USER MOD reduce.3.24.130724 H: found=0, std=0, add=1230, rem=0, adj=37 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 133 HIS : no HE2:sc= -13.4! C(o=-15!,f=-24!) USER MOD Set 1.2: A 151 LYS NZ :NH3+ -166:sc= -1.21 (180deg=-2.49!) USER MOD Set 2.1: A 80 CYS SG : rot -103:sc= -8.82! USER MOD Set 2.2: A 113 SER OG : rot 107:sc= -4.75! USER MOD Set 3.1: A 6 GLN : amide:sc= -7.51! K(o=-12!,f=-1.2) USER MOD Set 3.2: A 46 CYS SG : rot 180:sc= -4.14! USER MOD Set 4.1: A 3 SER OG : rot -100:sc= 0.835 USER MOD Set 4.2: A 119 SER OG : rot 171:sc= -1.23! USER MOD Single : A 12 CYS SG : rot 32:sc= -0.847 USER MOD Single : A 16 TYR OH : rot 180:sc= 0 USER MOD Single : A 18 MET CE :methyl 170:sc= -12.2! (180deg=-12.4!) USER MOD Single : A 30 LYS NZ :NH3+ -151:sc= 0 (180deg=-0.0149) 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+ -158:sc= 0.956 (180deg=0.247) USER MOD Single : A 39 CYS SG : rot 99:sc= -6.75! USER MOD Single : A 41 SER OG : rot -163:sc= -1.51 USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 LYS NZ :NH3+ -158:sc= 0.891 (180deg=0.371!) USER MOD Single : A 63 THR OG1 : rot 180:sc= 0 USER MOD Single : A 65 THR OG1 : rot 180:sc= -0.0947 USER MOD Single : A 69 LYS NZ :NH3+ -175:sc= -3.68! (180deg=-3.84!) USER MOD Single : A 70 HIS : no HE2:sc= -23.1! C(o=-23!,f=-19!) USER MOD Single : A 74 MET CE :methyl 157:sc= -17.9! (180deg=-19.1!) USER MOD Single : A 78 LYS NZ :NH3+ -151:sc= -0.623 (180deg=-1.17) USER MOD Single : A 82 TYR OH : rot 148:sc= -3.85! USER MOD Single : A 85 TYR OH : rot 180:sc= 0 USER MOD Single : A 88 SER OG : rot 52:sc= 0.0904 USER MOD Single : A 91 THR OG1 : rot 141:sc= -5.11! USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 SER OG : rot 102:sc= 0.48 USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 MET CE :methyl 171:sc= -10.5! (180deg=-10.6!) USER MOD Single : A 112 LYS NZ :NH3+ 154:sc= -0.171 (180deg=-0.696) USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 117 TYR OH : rot 163:sc= -3.03! USER MOD Single : A 120 SER OG : rot -40:sc= -5.08! USER MOD Single : A 121 LYS NZ :NH3+ -155:sc= -0.0445 (180deg=-0.176) USER MOD Single : A 125 LYS NZ :NH3+ 144:sc= 0.176! (180deg=-2.99!) USER MOD Single : A 126 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 LYS NZ :NH3+ 161:sc= 0 (180deg=-0.304) USER MOD Single : A 129 GLN : amide:sc= -6.47! K(o=-6.5!,f=-2.3) USER MOD Single : A 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 135 CYS SG : rot -150:sc= -1.93! USER MOD Single : A 136 GLN : amide:sc= -0.0555 K(o=-0.055,f=-1.9!) USER MOD Single : A 138 ASN : amide:sc= -3.23! K(o=-3.2!,f=-0.57) USER MOD Single : A 144 ASN : amide:sc= -5.71! C(o=-5.7!,f=-6.5!) USER MOD Single : A 147 CYS SG : rot 180:sc= 0 USER MOD Single : A 155 SER OG : rot 17:sc= 0.48 USER MOD Single : A 163 CYS SG : rot 180:sc= -2.09! USER MOD ----------------------------------------------------------------- ATOM 145 N SER A 3 8.699 18.520 5.202 1.00 0.62 N ATOM 146 CA SER A 3 9.807 19.451 5.559 1.00 0.63 C ATOM 147 C SER A 3 9.256 20.863 5.727 1.00 0.61 C ATOM 148 O SER A 3 8.867 21.510 4.776 1.00 0.79 O ATOM 149 CB SER A 3 10.879 19.449 4.467 1.00 0.67 C ATOM 150 OG SER A 3 10.433 18.686 3.353 1.00 1.26 O ATOM 0 HA SER A 3 10.256 19.118 6.495 1.00 0.63 H new ATOM 0 HB2 SER A 3 11.095 20.471 4.156 1.00 0.67 H new ATOM 0 HB3 SER A 3 11.807 19.031 4.857 1.00 0.67 H new ATOM 0 HG SER A 3 10.836 17.793 3.385 1.00 1.26 H new ATOM 156 N GLY A 4 9.228 21.344 6.936 1.00 0.44 N ATOM 157 CA GLY A 4 8.712 22.716 7.184 1.00 0.41 C ATOM 158 C GLY A 4 9.292 23.234 8.498 1.00 0.55 C ATOM 159 O GLY A 4 8.739 24.111 9.132 1.00 0.70 O ATOM 0 H GLY A 4 9.542 20.843 7.767 1.00 0.44 H new ATOM 0 HA2 GLY A 4 8.990 23.377 6.363 1.00 0.41 H new ATOM 0 HA3 GLY A 4 7.623 22.706 7.231 1.00 0.41 H new ATOM 163 N VAL A 5 10.405 22.695 8.912 1.00 0.78 N ATOM 164 CA VAL A 5 11.019 23.159 10.193 1.00 1.02 C ATOM 165 C VAL A 5 11.149 24.667 10.162 1.00 1.27 C ATOM 166 O VAL A 5 11.275 25.275 9.117 1.00 2.03 O ATOM 167 CB VAL A 5 12.394 22.543 10.414 1.00 1.20 C ATOM 168 CG1 VAL A 5 12.434 22.026 11.834 1.00 1.06 C ATOM 169 CG2 VAL A 5 12.637 21.387 9.450 1.00 2.65 C ATOM 0 H VAL A 5 10.915 21.958 8.425 1.00 0.78 H new ATOM 0 HA VAL A 5 10.373 22.845 11.012 1.00 1.02 H new ATOM 0 HB VAL A 5 13.166 23.292 10.240 1.00 1.20 H new ATOM 0 HG11 VAL A 5 13.407 21.576 12.030 1.00 1.06 H new ATOM 0 HG12 VAL A 5 12.270 22.852 12.527 1.00 1.06 H new ATOM 0 HG13 VAL A 5 11.654 21.277 11.971 1.00 1.06 H new ATOM 0 HG21 VAL A 5 13.626 20.965 9.629 1.00 2.65 H new ATOM 0 HG22 VAL A 5 11.881 20.618 9.606 1.00 2.65 H new ATOM 0 HG23 VAL A 5 12.578 21.750 8.424 1.00 2.65 H new ATOM 179 N GLN A 6 11.028 25.287 11.301 1.00 0.79 N ATOM 180 CA GLN A 6 11.042 26.769 11.326 1.00 1.05 C ATOM 181 C GLN A 6 12.174 27.301 12.184 1.00 0.91 C ATOM 182 O GLN A 6 12.145 28.424 12.638 1.00 1.07 O ATOM 183 CB GLN A 6 9.692 27.208 11.860 1.00 1.36 C ATOM 184 CG GLN A 6 8.724 26.058 11.582 1.00 1.90 C ATOM 185 CD GLN A 6 8.020 25.647 12.857 1.00 0.51 C ATOM 186 OE1 GLN A 6 6.849 25.908 13.057 1.00 0.85 O ATOM 187 NE2 GLN A 6 8.716 25.001 13.727 1.00 2.36 N ATOM 0 H GLN A 6 10.921 24.833 12.208 1.00 0.79 H new ATOM 0 HA GLN A 6 11.212 27.168 10.326 1.00 1.05 H new ATOM 0 HB2 GLN A 6 9.747 27.420 12.928 1.00 1.36 H new ATOM 0 HB3 GLN A 6 9.359 28.123 11.370 1.00 1.36 H new ATOM 0 HG2 GLN A 6 7.991 26.363 10.835 1.00 1.90 H new ATOM 0 HG3 GLN A 6 9.267 25.208 11.168 1.00 1.90 H new ATOM 0 HE21 GLN A 6 9.697 24.791 13.542 1.00 2.36 H new ATOM 0 HE22 GLN A 6 8.286 24.699 14.601 1.00 2.36 H new ATOM 196 N VAL A 7 13.176 26.503 12.378 1.00 0.69 N ATOM 197 CA VAL A 7 14.369 26.939 13.192 1.00 0.62 C ATOM 198 C VAL A 7 13.996 27.715 14.427 1.00 0.89 C ATOM 199 O VAL A 7 13.448 28.799 14.414 1.00 2.05 O ATOM 200 CB VAL A 7 15.303 27.799 12.361 1.00 0.81 C ATOM 201 CG1 VAL A 7 14.495 28.649 11.384 1.00 0.56 C ATOM 202 CG2 VAL A 7 16.103 28.719 13.287 1.00 1.22 C ATOM 0 H VAL A 7 13.235 25.554 12.010 1.00 0.69 H new ATOM 0 HA VAL A 7 14.861 26.017 13.502 1.00 0.62 H new ATOM 0 HB VAL A 7 15.982 27.155 11.802 1.00 0.81 H new ATOM 0 HG11 VAL A 7 15.172 29.264 10.791 1.00 0.56 H new ATOM 0 HG12 VAL A 7 13.922 27.998 10.723 1.00 0.56 H new ATOM 0 HG13 VAL A 7 13.813 29.293 11.940 1.00 0.56 H new ATOM 0 HG21 VAL A 7 16.775 29.338 12.693 1.00 1.22 H new ATOM 0 HG22 VAL A 7 15.419 29.358 13.845 1.00 1.22 H new ATOM 0 HG23 VAL A 7 16.686 28.116 13.984 1.00 1.22 H new ATOM 212 N ALA A 8 14.394 27.150 15.491 1.00 0.91 N ATOM 213 CA ALA A 8 14.218 27.754 16.812 1.00 0.75 C ATOM 214 C ALA A 8 15.022 29.051 16.830 1.00 1.20 C ATOM 215 O ALA A 8 16.048 29.140 16.189 1.00 3.17 O ATOM 216 CB ALA A 8 14.829 26.770 17.797 1.00 0.50 C ATOM 0 H ALA A 8 14.861 26.243 15.507 1.00 0.91 H new ATOM 0 HA ALA A 8 13.176 27.963 17.054 1.00 0.75 H new ATOM 0 HB1 ALA A 8 14.731 27.161 18.810 1.00 0.50 H new ATOM 0 HB2 ALA A 8 14.310 25.814 17.725 1.00 0.50 H new ATOM 0 HB3 ALA A 8 15.884 26.629 17.563 1.00 0.50 H new ATOM 222 N ASP A 9 14.612 30.052 17.548 1.00 1.35 N ATOM 223 CA ASP A 9 15.446 31.284 17.560 1.00 1.18 C ATOM 224 C ASP A 9 16.729 30.961 18.308 1.00 1.23 C ATOM 225 O ASP A 9 17.718 31.658 18.207 1.00 1.30 O ATOM 226 CB ASP A 9 14.746 32.425 18.275 1.00 1.23 C ATOM 227 CG ASP A 9 13.507 32.847 17.485 1.00 1.46 C ATOM 228 OD1 ASP A 9 13.669 33.548 16.499 1.00 1.58 O ATOM 229 OD2 ASP A 9 12.419 32.460 17.876 1.00 1.80 O ATOM 0 H ASP A 9 13.763 30.076 18.112 1.00 1.35 H new ATOM 0 HA ASP A 9 15.637 31.595 16.533 1.00 1.18 H new ATOM 0 HB2 ASP A 9 14.460 32.116 19.280 1.00 1.23 H new ATOM 0 HB3 ASP A 9 15.425 33.270 18.383 1.00 1.23 H new ATOM 234 N GLU A 10 16.713 29.895 19.061 1.00 1.23 N ATOM 235 CA GLU A 10 17.922 29.504 19.815 1.00 1.32 C ATOM 236 C GLU A 10 18.971 29.038 18.811 1.00 1.20 C ATOM 237 O GLU A 10 20.154 29.056 19.089 1.00 1.27 O ATOM 238 CB GLU A 10 17.543 28.398 20.821 1.00 1.55 C ATOM 239 CG GLU A 10 18.604 27.285 20.894 1.00 1.69 C ATOM 240 CD GLU A 10 18.993 27.048 22.353 1.00 2.35 C ATOM 241 OE1 GLU A 10 18.370 27.642 23.218 1.00 3.75 O ATOM 242 OE2 GLU A 10 19.909 26.276 22.582 1.00 2.65 O ATOM 0 H GLU A 10 15.908 29.280 19.182 1.00 1.23 H new ATOM 0 HA GLU A 10 18.336 30.337 20.383 1.00 1.32 H new ATOM 0 HB2 GLU A 10 17.413 28.838 21.810 1.00 1.55 H new ATOM 0 HB3 GLU A 10 16.584 27.965 20.537 1.00 1.55 H new ATOM 0 HG2 GLU A 10 18.214 26.366 20.457 1.00 1.69 H new ATOM 0 HG3 GLU A 10 19.482 27.566 20.313 1.00 1.69 H new ATOM 249 N VAL A 11 18.562 28.645 17.628 1.00 1.02 N ATOM 250 CA VAL A 11 19.573 28.222 16.637 1.00 0.99 C ATOM 251 C VAL A 11 20.354 29.455 16.208 1.00 0.88 C ATOM 252 O VAL A 11 21.458 29.364 15.717 1.00 0.91 O ATOM 253 CB VAL A 11 18.928 27.544 15.429 1.00 0.86 C ATOM 254 CG1 VAL A 11 18.829 28.530 14.274 1.00 0.86 C ATOM 255 CG2 VAL A 11 19.790 26.354 15.021 1.00 2.09 C ATOM 0 H VAL A 11 17.591 28.603 17.320 1.00 1.02 H new ATOM 0 HA VAL A 11 20.240 27.488 17.089 1.00 0.99 H new ATOM 0 HB VAL A 11 17.924 27.205 15.686 1.00 0.86 H new ATOM 0 HG11 VAL A 11 18.368 28.040 13.416 1.00 0.86 H new ATOM 0 HG12 VAL A 11 18.221 29.383 14.575 1.00 0.86 H new ATOM 0 HG13 VAL A 11 19.827 28.874 14.003 1.00 0.86 H new ATOM 0 HG21 VAL A 11 19.342 25.859 14.159 1.00 2.09 H new ATOM 0 HG22 VAL A 11 20.790 26.701 14.761 1.00 2.09 H new ATOM 0 HG23 VAL A 11 19.855 25.650 15.851 1.00 2.09 H new ATOM 265 N CYS A 12 19.815 30.622 16.444 1.00 0.82 N ATOM 266 CA CYS A 12 20.570 31.857 16.096 1.00 0.73 C ATOM 267 C CYS A 12 21.551 32.158 17.235 1.00 0.82 C ATOM 268 O CYS A 12 22.099 33.234 17.332 1.00 1.12 O ATOM 269 CB CYS A 12 19.602 33.020 15.940 1.00 0.55 C ATOM 270 SG CYS A 12 20.170 34.113 14.612 1.00 0.89 S ATOM 0 H CYS A 12 18.895 30.771 16.858 1.00 0.82 H new ATOM 0 HA CYS A 12 21.110 31.716 15.159 1.00 0.73 H new ATOM 0 HB2 CYS A 12 18.603 32.647 15.715 1.00 0.55 H new ATOM 0 HB3 CYS A 12 19.531 33.575 16.876 1.00 0.55 H new ATOM 0 HG CYS A 12 20.775 33.411 13.701 1.00 0.89 H new ATOM 276 N ARG A 13 21.787 31.186 18.072 1.00 0.63 N ATOM 277 CA ARG A 13 22.753 31.326 19.194 1.00 0.72 C ATOM 278 C ARG A 13 23.798 30.247 18.986 1.00 0.63 C ATOM 279 O ARG A 13 24.727 30.095 19.751 1.00 0.94 O ATOM 280 CB ARG A 13 22.056 31.101 20.537 1.00 0.79 C ATOM 281 CG ARG A 13 20.776 31.936 20.602 1.00 0.91 C ATOM 282 CD ARG A 13 21.129 33.377 20.970 1.00 0.70 C ATOM 283 NE ARG A 13 19.936 34.042 21.567 1.00 1.81 N ATOM 284 CZ ARG A 13 18.738 33.715 21.165 1.00 3.69 C ATOM 285 NH1 ARG A 13 18.292 34.156 20.022 1.00 4.87 N ATOM 286 NH2 ARG A 13 17.985 32.951 21.909 1.00 4.82 N ATOM 0 H ARG A 13 21.335 30.273 18.021 1.00 0.63 H new ATOM 0 HA ARG A 13 23.189 32.325 19.208 1.00 0.72 H new ATOM 0 HB2 ARG A 13 21.819 30.044 20.662 1.00 0.79 H new ATOM 0 HB3 ARG A 13 22.723 31.376 21.354 1.00 0.79 H new ATOM 0 HG2 ARG A 13 20.262 31.910 19.641 1.00 0.91 H new ATOM 0 HG3 ARG A 13 20.092 31.517 21.341 1.00 0.91 H new ATOM 0 HD2 ARG A 13 21.958 33.391 21.677 1.00 0.70 H new ATOM 0 HD3 ARG A 13 21.457 33.920 20.084 1.00 0.70 H new ATOM 0 HE ARG A 13 20.056 34.752 22.289 1.00 1.81 H new ATOM 0 HH11 ARG A 13 18.879 34.756 19.443 1.00 4.87 H new ATOM 0 HH12 ARG A 13 17.356 33.901 19.707 1.00 4.87 H new ATOM 0 HH21 ARG A 13 18.333 32.609 22.805 1.00 4.82 H new ATOM 0 HH22 ARG A 13 17.049 32.696 21.594 1.00 4.82 H new ATOM 300 N ILE A 14 23.655 29.498 17.927 1.00 0.24 N ATOM 301 CA ILE A 14 24.641 28.459 17.642 1.00 0.22 C ATOM 302 C ILE A 14 25.570 29.010 16.591 1.00 0.33 C ATOM 303 O ILE A 14 26.718 29.218 16.833 1.00 0.59 O ATOM 304 CB ILE A 14 23.973 27.227 17.083 1.00 0.19 C ATOM 305 CG1 ILE A 14 22.830 26.769 17.964 1.00 0.24 C ATOM 306 CG2 ILE A 14 25.001 26.116 16.980 1.00 0.42 C ATOM 307 CD1 ILE A 14 21.886 25.975 17.074 1.00 0.30 C ATOM 0 H ILE A 14 22.891 29.573 17.255 1.00 0.24 H new ATOM 0 HA ILE A 14 25.167 28.186 18.557 1.00 0.22 H new ATOM 0 HB ILE A 14 23.567 27.469 16.101 1.00 0.19 H new ATOM 0 HG12 ILE A 14 23.197 26.154 18.786 1.00 0.24 H new ATOM 0 HG13 ILE A 14 22.318 27.622 18.408 1.00 0.24 H new ATOM 0 HG21 ILE A 14 24.529 25.220 16.577 1.00 0.42 H new ATOM 0 HG22 ILE A 14 25.810 26.429 16.319 1.00 0.42 H new ATOM 0 HG23 ILE A 14 25.404 25.900 17.970 1.00 0.42 H new ATOM 0 HD11 ILE A 14 21.041 25.621 17.664 1.00 0.30 H new ATOM 0 HD12 ILE A 14 21.523 26.613 16.268 1.00 0.30 H new ATOM 0 HD13 ILE A 14 22.416 25.122 16.651 1.00 0.30 H new ATOM 319 N PHE A 15 25.064 29.300 15.433 1.00 0.21 N ATOM 320 CA PHE A 15 25.935 29.909 14.400 1.00 0.33 C ATOM 321 C PHE A 15 26.432 31.203 15.019 1.00 0.66 C ATOM 322 O PHE A 15 27.570 31.606 14.887 1.00 0.68 O ATOM 323 CB PHE A 15 25.105 30.246 13.169 1.00 0.33 C ATOM 324 CG PHE A 15 25.393 31.674 12.803 1.00 0.43 C ATOM 325 CD1 PHE A 15 26.538 31.997 12.062 1.00 0.24 C ATOM 326 CD2 PHE A 15 24.523 32.677 13.227 1.00 0.93 C ATOM 327 CE1 PHE A 15 26.801 33.336 11.742 1.00 0.34 C ATOM 328 CE2 PHE A 15 24.785 34.010 12.913 1.00 1.12 C ATOM 329 CZ PHE A 15 25.922 34.343 12.169 1.00 0.80 C ATOM 0 H PHE A 15 24.094 29.144 15.157 1.00 0.21 H new ATOM 0 HA PHE A 15 26.745 29.243 14.102 1.00 0.33 H new ATOM 0 HB2 PHE A 15 25.358 29.581 12.343 1.00 0.33 H new ATOM 0 HB3 PHE A 15 24.043 30.110 13.374 1.00 0.33 H new ATOM 0 HD1 PHE A 15 27.214 31.219 11.739 1.00 0.24 H new ATOM 0 HD2 PHE A 15 23.644 32.421 13.800 1.00 0.93 H new ATOM 0 HE1 PHE A 15 27.679 33.592 11.168 1.00 0.34 H new ATOM 0 HE2 PHE A 15 24.110 34.785 13.244 1.00 1.12 H new ATOM 0 HZ PHE A 15 26.123 35.375 11.923 1.00 0.80 H new ATOM 339 N TYR A 16 25.532 31.825 15.715 1.00 1.10 N ATOM 340 CA TYR A 16 25.796 33.094 16.423 1.00 1.49 C ATOM 341 C TYR A 16 27.022 33.000 17.316 1.00 1.50 C ATOM 342 O TYR A 16 27.680 33.987 17.572 1.00 1.92 O ATOM 343 CB TYR A 16 24.616 33.342 17.352 1.00 1.36 C ATOM 344 CG TYR A 16 25.140 33.811 18.690 1.00 1.25 C ATOM 345 CD1 TYR A 16 25.631 32.874 19.606 1.00 0.36 C ATOM 346 CD2 TYR A 16 25.158 35.171 19.006 1.00 2.11 C ATOM 347 CE1 TYR A 16 26.142 33.287 20.830 1.00 0.30 C ATOM 348 CE2 TYR A 16 25.667 35.593 20.241 1.00 2.03 C ATOM 349 CZ TYR A 16 26.163 34.650 21.155 1.00 1.09 C ATOM 350 OH TYR A 16 26.674 35.067 22.367 1.00 1.03 O ATOM 0 H TYR A 16 24.577 31.485 15.825 1.00 1.10 H new ATOM 0 HA TYR A 16 25.948 33.877 15.681 1.00 1.49 H new ATOM 0 HB2 TYR A 16 23.950 34.091 16.924 1.00 1.36 H new ATOM 0 HB3 TYR A 16 24.033 32.429 17.474 1.00 1.36 H new ATOM 0 HD1 TYR A 16 25.613 31.823 19.360 1.00 0.36 H new ATOM 0 HD2 TYR A 16 24.780 35.896 18.300 1.00 2.11 H new ATOM 0 HE1 TYR A 16 26.523 32.558 21.530 1.00 0.30 H new ATOM 0 HE2 TYR A 16 25.678 36.644 20.490 1.00 2.03 H new ATOM 0 HH TYR A 16 26.613 36.043 22.429 1.00 1.03 H new ATOM 360 N ASP A 17 27.320 31.847 17.849 1.00 1.25 N ATOM 361 CA ASP A 17 28.484 31.795 18.771 1.00 1.74 C ATOM 362 C ASP A 17 29.635 31.251 17.983 1.00 1.80 C ATOM 363 O ASP A 17 29.894 31.709 16.887 1.00 3.70 O ATOM 364 CB ASP A 17 28.147 30.886 19.957 1.00 1.94 C ATOM 365 CG ASP A 17 29.125 31.157 21.101 1.00 2.76 C ATOM 366 OD1 ASP A 17 29.803 32.169 21.046 1.00 3.16 O ATOM 367 OD2 ASP A 17 29.173 30.353 22.016 1.00 3.44 O ATOM 0 H ASP A 17 26.827 30.968 17.693 1.00 1.25 H new ATOM 0 HA ASP A 17 28.734 32.779 19.169 1.00 1.74 H new ATOM 0 HB2 ASP A 17 27.124 31.066 20.288 1.00 1.94 H new ATOM 0 HB3 ASP A 17 28.204 29.840 19.655 1.00 1.94 H new ATOM 372 N MET A 18 30.269 30.219 18.444 1.00 0.77 N ATOM 373 CA MET A 18 31.313 29.639 17.594 1.00 0.36 C ATOM 374 C MET A 18 32.206 30.785 17.103 1.00 0.97 C ATOM 375 O MET A 18 32.279 31.821 17.734 1.00 2.84 O ATOM 376 CB MET A 18 30.567 28.997 16.448 1.00 1.29 C ATOM 377 CG MET A 18 29.103 28.750 16.895 1.00 1.37 C ATOM 378 SD MET A 18 29.039 27.780 18.425 1.00 1.06 S ATOM 379 CE MET A 18 28.927 26.173 17.647 1.00 1.03 C ATOM 0 H MET A 18 30.112 29.768 19.345 1.00 0.77 H new ATOM 0 HA MET A 18 31.946 28.910 18.100 1.00 0.36 H new ATOM 0 HB2 MET A 18 30.592 29.643 15.570 1.00 1.29 H new ATOM 0 HB3 MET A 18 31.041 28.057 16.166 1.00 1.29 H new ATOM 0 HG2 MET A 18 28.600 29.705 17.046 1.00 1.37 H new ATOM 0 HG3 MET A 18 28.563 28.226 16.106 1.00 1.37 H new ATOM 0 HE1 MET A 18 29.054 25.395 18.400 1.00 1.03 H new ATOM 0 HE2 MET A 18 27.951 26.065 17.174 1.00 1.03 H new ATOM 0 HE3 MET A 18 29.708 26.079 16.893 1.00 1.03 H new ATOM 553 N ILE A 29 35.722 30.516 27.063 1.00 1.38 N ATOM 554 CA ILE A 29 34.822 30.092 26.012 1.00 1.23 C ATOM 555 C ILE A 29 34.845 28.582 25.847 1.00 1.10 C ATOM 556 O ILE A 29 33.854 27.961 25.555 1.00 1.22 O ATOM 557 CB ILE A 29 35.443 30.726 24.852 1.00 1.46 C ATOM 558 CG1 ILE A 29 34.592 31.918 24.451 1.00 1.88 C ATOM 559 CG2 ILE A 29 35.645 29.694 23.791 1.00 1.53 C ATOM 560 CD1 ILE A 29 34.230 32.686 25.708 1.00 1.95 C ATOM 0 HA ILE A 29 33.778 30.354 26.186 1.00 1.23 H new ATOM 0 HB ILE A 29 36.436 31.123 25.062 1.00 1.46 H new ATOM 0 HG12 ILE A 29 35.137 32.559 23.758 1.00 1.88 H new ATOM 0 HG13 ILE A 29 33.691 31.586 23.936 1.00 1.88 H new ATOM 0 HG21 ILE A 29 36.108 30.155 22.919 1.00 1.53 H new ATOM 0 HG22 ILE A 29 36.292 28.904 24.171 1.00 1.53 H new ATOM 0 HG23 ILE A 29 34.682 29.269 23.508 1.00 1.53 H new ATOM 0 HD11 ILE A 29 33.618 33.548 25.444 1.00 1.95 H new ATOM 0 HD12 ILE A 29 33.671 32.037 26.383 1.00 1.95 H new ATOM 0 HD13 ILE A 29 35.140 33.025 26.202 1.00 1.95 H new ATOM 572 N LYS A 30 35.985 27.993 26.025 1.00 1.14 N ATOM 573 CA LYS A 30 36.091 26.521 25.879 1.00 1.42 C ATOM 574 C LYS A 30 34.979 25.880 26.667 1.00 1.30 C ATOM 575 O LYS A 30 34.596 24.773 26.413 1.00 1.77 O ATOM 576 CB LYS A 30 37.428 26.001 26.404 1.00 1.59 C ATOM 577 CG LYS A 30 38.419 27.142 26.503 1.00 1.30 C ATOM 578 CD LYS A 30 39.811 26.596 26.818 1.00 1.51 C ATOM 579 CE LYS A 30 40.490 26.166 25.517 1.00 2.78 C ATOM 580 NZ LYS A 30 41.068 27.360 24.837 1.00 3.94 N ATOM 0 H LYS A 30 36.854 28.469 26.267 1.00 1.14 H new ATOM 0 HA LYS A 30 36.019 26.272 24.820 1.00 1.42 H new ATOM 0 HB2 LYS A 30 37.291 25.541 27.382 1.00 1.59 H new ATOM 0 HB3 LYS A 30 37.814 25.228 25.739 1.00 1.59 H new ATOM 0 HG2 LYS A 30 38.441 27.699 25.566 1.00 1.30 H new ATOM 0 HG3 LYS A 30 38.108 27.839 27.281 1.00 1.30 H new ATOM 0 HD2 LYS A 30 40.408 27.358 27.319 1.00 1.51 H new ATOM 0 HD3 LYS A 30 39.737 25.749 27.500 1.00 1.51 H new ATOM 0 HE2 LYS A 30 41.275 25.439 25.727 1.00 2.78 H new ATOM 0 HE3 LYS A 30 39.769 25.676 24.863 1.00 2.78 H new ATOM 0 HZ1 LYS A 30 41.080 27.202 23.809 1.00 3.94 H new ATOM 0 HZ2 LYS A 30 40.489 28.196 25.052 1.00 3.94 H new ATOM 0 HZ3 LYS A 30 42.039 27.516 25.175 1.00 3.94 H new ATOM 594 N LYS A 31 34.471 26.593 27.616 1.00 0.84 N ATOM 595 CA LYS A 31 33.353 26.078 28.456 1.00 0.81 C ATOM 596 C LYS A 31 32.150 26.996 28.252 1.00 1.08 C ATOM 597 O LYS A 31 31.516 27.439 29.190 1.00 1.97 O ATOM 598 CB LYS A 31 33.767 26.082 29.928 1.00 0.69 C ATOM 599 CG LYS A 31 35.096 25.341 30.084 1.00 2.32 C ATOM 600 CD LYS A 31 35.399 25.153 31.571 1.00 1.57 C ATOM 601 CE LYS A 31 34.751 23.856 32.065 1.00 1.72 C ATOM 602 NZ LYS A 31 35.584 23.268 33.152 1.00 2.19 N ATOM 0 H LYS A 31 34.785 27.533 27.857 1.00 0.84 H new ATOM 0 HA LYS A 31 33.102 25.056 28.170 1.00 0.81 H new ATOM 0 HB2 LYS A 31 33.865 27.107 30.287 1.00 0.69 H new ATOM 0 HB3 LYS A 31 32.998 25.604 30.535 1.00 0.69 H new ATOM 0 HG2 LYS A 31 35.046 24.373 29.586 1.00 2.32 H new ATOM 0 HG3 LYS A 31 35.898 25.904 29.606 1.00 2.32 H new ATOM 0 HD2 LYS A 31 36.477 25.118 31.732 1.00 1.57 H new ATOM 0 HD3 LYS A 31 35.019 26.001 32.140 1.00 1.57 H new ATOM 0 HE2 LYS A 31 33.744 24.056 32.432 1.00 1.72 H new ATOM 0 HE3 LYS A 31 34.655 23.148 31.242 1.00 1.72 H new ATOM 0 HZ1 LYS A 31 35.145 22.387 33.488 1.00 2.19 H new ATOM 0 HZ2 LYS A 31 36.536 23.063 32.787 1.00 2.19 H new ATOM 0 HZ3 LYS A 31 35.653 23.943 33.940 1.00 2.19 H new ATOM 616 N ARG A 32 31.861 27.303 27.020 1.00 0.79 N ATOM 617 CA ARG A 32 30.737 28.213 26.699 1.00 1.01 C ATOM 618 C ARG A 32 29.939 27.649 25.519 1.00 1.23 C ATOM 619 O ARG A 32 29.311 28.388 24.791 1.00 1.96 O ATOM 620 CB ARG A 32 31.341 29.537 26.278 1.00 1.21 C ATOM 621 CG ARG A 32 31.615 30.411 27.513 1.00 1.09 C ATOM 622 CD ARG A 32 32.995 30.077 28.093 1.00 1.29 C ATOM 623 NE ARG A 32 32.892 29.891 29.568 1.00 1.65 N ATOM 624 CZ ARG A 32 32.966 30.928 30.359 1.00 2.19 C ATOM 625 NH1 ARG A 32 32.807 32.129 29.872 1.00 2.44 N ATOM 626 NH2 ARG A 32 33.207 30.767 31.632 1.00 2.57 N ATOM 0 H ARG A 32 32.369 26.952 26.208 1.00 0.79 H new ATOM 0 HA ARG A 32 30.078 28.325 27.560 1.00 1.01 H new ATOM 0 HB2 ARG A 32 32.269 29.365 25.732 1.00 1.21 H new ATOM 0 HB3 ARG A 32 30.663 30.055 25.600 1.00 1.21 H new ATOM 0 HG2 ARG A 32 31.571 31.465 27.240 1.00 1.09 H new ATOM 0 HG3 ARG A 32 30.844 30.244 28.266 1.00 1.09 H new ATOM 0 HD2 ARG A 32 33.385 29.171 27.629 1.00 1.29 H new ATOM 0 HD3 ARG A 32 33.698 30.878 27.867 1.00 1.29 H new ATOM 0 HE ARG A 32 32.764 28.957 29.959 1.00 1.65 H new ATOM 0 HH11 ARG A 32 32.626 32.256 28.876 1.00 2.44 H new ATOM 0 HH12 ARG A 32 32.864 32.941 30.487 1.00 2.44 H new ATOM 0 HH21 ARG A 32 33.338 29.829 32.012 1.00 2.57 H new ATOM 0 HH22 ARG A 32 33.264 31.579 32.247 1.00 2.57 H new ATOM 640 N LYS A 33 29.993 26.353 25.330 1.00 0.69 N ATOM 641 CA LYS A 33 29.273 25.680 24.190 1.00 0.92 C ATOM 642 C LYS A 33 30.280 25.456 23.043 1.00 1.73 C ATOM 643 O LYS A 33 30.996 24.498 23.034 1.00 3.90 O ATOM 644 CB LYS A 33 28.083 26.535 23.725 1.00 2.52 C ATOM 645 CG LYS A 33 27.205 25.729 22.775 1.00 2.43 C ATOM 646 CD LYS A 33 26.019 26.589 22.325 1.00 3.54 C ATOM 647 CE LYS A 33 24.846 26.403 23.293 1.00 1.70 C ATOM 648 NZ LYS A 33 24.212 27.725 23.570 1.00 2.37 N ATOM 0 H LYS A 33 30.517 25.715 25.929 1.00 0.69 H new ATOM 0 HA LYS A 33 28.874 24.719 24.514 1.00 0.92 H new ATOM 0 HB2 LYS A 33 27.499 26.860 24.586 1.00 2.52 H new ATOM 0 HB3 LYS A 33 28.443 27.435 23.226 1.00 2.52 H new ATOM 0 HG2 LYS A 33 27.785 25.409 21.910 1.00 2.43 H new ATOM 0 HG3 LYS A 33 26.847 24.827 23.271 1.00 2.43 H new ATOM 0 HD2 LYS A 33 26.311 27.639 22.291 1.00 3.54 H new ATOM 0 HD3 LYS A 33 25.717 26.309 21.316 1.00 3.54 H new ATOM 0 HE2 LYS A 33 24.113 25.719 22.865 1.00 1.70 H new ATOM 0 HE3 LYS A 33 25.196 25.954 24.223 1.00 1.70 H new ATOM 0 HZ1 LYS A 33 23.416 27.597 24.227 1.00 2.37 H new ATOM 0 HZ2 LYS A 33 24.913 28.364 23.996 1.00 2.37 H new ATOM 0 HZ3 LYS A 33 23.864 28.136 22.680 1.00 2.37 H new ATOM 662 N LYS A 34 30.367 26.349 22.112 1.00 1.38 N ATOM 663 CA LYS A 34 31.369 26.215 20.998 1.00 2.19 C ATOM 664 C LYS A 34 30.925 25.205 19.946 1.00 2.02 C ATOM 665 O LYS A 34 30.983 25.479 18.770 1.00 3.17 O ATOM 666 CB LYS A 34 32.714 25.794 21.573 1.00 2.61 C ATOM 667 CG LYS A 34 33.029 26.663 22.787 1.00 2.15 C ATOM 668 CD LYS A 34 33.076 28.135 22.365 1.00 0.96 C ATOM 669 CE LYS A 34 32.431 29.002 23.451 1.00 0.86 C ATOM 670 NZ LYS A 34 31.812 30.201 22.817 1.00 1.19 N ATOM 0 H LYS A 34 29.784 27.184 22.062 1.00 1.38 H new ATOM 0 HA LYS A 34 31.453 27.186 20.509 1.00 2.19 H new ATOM 0 HB2 LYS A 34 32.689 24.743 21.859 1.00 2.61 H new ATOM 0 HB3 LYS A 34 33.495 25.901 20.820 1.00 2.61 H new ATOM 0 HG2 LYS A 34 32.271 26.519 23.557 1.00 2.15 H new ATOM 0 HG3 LYS A 34 33.984 26.368 23.221 1.00 2.15 H new ATOM 0 HD2 LYS A 34 34.109 28.445 22.204 1.00 0.96 H new ATOM 0 HD3 LYS A 34 32.552 28.269 21.419 1.00 0.96 H new ATOM 0 HE2 LYS A 34 31.676 28.430 23.989 1.00 0.86 H new ATOM 0 HE3 LYS A 34 33.180 29.308 24.182 1.00 0.86 H new ATOM 0 HZ1 LYS A 34 31.709 30.955 23.526 1.00 1.19 H new ATOM 0 HZ2 LYS A 34 32.419 30.536 22.041 1.00 1.19 H new ATOM 0 HZ3 LYS A 34 30.876 29.950 22.440 1.00 1.19 H new ATOM 684 N ALA A 35 30.488 24.048 20.339 1.00 0.66 N ATOM 685 CA ALA A 35 30.030 23.060 19.372 1.00 0.46 C ATOM 686 C ALA A 35 28.671 22.635 19.822 1.00 0.51 C ATOM 687 O ALA A 35 28.318 22.760 20.975 1.00 0.66 O ATOM 688 CB ALA A 35 30.932 21.860 19.372 1.00 0.40 C ATOM 0 H ALA A 35 30.433 23.752 21.314 1.00 0.66 H new ATOM 0 HA ALA A 35 30.025 23.482 18.367 1.00 0.46 H new ATOM 0 HB1 ALA A 35 30.572 21.134 18.643 1.00 0.40 H new ATOM 0 HB2 ALA A 35 31.945 22.166 19.110 1.00 0.40 H new ATOM 0 HB3 ALA A 35 30.935 21.407 20.363 1.00 0.40 H new ATOM 694 N VAL A 36 27.895 22.180 18.928 1.00 0.42 N ATOM 695 CA VAL A 36 26.524 21.815 19.323 1.00 0.52 C ATOM 696 C VAL A 36 25.743 21.101 18.230 1.00 0.50 C ATOM 697 O VAL A 36 25.766 21.490 17.080 1.00 0.53 O ATOM 698 CB VAL A 36 25.786 23.107 19.557 1.00 0.59 C ATOM 699 CG1 VAL A 36 25.908 23.564 21.011 1.00 0.52 C ATOM 700 CG2 VAL A 36 26.344 24.188 18.621 1.00 0.74 C ATOM 0 H VAL A 36 28.132 22.040 17.946 1.00 0.42 H new ATOM 0 HA VAL A 36 26.599 21.154 20.186 1.00 0.52 H new ATOM 0 HB VAL A 36 24.729 22.942 19.347 1.00 0.59 H new ATOM 0 HG11 VAL A 36 25.364 24.499 21.145 1.00 0.52 H new ATOM 0 HG12 VAL A 36 25.488 22.802 21.668 1.00 0.52 H new ATOM 0 HG13 VAL A 36 26.959 23.717 21.257 1.00 0.52 H new ATOM 0 HG21 VAL A 36 25.812 25.124 18.788 1.00 0.74 H new ATOM 0 HG22 VAL A 36 27.405 24.333 18.824 1.00 0.74 H new ATOM 0 HG23 VAL A 36 26.212 23.876 17.585 1.00 0.74 H new ATOM 710 N ILE A 37 24.956 20.127 18.601 1.00 0.55 N ATOM 711 CA ILE A 37 24.092 19.492 17.615 1.00 0.55 C ATOM 712 C ILE A 37 22.682 20.017 17.883 1.00 0.63 C ATOM 713 O ILE A 37 22.364 20.437 18.977 1.00 1.26 O ATOM 714 CB ILE A 37 24.085 17.988 17.774 1.00 0.57 C ATOM 715 CG1 ILE A 37 25.210 17.344 16.953 1.00 0.42 C ATOM 716 CG2 ILE A 37 22.742 17.512 17.275 1.00 0.74 C ATOM 717 CD1 ILE A 37 25.933 16.287 17.804 1.00 0.39 C ATOM 0 H ILE A 37 24.887 19.756 19.549 1.00 0.55 H new ATOM 0 HA ILE A 37 24.443 19.718 16.608 1.00 0.55 H new ATOM 0 HB ILE A 37 24.248 17.710 18.815 1.00 0.57 H new ATOM 0 HG12 ILE A 37 24.800 16.883 16.055 1.00 0.42 H new ATOM 0 HG13 ILE A 37 25.917 18.107 16.625 1.00 0.42 H new ATOM 0 HG21 ILE A 37 22.683 16.428 17.368 1.00 0.74 H new ATOM 0 HG22 ILE A 37 21.950 17.970 17.868 1.00 0.74 H new ATOM 0 HG23 ILE A 37 22.622 17.794 16.229 1.00 0.74 H new ATOM 0 HD11 ILE A 37 26.731 15.832 17.218 1.00 0.39 H new ATOM 0 HD12 ILE A 37 26.358 16.761 18.689 1.00 0.39 H new ATOM 0 HD13 ILE A 37 25.223 15.518 18.109 1.00 0.39 H new ATOM 729 N PHE A 38 21.850 20.006 16.901 1.00 0.38 N ATOM 730 CA PHE A 38 20.473 20.507 17.071 1.00 0.40 C ATOM 731 C PHE A 38 19.537 19.563 16.283 1.00 0.49 C ATOM 732 O PHE A 38 19.906 19.114 15.228 1.00 1.31 O ATOM 733 CB PHE A 38 20.439 21.932 16.489 1.00 0.81 C ATOM 734 CG PHE A 38 20.700 22.958 17.577 1.00 1.84 C ATOM 735 CD1 PHE A 38 21.972 23.108 18.184 1.00 1.76 C ATOM 736 CD2 PHE A 38 19.644 23.761 17.989 1.00 3.76 C ATOM 737 CE1 PHE A 38 22.146 24.063 19.194 1.00 3.61 C ATOM 738 CE2 PHE A 38 19.821 24.710 18.991 1.00 5.64 C ATOM 739 CZ PHE A 38 21.071 24.865 19.597 1.00 5.58 C ATOM 0 H PHE A 38 22.068 19.664 15.965 1.00 0.38 H new ATOM 0 HA PHE A 38 20.155 20.533 18.113 1.00 0.40 H new ATOM 0 HB2 PHE A 38 21.188 22.028 15.703 1.00 0.81 H new ATOM 0 HB3 PHE A 38 19.469 22.120 16.029 1.00 0.81 H new ATOM 0 HD1 PHE A 38 22.801 22.491 17.870 1.00 1.76 H new ATOM 0 HD2 PHE A 38 18.675 23.647 17.526 1.00 3.76 H new ATOM 0 HE1 PHE A 38 23.112 24.181 19.663 1.00 3.61 H new ATOM 0 HE2 PHE A 38 18.991 25.328 19.301 1.00 5.64 H new ATOM 0 HZ PHE A 38 21.208 25.602 20.375 1.00 5.58 H new ATOM 749 N CYS A 39 18.349 19.203 16.756 1.00 0.55 N ATOM 750 CA CYS A 39 17.535 18.257 15.912 1.00 0.35 C ATOM 751 C CYS A 39 16.020 18.502 15.968 1.00 0.37 C ATOM 752 O CYS A 39 15.253 17.580 16.156 1.00 0.40 O ATOM 753 CB CYS A 39 17.803 16.812 16.319 1.00 0.20 C ATOM 754 SG CYS A 39 17.887 16.687 18.124 1.00 0.45 S ATOM 0 H CYS A 39 17.932 19.505 17.637 1.00 0.55 H new ATOM 0 HA CYS A 39 17.856 18.447 14.888 1.00 0.35 H new ATOM 0 HB2 CYS A 39 17.013 16.165 15.937 1.00 0.20 H new ATOM 0 HB3 CYS A 39 18.738 16.468 15.878 1.00 0.20 H new ATOM 0 HG CYS A 39 16.747 16.263 18.583 1.00 0.45 H new ATOM 760 N LEU A 40 15.578 19.697 15.711 1.00 0.43 N ATOM 761 CA LEU A 40 14.102 19.952 15.642 1.00 0.50 C ATOM 762 C LEU A 40 13.387 19.869 16.996 1.00 0.45 C ATOM 763 O LEU A 40 13.542 18.934 17.758 1.00 0.47 O ATOM 764 CB LEU A 40 13.514 18.938 14.666 1.00 0.55 C ATOM 765 CG LEU A 40 14.406 18.921 13.429 1.00 0.58 C ATOM 766 CD1 LEU A 40 13.628 18.389 12.220 1.00 0.68 C ATOM 767 CD2 LEU A 40 14.879 20.353 13.160 1.00 0.57 C ATOM 0 H LEU A 40 16.168 20.512 15.545 1.00 0.43 H new ATOM 0 HA LEU A 40 13.949 20.978 15.308 1.00 0.50 H new ATOM 0 HB2 LEU A 40 13.471 17.948 15.121 1.00 0.55 H new ATOM 0 HB3 LEU A 40 12.493 19.211 14.399 1.00 0.55 H new ATOM 0 HG LEU A 40 15.262 18.267 13.596 1.00 0.58 H new ATOM 0 HD11 LEU A 40 14.277 18.382 11.344 1.00 0.68 H new ATOM 0 HD12 LEU A 40 13.285 17.375 12.425 1.00 0.68 H new ATOM 0 HD13 LEU A 40 12.768 19.031 12.030 1.00 0.68 H new ATOM 0 HD21 LEU A 40 15.520 20.365 12.278 1.00 0.57 H new ATOM 0 HD22 LEU A 40 14.015 20.996 12.990 1.00 0.57 H new ATOM 0 HD23 LEU A 40 15.439 20.719 14.020 1.00 0.57 H new ATOM 779 N SER A 41 12.600 20.886 17.272 1.00 0.43 N ATOM 780 CA SER A 41 11.824 21.000 18.538 1.00 0.48 C ATOM 781 C SER A 41 11.165 19.667 18.916 1.00 0.44 C ATOM 782 O SER A 41 11.276 18.683 18.214 1.00 0.53 O ATOM 783 CB SER A 41 10.725 22.046 18.342 1.00 0.75 C ATOM 784 OG SER A 41 11.322 23.305 18.054 1.00 2.49 O ATOM 0 H SER A 41 12.464 21.673 16.637 1.00 0.43 H new ATOM 0 HA SER A 41 12.508 21.286 19.337 1.00 0.48 H new ATOM 0 HB2 SER A 41 10.065 21.749 17.527 1.00 0.75 H new ATOM 0 HB3 SER A 41 10.111 22.118 19.240 1.00 0.75 H new ATOM 0 HG SER A 41 10.664 24.018 18.193 1.00 2.49 H new ATOM 790 N ALA A 42 10.456 19.638 20.020 1.00 0.58 N ATOM 791 CA ALA A 42 9.766 18.382 20.436 1.00 0.89 C ATOM 792 C ALA A 42 8.651 18.085 19.434 1.00 0.81 C ATOM 793 O ALA A 42 7.923 18.969 19.031 1.00 0.76 O ATOM 794 CB ALA A 42 9.160 18.555 21.832 1.00 1.20 C ATOM 0 H ALA A 42 10.327 20.431 20.648 1.00 0.58 H new ATOM 0 HA ALA A 42 10.482 17.561 20.461 1.00 0.89 H new ATOM 0 HB1 ALA A 42 8.658 17.634 22.128 1.00 1.20 H new ATOM 0 HB2 ALA A 42 9.951 18.783 22.546 1.00 1.20 H new ATOM 0 HB3 ALA A 42 8.439 19.372 21.817 1.00 1.20 H new ATOM 800 N ASP A 43 8.533 16.854 19.008 1.00 0.94 N ATOM 801 CA ASP A 43 7.484 16.491 18.005 1.00 0.89 C ATOM 802 C ASP A 43 8.020 16.800 16.601 1.00 0.42 C ATOM 803 O ASP A 43 7.454 16.394 15.607 1.00 0.30 O ATOM 804 CB ASP A 43 6.196 17.281 18.259 1.00 1.14 C ATOM 805 CG ASP A 43 5.017 16.555 17.604 1.00 1.13 C ATOM 806 OD1 ASP A 43 4.754 15.428 17.989 1.00 1.18 O ATOM 807 OD2 ASP A 43 4.396 17.140 16.731 1.00 1.12 O ATOM 0 H ASP A 43 9.122 16.079 19.313 1.00 0.94 H new ATOM 0 HA ASP A 43 7.252 15.430 18.092 1.00 0.89 H new ATOM 0 HB2 ASP A 43 6.024 17.384 19.331 1.00 1.14 H new ATOM 0 HB3 ASP A 43 6.288 18.288 17.853 1.00 1.14 H new ATOM 812 N LYS A 44 9.116 17.516 16.532 1.00 0.22 N ATOM 813 CA LYS A 44 9.743 17.870 15.233 1.00 0.32 C ATOM 814 C LYS A 44 9.129 19.136 14.687 1.00 0.56 C ATOM 815 O LYS A 44 7.928 19.277 14.596 1.00 1.37 O ATOM 816 CB LYS A 44 9.639 16.718 14.232 1.00 0.62 C ATOM 817 CG LYS A 44 11.049 16.347 13.761 1.00 0.95 C ATOM 818 CD LYS A 44 11.883 15.875 14.960 1.00 0.98 C ATOM 819 CE LYS A 44 11.649 14.379 15.182 1.00 1.07 C ATOM 820 NZ LYS A 44 11.219 14.146 16.591 1.00 1.12 N ATOM 0 H LYS A 44 9.610 17.876 17.348 1.00 0.22 H new ATOM 0 HA LYS A 44 10.805 18.051 15.401 1.00 0.32 H new ATOM 0 HB2 LYS A 44 9.157 15.857 14.695 1.00 0.62 H new ATOM 0 HB3 LYS A 44 9.022 17.010 13.383 1.00 0.62 H new ATOM 0 HG2 LYS A 44 10.997 15.560 13.009 1.00 0.95 H new ATOM 0 HG3 LYS A 44 11.525 17.207 13.290 1.00 0.95 H new ATOM 0 HD2 LYS A 44 12.941 16.066 14.780 1.00 0.98 H new ATOM 0 HD3 LYS A 44 11.606 16.435 15.853 1.00 0.98 H new ATOM 0 HE2 LYS A 44 10.888 14.013 14.493 1.00 1.07 H new ATOM 0 HE3 LYS A 44 12.562 13.822 14.973 1.00 1.07 H new ATOM 0 HZ1 LYS A 44 11.060 13.129 16.742 1.00 1.12 H new ATOM 0 HZ2 LYS A 44 11.960 14.481 17.240 1.00 1.12 H new ATOM 0 HZ3 LYS A 44 10.337 14.665 16.775 1.00 1.12 H new ATOM 834 N LYS A 45 9.995 20.058 14.363 1.00 0.41 N ATOM 835 CA LYS A 45 9.623 21.373 13.854 1.00 0.47 C ATOM 836 C LYS A 45 10.565 22.364 14.495 1.00 0.87 C ATOM 837 O LYS A 45 10.867 22.288 15.665 1.00 2.57 O ATOM 838 CB LYS A 45 8.234 21.740 14.260 1.00 0.49 C ATOM 839 CG LYS A 45 7.258 21.257 13.196 1.00 0.67 C ATOM 840 CD LYS A 45 5.869 21.077 13.816 1.00 0.97 C ATOM 841 CE LYS A 45 5.041 20.127 12.949 1.00 1.37 C ATOM 842 NZ LYS A 45 4.060 19.398 13.803 1.00 2.41 N ATOM 0 H LYS A 45 11.003 19.924 14.443 1.00 0.41 H new ATOM 0 HA LYS A 45 9.677 21.373 12.765 1.00 0.47 H new ATOM 0 HB2 LYS A 45 7.993 21.290 15.223 1.00 0.49 H new ATOM 0 HB3 LYS A 45 8.151 22.820 14.383 1.00 0.49 H new ATOM 0 HG2 LYS A 45 7.212 21.976 12.378 1.00 0.67 H new ATOM 0 HG3 LYS A 45 7.603 20.314 12.773 1.00 0.67 H new ATOM 0 HD2 LYS A 45 5.959 20.678 14.826 1.00 0.97 H new ATOM 0 HD3 LYS A 45 5.368 22.042 13.897 1.00 0.97 H new ATOM 0 HE2 LYS A 45 4.518 20.688 12.174 1.00 1.37 H new ATOM 0 HE3 LYS A 45 5.695 19.418 12.442 1.00 1.37 H new ATOM 0 HZ1 LYS A 45 3.498 18.753 13.212 1.00 2.41 H new ATOM 0 HZ2 LYS A 45 4.569 18.851 14.526 1.00 2.41 H new ATOM 0 HZ3 LYS A 45 3.428 20.082 14.267 1.00 2.41 H new ATOM 856 N CYS A 46 11.030 23.264 13.730 1.00 0.92 N ATOM 857 CA CYS A 46 11.981 24.294 14.226 1.00 0.69 C ATOM 858 C CYS A 46 13.299 23.658 14.528 1.00 0.52 C ATOM 859 O CYS A 46 13.408 22.922 15.477 1.00 0.53 O ATOM 860 CB CYS A 46 11.551 24.932 15.551 1.00 0.77 C ATOM 861 SG CYS A 46 10.601 26.439 15.231 1.00 1.07 S ATOM 0 H CYS A 46 10.794 23.349 12.741 1.00 0.92 H new ATOM 0 HA CYS A 46 12.022 25.047 13.439 1.00 0.69 H new ATOM 0 HB2 CYS A 46 10.949 24.228 16.125 1.00 0.77 H new ATOM 0 HB3 CYS A 46 12.429 25.166 16.153 1.00 0.77 H new ATOM 0 HG CYS A 46 10.239 26.972 16.360 1.00 1.07 H new ATOM 867 N ILE A 47 14.309 23.978 13.793 1.00 0.43 N ATOM 868 CA ILE A 47 15.634 23.443 14.128 1.00 0.28 C ATOM 869 C ILE A 47 15.722 23.510 15.648 1.00 0.39 C ATOM 870 O ILE A 47 15.039 24.310 16.257 1.00 0.52 O ATOM 871 CB ILE A 47 16.661 24.363 13.517 1.00 0.19 C ATOM 872 CG1 ILE A 47 17.814 23.541 12.974 1.00 0.13 C ATOM 873 CG2 ILE A 47 17.132 25.336 14.579 1.00 0.35 C ATOM 874 CD1 ILE A 47 17.452 23.147 11.554 1.00 0.30 C ATOM 0 H ILE A 47 14.273 24.587 12.975 1.00 0.43 H new ATOM 0 HA ILE A 47 15.797 22.428 13.765 1.00 0.28 H new ATOM 0 HB ILE A 47 16.230 24.927 12.690 1.00 0.19 H new ATOM 0 HG12 ILE A 47 18.739 24.118 12.990 1.00 0.13 H new ATOM 0 HG13 ILE A 47 17.979 22.656 13.589 1.00 0.13 H new ATOM 0 HG21 ILE A 47 17.876 26.009 14.152 1.00 0.35 H new ATOM 0 HG22 ILE A 47 16.284 25.916 14.942 1.00 0.35 H new ATOM 0 HG23 ILE A 47 17.575 24.784 15.408 1.00 0.35 H new ATOM 0 HD11 ILE A 47 18.258 22.552 11.125 1.00 0.30 H new ATOM 0 HD12 ILE A 47 16.533 22.561 11.562 1.00 0.30 H new ATOM 0 HD13 ILE A 47 17.304 24.045 10.954 1.00 0.30 H new ATOM 886 N ILE A 48 16.481 22.708 16.297 1.00 0.42 N ATOM 887 CA ILE A 48 16.449 22.820 17.770 1.00 0.48 C ATOM 888 C ILE A 48 17.555 22.032 18.402 1.00 0.57 C ATOM 889 O ILE A 48 18.298 21.370 17.749 1.00 1.36 O ATOM 890 CB ILE A 48 15.128 22.236 18.245 1.00 0.28 C ATOM 891 CG1 ILE A 48 14.599 23.031 19.433 1.00 0.46 C ATOM 892 CG2 ILE A 48 15.331 20.778 18.677 1.00 0.17 C ATOM 893 CD1 ILE A 48 14.605 22.119 20.655 1.00 0.58 C ATOM 0 H ILE A 48 17.103 22.003 15.901 1.00 0.42 H new ATOM 0 HA ILE A 48 16.565 23.867 18.049 1.00 0.48 H new ATOM 0 HB ILE A 48 14.412 22.285 17.425 1.00 0.28 H new ATOM 0 HG12 ILE A 48 15.220 23.909 19.610 1.00 0.46 H new ATOM 0 HG13 ILE A 48 13.590 23.390 19.231 1.00 0.46 H new ATOM 0 HG21 ILE A 48 14.382 20.364 19.017 1.00 0.17 H new ATOM 0 HG22 ILE A 48 15.699 20.196 17.832 1.00 0.17 H new ATOM 0 HG23 ILE A 48 16.056 20.737 19.490 1.00 0.17 H new ATOM 0 HD11 ILE A 48 14.230 22.667 21.520 1.00 0.58 H new ATOM 0 HD12 ILE A 48 13.967 21.255 20.468 1.00 0.58 H new ATOM 0 HD13 ILE A 48 15.623 21.782 20.853 1.00 0.58 H new ATOM 905 N VAL A 49 17.637 22.093 19.681 1.00 0.78 N ATOM 906 CA VAL A 49 18.669 21.307 20.396 1.00 0.66 C ATOM 907 C VAL A 49 17.937 20.409 21.387 1.00 0.55 C ATOM 908 O VAL A 49 17.421 20.874 22.384 1.00 0.60 O ATOM 909 CB VAL A 49 19.629 22.216 21.152 1.00 0.52 C ATOM 910 CG1 VAL A 49 18.840 23.070 22.144 1.00 2.50 C ATOM 911 CG2 VAL A 49 20.640 21.340 21.897 1.00 2.20 C ATOM 0 H VAL A 49 17.031 22.657 20.277 1.00 0.78 H new ATOM 0 HA VAL A 49 19.256 20.728 19.683 1.00 0.66 H new ATOM 0 HB VAL A 49 20.155 22.875 20.461 1.00 0.52 H new ATOM 0 HG11 VAL A 49 19.524 23.722 22.687 1.00 2.50 H new ATOM 0 HG12 VAL A 49 18.113 23.676 21.604 1.00 2.50 H new ATOM 0 HG13 VAL A 49 18.320 22.422 22.849 1.00 2.50 H new ATOM 0 HG21 VAL A 49 21.337 21.974 22.445 1.00 2.20 H new ATOM 0 HG22 VAL A 49 20.113 20.691 22.596 1.00 2.20 H new ATOM 0 HG23 VAL A 49 21.191 20.730 21.181 1.00 2.20 H new ATOM 921 N GLU A 50 17.858 19.138 21.122 1.00 0.45 N ATOM 922 CA GLU A 50 17.122 18.249 22.059 1.00 0.44 C ATOM 923 C GLU A 50 17.488 16.816 21.783 1.00 0.36 C ATOM 924 O GLU A 50 16.896 16.153 20.953 1.00 0.30 O ATOM 925 CB GLU A 50 15.610 18.465 21.884 1.00 0.63 C ATOM 926 CG GLU A 50 14.816 17.336 22.556 1.00 0.86 C ATOM 927 CD GLU A 50 13.518 17.102 21.781 1.00 0.84 C ATOM 928 OE1 GLU A 50 13.557 17.179 20.563 1.00 0.82 O ATOM 929 OE2 GLU A 50 12.508 16.850 22.417 1.00 0.91 O ATOM 0 H GLU A 50 18.266 18.680 20.307 1.00 0.45 H new ATOM 0 HA GLU A 50 17.394 18.486 23.088 1.00 0.44 H new ATOM 0 HB2 GLU A 50 15.323 19.424 22.315 1.00 0.63 H new ATOM 0 HB3 GLU A 50 15.365 18.506 20.823 1.00 0.63 H new ATOM 0 HG2 GLU A 50 15.409 16.422 22.579 1.00 0.86 H new ATOM 0 HG3 GLU A 50 14.594 17.598 23.590 1.00 0.86 H new ATOM 936 N GLU A 51 18.480 16.333 22.460 1.00 0.35 N ATOM 937 CA GLU A 51 18.897 14.943 22.211 1.00 0.31 C ATOM 938 C GLU A 51 20.086 14.569 23.091 1.00 0.33 C ATOM 939 O GLU A 51 20.250 13.434 23.494 1.00 0.35 O ATOM 940 CB GLU A 51 19.234 14.876 20.738 1.00 0.35 C ATOM 941 CG GLU A 51 20.738 14.783 20.549 1.00 0.34 C ATOM 942 CD GLU A 51 21.204 13.352 20.825 1.00 0.25 C ATOM 943 OE1 GLU A 51 20.888 12.483 20.030 1.00 0.24 O ATOM 944 OE2 GLU A 51 21.873 13.151 21.825 1.00 0.22 O ATOM 0 H GLU A 51 19.014 16.837 23.168 1.00 0.35 H new ATOM 0 HA GLU A 51 18.112 14.228 22.460 1.00 0.31 H new ATOM 0 HB2 GLU A 51 18.749 14.011 20.285 1.00 0.35 H new ATOM 0 HB3 GLU A 51 18.850 15.760 20.229 1.00 0.35 H new ATOM 0 HG2 GLU A 51 21.005 15.073 19.533 1.00 0.34 H new ATOM 0 HG3 GLU A 51 21.243 15.476 21.222 1.00 0.34 H new ATOM 951 N GLY A 52 20.882 15.524 23.422 1.00 0.38 N ATOM 952 CA GLY A 52 22.050 15.261 24.318 1.00 0.42 C ATOM 953 C GLY A 52 23.340 15.065 23.515 1.00 0.37 C ATOM 954 O GLY A 52 23.934 14.004 23.532 1.00 0.46 O ATOM 0 H GLY A 52 20.785 16.492 23.114 1.00 0.38 H new ATOM 0 HA2 GLY A 52 22.174 16.094 25.010 1.00 0.42 H new ATOM 0 HA3 GLY A 52 21.856 14.373 24.919 1.00 0.42 H new ATOM 958 N LYS A 53 23.797 16.083 22.837 1.00 0.28 N ATOM 959 CA LYS A 53 25.060 15.966 22.065 1.00 0.32 C ATOM 960 C LYS A 53 25.875 17.245 22.317 1.00 0.22 C ATOM 961 O LYS A 53 25.978 17.712 23.432 1.00 0.23 O ATOM 962 CB LYS A 53 24.748 15.865 20.565 1.00 0.40 C ATOM 963 CG LYS A 53 23.472 15.071 20.299 1.00 0.49 C ATOM 964 CD LYS A 53 23.832 13.787 19.552 1.00 0.59 C ATOM 965 CE LYS A 53 24.704 12.935 20.473 1.00 0.62 C ATOM 966 NZ LYS A 53 24.267 11.513 20.394 1.00 0.86 N ATOM 0 H LYS A 53 23.344 16.995 22.787 1.00 0.28 H new ATOM 0 HA LYS A 53 25.611 15.077 22.373 1.00 0.32 H new ATOM 0 HB2 LYS A 53 24.645 16.867 20.148 1.00 0.40 H new ATOM 0 HB3 LYS A 53 25.584 15.390 20.052 1.00 0.40 H new ATOM 0 HG2 LYS A 53 22.974 14.833 21.239 1.00 0.49 H new ATOM 0 HG3 LYS A 53 22.774 15.666 19.710 1.00 0.49 H new ATOM 0 HD2 LYS A 53 22.930 13.244 19.271 1.00 0.59 H new ATOM 0 HD3 LYS A 53 24.365 14.019 18.630 1.00 0.59 H new ATOM 0 HE2 LYS A 53 25.751 13.022 20.183 1.00 0.62 H new ATOM 0 HE3 LYS A 53 24.627 13.294 21.499 1.00 0.62 H new ATOM 0 HZ1 LYS A 53 24.574 11.008 21.250 1.00 0.86 H new ATOM 0 HZ2 LYS A 53 23.230 11.472 20.321 1.00 0.86 H new ATOM 0 HZ3 LYS A 53 24.691 11.065 19.557 1.00 0.86 H new ATOM 980 N GLU A 54 26.412 17.829 21.277 1.00 0.18 N ATOM 981 CA GLU A 54 27.173 19.104 21.412 1.00 0.15 C ATOM 982 C GLU A 54 28.593 18.884 21.916 1.00 0.23 C ATOM 983 O GLU A 54 28.815 18.253 22.930 1.00 0.26 O ATOM 984 CB GLU A 54 26.463 20.027 22.412 1.00 0.26 C ATOM 985 CG GLU A 54 27.374 20.274 23.626 1.00 0.95 C ATOM 986 CD GLU A 54 26.705 21.275 24.568 1.00 0.65 C ATOM 987 OE1 GLU A 54 25.906 22.065 24.091 1.00 1.45 O ATOM 988 OE2 GLU A 54 27.002 21.237 25.750 1.00 1.63 O ATOM 0 H GLU A 54 26.353 17.469 20.325 1.00 0.18 H new ATOM 0 HA GLU A 54 27.218 19.548 20.418 1.00 0.15 H new ATOM 0 HB2 GLU A 54 26.214 20.974 21.934 1.00 0.26 H new ATOM 0 HB3 GLU A 54 25.525 19.576 22.735 1.00 0.26 H new ATOM 0 HG2 GLU A 54 27.564 19.337 24.149 1.00 0.95 H new ATOM 0 HG3 GLU A 54 28.340 20.657 23.298 1.00 0.95 H new ATOM 995 N ILE A 55 29.554 19.488 21.269 1.00 0.39 N ATOM 996 CA ILE A 55 30.931 19.415 21.773 1.00 0.42 C ATOM 997 C ILE A 55 31.128 20.716 22.504 1.00 0.40 C ATOM 998 O ILE A 55 30.306 21.604 22.419 1.00 0.48 O ATOM 999 CB ILE A 55 31.918 19.340 20.636 1.00 0.41 C ATOM 1000 CG1 ILE A 55 32.682 18.061 20.726 1.00 0.57 C ATOM 1001 CG2 ILE A 55 32.964 20.450 20.716 1.00 0.26 C ATOM 1002 CD1 ILE A 55 33.476 18.010 19.454 1.00 0.61 C ATOM 0 H ILE A 55 29.432 20.027 20.412 1.00 0.39 H new ATOM 0 HA ILE A 55 31.086 18.534 22.396 1.00 0.42 H new ATOM 0 HB ILE A 55 31.342 19.425 19.715 1.00 0.41 H new ATOM 0 HG12 ILE A 55 33.332 18.047 21.601 1.00 0.57 H new ATOM 0 HG13 ILE A 55 32.014 17.204 20.812 1.00 0.57 H new ATOM 0 HG21 ILE A 55 33.656 20.359 19.878 1.00 0.26 H new ATOM 0 HG22 ILE A 55 32.469 21.420 20.675 1.00 0.26 H new ATOM 0 HG23 ILE A 55 33.515 20.364 21.652 1.00 0.26 H new ATOM 0 HD11 ILE A 55 34.072 17.098 19.433 1.00 0.61 H new ATOM 0 HD12 ILE A 55 32.798 18.020 18.601 1.00 0.61 H new ATOM 0 HD13 ILE A 55 34.136 18.876 19.402 1.00 0.61 H new ATOM 1014 N LEU A 56 32.182 20.874 23.191 1.00 0.34 N ATOM 1015 CA LEU A 56 32.372 22.146 23.870 1.00 0.37 C ATOM 1016 C LEU A 56 33.859 22.436 23.902 1.00 1.03 C ATOM 1017 O LEU A 56 34.379 22.708 24.929 1.00 2.07 O ATOM 1018 CB LEU A 56 31.724 22.011 25.257 1.00 1.13 C ATOM 1019 CG LEU A 56 32.006 23.158 26.207 1.00 1.84 C ATOM 1020 CD1 LEU A 56 33.130 22.708 27.147 1.00 2.89 C ATOM 1021 CD2 LEU A 56 32.335 24.457 25.442 1.00 4.56 C ATOM 0 H LEU A 56 32.922 20.183 23.316 1.00 0.34 H new ATOM 0 HA LEU A 56 31.901 22.992 23.369 1.00 0.37 H new ATOM 0 HB2 LEU A 56 30.645 21.920 25.131 1.00 1.13 H new ATOM 0 HB3 LEU A 56 32.071 21.085 25.715 1.00 1.13 H new ATOM 0 HG LEU A 56 31.123 23.400 26.798 1.00 1.84 H new ATOM 0 HD11 LEU A 56 33.361 23.510 27.848 1.00 2.89 H new ATOM 0 HD12 LEU A 56 32.810 21.825 27.700 1.00 2.89 H new ATOM 0 HD13 LEU A 56 34.019 22.469 26.563 1.00 2.89 H new ATOM 0 HD21 LEU A 56 32.532 25.259 26.154 1.00 4.56 H new ATOM 0 HD22 LEU A 56 33.216 24.300 24.820 1.00 4.56 H new ATOM 0 HD23 LEU A 56 31.490 24.732 24.811 1.00 4.56 H new ATOM 1033 N VAL A 57 34.526 22.379 22.746 1.00 0.71 N ATOM 1034 CA VAL A 57 36.005 22.662 22.650 1.00 1.54 C ATOM 1035 C VAL A 57 36.737 22.515 24.003 1.00 1.71 C ATOM 1036 O VAL A 57 37.585 21.661 24.125 1.00 2.37 O ATOM 1037 CB VAL A 57 36.232 24.037 22.015 1.00 1.87 C ATOM 1038 CG1 VAL A 57 35.179 24.268 20.933 1.00 2.25 C ATOM 1039 CG2 VAL A 57 36.145 25.159 23.050 1.00 1.22 C ATOM 0 H VAL A 57 34.090 22.143 21.855 1.00 0.71 H new ATOM 0 HA VAL A 57 36.447 21.904 22.003 1.00 1.54 H new ATOM 0 HB VAL A 57 37.234 24.051 21.586 1.00 1.87 H new ATOM 0 HG11 VAL A 57 35.335 25.245 20.477 1.00 2.25 H new ATOM 0 HG12 VAL A 57 35.265 23.494 20.171 1.00 2.25 H new ATOM 0 HG13 VAL A 57 34.185 24.230 21.379 1.00 2.25 H new ATOM 0 HG21 VAL A 57 36.312 26.119 22.561 1.00 1.22 H new ATOM 0 HG22 VAL A 57 35.157 25.153 23.511 1.00 1.22 H new ATOM 0 HG23 VAL A 57 36.904 25.006 23.817 1.00 1.22 H new ATOM 1049 N GLY A 58 36.428 23.291 25.023 1.00 1.30 N ATOM 1050 CA GLY A 58 37.115 23.083 26.332 1.00 1.80 C ATOM 1051 C GLY A 58 37.221 21.573 26.526 1.00 1.67 C ATOM 1052 O GLY A 58 38.252 21.046 26.897 1.00 1.94 O ATOM 0 H GLY A 58 35.741 24.045 25.001 1.00 1.30 H new ATOM 0 HA2 GLY A 58 38.102 23.545 26.330 1.00 1.80 H new ATOM 0 HA3 GLY A 58 36.550 23.541 27.144 1.00 1.80 H new ATOM 1056 N ASP A 59 36.168 20.865 26.190 1.00 1.21 N ATOM 1057 CA ASP A 59 36.213 19.388 26.257 1.00 1.07 C ATOM 1058 C ASP A 59 37.296 18.972 25.284 1.00 0.95 C ATOM 1059 O ASP A 59 38.267 18.367 25.652 1.00 0.89 O ATOM 1060 CB ASP A 59 34.887 18.784 25.783 1.00 0.85 C ATOM 1061 CG ASP A 59 33.956 18.570 26.979 1.00 1.08 C ATOM 1062 OD1 ASP A 59 34.446 18.592 28.097 1.00 1.94 O ATOM 1063 OD2 ASP A 59 32.771 18.391 26.756 1.00 0.87 O ATOM 0 H ASP A 59 35.282 21.257 25.873 1.00 1.21 H new ATOM 0 HA ASP A 59 36.398 19.051 27.277 1.00 1.07 H new ATOM 0 HB2 ASP A 59 34.415 19.446 25.057 1.00 0.85 H new ATOM 0 HB3 ASP A 59 35.069 17.835 25.278 1.00 0.85 H new ATOM 1068 N VAL A 60 37.130 19.347 24.038 1.00 0.93 N ATOM 1069 CA VAL A 60 38.147 19.029 23.002 1.00 0.85 C ATOM 1070 C VAL A 60 39.542 19.129 23.622 1.00 0.84 C ATOM 1071 O VAL A 60 40.123 20.192 23.731 1.00 0.97 O ATOM 1072 CB VAL A 60 37.998 20.024 21.852 1.00 0.91 C ATOM 1073 CG1 VAL A 60 39.116 19.812 20.848 1.00 0.87 C ATOM 1074 CG2 VAL A 60 36.650 19.794 21.162 1.00 0.91 C ATOM 0 H VAL A 60 36.321 19.866 23.697 1.00 0.93 H new ATOM 0 HA VAL A 60 38.006 18.017 22.622 1.00 0.85 H new ATOM 0 HB VAL A 60 38.048 21.041 22.241 1.00 0.91 H new ATOM 0 HG11 VAL A 60 39.008 20.522 20.028 1.00 0.87 H new ATOM 0 HG12 VAL A 60 40.078 19.965 21.337 1.00 0.87 H new ATOM 0 HG13 VAL A 60 39.066 18.796 20.457 1.00 0.87 H new ATOM 0 HG21 VAL A 60 36.537 20.501 20.340 1.00 0.91 H new ATOM 0 HG22 VAL A 60 36.609 18.776 20.774 1.00 0.91 H new ATOM 0 HG23 VAL A 60 35.844 19.941 21.881 1.00 0.91 H new ATOM 1084 N GLY A 61 40.058 18.015 24.049 1.00 0.71 N ATOM 1085 CA GLY A 61 41.399 17.981 24.697 1.00 0.73 C ATOM 1086 C GLY A 61 41.322 17.092 25.947 1.00 0.74 C ATOM 1087 O GLY A 61 42.309 16.817 26.600 1.00 0.84 O ATOM 0 H GLY A 61 39.599 17.107 23.976 1.00 0.71 H new ATOM 0 HA2 GLY A 61 42.144 17.592 24.003 1.00 0.73 H new ATOM 0 HA3 GLY A 61 41.712 18.989 24.969 1.00 0.73 H new ATOM 1091 N VAL A 62 40.145 16.628 26.257 1.00 0.67 N ATOM 1092 CA VAL A 62 39.925 15.740 27.419 1.00 0.68 C ATOM 1093 C VAL A 62 39.379 14.448 26.843 1.00 0.59 C ATOM 1094 O VAL A 62 40.118 13.562 26.458 1.00 0.63 O ATOM 1095 CB VAL A 62 38.881 16.379 28.330 1.00 0.69 C ATOM 1096 CG1 VAL A 62 38.363 15.348 29.328 1.00 0.70 C ATOM 1097 CG2 VAL A 62 39.509 17.556 29.065 1.00 0.76 C ATOM 0 H VAL A 62 39.298 16.839 25.729 1.00 0.67 H new ATOM 0 HA VAL A 62 40.834 15.570 27.996 1.00 0.68 H new ATOM 0 HB VAL A 62 38.042 16.736 27.732 1.00 0.69 H new ATOM 0 HG11 VAL A 62 37.618 15.811 29.975 1.00 0.70 H new ATOM 0 HG12 VAL A 62 37.909 14.516 28.789 1.00 0.70 H new ATOM 0 HG13 VAL A 62 39.191 14.980 29.933 1.00 0.70 H new ATOM 0 HG21 VAL A 62 38.766 18.016 29.717 1.00 0.76 H new ATOM 0 HG22 VAL A 62 40.350 17.205 29.663 1.00 0.76 H new ATOM 0 HG23 VAL A 62 39.861 18.291 28.341 1.00 0.76 H new ATOM 1107 N THR A 63 38.090 14.371 26.692 1.00 0.49 N ATOM 1108 CA THR A 63 37.504 13.187 26.048 1.00 0.41 C ATOM 1109 C THR A 63 37.786 13.345 24.561 1.00 0.36 C ATOM 1110 O THR A 63 37.650 12.422 23.784 1.00 0.29 O ATOM 1111 CB THR A 63 35.992 13.175 26.266 1.00 0.42 C ATOM 1112 OG1 THR A 63 35.701 12.816 27.612 1.00 0.82 O ATOM 1113 CG2 THR A 63 35.351 12.173 25.307 1.00 0.31 C ATOM 0 H THR A 63 37.422 15.082 26.990 1.00 0.49 H new ATOM 0 HA THR A 63 37.919 12.264 26.454 1.00 0.41 H new ATOM 0 HB THR A 63 35.588 14.169 26.072 1.00 0.42 H new ATOM 0 HG1 THR A 63 34.730 12.812 27.747 1.00 0.82 H new ATOM 0 HG21 THR A 63 34.272 12.162 25.460 1.00 0.31 H new ATOM 0 HG22 THR A 63 35.569 12.463 24.279 1.00 0.31 H new ATOM 0 HG23 THR A 63 35.754 11.178 25.497 1.00 0.31 H new ATOM 1121 N ILE A 64 38.160 14.541 24.162 1.00 0.42 N ATOM 1122 CA ILE A 64 38.427 14.793 22.725 1.00 0.40 C ATOM 1123 C ILE A 64 39.821 15.412 22.548 1.00 0.47 C ATOM 1124 O ILE A 64 40.605 15.440 23.477 1.00 0.56 O ATOM 1125 CB ILE A 64 37.332 15.721 22.207 1.00 0.55 C ATOM 1126 CG1 ILE A 64 36.556 16.330 23.392 1.00 0.68 C ATOM 1127 CG2 ILE A 64 36.370 14.884 21.390 1.00 0.57 C ATOM 1128 CD1 ILE A 64 35.294 17.045 22.885 1.00 0.68 C ATOM 0 H ILE A 64 38.289 15.346 24.775 1.00 0.42 H new ATOM 0 HA ILE A 64 38.416 13.863 22.157 1.00 0.40 H new ATOM 0 HB ILE A 64 37.772 16.522 21.613 1.00 0.55 H new ATOM 0 HG12 ILE A 64 36.281 15.546 24.098 1.00 0.68 H new ATOM 0 HG13 ILE A 64 37.191 17.034 23.929 1.00 0.68 H new ATOM 0 HG21 ILE A 64 35.573 15.519 21.004 1.00 0.57 H new ATOM 0 HG22 ILE A 64 36.903 14.425 20.558 1.00 0.57 H new ATOM 0 HG23 ILE A 64 35.941 14.105 22.020 1.00 0.57 H new ATOM 0 HD11 ILE A 64 34.753 17.472 23.730 1.00 0.68 H new ATOM 0 HD12 ILE A 64 35.578 17.841 22.197 1.00 0.68 H new ATOM 0 HD13 ILE A 64 34.654 16.330 22.368 1.00 0.68 H new ATOM 1140 N THR A 65 40.162 15.891 21.373 1.00 0.49 N ATOM 1141 CA THR A 65 41.532 16.471 21.206 1.00 0.62 C ATOM 1142 C THR A 65 41.613 17.464 20.049 1.00 0.82 C ATOM 1143 O THR A 65 42.699 17.796 19.622 1.00 1.08 O ATOM 1144 CB THR A 65 42.531 15.339 20.968 1.00 0.58 C ATOM 1145 OG1 THR A 65 41.836 14.103 20.906 1.00 0.60 O ATOM 1146 CG2 THR A 65 43.536 15.304 22.119 1.00 0.74 C ATOM 0 H THR A 65 39.568 15.906 20.544 1.00 0.49 H new ATOM 0 HA THR A 65 41.770 17.015 22.120 1.00 0.62 H new ATOM 0 HB THR A 65 43.058 15.505 20.029 1.00 0.58 H new ATOM 0 HG1 THR A 65 42.475 13.376 20.752 1.00 0.60 H new ATOM 0 HG21 THR A 65 44.251 14.498 21.954 1.00 0.74 H new ATOM 0 HG22 THR A 65 44.066 16.255 22.168 1.00 0.74 H new ATOM 0 HG23 THR A 65 43.008 15.134 23.058 1.00 0.74 H new ATOM 1154 N ASP A 66 40.494 17.957 19.563 1.00 0.79 N ATOM 1155 CA ASP A 66 40.518 18.979 18.458 1.00 0.98 C ATOM 1156 C ASP A 66 40.291 18.423 17.031 1.00 0.72 C ATOM 1157 O ASP A 66 40.213 19.212 16.111 1.00 0.66 O ATOM 1158 CB ASP A 66 41.845 19.734 18.506 1.00 1.32 C ATOM 1159 CG ASP A 66 41.655 21.147 17.953 1.00 1.59 C ATOM 1160 OD1 ASP A 66 40.822 21.311 17.077 1.00 1.16 O ATOM 1161 OD2 ASP A 66 42.343 22.041 18.417 1.00 2.32 O ATOM 0 H ASP A 66 39.562 17.696 19.884 1.00 0.79 H new ATOM 0 HA ASP A 66 39.667 19.634 18.646 1.00 0.98 H new ATOM 0 HB2 ASP A 66 42.211 19.781 19.532 1.00 1.32 H new ATOM 0 HB3 ASP A 66 42.598 19.203 17.923 1.00 1.32 H new ATOM 1166 N PRO A 67 40.162 17.128 16.839 1.00 0.60 N ATOM 1167 CA PRO A 67 39.916 16.599 15.488 1.00 0.40 C ATOM 1168 C PRO A 67 38.438 16.838 15.136 1.00 0.24 C ATOM 1169 O PRO A 67 38.043 17.939 14.808 1.00 0.36 O ATOM 1170 CB PRO A 67 40.239 15.107 15.621 1.00 0.39 C ATOM 1171 CG PRO A 67 40.067 14.767 17.118 1.00 0.46 C ATOM 1172 CD PRO A 67 40.250 16.090 17.883 1.00 0.64 C ATOM 0 HA PRO A 67 40.508 17.065 14.700 1.00 0.40 H new ATOM 0 HB2 PRO A 67 39.570 14.506 15.005 1.00 0.39 H new ATOM 0 HB3 PRO A 67 41.255 14.896 15.287 1.00 0.39 H new ATOM 0 HG2 PRO A 67 39.083 14.340 17.309 1.00 0.46 H new ATOM 0 HG3 PRO A 67 40.803 14.028 17.436 1.00 0.46 H new ATOM 0 HD2 PRO A 67 39.478 16.222 18.641 1.00 0.64 H new ATOM 0 HD3 PRO A 67 41.211 16.123 18.397 1.00 0.64 H new ATOM 1180 N PHE A 68 37.618 15.826 15.210 1.00 0.27 N ATOM 1181 CA PHE A 68 36.173 16.008 14.894 1.00 0.14 C ATOM 1182 C PHE A 68 35.450 14.659 15.053 1.00 0.10 C ATOM 1183 O PHE A 68 34.266 14.604 15.323 1.00 0.28 O ATOM 1184 CB PHE A 68 36.029 16.415 13.440 1.00 0.15 C ATOM 1185 CG PHE A 68 35.992 15.129 12.681 1.00 0.29 C ATOM 1186 CD1 PHE A 68 37.177 14.430 12.498 1.00 0.41 C ATOM 1187 CD2 PHE A 68 34.783 14.591 12.243 1.00 0.43 C ATOM 1188 CE1 PHE A 68 37.167 13.197 11.862 1.00 0.61 C ATOM 1189 CE2 PHE A 68 34.770 13.343 11.613 1.00 0.61 C ATOM 1190 CZ PHE A 68 35.961 12.647 11.420 1.00 0.70 C ATOM 0 H PHE A 68 37.887 14.879 15.476 1.00 0.27 H new ATOM 0 HA PHE A 68 35.754 16.763 15.559 1.00 0.14 H new ATOM 0 HB2 PHE A 68 35.119 16.994 13.280 1.00 0.15 H new ATOM 0 HB3 PHE A 68 36.864 17.038 13.120 1.00 0.15 H new ATOM 0 HD1 PHE A 68 38.109 14.847 12.851 1.00 0.41 H new ATOM 0 HD2 PHE A 68 33.862 15.135 12.389 1.00 0.43 H new ATOM 0 HE1 PHE A 68 38.092 12.662 11.708 1.00 0.61 H new ATOM 0 HE2 PHE A 68 33.836 12.918 11.276 1.00 0.61 H new ATOM 0 HZ PHE A 68 35.952 11.685 10.930 1.00 0.70 H new ATOM 1200 N LYS A 69 36.160 13.572 14.840 1.00 0.24 N ATOM 1201 CA LYS A 69 35.543 12.208 14.918 1.00 0.29 C ATOM 1202 C LYS A 69 34.948 11.912 16.301 1.00 0.45 C ATOM 1203 O LYS A 69 34.403 10.847 16.520 1.00 1.23 O ATOM 1204 CB LYS A 69 36.590 11.146 14.547 1.00 0.27 C ATOM 1205 CG LYS A 69 37.862 11.345 15.369 1.00 0.35 C ATOM 1206 CD LYS A 69 37.641 10.816 16.782 1.00 0.53 C ATOM 1207 CE LYS A 69 37.759 11.972 17.770 1.00 3.55 C ATOM 1208 NZ LYS A 69 37.306 11.524 19.117 1.00 4.69 N ATOM 0 H LYS A 69 37.154 13.574 14.612 1.00 0.24 H new ATOM 0 HA LYS A 69 34.718 12.178 14.207 1.00 0.29 H new ATOM 0 HB2 LYS A 69 36.186 10.149 14.725 1.00 0.27 H new ATOM 0 HB3 LYS A 69 36.822 11.210 13.484 1.00 0.27 H new ATOM 0 HG2 LYS A 69 38.696 10.823 14.900 1.00 0.35 H new ATOM 0 HG3 LYS A 69 38.125 12.402 15.402 1.00 0.35 H new ATOM 0 HD2 LYS A 69 36.658 10.353 16.861 1.00 0.53 H new ATOM 0 HD3 LYS A 69 38.376 10.046 17.015 1.00 0.53 H new ATOM 0 HE2 LYS A 69 38.791 12.319 17.819 1.00 3.55 H new ATOM 0 HE3 LYS A 69 37.155 12.815 17.433 1.00 3.55 H new ATOM 0 HZ1 LYS A 69 37.306 12.333 19.770 1.00 4.69 H new ATOM 0 HZ2 LYS A 69 36.344 11.135 19.048 1.00 4.69 H new ATOM 0 HZ3 LYS A 69 37.951 10.791 19.474 1.00 4.69 H new ATOM 1222 N HIS A 70 34.989 12.829 17.224 1.00 0.34 N ATOM 1223 CA HIS A 70 34.348 12.557 18.530 1.00 0.25 C ATOM 1224 C HIS A 70 32.946 13.126 18.454 1.00 0.26 C ATOM 1225 O HIS A 70 31.964 12.464 18.725 1.00 0.23 O ATOM 1226 CB HIS A 70 35.055 13.274 19.643 1.00 0.27 C ATOM 1227 CG HIS A 70 34.001 13.902 20.512 1.00 0.33 C ATOM 1228 ND1 HIS A 70 33.184 13.157 21.337 1.00 0.36 N ATOM 1229 CD2 HIS A 70 33.623 15.207 20.697 1.00 0.44 C ATOM 1230 CE1 HIS A 70 32.368 14.015 21.969 1.00 0.40 C ATOM 1231 NE2 HIS A 70 32.593 15.274 21.616 1.00 0.47 N ATOM 0 H HIS A 70 35.433 13.742 17.130 1.00 0.34 H new ATOM 0 HA HIS A 70 34.370 11.485 18.727 1.00 0.25 H new ATOM 0 HB2 HIS A 70 35.665 12.580 20.221 1.00 0.27 H new ATOM 0 HB3 HIS A 70 35.727 14.034 19.244 1.00 0.27 H new ATOM 0 HD1 HIS A 70 33.198 12.143 21.446 1.00 0.36 H new ATOM 0 HD2 HIS A 70 34.065 16.057 20.198 1.00 0.44 H new ATOM 0 HE1 HIS A 70 31.615 13.715 22.683 1.00 0.40 H new ATOM 1239 N PHE A 71 32.857 14.372 18.071 1.00 0.35 N ATOM 1240 CA PHE A 71 31.538 15.015 17.949 1.00 0.39 C ATOM 1241 C PHE A 71 30.740 14.219 16.920 1.00 0.30 C ATOM 1242 O PHE A 71 29.549 14.045 17.049 1.00 0.25 O ATOM 1243 CB PHE A 71 31.722 16.484 17.518 1.00 0.57 C ATOM 1244 CG PHE A 71 30.635 16.912 16.574 1.00 0.47 C ATOM 1245 CD1 PHE A 71 30.626 16.461 15.251 1.00 0.43 C ATOM 1246 CD2 PHE A 71 29.630 17.765 17.031 1.00 0.44 C ATOM 1247 CE1 PHE A 71 29.607 16.870 14.386 1.00 0.36 C ATOM 1248 CE2 PHE A 71 28.615 18.172 16.174 1.00 0.37 C ATOM 1249 CZ PHE A 71 28.599 17.724 14.848 1.00 0.32 C ATOM 0 H PHE A 71 33.652 14.967 17.838 1.00 0.35 H new ATOM 0 HA PHE A 71 31.002 15.021 18.898 1.00 0.39 H new ATOM 0 HB2 PHE A 71 31.718 17.127 18.398 1.00 0.57 H new ATOM 0 HB3 PHE A 71 32.693 16.606 17.038 1.00 0.57 H new ATOM 0 HD1 PHE A 71 31.403 15.799 14.899 1.00 0.43 H new ATOM 0 HD2 PHE A 71 29.641 18.110 18.054 1.00 0.44 H new ATOM 0 HE1 PHE A 71 29.598 16.527 13.362 1.00 0.36 H new ATOM 0 HE2 PHE A 71 27.839 18.833 16.531 1.00 0.37 H new ATOM 0 HZ PHE A 71 27.809 18.037 14.182 1.00 0.32 H new ATOM 1259 N VAL A 72 31.395 13.681 15.923 1.00 0.38 N ATOM 1260 CA VAL A 72 30.671 12.847 14.942 1.00 0.40 C ATOM 1261 C VAL A 72 30.118 11.674 15.723 1.00 0.30 C ATOM 1262 O VAL A 72 29.020 11.202 15.504 1.00 0.36 O ATOM 1263 CB VAL A 72 31.645 12.360 13.886 1.00 0.57 C ATOM 1264 CG1 VAL A 72 32.530 13.519 13.448 1.00 0.73 C ATOM 1265 CG2 VAL A 72 32.496 11.228 14.447 1.00 0.64 C ATOM 0 H VAL A 72 32.395 13.788 15.754 1.00 0.38 H new ATOM 0 HA VAL A 72 29.876 13.398 14.440 1.00 0.40 H new ATOM 0 HB VAL A 72 31.093 11.984 13.025 1.00 0.57 H new ATOM 0 HG11 VAL A 72 33.232 13.174 12.689 1.00 0.73 H new ATOM 0 HG12 VAL A 72 31.910 14.314 13.034 1.00 0.73 H new ATOM 0 HG13 VAL A 72 33.083 13.900 14.307 1.00 0.73 H new ATOM 0 HG21 VAL A 72 33.193 10.884 13.683 1.00 0.64 H new ATOM 0 HG22 VAL A 72 33.054 11.587 15.312 1.00 0.64 H new ATOM 0 HG23 VAL A 72 31.851 10.403 14.748 1.00 0.64 H new ATOM 1275 N GLY A 73 30.879 11.240 16.675 1.00 0.29 N ATOM 1276 CA GLY A 73 30.422 10.142 17.555 1.00 0.37 C ATOM 1277 C GLY A 73 29.137 10.631 18.215 1.00 0.31 C ATOM 1278 O GLY A 73 28.185 9.893 18.366 1.00 0.37 O ATOM 0 H GLY A 73 31.809 11.602 16.884 1.00 0.29 H new ATOM 0 HA2 GLY A 73 30.243 9.233 16.981 1.00 0.37 H new ATOM 0 HA3 GLY A 73 31.177 9.903 18.304 1.00 0.37 H new ATOM 1282 N MET A 74 29.080 11.903 18.563 1.00 0.27 N ATOM 1283 CA MET A 74 27.826 12.436 19.149 1.00 0.36 C ATOM 1284 C MET A 74 26.755 12.225 18.096 1.00 0.47 C ATOM 1285 O MET A 74 25.623 11.938 18.386 1.00 1.07 O ATOM 1286 CB MET A 74 27.981 13.923 19.474 1.00 0.22 C ATOM 1287 CG MET A 74 29.065 14.106 20.543 1.00 0.26 C ATOM 1288 SD MET A 74 28.968 15.781 21.203 1.00 0.38 S ATOM 1289 CE MET A 74 29.720 16.576 19.768 1.00 0.31 C ATOM 0 H MET A 74 29.841 12.575 18.464 1.00 0.27 H new ATOM 0 HA MET A 74 27.570 11.933 20.081 1.00 0.36 H new ATOM 0 HB2 MET A 74 28.247 14.477 18.573 1.00 0.22 H new ATOM 0 HB3 MET A 74 27.034 14.329 19.829 1.00 0.22 H new ATOM 0 HG2 MET A 74 28.930 13.378 21.343 1.00 0.26 H new ATOM 0 HG3 MET A 74 30.051 13.928 20.113 1.00 0.26 H new ATOM 0 HE1 MET A 74 29.420 17.623 19.733 1.00 0.31 H new ATOM 0 HE2 MET A 74 30.805 16.512 19.844 1.00 0.31 H new ATOM 0 HE3 MET A 74 29.390 16.073 18.859 1.00 0.31 H new ATOM 1299 N LEU A 75 27.149 12.339 16.865 1.00 0.27 N ATOM 1300 CA LEU A 75 26.220 12.129 15.721 1.00 0.22 C ATOM 1301 C LEU A 75 26.053 10.613 15.466 1.00 0.27 C ATOM 1302 O LEU A 75 26.950 9.993 14.930 1.00 0.41 O ATOM 1303 CB LEU A 75 26.872 12.767 14.491 1.00 0.20 C ATOM 1304 CG LEU A 75 27.328 14.180 14.825 1.00 0.20 C ATOM 1305 CD1 LEU A 75 27.914 14.821 13.568 1.00 0.31 C ATOM 1306 CD2 LEU A 75 26.134 15.005 15.302 1.00 0.31 C ATOM 0 H LEU A 75 28.103 12.576 16.593 1.00 0.27 H new ATOM 0 HA LEU A 75 25.244 12.567 15.928 1.00 0.22 H new ATOM 0 HB2 LEU A 75 27.723 12.168 14.167 1.00 0.20 H new ATOM 0 HB3 LEU A 75 26.164 12.790 13.663 1.00 0.20 H new ATOM 0 HG LEU A 75 28.081 14.146 15.613 1.00 0.20 H new ATOM 0 HD11 LEU A 75 28.244 15.834 13.796 1.00 0.31 H new ATOM 0 HD12 LEU A 75 28.763 14.232 13.221 1.00 0.31 H new ATOM 0 HD13 LEU A 75 27.153 14.854 12.788 1.00 0.31 H new ATOM 0 HD21 LEU A 75 26.463 16.016 15.541 1.00 0.31 H new ATOM 0 HD22 LEU A 75 25.381 15.044 14.515 1.00 0.31 H new ATOM 0 HD23 LEU A 75 25.705 14.544 16.191 1.00 0.31 H new ATOM 1318 N PRO A 76 24.926 10.047 15.854 1.00 0.14 N ATOM 1319 CA PRO A 76 24.664 8.610 15.674 1.00 0.21 C ATOM 1320 C PRO A 76 23.989 8.363 14.313 1.00 0.17 C ATOM 1321 O PRO A 76 24.049 9.173 13.422 1.00 0.19 O ATOM 1322 CB PRO A 76 23.692 8.291 16.808 1.00 0.26 C ATOM 1323 CG PRO A 76 23.001 9.628 17.180 1.00 0.20 C ATOM 1324 CD PRO A 76 23.815 10.759 16.514 1.00 0.07 C ATOM 0 HA PRO A 76 25.567 7.999 15.694 1.00 0.21 H new ATOM 0 HB2 PRO A 76 22.958 7.549 16.494 1.00 0.26 H new ATOM 0 HB3 PRO A 76 24.219 7.874 17.666 1.00 0.26 H new ATOM 0 HG2 PRO A 76 21.969 9.639 16.830 1.00 0.20 H new ATOM 0 HG3 PRO A 76 22.972 9.759 18.262 1.00 0.20 H new ATOM 0 HD2 PRO A 76 23.213 11.316 15.796 1.00 0.07 H new ATOM 0 HD3 PRO A 76 24.180 11.477 17.249 1.00 0.07 H new ATOM 1332 N GLU A 77 23.331 7.257 14.150 1.00 0.15 N ATOM 1333 CA GLU A 77 22.657 6.989 12.855 1.00 0.19 C ATOM 1334 C GLU A 77 21.143 7.138 13.048 1.00 0.30 C ATOM 1335 O GLU A 77 20.390 7.297 12.108 1.00 0.47 O ATOM 1336 CB GLU A 77 22.999 5.564 12.401 1.00 0.17 C ATOM 1337 CG GLU A 77 24.431 5.210 12.814 1.00 0.06 C ATOM 1338 CD GLU A 77 24.623 3.696 12.717 1.00 0.26 C ATOM 1339 OE1 GLU A 77 23.809 2.978 13.272 1.00 0.77 O ATOM 1340 OE2 GLU A 77 25.580 3.280 12.084 1.00 0.56 O ATOM 0 H GLU A 77 23.230 6.527 14.855 1.00 0.15 H new ATOM 0 HA GLU A 77 22.993 7.694 12.095 1.00 0.19 H new ATOM 0 HB2 GLU A 77 22.299 4.855 12.843 1.00 0.17 H new ATOM 0 HB3 GLU A 77 22.894 5.483 11.319 1.00 0.17 H new ATOM 0 HG2 GLU A 77 25.145 5.721 12.168 1.00 0.06 H new ATOM 0 HG3 GLU A 77 24.623 5.548 13.832 1.00 0.06 H new ATOM 1347 N LYS A 78 20.699 7.087 14.272 1.00 0.22 N ATOM 1348 CA LYS A 78 19.239 7.214 14.563 1.00 0.32 C ATOM 1349 C LYS A 78 18.881 8.662 14.903 1.00 0.52 C ATOM 1350 O LYS A 78 17.887 8.921 15.555 1.00 0.79 O ATOM 1351 CB LYS A 78 18.885 6.312 15.751 1.00 0.16 C ATOM 1352 CG LYS A 78 19.231 7.010 17.074 1.00 0.35 C ATOM 1353 CD LYS A 78 20.746 7.058 17.271 1.00 0.71 C ATOM 1354 CE LYS A 78 21.339 5.667 17.023 1.00 1.09 C ATOM 1355 NZ LYS A 78 20.561 4.655 17.793 1.00 1.54 N ATOM 0 H LYS A 78 21.290 6.961 15.094 1.00 0.22 H new ATOM 0 HA LYS A 78 18.675 6.913 13.680 1.00 0.32 H new ATOM 0 HB2 LYS A 78 17.823 6.069 15.728 1.00 0.16 H new ATOM 0 HB3 LYS A 78 19.429 5.371 15.676 1.00 0.16 H new ATOM 0 HG2 LYS A 78 18.825 8.022 17.076 1.00 0.35 H new ATOM 0 HG3 LYS A 78 18.766 6.479 17.905 1.00 0.35 H new ATOM 0 HD2 LYS A 78 21.189 7.781 16.587 1.00 0.71 H new ATOM 0 HD3 LYS A 78 20.981 7.390 18.282 1.00 0.71 H new ATOM 0 HE2 LYS A 78 21.311 5.432 15.959 1.00 1.09 H new ATOM 0 HE3 LYS A 78 22.386 5.646 17.327 1.00 1.09 H new ATOM 0 HZ1 LYS A 78 21.180 3.857 18.041 1.00 1.54 H new ATOM 0 HZ2 LYS A 78 20.191 5.090 18.662 1.00 1.54 H new ATOM 0 HZ3 LYS A 78 19.769 4.312 17.213 1.00 1.54 H new ATOM 1369 N ASP A 79 19.657 9.613 14.480 1.00 0.46 N ATOM 1370 CA ASP A 79 19.320 11.012 14.816 1.00 0.73 C ATOM 1371 C ASP A 79 19.930 11.946 13.787 1.00 0.57 C ATOM 1372 O ASP A 79 21.133 12.028 13.628 1.00 0.79 O ATOM 1373 CB ASP A 79 19.872 11.346 16.204 1.00 1.02 C ATOM 1374 CG ASP A 79 18.996 10.695 17.277 1.00 1.67 C ATOM 1375 OD1 ASP A 79 17.790 10.671 17.094 1.00 1.87 O ATOM 1376 OD2 ASP A 79 19.546 10.233 18.262 1.00 2.15 O ATOM 0 H ASP A 79 20.501 9.483 13.922 1.00 0.46 H new ATOM 0 HA ASP A 79 18.237 11.136 14.814 1.00 0.73 H new ATOM 0 HB2 ASP A 79 20.898 10.990 16.293 1.00 1.02 H new ATOM 0 HB3 ASP A 79 19.896 12.426 16.346 1.00 1.02 H new ATOM 1381 N CYS A 80 19.106 12.676 13.111 1.00 0.28 N ATOM 1382 CA CYS A 80 19.606 13.640 12.116 1.00 0.24 C ATOM 1383 C CYS A 80 19.557 14.992 12.781 1.00 0.25 C ATOM 1384 O CYS A 80 18.525 15.439 13.239 1.00 1.04 O ATOM 1385 CB CYS A 80 18.726 13.640 10.882 1.00 0.35 C ATOM 1386 SG CYS A 80 19.453 14.721 9.627 1.00 3.07 S ATOM 0 H CYS A 80 18.091 12.644 13.208 1.00 0.28 H new ATOM 0 HA CYS A 80 20.616 13.383 11.795 1.00 0.24 H new ATOM 0 HB2 CYS A 80 18.627 12.627 10.492 1.00 0.35 H new ATOM 0 HB3 CYS A 80 17.723 13.983 11.137 1.00 0.35 H new ATOM 0 HG CYS A 80 18.799 15.844 9.589 1.00 3.07 H new ATOM 1392 N ARG A 81 20.671 15.614 12.907 1.00 1.08 N ATOM 1393 CA ARG A 81 20.694 16.903 13.630 1.00 1.15 C ATOM 1394 C ARG A 81 21.602 17.931 12.947 1.00 1.11 C ATOM 1395 O ARG A 81 22.680 17.619 12.479 1.00 1.48 O ATOM 1396 CB ARG A 81 21.242 16.661 15.042 1.00 1.18 C ATOM 1397 CG ARG A 81 21.232 15.166 15.426 1.00 1.68 C ATOM 1398 CD ARG A 81 20.262 14.929 16.584 1.00 2.00 C ATOM 1399 NE ARG A 81 18.985 14.370 16.049 1.00 1.78 N ATOM 1400 CZ ARG A 81 18.110 13.838 16.858 1.00 1.72 C ATOM 1401 NH1 ARG A 81 18.371 13.737 18.132 1.00 2.01 N ATOM 1402 NH2 ARG A 81 16.968 13.413 16.389 1.00 3.40 N ATOM 0 H ARG A 81 21.569 15.294 12.545 1.00 1.08 H new ATOM 0 HA ARG A 81 19.677 17.294 13.646 1.00 1.15 H new ATOM 0 HB2 ARG A 81 22.261 17.043 15.104 1.00 1.18 H new ATOM 0 HB3 ARG A 81 20.646 17.223 15.762 1.00 1.18 H new ATOM 0 HG2 ARG A 81 20.939 14.563 14.566 1.00 1.68 H new ATOM 0 HG3 ARG A 81 22.235 14.849 15.711 1.00 1.68 H new ATOM 0 HD2 ARG A 81 20.700 14.240 17.306 1.00 2.00 H new ATOM 0 HD3 ARG A 81 20.071 15.864 17.111 1.00 2.00 H new ATOM 0 HE ARG A 81 18.796 14.404 15.047 1.00 1.78 H new ATOM 0 HH11 ARG A 81 19.261 14.074 18.499 1.00 2.01 H new ATOM 0 HH12 ARG A 81 17.685 13.321 18.762 1.00 2.01 H new ATOM 0 HH21 ARG A 81 16.762 13.497 15.394 1.00 3.40 H new ATOM 0 HH22 ARG A 81 16.282 12.997 17.018 1.00 3.40 H new ATOM 1416 N TYR A 82 21.190 19.174 12.955 1.00 0.67 N ATOM 1417 CA TYR A 82 22.031 20.258 12.388 1.00 0.58 C ATOM 1418 C TYR A 82 22.964 20.683 13.519 1.00 0.52 C ATOM 1419 O TYR A 82 22.525 20.949 14.610 1.00 0.51 O ATOM 1420 CB TYR A 82 21.111 21.389 11.919 1.00 0.56 C ATOM 1421 CG TYR A 82 20.598 21.057 10.527 1.00 0.58 C ATOM 1422 CD1 TYR A 82 20.997 19.870 9.899 1.00 0.78 C ATOM 1423 CD2 TYR A 82 19.736 21.933 9.857 1.00 0.50 C ATOM 1424 CE1 TYR A 82 20.545 19.565 8.613 1.00 0.82 C ATOM 1425 CE2 TYR A 82 19.281 21.625 8.567 1.00 0.63 C ATOM 1426 CZ TYR A 82 19.690 20.442 7.943 1.00 0.75 C ATOM 1427 OH TYR A 82 19.247 20.139 6.670 1.00 0.87 O ATOM 0 H TYR A 82 20.295 19.482 13.336 1.00 0.67 H new ATOM 0 HA TYR A 82 22.620 19.954 11.523 1.00 0.58 H new ATOM 0 HB2 TYR A 82 20.277 21.508 12.610 1.00 0.56 H new ATOM 0 HB3 TYR A 82 21.652 22.335 11.906 1.00 0.56 H new ATOM 0 HD1 TYR A 82 21.658 19.187 10.412 1.00 0.78 H new ATOM 0 HD2 TYR A 82 19.421 22.849 10.335 1.00 0.50 H new ATOM 0 HE1 TYR A 82 20.858 18.648 8.136 1.00 0.82 H new ATOM 0 HE2 TYR A 82 18.614 22.302 8.055 1.00 0.63 H new ATOM 0 HH TYR A 82 18.346 20.502 6.542 1.00 0.87 H new ATOM 1437 N ALA A 83 24.251 20.665 13.311 1.00 0.49 N ATOM 1438 CA ALA A 83 25.153 20.961 14.441 1.00 0.45 C ATOM 1439 C ALA A 83 26.295 21.897 14.074 1.00 0.39 C ATOM 1440 O ALA A 83 27.023 21.681 13.125 1.00 0.49 O ATOM 1441 CB ALA A 83 25.776 19.646 14.902 1.00 0.52 C ATOM 0 H ALA A 83 24.705 20.461 12.421 1.00 0.49 H new ATOM 0 HA ALA A 83 24.555 21.449 15.211 1.00 0.45 H new ATOM 0 HB1 ALA A 83 26.449 19.836 15.738 1.00 0.52 H new ATOM 0 HB2 ALA A 83 24.989 18.961 15.218 1.00 0.52 H new ATOM 0 HB3 ALA A 83 26.336 19.201 14.080 1.00 0.52 H new ATOM 1447 N LEU A 84 26.488 22.897 14.874 1.00 0.28 N ATOM 1448 CA LEU A 84 27.623 23.828 14.657 1.00 0.22 C ATOM 1449 C LEU A 84 28.720 23.487 15.644 1.00 0.21 C ATOM 1450 O LEU A 84 28.573 23.658 16.833 1.00 0.24 O ATOM 1451 CB LEU A 84 27.202 25.259 14.882 1.00 0.27 C ATOM 1452 CG LEU A 84 26.130 25.636 13.875 1.00 0.35 C ATOM 1453 CD1 LEU A 84 25.752 27.095 14.093 1.00 0.93 C ATOM 1454 CD2 LEU A 84 26.686 25.447 12.466 1.00 0.72 C ATOM 0 H LEU A 84 25.902 23.114 15.680 1.00 0.28 H new ATOM 0 HA LEU A 84 27.970 23.724 13.629 1.00 0.22 H new ATOM 0 HB2 LEU A 84 26.823 25.382 15.896 1.00 0.27 H new ATOM 0 HB3 LEU A 84 28.061 25.922 14.780 1.00 0.27 H new ATOM 0 HG LEU A 84 25.248 25.008 14.000 1.00 0.35 H new ATOM 0 HD11 LEU A 84 24.982 27.382 13.377 1.00 0.93 H new ATOM 0 HD12 LEU A 84 25.372 27.225 15.106 1.00 0.93 H new ATOM 0 HD13 LEU A 84 26.631 27.724 13.952 1.00 0.93 H new ATOM 0 HD21 LEU A 84 25.923 25.715 11.735 1.00 0.72 H new ATOM 0 HD22 LEU A 84 27.559 26.086 12.331 1.00 0.72 H new ATOM 0 HD23 LEU A 84 26.973 24.405 12.325 1.00 0.72 H new ATOM 1466 N TYR A 85 29.812 22.999 15.157 1.00 0.17 N ATOM 1467 CA TYR A 85 30.920 22.614 16.067 1.00 0.17 C ATOM 1468 C TYR A 85 32.092 23.579 15.934 1.00 0.20 C ATOM 1469 O TYR A 85 32.630 23.773 14.865 1.00 0.15 O ATOM 1470 CB TYR A 85 31.389 21.218 15.691 1.00 0.12 C ATOM 1471 CG TYR A 85 32.845 21.083 16.033 1.00 0.15 C ATOM 1472 CD1 TYR A 85 33.234 21.012 17.374 1.00 0.24 C ATOM 1473 CD2 TYR A 85 33.801 21.021 15.012 1.00 0.14 C ATOM 1474 CE1 TYR A 85 34.588 20.870 17.705 1.00 0.29 C ATOM 1475 CE2 TYR A 85 35.156 20.879 15.341 1.00 0.21 C ATOM 1476 CZ TYR A 85 35.550 20.799 16.686 1.00 0.28 C ATOM 1477 OH TYR A 85 36.886 20.659 17.006 1.00 0.36 O ATOM 0 H TYR A 85 29.991 22.847 14.164 1.00 0.17 H new ATOM 0 HA TYR A 85 30.560 22.642 17.096 1.00 0.17 H new ATOM 0 HB2 TYR A 85 30.806 20.468 16.225 1.00 0.12 H new ATOM 0 HB3 TYR A 85 31.234 21.043 14.626 1.00 0.12 H new ATOM 0 HD1 TYR A 85 32.490 21.067 18.155 1.00 0.24 H new ATOM 0 HD2 TYR A 85 33.496 21.082 13.978 1.00 0.14 H new ATOM 0 HE1 TYR A 85 34.890 20.815 18.740 1.00 0.29 H new ATOM 0 HE2 TYR A 85 35.898 20.831 14.558 1.00 0.21 H new ATOM 0 HH TYR A 85 37.418 20.625 16.183 1.00 0.36 H new ATOM 1487 N ASP A 86 32.511 24.157 17.021 1.00 0.40 N ATOM 1488 CA ASP A 86 33.675 25.084 16.963 1.00 0.46 C ATOM 1489 C ASP A 86 34.833 24.354 16.279 1.00 0.41 C ATOM 1490 O ASP A 86 35.537 23.575 16.892 1.00 0.44 O ATOM 1491 CB ASP A 86 34.085 25.481 18.382 1.00 0.59 C ATOM 1492 CG ASP A 86 34.195 27.005 18.482 1.00 0.40 C ATOM 1493 OD1 ASP A 86 33.986 27.663 17.477 1.00 0.69 O ATOM 1494 OD2 ASP A 86 34.483 27.487 19.565 1.00 0.52 O ATOM 0 H ASP A 86 32.100 24.029 17.946 1.00 0.40 H new ATOM 0 HA ASP A 86 33.414 25.984 16.406 1.00 0.46 H new ATOM 0 HB2 ASP A 86 33.352 25.112 19.099 1.00 0.59 H new ATOM 0 HB3 ASP A 86 35.040 25.021 18.637 1.00 0.59 H new ATOM 1499 N ALA A 87 35.025 24.584 15.011 1.00 0.34 N ATOM 1500 CA ALA A 87 36.125 23.884 14.288 1.00 0.29 C ATOM 1501 C ALA A 87 37.434 24.643 14.455 1.00 0.32 C ATOM 1502 O ALA A 87 37.538 25.792 14.094 1.00 0.31 O ATOM 1503 CB ALA A 87 35.799 23.812 12.796 1.00 0.19 C ATOM 0 H ALA A 87 34.470 25.225 14.444 1.00 0.34 H new ATOM 0 HA ALA A 87 36.224 22.881 14.703 1.00 0.29 H new ATOM 0 HB1 ALA A 87 36.606 23.300 12.272 1.00 0.19 H new ATOM 0 HB2 ALA A 87 34.868 23.264 12.653 1.00 0.19 H new ATOM 0 HB3 ALA A 87 35.691 24.821 12.398 1.00 0.19 H new ATOM 1509 N SER A 88 38.442 23.999 14.970 1.00 0.37 N ATOM 1510 CA SER A 88 39.757 24.678 15.125 1.00 0.44 C ATOM 1511 C SER A 88 40.690 24.158 14.043 1.00 0.46 C ATOM 1512 O SER A 88 41.321 23.130 14.188 1.00 0.56 O ATOM 1513 CB SER A 88 40.354 24.366 16.488 1.00 0.59 C ATOM 1514 OG SER A 88 39.822 25.259 17.456 1.00 1.15 O ATOM 0 H SER A 88 38.412 23.031 15.291 1.00 0.37 H new ATOM 0 HA SER A 88 39.625 25.757 15.038 1.00 0.44 H new ATOM 0 HB2 SER A 88 40.131 23.336 16.767 1.00 0.59 H new ATOM 0 HB3 SER A 88 41.439 24.458 16.451 1.00 0.59 H new ATOM 0 HG SER A 88 38.843 25.252 17.405 1.00 1.15 H new ATOM 1520 N PHE A 89 40.757 24.843 12.947 1.00 0.41 N ATOM 1521 CA PHE A 89 41.623 24.372 11.832 1.00 0.50 C ATOM 1522 C PHE A 89 42.361 25.538 11.179 1.00 0.55 C ATOM 1523 O PHE A 89 41.829 26.621 11.029 1.00 0.54 O ATOM 1524 CB PHE A 89 40.739 23.738 10.772 1.00 0.46 C ATOM 1525 CG PHE A 89 39.978 24.840 10.085 1.00 0.44 C ATOM 1526 CD1 PHE A 89 40.535 25.494 8.977 1.00 0.39 C ATOM 1527 CD2 PHE A 89 38.718 25.214 10.562 1.00 0.51 C ATOM 1528 CE1 PHE A 89 39.825 26.522 8.346 1.00 0.41 C ATOM 1529 CE2 PHE A 89 38.009 26.240 9.930 1.00 0.49 C ATOM 1530 CZ PHE A 89 38.561 26.893 8.821 1.00 0.43 C ATOM 0 H PHE A 89 40.251 25.711 12.769 1.00 0.41 H new ATOM 0 HA PHE A 89 42.349 23.665 12.234 1.00 0.50 H new ATOM 0 HB2 PHE A 89 41.343 23.185 10.052 1.00 0.46 H new ATOM 0 HB3 PHE A 89 40.051 23.025 11.226 1.00 0.46 H new ATOM 0 HD1 PHE A 89 41.509 25.205 8.611 1.00 0.39 H new ATOM 0 HD2 PHE A 89 38.293 24.711 11.418 1.00 0.51 H new ATOM 0 HE1 PHE A 89 40.252 27.029 7.493 1.00 0.41 H new ATOM 0 HE2 PHE A 89 37.035 26.529 10.297 1.00 0.49 H new ATOM 0 HZ PHE A 89 38.011 27.683 8.332 1.00 0.43 H new ATOM 1540 N GLU A 90 43.570 25.308 10.748 1.00 0.61 N ATOM 1541 CA GLU A 90 44.326 26.385 10.056 1.00 0.68 C ATOM 1542 C GLU A 90 44.049 26.291 8.571 1.00 0.78 C ATOM 1543 O GLU A 90 43.457 25.348 8.093 1.00 1.57 O ATOM 1544 CB GLU A 90 45.820 26.241 10.292 1.00 0.50 C ATOM 1545 CG GLU A 90 46.110 26.486 11.769 1.00 0.64 C ATOM 1546 CD GLU A 90 47.043 25.399 12.302 1.00 0.55 C ATOM 1547 OE1 GLU A 90 47.588 24.665 11.495 1.00 1.64 O ATOM 1548 OE2 GLU A 90 47.197 25.318 13.510 1.00 1.65 O ATOM 0 H GLU A 90 44.065 24.422 10.846 1.00 0.61 H new ATOM 0 HA GLU A 90 44.007 27.350 10.450 1.00 0.68 H new ATOM 0 HB2 GLU A 90 46.154 25.245 10.002 1.00 0.50 H new ATOM 0 HB3 GLU A 90 46.370 26.953 9.676 1.00 0.50 H new ATOM 0 HG2 GLU A 90 46.567 27.467 11.901 1.00 0.64 H new ATOM 0 HG3 GLU A 90 45.179 26.489 12.336 1.00 0.64 H new ATOM 1555 N THR A 91 44.453 27.268 7.838 1.00 0.77 N ATOM 1556 CA THR A 91 44.178 27.242 6.390 1.00 0.66 C ATOM 1557 C THR A 91 45.281 28.017 5.662 1.00 0.61 C ATOM 1558 O THR A 91 46.229 28.456 6.282 1.00 0.59 O ATOM 1559 CB THR A 91 42.835 27.959 6.176 1.00 0.78 C ATOM 1560 OG1 THR A 91 42.793 28.581 4.901 1.00 0.77 O ATOM 1561 CG2 THR A 91 42.671 29.028 7.250 1.00 0.80 C ATOM 0 H THR A 91 44.962 28.085 8.175 1.00 0.77 H new ATOM 0 HA THR A 91 44.144 26.221 6.010 1.00 0.66 H new ATOM 0 HB THR A 91 42.032 27.225 6.235 1.00 0.78 H new ATOM 0 HG1 THR A 91 41.898 28.476 4.515 1.00 0.77 H new ATOM 0 HG21 THR A 91 41.721 29.544 7.108 1.00 0.80 H new ATOM 0 HG22 THR A 91 42.686 28.560 8.234 1.00 0.80 H new ATOM 0 HG23 THR A 91 43.488 29.746 7.177 1.00 0.80 H new ATOM 1569 N LYS A 92 45.168 28.270 4.377 1.00 0.61 N ATOM 1570 CA LYS A 92 46.210 29.113 3.772 1.00 0.59 C ATOM 1571 C LYS A 92 46.175 30.396 4.601 1.00 0.57 C ATOM 1572 O LYS A 92 47.143 31.122 4.712 1.00 0.53 O ATOM 1573 CB LYS A 92 45.876 29.422 2.308 1.00 0.59 C ATOM 1574 CG LYS A 92 45.457 28.139 1.590 1.00 0.78 C ATOM 1575 CD LYS A 92 46.622 27.614 0.752 1.00 0.75 C ATOM 1576 CE LYS A 92 46.515 26.093 0.628 1.00 1.47 C ATOM 1577 NZ LYS A 92 47.305 25.637 -0.549 1.00 2.27 N ATOM 0 H LYS A 92 44.429 27.939 3.757 1.00 0.61 H new ATOM 0 HA LYS A 92 47.188 28.631 3.773 1.00 0.59 H new ATOM 0 HB2 LYS A 92 45.073 30.157 2.256 1.00 0.59 H new ATOM 0 HB3 LYS A 92 46.742 29.860 1.813 1.00 0.59 H new ATOM 0 HG2 LYS A 92 45.152 27.387 2.317 1.00 0.78 H new ATOM 0 HG3 LYS A 92 44.595 28.333 0.951 1.00 0.78 H new ATOM 0 HD2 LYS A 92 46.608 28.072 -0.237 1.00 0.75 H new ATOM 0 HD3 LYS A 92 47.570 27.886 1.216 1.00 0.75 H new ATOM 0 HE2 LYS A 92 46.885 25.616 1.535 1.00 1.47 H new ATOM 0 HE3 LYS A 92 45.472 25.799 0.516 1.00 1.47 H new ATOM 0 HZ1 LYS A 92 47.234 24.603 -0.635 1.00 2.27 H new ATOM 0 HZ2 LYS A 92 46.932 26.083 -1.411 1.00 2.27 H new ATOM 0 HZ3 LYS A 92 48.302 25.906 -0.423 1.00 2.27 H new ATOM 1591 N GLU A 93 45.035 30.643 5.221 1.00 0.63 N ATOM 1592 CA GLU A 93 44.874 31.832 6.091 1.00 0.62 C ATOM 1593 C GLU A 93 45.523 31.544 7.443 1.00 0.64 C ATOM 1594 O GLU A 93 46.027 32.438 8.088 1.00 0.68 O ATOM 1595 CB GLU A 93 43.384 32.130 6.299 1.00 0.59 C ATOM 1596 CG GLU A 93 42.569 31.558 5.135 1.00 0.58 C ATOM 1597 CD GLU A 93 41.349 32.444 4.886 1.00 0.46 C ATOM 1598 OE1 GLU A 93 41.495 33.653 4.955 1.00 1.01 O ATOM 1599 OE2 GLU A 93 40.288 31.898 4.630 1.00 1.49 O ATOM 0 H GLU A 93 44.206 30.053 5.150 1.00 0.63 H new ATOM 0 HA GLU A 93 45.348 32.694 5.621 1.00 0.62 H new ATOM 0 HB2 GLU A 93 43.045 31.695 7.239 1.00 0.59 H new ATOM 0 HB3 GLU A 93 43.226 33.206 6.370 1.00 0.59 H new ATOM 0 HG2 GLU A 93 43.184 31.506 4.237 1.00 0.58 H new ATOM 0 HG3 GLU A 93 42.253 30.540 5.364 1.00 0.58 H new ATOM 1606 N SER A 94 45.490 30.288 7.850 1.00 0.59 N ATOM 1607 CA SER A 94 46.070 29.831 9.142 1.00 0.59 C ATOM 1608 C SER A 94 44.940 29.485 10.095 1.00 0.67 C ATOM 1609 O SER A 94 43.781 29.515 9.742 1.00 0.77 O ATOM 1610 CB SER A 94 46.882 30.920 9.782 1.00 0.51 C ATOM 1611 OG SER A 94 47.912 31.337 8.894 1.00 0.40 O ATOM 0 H SER A 94 45.063 29.538 7.306 1.00 0.59 H new ATOM 0 HA SER A 94 46.706 28.969 8.943 1.00 0.59 H new ATOM 0 HB2 SER A 94 46.241 31.765 10.033 1.00 0.51 H new ATOM 0 HB3 SER A 94 47.317 30.562 10.715 1.00 0.51 H new ATOM 0 HG SER A 94 47.652 32.177 8.463 1.00 0.40 H new ATOM 1617 N ARG A 95 45.262 29.198 11.316 1.00 0.65 N ATOM 1618 CA ARG A 95 44.218 28.900 12.285 1.00 0.81 C ATOM 1619 C ARG A 95 43.278 30.080 12.294 1.00 0.79 C ATOM 1620 O ARG A 95 43.673 31.220 12.161 1.00 1.41 O ATOM 1621 CB ARG A 95 44.845 28.680 13.652 1.00 0.85 C ATOM 1622 CG ARG A 95 45.250 30.012 14.271 1.00 2.22 C ATOM 1623 CD ARG A 95 45.129 29.871 15.771 1.00 3.09 C ATOM 1624 NE ARG A 95 45.586 31.122 16.438 1.00 4.94 N ATOM 1625 CZ ARG A 95 46.753 31.164 17.019 1.00 5.04 C ATOM 1626 NH1 ARG A 95 47.001 30.394 18.042 1.00 5.01 N ATOM 1627 NH2 ARG A 95 47.670 31.980 16.579 1.00 5.19 N ATOM 0 H ARG A 95 46.216 29.160 11.676 1.00 0.65 H new ATOM 0 HA ARG A 95 43.672 27.993 12.027 1.00 0.81 H new ATOM 0 HB2 ARG A 95 44.138 28.168 14.305 1.00 0.85 H new ATOM 0 HB3 ARG A 95 45.718 28.034 13.559 1.00 0.85 H new ATOM 0 HG2 ARG A 95 46.271 30.270 13.991 1.00 2.22 H new ATOM 0 HG3 ARG A 95 44.608 30.815 13.908 1.00 2.22 H new ATOM 0 HD2 ARG A 95 44.094 29.661 16.043 1.00 3.09 H new ATOM 0 HD3 ARG A 95 45.726 29.027 16.115 1.00 3.09 H new ATOM 0 HE ARG A 95 44.986 31.947 16.440 1.00 4.94 H new ATOM 0 HH11 ARG A 95 46.282 29.758 18.388 1.00 5.01 H new ATOM 0 HH12 ARG A 95 47.914 30.427 18.496 1.00 5.01 H new ATOM 0 HH21 ARG A 95 47.474 32.585 15.781 1.00 5.19 H new ATOM 0 HH22 ARG A 95 48.583 32.014 17.033 1.00 5.19 H new ATOM 1641 N LYS A 96 42.051 29.792 12.417 1.00 0.41 N ATOM 1642 CA LYS A 96 41.010 30.861 12.408 1.00 0.57 C ATOM 1643 C LYS A 96 39.672 30.262 12.824 1.00 0.84 C ATOM 1644 O LYS A 96 38.630 30.758 12.457 1.00 2.14 O ATOM 1645 CB LYS A 96 40.875 31.417 10.990 1.00 0.49 C ATOM 1646 CG LYS A 96 42.010 32.400 10.689 1.00 0.88 C ATOM 1647 CD LYS A 96 41.509 33.492 9.739 1.00 1.08 C ATOM 1648 CE LYS A 96 42.687 34.067 8.952 1.00 1.55 C ATOM 1649 NZ LYS A 96 43.063 35.397 9.512 1.00 2.46 N ATOM 0 H LYS A 96 41.690 28.844 12.528 1.00 0.41 H new ATOM 0 HA LYS A 96 41.296 31.655 13.098 1.00 0.57 H new ATOM 0 HB2 LYS A 96 40.893 30.600 10.269 1.00 0.49 H new ATOM 0 HB3 LYS A 96 39.913 31.918 10.879 1.00 0.49 H new ATOM 0 HG2 LYS A 96 42.371 32.848 11.615 1.00 0.88 H new ATOM 0 HG3 LYS A 96 42.852 31.872 10.240 1.00 0.88 H new ATOM 0 HD2 LYS A 96 40.767 33.080 9.054 1.00 1.08 H new ATOM 0 HD3 LYS A 96 41.016 34.282 10.305 1.00 1.08 H new ATOM 0 HE2 LYS A 96 43.537 33.387 9.002 1.00 1.55 H new ATOM 0 HE3 LYS A 96 42.420 34.167 7.900 1.00 1.55 H new ATOM 0 HZ1 LYS A 96 43.864 35.786 8.975 1.00 2.46 H new ATOM 0 HZ2 LYS A 96 42.252 36.045 9.442 1.00 2.46 H new ATOM 0 HZ3 LYS A 96 43.335 35.289 10.510 1.00 2.46 H new ATOM 1663 N GLU A 97 39.724 29.190 13.566 1.00 0.55 N ATOM 1664 CA GLU A 97 38.514 28.471 14.036 1.00 0.41 C ATOM 1665 C GLU A 97 37.249 28.874 13.296 1.00 0.32 C ATOM 1666 O GLU A 97 36.739 29.969 13.432 1.00 0.33 O ATOM 1667 CB GLU A 97 38.306 28.701 15.514 1.00 0.49 C ATOM 1668 CG GLU A 97 37.678 27.443 16.080 1.00 0.46 C ATOM 1669 CD GLU A 97 37.416 27.619 17.576 1.00 0.49 C ATOM 1670 OE1 GLU A 97 36.696 28.537 17.928 1.00 0.42 O ATOM 1671 OE2 GLU A 97 37.942 26.831 18.344 1.00 0.63 O ATOM 0 H GLU A 97 40.599 28.768 13.877 1.00 0.55 H new ATOM 0 HA GLU A 97 38.695 27.416 13.831 1.00 0.41 H new ATOM 0 HB2 GLU A 97 39.255 28.913 16.007 1.00 0.49 H new ATOM 0 HB3 GLU A 97 37.660 29.563 15.682 1.00 0.49 H new ATOM 0 HG2 GLU A 97 36.744 27.228 15.561 1.00 0.46 H new ATOM 0 HG3 GLU A 97 38.338 26.591 15.915 1.00 0.46 H new ATOM 1678 N GLU A 98 36.722 27.965 12.545 1.00 0.21 N ATOM 1679 CA GLU A 98 35.468 28.246 11.812 1.00 0.10 C ATOM 1680 C GLU A 98 34.542 27.039 11.930 1.00 0.11 C ATOM 1681 O GLU A 98 34.672 26.046 11.239 1.00 0.08 O ATOM 1682 CB GLU A 98 35.782 28.575 10.351 1.00 0.09 C ATOM 1683 CG GLU A 98 34.973 27.687 9.400 1.00 0.07 C ATOM 1684 CD GLU A 98 35.015 28.282 7.989 1.00 0.16 C ATOM 1685 OE1 GLU A 98 34.173 29.113 7.693 1.00 1.56 O ATOM 1686 OE2 GLU A 98 35.889 27.898 7.231 1.00 1.59 O ATOM 0 H GLU A 98 37.107 27.031 12.404 1.00 0.21 H new ATOM 0 HA GLU A 98 34.964 29.111 12.243 1.00 0.10 H new ATOM 0 HB2 GLU A 98 35.557 29.623 10.155 1.00 0.09 H new ATOM 0 HB3 GLU A 98 36.847 28.437 10.165 1.00 0.09 H new ATOM 0 HG2 GLU A 98 35.381 26.676 9.393 1.00 0.07 H new ATOM 0 HG3 GLU A 98 33.942 27.612 9.744 1.00 0.07 H new ATOM 1693 N LEU A 99 33.614 27.124 12.828 1.00 0.17 N ATOM 1694 CA LEU A 99 32.657 26.000 13.031 1.00 0.24 C ATOM 1695 C LEU A 99 32.057 25.620 11.696 1.00 0.17 C ATOM 1696 O LEU A 99 32.292 26.264 10.692 1.00 0.19 O ATOM 1697 CB LEU A 99 31.564 26.428 14.010 1.00 0.52 C ATOM 1698 CG LEU A 99 30.314 26.944 13.278 1.00 1.04 C ATOM 1699 CD1 LEU A 99 29.461 27.679 14.298 1.00 2.22 C ATOM 1700 CD2 LEU A 99 30.691 27.916 12.156 1.00 2.01 C ATOM 0 H LEU A 99 33.471 27.928 13.439 1.00 0.17 H new ATOM 0 HA LEU A 99 33.175 25.137 13.448 1.00 0.24 H new ATOM 0 HB2 LEU A 99 31.292 25.584 14.643 1.00 0.52 H new ATOM 0 HB3 LEU A 99 31.949 27.208 14.667 1.00 0.52 H new ATOM 0 HG LEU A 99 29.780 26.104 12.833 1.00 1.04 H new ATOM 0 HD11 LEU A 99 28.562 28.061 13.813 1.00 2.22 H new ATOM 0 HD12 LEU A 99 29.179 26.994 15.098 1.00 2.22 H new ATOM 0 HD13 LEU A 99 30.029 28.510 14.716 1.00 2.22 H new ATOM 0 HD21 LEU A 99 29.787 28.264 11.657 1.00 2.01 H new ATOM 0 HD22 LEU A 99 31.224 28.769 12.577 1.00 2.01 H new ATOM 0 HD23 LEU A 99 31.331 27.408 11.435 1.00 2.01 H new ATOM 1712 N MET A 100 31.324 24.559 11.655 1.00 0.20 N ATOM 1713 CA MET A 100 30.769 24.131 10.363 1.00 0.19 C ATOM 1714 C MET A 100 29.399 23.503 10.522 1.00 0.23 C ATOM 1715 O MET A 100 29.175 22.637 11.344 1.00 0.24 O ATOM 1716 CB MET A 100 31.743 23.148 9.790 1.00 0.12 C ATOM 1717 CG MET A 100 33.114 23.829 9.789 1.00 0.09 C ATOM 1718 SD MET A 100 34.329 22.772 8.972 1.00 0.08 S ATOM 1719 CE MET A 100 33.271 21.326 8.918 1.00 0.11 C ATOM 0 H MET A 100 31.087 23.973 12.456 1.00 0.20 H new ATOM 0 HA MET A 100 30.633 24.987 9.702 1.00 0.19 H new ATOM 0 HB2 MET A 100 31.766 22.235 10.385 1.00 0.12 H new ATOM 0 HB3 MET A 100 31.453 22.862 8.779 1.00 0.12 H new ATOM 0 HG2 MET A 100 33.052 24.789 9.276 1.00 0.09 H new ATOM 0 HG3 MET A 100 33.428 24.034 10.812 1.00 0.09 H new ATOM 0 HE1 MET A 100 33.739 20.555 8.305 1.00 0.11 H new ATOM 0 HE2 MET A 100 33.123 20.946 9.929 1.00 0.11 H new ATOM 0 HE3 MET A 100 32.307 21.596 8.487 1.00 0.11 H new ATOM 1729 N PHE A 101 28.485 23.947 9.719 1.00 0.25 N ATOM 1730 CA PHE A 101 27.113 23.409 9.772 1.00 0.29 C ATOM 1731 C PHE A 101 27.169 21.898 9.643 1.00 0.31 C ATOM 1732 O PHE A 101 27.764 21.382 8.721 1.00 0.26 O ATOM 1733 CB PHE A 101 26.324 23.937 8.586 1.00 0.28 C ATOM 1734 CG PHE A 101 24.846 23.991 8.886 1.00 0.26 C ATOM 1735 CD1 PHE A 101 24.369 23.764 10.177 1.00 0.29 C ATOM 1736 CD2 PHE A 101 23.946 24.269 7.851 1.00 0.28 C ATOM 1737 CE1 PHE A 101 22.997 23.814 10.434 1.00 0.34 C ATOM 1738 CE2 PHE A 101 22.573 24.323 8.110 1.00 0.28 C ATOM 1739 CZ PHE A 101 22.098 24.093 9.401 1.00 0.32 C ATOM 0 H PHE A 101 28.635 24.672 9.017 1.00 0.25 H new ATOM 0 HA PHE A 101 26.646 23.704 10.712 1.00 0.29 H new ATOM 0 HB2 PHE A 101 26.680 24.934 8.325 1.00 0.28 H new ATOM 0 HB3 PHE A 101 26.497 23.299 7.719 1.00 0.28 H new ATOM 0 HD1 PHE A 101 25.061 23.550 10.978 1.00 0.29 H new ATOM 0 HD2 PHE A 101 24.313 24.442 6.850 1.00 0.28 H new ATOM 0 HE1 PHE A 101 22.630 23.637 11.434 1.00 0.34 H new ATOM 0 HE2 PHE A 101 21.881 24.543 7.311 1.00 0.28 H new ATOM 0 HZ PHE A 101 21.038 24.130 9.602 1.00 0.32 H new ATOM 1749 N PHE A 102 26.549 21.170 10.517 1.00 0.45 N ATOM 1750 CA PHE A 102 26.594 19.705 10.343 1.00 0.46 C ATOM 1751 C PHE A 102 25.194 19.186 10.084 1.00 0.43 C ATOM 1752 O PHE A 102 24.384 19.081 10.976 1.00 0.41 O ATOM 1753 CB PHE A 102 27.199 19.036 11.569 1.00 0.46 C ATOM 1754 CG PHE A 102 28.643 18.758 11.252 1.00 0.46 C ATOM 1755 CD1 PHE A 102 28.971 17.775 10.305 1.00 0.44 C ATOM 1756 CD2 PHE A 102 29.649 19.509 11.866 1.00 0.48 C ATOM 1757 CE1 PHE A 102 30.318 17.545 9.982 1.00 0.43 C ATOM 1758 CE2 PHE A 102 30.990 19.285 11.540 1.00 0.47 C ATOM 1759 CZ PHE A 102 31.325 18.302 10.597 1.00 0.45 C ATOM 0 H PHE A 102 26.027 21.514 11.323 1.00 0.45 H new ATOM 0 HA PHE A 102 27.227 19.466 9.488 1.00 0.46 H new ATOM 0 HB2 PHE A 102 27.114 19.683 12.442 1.00 0.46 H new ATOM 0 HB3 PHE A 102 26.671 18.112 11.804 1.00 0.46 H new ATOM 0 HD1 PHE A 102 28.192 17.199 9.828 1.00 0.44 H new ATOM 0 HD2 PHE A 102 29.390 20.264 12.594 1.00 0.48 H new ATOM 0 HE1 PHE A 102 30.578 16.785 9.260 1.00 0.43 H new ATOM 0 HE2 PHE A 102 31.766 19.868 12.013 1.00 0.47 H new ATOM 0 HZ PHE A 102 32.361 18.128 10.344 1.00 0.45 H new ATOM 1769 N LEU A 103 24.915 18.847 8.859 1.00 0.44 N ATOM 1770 CA LEU A 103 23.581 18.310 8.511 1.00 0.41 C ATOM 1771 C LEU A 103 23.589 16.824 8.811 1.00 0.34 C ATOM 1772 O LEU A 103 23.168 16.010 8.013 1.00 0.35 O ATOM 1773 CB LEU A 103 23.322 18.534 7.031 1.00 0.48 C ATOM 1774 CG LEU A 103 23.574 20.004 6.670 1.00 0.58 C ATOM 1775 CD1 LEU A 103 23.490 20.886 7.919 1.00 0.48 C ATOM 1776 CD2 LEU A 103 24.964 20.150 6.054 1.00 0.95 C ATOM 0 H LEU A 103 25.565 18.922 8.077 1.00 0.44 H new ATOM 0 HA LEU A 103 22.800 18.808 9.085 1.00 0.41 H new ATOM 0 HB2 LEU A 103 23.971 17.889 6.438 1.00 0.48 H new ATOM 0 HB3 LEU A 103 22.295 18.262 6.788 1.00 0.48 H new ATOM 0 HG LEU A 103 22.813 20.320 5.957 1.00 0.58 H new ATOM 0 HD11 LEU A 103 23.671 21.925 7.644 1.00 0.48 H new ATOM 0 HD12 LEU A 103 22.498 20.796 8.362 1.00 0.48 H new ATOM 0 HD13 LEU A 103 24.241 20.566 8.642 1.00 0.48 H new ATOM 0 HD21 LEU A 103 25.141 21.195 5.798 1.00 0.95 H new ATOM 0 HD22 LEU A 103 25.716 19.819 6.770 1.00 0.95 H new ATOM 0 HD23 LEU A 103 25.029 19.540 5.153 1.00 0.95 H new ATOM 1788 N TRP A 104 24.091 16.485 9.960 1.00 0.30 N ATOM 1789 CA TRP A 104 24.180 15.073 10.376 1.00 0.26 C ATOM 1790 C TRP A 104 22.937 14.324 9.902 1.00 0.19 C ATOM 1791 O TRP A 104 21.941 14.283 10.586 1.00 0.13 O ATOM 1792 CB TRP A 104 24.269 14.994 11.906 1.00 0.26 C ATOM 1793 CG TRP A 104 24.465 13.570 12.301 1.00 0.22 C ATOM 1794 CD1 TRP A 104 23.978 12.981 13.426 1.00 0.23 C ATOM 1795 CD2 TRP A 104 25.199 12.540 11.576 1.00 0.20 C ATOM 1796 NE1 TRP A 104 24.367 11.649 13.424 1.00 0.22 N ATOM 1797 CE2 TRP A 104 25.129 11.332 12.299 1.00 0.20 C ATOM 1798 CE3 TRP A 104 25.914 12.538 10.364 1.00 0.21 C ATOM 1799 CZ2 TRP A 104 25.761 10.172 11.817 1.00 0.19 C ATOM 1800 CZ3 TRP A 104 26.522 11.396 9.895 1.00 0.20 C ATOM 1801 CH2 TRP A 104 26.449 10.211 10.613 1.00 0.19 C ATOM 0 H TRP A 104 24.452 17.150 10.644 1.00 0.30 H new ATOM 0 HA TRP A 104 25.069 14.621 9.936 1.00 0.26 H new ATOM 0 HB2 TRP A 104 25.097 15.604 12.268 1.00 0.26 H new ATOM 0 HB3 TRP A 104 23.360 15.390 12.358 1.00 0.26 H new ATOM 0 HD1 TRP A 104 23.389 13.467 14.190 1.00 0.23 H new ATOM 0 HE1 TRP A 104 24.125 10.982 14.157 1.00 0.22 H new ATOM 0 HE3 TRP A 104 25.987 13.450 9.791 1.00 0.21 H new ATOM 0 HZ2 TRP A 104 25.711 9.253 12.383 1.00 0.19 H new ATOM 0 HZ3 TRP A 104 27.061 11.422 8.959 1.00 0.20 H new ATOM 0 HH2 TRP A 104 26.927 9.320 10.235 1.00 0.19 H new ATOM 1812 N ALA A 105 22.983 13.736 8.740 1.00 0.27 N ATOM 1813 CA ALA A 105 21.787 12.998 8.232 1.00 0.27 C ATOM 1814 C ALA A 105 22.217 11.595 7.830 1.00 0.31 C ATOM 1815 O ALA A 105 22.795 11.417 6.788 1.00 0.34 O ATOM 1816 CB ALA A 105 21.211 13.730 7.009 1.00 0.31 C ATOM 0 H ALA A 105 23.793 13.733 8.120 1.00 0.27 H new ATOM 0 HA ALA A 105 21.023 12.946 9.008 1.00 0.27 H new ATOM 0 HB1 ALA A 105 20.339 13.191 6.640 1.00 0.31 H new ATOM 0 HB2 ALA A 105 20.919 14.741 7.294 1.00 0.31 H new ATOM 0 HB3 ALA A 105 21.967 13.779 6.225 1.00 0.31 H new ATOM 1822 N PRO A 106 21.937 10.639 8.674 1.00 0.32 N ATOM 1823 CA PRO A 106 22.324 9.243 8.428 1.00 0.36 C ATOM 1824 C PRO A 106 21.431 8.614 7.362 1.00 0.32 C ATOM 1825 O PRO A 106 20.266 8.941 7.236 1.00 0.34 O ATOM 1826 CB PRO A 106 22.139 8.574 9.788 1.00 0.42 C ATOM 1827 CG PRO A 106 21.145 9.453 10.578 1.00 0.36 C ATOM 1828 CD PRO A 106 21.193 10.849 9.933 1.00 0.30 C ATOM 0 HA PRO A 106 23.341 9.138 8.051 1.00 0.36 H new ATOM 0 HB2 PRO A 106 21.754 7.561 9.673 1.00 0.42 H new ATOM 0 HB3 PRO A 106 23.090 8.495 10.314 1.00 0.42 H new ATOM 0 HG2 PRO A 106 20.138 9.038 10.532 1.00 0.36 H new ATOM 0 HG3 PRO A 106 21.422 9.502 11.631 1.00 0.36 H new ATOM 0 HD2 PRO A 106 20.191 11.236 9.744 1.00 0.30 H new ATOM 0 HD3 PRO A 106 21.696 11.569 10.578 1.00 0.30 H new ATOM 1836 N GLU A 107 21.976 7.724 6.582 1.00 0.29 N ATOM 1837 CA GLU A 107 21.174 7.080 5.508 1.00 0.29 C ATOM 1838 C GLU A 107 20.055 6.222 6.116 1.00 0.27 C ATOM 1839 O GLU A 107 19.220 5.698 5.404 1.00 0.30 O ATOM 1840 CB GLU A 107 22.086 6.187 4.659 1.00 0.33 C ATOM 1841 CG GLU A 107 22.533 6.947 3.409 1.00 0.32 C ATOM 1842 CD GLU A 107 22.871 5.949 2.300 1.00 0.78 C ATOM 1843 OE1 GLU A 107 21.973 5.240 1.875 1.00 1.64 O ATOM 1844 OE2 GLU A 107 24.020 5.910 1.896 1.00 1.16 O ATOM 0 H GLU A 107 22.946 7.414 6.643 1.00 0.29 H new ATOM 0 HA GLU A 107 20.729 7.858 4.888 1.00 0.29 H new ATOM 0 HB2 GLU A 107 22.956 5.881 5.241 1.00 0.33 H new ATOM 0 HB3 GLU A 107 21.557 5.277 4.374 1.00 0.33 H new ATOM 0 HG2 GLU A 107 21.743 7.621 3.078 1.00 0.32 H new ATOM 0 HG3 GLU A 107 23.403 7.563 3.636 1.00 0.32 H new ATOM 1851 N LEU A 108 20.032 6.053 7.415 1.00 0.24 N ATOM 1852 CA LEU A 108 18.964 5.206 8.032 1.00 0.26 C ATOM 1853 C LEU A 108 18.194 5.962 9.123 1.00 0.48 C ATOM 1854 O LEU A 108 17.444 5.379 9.881 1.00 1.05 O ATOM 1855 CB LEU A 108 19.595 3.926 8.588 1.00 0.42 C ATOM 1856 CG LEU A 108 20.285 4.169 9.933 1.00 1.01 C ATOM 1857 CD1 LEU A 108 20.929 5.541 9.995 1.00 3.41 C ATOM 1858 CD2 LEU A 108 19.263 4.039 11.055 1.00 1.32 C ATOM 0 H LEU A 108 20.700 6.460 8.070 1.00 0.24 H new ATOM 0 HA LEU A 108 18.238 4.946 7.262 1.00 0.26 H new ATOM 0 HB2 LEU A 108 18.825 3.164 8.707 1.00 0.42 H new ATOM 0 HB3 LEU A 108 20.320 3.538 7.873 1.00 0.42 H new ATOM 0 HG LEU A 108 21.072 3.423 10.047 1.00 1.01 H new ATOM 0 HD11 LEU A 108 21.408 5.675 10.965 1.00 3.41 H new ATOM 0 HD12 LEU A 108 21.676 5.628 9.206 1.00 3.41 H new ATOM 0 HD13 LEU A 108 20.166 6.308 9.858 1.00 3.41 H new ATOM 0 HD21 LEU A 108 19.752 4.212 12.014 1.00 1.32 H new ATOM 0 HD22 LEU A 108 18.472 4.775 10.913 1.00 1.32 H new ATOM 0 HD23 LEU A 108 18.833 3.037 11.042 1.00 1.32 H new ATOM 1870 N ALA A 109 18.363 7.257 9.201 1.00 0.34 N ATOM 1871 CA ALA A 109 17.634 8.047 10.232 1.00 0.52 C ATOM 1872 C ALA A 109 16.132 7.730 10.132 1.00 0.78 C ATOM 1873 O ALA A 109 15.747 6.838 9.402 1.00 1.12 O ATOM 1874 CB ALA A 109 17.915 9.532 9.988 1.00 0.38 C ATOM 0 H ALA A 109 18.976 7.800 8.593 1.00 0.34 H new ATOM 0 HA ALA A 109 17.967 7.791 11.238 1.00 0.52 H new ATOM 0 HB1 ALA A 109 17.390 10.129 10.733 1.00 0.38 H new ATOM 0 HB2 ALA A 109 18.986 9.717 10.065 1.00 0.38 H new ATOM 0 HB3 ALA A 109 17.569 9.809 8.992 1.00 0.38 H new ATOM 1880 N PRO A 110 15.316 8.438 10.874 1.00 0.90 N ATOM 1881 CA PRO A 110 13.864 8.191 10.877 1.00 1.23 C ATOM 1882 C PRO A 110 13.190 8.638 9.573 1.00 1.13 C ATOM 1883 O PRO A 110 11.994 8.495 9.421 1.00 2.60 O ATOM 1884 CB PRO A 110 13.361 8.978 12.092 1.00 1.36 C ATOM 1885 CG PRO A 110 14.438 10.037 12.410 1.00 1.16 C ATOM 1886 CD PRO A 110 15.746 9.548 11.760 1.00 1.02 C ATOM 0 HA PRO A 110 13.626 7.129 10.941 1.00 1.23 H new ATOM 0 HB2 PRO A 110 12.403 9.452 11.877 1.00 1.36 H new ATOM 0 HB3 PRO A 110 13.205 8.317 12.944 1.00 1.36 H new ATOM 0 HG2 PRO A 110 14.151 11.012 12.015 1.00 1.16 H new ATOM 0 HG3 PRO A 110 14.561 10.153 13.487 1.00 1.16 H new ATOM 0 HD2 PRO A 110 16.232 10.343 11.195 1.00 1.02 H new ATOM 0 HD3 PRO A 110 16.460 9.206 12.509 1.00 1.02 H new ATOM 1894 N LEU A 111 13.942 9.145 8.624 1.00 1.74 N ATOM 1895 CA LEU A 111 13.328 9.571 7.322 1.00 1.31 C ATOM 1896 C LEU A 111 12.685 10.940 7.468 1.00 0.91 C ATOM 1897 O LEU A 111 12.918 11.819 6.673 1.00 0.94 O ATOM 1898 CB LEU A 111 12.272 8.551 6.898 1.00 1.82 C ATOM 1899 CG LEU A 111 12.202 8.494 5.375 1.00 0.93 C ATOM 1900 CD1 LEU A 111 13.410 7.725 4.838 1.00 2.49 C ATOM 1901 CD2 LEU A 111 10.917 7.781 4.957 1.00 1.72 C ATOM 0 H LEU A 111 14.950 9.282 8.693 1.00 1.74 H new ATOM 0 HA LEU A 111 14.108 9.627 6.563 1.00 1.31 H new ATOM 0 HB2 LEU A 111 12.519 7.568 7.298 1.00 1.82 H new ATOM 0 HB3 LEU A 111 11.300 8.826 7.307 1.00 1.82 H new ATOM 0 HG LEU A 111 12.208 9.506 4.970 1.00 0.93 H new ATOM 0 HD11 LEU A 111 13.361 7.684 3.750 1.00 2.49 H new ATOM 0 HD12 LEU A 111 14.327 8.230 5.141 1.00 2.49 H new ATOM 0 HD13 LEU A 111 13.404 6.712 5.240 1.00 2.49 H new ATOM 0 HD21 LEU A 111 10.862 7.738 3.869 1.00 1.72 H new ATOM 0 HD22 LEU A 111 10.915 6.769 5.361 1.00 1.72 H new ATOM 0 HD23 LEU A 111 10.056 8.327 5.342 1.00 1.72 H new ATOM 1913 N LYS A 112 11.887 11.141 8.468 1.00 0.59 N ATOM 1914 CA LYS A 112 11.256 12.468 8.641 1.00 0.24 C ATOM 1915 C LYS A 112 12.332 13.537 8.530 1.00 0.31 C ATOM 1916 O LYS A 112 12.100 14.616 8.039 1.00 0.45 O ATOM 1917 CB LYS A 112 10.619 12.550 10.028 1.00 0.49 C ATOM 1918 CG LYS A 112 11.540 11.893 11.066 1.00 0.97 C ATOM 1919 CD LYS A 112 12.082 12.959 12.023 1.00 1.38 C ATOM 1920 CE LYS A 112 13.492 13.369 11.589 1.00 1.26 C ATOM 1921 NZ LYS A 112 14.309 13.700 12.792 1.00 1.64 N ATOM 0 H LYS A 112 11.644 10.445 9.173 1.00 0.59 H new ATOM 0 HA LYS A 112 10.493 12.617 7.877 1.00 0.24 H new ATOM 0 HB2 LYS A 112 10.441 13.592 10.295 1.00 0.49 H new ATOM 0 HB3 LYS A 112 9.649 12.052 10.022 1.00 0.49 H new ATOM 0 HG2 LYS A 112 10.992 11.134 11.624 1.00 0.97 H new ATOM 0 HG3 LYS A 112 12.365 11.386 10.565 1.00 0.97 H new ATOM 0 HD2 LYS A 112 11.424 13.828 12.026 1.00 1.38 H new ATOM 0 HD3 LYS A 112 12.102 12.571 13.042 1.00 1.38 H new ATOM 0 HE2 LYS A 112 13.961 12.560 11.030 1.00 1.26 H new ATOM 0 HE3 LYS A 112 13.442 14.230 10.922 1.00 1.26 H new ATOM 0 HZ1 LYS A 112 15.316 13.548 12.580 1.00 1.64 H new ATOM 0 HZ2 LYS A 112 14.156 14.695 13.052 1.00 1.64 H new ATOM 0 HZ3 LYS A 112 14.026 13.088 13.583 1.00 1.64 H new ATOM 1935 N SER A 113 13.507 13.236 8.995 1.00 0.53 N ATOM 1936 CA SER A 113 14.618 14.230 8.948 1.00 0.82 C ATOM 1937 C SER A 113 15.187 14.285 7.545 1.00 1.06 C ATOM 1938 O SER A 113 15.624 15.308 7.063 1.00 2.02 O ATOM 1939 CB SER A 113 15.727 13.781 9.883 1.00 1.24 C ATOM 1940 OG SER A 113 16.943 13.827 9.161 1.00 2.09 O ATOM 0 H SER A 113 13.752 12.337 9.410 1.00 0.53 H new ATOM 0 HA SER A 113 14.237 15.208 9.242 1.00 0.82 H new ATOM 0 HB2 SER A 113 15.776 14.430 10.757 1.00 1.24 H new ATOM 0 HB3 SER A 113 15.536 12.771 10.246 1.00 1.24 H new ATOM 0 HG SER A 113 17.478 14.588 9.469 1.00 2.09 H new ATOM 1946 N LYS A 114 15.187 13.173 6.901 1.00 0.57 N ATOM 1947 CA LYS A 114 15.724 13.095 5.527 1.00 0.70 C ATOM 1948 C LYS A 114 14.810 13.906 4.618 1.00 0.61 C ATOM 1949 O LYS A 114 15.210 14.418 3.592 1.00 0.92 O ATOM 1950 CB LYS A 114 15.745 11.625 5.119 1.00 0.73 C ATOM 1951 CG LYS A 114 16.194 10.787 6.328 1.00 0.96 C ATOM 1952 CD LYS A 114 16.474 9.353 5.876 1.00 1.02 C ATOM 1953 CE LYS A 114 17.789 9.311 5.098 1.00 1.46 C ATOM 1954 NZ LYS A 114 17.654 8.378 3.945 1.00 1.81 N ATOM 0 H LYS A 114 14.831 12.292 7.272 1.00 0.57 H new ATOM 0 HA LYS A 114 16.735 13.497 5.457 1.00 0.70 H new ATOM 0 HB2 LYS A 114 14.756 11.310 4.787 1.00 0.73 H new ATOM 0 HB3 LYS A 114 16.425 11.475 4.281 1.00 0.73 H new ATOM 0 HG2 LYS A 114 17.089 11.221 6.773 1.00 0.96 H new ATOM 0 HG3 LYS A 114 15.421 10.793 7.096 1.00 0.96 H new ATOM 0 HD2 LYS A 114 16.530 8.692 6.741 1.00 1.02 H new ATOM 0 HD3 LYS A 114 15.658 8.992 5.251 1.00 1.02 H new ATOM 0 HE2 LYS A 114 18.046 10.309 4.744 1.00 1.46 H new ATOM 0 HE3 LYS A 114 18.600 8.985 5.750 1.00 1.46 H new ATOM 0 HZ1 LYS A 114 18.549 8.349 3.415 1.00 1.81 H new ATOM 0 HZ2 LYS A 114 17.427 7.425 4.294 1.00 1.81 H new ATOM 0 HZ3 LYS A 114 16.892 8.708 3.319 1.00 1.81 H new ATOM 1968 N MET A 115 13.578 14.030 5.014 1.00 0.31 N ATOM 1969 CA MET A 115 12.592 14.812 4.215 1.00 0.50 C ATOM 1970 C MET A 115 12.334 16.147 4.882 1.00 0.51 C ATOM 1971 O MET A 115 11.673 17.004 4.333 1.00 0.78 O ATOM 1972 CB MET A 115 11.246 14.107 4.218 1.00 0.58 C ATOM 1973 CG MET A 115 11.433 12.585 4.301 1.00 0.74 C ATOM 1974 SD MET A 115 10.656 11.803 2.869 1.00 1.41 S ATOM 1975 CE MET A 115 12.181 11.291 2.039 1.00 2.11 C ATOM 0 H MET A 115 13.204 13.618 5.869 1.00 0.31 H new ATOM 0 HA MET A 115 12.998 14.922 3.209 1.00 0.50 H new ATOM 0 HB2 MET A 115 10.651 14.452 5.063 1.00 0.58 H new ATOM 0 HB3 MET A 115 10.694 14.362 3.314 1.00 0.58 H new ATOM 0 HG2 MET A 115 12.495 12.340 4.331 1.00 0.74 H new ATOM 0 HG3 MET A 115 10.991 12.203 5.221 1.00 0.74 H new ATOM 0 HE1 MET A 115 11.935 10.776 1.110 1.00 2.11 H new ATOM 0 HE2 MET A 115 12.787 12.169 1.817 1.00 2.11 H new ATOM 0 HE3 MET A 115 12.741 10.619 2.689 1.00 2.11 H new ATOM 1985 N ILE A 116 12.770 16.311 6.088 1.00 0.22 N ATOM 1986 CA ILE A 116 12.469 17.537 6.799 1.00 0.22 C ATOM 1987 C ILE A 116 13.573 18.551 6.609 1.00 0.23 C ATOM 1988 O ILE A 116 13.371 19.681 6.222 1.00 0.24 O ATOM 1989 CB ILE A 116 12.459 17.177 8.260 1.00 0.24 C ATOM 1990 CG1 ILE A 116 11.051 16.849 8.735 1.00 0.23 C ATOM 1991 CG2 ILE A 116 13.014 18.337 9.029 1.00 0.25 C ATOM 1992 CD1 ILE A 116 11.094 16.431 10.205 1.00 0.27 C ATOM 0 H ILE A 116 13.328 15.632 6.606 1.00 0.22 H new ATOM 0 HA ILE A 116 11.528 17.955 6.441 1.00 0.22 H new ATOM 0 HB ILE A 116 13.069 16.289 8.422 1.00 0.24 H new ATOM 0 HG12 ILE A 116 10.403 17.716 8.611 1.00 0.23 H new ATOM 0 HG13 ILE A 116 10.629 16.047 8.130 1.00 0.23 H new ATOM 0 HG21 ILE A 116 13.017 18.100 10.093 1.00 0.25 H new ATOM 0 HG22 ILE A 116 14.033 18.538 8.699 1.00 0.25 H new ATOM 0 HG23 ILE A 116 12.396 19.218 8.855 1.00 0.25 H new ATOM 0 HD11 ILE A 116 10.086 16.196 10.546 1.00 0.27 H new ATOM 0 HD12 ILE A 116 11.729 15.552 10.315 1.00 0.27 H new ATOM 0 HD13 ILE A 116 11.498 17.247 10.804 1.00 0.27 H new ATOM 2004 N TYR A 117 14.737 18.117 6.922 1.00 0.24 N ATOM 2005 CA TYR A 117 15.936 18.966 6.817 1.00 0.26 C ATOM 2006 C TYR A 117 15.973 19.498 5.402 1.00 0.28 C ATOM 2007 O TYR A 117 16.475 20.565 5.119 1.00 0.31 O ATOM 2008 CB TYR A 117 17.125 18.078 7.113 1.00 0.25 C ATOM 2009 CG TYR A 117 17.397 18.101 8.598 1.00 0.21 C ATOM 2010 CD1 TYR A 117 17.527 19.317 9.265 1.00 0.38 C ATOM 2011 CD2 TYR A 117 17.506 16.901 9.307 1.00 0.21 C ATOM 2012 CE1 TYR A 117 17.767 19.341 10.642 1.00 0.61 C ATOM 2013 CE2 TYR A 117 17.748 16.922 10.686 1.00 0.38 C ATOM 2014 CZ TYR A 117 17.877 18.144 11.352 1.00 0.61 C ATOM 2015 OH TYR A 117 18.104 18.173 12.710 1.00 0.86 O ATOM 0 H TYR A 117 14.919 17.172 7.260 1.00 0.24 H new ATOM 0 HA TYR A 117 15.940 19.807 7.510 1.00 0.26 H new ATOM 0 HB2 TYR A 117 16.925 17.059 6.782 1.00 0.25 H new ATOM 0 HB3 TYR A 117 18.000 18.425 6.564 1.00 0.25 H new ATOM 0 HD1 TYR A 117 17.442 20.244 8.717 1.00 0.38 H new ATOM 0 HD2 TYR A 117 17.404 15.958 8.791 1.00 0.21 H new ATOM 0 HE1 TYR A 117 17.867 20.285 11.156 1.00 0.61 H new ATOM 0 HE2 TYR A 117 17.835 15.995 11.234 1.00 0.38 H new ATOM 0 HH TYR A 117 17.888 17.299 13.097 1.00 0.86 H new ATOM 2025 N ALA A 118 15.382 18.755 4.528 1.00 0.33 N ATOM 2026 CA ALA A 118 15.280 19.162 3.122 1.00 0.42 C ATOM 2027 C ALA A 118 14.923 20.645 3.074 1.00 0.48 C ATOM 2028 O ALA A 118 15.554 21.432 2.394 1.00 0.55 O ATOM 2029 CB ALA A 118 14.154 18.344 2.528 1.00 0.51 C ATOM 0 H ALA A 118 14.953 17.854 4.740 1.00 0.33 H new ATOM 0 HA ALA A 118 16.210 19.005 2.575 1.00 0.42 H new ATOM 0 HB1 ALA A 118 14.030 18.605 1.477 1.00 0.51 H new ATOM 0 HB2 ALA A 118 14.391 17.283 2.613 1.00 0.51 H new ATOM 0 HB3 ALA A 118 13.229 18.554 3.065 1.00 0.51 H new ATOM 2035 N SER A 119 13.911 21.028 3.813 1.00 0.48 N ATOM 2036 CA SER A 119 13.498 22.460 3.838 1.00 0.58 C ATOM 2037 C SER A 119 13.953 23.097 5.151 1.00 0.52 C ATOM 2038 O SER A 119 13.821 24.289 5.347 1.00 0.59 O ATOM 2039 CB SER A 119 11.981 22.562 3.744 1.00 0.74 C ATOM 2040 OG SER A 119 11.529 21.821 2.620 1.00 1.67 O ATOM 0 H SER A 119 13.354 20.407 4.400 1.00 0.48 H new ATOM 0 HA SER A 119 13.954 22.976 2.993 1.00 0.58 H new ATOM 0 HB2 SER A 119 11.522 22.178 4.655 1.00 0.74 H new ATOM 0 HB3 SER A 119 11.680 23.606 3.651 1.00 0.74 H new ATOM 0 HG SER A 119 10.551 21.763 2.638 1.00 1.67 H new ATOM 2046 N SER A 120 14.495 22.323 6.053 1.00 0.43 N ATOM 2047 CA SER A 120 14.958 22.920 7.344 1.00 0.44 C ATOM 2048 C SER A 120 16.204 23.730 7.060 1.00 0.33 C ATOM 2049 O SER A 120 16.468 24.724 7.696 1.00 0.28 O ATOM 2050 CB SER A 120 15.281 21.838 8.366 1.00 0.42 C ATOM 2051 OG SER A 120 15.033 22.342 9.672 1.00 0.71 O ATOM 0 H SER A 120 14.637 21.317 5.957 1.00 0.43 H new ATOM 0 HA SER A 120 14.167 23.546 7.758 1.00 0.44 H new ATOM 0 HB2 SER A 120 14.671 20.953 8.182 1.00 0.42 H new ATOM 0 HB3 SER A 120 16.323 21.532 8.273 1.00 0.42 H new ATOM 0 HG SER A 120 15.336 23.273 9.726 1.00 0.71 H new ATOM 2057 N LYS A 121 16.955 23.325 6.084 1.00 0.30 N ATOM 2058 CA LYS A 121 18.159 24.079 5.715 1.00 0.21 C ATOM 2059 C LYS A 121 17.738 25.143 4.736 1.00 0.22 C ATOM 2060 O LYS A 121 17.869 25.060 3.531 1.00 0.28 O ATOM 2061 CB LYS A 121 19.177 23.175 5.125 1.00 0.24 C ATOM 2062 CG LYS A 121 20.363 23.173 6.074 1.00 0.22 C ATOM 2063 CD LYS A 121 21.187 21.921 5.825 1.00 0.22 C ATOM 2064 CE LYS A 121 22.325 22.278 4.869 1.00 0.32 C ATOM 2065 NZ LYS A 121 22.289 21.374 3.685 1.00 0.39 N ATOM 0 H LYS A 121 16.778 22.492 5.523 1.00 0.30 H new ATOM 0 HA LYS A 121 18.615 24.538 6.592 1.00 0.21 H new ATOM 0 HB2 LYS A 121 18.777 22.168 5.004 1.00 0.24 H new ATOM 0 HB3 LYS A 121 19.474 23.521 4.135 1.00 0.24 H new ATOM 0 HG2 LYS A 121 20.973 24.063 5.918 1.00 0.22 H new ATOM 0 HG3 LYS A 121 20.019 23.199 7.108 1.00 0.22 H new ATOM 0 HD2 LYS A 121 21.586 21.536 6.763 1.00 0.22 H new ATOM 0 HD3 LYS A 121 20.564 21.135 5.397 1.00 0.22 H new ATOM 0 HE2 LYS A 121 22.232 23.316 4.549 1.00 0.32 H new ATOM 0 HE3 LYS A 121 23.284 22.187 5.379 1.00 0.32 H new ATOM 0 HZ1 LYS A 121 23.240 21.310 3.268 1.00 0.39 H new ATOM 0 HZ2 LYS A 121 21.976 20.427 3.980 1.00 0.39 H new ATOM 0 HZ3 LYS A 121 21.626 21.753 2.979 1.00 0.39 H new ATOM 2079 N ASP A 122 17.191 26.112 5.326 1.00 0.19 N ATOM 2080 CA ASP A 122 16.628 27.299 4.649 1.00 0.24 C ATOM 2081 C ASP A 122 16.075 28.117 5.794 1.00 0.20 C ATOM 2082 O ASP A 122 16.229 29.320 5.880 1.00 0.20 O ATOM 2083 CB ASP A 122 15.491 26.881 3.715 1.00 0.34 C ATOM 2084 CG ASP A 122 15.438 27.821 2.509 1.00 0.40 C ATOM 2085 OD1 ASP A 122 15.634 29.010 2.700 1.00 0.35 O ATOM 2086 OD2 ASP A 122 15.199 27.336 1.415 1.00 0.57 O ATOM 0 H ASP A 122 17.094 26.149 6.341 1.00 0.19 H new ATOM 0 HA ASP A 122 17.358 27.836 4.043 1.00 0.24 H new ATOM 0 HB2 ASP A 122 15.641 25.854 3.381 1.00 0.34 H new ATOM 0 HB3 ASP A 122 14.541 26.906 4.249 1.00 0.34 H new ATOM 2091 N ALA A 123 15.492 27.412 6.720 1.00 0.21 N ATOM 2092 CA ALA A 123 14.976 28.049 7.947 1.00 0.19 C ATOM 2093 C ALA A 123 16.196 28.329 8.823 1.00 0.14 C ATOM 2094 O ALA A 123 16.492 29.454 9.179 1.00 0.12 O ATOM 2095 CB ALA A 123 14.052 27.061 8.648 1.00 0.23 C ATOM 0 H ALA A 123 15.352 26.403 6.672 1.00 0.21 H new ATOM 0 HA ALA A 123 14.423 28.965 7.741 1.00 0.19 H new ATOM 0 HB1 ALA A 123 13.659 27.513 9.559 1.00 0.23 H new ATOM 0 HB2 ALA A 123 13.226 26.803 7.986 1.00 0.23 H new ATOM 0 HB3 ALA A 123 14.609 26.159 8.902 1.00 0.23 H new ATOM 2101 N ILE A 124 16.937 27.295 9.121 1.00 0.24 N ATOM 2102 CA ILE A 124 18.173 27.442 9.914 1.00 0.19 C ATOM 2103 C ILE A 124 19.052 28.459 9.242 1.00 0.17 C ATOM 2104 O ILE A 124 19.721 29.218 9.886 1.00 0.16 O ATOM 2105 CB ILE A 124 18.918 26.140 9.895 1.00 0.12 C ATOM 2106 CG1 ILE A 124 20.248 26.329 10.609 1.00 0.14 C ATOM 2107 CG2 ILE A 124 19.164 25.754 8.446 1.00 0.10 C ATOM 2108 CD1 ILE A 124 20.462 25.184 11.587 1.00 0.18 C ATOM 0 H ILE A 124 16.725 26.338 8.838 1.00 0.24 H new ATOM 0 HA ILE A 124 17.924 27.739 10.933 1.00 0.19 H new ATOM 0 HB ILE A 124 18.346 25.358 10.395 1.00 0.12 H new ATOM 0 HG12 ILE A 124 21.062 26.360 9.884 1.00 0.14 H new ATOM 0 HG13 ILE A 124 20.257 27.281 11.139 1.00 0.14 H new ATOM 0 HG21 ILE A 124 19.705 24.809 8.408 1.00 0.10 H new ATOM 0 HG22 ILE A 124 18.209 25.646 7.931 1.00 0.10 H new ATOM 0 HG23 ILE A 124 19.754 26.530 7.958 1.00 0.10 H new ATOM 0 HD11 ILE A 124 21.414 25.317 12.100 1.00 0.18 H new ATOM 0 HD12 ILE A 124 19.654 25.175 12.319 1.00 0.18 H new ATOM 0 HD13 ILE A 124 20.471 24.239 11.044 1.00 0.18 H new ATOM 2120 N LYS A 125 19.068 28.439 7.940 1.00 0.18 N ATOM 2121 CA LYS A 125 19.910 29.394 7.174 1.00 0.20 C ATOM 2122 C LYS A 125 19.551 30.822 7.586 1.00 0.32 C ATOM 2123 O LYS A 125 20.406 31.674 7.721 1.00 0.50 O ATOM 2124 CB LYS A 125 19.629 29.215 5.683 1.00 0.38 C ATOM 2125 CG LYS A 125 20.734 28.376 5.044 1.00 0.56 C ATOM 2126 CD LYS A 125 20.816 27.013 5.729 1.00 0.90 C ATOM 2127 CE LYS A 125 22.022 26.988 6.668 1.00 1.25 C ATOM 2128 NZ LYS A 125 23.163 26.309 5.991 1.00 1.21 N ATOM 0 H LYS A 125 18.526 27.792 7.367 1.00 0.18 H new ATOM 0 HA LYS A 125 20.964 29.208 7.378 1.00 0.20 H new ATOM 0 HB2 LYS A 125 18.663 28.729 5.542 1.00 0.38 H new ATOM 0 HB3 LYS A 125 19.571 30.188 5.195 1.00 0.38 H new ATOM 0 HG2 LYS A 125 20.535 28.246 3.980 1.00 0.56 H new ATOM 0 HG3 LYS A 125 21.690 28.893 5.129 1.00 0.56 H new ATOM 0 HD2 LYS A 125 19.901 26.820 6.289 1.00 0.90 H new ATOM 0 HD3 LYS A 125 20.906 26.224 4.983 1.00 0.90 H new ATOM 0 HE2 LYS A 125 22.302 28.004 6.945 1.00 1.25 H new ATOM 0 HE3 LYS A 125 21.768 26.465 7.590 1.00 1.25 H new ATOM 0 HZ1 LYS A 125 24.054 26.771 6.265 1.00 1.21 H new ATOM 0 HZ2 LYS A 125 23.190 25.309 6.275 1.00 1.21 H new ATOM 0 HZ3 LYS A 125 23.043 26.373 4.960 1.00 1.21 H new ATOM 2142 N LYS A 126 18.288 31.088 7.783 1.00 0.25 N ATOM 2143 CA LYS A 126 17.867 32.467 8.184 1.00 0.37 C ATOM 2144 C LYS A 126 18.549 32.842 9.500 1.00 0.49 C ATOM 2145 O LYS A 126 18.709 34.000 9.829 1.00 0.67 O ATOM 2146 CB LYS A 126 16.352 32.511 8.368 1.00 0.29 C ATOM 2147 CG LYS A 126 15.746 33.497 7.368 1.00 1.29 C ATOM 2148 CD LYS A 126 14.326 33.850 7.804 1.00 1.12 C ATOM 2149 CE LYS A 126 13.547 32.564 8.086 1.00 1.55 C ATOM 2150 NZ LYS A 126 12.209 32.906 8.644 1.00 2.60 N ATOM 0 H LYS A 126 17.529 30.414 7.685 1.00 0.25 H new ATOM 0 HA LYS A 126 18.156 33.173 7.406 1.00 0.37 H new ATOM 0 HB2 LYS A 126 15.928 31.518 8.219 1.00 0.29 H new ATOM 0 HB3 LYS A 126 16.107 32.813 9.386 1.00 0.29 H new ATOM 0 HG2 LYS A 126 16.356 34.398 7.313 1.00 1.29 H new ATOM 0 HG3 LYS A 126 15.734 33.059 6.370 1.00 1.29 H new ATOM 0 HD2 LYS A 126 14.353 34.475 8.696 1.00 1.12 H new ATOM 0 HD3 LYS A 126 13.827 34.427 7.025 1.00 1.12 H new ATOM 0 HE2 LYS A 126 13.433 31.986 7.169 1.00 1.55 H new ATOM 0 HE3 LYS A 126 14.098 31.940 8.790 1.00 1.55 H new ATOM 0 HZ1 LYS A 126 11.679 32.032 8.836 1.00 2.60 H new ATOM 0 HZ2 LYS A 126 12.328 33.440 9.528 1.00 2.60 H new ATOM 0 HZ3 LYS A 126 11.684 33.485 7.958 1.00 2.60 H new ATOM 2164 N LYS A 127 18.959 31.862 10.245 1.00 0.44 N ATOM 2165 CA LYS A 127 19.654 32.122 11.534 1.00 0.59 C ATOM 2166 C LYS A 127 21.097 31.640 11.408 1.00 0.59 C ATOM 2167 O LYS A 127 21.936 31.927 12.238 1.00 0.74 O ATOM 2168 CB LYS A 127 18.966 31.352 12.659 1.00 0.63 C ATOM 2169 CG LYS A 127 17.471 31.679 12.672 1.00 0.63 C ATOM 2170 CD LYS A 127 17.273 33.168 12.965 1.00 0.90 C ATOM 2171 CE LYS A 127 16.132 33.710 12.103 1.00 1.29 C ATOM 2172 NZ LYS A 127 14.895 32.919 12.360 1.00 1.84 N ATOM 0 H LYS A 127 18.841 30.875 10.014 1.00 0.44 H new ATOM 0 HA LYS A 127 19.625 33.188 11.762 1.00 0.59 H new ATOM 0 HB2 LYS A 127 19.112 30.281 12.521 1.00 0.63 H new ATOM 0 HB3 LYS A 127 19.413 31.614 13.618 1.00 0.63 H new ATOM 0 HG2 LYS A 127 17.025 31.425 11.711 1.00 0.63 H new ATOM 0 HG3 LYS A 127 16.964 31.079 13.428 1.00 0.63 H new ATOM 0 HD2 LYS A 127 17.047 33.315 14.021 1.00 0.90 H new ATOM 0 HD3 LYS A 127 18.192 33.716 12.757 1.00 0.90 H new ATOM 0 HE2 LYS A 127 15.958 34.762 12.331 1.00 1.29 H new ATOM 0 HE3 LYS A 127 16.400 33.653 11.048 1.00 1.29 H new ATOM 0 HZ1 LYS A 127 14.065 33.459 12.043 1.00 1.84 H new ATOM 0 HZ2 LYS A 127 14.943 32.020 11.839 1.00 1.84 H new ATOM 0 HZ3 LYS A 127 14.813 32.724 13.378 1.00 1.84 H new ATOM 2186 N PHE A 128 21.395 30.924 10.354 1.00 0.45 N ATOM 2187 CA PHE A 128 22.785 30.435 10.140 1.00 0.48 C ATOM 2188 C PHE A 128 23.441 31.360 9.151 1.00 0.59 C ATOM 2189 O PHE A 128 24.242 30.967 8.325 1.00 0.62 O ATOM 2190 CB PHE A 128 22.764 29.002 9.631 1.00 0.36 C ATOM 2191 CG PHE A 128 22.880 28.132 10.845 1.00 0.37 C ATOM 2192 CD1 PHE A 128 22.391 28.629 12.054 1.00 0.48 C ATOM 2193 CD2 PHE A 128 23.480 26.869 10.792 1.00 0.34 C ATOM 2194 CE1 PHE A 128 22.497 27.874 13.216 1.00 0.57 C ATOM 2195 CE2 PHE A 128 23.586 26.107 11.970 1.00 0.39 C ATOM 2196 CZ PHE A 128 23.094 26.613 13.178 1.00 0.52 C ATOM 0 H PHE A 128 20.729 30.657 9.629 1.00 0.45 H new ATOM 0 HA PHE A 128 23.348 30.434 11.073 1.00 0.48 H new ATOM 0 HB2 PHE A 128 21.842 28.794 9.088 1.00 0.36 H new ATOM 0 HB3 PHE A 128 23.588 28.821 8.941 1.00 0.36 H new ATOM 0 HD1 PHE A 128 21.928 29.604 12.087 1.00 0.48 H new ATOM 0 HD2 PHE A 128 23.858 26.483 9.857 1.00 0.34 H new ATOM 0 HE1 PHE A 128 22.117 28.263 14.149 1.00 0.57 H new ATOM 0 HE2 PHE A 128 24.047 25.131 11.942 1.00 0.39 H new ATOM 0 HZ PHE A 128 23.176 26.027 14.082 1.00 0.52 H new ATOM 2206 N GLN A 129 23.073 32.599 9.273 1.00 0.66 N ATOM 2207 CA GLN A 129 23.610 33.681 8.399 1.00 0.78 C ATOM 2208 C GLN A 129 24.959 33.257 7.825 1.00 0.74 C ATOM 2209 O GLN A 129 25.128 33.109 6.632 1.00 0.77 O ATOM 2210 CB GLN A 129 23.802 34.944 9.238 1.00 0.93 C ATOM 2211 CG GLN A 129 22.592 35.152 10.147 1.00 0.93 C ATOM 2212 CD GLN A 129 21.347 35.399 9.293 1.00 0.91 C ATOM 2213 OE1 GLN A 129 20.889 36.517 9.179 1.00 0.87 O ATOM 2214 NE2 GLN A 129 20.777 34.395 8.684 1.00 0.94 N ATOM 0 H GLN A 129 22.398 32.921 9.967 1.00 0.66 H new ATOM 0 HA GLN A 129 22.912 33.871 7.583 1.00 0.78 H new ATOM 0 HB2 GLN A 129 24.708 34.859 9.838 1.00 0.93 H new ATOM 0 HB3 GLN A 129 23.931 35.808 8.586 1.00 0.93 H new ATOM 0 HG2 GLN A 129 22.444 34.276 10.779 1.00 0.93 H new ATOM 0 HG3 GLN A 129 22.764 35.999 10.811 1.00 0.93 H new ATOM 0 HE21 GLN A 129 21.162 33.455 8.780 1.00 0.94 H new ATOM 0 HE22 GLN A 129 19.947 34.550 8.112 1.00 0.94 H new ATOM 2223 N GLY A 130 25.915 33.035 8.681 1.00 0.72 N ATOM 2224 CA GLY A 130 27.254 32.592 8.216 1.00 0.66 C ATOM 2225 C GLY A 130 27.525 31.204 8.790 1.00 0.54 C ATOM 2226 O GLY A 130 28.201 31.055 9.788 1.00 0.50 O ATOM 0 H GLY A 130 25.824 33.143 9.691 1.00 0.72 H new ATOM 0 HA2 GLY A 130 27.288 32.566 7.127 1.00 0.66 H new ATOM 0 HA3 GLY A 130 28.021 33.294 8.542 1.00 0.66 H new ATOM 2230 N ILE A 131 26.996 30.184 8.173 1.00 0.50 N ATOM 2231 CA ILE A 131 27.216 28.823 8.682 1.00 0.39 C ATOM 2232 C ILE A 131 28.694 28.556 8.716 1.00 0.26 C ATOM 2233 O ILE A 131 29.176 27.768 9.505 1.00 0.31 O ATOM 2234 CB ILE A 131 26.537 27.830 7.730 1.00 0.35 C ATOM 2235 CG1 ILE A 131 25.527 26.984 8.436 1.00 0.33 C ATOM 2236 CG2 ILE A 131 27.547 26.867 7.189 1.00 0.25 C ATOM 2237 CD1 ILE A 131 26.060 26.663 9.813 1.00 0.33 C ATOM 0 H ILE A 131 26.419 30.246 7.334 1.00 0.50 H new ATOM 0 HA ILE A 131 26.801 28.716 9.684 1.00 0.39 H new ATOM 0 HB ILE A 131 26.066 28.429 6.950 1.00 0.35 H new ATOM 0 HG12 ILE A 131 24.575 27.510 8.510 1.00 0.33 H new ATOM 0 HG13 ILE A 131 25.342 26.067 7.877 1.00 0.33 H new ATOM 0 HG21 ILE A 131 27.056 26.166 6.514 1.00 0.25 H new ATOM 0 HG22 ILE A 131 28.317 27.415 6.646 1.00 0.25 H new ATOM 0 HG23 ILE A 131 28.004 26.318 8.012 1.00 0.25 H new ATOM 0 HD11 ILE A 131 25.338 26.045 10.348 1.00 0.33 H new ATOM 0 HD12 ILE A 131 27.002 26.123 9.722 1.00 0.33 H new ATOM 0 HD13 ILE A 131 26.224 27.589 10.365 1.00 0.33 H new ATOM 2249 N LYS A 132 29.404 29.190 7.839 1.00 0.18 N ATOM 2250 CA LYS A 132 30.869 28.975 7.740 1.00 0.13 C ATOM 2251 C LYS A 132 31.057 27.724 6.928 1.00 0.15 C ATOM 2252 O LYS A 132 31.841 27.681 5.999 1.00 0.26 O ATOM 2253 CB LYS A 132 31.511 28.765 9.108 1.00 0.16 C ATOM 2254 CG LYS A 132 30.908 29.738 10.107 1.00 0.25 C ATOM 2255 CD LYS A 132 30.772 31.115 9.464 1.00 0.22 C ATOM 2256 CE LYS A 132 32.156 31.637 9.079 1.00 0.59 C ATOM 2257 NZ LYS A 132 32.010 32.920 8.336 1.00 0.58 N ATOM 0 H LYS A 132 29.026 29.862 7.172 1.00 0.18 H new ATOM 0 HA LYS A 132 31.337 29.851 7.291 1.00 0.13 H new ATOM 0 HB2 LYS A 132 31.352 27.740 9.442 1.00 0.16 H new ATOM 0 HB3 LYS A 132 32.589 28.916 9.043 1.00 0.16 H new ATOM 0 HG2 LYS A 132 29.932 29.380 10.434 1.00 0.25 H new ATOM 0 HG3 LYS A 132 31.538 29.801 10.994 1.00 0.25 H new ATOM 0 HD2 LYS A 132 30.136 31.054 8.581 1.00 0.22 H new ATOM 0 HD3 LYS A 132 30.291 31.806 10.157 1.00 0.22 H new ATOM 0 HE2 LYS A 132 32.762 31.788 9.973 1.00 0.59 H new ATOM 0 HE3 LYS A 132 32.675 30.903 8.462 1.00 0.59 H new ATOM 0 HZ1 LYS A 132 32.950 33.278 8.073 1.00 0.58 H new ATOM 0 HZ2 LYS A 132 31.447 32.761 7.476 1.00 0.58 H new ATOM 0 HZ3 LYS A 132 31.531 33.618 8.940 1.00 0.58 H new ATOM 2271 N HIS A 133 30.338 26.688 7.261 1.00 0.15 N ATOM 2272 CA HIS A 133 30.522 25.444 6.454 1.00 0.17 C ATOM 2273 C HIS A 133 29.301 24.544 6.417 1.00 0.20 C ATOM 2274 O HIS A 133 29.124 23.698 7.268 1.00 0.24 O ATOM 2275 CB HIS A 133 31.650 24.624 7.039 1.00 0.14 C ATOM 2276 CG HIS A 133 32.947 25.092 6.462 1.00 0.09 C ATOM 2277 ND1 HIS A 133 33.074 25.479 5.139 1.00 0.14 N ATOM 2278 CD2 HIS A 133 34.179 25.255 7.024 1.00 0.06 C ATOM 2279 CE1 HIS A 133 34.351 25.854 4.949 1.00 0.15 C ATOM 2280 NE2 HIS A 133 35.069 25.737 6.068 1.00 0.10 N ATOM 0 H HIS A 133 29.659 26.643 8.021 1.00 0.15 H new ATOM 0 HA HIS A 133 30.727 25.785 5.439 1.00 0.17 H new ATOM 0 HB2 HIS A 133 31.664 24.724 8.124 1.00 0.14 H new ATOM 0 HB3 HIS A 133 31.500 23.567 6.818 1.00 0.14 H new ATOM 0 HD1 HIS A 133 32.334 25.480 4.437 1.00 0.14 H new ATOM 0 HD2 HIS A 133 34.426 25.043 8.054 1.00 0.06 H new ATOM 0 HE1 HIS A 133 34.747 26.206 4.008 1.00 0.15 H new ATOM 2288 N GLU A 134 28.498 24.644 5.404 1.00 0.18 N ATOM 2289 CA GLU A 134 27.370 23.709 5.321 1.00 0.21 C ATOM 2290 C GLU A 134 27.935 22.366 4.867 1.00 0.20 C ATOM 2291 O GLU A 134 28.352 22.185 3.742 1.00 0.21 O ATOM 2292 CB GLU A 134 26.313 24.217 4.358 1.00 0.21 C ATOM 2293 CG GLU A 134 25.815 23.094 3.448 1.00 0.18 C ATOM 2294 CD GLU A 134 26.608 23.102 2.138 1.00 2.14 C ATOM 2295 OE1 GLU A 134 27.608 23.799 2.079 1.00 3.52 O ATOM 2296 OE2 GLU A 134 26.203 22.410 1.219 1.00 2.48 O ATOM 0 H GLU A 134 28.576 25.322 4.646 1.00 0.18 H new ATOM 0 HA GLU A 134 26.881 23.607 6.290 1.00 0.21 H new ATOM 0 HB2 GLU A 134 25.476 24.634 4.918 1.00 0.21 H new ATOM 0 HB3 GLU A 134 26.725 25.024 3.753 1.00 0.21 H new ATOM 0 HG2 GLU A 134 25.928 22.131 3.947 1.00 0.18 H new ATOM 0 HG3 GLU A 134 24.753 23.224 3.242 1.00 0.18 H new ATOM 2303 N CYS A 135 27.970 21.444 5.761 1.00 0.20 N ATOM 2304 CA CYS A 135 28.535 20.085 5.440 1.00 0.20 C ATOM 2305 C CYS A 135 27.513 18.986 5.735 1.00 0.09 C ATOM 2306 O CYS A 135 27.170 18.745 6.872 1.00 0.17 O ATOM 2307 CB CYS A 135 29.780 19.819 6.296 1.00 0.31 C ATOM 2308 SG CYS A 135 30.851 18.632 5.446 1.00 0.37 S ATOM 0 H CYS A 135 27.633 21.554 6.717 1.00 0.20 H new ATOM 0 HA CYS A 135 28.790 20.074 4.380 1.00 0.20 H new ATOM 0 HB2 CYS A 135 30.319 20.750 6.473 1.00 0.31 H new ATOM 0 HB3 CYS A 135 29.488 19.429 7.271 1.00 0.31 H new ATOM 0 HG CYS A 135 31.511 17.937 6.324 1.00 0.37 H new ATOM 2314 N GLN A 136 27.040 18.294 4.730 1.00 0.03 N ATOM 2315 CA GLN A 136 26.062 17.204 4.993 1.00 0.14 C ATOM 2316 C GLN A 136 26.797 15.890 5.229 1.00 0.16 C ATOM 2317 O GLN A 136 27.710 15.533 4.509 1.00 0.58 O ATOM 2318 CB GLN A 136 25.091 17.050 3.818 1.00 0.22 C ATOM 2319 CG GLN A 136 23.666 17.214 4.346 1.00 1.46 C ATOM 2320 CD GLN A 136 22.655 16.583 3.401 1.00 0.73 C ATOM 2321 OE1 GLN A 136 23.016 15.955 2.424 1.00 0.80 O ATOM 2322 NE2 GLN A 136 21.385 16.731 3.661 1.00 0.66 N ATOM 0 H GLN A 136 27.287 18.436 3.751 1.00 0.03 H new ATOM 0 HA GLN A 136 25.491 17.464 5.884 1.00 0.14 H new ATOM 0 HB2 GLN A 136 25.300 17.797 3.052 1.00 0.22 H new ATOM 0 HB3 GLN A 136 25.212 16.073 3.351 1.00 0.22 H new ATOM 0 HG2 GLN A 136 23.585 16.753 5.331 1.00 1.46 H new ATOM 0 HG3 GLN A 136 23.441 18.273 4.470 1.00 1.46 H new ATOM 0 HE21 GLN A 136 21.091 17.259 4.483 1.00 0.66 H new ATOM 0 HE22 GLN A 136 20.686 16.318 3.043 1.00 0.66 H new ATOM 2331 N ALA A 137 26.401 15.170 6.241 1.00 0.32 N ATOM 2332 CA ALA A 137 27.065 13.878 6.546 1.00 0.34 C ATOM 2333 C ALA A 137 26.057 12.746 6.466 1.00 0.30 C ATOM 2334 O ALA A 137 25.223 12.565 7.327 1.00 0.26 O ATOM 2335 CB ALA A 137 27.677 13.926 7.942 1.00 0.36 C ATOM 0 H ALA A 137 25.641 15.425 6.872 1.00 0.32 H new ATOM 0 HA ALA A 137 27.855 13.704 5.815 1.00 0.34 H new ATOM 0 HB1 ALA A 137 28.163 12.975 8.159 1.00 0.36 H new ATOM 0 HB2 ALA A 137 28.413 14.728 7.989 1.00 0.36 H new ATOM 0 HB3 ALA A 137 26.893 14.109 8.677 1.00 0.36 H new ATOM 2341 N ASN A 138 26.162 11.960 5.443 1.00 0.33 N ATOM 2342 CA ASN A 138 25.251 10.800 5.289 1.00 0.30 C ATOM 2343 C ASN A 138 26.064 9.590 5.679 1.00 0.30 C ATOM 2344 O ASN A 138 26.180 8.598 4.984 1.00 0.38 O ATOM 2345 CB ASN A 138 24.746 10.724 3.860 1.00 0.36 C ATOM 2346 CG ASN A 138 24.296 12.131 3.421 1.00 0.55 C ATOM 2347 OD1 ASN A 138 24.212 12.413 2.243 1.00 0.85 O ATOM 2348 ND2 ASN A 138 24.000 13.029 4.337 1.00 0.42 N ATOM 0 H ASN A 138 26.848 12.071 4.696 1.00 0.33 H new ATOM 0 HA ASN A 138 24.363 10.875 5.916 1.00 0.30 H new ATOM 0 HB2 ASN A 138 25.532 10.355 3.200 1.00 0.36 H new ATOM 0 HB3 ASN A 138 23.915 10.022 3.789 1.00 0.36 H new ATOM 0 HD21 ASN A 138 23.700 13.963 4.057 1.00 0.42 H new ATOM 0 HD22 ASN A 138 24.071 12.791 5.326 1.00 0.42 H new ATOM 2355 N GLY A 139 26.666 9.757 6.801 1.00 0.27 N ATOM 2356 CA GLY A 139 27.571 8.778 7.401 1.00 0.30 C ATOM 2357 C GLY A 139 28.432 9.643 8.291 1.00 0.32 C ATOM 2358 O GLY A 139 28.696 10.775 7.943 1.00 0.31 O ATOM 0 H GLY A 139 26.555 10.600 7.365 1.00 0.27 H new ATOM 0 HA2 GLY A 139 27.032 8.020 7.969 1.00 0.30 H new ATOM 0 HA3 GLY A 139 28.161 8.254 6.649 1.00 0.30 H new ATOM 2362 N PRO A 140 28.859 9.136 9.388 1.00 0.34 N ATOM 2363 CA PRO A 140 29.693 9.926 10.278 1.00 0.35 C ATOM 2364 C PRO A 140 31.072 10.086 9.596 1.00 0.30 C ATOM 2365 O PRO A 140 31.982 10.704 10.113 1.00 0.28 O ATOM 2366 CB PRO A 140 29.748 9.089 11.561 1.00 0.43 C ATOM 2367 CG PRO A 140 29.387 7.645 11.145 1.00 0.46 C ATOM 2368 CD PRO A 140 28.590 7.762 9.827 1.00 0.38 C ATOM 0 HA PRO A 140 29.333 10.931 10.498 1.00 0.35 H new ATOM 0 HB2 PRO A 140 30.740 9.129 12.010 1.00 0.43 H new ATOM 0 HB3 PRO A 140 29.046 9.468 12.304 1.00 0.43 H new ATOM 0 HG2 PRO A 140 30.286 7.044 11.004 1.00 0.46 H new ATOM 0 HG3 PRO A 140 28.793 7.155 11.917 1.00 0.46 H new ATOM 0 HD2 PRO A 140 28.924 7.032 9.090 1.00 0.38 H new ATOM 0 HD3 PRO A 140 27.525 7.592 9.985 1.00 0.38 H new ATOM 2376 N GLU A 141 31.201 9.499 8.417 1.00 0.28 N ATOM 2377 CA GLU A 141 32.456 9.534 7.616 1.00 0.21 C ATOM 2378 C GLU A 141 32.441 10.733 6.695 1.00 0.18 C ATOM 2379 O GLU A 141 33.466 11.165 6.215 1.00 0.19 O ATOM 2380 CB GLU A 141 32.477 8.265 6.806 1.00 0.36 C ATOM 2381 CG GLU A 141 31.877 7.204 7.692 1.00 3.24 C ATOM 2382 CD GLU A 141 32.636 5.885 7.524 1.00 3.88 C ATOM 2383 OE1 GLU A 141 33.030 5.588 6.406 1.00 3.67 O ATOM 2384 OE2 GLU A 141 32.818 5.197 8.515 1.00 4.89 O ATOM 0 H GLU A 141 30.447 8.978 7.970 1.00 0.28 H new ATOM 0 HA GLU A 141 33.336 9.611 8.255 1.00 0.21 H new ATOM 0 HB2 GLU A 141 31.902 8.378 5.887 1.00 0.36 H new ATOM 0 HB3 GLU A 141 33.494 8.003 6.516 1.00 0.36 H new ATOM 0 HG2 GLU A 141 31.916 7.524 8.733 1.00 3.24 H new ATOM 0 HG3 GLU A 141 30.826 7.062 7.441 1.00 3.24 H new ATOM 2391 N ASP A 142 31.301 11.311 6.472 1.00 0.25 N ATOM 2392 CA ASP A 142 31.298 12.529 5.649 1.00 0.25 C ATOM 2393 C ASP A 142 31.953 13.591 6.530 1.00 0.34 C ATOM 2394 O ASP A 142 32.386 14.631 6.074 1.00 0.36 O ATOM 2395 CB ASP A 142 29.875 12.935 5.301 1.00 0.37 C ATOM 2396 CG ASP A 142 29.753 13.113 3.788 1.00 0.67 C ATOM 2397 OD1 ASP A 142 30.254 12.264 3.071 1.00 1.20 O ATOM 2398 OD2 ASP A 142 29.160 14.095 3.372 1.00 1.20 O ATOM 0 H ASP A 142 30.394 10.998 6.817 1.00 0.25 H new ATOM 0 HA ASP A 142 31.824 12.390 4.704 1.00 0.25 H new ATOM 0 HB2 ASP A 142 29.174 12.175 5.647 1.00 0.37 H new ATOM 0 HB3 ASP A 142 29.615 13.864 5.810 1.00 0.37 H new ATOM 2403 N LEU A 143 32.069 13.284 7.809 1.00 0.46 N ATOM 2404 CA LEU A 143 32.741 14.207 8.763 1.00 0.63 C ATOM 2405 C LEU A 143 34.230 13.835 8.776 1.00 0.72 C ATOM 2406 O LEU A 143 35.061 14.472 9.384 1.00 0.94 O ATOM 2407 CB LEU A 143 32.141 13.997 10.137 1.00 0.62 C ATOM 2408 CG LEU A 143 30.659 14.324 10.072 1.00 0.62 C ATOM 2409 CD1 LEU A 143 29.878 13.028 9.914 1.00 0.50 C ATOM 2410 CD2 LEU A 143 30.238 15.032 11.354 1.00 0.70 C ATOM 0 H LEU A 143 31.719 12.421 8.226 1.00 0.46 H new ATOM 0 HA LEU A 143 32.614 15.251 8.477 1.00 0.63 H new ATOM 0 HB2 LEU A 143 32.287 12.967 10.461 1.00 0.62 H new ATOM 0 HB3 LEU A 143 32.638 14.634 10.868 1.00 0.62 H new ATOM 0 HG LEU A 143 30.457 14.979 9.224 1.00 0.62 H new ATOM 0 HD11 LEU A 143 28.812 13.249 9.866 1.00 0.50 H new ATOM 0 HD12 LEU A 143 30.186 12.527 8.996 1.00 0.50 H new ATOM 0 HD13 LEU A 143 30.076 12.378 10.766 1.00 0.50 H new ATOM 0 HD21 LEU A 143 29.175 15.267 11.308 1.00 0.70 H new ATOM 0 HD22 LEU A 143 30.429 14.382 12.208 1.00 0.70 H new ATOM 0 HD23 LEU A 143 30.809 15.954 11.465 1.00 0.70 H new ATOM 2422 N ASN A 144 34.519 12.782 8.066 1.00 0.59 N ATOM 2423 CA ASN A 144 35.873 12.215 7.889 1.00 0.85 C ATOM 2424 C ASN A 144 36.960 12.964 8.632 1.00 1.49 C ATOM 2425 O ASN A 144 37.621 12.408 9.474 1.00 3.74 O ATOM 2426 CB ASN A 144 36.189 12.298 6.407 1.00 0.41 C ATOM 2427 CG ASN A 144 37.516 11.622 6.121 1.00 0.81 C ATOM 2428 OD1 ASN A 144 38.132 11.870 5.107 1.00 0.92 O ATOM 2429 ND2 ASN A 144 37.976 10.761 6.967 1.00 1.10 N ATOM 0 H ASN A 144 33.804 12.255 7.564 1.00 0.59 H new ATOM 0 HA ASN A 144 35.862 11.201 8.287 1.00 0.85 H new ATOM 0 HB2 ASN A 144 35.397 11.821 5.831 1.00 0.41 H new ATOM 0 HB3 ASN A 144 36.228 13.341 6.093 1.00 0.41 H new ATOM 0 HD21 ASN A 144 38.860 10.287 6.783 1.00 1.10 H new ATOM 0 HD22 ASN A 144 37.455 10.555 7.819 1.00 1.10 H new ATOM 2436 N ARG A 145 37.167 14.192 8.234 1.00 0.79 N ATOM 2437 CA ARG A 145 38.241 15.079 8.779 1.00 0.53 C ATOM 2438 C ARG A 145 39.069 15.466 7.570 1.00 0.32 C ATOM 2439 O ARG A 145 39.273 16.621 7.277 1.00 0.28 O ATOM 2440 CB ARG A 145 39.153 14.379 9.777 1.00 1.19 C ATOM 2441 CG ARG A 145 39.596 15.363 10.860 1.00 1.37 C ATOM 2442 CD ARG A 145 41.021 15.817 10.561 1.00 1.87 C ATOM 2443 NE ARG A 145 41.864 15.650 11.779 1.00 2.30 N ATOM 2444 CZ ARG A 145 42.762 14.704 11.821 1.00 2.15 C ATOM 2445 NH1 ARG A 145 42.608 13.624 11.106 1.00 2.60 N ATOM 2446 NH2 ARG A 145 43.815 14.836 12.581 1.00 1.80 N ATOM 0 H ARG A 145 36.602 14.640 7.512 1.00 0.79 H new ATOM 0 HA ARG A 145 37.792 15.917 9.311 1.00 0.53 H new ATOM 0 HB2 ARG A 145 38.631 13.537 10.231 1.00 1.19 H new ATOM 0 HB3 ARG A 145 40.025 13.974 9.263 1.00 1.19 H new ATOM 0 HG2 ARG A 145 38.925 16.221 10.887 1.00 1.37 H new ATOM 0 HG3 ARG A 145 39.549 14.890 11.841 1.00 1.37 H new ATOM 0 HD2 ARG A 145 41.434 15.234 9.738 1.00 1.87 H new ATOM 0 HD3 ARG A 145 41.023 16.860 10.245 1.00 1.87 H new ATOM 0 HE ARG A 145 41.739 16.273 12.577 1.00 2.30 H new ATOM 0 HH11 ARG A 145 41.785 13.518 10.513 1.00 2.60 H new ATOM 0 HH12 ARG A 145 43.311 12.885 11.140 1.00 2.60 H new ATOM 0 HH21 ARG A 145 43.936 15.679 13.142 1.00 1.80 H new ATOM 0 HH22 ARG A 145 44.517 14.096 12.613 1.00 1.80 H new ATOM 2460 N ALA A 146 39.476 14.470 6.829 1.00 0.34 N ATOM 2461 CA ALA A 146 40.201 14.706 5.564 1.00 0.28 C ATOM 2462 C ALA A 146 39.166 15.324 4.649 1.00 0.20 C ATOM 2463 O ALA A 146 39.428 16.179 3.829 1.00 0.24 O ATOM 2464 CB ALA A 146 40.614 13.374 4.963 1.00 0.42 C ATOM 0 H ALA A 146 39.330 13.487 7.059 1.00 0.34 H new ATOM 0 HA ALA A 146 41.088 15.324 5.705 1.00 0.28 H new ATOM 0 HB1 ALA A 146 41.149 13.546 4.029 1.00 0.42 H new ATOM 0 HB2 ALA A 146 41.263 12.846 5.661 1.00 0.42 H new ATOM 0 HB3 ALA A 146 39.726 12.773 4.767 1.00 0.42 H new ATOM 2470 N CYS A 147 37.957 14.877 4.832 1.00 0.20 N ATOM 2471 CA CYS A 147 36.825 15.410 4.043 1.00 0.17 C ATOM 2472 C CYS A 147 36.484 16.745 4.604 1.00 0.22 C ATOM 2473 O CYS A 147 36.228 17.674 3.894 1.00 0.25 O ATOM 2474 CB CYS A 147 35.649 14.504 4.197 1.00 0.19 C ATOM 2475 SG CYS A 147 34.620 14.566 2.711 1.00 0.31 S ATOM 0 H CYS A 147 37.706 14.154 5.506 1.00 0.20 H new ATOM 0 HA CYS A 147 37.087 15.483 2.988 1.00 0.17 H new ATOM 0 HB2 CYS A 147 35.987 13.483 4.373 1.00 0.19 H new ATOM 0 HB3 CYS A 147 35.063 14.800 5.067 1.00 0.19 H new ATOM 0 HG CYS A 147 33.601 13.772 2.856 1.00 0.31 H new ATOM 2481 N ILE A 148 36.537 16.885 5.878 1.00 0.29 N ATOM 2482 CA ILE A 148 36.297 18.193 6.412 1.00 0.31 C ATOM 2483 C ILE A 148 37.488 19.012 5.942 1.00 0.23 C ATOM 2484 O ILE A 148 37.461 20.218 5.833 1.00 0.26 O ATOM 2485 CB ILE A 148 36.277 18.095 7.901 1.00 0.35 C ATOM 2486 CG1 ILE A 148 35.126 17.185 8.337 1.00 0.55 C ATOM 2487 CG2 ILE A 148 36.110 19.488 8.407 1.00 0.31 C ATOM 2488 CD1 ILE A 148 34.095 17.070 7.215 1.00 0.38 C ATOM 0 H ILE A 148 36.735 16.149 6.555 1.00 0.29 H new ATOM 0 HA ILE A 148 35.353 18.636 6.094 1.00 0.31 H new ATOM 0 HB ILE A 148 37.192 17.659 8.303 1.00 0.35 H new ATOM 0 HG12 ILE A 148 35.509 16.197 8.592 1.00 0.55 H new ATOM 0 HG13 ILE A 148 34.655 17.586 9.235 1.00 0.55 H new ATOM 0 HG21 ILE A 148 36.088 19.479 9.497 1.00 0.31 H new ATOM 0 HG22 ILE A 148 36.944 20.102 8.066 1.00 0.31 H new ATOM 0 HG23 ILE A 148 35.176 19.903 8.029 1.00 0.31 H new ATOM 0 HD11 ILE A 148 33.280 16.421 7.535 1.00 0.38 H new ATOM 0 HD12 ILE A 148 33.700 18.059 6.981 1.00 0.38 H new ATOM 0 HD13 ILE A 148 34.568 16.649 6.328 1.00 0.38 H new ATOM 2500 N ALA A 149 38.519 18.288 5.595 1.00 0.23 N ATOM 2501 CA ALA A 149 39.769 18.871 5.038 1.00 0.32 C ATOM 2502 C ALA A 149 39.637 18.883 3.520 1.00 0.38 C ATOM 2503 O ALA A 149 40.577 18.794 2.764 1.00 0.50 O ATOM 2504 CB ALA A 149 40.921 17.988 5.428 1.00 0.34 C ATOM 0 H ALA A 149 38.542 17.272 5.680 1.00 0.23 H new ATOM 0 HA ALA A 149 39.936 19.880 5.414 1.00 0.32 H new ATOM 0 HB1 ALA A 149 41.847 18.400 5.028 1.00 0.34 H new ATOM 0 HB2 ALA A 149 40.987 17.935 6.515 1.00 0.34 H new ATOM 0 HB3 ALA A 149 40.765 16.987 5.025 1.00 0.34 H new ATOM 2510 N GLU A 150 38.437 18.997 3.118 1.00 0.33 N ATOM 2511 CA GLU A 150 38.052 19.063 1.695 1.00 0.41 C ATOM 2512 C GLU A 150 37.006 20.160 1.629 1.00 0.37 C ATOM 2513 O GLU A 150 37.029 21.042 0.798 1.00 0.36 O ATOM 2514 CB GLU A 150 37.432 17.749 1.276 1.00 0.49 C ATOM 2515 CG GLU A 150 38.528 16.713 1.125 1.00 2.33 C ATOM 2516 CD GLU A 150 38.301 15.906 -0.153 1.00 2.24 C ATOM 2517 OE1 GLU A 150 37.559 14.940 -0.093 1.00 2.94 O ATOM 2518 OE2 GLU A 150 38.869 16.268 -1.169 1.00 2.05 O ATOM 0 H GLU A 150 37.643 19.052 3.756 1.00 0.33 H new ATOM 0 HA GLU A 150 38.903 19.256 1.042 1.00 0.41 H new ATOM 0 HB2 GLU A 150 36.704 17.422 2.019 1.00 0.49 H new ATOM 0 HB3 GLU A 150 36.895 17.869 0.335 1.00 0.49 H new ATOM 0 HG2 GLU A 150 39.502 17.202 1.090 1.00 2.33 H new ATOM 0 HG3 GLU A 150 38.536 16.049 1.989 1.00 2.33 H new ATOM 2525 N LYS A 151 36.132 20.139 2.585 1.00 0.40 N ATOM 2526 CA LYS A 151 35.119 21.197 2.701 1.00 0.39 C ATOM 2527 C LYS A 151 35.915 22.454 3.042 1.00 0.37 C ATOM 2528 O LYS A 151 35.565 23.564 2.693 1.00 0.39 O ATOM 2529 CB LYS A 151 34.154 20.808 3.816 1.00 0.36 C ATOM 2530 CG LYS A 151 34.106 21.907 4.862 1.00 0.35 C ATOM 2531 CD LYS A 151 32.887 21.686 5.758 1.00 0.34 C ATOM 2532 CE LYS A 151 31.612 21.883 4.935 1.00 0.34 C ATOM 2533 NZ LYS A 151 31.880 22.818 3.805 1.00 0.36 N ATOM 0 H LYS A 151 36.080 19.416 3.303 1.00 0.40 H new ATOM 0 HA LYS A 151 34.525 21.353 1.801 1.00 0.39 H new ATOM 0 HB2 LYS A 151 33.158 20.640 3.405 1.00 0.36 H new ATOM 0 HB3 LYS A 151 34.472 19.871 4.274 1.00 0.36 H new ATOM 0 HG2 LYS A 151 35.018 21.900 5.458 1.00 0.35 H new ATOM 0 HG3 LYS A 151 34.048 22.883 4.381 1.00 0.35 H new ATOM 0 HD2 LYS A 151 32.909 20.681 6.181 1.00 0.34 H new ATOM 0 HD3 LYS A 151 32.905 22.384 6.595 1.00 0.34 H new ATOM 0 HE2 LYS A 151 31.264 20.924 4.551 1.00 0.34 H new ATOM 0 HE3 LYS A 151 30.818 22.280 5.567 1.00 0.34 H new ATOM 0 HZ1 LYS A 151 30.978 23.135 3.395 1.00 0.36 H new ATOM 0 HZ2 LYS A 151 32.410 23.642 4.154 1.00 0.36 H new ATOM 0 HZ3 LYS A 151 32.439 22.330 3.076 1.00 0.36 H new ATOM 2547 N LEU A 152 37.044 22.235 3.672 1.00 0.34 N ATOM 2548 CA LEU A 152 37.984 23.331 4.010 1.00 0.32 C ATOM 2549 C LEU A 152 39.270 23.046 3.239 1.00 0.35 C ATOM 2550 O LEU A 152 39.919 23.929 2.714 1.00 0.36 O ATOM 2551 CB LEU A 152 38.353 23.295 5.495 1.00 0.27 C ATOM 2552 CG LEU A 152 37.124 23.429 6.380 1.00 0.23 C ATOM 2553 CD1 LEU A 152 37.081 22.241 7.342 1.00 0.16 C ATOM 2554 CD2 LEU A 152 37.238 24.724 7.184 1.00 0.18 C ATOM 0 H LEU A 152 37.355 21.311 3.972 1.00 0.34 H new ATOM 0 HA LEU A 152 37.529 24.292 3.770 1.00 0.32 H new ATOM 0 HB2 LEU A 152 38.865 22.359 5.721 1.00 0.27 H new ATOM 0 HB3 LEU A 152 39.052 24.102 5.717 1.00 0.27 H new ATOM 0 HG LEU A 152 36.219 23.448 5.773 1.00 0.23 H new ATOM 0 HD11 LEU A 152 36.204 22.324 7.984 1.00 0.16 H new ATOM 0 HD12 LEU A 152 37.027 21.313 6.772 1.00 0.16 H new ATOM 0 HD13 LEU A 152 37.981 22.238 7.957 1.00 0.16 H new ATOM 0 HD21 LEU A 152 36.362 24.833 7.824 1.00 0.18 H new ATOM 0 HD22 LEU A 152 38.136 24.692 7.801 1.00 0.18 H new ATOM 0 HD23 LEU A 152 37.297 25.572 6.502 1.00 0.18 H new ATOM 2566 N GLY A 153 39.648 21.787 3.209 1.00 0.36 N ATOM 2567 CA GLY A 153 40.902 21.379 2.527 1.00 0.38 C ATOM 2568 C GLY A 153 40.613 21.036 1.083 1.00 0.55 C ATOM 2569 O GLY A 153 41.422 20.462 0.382 1.00 0.88 O ATOM 0 H GLY A 153 39.127 21.021 3.637 1.00 0.36 H new ATOM 0 HA2 GLY A 153 41.634 22.185 2.579 1.00 0.38 H new ATOM 0 HA3 GLY A 153 41.339 20.519 3.034 1.00 0.38 H new ATOM 2573 N GLY A 154 39.478 21.428 0.630 1.00 0.37 N ATOM 2574 CA GLY A 154 39.122 21.181 -0.791 1.00 0.52 C ATOM 2575 C GLY A 154 39.154 22.526 -1.503 1.00 0.64 C ATOM 2576 O GLY A 154 38.590 22.698 -2.566 1.00 1.19 O ATOM 0 H GLY A 154 38.768 21.914 1.178 1.00 0.37 H new ATOM 0 HA2 GLY A 154 39.826 20.486 -1.249 1.00 0.52 H new ATOM 0 HA3 GLY A 154 38.133 20.729 -0.867 1.00 0.52 H new ATOM 2580 N SER A 155 39.809 23.492 -0.909 1.00 0.79 N ATOM 2581 CA SER A 155 39.874 24.835 -1.530 1.00 1.01 C ATOM 2582 C SER A 155 41.164 25.553 -1.133 1.00 0.73 C ATOM 2583 O SER A 155 42.039 25.745 -1.954 1.00 0.62 O ATOM 2584 CB SER A 155 38.677 25.663 -1.069 1.00 1.29 C ATOM 2585 OG SER A 155 37.541 25.321 -1.852 1.00 1.93 O ATOM 0 H SER A 155 40.300 23.401 -0.020 1.00 0.79 H new ATOM 0 HA SER A 155 39.856 24.719 -2.614 1.00 1.01 H new ATOM 0 HB2 SER A 155 38.476 25.477 -0.014 1.00 1.29 H new ATOM 0 HB3 SER A 155 38.895 26.726 -1.169 1.00 1.29 H new ATOM 0 HG SER A 155 37.701 24.467 -2.305 1.00 1.93 H new ATOM 2591 N LEU A 156 41.296 25.991 0.099 1.00 0.65 N ATOM 2592 CA LEU A 156 42.535 26.739 0.447 1.00 0.56 C ATOM 2593 C LEU A 156 42.844 26.755 1.939 1.00 0.55 C ATOM 2594 O LEU A 156 42.936 27.814 2.522 1.00 0.59 O ATOM 2595 CB LEU A 156 42.390 28.194 -0.008 1.00 0.68 C ATOM 2596 CG LEU A 156 41.114 28.387 -0.833 1.00 0.71 C ATOM 2597 CD1 LEU A 156 40.594 29.810 -0.629 1.00 1.39 C ATOM 2598 CD2 LEU A 156 41.418 28.163 -2.316 1.00 2.21 C ATOM 0 H LEU A 156 40.620 25.866 0.853 1.00 0.65 H new ATOM 0 HA LEU A 156 43.351 26.223 -0.058 1.00 0.56 H new ATOM 0 HB2 LEU A 156 42.367 28.850 0.862 1.00 0.68 H new ATOM 0 HB3 LEU A 156 43.258 28.481 -0.602 1.00 0.68 H new ATOM 0 HG LEU A 156 40.360 27.669 -0.509 1.00 0.71 H new ATOM 0 HD11 LEU A 156 39.686 29.953 -1.214 1.00 1.39 H new ATOM 0 HD12 LEU A 156 40.374 29.969 0.427 1.00 1.39 H new ATOM 0 HD13 LEU A 156 41.351 30.524 -0.954 1.00 1.39 H new ATOM 0 HD21 LEU A 156 40.507 28.301 -2.899 1.00 2.21 H new ATOM 0 HD22 LEU A 156 42.172 28.878 -2.645 1.00 2.21 H new ATOM 0 HD23 LEU A 156 41.792 27.149 -2.462 1.00 2.21 H new ATOM 2610 N ILE A 157 43.067 25.642 2.576 1.00 0.52 N ATOM 2611 CA ILE A 157 43.438 25.736 3.998 1.00 0.52 C ATOM 2612 C ILE A 157 44.915 25.340 4.155 1.00 0.57 C ATOM 2613 O ILE A 157 45.748 25.680 3.341 1.00 0.74 O ATOM 2614 CB ILE A 157 42.531 24.876 4.852 1.00 0.48 C ATOM 2615 CG1 ILE A 157 42.523 23.456 4.342 1.00 0.31 C ATOM 2616 CG2 ILE A 157 41.112 25.436 4.792 1.00 0.57 C ATOM 2617 CD1 ILE A 157 41.681 22.666 5.303 1.00 0.25 C ATOM 0 H ILE A 157 43.009 24.702 2.183 1.00 0.52 H new ATOM 0 HA ILE A 157 43.311 26.762 4.343 1.00 0.52 H new ATOM 0 HB ILE A 157 42.897 24.883 5.879 1.00 0.48 H new ATOM 0 HG12 ILE A 157 42.111 23.408 3.334 1.00 0.31 H new ATOM 0 HG13 ILE A 157 43.535 23.055 4.292 1.00 0.31 H new ATOM 0 HG21 ILE A 157 40.452 24.822 5.405 1.00 0.57 H new ATOM 0 HG22 ILE A 157 41.108 26.459 5.168 1.00 0.57 H new ATOM 0 HG23 ILE A 157 40.761 25.428 3.760 1.00 0.57 H new ATOM 0 HD11 ILE A 157 41.640 21.625 4.981 1.00 0.25 H new ATOM 0 HD12 ILE A 157 42.119 22.720 6.300 1.00 0.25 H new ATOM 0 HD13 ILE A 157 40.672 23.078 5.327 1.00 0.25 H new ATOM 2629 N VAL A 158 45.241 24.649 5.198 1.00 0.49 N ATOM 2630 CA VAL A 158 46.647 24.249 5.436 1.00 0.54 C ATOM 2631 C VAL A 158 46.624 23.096 6.426 1.00 0.58 C ATOM 2632 O VAL A 158 47.412 22.192 6.361 1.00 0.74 O ATOM 2633 CB VAL A 158 47.423 25.430 6.025 1.00 0.53 C ATOM 2634 CG1 VAL A 158 48.642 24.916 6.793 1.00 0.62 C ATOM 2635 CG2 VAL A 158 47.881 26.353 4.894 1.00 0.55 C ATOM 0 H VAL A 158 44.581 24.337 5.911 1.00 0.49 H new ATOM 0 HA VAL A 158 47.132 23.949 4.507 1.00 0.54 H new ATOM 0 HB VAL A 158 46.777 25.983 6.707 1.00 0.53 H new ATOM 0 HG11 VAL A 158 49.191 25.760 7.210 1.00 0.62 H new ATOM 0 HG12 VAL A 158 48.314 24.261 7.600 1.00 0.62 H new ATOM 0 HG13 VAL A 158 49.291 24.360 6.116 1.00 0.62 H new ATOM 0 HG21 VAL A 158 48.434 27.194 5.312 1.00 0.55 H new ATOM 0 HG22 VAL A 158 48.525 25.799 4.211 1.00 0.55 H new ATOM 0 HG23 VAL A 158 47.011 26.724 4.352 1.00 0.55 H new ATOM 2645 N ALA A 159 45.688 23.130 7.326 1.00 0.48 N ATOM 2646 CA ALA A 159 45.534 22.044 8.319 1.00 0.50 C ATOM 2647 C ALA A 159 44.197 21.386 8.079 1.00 0.49 C ATOM 2648 O ALA A 159 43.299 21.975 7.513 1.00 0.47 O ATOM 2649 CB ALA A 159 45.583 22.607 9.718 1.00 0.47 C ATOM 0 H ALA A 159 45.008 23.885 7.415 1.00 0.48 H new ATOM 0 HA ALA A 159 46.342 21.320 8.214 1.00 0.50 H new ATOM 0 HB1 ALA A 159 45.469 21.798 10.440 1.00 0.47 H new ATOM 0 HB2 ALA A 159 46.541 23.103 9.877 1.00 0.47 H new ATOM 0 HB3 ALA A 159 44.775 23.327 9.849 1.00 0.47 H new ATOM 2655 N PHE A 160 44.122 20.134 8.413 1.00 0.51 N ATOM 2656 CA PHE A 160 42.923 19.306 8.138 1.00 0.49 C ATOM 2657 C PHE A 160 43.226 18.724 6.777 1.00 0.48 C ATOM 2658 O PHE A 160 43.176 17.534 6.544 1.00 0.46 O ATOM 2659 CB PHE A 160 41.616 20.112 8.126 1.00 0.47 C ATOM 2660 CG PHE A 160 40.744 19.560 9.214 1.00 0.34 C ATOM 2661 CD1 PHE A 160 41.309 19.307 10.460 1.00 0.52 C ATOM 2662 CD2 PHE A 160 39.395 19.294 8.983 1.00 0.13 C ATOM 2663 CE1 PHE A 160 40.525 18.782 11.493 1.00 0.56 C ATOM 2664 CE2 PHE A 160 38.605 18.768 10.014 1.00 0.16 C ATOM 2665 CZ PHE A 160 39.170 18.513 11.269 1.00 0.41 C ATOM 0 H PHE A 160 44.874 19.631 8.885 1.00 0.51 H new ATOM 0 HA PHE A 160 42.754 18.558 8.913 1.00 0.49 H new ATOM 0 HB2 PHE A 160 41.815 21.171 8.293 1.00 0.47 H new ATOM 0 HB3 PHE A 160 41.122 20.029 7.158 1.00 0.47 H new ATOM 0 HD1 PHE A 160 42.355 19.516 10.630 1.00 0.52 H new ATOM 0 HD2 PHE A 160 38.961 19.492 8.014 1.00 0.13 H new ATOM 0 HE1 PHE A 160 40.964 18.585 12.460 1.00 0.56 H new ATOM 0 HE2 PHE A 160 37.560 18.559 9.840 1.00 0.16 H new ATOM 0 HZ PHE A 160 38.561 18.109 12.064 1.00 0.41 H new ATOM 2675 N GLU A 161 43.634 19.592 5.908 1.00 0.50 N ATOM 2676 CA GLU A 161 44.069 19.198 4.561 1.00 0.48 C ATOM 2677 C GLU A 161 45.593 19.121 4.600 1.00 0.24 C ATOM 2678 O GLU A 161 46.214 18.554 3.723 1.00 0.26 O ATOM 2679 CB GLU A 161 43.665 20.280 3.562 1.00 0.66 C ATOM 2680 CG GLU A 161 43.397 19.650 2.193 1.00 0.60 C ATOM 2681 CD GLU A 161 44.012 20.521 1.094 1.00 1.42 C ATOM 2682 OE1 GLU A 161 43.997 21.732 1.243 1.00 1.78 O ATOM 2683 OE2 GLU A 161 44.482 19.961 0.117 1.00 1.79 O ATOM 0 H GLU A 161 43.684 20.595 6.088 1.00 0.50 H new ATOM 0 HA GLU A 161 43.621 18.249 4.266 1.00 0.48 H new ATOM 0 HB2 GLU A 161 42.773 20.798 3.915 1.00 0.66 H new ATOM 0 HB3 GLU A 161 44.456 21.026 3.481 1.00 0.66 H new ATOM 0 HG2 GLU A 161 43.821 18.646 2.155 1.00 0.60 H new ATOM 0 HG3 GLU A 161 42.324 19.549 2.032 1.00 0.60 H new ATOM 2690 N GLY A 162 46.217 19.728 5.600 1.00 0.22 N ATOM 2691 CA GLY A 162 47.711 19.700 5.627 1.00 0.40 C ATOM 2692 C GLY A 162 48.306 19.224 6.973 1.00 0.53 C ATOM 2693 O GLY A 162 48.791 18.114 7.075 1.00 1.16 O ATOM 0 H GLY A 162 45.766 20.223 6.369 1.00 0.22 H new ATOM 0 HA2 GLY A 162 48.066 19.044 4.832 1.00 0.40 H new ATOM 0 HA3 GLY A 162 48.087 20.699 5.408 1.00 0.40 H new ATOM 2697 N CYS A 163 48.351 20.069 7.982 1.00 0.26 N ATOM 2698 CA CYS A 163 49.006 19.664 9.271 1.00 0.63 C ATOM 2699 C CYS A 163 48.434 18.349 9.836 1.00 0.74 C ATOM 2700 O CYS A 163 49.073 17.321 9.724 1.00 0.80 O ATOM 2701 CB CYS A 163 48.950 20.814 10.290 1.00 0.81 C ATOM 2702 SG CYS A 163 49.276 20.168 11.953 1.00 3.00 S ATOM 0 H CYS A 163 47.966 21.013 7.968 1.00 0.26 H new ATOM 0 HA CYS A 163 50.055 19.459 9.059 1.00 0.63 H new ATOM 0 HB2 CYS A 163 49.686 21.576 10.034 1.00 0.81 H new ATOM 0 HB3 CYS A 163 47.971 21.293 10.260 1.00 0.81 H new ATOM 0 HG CYS A 163 49.230 21.142 12.813 1.00 3.00 H new ATOM 2708 N PRO A 164 47.265 18.393 10.412 1.00 0.78 N ATOM 2709 CA PRO A 164 46.625 17.195 10.981 1.00 0.87 C ATOM 2710 C PRO A 164 46.250 16.223 9.870 1.00 0.61 C ATOM 2711 O PRO A 164 46.329 15.021 10.028 1.00 0.69 O ATOM 2712 CB PRO A 164 45.388 17.741 11.696 1.00 1.04 C ATOM 2713 CG PRO A 164 45.111 19.123 11.072 1.00 0.96 C ATOM 2714 CD PRO A 164 46.470 19.614 10.532 1.00 0.77 C ATOM 0 HA PRO A 164 47.273 16.639 11.658 1.00 0.87 H new ATOM 0 HB2 PRO A 164 44.535 17.075 11.563 1.00 1.04 H new ATOM 0 HB3 PRO A 164 45.563 17.825 12.769 1.00 1.04 H new ATOM 0 HG2 PRO A 164 44.374 19.051 10.272 1.00 0.96 H new ATOM 0 HG3 PRO A 164 44.711 19.815 11.813 1.00 0.96 H new ATOM 0 HD2 PRO A 164 46.360 20.115 9.570 1.00 0.77 H new ATOM 0 HD3 PRO A 164 46.935 20.328 11.212 1.00 0.77 H new ATOM 2722 N VAL A 165 45.856 16.729 8.741 1.00 0.35 N ATOM 2723 CA VAL A 165 45.496 15.808 7.617 1.00 0.22 C ATOM 2724 C VAL A 165 45.608 16.559 6.295 1.00 0.24 C ATOM 2725 O VAL A 165 44.791 16.316 5.424 1.00 0.31 O ATOM 2726 CB VAL A 165 44.068 15.262 7.799 1.00 0.26 C ATOM 2727 CG1 VAL A 165 44.131 13.847 8.376 1.00 0.21 C ATOM 2728 CG2 VAL A 165 43.283 16.146 8.767 1.00 0.46 C ATOM 2729 OXT VAL A 165 46.519 17.362 6.175 1.00 0.24 O ATOM 0 H VAL A 165 45.766 17.725 8.541 1.00 0.35 H new ATOM 0 HA VAL A 165 46.184 14.963 7.615 1.00 0.22 H new ATOM 0 HB VAL A 165 43.573 15.253 6.828 1.00 0.26 H new ATOM 0 HG11 VAL A 165 43.120 13.461 8.505 1.00 0.21 H new ATOM 0 HG12 VAL A 165 44.682 13.200 7.694 1.00 0.21 H new ATOM 0 HG13 VAL A 165 44.636 13.870 9.342 1.00 0.21 H new ATOM 0 HG21 VAL A 165 42.275 15.749 8.887 1.00 0.46 H new ATOM 0 HG22 VAL A 165 43.785 16.161 9.735 1.00 0.46 H new ATOM 0 HG23 VAL A 165 43.229 17.160 8.371 1.00 0.46 H new