 0.86 H new ATOM 2206 N GLN A 129 23.209 32.517 7.380 1.00 1.24 N ATOM 2207 CA GLN A 129 23.714 33.314 6.229 1.00 1.42 C ATOM 2208 C GLN A 129 25.238 33.168 6.159 1.00 0.97 C ATOM 2209 O GLN A 129 25.828 33.178 5.098 1.00 1.16 O ATOM 2210 CB GLN A 129 23.329 34.783 6.421 1.00 1.96 C ATOM 2211 CG GLN A 129 21.919 34.864 7.020 1.00 2.36 C ATOM 2212 CD GLN A 129 20.881 34.548 5.941 1.00 2.65 C ATOM 2213 OE1 GLN A 129 21.180 33.887 4.968 1.00 4.25 O ATOM 2214 NE2 GLN A 129 19.662 34.997 6.077 1.00 2.17 N ATOM 0 H GLN A 129 22.794 33.068 8.131 1.00 1.24 H new ATOM 0 HA GLN A 129 23.274 32.955 5.299 1.00 1.42 H new ATOM 0 HB2 GLN A 129 24.045 35.275 7.079 1.00 1.96 H new ATOM 0 HB3 GLN A 129 23.361 35.307 5.466 1.00 1.96 H new ATOM 0 HG2 GLN A 129 21.824 34.160 7.847 1.00 2.36 H new ATOM 0 HG3 GLN A 129 21.743 35.860 7.427 1.00 2.36 H new ATOM 0 HE21 GLN A 129 19.411 35.552 6.895 1.00 2.17 H new ATOM 0 HE22 GLN A 129 18.961 34.792 5.365 1.00 2.17 H new ATOM 2223 N GLY A 130 25.871 33.008 7.291 1.00 0.69 N ATOM 2224 CA GLY A 130 27.355 32.828 7.318 1.00 0.35 C ATOM 2225 C GLY A 130 27.661 31.559 8.113 1.00 0.37 C ATOM 2226 O GLY A 130 28.390 31.576 9.084 1.00 0.52 O ATOM 0 H GLY A 130 25.421 32.994 8.206 1.00 0.69 H new ATOM 0 HA2 GLY A 130 27.748 32.747 6.304 1.00 0.35 H new ATOM 0 HA3 GLY A 130 27.836 33.691 7.778 1.00 0.35 H new ATOM 2230 N ILE A 131 27.079 30.465 7.701 1.00 0.30 N ATOM 2231 CA ILE A 131 27.257 29.168 8.387 1.00 0.34 C ATOM 2232 C ILE A 131 28.708 28.816 8.558 1.00 0.30 C ATOM 2233 O ILE A 131 29.040 27.940 9.331 1.00 0.29 O ATOM 2234 CB ILE A 131 26.575 28.115 7.516 1.00 0.35 C ATOM 2235 CG1 ILE A 131 25.483 27.444 8.266 1.00 0.46 C ATOM 2236 CG2 ILE A 131 27.542 27.045 7.110 1.00 0.31 C ATOM 2237 CD1 ILE A 131 26.010 27.059 9.612 1.00 0.34 C ATOM 0 H ILE A 131 26.467 30.424 6.886 1.00 0.30 H new ATOM 0 HA ILE A 131 26.824 29.218 9.386 1.00 0.34 H new ATOM 0 HB ILE A 131 26.187 28.634 6.640 1.00 0.35 H new ATOM 0 HG12 ILE A 131 24.627 28.111 8.369 1.00 0.46 H new ATOM 0 HG13 ILE A 131 25.137 26.562 7.727 1.00 0.46 H new ATOM 0 HG21 ILE A 131 27.030 26.308 6.491 1.00 0.31 H new ATOM 0 HG22 ILE A 131 28.360 27.490 6.544 1.00 0.31 H new ATOM 0 HG23 ILE A 131 27.940 26.557 8.000 1.00 0.31 H new ATOM 0 HD11 ILE A 131 25.224 26.564 10.182 1.00 0.34 H new ATOM 0 HD12 ILE A 131 26.854 26.380 9.492 1.00 0.34 H new ATOM 0 HD13 ILE A 131 26.336 27.953 10.144 1.00 0.34 H new ATOM 2249 N LYS A 132 29.563 29.443 7.821 1.00 0.28 N ATOM 2250 CA LYS A 132 31.007 29.100 7.883 1.00 0.23 C ATOM 2251 C LYS A 132 31.172 27.891 7.005 1.00 0.24 C ATOM 2252 O LYS A 132 32.027 27.837 6.141 1.00 0.23 O ATOM 2253 CB LYS A 132 31.462 28.718 9.293 1.00 0.15 C ATOM 2254 CG LYS A 132 30.824 29.642 10.320 1.00 0.19 C ATOM 2255 CD LYS A 132 30.866 31.082 9.813 1.00 0.27 C ATOM 2256 CE LYS A 132 32.318 31.556 9.737 1.00 0.22 C ATOM 2257 NZ LYS A 132 32.431 32.660 8.742 1.00 0.40 N ATOM 0 H LYS A 132 29.326 30.189 7.168 1.00 0.28 H new ATOM 0 HA LYS A 132 31.598 29.962 7.573 1.00 0.23 H new ATOM 0 HB2 LYS A 132 31.188 27.684 9.504 1.00 0.15 H new ATOM 0 HB3 LYS A 132 32.548 28.781 9.362 1.00 0.15 H new ATOM 0 HG2 LYS A 132 29.793 29.341 10.503 1.00 0.19 H new ATOM 0 HG3 LYS A 132 31.352 29.565 11.270 1.00 0.19 H new ATOM 0 HD2 LYS A 132 30.400 31.146 8.830 1.00 0.27 H new ATOM 0 HD3 LYS A 132 30.296 31.730 10.479 1.00 0.27 H new ATOM 0 HE2 LYS A 132 32.651 31.900 10.716 1.00 0.22 H new ATOM 0 HE3 LYS A 132 32.967 30.728 9.452 1.00 0.22 H new ATOM 0 HZ1 LYS A 132 33.419 32.982 8.691 1.00 0.40 H new ATOM 0 HZ2 LYS A 132 32.130 32.317 7.807 1.00 0.40 H new ATOM 0 HZ3 LYS A 132 31.823 33.453 9.032 1.00 0.40 H new ATOM 2271 N HIS A 133 30.348 26.901 7.215 1.00 0.26 N ATOM 2272 CA HIS A 133 30.494 25.691 6.350 1.00 0.28 C ATOM 2273 C HIS A 133 29.218 24.876 6.211 1.00 0.36 C ATOM 2274 O HIS A 133 28.959 23.986 6.995 1.00 0.40 O ATOM 2275 CB HIS A 133 31.542 24.774 6.943 1.00 0.23 C ATOM 2276 CG HIS A 133 32.860 25.052 6.301 1.00 0.20 C ATOM 2277 ND1 HIS A 133 32.997 25.266 4.939 1.00 0.38 N ATOM 2278 CD2 HIS A 133 34.109 25.183 6.831 1.00 0.23 C ATOM 2279 CE1 HIS A 133 34.295 25.518 4.700 1.00 0.52 C ATOM 2280 NE2 HIS A 133 35.018 25.480 5.822 1.00 0.42 N ATOM 0 H HIS A 133 29.608 26.872 7.917 1.00 0.26 H new ATOM 0 HA HIS A 133 30.768 26.064 5.363 1.00 0.28 H new ATOM 0 HB2 HIS A 133 31.609 24.928 8.020 1.00 0.23 H new ATOM 0 HB3 HIS A 133 31.261 23.732 6.787 1.00 0.23 H new ATOM 0 HD1 HIS A 133 32.250 25.237 4.245 1.00 0.38 H new ATOM 0 HD2 HIS A 133 34.355 25.073 7.877 1.00 0.23 H new ATOM 0 HE1 HIS A 133 34.703 25.726 3.722 1.00 0.52 H new ATOM 2288 N GLU A 134 28.464 25.085 5.176 1.00 0.39 N ATOM 2289 CA GLU A 134 27.288 24.211 4.999 1.00 0.46 C ATOM 2290 C GLU A 134 27.825 22.882 4.498 1.00 0.49 C ATOM 2291 O GLU A 134 28.327 22.769 3.397 1.00 0.54 O ATOM 2292 CB GLU A 134 26.294 24.768 4.004 1.00 0.51 C ATOM 2293 CG GLU A 134 25.932 23.682 2.989 1.00 0.63 C ATOM 2294 CD GLU A 134 24.670 24.086 2.225 1.00 0.70 C ATOM 2295 OE1 GLU A 134 24.591 25.230 1.809 1.00 1.02 O ATOM 2296 OE2 GLU A 134 23.803 23.242 2.066 1.00 0.63 O ATOM 0 H GLU A 134 28.606 25.802 4.465 1.00 0.39 H new ATOM 0 HA GLU A 134 26.751 24.118 5.943 1.00 0.46 H new ATOM 0 HB2 GLU A 134 25.398 25.112 4.521 1.00 0.51 H new ATOM 0 HB3 GLU A 134 26.719 25.632 3.493 1.00 0.51 H new ATOM 0 HG2 GLU A 134 26.757 23.533 2.293 1.00 0.63 H new ATOM 0 HG3 GLU A 134 25.770 22.733 3.500 1.00 0.63 H new ATOM 2303 N CYS A 135 27.777 21.900 5.322 1.00 0.49 N ATOM 2304 CA CYS A 135 28.347 20.574 4.927 1.00 0.55 C ATOM 2305 C CYS A 135 27.259 19.514 4.686 1.00 1.13 C ATOM 2306 O CYS A 135 26.690 19.439 3.617 1.00 3.33 O ATOM 2307 CB CYS A 135 29.308 20.088 6.024 1.00 0.53 C ATOM 2308 SG CYS A 135 29.855 18.402 5.654 1.00 1.19 S ATOM 0 H CYS A 135 27.371 21.940 6.257 1.00 0.49 H new ATOM 0 HA CYS A 135 28.878 20.711 3.985 1.00 0.55 H new ATOM 0 HB2 CYS A 135 30.169 20.754 6.088 1.00 0.53 H new ATOM 0 HB3 CYS A 135 28.811 20.115 6.994 1.00 0.53 H new ATOM 0 HG CYS A 135 28.887 17.569 5.895 1.00 1.19 H new ATOM 2314 N GLN A 136 27.020 18.676 5.670 1.00 0.99 N ATOM 2315 CA GLN A 136 26.031 17.563 5.569 1.00 0.57 C ATOM 2316 C GLN A 136 26.795 16.254 5.659 1.00 0.45 C ATOM 2317 O GLN A 136 27.963 16.181 5.331 1.00 0.56 O ATOM 2318 CB GLN A 136 25.242 17.558 4.257 1.00 0.68 C ATOM 2319 CG GLN A 136 24.337 16.330 4.276 1.00 0.57 C ATOM 2320 CD GLN A 136 23.143 16.508 3.341 1.00 0.75 C ATOM 2321 OE1 GLN A 136 22.051 17.054 3.799 1.00 1.13 O flip ATOM 2322 NE2 GLN A 136 23.204 16.147 2.182 1.00 0.51 N flip ATOM 0 H GLN A 136 27.492 18.725 6.573 1.00 0.99 H new ATOM 0 HA GLN A 136 25.311 17.695 6.377 1.00 0.57 H new ATOM 0 HB2 GLN A 136 24.651 18.469 4.160 1.00 0.68 H new ATOM 0 HB3 GLN A 136 25.918 17.524 3.402 1.00 0.68 H new ATOM 0 HG2 GLN A 136 24.907 15.450 3.978 1.00 0.57 H new ATOM 0 HG3 GLN A 136 23.983 16.152 5.291 1.00 0.57 H new ATOM 0 HE21 GLN A 136 24.059 15.720 1.825 1.00 0.51 H new ATOM 0 HE22 GLN A 136 22.400 16.271 1.566 1.00 0.51 H new ATOM 2331 N ALA A 137 26.149 15.220 6.097 1.00 0.28 N ATOM 2332 CA ALA A 137 26.844 13.918 6.203 1.00 0.26 C ATOM 2333 C ALA A 137 25.834 12.794 6.182 1.00 0.27 C ATOM 2334 O ALA A 137 25.069 12.605 7.102 1.00 0.26 O ATOM 2335 CB ALA A 137 27.641 13.857 7.498 1.00 0.19 C ATOM 0 H ALA A 137 25.171 15.219 6.386 1.00 0.28 H new ATOM 0 HA ALA A 137 27.523 13.812 5.357 1.00 0.26 H new ATOM 0 HB1 ALA A 137 28.149 12.895 7.568 1.00 0.19 H new ATOM 0 HB2 ALA A 137 28.379 14.659 7.509 1.00 0.19 H new ATOM 0 HB3 ALA A 137 26.966 13.973 8.346 1.00 0.19 H new ATOM 2341 N ASN A 138 25.855 12.014 5.151 1.00 0.27 N ATOM 2342 CA ASN A 138 24.925 10.867 5.082 1.00 0.27 C ATOM 2343 C ASN A 138 25.745 9.660 5.459 1.00 0.27 C ATOM 2344 O ASN A 138 25.787 8.634 4.808 1.00 0.28 O ATOM 2345 CB ASN A 138 24.324 10.757 3.693 1.00 0.33 C ATOM 2346 CG ASN A 138 23.394 11.967 3.463 1.00 0.57 C ATOM 2347 OD1 ASN A 138 23.851 13.190 3.645 1.00 1.65 O flip ATOM 2348 ND2 ASN A 138 22.242 11.799 3.115 1.00 0.57 N flip ATOM 0 H ASN A 138 26.477 12.120 4.350 1.00 0.27 H new ATOM 0 HA ASN A 138 24.076 10.973 5.758 1.00 0.27 H new ATOM 0 HB2 ASN A 138 25.112 10.737 2.940 1.00 0.33 H new ATOM 0 HB3 ASN A 138 23.765 9.826 3.595 1.00 0.33 H new ATOM 0 HD21 ASN A 138 21.885 10.854 2.973 1.00 0.57 H new ATOM 0 HD22 ASN A 138 21.632 12.603 2.965 1.00 0.57 H new ATOM 2355 N GLY A 139 26.432 9.864 6.527 1.00 0.29 N ATOM 2356 CA GLY A 139 27.359 8.898 7.106 1.00 0.30 C ATOM 2357 C GLY A 139 28.237 9.781 7.962 1.00 0.35 C ATOM 2358 O GLY A 139 28.480 10.917 7.605 1.00 0.38 O ATOM 0 H GLY A 139 26.377 10.734 7.057 1.00 0.29 H new ATOM 0 HA2 GLY A 139 26.843 8.140 7.696 1.00 0.30 H new ATOM 0 HA3 GLY A 139 27.931 8.372 6.341 1.00 0.30 H new ATOM 2362 N PRO A 140 28.677 9.285 9.054 1.00 0.38 N ATOM 2363 CA PRO A 140 29.513 10.077 9.950 1.00 0.43 C ATOM 2364 C PRO A 140 30.874 10.332 9.270 1.00 0.46 C ATOM 2365 O PRO A 140 31.753 10.961 9.825 1.00 0.49 O ATOM 2366 CB PRO A 140 29.635 9.195 11.196 1.00 0.43 C ATOM 2367 CG PRO A 140 29.314 7.756 10.731 1.00 0.40 C ATOM 2368 CD PRO A 140 28.421 7.909 9.483 1.00 0.36 C ATOM 0 HA PRO A 140 29.112 11.060 10.199 1.00 0.43 H new ATOM 0 HB2 PRO A 140 30.638 9.254 11.619 1.00 0.43 H new ATOM 0 HB3 PRO A 140 28.942 9.518 11.972 1.00 0.43 H new ATOM 0 HG2 PRO A 140 30.226 7.208 10.495 1.00 0.40 H new ATOM 0 HG3 PRO A 140 28.801 7.197 11.513 1.00 0.40 H new ATOM 0 HD2 PRO A 140 28.686 7.190 8.708 1.00 0.36 H new ATOM 0 HD3 PRO A 140 27.369 7.750 9.719 1.00 0.36 H new ATOM 2376 N GLU A 141 31.046 9.829 8.062 1.00 0.44 N ATOM 2377 CA GLU A 141 32.321 10.009 7.317 1.00 0.47 C ATOM 2378 C GLU A 141 32.269 11.282 6.474 1.00 0.47 C ATOM 2379 O GLU A 141 33.285 11.878 6.187 1.00 0.56 O ATOM 2380 CB GLU A 141 32.507 8.817 6.395 1.00 0.48 C ATOM 2381 CG GLU A 141 32.660 9.339 4.974 1.00 0.49 C ATOM 2382 CD GLU A 141 32.892 8.172 4.016 1.00 0.50 C ATOM 2383 OE1 GLU A 141 31.936 7.472 3.726 1.00 0.67 O ATOM 2384 OE2 GLU A 141 34.021 7.997 3.587 1.00 0.38 O ATOM 0 H GLU A 141 30.337 9.293 7.561 1.00 0.44 H new ATOM 0 HA GLU A 141 33.147 10.087 8.024 1.00 0.47 H new ATOM 0 HB2 GLU A 141 33.387 8.244 6.687 1.00 0.48 H new ATOM 0 HB3 GLU A 141 31.651 8.145 6.464 1.00 0.48 H new ATOM 0 HG2 GLU A 141 31.766 9.890 4.681 1.00 0.49 H new ATOM 0 HG3 GLU A 141 33.496 10.037 4.921 1.00 0.49 H new ATOM 2391 N ASP A 142 31.111 11.726 6.077 1.00 0.42 N ATOM 2392 CA ASP A 142 31.067 12.986 5.292 1.00 0.44 C ATOM 2393 C ASP A 142 31.527 14.091 6.245 1.00 0.41 C ATOM 2394 O ASP A 142 32.014 15.130 5.849 1.00 0.37 O ATOM 2395 CB ASP A 142 29.640 13.254 4.829 1.00 0.42 C ATOM 2396 CG ASP A 142 29.478 12.843 3.365 1.00 0.39 C ATOM 2397 OD1 ASP A 142 30.183 11.942 2.940 1.00 0.95 O ATOM 2398 OD2 ASP A 142 28.645 13.432 2.693 1.00 1.18 O ATOM 0 H ASP A 142 30.211 11.281 6.258 1.00 0.42 H new ATOM 0 HA ASP A 142 31.700 12.934 4.406 1.00 0.44 H new ATOM 0 HB2 ASP A 142 28.937 12.699 5.451 1.00 0.42 H new ATOM 0 HB3 ASP A 142 29.404 14.312 4.946 1.00 0.42 H new ATOM 2403 N LEU A 143 31.396 13.822 7.517 1.00 0.47 N ATOM 2404 CA LEU A 143 31.831 14.762 8.571 1.00 0.47 C ATOM 2405 C LEU A 143 33.332 14.636 8.713 1.00 0.49 C ATOM 2406 O LEU A 143 33.990 15.489 9.243 1.00 0.55 O ATOM 2407 CB LEU A 143 31.206 14.333 9.886 1.00 0.41 C ATOM 2408 CG LEU A 143 29.725 14.664 9.906 1.00 0.48 C ATOM 2409 CD1 LEU A 143 28.937 13.357 9.931 1.00 0.71 C ATOM 2410 CD2 LEU A 143 29.432 15.478 11.163 1.00 0.51 C ATOM 0 H LEU A 143 30.990 12.956 7.872 1.00 0.47 H new ATOM 0 HA LEU A 143 31.540 15.782 8.320 1.00 0.47 H new ATOM 0 HB2 LEU A 143 31.347 13.262 10.029 1.00 0.41 H new ATOM 0 HB3 LEU A 143 31.707 14.834 10.714 1.00 0.41 H new ATOM 0 HG LEU A 143 29.440 15.240 9.026 1.00 0.48 H new ATOM 0 HD11 LEU A 143 27.869 13.576 9.946 1.00 0.71 H new ATOM 0 HD12 LEU A 143 29.175 12.772 9.043 1.00 0.71 H new ATOM 0 HD13 LEU A 143 29.203 12.789 10.822 1.00 0.71 H new ATOM 0 HD21 LEU A 143 28.371 15.727 11.196 1.00 0.51 H new ATOM 0 HD22 LEU A 143 29.696 14.894 12.045 1.00 0.51 H new ATOM 0 HD23 LEU A 143 30.019 16.396 11.147 1.00 0.51 H new ATOM 2422 N ASN A 144 33.841 13.539 8.252 1.00 0.50 N ATOM 2423 CA ASN A 144 35.275 13.239 8.318 1.00 0.51 C ATOM 2424 C ASN A 144 36.070 14.515 8.277 1.00 0.45 C ATOM 2425 O ASN A 144 35.810 15.387 7.490 1.00 0.34 O ATOM 2426 CB ASN A 144 35.649 12.376 7.124 1.00 0.53 C ATOM 2427 CG ASN A 144 37.113 12.032 7.224 1.00 0.54 C ATOM 2428 OD1 ASN A 144 37.833 12.052 6.250 1.00 0.54 O ATOM 2429 ND2 ASN A 144 37.578 11.708 8.379 1.00 0.70 N ATOM 0 H ASN A 144 33.286 12.806 7.811 1.00 0.50 H new ATOM 0 HA ASN A 144 35.495 12.713 9.247 1.00 0.51 H new ATOM 0 HB2 ASN A 144 35.046 11.468 7.109 1.00 0.53 H new ATOM 0 HB3 ASN A 144 35.447 12.908 6.194 1.00 0.53 H new ATOM 0 HD21 ASN A 144 38.563 11.464 8.482 1.00 0.70 H new ATOM 0 HD22 ASN A 144 36.962 11.695 9.192 1.00 0.70 H new ATOM 2436 N ARG A 145 37.024 14.619 9.129 1.00 0.62 N ATOM 2437 CA ARG A 145 37.860 15.849 9.173 1.00 0.57 C ATOM 2438 C ARG A 145 38.724 15.924 7.920 1.00 0.48 C ATOM 2439 O ARG A 145 39.148 16.983 7.514 1.00 0.38 O ATOM 2440 CB ARG A 145 38.746 15.869 10.416 1.00 0.66 C ATOM 2441 CG ARG A 145 39.141 14.445 10.831 1.00 0.72 C ATOM 2442 CD ARG A 145 40.655 14.371 11.036 1.00 0.75 C ATOM 2443 NE ARG A 145 40.984 13.160 11.839 1.00 0.64 N ATOM 2444 CZ ARG A 145 41.771 12.243 11.346 1.00 1.19 C ATOM 2445 NH1 ARG A 145 41.731 11.966 10.071 1.00 3.16 N ATOM 2446 NH2 ARG A 145 42.592 11.599 12.128 1.00 0.39 N ATOM 0 H ARG A 145 37.273 13.902 9.811 1.00 0.62 H new ATOM 0 HA ARG A 145 37.198 16.714 9.216 1.00 0.57 H new ATOM 0 HB2 ARG A 145 39.643 16.456 10.219 1.00 0.66 H new ATOM 0 HB3 ARG A 145 38.219 16.358 11.235 1.00 0.66 H new ATOM 0 HG2 ARG A 145 38.625 14.167 11.750 1.00 0.72 H new ATOM 0 HG3 ARG A 145 38.832 13.733 10.065 1.00 0.72 H new ATOM 0 HD2 ARG A 145 41.163 14.331 10.072 1.00 0.75 H new ATOM 0 HD3 ARG A 145 41.009 15.267 11.546 1.00 0.75 H new ATOM 0 HE ARG A 145 40.594 13.047 12.775 1.00 0.64 H new ATOM 0 HH11 ARG A 145 41.085 12.466 9.460 1.00 3.16 H new ATOM 0 HH12 ARG A 145 42.346 11.249 9.685 1.00 3.16 H new ATOM 0 HH21 ARG A 145 42.619 11.812 13.125 1.00 0.39 H new ATOM 0 HH22 ARG A 145 43.207 10.882 11.743 1.00 0.39 H new ATOM 2460 N ALA A 146 38.960 14.812 7.292 1.00 0.53 N ATOM 2461 CA ALA A 146 39.753 14.820 6.038 1.00 0.47 C ATOM 2462 C ALA A 146 38.863 15.441 4.979 1.00 0.40 C ATOM 2463 O ALA A 146 39.286 16.169 4.103 1.00 0.34 O ATOM 2464 CB ALA A 146 40.055 13.385 5.624 1.00 0.52 C ATOM 0 H ALA A 146 38.636 13.893 7.595 1.00 0.53 H new ATOM 0 HA ALA A 146 40.689 15.365 6.165 1.00 0.47 H new ATOM 0 HB1 ALA A 146 40.638 13.387 4.703 1.00 0.52 H new ATOM 0 HB2 ALA A 146 40.624 12.891 6.412 1.00 0.52 H new ATOM 0 HB3 ALA A 146 39.120 12.849 5.461 1.00 0.52 H new ATOM 2470 N CYS A 147 37.610 15.133 5.091 1.00 0.41 N ATOM 2471 CA CYS A 147 36.591 15.659 4.142 1.00 0.36 C ATOM 2472 C CYS A 147 36.255 17.073 4.509 1.00 0.35 C ATOM 2473 O CYS A 147 35.992 17.904 3.670 1.00 0.36 O ATOM 2474 CB CYS A 147 35.351 14.829 4.303 1.00 0.39 C ATOM 2475 SG CYS A 147 34.440 14.748 2.741 1.00 0.23 S ATOM 0 H CYS A 147 37.235 14.523 5.818 1.00 0.41 H new ATOM 0 HA CYS A 147 36.969 15.621 3.120 1.00 0.36 H new ATOM 0 HB2 CYS A 147 35.618 13.824 4.628 1.00 0.39 H new ATOM 0 HB3 CYS A 147 34.717 15.257 5.079 1.00 0.39 H new ATOM 0 HG CYS A 147 33.371 14.025 2.899 1.00 0.23 H new ATOM 2481 N ILE A 148 36.304 17.355 5.761 1.00 0.33 N ATOM 2482 CA ILE A 148 36.054 18.690 6.215 1.00 0.33 C ATOM 2483 C ILE A 148 37.333 19.418 5.864 1.00 0.29 C ATOM 2484 O ILE A 148 37.384 20.607 5.638 1.00 0.28 O ATOM 2485 CB ILE A 148 35.879 18.613 7.700 1.00 0.35 C ATOM 2486 CG1 ILE A 148 34.609 17.828 8.068 1.00 0.33 C ATOM 2487 CG2 ILE A 148 35.829 20.013 8.225 1.00 0.36 C ATOM 2488 CD1 ILE A 148 33.759 17.507 6.834 1.00 0.39 C ATOM 0 H ILE A 148 36.515 16.682 6.498 1.00 0.33 H new ATOM 0 HA ILE A 148 35.178 19.177 5.786 1.00 0.33 H new ATOM 0 HB ILE A 148 36.714 18.077 8.152 1.00 0.35 H new ATOM 0 HG12 ILE A 148 34.888 16.901 8.568 1.00 0.33 H new ATOM 0 HG13 ILE A 148 34.017 18.407 8.776 1.00 0.33 H new ATOM 0 HG21 ILE A 148 35.702 19.991 9.307 1.00 0.36 H new ATOM 0 HG22 ILE A 148 36.758 20.527 7.979 1.00 0.36 H new ATOM 0 HG23 ILE A 148 34.991 20.542 7.772 1.00 0.36 H new ATOM 0 HD11 ILE A 148 32.871 16.952 7.138 1.00 0.39 H new ATOM 0 HD12 ILE A 148 33.458 18.435 6.348 1.00 0.39 H new ATOM 0 HD13 ILE A 148 34.342 16.905 6.137 1.00 0.39 H new ATOM 2500 N ALA A 149 38.362 18.613 5.735 1.00 0.29 N ATOM 2501 CA ALA A 149 39.701 19.080 5.308 1.00 0.24 C ATOM 2502 C ALA A 149 39.712 19.064 3.782 1.00 0.20 C ATOM 2503 O ALA A 149 40.725 18.983 3.125 1.00 0.18 O ATOM 2504 CB ALA A 149 40.725 18.103 5.823 1.00 0.28 C ATOM 0 H ALA A 149 38.315 17.611 5.919 1.00 0.29 H new ATOM 0 HA ALA A 149 39.923 20.078 5.686 1.00 0.24 H new ATOM 0 HB1 ALA A 149 41.721 18.426 5.520 1.00 0.28 H new ATOM 0 HB2 ALA A 149 40.672 18.060 6.911 1.00 0.28 H new ATOM 0 HB3 ALA A 149 40.524 17.114 5.411 1.00 0.28 H new ATOM 2510 N GLU A 150 38.547 19.116 3.256 1.00 0.19 N ATOM 2511 CA GLU A 150 38.300 19.125 1.806 1.00 0.15 C ATOM 2512 C GLU A 150 37.303 20.253 1.567 1.00 0.13 C ATOM 2513 O GLU A 150 37.382 21.004 0.622 1.00 0.11 O ATOM 2514 CB GLU A 150 37.679 17.804 1.423 1.00 0.24 C ATOM 2515 CG GLU A 150 36.390 18.050 0.641 1.00 0.27 C ATOM 2516 CD GLU A 150 35.782 16.708 0.234 1.00 0.46 C ATOM 2517 OE1 GLU A 150 36.469 15.708 0.359 1.00 0.94 O ATOM 2518 OE2 GLU A 150 34.639 16.704 -0.191 1.00 0.53 O ATOM 0 H GLU A 150 37.692 19.156 3.811 1.00 0.19 H new ATOM 0 HA GLU A 150 39.210 19.268 1.223 1.00 0.15 H new ATOM 0 HB2 GLU A 150 38.377 17.224 0.819 1.00 0.24 H new ATOM 0 HB3 GLU A 150 37.467 17.218 2.317 1.00 0.24 H new ATOM 0 HG2 GLU A 150 35.683 18.613 1.251 1.00 0.27 H new ATOM 0 HG3 GLU A 150 36.597 18.652 -0.244 1.00 0.27 H new ATOM 2525 N LYS A 151 36.396 20.406 2.487 1.00 0.22 N ATOM 2526 CA LYS A 151 35.424 21.501 2.419 1.00 0.27 C ATOM 2527 C LYS A 151 36.200 22.745 2.853 1.00 0.20 C ATOM 2528 O LYS A 151 35.901 23.862 2.482 1.00 0.19 O ATOM 2529 CB LYS A 151 34.274 21.141 3.356 1.00 0.40 C ATOM 2530 CG LYS A 151 33.981 22.269 4.326 1.00 0.48 C ATOM 2531 CD LYS A 151 32.658 21.964 5.044 1.00 0.64 C ATOM 2532 CE LYS A 151 31.578 21.635 4.006 1.00 0.81 C ATOM 2533 NZ LYS A 151 31.477 20.155 3.836 1.00 2.84 N ATOM 0 H LYS A 151 36.294 19.797 3.299 1.00 0.22 H new ATOM 0 HA LYS A 151 34.989 21.677 1.435 1.00 0.27 H new ATOM 0 HB2 LYS A 151 33.381 20.920 2.771 1.00 0.40 H new ATOM 0 HB3 LYS A 151 34.524 20.237 3.911 1.00 0.40 H new ATOM 0 HG2 LYS A 151 34.791 22.366 5.049 1.00 0.48 H new ATOM 0 HG3 LYS A 151 33.913 23.218 3.794 1.00 0.48 H new ATOM 0 HD2 LYS A 151 32.788 21.125 5.728 1.00 0.64 H new ATOM 0 HD3 LYS A 151 32.352 22.821 5.644 1.00 0.64 H new ATOM 0 HE2 LYS A 151 30.618 22.040 4.325 1.00 0.81 H new ATOM 0 HE3 LYS A 151 31.821 22.104 3.053 1.00 0.81 H new ATOM 0 HZ1 LYS A 151 30.886 19.940 3.008 1.00 2.84 H new ATOM 0 HZ2 LYS A 151 32.427 19.756 3.696 1.00 2.84 H new ATOM 0 HZ3 LYS A 151 31.048 19.736 4.686 1.00 2.84 H new ATOM 2547 N LEU A 152 37.270 22.505 3.575 1.00 0.16 N ATOM 2548 CA LEU A 152 38.200 23.582 3.995 1.00 0.11 C ATOM 2549 C LEU A 152 39.528 23.272 3.310 1.00 0.05 C ATOM 2550 O LEU A 152 40.220 24.141 2.819 1.00 0.05 O ATOM 2551 CB LEU A 152 38.458 23.532 5.503 1.00 0.13 C ATOM 2552 CG LEU A 152 37.172 23.733 6.286 1.00 0.20 C ATOM 2553 CD1 LEU A 152 36.992 22.554 7.235 1.00 0.25 C ATOM 2554 CD2 LEU A 152 37.279 25.026 7.095 1.00 0.25 C ATOM 0 H LEU A 152 37.538 21.575 3.896 1.00 0.16 H new ATOM 0 HA LEU A 152 37.783 24.556 3.739 1.00 0.11 H new ATOM 0 HB2 LEU A 152 38.902 22.572 5.767 1.00 0.13 H new ATOM 0 HB3 LEU A 152 39.178 24.303 5.777 1.00 0.13 H new ATOM 0 HG LEU A 152 36.321 23.797 5.608 1.00 0.20 H new ATOM 0 HD11 LEU A 152 36.072 22.683 7.805 1.00 0.25 H new ATOM 0 HD12 LEU A 152 36.936 21.630 6.660 1.00 0.25 H new ATOM 0 HD13 LEU A 152 37.839 22.505 7.919 1.00 0.25 H new ATOM 0 HD21 LEU A 152 36.360 25.178 7.661 1.00 0.25 H new ATOM 0 HD22 LEU A 152 38.121 24.956 7.783 1.00 0.25 H new ATOM 0 HD23 LEU A 152 37.432 25.867 6.419 1.00 0.25 H new ATOM 2566 N GLY A 153 39.882 22.006 3.302 1.00 0.11 N ATOM 2567 CA GLY A 153 41.161 21.569 2.689 1.00 0.19 C ATOM 2568 C GLY A 153 40.987 21.369 1.204 1.00 0.20 C ATOM 2569 O GLY A 153 41.911 21.050 0.485 1.00 0.30 O ATOM 0 H GLY A 153 39.324 21.252 3.703 1.00 0.11 H new ATOM 0 HA2 GLY A 153 41.935 22.314 2.875 1.00 0.19 H new ATOM 0 HA3 GLY A 153 41.495 20.640 3.151 1.00 0.19 H new ATOM 2573 N GLY A 154 39.817 21.600 0.745 1.00 0.14 N ATOM 2574 CA GLY A 154 39.558 21.482 -0.716 1.00 0.21 C ATOM 2575 C GLY A 154 39.447 22.899 -1.246 1.00 0.16 C ATOM 2576 O GLY A 154 38.886 23.155 -2.292 1.00 0.78 O ATOM 0 H GLY A 154 39.011 21.869 1.310 1.00 0.14 H new ATOM 0 HA2 GLY A 154 40.366 20.944 -1.212 1.00 0.21 H new ATOM 0 HA3 GLY A 154 38.641 20.924 -0.904 1.00 0.21 H new ATOM 2580 N SER A 155 39.982 23.827 -0.500 1.00 0.57 N ATOM 2581 CA SER A 155 39.925 25.243 -0.900 1.00 0.46 C ATOM 2582 C SER A 155 41.229 25.935 -0.509 1.00 0.29 C ATOM 2583 O SER A 155 42.101 26.123 -1.334 1.00 0.43 O ATOM 2584 CB SER A 155 38.738 25.910 -0.201 1.00 0.46 C ATOM 2585 OG SER A 155 38.002 26.669 -1.152 1.00 0.61 O ATOM 0 H SER A 155 40.462 23.651 0.383 1.00 0.57 H new ATOM 0 HA SER A 155 39.797 25.323 -1.979 1.00 0.46 H new ATOM 0 HB2 SER A 155 38.097 25.155 0.254 1.00 0.46 H new ATOM 0 HB3 SER A 155 39.090 26.556 0.603 1.00 0.46 H new ATOM 0 HG SER A 155 37.239 27.097 -0.709 1.00 0.61 H new ATOM 2591 N LEU A 156 41.377 26.322 0.734 1.00 0.14 N ATOM 2592 CA LEU A 156 42.631 27.037 1.145 1.00 0.32 C ATOM 2593 C LEU A 156 42.938 26.930 2.628 1.00 0.25 C ATOM 2594 O LEU A 156 43.017 27.942 3.291 1.00 0.26 O ATOM 2595 CB LEU A 156 42.479 28.530 0.860 1.00 0.51 C ATOM 2596 CG LEU A 156 41.625 28.741 -0.385 1.00 0.26 C ATOM 2597 CD1 LEU A 156 40.146 28.557 -0.056 1.00 0.22 C ATOM 2598 CD2 LEU A 156 41.859 30.150 -0.931 1.00 0.40 C ATOM 0 H LEU A 156 40.693 26.177 1.477 1.00 0.14 H new ATOM 0 HA LEU A 156 43.434 26.565 0.579 1.00 0.32 H new ATOM 0 HB2 LEU A 156 42.019 29.026 1.714 1.00 0.51 H new ATOM 0 HB3 LEU A 156 43.460 28.983 0.719 1.00 0.51 H new ATOM 0 HG LEU A 156 41.910 28.004 -1.136 1.00 0.26 H new ATOM 0 HD11 LEU A 156 39.551 28.711 -0.956 1.00 0.22 H new ATOM 0 HD12 LEU A 156 39.980 27.548 0.320 1.00 0.22 H new ATOM 0 HD13 LEU A 156 39.849 29.281 0.703 1.00 0.22 H new ATOM 0 HD21 LEU A 156 41.249 30.301 -1.821 1.00 0.40 H new ATOM 0 HD22 LEU A 156 41.584 30.884 -0.174 1.00 0.40 H new ATOM 0 HD23 LEU A 156 42.911 30.270 -1.188 1.00 0.40 H new ATOM 2610 N ILE A 157 43.169 25.776 3.176 1.00 0.21 N ATOM 2611 CA ILE A 157 43.532 25.775 4.601 1.00 0.16 C ATOM 2612 C ILE A 157 45.016 25.421 4.733 1.00 0.12 C ATOM 2613 O ILE A 157 45.852 25.975 4.050 1.00 0.13 O ATOM 2614 CB ILE A 157 42.644 24.835 5.386 1.00 0.13 C ATOM 2615 CG1 ILE A 157 42.589 23.484 4.723 1.00 0.13 C ATOM 2616 CG2 ILE A 157 41.232 25.414 5.441 1.00 0.13 C ATOM 2617 CD1 ILE A 157 41.702 22.638 5.587 1.00 0.15 C ATOM 0 H ILE A 157 43.124 24.867 2.715 1.00 0.21 H new ATOM 0 HA ILE A 157 43.375 26.767 5.025 1.00 0.16 H new ATOM 0 HB ILE A 157 43.051 24.722 6.391 1.00 0.13 H new ATOM 0 HG12 ILE A 157 42.190 23.561 3.711 1.00 0.13 H new ATOM 0 HG13 ILE A 157 43.585 23.048 4.641 1.00 0.13 H new ATOM 0 HG21 ILE A 157 40.585 24.742 6.005 1.00 0.13 H new ATOM 0 HG22 ILE A 157 41.257 26.388 5.929 1.00 0.13 H new ATOM 0 HG23 ILE A 157 40.845 25.525 4.428 1.00 0.13 H new ATOM 0 HD11 ILE A 157 41.621 21.639 5.158 1.00 0.15 H new ATOM 0 HD12 ILE A 157 42.128 22.569 6.588 1.00 0.15 H new ATOM 0 HD13 ILE A 157 40.712 23.090 5.644 1.00 0.15 H new ATOM 2629 N VAL A 158 45.347 24.530 5.609 1.00 0.07 N ATOM 2630 CA VAL A 158 46.766 24.153 5.822 1.00 0.13 C ATOM 2631 C VAL A 158 46.774 22.980 6.787 1.00 0.19 C ATOM 2632 O VAL A 158 47.604 22.109 6.725 1.00 0.35 O ATOM 2633 CB VAL A 158 47.531 25.325 6.438 1.00 0.11 C ATOM 2634 CG1 VAL A 158 48.702 24.794 7.263 1.00 0.17 C ATOM 2635 CG2 VAL A 158 48.064 26.233 5.330 1.00 0.10 C ATOM 0 H VAL A 158 44.682 24.034 6.202 1.00 0.07 H new ATOM 0 HA VAL A 158 47.242 23.891 4.877 1.00 0.13 H new ATOM 0 HB VAL A 158 46.859 25.893 7.081 1.00 0.11 H new ATOM 0 HG11 VAL A 158 49.247 25.630 7.702 1.00 0.17 H new ATOM 0 HG12 VAL A 158 48.325 24.150 8.057 1.00 0.17 H new ATOM 0 HG13 VAL A 158 49.371 24.223 6.619 1.00 0.17 H new ATOM 0 HG21 VAL A 158 48.608 27.067 5.773 1.00 0.10 H new ATOM 0 HG22 VAL A 158 48.734 25.665 4.684 1.00 0.10 H new ATOM 0 HG23 VAL A 158 47.231 26.616 4.741 1.00 0.10 H new ATOM 2645 N ALA A 159 45.814 22.963 7.664 1.00 0.13 N ATOM 2646 CA ALA A 159 45.667 21.863 8.640 1.00 0.15 C ATOM 2647 C ALA A 159 44.282 21.301 8.446 1.00 0.14 C ATOM 2648 O ALA A 159 43.417 21.966 7.917 1.00 0.20 O ATOM 2649 CB ALA A 159 45.823 22.393 10.048 1.00 0.25 C ATOM 0 H ALA A 159 45.105 23.692 7.743 1.00 0.13 H new ATOM 0 HA ALA A 159 46.427 21.097 8.489 1.00 0.15 H new ATOM 0 HB1 ALA A 159 45.713 21.574 10.759 1.00 0.25 H new ATOM 0 HB2 ALA A 159 46.810 22.841 10.161 1.00 0.25 H new ATOM 0 HB3 ALA A 159 45.059 23.146 10.240 1.00 0.25 H new ATOM 2655 N PHE A 160 44.120 20.050 8.762 1.00 0.18 N ATOM 2656 CA PHE A 160 42.845 19.334 8.512 1.00 0.27 C ATOM 2657 C PHE A 160 43.090 18.717 7.154 1.00 0.27 C ATOM 2658 O PHE A 160 42.939 17.535 6.934 1.00 0.27 O ATOM 2659 CB PHE A 160 41.634 20.274 8.489 1.00 0.32 C ATOM 2660 CG PHE A 160 40.593 19.741 9.429 1.00 0.40 C ATOM 2661 CD1 PHE A 160 40.937 19.491 10.755 1.00 0.64 C ATOM 2662 CD2 PHE A 160 39.295 19.506 8.981 1.00 0.28 C ATOM 2663 CE1 PHE A 160 39.979 19.002 11.649 1.00 0.72 C ATOM 2664 CE2 PHE A 160 38.329 19.015 9.873 1.00 0.35 C ATOM 2665 CZ PHE A 160 38.673 18.763 11.206 1.00 0.57 C ATOM 0 H PHE A 160 44.843 19.477 9.197 1.00 0.18 H new ATOM 0 HA PHE A 160 42.602 18.613 9.293 1.00 0.27 H new ATOM 0 HB2 PHE A 160 41.931 21.280 8.785 1.00 0.32 H new ATOM 0 HB3 PHE A 160 41.230 20.345 7.479 1.00 0.32 H new ATOM 0 HD1 PHE A 160 41.946 19.675 11.094 1.00 0.64 H new ATOM 0 HD2 PHE A 160 39.033 19.701 7.952 1.00 0.28 H new ATOM 0 HE1 PHE A 160 40.246 18.809 12.678 1.00 0.72 H new ATOM 0 HE2 PHE A 160 37.321 18.832 9.531 1.00 0.35 H new ATOM 0 HZ PHE A 160 37.931 18.384 11.893 1.00 0.57 H new ATOM 2675 N GLU A 161 43.566 19.548 6.275 1.00 0.24 N ATOM 2676 CA GLU A 161 43.965 19.121 4.923 1.00 0.21 C ATOM 2677 C GLU A 161 45.487 18.984 4.927 1.00 0.27 C ATOM 2678 O GLU A 161 46.066 18.374 4.050 1.00 0.49 O ATOM 2679 CB GLU A 161 43.591 20.207 3.917 1.00 0.41 C ATOM 2680 CG GLU A 161 43.472 19.594 2.517 1.00 0.40 C ATOM 2681 CD GLU A 161 44.364 20.371 1.546 1.00 0.93 C ATOM 2682 OE1 GLU A 161 44.635 21.528 1.818 1.00 1.03 O ATOM 2683 OE2 GLU A 161 44.763 19.794 0.547 1.00 1.32 O ATOM 0 H GLU A 161 43.697 20.544 6.453 1.00 0.24 H new ATOM 0 HA GLU A 161 43.473 18.186 4.655 1.00 0.21 H new ATOM 0 HB2 GLU A 161 42.647 20.672 4.203 1.00 0.41 H new ATOM 0 HB3 GLU A 161 44.346 20.993 3.918 1.00 0.41 H new ATOM 0 HG2 GLU A 161 43.768 18.545 2.541 1.00 0.40 H new ATOM 0 HG3 GLU A 161 42.436 19.625 2.181 1.00 0.40 H new ATOM 2690 N GLY A 162 46.156 19.588 5.894 1.00 0.33 N ATOM 2691 CA GLY A 162 47.645 19.510 5.894 1.00 0.68 C ATOM 2692 C GLY A 162 48.228 18.967 7.217 1.00 0.87 C ATOM 2693 O GLY A 162 48.658 17.834 7.287 1.00 1.52 O ATOM 0 H GLY A 162 45.739 20.116 6.661 1.00 0.33 H new ATOM 0 HA2 GLY A 162 47.968 18.870 5.073 1.00 0.68 H new ATOM 0 HA3 GLY A 162 48.054 20.503 5.705 1.00 0.68 H new ATOM 2697 N CYS A 163 48.317 19.783 8.242 1.00 0.41 N ATOM 2698 CA CYS A 163 48.956 19.323 9.520 1.00 0.75 C ATOM 2699 C CYS A 163 48.272 18.074 10.114 1.00 0.94 C ATOM 2700 O CYS A 163 48.808 16.991 10.001 1.00 1.10 O ATOM 2701 CB CYS A 163 49.027 20.490 10.517 1.00 0.72 C ATOM 2702 SG CYS A 163 49.334 19.854 12.186 1.00 3.26 S ATOM 0 H CYS A 163 47.976 20.744 8.250 1.00 0.41 H new ATOM 0 HA CYS A 163 49.974 19.006 9.294 1.00 0.75 H new ATOM 0 HB2 CYS A 163 49.821 21.179 10.229 1.00 0.72 H new ATOM 0 HB3 CYS A 163 48.094 21.053 10.499 1.00 0.72 H new ATOM 0 HG CYS A 163 49.395 20.846 13.024 1.00 3.26 H new ATOM 2708 N PRO A 164 47.127 18.231 10.719 1.00 0.95 N ATOM 2709 CA PRO A 164 46.398 17.097 11.317 1.00 1.13 C ATOM 2710 C PRO A 164 45.896 16.143 10.233 1.00 1.01 C ATOM 2711 O PRO A 164 45.898 14.939 10.409 1.00 1.19 O ATOM 2712 CB PRO A 164 45.247 17.761 12.075 1.00 1.20 C ATOM 2713 CG PRO A 164 45.074 19.160 11.456 1.00 0.98 C ATOM 2714 CD PRO A 164 46.449 19.520 10.852 1.00 0.82 C ATOM 0 HA PRO A 164 47.018 16.485 11.972 1.00 1.13 H new ATOM 0 HB2 PRO A 164 44.331 17.178 11.980 1.00 1.20 H new ATOM 0 HB3 PRO A 164 45.471 17.831 13.139 1.00 1.20 H new ATOM 0 HG2 PRO A 164 44.298 19.157 10.690 1.00 0.98 H new ATOM 0 HG3 PRO A 164 44.774 19.888 12.210 1.00 0.98 H new ATOM 0 HD2 PRO A 164 46.343 20.017 9.887 1.00 0.82 H new ATOM 0 HD3 PRO A 164 47.004 20.198 11.500 1.00 0.82 H new ATOM 2722 N VAL A 165 45.485 16.655 9.109 1.00 0.70 N ATOM 2723 CA VAL A 165 45.009 15.737 8.022 1.00 0.57 C ATOM 2724 C VAL A 165 45.217 16.405 6.662 1.00 0.37 C ATOM 2725 O VAL A 165 44.403 16.181 5.781 1.00 0.27 O ATOM 2726 CB VAL A 165 43.520 15.363 8.200 1.00 0.54 C ATOM 2727 CG1 VAL A 165 43.418 13.918 8.690 1.00 0.63 C ATOM 2728 CG2 VAL A 165 42.830 16.276 9.221 1.00 0.68 C ATOM 2729 OXT VAL A 165 46.200 17.112 6.518 1.00 0.37 O ATOM 0 H VAL A 165 45.455 17.651 8.891 1.00 0.70 H new ATOM 0 HA VAL A 165 45.591 14.817 8.078 1.00 0.57 H new ATOM 0 HB VAL A 165 43.025 15.482 7.236 1.00 0.54 H new ATOM 0 HG11 VAL A 165 42.369 13.650 8.817 1.00 0.63 H new ATOM 0 HG12 VAL A 165 43.877 13.253 7.959 1.00 0.63 H new ATOM 0 HG13 VAL A 165 43.936 13.820 9.644 1.00 0.63 H new ATOM 0 HG21 VAL A 165 41.784 15.985 9.321 1.00 0.68 H new ATOM 0 HG22 VAL A 165 43.327 16.183 10.187 1.00 0.68 H new ATOM 0 HG23 VAL A 165 42.888 17.310 8.882 1.00 0.68 H new