USER MOD reduce.3.24.130724 H: found=0, std=0, add=1230, rem=0, adj=39 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 136 GLN : amide:sc= -0.217 K(o=-1.1,f=-3.1!) USER MOD Set 1.2: A 138 ASN :FLIP amide:sc= -0.898 F(o=-5!,f=-1.1) USER MOD Set 2.1: A 6 GLN :FLIP amide:sc= -2.86 F(o=-10!,f=-6.4) USER MOD Set 2.2: A 45 LYS NZ :NH3+ -175:sc= -1.8 (180deg=-0.167) USER MOD Set 2.3: A 46 CYS SG : rot 47:sc= -1.76! USER MOD Set 3.1: A 3 SER OG : rot -131:sc= 0.837 USER MOD Set 3.2: A 119 SER OG : rot -150:sc= -1.04 USER MOD Single : A 12 CYS SG : rot -41:sc= 1.71 USER MOD Single : A 16 TYR OH : rot 110:sc= 0.0566 USER MOD Single : A 18 MET CE :methyl -140:sc= -22! (180deg=-30.1!) USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 LYS NZ :NH3+ -163:sc= -0.0563 (180deg=-0.302) USER MOD Single : A 34 LYS NZ :NH3+ -169:sc= -1.7 (180deg=-2.43) USER MOD Single : A 39 CYS SG : rot -80:sc= -1.78! USER MOD Single : A 41 SER OG : rot -90:sc= 0.197 USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 LYS NZ :NH3+ 174:sc= -3.52! (180deg=-4.07!) USER MOD Single : A 63 THR OG1 : rot 180:sc= 0 USER MOD Single : A 65 THR OG1 : rot 180:sc= -0.187 USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 HIS :FLIP no HD1:sc= -14.6! C(o=-20!,f=-15!) USER MOD Single : A 74 MET CE :methyl 150:sc= -19! (180deg=-21.2!) USER MOD Single : A 78 LYS NZ :NH3+ -137:sc= -0.653 (180deg=-2.82!) USER MOD Single : A 80 CYS SG : rot 42:sc= -8.39! USER MOD Single : A 82 TYR OH : rot 148:sc= -3.33! USER MOD Single : A 85 TYR OH : rot 117:sc=0.000855 USER MOD Single : A 88 SER OG : rot 180:sc= -0.903 USER MOD Single : A 91 THR OG1 : rot 180:sc= -3.55! USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 SER OG : rot 94:sc= 0.621 USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 MET CE :methyl 179:sc= -10.8! (180deg=-10.9!) USER MOD Single : A 112 LYS NZ :NH3+ -175:sc= 0.192 (180deg=0.183) USER MOD Single : A 113 SER OG : rot 105:sc= -0.216! USER MOD Single : A 114 LYS NZ :NH3+ -148:sc= -0.908 (180deg=-2.22!) USER MOD Single : A 115 MET CE :methyl -149:sc= -0.111 (180deg=-1.19) USER MOD Single : A 117 TYR OH : rot -77:sc= -1.11 USER MOD Single : A 120 SER OG : rot -30:sc= -1.94 USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 129 GLN :FLIP amide:sc= -1.37 F(o=-2.6!,f=-1.4) USER MOD Single : A 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 133 HIS : no HE2:sc= -12.6! C(o=-13!,f=-16!) USER MOD Single : A 135 CYS SG : rot -129:sc=-0.00501 USER MOD Single : A 144 ASN : amide:sc= -6.25! C(o=-6.2!,f=-7.8!) USER MOD Single : A 147 CYS SG : rot 41:sc= 1.21 USER MOD Single : A 151 LYS NZ :NH3+ -159:sc= -1.1 (180deg=-1.97!) USER MOD Single : A 155 SER OG : rot 180:sc= 0 USER MOD Single : A 163 CYS SG : rot -130:sc= -2.15! USER MOD ----------------------------------------------------------------- ATOM 145 N SER A 3 8.266 19.019 5.784 1.00 0.94 N ATOM 146 CA SER A 3 9.422 19.893 6.137 1.00 0.84 C ATOM 147 C SER A 3 8.917 21.286 6.509 1.00 0.86 C ATOM 148 O SER A 3 8.811 22.162 5.673 1.00 0.88 O ATOM 149 CB SER A 3 10.359 20.004 4.935 1.00 0.95 C ATOM 150 OG SER A 3 10.086 18.948 4.026 1.00 1.27 O ATOM 0 HA SER A 3 9.956 19.461 6.983 1.00 0.84 H new ATOM 0 HB2 SER A 3 10.224 20.967 4.442 1.00 0.95 H new ATOM 0 HB3 SER A 3 11.397 19.957 5.264 1.00 0.95 H new ATOM 0 HG SER A 3 10.925 18.513 3.768 1.00 1.27 H new ATOM 156 N GLY A 4 8.605 21.502 7.757 1.00 0.93 N ATOM 157 CA GLY A 4 8.108 22.842 8.179 1.00 1.01 C ATOM 158 C GLY A 4 8.870 23.304 9.422 1.00 0.55 C ATOM 159 O GLY A 4 8.420 24.161 10.154 1.00 0.73 O ATOM 0 H GLY A 4 8.673 20.809 8.502 1.00 0.93 H new ATOM 0 HA2 GLY A 4 8.240 23.561 7.371 1.00 1.01 H new ATOM 0 HA3 GLY A 4 7.040 22.794 8.392 1.00 1.01 H new ATOM 163 N VAL A 5 10.023 22.746 9.664 1.00 0.42 N ATOM 164 CA VAL A 5 10.809 23.162 10.862 1.00 0.58 C ATOM 165 C VAL A 5 10.858 24.668 10.919 1.00 0.69 C ATOM 166 O VAL A 5 10.802 25.348 9.915 1.00 1.26 O ATOM 167 CB VAL A 5 12.229 22.633 10.821 1.00 0.80 C ATOM 168 CG1 VAL A 5 12.464 21.863 12.100 1.00 1.23 C ATOM 169 CG2 VAL A 5 12.433 21.714 9.622 1.00 2.30 C ATOM 0 H VAL A 5 10.455 22.023 9.088 1.00 0.42 H new ATOM 0 HA VAL A 5 10.317 22.750 11.743 1.00 0.58 H new ATOM 0 HB VAL A 5 12.931 23.461 10.727 1.00 0.80 H new ATOM 0 HG11 VAL A 5 13.479 21.467 12.105 1.00 1.23 H new ATOM 0 HG12 VAL A 5 12.330 22.527 12.954 1.00 1.23 H new ATOM 0 HG13 VAL A 5 11.753 21.040 12.165 1.00 1.23 H new ATOM 0 HG21 VAL A 5 13.460 21.348 9.615 1.00 2.30 H new ATOM 0 HG22 VAL A 5 11.747 20.870 9.690 1.00 2.30 H new ATOM 0 HG23 VAL A 5 12.239 22.267 8.703 1.00 2.30 H new ATOM 179 N GLN A 6 10.871 25.197 12.106 1.00 0.32 N ATOM 180 CA GLN A 6 10.814 26.662 12.242 1.00 0.30 C ATOM 181 C GLN A 6 11.981 27.191 13.051 1.00 0.21 C ATOM 182 O GLN A 6 11.958 28.305 13.533 1.00 0.27 O ATOM 183 CB GLN A 6 9.494 26.975 12.917 1.00 0.41 C ATOM 184 CG GLN A 6 8.572 25.783 12.654 1.00 0.88 C ATOM 185 CD GLN A 6 8.031 25.263 13.964 1.00 1.54 C ATOM 186 OE1 GLN A 6 8.866 24.667 14.740 1.00 2.01 O flip ATOM 187 NE2 GLN A 6 6.860 25.392 14.274 1.00 3.34 N flip ATOM 0 H GLN A 6 10.919 24.675 12.981 1.00 0.32 H new ATOM 0 HA GLN A 6 10.882 27.145 11.267 1.00 0.30 H new ATOM 0 HB2 GLN A 6 9.633 27.128 13.987 1.00 0.41 H new ATOM 0 HB3 GLN A 6 9.063 27.893 12.517 1.00 0.41 H new ATOM 0 HG2 GLN A 6 7.751 26.082 12.003 1.00 0.88 H new ATOM 0 HG3 GLN A 6 9.118 24.995 12.136 1.00 0.88 H new ATOM 0 HE21 GLN A 6 6.215 25.868 13.643 1.00 3.34 H new ATOM 0 HE22 GLN A 6 6.525 25.024 15.164 1.00 3.34 H new ATOM 196 N VAL A 7 13.017 26.425 13.177 1.00 0.21 N ATOM 197 CA VAL A 7 14.196 26.944 13.940 1.00 0.21 C ATOM 198 C VAL A 7 13.758 27.366 15.338 1.00 0.22 C ATOM 199 O VAL A 7 12.599 27.584 15.618 1.00 0.38 O ATOM 200 CB VAL A 7 14.740 28.133 13.149 1.00 0.33 C ATOM 201 CG1 VAL A 7 15.978 28.735 13.812 1.00 2.62 C ATOM 202 CG2 VAL A 7 15.099 27.668 11.738 1.00 2.80 C ATOM 0 H VAL A 7 13.109 25.482 12.799 1.00 0.21 H new ATOM 0 HA VAL A 7 14.968 26.184 14.058 1.00 0.21 H new ATOM 0 HB VAL A 7 13.969 28.903 13.117 1.00 0.33 H new ATOM 0 HG11 VAL A 7 16.335 29.578 13.220 1.00 2.62 H new ATOM 0 HG12 VAL A 7 15.723 29.078 14.815 1.00 2.62 H new ATOM 0 HG13 VAL A 7 16.761 27.979 13.875 1.00 2.62 H new ATOM 0 HG21 VAL A 7 15.488 28.510 11.165 1.00 2.80 H new ATOM 0 HG22 VAL A 7 15.856 26.886 11.794 1.00 2.80 H new ATOM 0 HG23 VAL A 7 14.209 27.276 11.247 1.00 2.80 H new ATOM 212 N ALA A 8 14.693 27.413 16.224 1.00 0.35 N ATOM 213 CA ALA A 8 14.396 27.734 17.639 1.00 0.29 C ATOM 214 C ALA A 8 15.022 29.072 18.059 1.00 0.21 C ATOM 215 O ALA A 8 14.837 29.526 19.168 1.00 0.21 O ATOM 216 CB ALA A 8 15.014 26.600 18.440 1.00 0.24 C ATOM 0 H ALA A 8 15.678 27.238 16.026 1.00 0.35 H new ATOM 0 HA ALA A 8 13.323 27.831 17.803 1.00 0.29 H new ATOM 0 HB1 ALA A 8 14.836 26.766 19.502 1.00 0.24 H new ATOM 0 HB2 ALA A 8 14.563 25.654 18.140 1.00 0.24 H new ATOM 0 HB3 ALA A 8 16.087 26.565 18.253 1.00 0.24 H new ATOM 222 N ASP A 9 15.776 29.685 17.190 1.00 0.25 N ATOM 223 CA ASP A 9 16.452 30.977 17.519 1.00 0.26 C ATOM 224 C ASP A 9 17.751 30.663 18.245 1.00 0.18 C ATOM 225 O ASP A 9 18.789 31.219 17.947 1.00 0.23 O ATOM 226 CB ASP A 9 15.579 31.857 18.399 1.00 0.34 C ATOM 227 CG ASP A 9 14.161 31.927 17.823 1.00 0.44 C ATOM 228 OD1 ASP A 9 13.859 31.135 16.945 1.00 1.02 O ATOM 229 OD2 ASP A 9 13.405 32.777 18.264 1.00 1.40 O ATOM 0 H ASP A 9 15.957 29.341 16.247 1.00 0.25 H new ATOM 0 HA ASP A 9 16.643 31.521 16.594 1.00 0.26 H new ATOM 0 HB2 ASP A 9 15.550 31.457 19.413 1.00 0.34 H new ATOM 0 HB3 ASP A 9 16.005 32.858 18.463 1.00 0.34 H new ATOM 234 N GLU A 10 17.724 29.737 19.165 1.00 0.27 N ATOM 235 CA GLU A 10 18.985 29.361 19.837 1.00 0.39 C ATOM 236 C GLU A 10 19.921 28.891 18.727 1.00 0.35 C ATOM 237 O GLU A 10 21.123 28.853 18.879 1.00 0.38 O ATOM 238 CB GLU A 10 18.721 28.234 20.851 1.00 0.66 C ATOM 239 CG GLU A 10 19.629 27.026 20.580 1.00 0.86 C ATOM 240 CD GLU A 10 19.781 26.213 21.867 1.00 1.34 C ATOM 241 OE1 GLU A 10 18.768 25.900 22.471 1.00 2.04 O ATOM 242 OE2 GLU A 10 20.909 25.917 22.227 1.00 1.05 O ATOM 0 H GLU A 10 16.891 29.234 19.473 1.00 0.27 H new ATOM 0 HA GLU A 10 19.421 30.193 20.391 1.00 0.39 H new ATOM 0 HB2 GLU A 10 18.892 28.603 21.862 1.00 0.66 H new ATOM 0 HB3 GLU A 10 17.676 27.928 20.796 1.00 0.66 H new ATOM 0 HG2 GLU A 10 19.203 26.405 19.792 1.00 0.86 H new ATOM 0 HG3 GLU A 10 20.605 27.361 20.230 1.00 0.86 H new ATOM 249 N VAL A 11 19.357 28.553 17.590 1.00 0.37 N ATOM 250 CA VAL A 11 20.198 28.107 16.445 1.00 0.52 C ATOM 251 C VAL A 11 20.950 29.302 15.911 1.00 0.47 C ATOM 252 O VAL A 11 22.112 29.231 15.574 1.00 0.56 O ATOM 253 CB VAL A 11 19.352 27.508 15.317 1.00 0.66 C ATOM 254 CG1 VAL A 11 17.880 27.507 15.693 1.00 1.92 C ATOM 255 CG2 VAL A 11 19.542 28.320 14.035 1.00 0.92 C ATOM 0 H VAL A 11 18.353 28.568 17.411 1.00 0.37 H new ATOM 0 HA VAL A 11 20.881 27.335 16.799 1.00 0.52 H new ATOM 0 HB VAL A 11 19.678 26.481 15.155 1.00 0.66 H new ATOM 0 HG11 VAL A 11 17.297 27.078 14.878 1.00 1.92 H new ATOM 0 HG12 VAL A 11 17.735 26.913 16.595 1.00 1.92 H new ATOM 0 HG13 VAL A 11 17.550 28.530 15.875 1.00 1.92 H new ATOM 0 HG21 VAL A 11 18.937 27.888 13.238 1.00 0.92 H new ATOM 0 HG22 VAL A 11 19.232 29.351 14.208 1.00 0.92 H new ATOM 0 HG23 VAL A 11 20.592 28.301 13.745 1.00 0.92 H new ATOM 265 N CYS A 12 20.298 30.417 15.860 1.00 0.42 N ATOM 266 CA CYS A 12 20.978 31.645 15.376 1.00 0.55 C ATOM 267 C CYS A 12 22.052 32.056 16.385 1.00 0.42 C ATOM 268 O CYS A 12 22.715 33.055 16.214 1.00 0.49 O ATOM 269 CB CYS A 12 19.951 32.770 15.249 1.00 0.68 C ATOM 270 SG CYS A 12 20.776 34.301 14.750 1.00 0.48 S ATOM 0 H CYS A 12 19.322 30.536 16.132 1.00 0.42 H new ATOM 0 HA CYS A 12 21.438 31.454 14.406 1.00 0.55 H new ATOM 0 HB2 CYS A 12 19.191 32.500 14.515 1.00 0.68 H new ATOM 0 HB3 CYS A 12 19.438 32.916 16.200 1.00 0.68 H new ATOM 0 HG CYS A 12 21.902 34.416 15.390 1.00 0.48 H new ATOM 276 N ARG A 13 22.253 31.283 17.422 1.00 0.31 N ATOM 277 CA ARG A 13 23.299 31.625 18.414 1.00 0.32 C ATOM 278 C ARG A 13 24.363 30.560 18.331 1.00 0.30 C ATOM 279 O ARG A 13 25.465 30.732 18.799 1.00 0.49 O ATOM 280 CB ARG A 13 22.727 31.635 19.825 1.00 0.35 C ATOM 281 CG ARG A 13 22.950 30.271 20.483 1.00 2.64 C ATOM 282 CD ARG A 13 24.335 30.249 21.122 1.00 4.15 C ATOM 283 NE ARG A 13 24.246 29.664 22.490 1.00 4.65 N ATOM 284 CZ ARG A 13 24.436 28.383 22.669 1.00 6.23 C ATOM 285 NH1 ARG A 13 23.935 27.525 21.822 1.00 8.19 N ATOM 286 NH2 ARG A 13 25.128 27.961 23.691 1.00 6.15 N ATOM 0 H ARG A 13 21.732 30.428 17.619 1.00 0.31 H new ATOM 0 HA ARG A 13 23.699 32.616 18.199 1.00 0.32 H new ATOM 0 HB2 ARG A 13 23.205 32.417 20.416 1.00 0.35 H new ATOM 0 HB3 ARG A 13 21.662 31.865 19.794 1.00 0.35 H new ATOM 0 HG2 ARG A 13 22.185 30.087 21.237 1.00 2.64 H new ATOM 0 HG3 ARG A 13 22.865 29.477 19.741 1.00 2.64 H new ATOM 0 HD2 ARG A 13 25.020 29.663 20.509 1.00 4.15 H new ATOM 0 HD3 ARG A 13 24.739 31.260 21.174 1.00 4.15 H new ATOM 0 HE ARG A 13 24.037 30.264 23.288 1.00 4.65 H new ATOM 0 HH11 ARG A 13 23.396 27.854 21.021 1.00 8.19 H new ATOM 0 HH12 ARG A 13 24.083 26.525 21.961 1.00 8.19 H new ATOM 0 HH21 ARG A 13 25.522 28.631 24.352 1.00 6.15 H new ATOM 0 HH22 ARG A 13 25.275 26.961 23.829 1.00 6.15 H new ATOM 300 N ILE A 14 24.032 29.451 17.733 1.00 0.25 N ATOM 301 CA ILE A 14 25.016 28.371 17.602 1.00 0.36 C ATOM 302 C ILE A 14 26.112 28.854 16.678 1.00 0.48 C ATOM 303 O ILE A 14 27.266 28.927 17.032 1.00 0.59 O ATOM 304 CB ILE A 14 24.383 27.161 16.942 1.00 0.49 C ATOM 305 CG1 ILE A 14 23.057 26.771 17.566 1.00 0.52 C ATOM 306 CG2 ILE A 14 25.348 25.994 17.062 1.00 0.67 C ATOM 307 CD1 ILE A 14 22.341 25.843 16.568 1.00 0.92 C ATOM 0 H ILE A 14 23.115 29.256 17.331 1.00 0.25 H new ATOM 0 HA ILE A 14 25.392 28.105 18.590 1.00 0.36 H new ATOM 0 HB ILE A 14 24.183 27.417 15.902 1.00 0.49 H new ATOM 0 HG12 ILE A 14 23.214 26.264 18.518 1.00 0.52 H new ATOM 0 HG13 ILE A 14 22.453 27.655 17.771 1.00 0.52 H new ATOM 0 HG21 ILE A 14 24.912 25.112 16.593 1.00 0.67 H new ATOM 0 HG22 ILE A 14 26.285 26.244 16.564 1.00 0.67 H new ATOM 0 HG23 ILE A 14 25.540 25.788 18.115 1.00 0.67 H new ATOM 0 HD11 ILE A 14 21.379 25.538 16.980 1.00 0.92 H new ATOM 0 HD12 ILE A 14 22.182 26.372 15.629 1.00 0.92 H new ATOM 0 HD13 ILE A 14 22.954 24.960 16.388 1.00 0.92 H new ATOM 319 N PHE A 15 25.741 29.205 15.490 1.00 0.51 N ATOM 320 CA PHE A 15 26.735 29.729 14.537 1.00 0.56 C ATOM 321 C PHE A 15 27.442 30.859 15.291 1.00 0.54 C ATOM 322 O PHE A 15 28.648 30.879 15.445 1.00 1.20 O ATOM 323 CB PHE A 15 25.968 30.203 13.298 1.00 0.56 C ATOM 324 CG PHE A 15 26.392 31.577 12.879 1.00 0.68 C ATOM 325 CD1 PHE A 15 27.668 31.802 12.351 1.00 1.14 C ATOM 326 CD2 PHE A 15 25.486 32.624 12.996 1.00 0.96 C ATOM 327 CE1 PHE A 15 28.030 33.089 11.939 1.00 1.18 C ATOM 328 CE2 PHE A 15 25.844 33.903 12.591 1.00 1.28 C ATOM 329 CZ PHE A 15 27.115 34.143 12.060 1.00 1.13 C ATOM 0 H PHE A 15 24.786 29.151 15.137 1.00 0.51 H new ATOM 0 HA PHE A 15 27.478 29.009 14.193 1.00 0.56 H new ATOM 0 HB2 PHE A 15 26.134 29.505 12.478 1.00 0.56 H new ATOM 0 HB3 PHE A 15 24.898 30.200 13.508 1.00 0.56 H new ATOM 0 HD1 PHE A 15 28.370 30.986 12.262 1.00 1.14 H new ATOM 0 HD2 PHE A 15 24.502 32.443 13.403 1.00 0.96 H new ATOM 0 HE1 PHE A 15 29.013 33.270 11.529 1.00 1.18 H new ATOM 0 HE2 PHE A 15 25.138 34.715 12.686 1.00 1.28 H new ATOM 0 HZ PHE A 15 27.391 35.138 11.744 1.00 1.13 H new ATOM 339 N TYR A 16 26.665 31.753 15.831 1.00 0.47 N ATOM 340 CA TYR A 16 27.198 32.860 16.675 1.00 0.38 C ATOM 341 C TYR A 16 28.148 32.340 17.761 1.00 0.47 C ATOM 342 O TYR A 16 29.007 33.055 18.240 1.00 0.54 O ATOM 343 CB TYR A 16 26.033 33.400 17.481 1.00 0.19 C ATOM 344 CG TYR A 16 25.196 34.383 16.712 1.00 2.41 C ATOM 345 CD1 TYR A 16 25.555 34.800 15.429 1.00 3.86 C ATOM 346 CD2 TYR A 16 24.039 34.880 17.314 1.00 3.66 C ATOM 347 CE1 TYR A 16 24.748 35.719 14.750 1.00 6.20 C ATOM 348 CE2 TYR A 16 23.235 35.791 16.639 1.00 5.96 C ATOM 349 CZ TYR A 16 23.587 36.215 15.356 1.00 7.18 C ATOM 350 OH TYR A 16 22.790 37.120 14.685 1.00 9.55 O ATOM 0 H TYR A 16 25.651 31.763 15.719 1.00 0.47 H new ATOM 0 HA TYR A 16 27.695 33.571 16.015 1.00 0.38 H new ATOM 0 HB2 TYR A 16 25.405 32.570 17.803 1.00 0.19 H new ATOM 0 HB3 TYR A 16 26.413 33.881 18.382 1.00 0.19 H new ATOM 0 HD1 TYR A 16 26.450 34.415 14.963 1.00 3.86 H new ATOM 0 HD2 TYR A 16 23.768 34.556 18.308 1.00 3.66 H new ATOM 0 HE1 TYR A 16 25.021 36.046 13.758 1.00 6.20 H new ATOM 0 HE2 TYR A 16 22.339 36.171 17.107 1.00 5.96 H new ATOM 0 HH TYR A 16 21.946 36.689 14.434 1.00 9.55 H new ATOM 360 N ASP A 17 27.932 31.137 18.227 1.00 0.47 N ATOM 361 CA ASP A 17 28.753 30.631 19.369 1.00 0.56 C ATOM 362 C ASP A 17 30.145 30.249 18.914 1.00 0.53 C ATOM 363 O ASP A 17 31.132 30.560 19.549 1.00 0.89 O ATOM 364 CB ASP A 17 28.070 29.404 19.982 1.00 0.56 C ATOM 365 CG ASP A 17 27.563 29.744 21.387 1.00 0.64 C ATOM 366 OD1 ASP A 17 27.843 30.838 21.850 1.00 0.90 O ATOM 367 OD2 ASP A 17 26.904 28.903 21.977 1.00 0.76 O ATOM 0 H ASP A 17 27.230 30.488 17.871 1.00 0.47 H new ATOM 0 HA ASP A 17 28.837 31.427 20.109 1.00 0.56 H new ATOM 0 HB2 ASP A 17 27.239 29.086 19.352 1.00 0.56 H new ATOM 0 HB3 ASP A 17 28.771 28.571 20.030 1.00 0.56 H new ATOM 372 N MET A 18 30.228 29.564 17.832 1.00 0.27 N ATOM 373 CA MET A 18 31.553 29.132 17.336 1.00 0.29 C ATOM 374 C MET A 18 32.087 30.143 16.314 1.00 0.38 C ATOM 375 O MET A 18 32.954 29.838 15.520 1.00 0.43 O ATOM 376 CB MET A 18 31.427 27.753 16.707 1.00 0.28 C ATOM 377 CG MET A 18 30.008 27.550 16.159 1.00 0.30 C ATOM 378 SD MET A 18 28.972 26.892 17.472 1.00 0.32 S ATOM 379 CE MET A 18 29.942 25.406 17.668 1.00 0.30 C ATOM 0 H MET A 18 29.434 29.278 17.259 1.00 0.27 H new ATOM 0 HA MET A 18 32.256 29.082 18.167 1.00 0.29 H new ATOM 0 HB2 MET A 18 32.155 27.644 15.903 1.00 0.28 H new ATOM 0 HB3 MET A 18 31.652 26.985 17.447 1.00 0.28 H new ATOM 0 HG2 MET A 18 29.604 28.495 15.797 1.00 0.30 H new ATOM 0 HG3 MET A 18 30.025 26.865 15.311 1.00 0.30 H new ATOM 0 HE1 MET A 18 29.278 24.557 17.829 1.00 0.30 H new ATOM 0 HE2 MET A 18 30.535 25.238 16.769 1.00 0.30 H new ATOM 0 HE3 MET A 18 30.606 25.515 18.526 1.00 0.30 H new ATOM 553 N ILE A 29 34.860 28.522 29.057 1.00 1.84 N ATOM 554 CA ILE A 29 34.094 28.690 27.854 1.00 1.79 C ATOM 555 C ILE A 29 33.866 27.336 27.207 1.00 1.85 C ATOM 556 O ILE A 29 32.817 27.045 26.704 1.00 1.91 O ATOM 557 CB ILE A 29 35.005 29.487 27.035 1.00 1.92 C ATOM 558 CG1 ILE A 29 34.548 30.948 27.053 1.00 1.85 C ATOM 559 CG2 ILE A 29 35.061 28.846 25.692 1.00 1.97 C ATOM 560 CD1 ILE A 29 34.106 31.283 28.463 1.00 1.78 C ATOM 0 HA ILE A 29 33.113 29.142 27.999 1.00 1.79 H new ATOM 0 HB ILE A 29 36.026 29.512 27.416 1.00 1.92 H new ATOM 0 HG12 ILE A 29 35.360 31.605 26.742 1.00 1.85 H new ATOM 0 HG13 ILE A 29 33.728 31.100 26.351 1.00 1.85 H new ATOM 0 HG21 ILE A 29 35.733 29.412 25.047 1.00 1.97 H new ATOM 0 HG22 ILE A 29 35.428 27.824 25.791 1.00 1.97 H new ATOM 0 HG23 ILE A 29 34.063 28.832 25.254 1.00 1.97 H new ATOM 0 HD11 ILE A 29 33.775 32.321 28.504 1.00 1.78 H new ATOM 0 HD12 ILE A 29 33.284 30.628 28.752 1.00 1.78 H new ATOM 0 HD13 ILE A 29 34.941 31.142 29.149 1.00 1.78 H new ATOM 572 N LYS A 30 34.864 26.511 27.220 1.00 1.86 N ATOM 573 CA LYS A 30 34.714 25.161 26.633 1.00 1.96 C ATOM 574 C LYS A 30 33.424 24.600 27.180 1.00 1.65 C ATOM 575 O LYS A 30 32.625 23.999 26.501 1.00 1.40 O ATOM 576 CB LYS A 30 35.838 24.236 27.124 1.00 2.41 C ATOM 577 CG LYS A 30 37.100 25.030 27.483 1.00 2.23 C ATOM 578 CD LYS A 30 38.212 24.058 27.877 1.00 2.72 C ATOM 579 CE LYS A 30 38.021 23.640 29.336 1.00 2.59 C ATOM 580 NZ LYS A 30 37.606 22.210 29.396 1.00 3.88 N ATOM 0 H LYS A 30 35.783 26.714 27.614 1.00 1.86 H new ATOM 0 HA LYS A 30 34.736 25.223 25.545 1.00 1.96 H new ATOM 0 HB2 LYS A 30 35.497 23.678 27.996 1.00 2.41 H new ATOM 0 HB3 LYS A 30 36.074 23.505 26.350 1.00 2.41 H new ATOM 0 HG2 LYS A 30 37.415 25.637 26.634 1.00 2.23 H new ATOM 0 HG3 LYS A 30 36.891 25.715 28.305 1.00 2.23 H new ATOM 0 HD2 LYS A 30 38.192 23.181 27.229 1.00 2.72 H new ATOM 0 HD3 LYS A 30 39.186 24.529 27.746 1.00 2.72 H new ATOM 0 HE2 LYS A 30 38.948 23.784 29.890 1.00 2.59 H new ATOM 0 HE3 LYS A 30 37.266 24.268 29.809 1.00 2.59 H new ATOM 0 HZ1 LYS A 30 37.477 21.927 30.388 1.00 3.88 H new ATOM 0 HZ2 LYS A 30 36.711 22.086 28.881 1.00 3.88 H new ATOM 0 HZ3 LYS A 30 38.341 21.617 28.960 1.00 3.88 H new ATOM 594 N LYS A 31 33.245 24.821 28.438 1.00 1.72 N ATOM 595 CA LYS A 31 32.028 24.310 29.148 1.00 1.58 C ATOM 596 C LYS A 31 30.866 25.280 28.973 1.00 1.25 C ATOM 597 O LYS A 31 29.982 25.368 29.801 1.00 1.05 O ATOM 598 CB LYS A 31 32.329 24.145 30.641 1.00 1.89 C ATOM 599 CG LYS A 31 33.402 23.072 30.840 1.00 1.27 C ATOM 600 CD LYS A 31 32.742 21.752 31.247 1.00 2.76 C ATOM 601 CE LYS A 31 33.666 20.588 30.883 1.00 2.46 C ATOM 602 NZ LYS A 31 33.352 19.409 31.740 1.00 2.70 N ATOM 0 H LYS A 31 33.894 25.342 29.027 1.00 1.72 H new ATOM 0 HA LYS A 31 31.755 23.345 28.720 1.00 1.58 H new ATOM 0 HB2 LYS A 31 32.668 25.093 31.060 1.00 1.89 H new ATOM 0 HB3 LYS A 31 31.421 23.867 31.176 1.00 1.89 H new ATOM 0 HG2 LYS A 31 33.970 22.937 29.920 1.00 1.27 H new ATOM 0 HG3 LYS A 31 34.109 23.388 31.607 1.00 1.27 H new ATOM 0 HD2 LYS A 31 32.540 21.749 32.318 1.00 2.76 H new ATOM 0 HD3 LYS A 31 31.783 21.641 30.741 1.00 2.76 H new ATOM 0 HE2 LYS A 31 33.543 20.328 29.832 1.00 2.46 H new ATOM 0 HE3 LYS A 31 34.707 20.881 31.019 1.00 2.46 H new ATOM 0 HZ1 LYS A 31 33.982 18.620 31.490 1.00 2.70 H new ATOM 0 HZ2 LYS A 31 33.491 19.660 32.740 1.00 2.70 H new ATOM 0 HZ3 LYS A 31 32.363 19.124 31.589 1.00 2.70 H new ATOM 616 N ARG A 32 30.849 25.983 27.888 1.00 1.42 N ATOM 617 CA ARG A 32 29.745 26.923 27.619 1.00 1.14 C ATOM 618 C ARG A 32 28.913 26.336 26.482 1.00 0.93 C ATOM 619 O ARG A 32 27.905 26.882 26.079 1.00 0.72 O ATOM 620 CB ARG A 32 30.310 28.293 27.219 1.00 1.19 C ATOM 621 CG ARG A 32 30.744 29.080 28.470 1.00 1.34 C ATOM 622 CD ARG A 32 31.733 28.253 29.310 1.00 1.67 C ATOM 623 NE ARG A 32 31.029 27.641 30.476 1.00 1.61 N ATOM 624 CZ ARG A 32 30.094 28.305 31.100 1.00 1.86 C ATOM 625 NH1 ARG A 32 30.310 29.535 31.479 1.00 1.28 N ATOM 626 NH2 ARG A 32 28.938 27.743 31.330 1.00 3.87 N ATOM 0 H ARG A 32 31.566 25.945 27.164 1.00 1.42 H new ATOM 0 HA ARG A 32 29.128 27.063 28.507 1.00 1.14 H new ATOM 0 HB2 ARG A 32 31.161 28.162 26.551 1.00 1.19 H new ATOM 0 HB3 ARG A 32 29.557 28.858 26.669 1.00 1.19 H new ATOM 0 HG2 ARG A 32 31.208 30.020 28.173 1.00 1.34 H new ATOM 0 HG3 ARG A 32 29.870 29.332 29.070 1.00 1.34 H new ATOM 0 HD2 ARG A 32 32.181 27.472 28.695 1.00 1.67 H new ATOM 0 HD3 ARG A 32 32.546 28.889 29.659 1.00 1.67 H new ATOM 0 HE ARG A 32 31.279 26.702 30.786 1.00 1.61 H new ATOM 0 HH11 ARG A 32 31.209 29.977 31.288 1.00 1.28 H new ATOM 0 HH12 ARG A 32 29.580 30.054 31.967 1.00 1.28 H new ATOM 0 HH21 ARG A 32 28.766 26.786 31.022 1.00 3.87 H new ATOM 0 HH22 ARG A 32 28.207 28.261 31.817 1.00 3.87 H new ATOM 640 N LYS A 33 29.333 25.203 25.981 1.00 1.00 N ATOM 641 CA LYS A 33 28.582 24.534 24.884 1.00 0.84 C ATOM 642 C LYS A 33 28.533 25.424 23.650 1.00 0.62 C ATOM 643 O LYS A 33 27.872 26.443 23.621 1.00 0.53 O ATOM 644 CB LYS A 33 27.159 24.229 25.354 1.00 0.83 C ATOM 645 CG LYS A 33 26.269 23.951 24.142 1.00 0.68 C ATOM 646 CD LYS A 33 25.434 22.695 24.401 1.00 1.62 C ATOM 647 CE LYS A 33 24.024 23.096 24.837 1.00 2.12 C ATOM 648 NZ LYS A 33 24.100 23.928 26.072 1.00 2.67 N ATOM 0 H LYS A 33 30.171 24.711 26.290 1.00 1.00 H new ATOM 0 HA LYS A 33 29.091 23.606 24.624 1.00 0.84 H new ATOM 0 HB2 LYS A 33 27.162 23.367 26.021 1.00 0.83 H new ATOM 0 HB3 LYS A 33 26.764 25.071 25.923 1.00 0.83 H new ATOM 0 HG2 LYS A 33 25.616 24.803 23.954 1.00 0.68 H new ATOM 0 HG3 LYS A 33 26.882 23.816 23.251 1.00 0.68 H new ATOM 0 HD2 LYS A 33 25.387 22.085 23.499 1.00 1.62 H new ATOM 0 HD3 LYS A 33 25.905 22.086 25.173 1.00 1.62 H new ATOM 0 HE2 LYS A 33 23.531 23.653 24.041 1.00 2.12 H new ATOM 0 HE3 LYS A 33 23.423 22.206 25.022 1.00 2.12 H new ATOM 0 HZ1 LYS A 33 23.166 23.960 26.527 1.00 2.67 H new ATOM 0 HZ2 LYS A 33 24.791 23.512 26.729 1.00 2.67 H new ATOM 0 HZ3 LYS A 33 24.396 24.893 25.823 1.00 2.67 H new ATOM 662 N LYS A 34 29.209 25.018 22.618 1.00 0.53 N ATOM 663 CA LYS A 34 29.201 25.787 21.359 1.00 0.35 C ATOM 664 C LYS A 34 28.976 24.782 20.260 1.00 0.20 C ATOM 665 O LYS A 34 28.052 24.903 19.492 1.00 0.15 O ATOM 666 CB LYS A 34 30.534 26.493 21.177 1.00 0.52 C ATOM 667 CG LYS A 34 30.915 27.139 22.500 1.00 0.58 C ATOM 668 CD LYS A 34 32.335 27.675 22.413 1.00 0.92 C ATOM 669 CE LYS A 34 32.716 28.279 23.755 1.00 1.35 C ATOM 670 NZ LYS A 34 31.540 28.982 24.345 1.00 2.91 N ATOM 0 H LYS A 34 29.775 24.170 22.598 1.00 0.53 H new ATOM 0 HA LYS A 34 28.425 26.553 21.355 1.00 0.35 H new ATOM 0 HB2 LYS A 34 31.301 25.783 20.866 1.00 0.52 H new ATOM 0 HB3 LYS A 34 30.461 27.247 20.393 1.00 0.52 H new ATOM 0 HG2 LYS A 34 30.223 27.948 22.734 1.00 0.58 H new ATOM 0 HG3 LYS A 34 30.839 26.411 23.308 1.00 0.58 H new ATOM 0 HD2 LYS A 34 33.025 26.873 22.151 1.00 0.92 H new ATOM 0 HD3 LYS A 34 32.407 28.427 21.627 1.00 0.92 H new ATOM 0 HE2 LYS A 34 33.061 27.497 24.431 1.00 1.35 H new ATOM 0 HE3 LYS A 34 33.543 28.978 23.628 1.00 1.35 H new ATOM 0 HZ1 LYS A 34 31.847 29.547 25.162 1.00 2.91 H new ATOM 0 HZ2 LYS A 34 31.116 29.608 23.631 1.00 2.91 H new ATOM 0 HZ3 LYS A 34 30.836 28.282 24.653 1.00 2.91 H new ATOM 684 N ALA A 35 29.779 23.745 20.239 1.00 0.26 N ATOM 685 CA ALA A 35 29.606 22.670 19.264 1.00 0.23 C ATOM 686 C ALA A 35 28.278 22.071 19.555 1.00 0.30 C ATOM 687 O ALA A 35 27.838 22.030 20.683 1.00 0.33 O ATOM 688 CB ALA A 35 30.673 21.626 19.459 1.00 0.27 C ATOM 0 H ALA A 35 30.561 23.614 20.881 1.00 0.26 H new ATOM 0 HA ALA A 35 29.675 23.042 18.242 1.00 0.23 H new ATOM 0 HB1 ALA A 35 30.538 20.828 18.729 1.00 0.27 H new ATOM 0 HB2 ALA A 35 31.655 22.080 19.324 1.00 0.27 H new ATOM 0 HB3 ALA A 35 30.599 21.214 20.465 1.00 0.27 H new ATOM 694 N VAL A 36 27.607 21.680 18.561 1.00 0.35 N ATOM 695 CA VAL A 36 26.241 21.170 18.817 1.00 0.42 C ATOM 696 C VAL A 36 25.600 20.468 17.645 1.00 0.43 C ATOM 697 O VAL A 36 25.771 20.831 16.504 1.00 0.34 O ATOM 698 CB VAL A 36 25.363 22.376 19.075 1.00 0.45 C ATOM 699 CG1 VAL A 36 25.253 22.687 20.569 1.00 0.75 C ATOM 700 CG2 VAL A 36 25.927 23.582 18.335 1.00 0.28 C ATOM 0 H VAL A 36 27.916 21.681 17.589 1.00 0.35 H new ATOM 0 HA VAL A 36 26.327 20.458 19.638 1.00 0.42 H new ATOM 0 HB VAL A 36 24.361 22.150 18.710 1.00 0.45 H new ATOM 0 HG11 VAL A 36 24.615 23.559 20.713 1.00 0.75 H new ATOM 0 HG12 VAL A 36 24.821 21.831 21.088 1.00 0.75 H new ATOM 0 HG13 VAL A 36 26.245 22.893 20.972 1.00 0.75 H new ATOM 0 HG21 VAL A 36 25.295 24.451 18.520 1.00 0.28 H new ATOM 0 HG22 VAL A 36 26.938 23.786 18.689 1.00 0.28 H new ATOM 0 HG23 VAL A 36 25.952 23.373 17.265 1.00 0.28 H new ATOM 710 N ILE A 37 24.728 19.556 17.958 1.00 0.51 N ATOM 711 CA ILE A 37 23.917 18.922 16.937 1.00 0.50 C ATOM 712 C ILE A 37 22.541 19.501 17.224 1.00 0.45 C ATOM 713 O ILE A 37 22.359 20.165 18.224 1.00 1.10 O ATOM 714 CB ILE A 37 23.899 17.410 17.109 1.00 0.44 C ATOM 715 CG1 ILE A 37 25.149 16.772 16.470 1.00 0.60 C ATOM 716 CG2 ILE A 37 22.638 16.890 16.442 1.00 0.41 C ATOM 717 CD1 ILE A 37 25.896 15.886 17.498 1.00 0.57 C ATOM 0 H ILE A 37 24.553 19.228 18.908 1.00 0.51 H new ATOM 0 HA ILE A 37 24.277 19.099 15.924 1.00 0.50 H new ATOM 0 HB ILE A 37 23.908 17.150 18.168 1.00 0.44 H new ATOM 0 HG12 ILE A 37 24.857 16.171 15.609 1.00 0.60 H new ATOM 0 HG13 ILE A 37 25.815 17.553 16.103 1.00 0.60 H new ATOM 0 HG21 ILE A 37 22.592 15.806 16.546 1.00 0.41 H new ATOM 0 HG22 ILE A 37 21.765 17.338 16.916 1.00 0.41 H new ATOM 0 HG23 ILE A 37 22.651 17.153 15.384 1.00 0.41 H new ATOM 0 HD11 ILE A 37 26.775 15.445 17.028 1.00 0.57 H new ATOM 0 HD12 ILE A 37 26.206 16.496 18.347 1.00 0.57 H new ATOM 0 HD13 ILE A 37 25.233 15.093 17.844 1.00 0.57 H new ATOM 729 N PHE A 38 21.580 19.308 16.405 1.00 0.87 N ATOM 730 CA PHE A 38 20.272 19.903 16.707 1.00 0.61 C ATOM 731 C PHE A 38 19.203 18.918 16.181 1.00 0.42 C ATOM 732 O PHE A 38 19.333 18.415 15.084 1.00 1.20 O ATOM 733 CB PHE A 38 20.244 21.283 16.009 1.00 0.91 C ATOM 734 CG PHE A 38 20.671 22.386 16.988 1.00 1.17 C ATOM 735 CD1 PHE A 38 22.027 22.629 17.344 1.00 0.89 C ATOM 736 CD2 PHE A 38 19.678 23.162 17.561 1.00 3.23 C ATOM 737 CE1 PHE A 38 22.333 23.638 18.268 1.00 2.62 C ATOM 738 CE2 PHE A 38 19.983 24.162 18.486 1.00 5.02 C ATOM 739 CZ PHE A 38 21.313 24.398 18.845 1.00 4.72 C ATOM 0 H PHE A 38 21.635 18.768 15.542 1.00 0.87 H new ATOM 0 HA PHE A 38 20.079 20.063 17.768 1.00 0.61 H new ATOM 0 HB2 PHE A 38 20.911 21.275 15.147 1.00 0.91 H new ATOM 0 HB3 PHE A 38 19.241 21.488 15.635 1.00 0.91 H new ATOM 0 HD1 PHE A 38 22.817 22.039 16.904 1.00 0.89 H new ATOM 0 HD2 PHE A 38 18.648 22.990 17.287 1.00 3.23 H new ATOM 0 HE1 PHE A 38 23.362 23.828 18.535 1.00 2.62 H new ATOM 0 HE2 PHE A 38 19.192 24.753 18.924 1.00 5.02 H new ATOM 0 HZ PHE A 38 21.551 25.166 19.566 1.00 4.72 H new ATOM 749 N CYS A 39 18.187 18.556 16.962 1.00 0.98 N ATOM 750 CA CYS A 39 17.231 17.515 16.439 1.00 0.92 C ATOM 751 C CYS A 39 15.745 17.894 16.528 1.00 0.76 C ATOM 752 O CYS A 39 14.916 17.051 16.803 1.00 0.87 O ATOM 753 CB CYS A 39 17.430 16.219 17.223 1.00 1.02 C ATOM 754 SG CYS A 39 18.906 16.367 18.260 1.00 1.38 S ATOM 0 H CYS A 39 17.990 18.920 17.894 1.00 0.98 H new ATOM 0 HA CYS A 39 17.465 17.412 15.379 1.00 0.92 H new ATOM 0 HB2 CYS A 39 16.556 16.017 17.842 1.00 1.02 H new ATOM 0 HB3 CYS A 39 17.536 15.378 16.537 1.00 1.02 H new ATOM 0 HG CYS A 39 19.966 16.158 17.538 1.00 1.38 H new ATOM 760 N LEU A 40 15.378 19.100 16.229 1.00 0.60 N ATOM 761 CA LEU A 40 13.918 19.441 16.220 1.00 0.49 C ATOM 762 C LEU A 40 13.239 19.337 17.592 1.00 0.47 C ATOM 763 O LEU A 40 13.384 18.378 18.322 1.00 0.48 O ATOM 764 CB LEU A 40 13.261 18.507 15.211 1.00 0.36 C ATOM 765 CG LEU A 40 13.970 18.713 13.878 1.00 0.26 C ATOM 766 CD1 LEU A 40 13.077 18.238 12.729 1.00 0.33 C ATOM 767 CD2 LEU A 40 14.282 20.207 13.730 1.00 0.55 C ATOM 0 H LEU A 40 16.010 19.865 15.991 1.00 0.60 H new ATOM 0 HA LEU A 40 13.802 20.489 15.945 1.00 0.49 H new ATOM 0 HB2 LEU A 40 13.345 17.470 15.535 1.00 0.36 H new ATOM 0 HB3 LEU A 40 12.197 18.727 15.119 1.00 0.36 H new ATOM 0 HG LEU A 40 14.894 18.135 13.848 1.00 0.26 H new ATOM 0 HD11 LEU A 40 13.593 18.390 11.781 1.00 0.33 H new ATOM 0 HD12 LEU A 40 12.854 17.179 12.856 1.00 0.33 H new ATOM 0 HD13 LEU A 40 12.147 18.807 12.731 1.00 0.33 H new ATOM 0 HD21 LEU A 40 14.791 20.380 12.782 1.00 0.55 H new ATOM 0 HD22 LEU A 40 13.353 20.777 13.753 1.00 0.55 H new ATOM 0 HD23 LEU A 40 14.924 20.528 14.550 1.00 0.55 H new ATOM 779 N SER A 41 12.509 20.380 17.928 1.00 0.45 N ATOM 780 CA SER A 41 11.792 20.475 19.236 1.00 0.44 C ATOM 781 C SER A 41 10.996 19.199 19.533 1.00 0.55 C ATOM 782 O SER A 41 11.123 18.198 18.857 1.00 0.46 O ATOM 783 CB SER A 41 10.830 21.662 19.180 1.00 0.52 C ATOM 784 OG SER A 41 9.549 21.214 18.760 1.00 2.49 O ATOM 0 H SER A 41 12.380 21.193 17.326 1.00 0.45 H new ATOM 0 HA SER A 41 12.529 20.607 20.028 1.00 0.44 H new ATOM 0 HB2 SER A 41 10.759 22.133 20.161 1.00 0.52 H new ATOM 0 HB3 SER A 41 11.207 22.417 18.490 1.00 0.52 H new ATOM 0 HG SER A 41 9.491 21.259 17.783 1.00 2.49 H new ATOM 790 N ALA A 42 10.159 19.241 20.544 1.00 0.77 N ATOM 791 CA ALA A 42 9.336 18.046 20.890 1.00 0.93 C ATOM 792 C ALA A 42 8.266 17.867 19.817 1.00 0.93 C ATOM 793 O ALA A 42 7.678 18.823 19.358 1.00 1.02 O ATOM 794 CB ALA A 42 8.663 18.254 22.249 1.00 1.19 C ATOM 0 H ALA A 42 10.013 20.054 21.143 1.00 0.77 H new ATOM 0 HA ALA A 42 9.971 17.162 20.941 1.00 0.93 H new ATOM 0 HB1 ALA A 42 8.063 17.378 22.496 1.00 1.19 H new ATOM 0 HB2 ALA A 42 9.426 18.399 23.014 1.00 1.19 H new ATOM 0 HB3 ALA A 42 8.020 19.133 22.206 1.00 1.19 H new ATOM 800 N ASP A 43 8.035 16.655 19.391 1.00 0.89 N ATOM 801 CA ASP A 43 7.026 16.413 18.317 1.00 0.89 C ATOM 802 C ASP A 43 7.675 16.704 16.958 1.00 0.61 C ATOM 803 O ASP A 43 7.131 16.394 15.918 1.00 0.57 O ATOM 804 CB ASP A 43 5.810 17.322 18.518 1.00 1.20 C ATOM 805 CG ASP A 43 4.597 16.711 17.813 1.00 0.94 C ATOM 806 OD1 ASP A 43 4.737 15.629 17.269 1.00 1.15 O ATOM 807 OD2 ASP A 43 3.548 17.336 17.831 1.00 1.58 O ATOM 0 H ASP A 43 8.502 15.819 19.741 1.00 0.89 H new ATOM 0 HA ASP A 43 6.692 15.376 18.356 1.00 0.89 H new ATOM 0 HB2 ASP A 43 5.604 17.442 19.582 1.00 1.20 H new ATOM 0 HB3 ASP A 43 6.015 18.315 18.119 1.00 1.20 H new ATOM 812 N LYS A 44 8.844 17.297 16.975 1.00 0.50 N ATOM 813 CA LYS A 44 9.572 17.617 15.722 1.00 0.41 C ATOM 814 C LYS A 44 9.046 18.902 15.127 1.00 0.80 C ATOM 815 O LYS A 44 7.869 19.059 14.877 1.00 1.54 O ATOM 816 CB LYS A 44 9.481 16.455 14.734 1.00 0.37 C ATOM 817 CG LYS A 44 10.897 15.944 14.446 1.00 0.38 C ATOM 818 CD LYS A 44 11.577 15.530 15.760 1.00 0.29 C ATOM 819 CE LYS A 44 11.166 14.100 16.117 1.00 0.57 C ATOM 820 NZ LYS A 44 11.557 13.806 17.524 1.00 0.16 N ATOM 0 H LYS A 44 9.329 17.576 17.828 1.00 0.50 H new ATOM 0 HA LYS A 44 10.627 17.764 15.952 1.00 0.41 H new ATOM 0 HB2 LYS A 44 8.867 15.655 15.147 1.00 0.37 H new ATOM 0 HB3 LYS A 44 9.001 16.780 13.811 1.00 0.37 H new ATOM 0 HG2 LYS A 44 10.856 15.095 13.764 1.00 0.38 H new ATOM 0 HG3 LYS A 44 11.481 16.721 13.953 1.00 0.38 H new ATOM 0 HD2 LYS A 44 12.660 15.594 15.657 1.00 0.29 H new ATOM 0 HD3 LYS A 44 11.292 16.213 16.561 1.00 0.29 H new ATOM 0 HE2 LYS A 44 10.090 13.979 15.995 1.00 0.57 H new ATOM 0 HE3 LYS A 44 11.645 13.393 15.440 1.00 0.57 H new ATOM 0 HZ1 LYS A 44 11.277 12.834 17.766 1.00 0.16 H new ATOM 0 HZ2 LYS A 44 12.587 13.906 17.626 1.00 0.16 H new ATOM 0 HZ3 LYS A 44 11.080 14.473 18.164 1.00 0.16 H new ATOM 834 N LYS A 45 9.955 19.824 14.945 1.00 0.35 N ATOM 835 CA LYS A 45 9.669 21.150 14.424 1.00 0.65 C ATOM 836 C LYS A 45 10.604 22.098 15.140 1.00 1.27 C ATOM 837 O LYS A 45 10.804 21.998 16.328 1.00 3.11 O ATOM 838 CB LYS A 45 8.258 21.535 14.729 1.00 0.58 C ATOM 839 CG LYS A 45 7.399 21.169 13.528 1.00 0.30 C ATOM 840 CD LYS A 45 5.925 21.145 13.933 1.00 0.87 C ATOM 841 CE LYS A 45 5.362 22.564 13.859 1.00 1.48 C ATOM 842 NZ LYS A 45 5.383 23.178 15.219 1.00 2.18 N ATOM 0 H LYS A 45 10.942 19.677 15.158 1.00 0.35 H new ATOM 0 HA LYS A 45 9.804 21.179 13.343 1.00 0.65 H new ATOM 0 HB2 LYS A 45 7.906 21.017 15.621 1.00 0.58 H new ATOM 0 HB3 LYS A 45 8.191 22.603 14.934 1.00 0.58 H new ATOM 0 HG2 LYS A 45 7.553 21.890 12.726 1.00 0.30 H new ATOM 0 HG3 LYS A 45 7.695 20.194 13.141 1.00 0.30 H new ATOM 0 HD2 LYS A 45 5.364 20.483 13.273 1.00 0.87 H new ATOM 0 HD3 LYS A 45 5.819 20.751 14.944 1.00 0.87 H new ATOM 0 HE2 LYS A 45 5.952 23.165 13.167 1.00 1.48 H new ATOM 0 HE3 LYS A 45 4.343 22.543 13.473 1.00 1.48 H new ATOM 0 HZ1 LYS A 45 4.923 24.110 15.186 1.00 2.18 H new ATOM 0 HZ2 LYS A 45 4.873 22.563 15.885 1.00 2.18 H new ATOM 0 HZ3 LYS A 45 6.368 23.289 15.535 1.00 2.18 H new ATOM 856 N CYS A 46 11.181 22.978 14.407 1.00 0.32 N ATOM 857 CA CYS A 46 12.148 23.974 14.953 1.00 0.15 C ATOM 858 C CYS A 46 13.517 23.352 15.008 1.00 0.12 C ATOM 859 O CYS A 46 13.748 22.476 15.813 1.00 0.15 O ATOM 860 CB CYS A 46 11.837 24.392 16.408 1.00 0.39 C ATOM 861 SG CYS A 46 10.720 25.814 16.447 1.00 0.40 S ATOM 0 H CYS A 46 11.023 23.063 13.403 1.00 0.32 H new ATOM 0 HA CYS A 46 12.083 24.842 14.297 1.00 0.15 H new ATOM 0 HB2 CYS A 46 11.386 23.556 16.942 1.00 0.39 H new ATOM 0 HB3 CYS A 46 12.764 24.638 16.926 1.00 0.39 H new ATOM 0 HG CYS A 46 9.729 25.610 15.631 1.00 0.40 H new ATOM 867 N ILE A 47 14.457 23.824 14.244 1.00 0.10 N ATOM 868 CA ILE A 47 15.800 23.263 14.401 1.00 0.09 C ATOM 869 C ILE A 47 16.037 23.382 15.884 1.00 0.11 C ATOM 870 O ILE A 47 15.664 24.367 16.475 1.00 0.32 O ATOM 871 CB ILE A 47 16.811 24.115 13.666 1.00 0.18 C ATOM 872 CG1 ILE A 47 17.764 23.227 12.901 1.00 0.24 C ATOM 873 CG2 ILE A 47 17.576 24.925 14.684 1.00 0.30 C ATOM 874 CD1 ILE A 47 17.173 22.993 11.527 1.00 0.24 C ATOM 0 H ILE A 47 14.350 24.554 13.539 1.00 0.10 H new ATOM 0 HA ILE A 47 15.891 22.248 14.014 1.00 0.09 H new ATOM 0 HB ILE A 47 16.306 24.776 12.962 1.00 0.18 H new ATOM 0 HG12 ILE A 47 18.744 23.697 12.821 1.00 0.24 H new ATOM 0 HG13 ILE A 47 17.907 22.280 13.422 1.00 0.24 H new ATOM 0 HG21 ILE A 47 18.312 25.548 14.175 1.00 0.30 H new ATOM 0 HG22 ILE A 47 16.884 25.560 15.238 1.00 0.30 H new ATOM 0 HG23 ILE A 47 18.085 24.253 15.375 1.00 0.30 H new ATOM 0 HD11 ILE A 47 17.840 22.353 10.948 1.00 0.24 H new ATOM 0 HD12 ILE A 47 16.201 22.509 11.626 1.00 0.24 H new ATOM 0 HD13 ILE A 47 17.052 23.948 11.016 1.00 0.24 H new ATOM 886 N ILE A 48 16.553 22.415 16.531 1.00 0.17 N ATOM 887 CA ILE A 48 16.667 22.590 17.984 1.00 0.17 C ATOM 888 C ILE A 48 17.636 21.600 18.557 1.00 0.12 C ATOM 889 O ILE A 48 18.191 20.788 17.867 1.00 0.85 O ATOM 890 CB ILE A 48 15.303 22.340 18.585 1.00 0.29 C ATOM 891 CG1 ILE A 48 15.156 23.107 19.891 1.00 0.35 C ATOM 892 CG2 ILE A 48 15.151 20.854 18.864 1.00 0.25 C ATOM 893 CD1 ILE A 48 15.106 22.097 21.036 1.00 0.24 C ATOM 0 H ILE A 48 16.894 21.535 16.143 1.00 0.17 H new ATOM 0 HA ILE A 48 17.022 23.596 18.207 1.00 0.17 H new ATOM 0 HB ILE A 48 14.537 22.675 17.886 1.00 0.29 H new ATOM 0 HG12 ILE A 48 15.993 23.792 20.025 1.00 0.35 H new ATOM 0 HG13 ILE A 48 14.249 23.711 19.877 1.00 0.35 H new ATOM 0 HG21 ILE A 48 14.169 20.664 19.298 1.00 0.25 H new ATOM 0 HG22 ILE A 48 15.250 20.297 17.932 1.00 0.25 H new ATOM 0 HG23 ILE A 48 15.925 20.534 19.562 1.00 0.25 H new ATOM 0 HD11 ILE A 48 15.001 22.626 21.983 1.00 0.24 H new ATOM 0 HD12 ILE A 48 14.255 21.430 20.896 1.00 0.24 H new ATOM 0 HD13 ILE A 48 16.026 21.513 21.047 1.00 0.24 H new ATOM 905 N VAL A 49 17.816 21.667 19.820 1.00 0.78 N ATOM 906 CA VAL A 49 18.714 20.712 20.488 1.00 0.86 C ATOM 907 C VAL A 49 17.780 19.688 21.123 1.00 1.01 C ATOM 908 O VAL A 49 17.082 19.998 22.068 1.00 1.26 O ATOM 909 CB VAL A 49 19.527 21.440 21.561 1.00 1.05 C ATOM 910 CG1 VAL A 49 20.680 20.550 22.024 1.00 0.98 C ATOM 911 CG2 VAL A 49 20.090 22.747 20.983 1.00 1.30 C ATOM 0 H VAL A 49 17.375 22.351 20.435 1.00 0.78 H new ATOM 0 HA VAL A 49 19.425 20.246 19.806 1.00 0.86 H new ATOM 0 HB VAL A 49 18.881 21.667 22.409 1.00 1.05 H new ATOM 0 HG11 VAL A 49 21.257 21.071 22.788 1.00 0.98 H new ATOM 0 HG12 VAL A 49 20.281 19.624 22.439 1.00 0.98 H new ATOM 0 HG13 VAL A 49 21.325 20.320 21.176 1.00 0.98 H new ATOM 0 HG21 VAL A 49 20.669 23.264 21.749 1.00 1.30 H new ATOM 0 HG22 VAL A 49 20.733 22.521 20.133 1.00 1.30 H new ATOM 0 HG23 VAL A 49 19.268 23.385 20.657 1.00 1.30 H new ATOM 921 N GLU A 50 17.668 18.501 20.588 1.00 0.92 N ATOM 922 CA GLU A 50 16.660 17.571 21.189 1.00 1.13 C ATOM 923 C GLU A 50 17.135 16.142 21.280 1.00 0.87 C ATOM 924 O GLU A 50 16.570 15.260 20.663 1.00 1.03 O ATOM 925 CB GLU A 50 15.395 17.618 20.334 1.00 1.56 C ATOM 926 CG GLU A 50 14.160 17.618 21.237 1.00 1.57 C ATOM 927 CD GLU A 50 13.332 16.363 20.959 1.00 1.85 C ATOM 928 OE1 GLU A 50 12.715 16.304 19.910 1.00 1.97 O ATOM 929 OE2 GLU A 50 13.336 15.478 21.800 1.00 2.50 O ATOM 0 H GLU A 50 18.203 18.143 19.797 1.00 0.92 H new ATOM 0 HA GLU A 50 16.479 17.906 22.210 1.00 1.13 H new ATOM 0 HB2 GLU A 50 15.400 18.511 19.709 1.00 1.56 H new ATOM 0 HB3 GLU A 50 15.366 16.760 19.663 1.00 1.56 H new ATOM 0 HG2 GLU A 50 14.461 17.645 22.284 1.00 1.57 H new ATOM 0 HG3 GLU A 50 13.562 18.511 21.054 1.00 1.57 H new ATOM 936 N GLU A 51 18.140 15.880 22.060 1.00 0.59 N ATOM 937 CA GLU A 51 18.598 14.486 22.174 1.00 0.52 C ATOM 938 C GLU A 51 19.812 14.393 23.088 1.00 0.31 C ATOM 939 O GLU A 51 20.048 13.395 23.741 1.00 0.48 O ATOM 940 CB GLU A 51 18.883 14.025 20.753 1.00 0.77 C ATOM 941 CG GLU A 51 20.378 13.985 20.444 1.00 0.74 C ATOM 942 CD GLU A 51 20.664 12.774 19.549 1.00 1.25 C ATOM 943 OE1 GLU A 51 20.606 12.926 18.341 1.00 1.62 O ATOM 944 OE2 GLU A 51 20.938 11.716 20.090 1.00 2.26 O ATOM 0 H GLU A 51 18.654 16.564 22.614 1.00 0.59 H new ATOM 0 HA GLU A 51 17.850 13.838 22.631 1.00 0.52 H new ATOM 0 HB2 GLU A 51 18.457 13.033 20.603 1.00 0.77 H new ATOM 0 HB3 GLU A 51 18.387 14.694 20.050 1.00 0.77 H new ATOM 0 HG2 GLU A 51 20.685 14.904 19.945 1.00 0.74 H new ATOM 0 HG3 GLU A 51 20.953 13.916 21.368 1.00 0.74 H new ATOM 951 N GLY A 52 20.569 15.428 23.134 1.00 0.28 N ATOM 952 CA GLY A 52 21.785 15.442 24.000 1.00 0.47 C ATOM 953 C GLY A 52 23.027 15.314 23.119 1.00 0.45 C ATOM 954 O GLY A 52 23.582 14.245 22.959 1.00 0.48 O ATOM 0 H GLY A 52 20.408 16.286 22.606 1.00 0.28 H new ATOM 0 HA2 GLY A 52 21.826 16.367 24.576 1.00 0.47 H new ATOM 0 HA3 GLY A 52 21.746 14.622 24.717 1.00 0.47 H new ATOM 958 N LYS A 53 23.456 16.395 22.531 1.00 0.43 N ATOM 959 CA LYS A 53 24.632 16.354 21.651 1.00 0.46 C ATOM 960 C LYS A 53 25.609 17.450 22.088 1.00 0.21 C ATOM 961 O LYS A 53 25.743 17.749 23.253 1.00 0.10 O ATOM 962 CB LYS A 53 24.159 16.648 20.225 1.00 0.69 C ATOM 963 CG LYS A 53 22.815 15.970 19.935 1.00 0.73 C ATOM 964 CD LYS A 53 23.032 14.865 18.901 1.00 0.93 C ATOM 965 CE LYS A 53 24.049 13.883 19.465 1.00 0.99 C ATOM 966 NZ LYS A 53 23.345 12.824 20.240 1.00 1.38 N ATOM 0 H LYS A 53 23.027 17.315 22.631 1.00 0.43 H new ATOM 0 HA LYS A 53 25.122 15.382 21.700 1.00 0.46 H new ATOM 0 HB2 LYS A 53 24.063 17.725 20.086 1.00 0.69 H new ATOM 0 HB3 LYS A 53 24.906 16.299 19.512 1.00 0.69 H new ATOM 0 HG2 LYS A 53 22.398 15.552 20.851 1.00 0.73 H new ATOM 0 HG3 LYS A 53 22.097 16.700 19.562 1.00 0.73 H new ATOM 0 HD2 LYS A 53 22.092 14.357 18.684 1.00 0.93 H new ATOM 0 HD3 LYS A 53 23.391 15.287 17.962 1.00 0.93 H new ATOM 0 HE2 LYS A 53 24.624 13.434 18.655 1.00 0.99 H new ATOM 0 HE3 LYS A 53 24.758 14.406 20.106 1.00 0.99 H new ATOM 0 HZ1 LYS A 53 24.029 12.100 20.538 1.00 1.38 H new ATOM 0 HZ2 LYS A 53 22.899 13.246 21.079 1.00 1.38 H new ATOM 0 HZ3 LYS A 53 22.614 12.385 19.644 1.00 1.38 H new ATOM 980 N GLU A 54 26.238 18.081 21.139 1.00 0.16 N ATOM 981 CA GLU A 54 27.165 19.217 21.430 1.00 0.10 C ATOM 982 C GLU A 54 28.542 18.804 21.906 1.00 0.23 C ATOM 983 O GLU A 54 28.714 18.111 22.888 1.00 0.17 O ATOM 984 CB GLU A 54 26.541 20.155 22.484 1.00 0.32 C ATOM 985 CG GLU A 54 27.446 20.317 23.733 1.00 0.99 C ATOM 986 CD GLU A 54 27.034 19.299 24.801 1.00 1.45 C ATOM 987 OE1 GLU A 54 26.006 19.511 25.424 1.00 1.67 O ATOM 988 OE2 GLU A 54 27.751 18.330 24.980 1.00 1.74 O ATOM 0 H GLU A 54 26.149 17.854 20.149 1.00 0.16 H new ATOM 0 HA GLU A 54 27.302 19.723 20.474 1.00 0.10 H new ATOM 0 HB2 GLU A 54 26.363 21.133 22.037 1.00 0.32 H new ATOM 0 HB3 GLU A 54 25.571 19.762 22.789 1.00 0.32 H new ATOM 0 HG2 GLU A 54 28.491 20.170 23.459 1.00 0.99 H new ATOM 0 HG3 GLU A 54 27.360 21.329 24.128 1.00 0.99 H new ATOM 995 N ILE A 55 29.523 19.370 21.269 1.00 0.44 N ATOM 996 CA ILE A 55 30.912 19.200 21.708 1.00 0.58 C ATOM 997 C ILE A 55 31.124 20.400 22.635 1.00 0.57 C ATOM 998 O ILE A 55 30.201 21.146 22.874 1.00 0.64 O ATOM 999 CB ILE A 55 31.815 19.246 20.501 1.00 0.48 C ATOM 1000 CG1 ILE A 55 32.601 17.977 20.413 1.00 0.73 C ATOM 1001 CG2 ILE A 55 32.828 20.362 20.579 1.00 0.29 C ATOM 1002 CD1 ILE A 55 33.330 18.080 19.111 1.00 0.78 C ATOM 0 H ILE A 55 29.407 19.956 20.442 1.00 0.44 H new ATOM 0 HA ILE A 55 31.125 18.256 22.210 1.00 0.58 H new ATOM 0 HB ILE A 55 31.165 19.398 19.639 1.00 0.48 H new ATOM 0 HG12 ILE A 55 33.293 17.880 21.249 1.00 0.73 H new ATOM 0 HG13 ILE A 55 31.949 17.104 20.435 1.00 0.73 H new ATOM 0 HG21 ILE A 55 33.452 20.350 19.686 1.00 0.29 H new ATOM 0 HG22 ILE A 55 32.311 21.319 20.647 1.00 0.29 H new ATOM 0 HG23 ILE A 55 33.454 20.224 21.461 1.00 0.29 H new ATOM 0 HD11 ILE A 55 33.936 17.187 18.962 1.00 0.78 H new ATOM 0 HD12 ILE A 55 32.610 18.170 18.297 1.00 0.78 H new ATOM 0 HD13 ILE A 55 33.975 18.958 19.124 1.00 0.78 H new ATOM 1014 N LEU A 56 32.269 20.618 23.171 1.00 0.58 N ATOM 1015 CA LEU A 56 32.400 21.792 24.083 1.00 0.62 C ATOM 1016 C LEU A 56 33.409 22.800 23.560 1.00 0.44 C ATOM 1017 O LEU A 56 33.654 23.790 24.211 1.00 0.64 O ATOM 1018 CB LEU A 56 32.825 21.335 25.481 1.00 0.81 C ATOM 1019 CG LEU A 56 31.811 20.340 26.033 1.00 1.04 C ATOM 1020 CD1 LEU A 56 30.418 20.973 25.976 1.00 1.15 C ATOM 1021 CD2 LEU A 56 31.842 19.065 25.191 1.00 1.05 C ATOM 0 H LEU A 56 33.111 20.059 23.032 1.00 0.58 H new ATOM 0 HA LEU A 56 31.424 22.274 24.131 1.00 0.62 H new ATOM 0 HB2 LEU A 56 33.812 20.875 25.438 1.00 0.81 H new ATOM 0 HB3 LEU A 56 32.903 22.195 26.146 1.00 0.81 H new ATOM 0 HG LEU A 56 32.054 20.088 27.065 1.00 1.04 H new ATOM 0 HD11 LEU A 56 29.683 20.270 26.368 1.00 1.15 H new ATOM 0 HD12 LEU A 56 30.407 21.883 26.576 1.00 1.15 H new ATOM 0 HD13 LEU A 56 30.171 21.217 24.943 1.00 1.15 H new ATOM 0 HD21 LEU A 56 31.117 18.352 25.584 1.00 1.05 H new ATOM 0 HD22 LEU A 56 31.591 19.305 24.158 1.00 1.05 H new ATOM 0 HD23 LEU A 56 32.840 18.627 25.230 1.00 1.05 H new ATOM 1033 N VAL A 57 33.973 22.589 22.398 1.00 0.14 N ATOM 1034 CA VAL A 57 34.948 23.567 21.867 1.00 0.22 C ATOM 1035 C VAL A 57 36.273 23.418 22.606 1.00 0.10 C ATOM 1036 O VAL A 57 37.280 23.073 22.019 1.00 0.22 O ATOM 1037 CB VAL A 57 34.362 24.972 22.027 1.00 0.67 C ATOM 1038 CG1 VAL A 57 35.324 25.888 22.807 1.00 2.65 C ATOM 1039 CG2 VAL A 57 34.109 25.527 20.632 1.00 2.25 C ATOM 0 H VAL A 57 33.796 21.781 21.801 1.00 0.14 H new ATOM 0 HA VAL A 57 35.141 23.389 20.809 1.00 0.22 H new ATOM 0 HB VAL A 57 33.433 24.926 22.595 1.00 0.67 H new ATOM 0 HG11 VAL A 57 34.882 26.880 22.906 1.00 2.65 H new ATOM 0 HG12 VAL A 57 35.502 25.470 23.798 1.00 2.65 H new ATOM 0 HG13 VAL A 57 36.270 25.964 22.270 1.00 2.65 H new ATOM 0 HG21 VAL A 57 33.690 26.530 20.710 1.00 2.25 H new ATOM 0 HG22 VAL A 57 35.048 25.568 20.081 1.00 2.25 H new ATOM 0 HG23 VAL A 57 33.407 24.881 20.105 1.00 2.25 H new ATOM 1049 N GLY A 58 36.289 23.632 23.884 1.00 0.15 N ATOM 1050 CA GLY A 58 37.549 23.456 24.630 1.00 0.18 C ATOM 1051 C GLY A 58 37.651 21.988 25.008 1.00 0.17 C ATOM 1052 O GLY A 58 38.739 21.469 25.171 1.00 0.20 O ATOM 0 H GLY A 58 35.485 23.920 24.441 1.00 0.15 H new ATOM 0 HA2 GLY A 58 38.401 23.756 24.020 1.00 0.18 H new ATOM 0 HA3 GLY A 58 37.558 24.084 25.521 1.00 0.18 H new ATOM 1056 N ASP A 59 36.527 21.291 25.106 1.00 0.19 N ATOM 1057 CA ASP A 59 36.617 19.840 25.411 1.00 0.22 C ATOM 1058 C ASP A 59 37.666 19.343 24.465 1.00 0.20 C ATOM 1059 O ASP A 59 38.592 18.678 24.842 1.00 0.25 O ATOM 1060 CB ASP A 59 35.309 19.098 25.110 1.00 0.25 C ATOM 1061 CG ASP A 59 34.517 18.903 26.405 1.00 0.50 C ATOM 1062 OD1 ASP A 59 34.499 19.819 27.211 1.00 0.55 O ATOM 1063 OD2 ASP A 59 33.942 17.839 26.569 1.00 0.79 O ATOM 0 H ASP A 59 35.585 21.664 24.989 1.00 0.19 H new ATOM 0 HA ASP A 59 36.834 19.675 26.466 1.00 0.22 H new ATOM 0 HB2 ASP A 59 34.716 19.664 24.391 1.00 0.25 H new ATOM 0 HB3 ASP A 59 35.524 18.131 24.655 1.00 0.25 H new ATOM 1068 N VAL A 60 37.526 19.743 23.229 1.00 0.14 N ATOM 1069 CA VAL A 60 38.515 19.387 22.188 1.00 0.18 C ATOM 1070 C VAL A 60 39.916 19.402 22.810 1.00 0.18 C ATOM 1071 O VAL A 60 40.587 20.415 22.847 1.00 0.19 O ATOM 1072 CB VAL A 60 38.393 20.443 21.080 1.00 0.23 C ATOM 1073 CG1 VAL A 60 39.496 20.264 20.043 1.00 0.38 C ATOM 1074 CG2 VAL A 60 37.023 20.311 20.408 1.00 0.20 C ATOM 0 H VAL A 60 36.748 20.314 22.897 1.00 0.14 H new ATOM 0 HA VAL A 60 38.339 18.393 21.777 1.00 0.18 H new ATOM 0 HB VAL A 60 38.495 21.434 21.522 1.00 0.23 H new ATOM 0 HG11 VAL A 60 39.392 21.022 19.267 1.00 0.38 H new ATOM 0 HG12 VAL A 60 40.468 20.369 20.524 1.00 0.38 H new ATOM 0 HG13 VAL A 60 39.418 19.273 19.596 1.00 0.38 H new ATOM 0 HG21 VAL A 60 36.931 21.059 19.620 1.00 0.20 H new ATOM 0 HG22 VAL A 60 36.924 19.315 19.977 1.00 0.20 H new ATOM 0 HG23 VAL A 60 36.238 20.465 21.148 1.00 0.20 H new ATOM 1084 N GLY A 61 40.344 18.278 23.319 1.00 0.18 N ATOM 1085 CA GLY A 61 41.683 18.196 23.971 1.00 0.19 C ATOM 1086 C GLY A 61 41.612 17.288 25.203 1.00 0.18 C ATOM 1087 O GLY A 61 42.613 16.966 25.810 1.00 0.24 O ATOM 0 H GLY A 61 39.818 17.404 23.311 1.00 0.18 H new ATOM 0 HA2 GLY A 61 42.417 17.808 23.265 1.00 0.19 H new ATOM 0 HA3 GLY A 61 42.016 19.192 24.262 1.00 0.19 H new ATOM 1091 N VAL A 62 40.438 16.853 25.553 1.00 0.17 N ATOM 1092 CA VAL A 62 40.280 15.944 26.716 1.00 0.17 C ATOM 1093 C VAL A 62 39.770 14.632 26.153 1.00 0.24 C ATOM 1094 O VAL A 62 40.527 13.831 25.643 1.00 0.33 O ATOM 1095 CB VAL A 62 39.257 16.530 27.684 1.00 0.23 C ATOM 1096 CG1 VAL A 62 38.885 15.478 28.726 1.00 0.17 C ATOM 1097 CG2 VAL A 62 39.857 17.753 28.372 1.00 0.36 C ATOM 0 H VAL A 62 39.569 17.092 25.076 1.00 0.17 H new ATOM 0 HA VAL A 62 41.216 15.808 27.257 1.00 0.17 H new ATOM 0 HB VAL A 62 38.361 16.827 27.139 1.00 0.23 H new ATOM 0 HG11 VAL A 62 38.154 15.895 29.419 1.00 0.17 H new ATOM 0 HG12 VAL A 62 38.458 14.608 28.228 1.00 0.17 H new ATOM 0 HG13 VAL A 62 39.777 15.179 29.276 1.00 0.17 H new ATOM 0 HG21 VAL A 62 39.129 18.175 29.065 1.00 0.36 H new ATOM 0 HG22 VAL A 62 40.752 17.459 28.921 1.00 0.36 H new ATOM 0 HG23 VAL A 62 40.120 18.500 27.623 1.00 0.36 H new ATOM 1107 N THR A 63 38.484 14.436 26.156 1.00 0.29 N ATOM 1108 CA THR A 63 37.950 13.225 25.530 1.00 0.41 C ATOM 1109 C THR A 63 38.175 13.412 24.031 1.00 0.36 C ATOM 1110 O THR A 63 38.108 12.484 23.251 1.00 0.48 O ATOM 1111 CB THR A 63 36.460 13.110 25.843 1.00 0.52 C ATOM 1112 OG1 THR A 63 36.287 12.944 27.243 1.00 0.72 O ATOM 1113 CG2 THR A 63 35.872 11.910 25.110 1.00 0.64 C ATOM 0 H THR A 63 37.792 15.064 26.565 1.00 0.29 H new ATOM 0 HA THR A 63 38.432 12.317 25.892 1.00 0.41 H new ATOM 0 HB THR A 63 35.949 14.015 25.516 1.00 0.52 H new ATOM 0 HG1 THR A 63 35.331 12.872 27.448 1.00 0.72 H new ATOM 0 HG21 THR A 63 34.809 11.831 25.336 1.00 0.64 H new ATOM 0 HG22 THR A 63 36.006 12.038 24.036 1.00 0.64 H new ATOM 0 HG23 THR A 63 36.380 11.001 25.433 1.00 0.64 H new ATOM 1121 N ILE A 64 38.470 14.635 23.629 1.00 0.23 N ATOM 1122 CA ILE A 64 38.725 14.916 22.198 1.00 0.21 C ATOM 1123 C ILE A 64 40.119 15.545 22.081 1.00 0.30 C ATOM 1124 O ILE A 64 40.825 15.664 23.063 1.00 0.54 O ATOM 1125 CB ILE A 64 37.653 15.878 21.677 1.00 0.17 C ATOM 1126 CG1 ILE A 64 37.010 16.635 22.844 1.00 0.14 C ATOM 1127 CG2 ILE A 64 36.566 15.083 20.960 1.00 0.16 C ATOM 1128 CD1 ILE A 64 35.721 17.304 22.358 1.00 0.06 C ATOM 0 H ILE A 64 38.542 15.444 24.246 1.00 0.23 H new ATOM 0 HA ILE A 64 38.685 14.002 21.605 1.00 0.21 H new ATOM 0 HB ILE A 64 38.121 16.587 20.994 1.00 0.17 H new ATOM 0 HG12 ILE A 64 36.792 15.949 23.663 1.00 0.14 H new ATOM 0 HG13 ILE A 64 37.700 17.385 23.231 1.00 0.14 H new ATOM 0 HG21 ILE A 64 35.802 15.765 20.588 1.00 0.16 H new ATOM 0 HG22 ILE A 64 37.005 14.539 20.124 1.00 0.16 H new ATOM 0 HG23 ILE A 64 36.114 14.376 21.655 1.00 0.16 H new ATOM 0 HD11 ILE A 64 35.258 17.845 23.184 1.00 0.06 H new ATOM 0 HD12 ILE A 64 35.954 18.001 21.553 1.00 0.06 H new ATOM 0 HD13 ILE A 64 35.032 16.543 21.991 1.00 0.06 H new ATOM 1140 N THR A 65 40.541 15.946 20.912 1.00 0.24 N ATOM 1141 CA THR A 65 41.905 16.547 20.811 1.00 0.42 C ATOM 1142 C THR A 65 42.099 17.336 19.529 1.00 0.36 C ATOM 1143 O THR A 65 43.158 17.281 18.938 1.00 0.34 O ATOM 1144 CB THR A 65 42.961 15.447 20.894 1.00 0.63 C ATOM 1145 OG1 THR A 65 42.324 14.178 20.901 1.00 0.75 O ATOM 1146 CG2 THR A 65 43.775 15.620 22.178 1.00 1.10 C ATOM 0 H THR A 65 40.015 15.887 20.040 1.00 0.24 H new ATOM 0 HA THR A 65 42.013 17.242 21.644 1.00 0.42 H new ATOM 0 HB THR A 65 43.625 15.513 20.032 1.00 0.63 H new ATOM 0 HG1 THR A 65 43.002 13.472 20.953 1.00 0.75 H new ATOM 0 HG21 THR A 65 44.529 14.836 22.239 1.00 1.10 H new ATOM 0 HG22 THR A 65 44.264 16.594 22.170 1.00 1.10 H new ATOM 0 HG23 THR A 65 43.112 15.554 23.041 1.00 1.10 H new ATOM 1154 N ASP A 66 41.110 18.102 19.128 1.00 0.37 N ATOM 1155 CA ASP A 66 41.249 18.971 17.911 1.00 0.34 C ATOM 1156 C ASP A 66 40.612 18.416 16.613 1.00 0.38 C ATOM 1157 O ASP A 66 40.399 19.187 15.698 1.00 0.41 O ATOM 1158 CB ASP A 66 42.726 19.275 17.683 1.00 0.35 C ATOM 1159 CG ASP A 66 42.874 20.611 16.951 1.00 0.43 C ATOM 1160 OD1 ASP A 66 42.715 21.636 17.594 1.00 1.18 O ATOM 1161 OD2 ASP A 66 43.148 20.587 15.763 1.00 1.82 O ATOM 0 H ASP A 66 40.205 18.163 19.595 1.00 0.37 H new ATOM 0 HA ASP A 66 40.680 19.875 18.128 1.00 0.34 H new ATOM 0 HB2 ASP A 66 43.250 19.313 18.638 1.00 0.35 H new ATOM 0 HB3 ASP A 66 43.185 18.477 17.099 1.00 0.35 H new ATOM 1166 N PRO A 67 40.298 17.144 16.528 1.00 0.42 N ATOM 1167 CA PRO A 67 39.672 16.605 15.316 1.00 0.52 C ATOM 1168 C PRO A 67 38.199 17.015 15.364 1.00 0.59 C ATOM 1169 O PRO A 67 37.889 18.189 15.418 1.00 0.61 O ATOM 1170 CB PRO A 67 39.875 15.089 15.447 1.00 0.54 C ATOM 1171 CG PRO A 67 40.058 14.815 16.954 1.00 0.44 C ATOM 1172 CD PRO A 67 40.513 16.145 17.581 1.00 0.39 C ATOM 0 HA PRO A 67 40.078 16.959 14.368 1.00 0.52 H new ATOM 0 HB2 PRO A 67 39.017 14.545 15.053 1.00 0.54 H new ATOM 0 HB3 PRO A 67 40.748 14.762 14.882 1.00 0.54 H new ATOM 0 HG2 PRO A 67 39.126 14.472 17.403 1.00 0.44 H new ATOM 0 HG3 PRO A 67 40.799 14.033 17.120 1.00 0.44 H new ATOM 0 HD2 PRO A 67 39.935 16.380 18.474 1.00 0.39 H new ATOM 0 HD3 PRO A 67 41.560 16.104 17.881 1.00 0.39 H new ATOM 1180 N PHE A 68 37.283 16.095 15.365 1.00 0.70 N ATOM 1181 CA PHE A 68 35.865 16.502 15.433 1.00 0.86 C ATOM 1182 C PHE A 68 34.970 15.238 15.398 1.00 0.79 C ATOM 1183 O PHE A 68 33.847 15.256 15.853 1.00 0.79 O ATOM 1184 CB PHE A 68 35.549 17.345 14.217 1.00 1.21 C ATOM 1185 CG PHE A 68 34.844 16.415 13.325 1.00 1.64 C ATOM 1186 CD1 PHE A 68 35.583 15.448 12.661 1.00 1.69 C ATOM 1187 CD2 PHE A 68 33.462 16.433 13.256 1.00 2.12 C ATOM 1188 CE1 PHE A 68 34.942 14.493 11.904 1.00 2.17 C ATOM 1189 CE2 PHE A 68 32.806 15.473 12.510 1.00 2.53 C ATOM 1190 CZ PHE A 68 33.542 14.492 11.831 1.00 2.55 C ATOM 0 H PHE A 68 37.454 15.090 15.322 1.00 0.70 H new ATOM 0 HA PHE A 68 35.683 17.063 16.349 1.00 0.86 H new ATOM 0 HB2 PHE A 68 34.927 18.203 14.474 1.00 1.21 H new ATOM 0 HB3 PHE A 68 36.455 17.736 13.754 1.00 1.21 H new ATOM 0 HD1 PHE A 68 36.660 15.444 12.737 1.00 1.69 H new ATOM 0 HD2 PHE A 68 32.901 17.192 13.781 1.00 2.12 H new ATOM 0 HE1 PHE A 68 35.514 13.749 11.370 1.00 2.17 H new ATOM 0 HE2 PHE A 68 31.728 15.478 12.450 1.00 2.53 H new ATOM 0 HZ PHE A 68 33.031 13.736 11.252 1.00 2.55 H new ATOM 1200 N LYS A 69 35.454 14.151 14.830 1.00 0.81 N ATOM 1201 CA LYS A 69 34.634 12.899 14.743 1.00 0.90 C ATOM 1202 C LYS A 69 34.133 12.533 16.128 1.00 0.62 C ATOM 1203 O LYS A 69 33.088 11.947 16.276 1.00 0.54 O ATOM 1204 CB LYS A 69 35.484 11.760 14.184 1.00 1.10 C ATOM 1205 CG LYS A 69 36.932 11.923 14.643 1.00 1.15 C ATOM 1206 CD LYS A 69 37.457 10.576 15.133 1.00 1.45 C ATOM 1207 CE LYS A 69 36.962 9.476 14.195 1.00 1.84 C ATOM 1208 NZ LYS A 69 38.078 8.531 13.903 1.00 2.36 N ATOM 0 H LYS A 69 36.386 14.081 14.422 1.00 0.81 H new ATOM 0 HA LYS A 69 33.785 13.066 14.080 1.00 0.90 H new ATOM 0 HB2 LYS A 69 35.091 10.801 14.522 1.00 1.10 H new ATOM 0 HB3 LYS A 69 35.436 11.758 13.095 1.00 1.10 H new ATOM 0 HG2 LYS A 69 37.547 12.290 13.822 1.00 1.15 H new ATOM 0 HG3 LYS A 69 36.992 12.663 15.441 1.00 1.15 H new ATOM 0 HD2 LYS A 69 38.547 10.585 15.161 1.00 1.45 H new ATOM 0 HD3 LYS A 69 37.114 10.386 16.150 1.00 1.45 H new ATOM 0 HE2 LYS A 69 36.129 8.942 14.652 1.00 1.84 H new ATOM 0 HE3 LYS A 69 36.590 9.914 13.269 1.00 1.84 H new ATOM 0 HZ1 LYS A 69 37.741 7.782 13.265 1.00 2.36 H new ATOM 0 HZ2 LYS A 69 38.860 9.046 13.450 1.00 2.36 H new ATOM 0 HZ3 LYS A 69 38.413 8.104 14.790 1.00 2.36 H new ATOM 1222 N HIS A 70 34.831 12.890 17.159 1.00 0.51 N ATOM 1223 CA HIS A 70 34.292 12.560 18.493 1.00 0.30 C ATOM 1224 C HIS A 70 32.860 13.075 18.512 1.00 0.36 C ATOM 1225 O HIS A 70 31.930 12.392 18.892 1.00 0.33 O ATOM 1226 CB HIS A 70 35.059 13.283 19.566 1.00 0.25 C ATOM 1227 CG HIS A 70 34.057 13.959 20.452 1.00 0.24 C ATOM 1228 ND1 HIS A 70 33.520 15.222 20.442 1.00 0.23 N flip ATOM 1229 CD2 HIS A 70 33.447 13.302 21.497 1.00 0.34 C flip ATOM 1230 CE1 HIS A 70 32.597 15.346 21.462 1.00 0.30 C flip ATOM 1231 NE2 HIS A 70 32.590 14.165 22.062 1.00 0.33 N flip ATOM 0 H HIS A 70 35.725 13.381 17.139 1.00 0.51 H new ATOM 0 HA HIS A 70 34.360 11.488 18.676 1.00 0.30 H new ATOM 0 HB2 HIS A 70 35.669 12.585 20.139 1.00 0.25 H new ATOM 0 HB3 HIS A 70 35.738 14.014 19.127 1.00 0.25 H new ATOM 0 HD2 HIS A 70 33.625 12.282 21.804 1.00 0.34 H new ATOM 0 HE1 HIS A 70 32.009 16.216 21.715 1.00 0.30 H new ATOM 0 HE2 HIS A 70 32.000 13.938 22.862 1.00 0.33 H new ATOM 1239 N PHE A 71 32.698 14.298 18.078 1.00 0.47 N ATOM 1240 CA PHE A 71 31.360 14.921 18.025 1.00 0.56 C ATOM 1241 C PHE A 71 30.438 14.049 17.169 1.00 0.65 C ATOM 1242 O PHE A 71 29.268 13.906 17.459 1.00 0.76 O ATOM 1243 CB PHE A 71 31.485 16.332 17.398 1.00 0.63 C ATOM 1244 CG PHE A 71 30.331 16.619 16.456 1.00 0.61 C ATOM 1245 CD1 PHE A 71 30.246 15.986 15.204 1.00 0.71 C ATOM 1246 CD2 PHE A 71 29.349 17.538 16.837 1.00 0.58 C ATOM 1247 CE1 PHE A 71 29.174 16.274 14.347 1.00 0.80 C ATOM 1248 CE2 PHE A 71 28.281 17.825 15.984 1.00 0.64 C ATOM 1249 CZ PHE A 71 28.191 17.193 14.739 1.00 0.76 C ATOM 0 H PHE A 71 33.458 14.896 17.753 1.00 0.47 H new ATOM 0 HA PHE A 71 30.944 15.008 19.029 1.00 0.56 H new ATOM 0 HB2 PHE A 71 31.508 17.083 18.188 1.00 0.63 H new ATOM 0 HB3 PHE A 71 32.428 16.410 16.856 1.00 0.63 H new ATOM 0 HD1 PHE A 71 31.005 15.279 14.903 1.00 0.71 H new ATOM 0 HD2 PHE A 71 29.417 18.029 17.797 1.00 0.58 H new ATOM 0 HE1 PHE A 71 29.106 15.788 13.385 1.00 0.80 H new ATOM 0 HE2 PHE A 71 27.525 18.535 16.285 1.00 0.64 H new ATOM 0 HZ PHE A 71 27.364 17.413 14.080 1.00 0.76 H new ATOM 1259 N VAL A 72 30.945 13.461 16.110 1.00 0.65 N ATOM 1260 CA VAL A 72 30.069 12.610 15.277 1.00 0.74 C ATOM 1261 C VAL A 72 29.543 11.499 16.164 1.00 0.66 C ATOM 1262 O VAL A 72 28.422 11.065 16.052 1.00 0.86 O ATOM 1263 CB VAL A 72 30.841 12.040 14.075 1.00 0.80 C ATOM 1264 CG1 VAL A 72 31.622 13.141 13.374 1.00 0.97 C ATOM 1265 CG2 VAL A 72 31.791 10.903 14.473 1.00 0.65 C ATOM 0 H VAL A 72 31.913 13.538 15.799 1.00 0.65 H new ATOM 0 HA VAL A 72 29.243 13.194 14.871 1.00 0.74 H new ATOM 0 HB VAL A 72 30.099 11.625 13.393 1.00 0.80 H new ATOM 0 HG11 VAL A 72 32.162 12.720 12.526 1.00 0.97 H new ATOM 0 HG12 VAL A 72 30.933 13.908 13.021 1.00 0.97 H new ATOM 0 HG13 VAL A 72 32.332 13.585 14.072 1.00 0.97 H new ATOM 0 HG21 VAL A 72 32.311 10.537 13.588 1.00 0.65 H new ATOM 0 HG22 VAL A 72 32.519 11.273 15.194 1.00 0.65 H new ATOM 0 HG23 VAL A 72 31.219 10.090 14.920 1.00 0.65 H new ATOM 1275 N GLY A 73 30.353 11.070 17.070 1.00 0.41 N ATOM 1276 CA GLY A 73 29.930 10.011 18.019 1.00 0.33 C ATOM 1277 C GLY A 73 28.734 10.540 18.804 1.00 0.49 C ATOM 1278 O GLY A 73 27.809 9.816 19.109 1.00 0.57 O ATOM 0 H GLY A 73 31.306 11.409 17.201 1.00 0.41 H new ATOM 0 HA2 GLY A 73 29.662 9.101 17.482 1.00 0.33 H new ATOM 0 HA3 GLY A 73 30.747 9.754 18.694 1.00 0.33 H new ATOM 1282 N MET A 74 28.735 11.815 19.105 1.00 0.61 N ATOM 1283 CA MET A 74 27.584 12.399 19.835 1.00 0.88 C ATOM 1284 C MET A 74 26.337 12.070 19.054 1.00 1.34 C ATOM 1285 O MET A 74 25.346 11.614 19.581 1.00 2.06 O ATOM 1286 CB MET A 74 27.759 13.911 19.942 1.00 0.62 C ATOM 1287 CG MET A 74 29.009 14.208 20.769 1.00 0.50 C ATOM 1288 SD MET A 74 29.027 15.952 21.220 1.00 0.38 S ATOM 1289 CE MET A 74 29.508 16.581 19.595 1.00 0.36 C ATOM 0 H MET A 74 29.483 12.469 18.875 1.00 0.61 H new ATOM 0 HA MET A 74 27.515 11.992 20.844 1.00 0.88 H new ATOM 0 HB2 MET A 74 27.851 14.351 18.949 1.00 0.62 H new ATOM 0 HB3 MET A 74 26.882 14.360 20.409 1.00 0.62 H new ATOM 0 HG2 MET A 74 29.021 13.589 21.666 1.00 0.50 H new ATOM 0 HG3 MET A 74 29.904 13.959 20.198 1.00 0.50 H new ATOM 0 HE1 MET A 74 29.091 17.578 19.453 1.00 0.36 H new ATOM 0 HE2 MET A 74 30.595 16.629 19.531 1.00 0.36 H new ATOM 0 HE3 MET A 74 29.128 15.915 18.820 1.00 0.36 H new ATOM 1299 N LEU A 75 26.399 12.288 17.790 1.00 1.26 N ATOM 1300 CA LEU A 75 25.237 11.990 16.919 1.00 1.65 C ATOM 1301 C LEU A 75 25.362 10.565 16.361 1.00 1.21 C ATOM 1302 O LEU A 75 26.358 10.216 15.769 1.00 1.23 O ATOM 1303 CB LEU A 75 25.183 12.997 15.775 1.00 2.23 C ATOM 1304 CG LEU A 75 26.542 13.081 15.082 1.00 1.32 C ATOM 1305 CD1 LEU A 75 26.566 12.079 13.941 1.00 2.99 C ATOM 1306 CD2 LEU A 75 26.740 14.500 14.548 1.00 0.85 C ATOM 0 H LEU A 75 27.214 12.666 17.307 1.00 1.26 H new ATOM 0 HA LEU A 75 24.318 12.064 17.501 1.00 1.65 H new ATOM 0 HB2 LEU A 75 24.418 12.702 15.057 1.00 2.23 H new ATOM 0 HB3 LEU A 75 24.900 13.978 16.157 1.00 2.23 H new ATOM 0 HG LEU A 75 27.346 12.851 15.781 1.00 1.32 H new ATOM 0 HD11 LEU A 75 27.530 12.126 13.435 1.00 2.99 H new ATOM 0 HD12 LEU A 75 26.412 11.075 14.335 1.00 2.99 H new ATOM 0 HD13 LEU A 75 25.773 12.316 13.232 1.00 2.99 H new ATOM 0 HD21 LEU A 75 27.708 14.570 14.051 1.00 0.85 H new ATOM 0 HD22 LEU A 75 25.949 14.734 13.836 1.00 0.85 H new ATOM 0 HD23 LEU A 75 26.705 15.208 15.376 1.00 0.85 H new ATOM 1318 N PRO A 76 24.337 9.785 16.564 1.00 0.93 N ATOM 1319 CA PRO A 76 24.295 8.398 16.094 1.00 0.52 C ATOM 1320 C PRO A 76 23.937 8.416 14.610 1.00 0.37 C ATOM 1321 O PRO A 76 24.354 9.292 13.884 1.00 0.73 O ATOM 1322 CB PRO A 76 23.187 7.767 16.955 1.00 0.67 C ATOM 1323 CG PRO A 76 22.295 8.934 17.438 1.00 1.02 C ATOM 1324 CD PRO A 76 23.122 10.219 17.264 1.00 1.13 C ATOM 0 HA PRO A 76 25.229 7.845 16.186 1.00 0.52 H new ATOM 0 HB2 PRO A 76 22.607 7.048 16.376 1.00 0.67 H new ATOM 0 HB3 PRO A 76 23.612 7.227 17.801 1.00 0.67 H new ATOM 0 HG2 PRO A 76 21.374 8.984 16.857 1.00 1.02 H new ATOM 0 HG3 PRO A 76 22.007 8.796 18.480 1.00 1.02 H new ATOM 0 HD2 PRO A 76 22.577 10.966 16.687 1.00 1.13 H new ATOM 0 HD3 PRO A 76 23.359 10.671 18.227 1.00 1.13 H new ATOM 1332 N GLU A 77 23.175 7.480 14.147 1.00 0.32 N ATOM 1333 CA GLU A 77 22.805 7.487 12.713 1.00 0.72 C ATOM 1334 C GLU A 77 21.290 7.432 12.579 1.00 0.76 C ATOM 1335 O GLU A 77 20.745 7.480 11.494 1.00 0.96 O ATOM 1336 CB GLU A 77 23.392 6.253 12.050 1.00 1.01 C ATOM 1337 CG GLU A 77 24.727 5.897 12.707 1.00 0.77 C ATOM 1338 CD GLU A 77 25.178 4.518 12.224 1.00 0.93 C ATOM 1339 OE1 GLU A 77 24.338 3.638 12.137 1.00 1.52 O ATOM 1340 OE2 GLU A 77 26.357 4.365 11.950 1.00 1.33 O ATOM 0 H GLU A 77 22.791 6.710 14.696 1.00 0.32 H new ATOM 0 HA GLU A 77 23.186 8.393 12.242 1.00 0.72 H new ATOM 0 HB2 GLU A 77 22.698 5.417 12.138 1.00 1.01 H new ATOM 0 HB3 GLU A 77 23.537 6.435 10.985 1.00 1.01 H new ATOM 0 HG2 GLU A 77 25.479 6.646 12.458 1.00 0.77 H new ATOM 0 HG3 GLU A 77 24.623 5.899 13.792 1.00 0.77 H new ATOM 1347 N LYS A 78 20.616 7.283 13.674 1.00 0.69 N ATOM 1348 CA LYS A 78 19.138 7.167 13.635 1.00 0.91 C ATOM 1349 C LYS A 78 18.421 8.408 14.189 1.00 0.46 C ATOM 1350 O LYS A 78 17.233 8.345 14.438 1.00 0.64 O ATOM 1351 CB LYS A 78 18.731 5.941 14.461 1.00 1.40 C ATOM 1352 CG LYS A 78 18.576 6.321 15.937 1.00 1.40 C ATOM 1353 CD LYS A 78 19.952 6.593 16.558 1.00 1.32 C ATOM 1354 CE LYS A 78 20.887 5.416 16.259 1.00 1.85 C ATOM 1355 NZ LYS A 78 21.692 5.097 17.472 1.00 1.94 N ATOM 0 H LYS A 78 21.028 7.236 14.606 1.00 0.69 H new ATOM 0 HA LYS A 78 18.840 7.070 12.591 1.00 0.91 H new ATOM 0 HB2 LYS A 78 17.793 5.534 14.083 1.00 1.40 H new ATOM 0 HB3 LYS A 78 19.483 5.158 14.357 1.00 1.40 H new ATOM 0 HG2 LYS A 78 17.946 7.206 16.029 1.00 1.40 H new ATOM 0 HG3 LYS A 78 18.077 5.517 16.477 1.00 1.40 H new ATOM 0 HD2 LYS A 78 20.370 7.515 16.154 1.00 1.32 H new ATOM 0 HD3 LYS A 78 19.856 6.731 17.635 1.00 1.32 H new ATOM 0 HE2 LYS A 78 20.306 4.545 15.956 1.00 1.85 H new ATOM 0 HE3 LYS A 78 21.546 5.664 15.427 1.00 1.85 H new ATOM 0 HZ1 LYS A 78 22.679 4.920 17.197 1.00 1.94 H new ATOM 0 HZ2 LYS A 78 21.655 5.899 18.134 1.00 1.94 H new ATOM 0 HZ3 LYS A 78 21.304 4.249 17.933 1.00 1.94 H new ATOM 1369 N ASP A 79 19.059 9.541 14.395 1.00 0.41 N ATOM 1370 CA ASP A 79 18.225 10.673 14.937 1.00 0.88 C ATOM 1371 C ASP A 79 19.021 11.941 15.271 1.00 2.00 C ATOM 1372 O ASP A 79 19.605 12.053 16.330 1.00 3.42 O ATOM 1373 CB ASP A 79 17.515 10.195 16.203 1.00 1.81 C ATOM 1374 CG ASP A 79 16.014 10.085 15.934 1.00 1.92 C ATOM 1375 OD1 ASP A 79 15.412 11.099 15.618 1.00 1.20 O ATOM 1376 OD2 ASP A 79 15.489 8.990 16.048 1.00 3.17 O ATOM 0 H ASP A 79 20.048 9.728 14.227 1.00 0.41 H new ATOM 0 HA ASP A 79 17.526 10.946 14.147 1.00 0.88 H new ATOM 0 HB2 ASP A 79 17.912 9.228 16.512 1.00 1.81 H new ATOM 0 HB3 ASP A 79 17.699 10.892 17.021 1.00 1.81 H new ATOM 1381 N CYS A 80 18.964 12.906 14.380 1.00 1.56 N ATOM 1382 CA CYS A 80 19.632 14.240 14.561 1.00 2.71 C ATOM 1383 C CYS A 80 20.254 14.628 13.223 1.00 0.83 C ATOM 1384 O CYS A 80 20.604 13.771 12.434 1.00 2.22 O ATOM 1385 CB CYS A 80 20.696 14.220 15.661 1.00 5.35 C ATOM 1386 SG CYS A 80 21.904 12.912 15.354 1.00 6.40 S ATOM 0 H CYS A 80 18.460 12.819 13.497 1.00 1.56 H new ATOM 0 HA CYS A 80 18.887 14.971 14.876 1.00 2.71 H new ATOM 0 HB2 CYS A 80 21.200 15.185 15.704 1.00 5.35 H new ATOM 0 HB3 CYS A 80 20.222 14.064 16.630 1.00 5.35 H new ATOM 0 HG CYS A 80 22.208 12.890 14.090 1.00 6.40 H new ATOM 1392 N ARG A 81 20.356 15.895 12.915 1.00 0.95 N ATOM 1393 CA ARG A 81 20.909 16.242 11.578 1.00 1.62 C ATOM 1394 C ARG A 81 21.678 17.577 11.542 1.00 0.93 C ATOM 1395 O ARG A 81 22.775 17.623 11.024 1.00 0.84 O ATOM 1396 CB ARG A 81 19.750 16.302 10.585 1.00 3.69 C ATOM 1397 CG ARG A 81 20.265 16.008 9.178 1.00 5.16 C ATOM 1398 CD ARG A 81 19.488 16.856 8.172 1.00 7.42 C ATOM 1399 NE ARG A 81 20.246 16.934 6.893 1.00 9.35 N ATOM 1400 CZ ARG A 81 19.602 17.035 5.764 1.00 11.17 C ATOM 1401 NH1 ARG A 81 18.917 16.021 5.311 1.00 12.53 N ATOM 1402 NH2 ARG A 81 19.638 18.152 5.090 1.00 11.82 N ATOM 0 H ARG A 81 20.090 16.679 13.510 1.00 0.95 H new ATOM 0 HA ARG A 81 21.634 15.470 11.320 1.00 1.62 H new ATOM 0 HB2 ARG A 81 18.983 15.578 10.861 1.00 3.69 H new ATOM 0 HB3 ARG A 81 19.284 17.287 10.614 1.00 3.69 H new ATOM 0 HG2 ARG A 81 21.330 16.231 9.114 1.00 5.16 H new ATOM 0 HG3 ARG A 81 20.146 14.949 8.948 1.00 5.16 H new ATOM 0 HD2 ARG A 81 18.504 16.420 7.997 1.00 7.42 H new ATOM 0 HD3 ARG A 81 19.327 17.857 8.573 1.00 7.42 H new ATOM 0 HE ARG A 81 21.266 16.909 6.900 1.00 9.35 H new ATOM 0 HH11 ARG A 81 18.885 15.150 5.840 1.00 12.53 H new ATOM 0 HH12 ARG A 81 18.413 16.100 4.428 1.00 12.53 H new ATOM 0 HH21 ARG A 81 20.170 18.946 5.447 1.00 11.82 H new ATOM 0 HH22 ARG A 81 19.134 18.231 4.207 1.00 11.82 H new ATOM 1416 N TYR A 82 21.139 18.677 12.021 1.00 0.83 N ATOM 1417 CA TYR A 82 21.916 19.948 11.902 1.00 0.52 C ATOM 1418 C TYR A 82 22.804 20.154 13.119 1.00 0.63 C ATOM 1419 O TYR A 82 22.372 20.058 14.242 1.00 0.94 O ATOM 1420 CB TYR A 82 20.939 21.094 11.681 1.00 0.66 C ATOM 1421 CG TYR A 82 20.414 20.984 10.259 1.00 0.47 C ATOM 1422 CD1 TYR A 82 20.897 19.976 9.405 1.00 0.40 C ATOM 1423 CD2 TYR A 82 19.449 21.877 9.792 1.00 0.40 C ATOM 1424 CE1 TYR A 82 20.414 19.869 8.098 1.00 0.29 C ATOM 1425 CE2 TYR A 82 18.963 21.769 8.484 1.00 0.30 C ATOM 1426 CZ TYR A 82 19.447 20.767 7.637 1.00 0.27 C ATOM 1427 OH TYR A 82 18.962 20.661 6.351 1.00 0.32 O ATOM 0 H TYR A 82 20.227 18.748 12.473 1.00 0.83 H new ATOM 0 HA TYR A 82 22.589 19.904 11.046 1.00 0.52 H new ATOM 0 HB2 TYR A 82 20.119 21.041 12.397 1.00 0.66 H new ATOM 0 HB3 TYR A 82 21.434 22.053 11.833 1.00 0.66 H new ATOM 0 HD1 TYR A 82 21.644 19.282 9.761 1.00 0.40 H new ATOM 0 HD2 TYR A 82 19.076 22.654 10.442 1.00 0.40 H new ATOM 0 HE1 TYR A 82 20.787 19.094 7.445 1.00 0.29 H new ATOM 0 HE2 TYR A 82 18.213 22.460 8.128 1.00 0.30 H new ATOM 0 HH TYR A 82 18.026 20.952 6.329 1.00 0.32 H new ATOM 1437 N ALA A 83 24.070 20.403 12.894 1.00 0.34 N ATOM 1438 CA ALA A 83 24.998 20.564 14.029 1.00 0.38 C ATOM 1439 C ALA A 83 26.067 21.608 13.739 1.00 0.30 C ATOM 1440 O ALA A 83 26.776 21.547 12.756 1.00 0.27 O ATOM 1441 CB ALA A 83 25.698 19.231 14.296 1.00 0.41 C ATOM 0 H ALA A 83 24.491 20.500 11.970 1.00 0.34 H new ATOM 0 HA ALA A 83 24.415 20.888 14.891 1.00 0.38 H new ATOM 0 HB1 ALA A 83 26.386 19.343 15.134 1.00 0.41 H new ATOM 0 HB2 ALA A 83 24.954 18.471 14.536 1.00 0.41 H new ATOM 0 HB3 ALA A 83 26.254 18.928 13.409 1.00 0.41 H new ATOM 1447 N LEU A 84 26.219 22.539 14.620 1.00 0.29 N ATOM 1448 CA LEU A 84 27.281 23.555 14.433 1.00 0.31 C ATOM 1449 C LEU A 84 28.376 23.323 15.430 1.00 0.24 C ATOM 1450 O LEU A 84 28.244 23.555 16.613 1.00 0.17 O ATOM 1451 CB LEU A 84 26.732 24.957 14.535 1.00 0.43 C ATOM 1452 CG LEU A 84 26.546 25.451 13.118 1.00 0.61 C ATOM 1453 CD1 LEU A 84 25.661 24.463 12.423 1.00 2.74 C ATOM 1454 CD2 LEU A 84 25.923 26.844 13.118 1.00 2.31 C ATOM 0 H LEU A 84 25.656 22.645 15.464 1.00 0.29 H new ATOM 0 HA LEU A 84 27.691 23.451 13.428 1.00 0.31 H new ATOM 0 HB2 LEU A 84 25.785 24.964 15.075 1.00 0.43 H new ATOM 0 HB3 LEU A 84 27.417 25.603 15.084 1.00 0.43 H new ATOM 0 HG LEU A 84 27.503 25.531 12.602 1.00 0.61 H new ATOM 0 HD11 LEU A 84 25.499 24.781 11.393 1.00 2.74 H new ATOM 0 HD12 LEU A 84 26.136 23.482 12.430 1.00 2.74 H new ATOM 0 HD13 LEU A 84 24.703 24.406 12.940 1.00 2.74 H new ATOM 0 HD21 LEU A 84 25.796 27.186 12.091 1.00 2.31 H new ATOM 0 HD22 LEU A 84 24.952 26.808 13.612 1.00 2.31 H new ATOM 0 HD23 LEU A 84 26.576 27.535 13.652 1.00 2.31 H new ATOM 1466 N TYR A 85 29.462 22.839 14.930 1.00 0.28 N ATOM 1467 CA TYR A 85 30.621 22.537 15.804 1.00 0.25 C ATOM 1468 C TYR A 85 31.736 23.543 15.578 1.00 0.34 C ATOM 1469 O TYR A 85 32.188 23.759 14.472 1.00 0.55 O ATOM 1470 CB TYR A 85 31.150 21.148 15.499 1.00 0.21 C ATOM 1471 CG TYR A 85 32.606 21.094 15.885 1.00 0.23 C ATOM 1472 CD1 TYR A 85 32.968 20.958 17.236 1.00 0.24 C ATOM 1473 CD2 TYR A 85 33.597 21.172 14.893 1.00 0.30 C ATOM 1474 CE1 TYR A 85 34.328 20.897 17.590 1.00 0.27 C ATOM 1475 CE2 TYR A 85 34.950 21.113 15.254 1.00 0.36 C ATOM 1476 CZ TYR A 85 35.315 20.971 16.599 1.00 0.32 C ATOM 1477 OH TYR A 85 36.648 20.916 16.951 1.00 0.38 O ATOM 0 H TYR A 85 29.603 22.635 13.941 1.00 0.28 H new ATOM 0 HA TYR A 85 30.289 22.591 16.841 1.00 0.25 H new ATOM 0 HB2 TYR A 85 30.584 20.398 16.051 1.00 0.21 H new ATOM 0 HB3 TYR A 85 31.031 20.922 14.439 1.00 0.21 H new ATOM 0 HD1 TYR A 85 32.206 20.901 17.999 1.00 0.24 H new ATOM 0 HD2 TYR A 85 33.317 21.277 13.855 1.00 0.30 H new ATOM 0 HE1 TYR A 85 34.611 20.793 18.627 1.00 0.27 H new ATOM 0 HE2 TYR A 85 35.714 21.177 14.493 1.00 0.36 H new ATOM 0 HH TYR A 85 37.058 20.118 16.557 1.00 0.38 H new ATOM 1487 N ASP A 86 32.190 24.149 16.629 1.00 0.32 N ATOM 1488 CA ASP A 86 33.292 25.140 16.499 1.00 0.36 C ATOM 1489 C ASP A 86 34.516 24.432 15.920 1.00 0.34 C ATOM 1490 O ASP A 86 35.039 23.506 16.504 1.00 0.53 O ATOM 1491 CB ASP A 86 33.636 25.693 17.874 1.00 0.37 C ATOM 1492 CG ASP A 86 34.325 27.050 17.727 1.00 0.45 C ATOM 1493 OD1 ASP A 86 34.278 27.602 16.640 1.00 0.46 O ATOM 1494 OD2 ASP A 86 34.887 27.515 18.705 1.00 0.75 O ATOM 0 H ASP A 86 31.847 24.003 17.578 1.00 0.32 H new ATOM 0 HA ASP A 86 32.986 25.957 15.846 1.00 0.36 H new ATOM 0 HB2 ASP A 86 32.730 25.797 18.472 1.00 0.37 H new ATOM 0 HB3 ASP A 86 34.289 24.998 18.403 1.00 0.37 H new ATOM 1499 N ALA A 87 34.974 24.846 14.773 1.00 0.33 N ATOM 1500 CA ALA A 87 36.158 24.159 14.166 1.00 0.35 C ATOM 1501 C ALA A 87 37.442 24.945 14.414 1.00 0.37 C ATOM 1502 O ALA A 87 37.499 26.136 14.206 1.00 0.29 O ATOM 1503 CB ALA A 87 35.967 24.026 12.659 1.00 0.34 C ATOM 0 H ALA A 87 34.589 25.620 14.231 1.00 0.33 H new ATOM 0 HA ALA A 87 36.240 23.177 14.632 1.00 0.35 H new ATOM 0 HB1 ALA A 87 36.833 23.525 12.225 1.00 0.34 H new ATOM 0 HB2 ALA A 87 35.070 23.441 12.456 1.00 0.34 H new ATOM 0 HB3 ALA A 87 35.862 25.017 12.217 1.00 0.34 H new ATOM 1509 N SER A 88 38.482 24.265 14.815 1.00 0.52 N ATOM 1510 CA SER A 88 39.788 24.944 15.039 1.00 0.55 C ATOM 1511 C SER A 88 40.782 24.403 14.024 1.00 0.57 C ATOM 1512 O SER A 88 41.347 23.341 14.190 1.00 0.59 O ATOM 1513 CB SER A 88 40.298 24.658 16.444 1.00 0.60 C ATOM 1514 OG SER A 88 39.786 25.636 17.341 1.00 1.37 O ATOM 0 H SER A 88 38.482 23.262 14.998 1.00 0.52 H new ATOM 0 HA SER A 88 39.667 26.021 14.926 1.00 0.55 H new ATOM 0 HB2 SER A 88 39.988 23.662 16.759 1.00 0.60 H new ATOM 0 HB3 SER A 88 41.388 24.672 16.457 1.00 0.60 H new ATOM 0 HG SER A 88 40.112 25.452 18.247 1.00 1.37 H new ATOM 1520 N PHE A 89 40.964 25.109 12.955 1.00 0.56 N ATOM 1521 CA PHE A 89 41.887 24.626 11.892 1.00 0.58 C ATOM 1522 C PHE A 89 42.562 25.793 11.178 1.00 0.64 C ATOM 1523 O PHE A 89 41.922 26.763 10.825 1.00 0.77 O ATOM 1524 CB PHE A 89 41.056 23.899 10.849 1.00 0.47 C ATOM 1525 CG PHE A 89 40.247 24.941 10.118 1.00 0.48 C ATOM 1526 CD1 PHE A 89 39.011 25.350 10.632 1.00 0.49 C ATOM 1527 CD2 PHE A 89 40.739 25.512 8.938 1.00 0.49 C ATOM 1528 CE1 PHE A 89 38.265 26.327 9.962 1.00 0.51 C ATOM 1529 CE2 PHE A 89 39.994 26.490 8.269 1.00 0.51 C ATOM 1530 CZ PHE A 89 38.756 26.898 8.780 1.00 0.52 C ATOM 0 H PHE A 89 40.514 26.005 12.765 1.00 0.56 H new ATOM 0 HA PHE A 89 42.643 23.989 12.351 1.00 0.58 H new ATOM 0 HB2 PHE A 89 41.698 23.355 10.156 1.00 0.47 H new ATOM 0 HB3 PHE A 89 40.402 23.166 11.321 1.00 0.47 H new ATOM 0 HD1 PHE A 89 38.633 24.912 11.544 1.00 0.49 H new ATOM 0 HD2 PHE A 89 41.694 25.198 8.544 1.00 0.49 H new ATOM 0 HE1 PHE A 89 37.310 26.641 10.356 1.00 0.51 H new ATOM 0 HE2 PHE A 89 40.374 26.930 7.359 1.00 0.51 H new ATOM 0 HZ PHE A 89 38.180 27.652 8.264 1.00 0.52 H new ATOM 1540 N GLU A 90 43.831 25.686 10.895 1.00 0.63 N ATOM 1541 CA GLU A 90 44.484 26.772 10.125 1.00 0.71 C ATOM 1542 C GLU A 90 44.183 26.516 8.670 1.00 0.68 C ATOM 1543 O GLU A 90 43.634 25.499 8.310 1.00 1.44 O ATOM 1544 CB GLU A 90 45.993 26.781 10.306 1.00 0.80 C ATOM 1545 CG GLU A 90 46.311 26.909 11.781 1.00 0.91 C ATOM 1546 CD GLU A 90 47.318 25.833 12.191 1.00 0.95 C ATOM 1547 OE1 GLU A 90 48.307 25.678 11.493 1.00 1.14 O ATOM 1548 OE2 GLU A 90 47.081 25.180 13.194 1.00 1.50 O ATOM 0 H GLU A 90 44.433 24.906 11.160 1.00 0.63 H new ATOM 0 HA GLU A 90 44.106 27.733 10.475 1.00 0.71 H new ATOM 0 HB2 GLU A 90 46.426 25.864 9.906 1.00 0.80 H new ATOM 0 HB3 GLU A 90 46.434 27.610 9.752 1.00 0.80 H new ATOM 0 HG2 GLU A 90 46.718 27.899 11.990 1.00 0.91 H new ATOM 0 HG3 GLU A 90 45.399 26.809 12.369 1.00 0.91 H new ATOM 1555 N THR A 91 44.525 27.417 7.831 1.00 0.84 N ATOM 1556 CA THR A 91 44.221 27.205 6.400 1.00 0.63 C ATOM 1557 C THR A 91 45.278 27.933 5.561 1.00 0.69 C ATOM 1558 O THR A 91 46.215 28.484 6.104 1.00 0.77 O ATOM 1559 CB THR A 91 42.846 27.843 6.146 1.00 0.78 C ATOM 1560 OG1 THR A 91 42.764 28.347 4.820 1.00 0.81 O ATOM 1561 CG2 THR A 91 42.659 28.997 7.125 1.00 0.91 C ATOM 0 H THR A 91 45.000 28.290 8.060 1.00 0.84 H new ATOM 0 HA THR A 91 44.221 26.147 6.138 1.00 0.63 H new ATOM 0 HB THR A 91 42.072 27.088 6.282 1.00 0.78 H new ATOM 0 HG1 THR A 91 41.881 28.748 4.676 1.00 0.81 H new ATOM 0 HG21 THR A 91 41.687 29.462 6.958 1.00 0.91 H new ATOM 0 HG22 THR A 91 42.711 28.620 8.146 1.00 0.91 H new ATOM 0 HG23 THR A 91 43.445 29.736 6.971 1.00 0.91 H new ATOM 1569 N LYS A 92 45.141 28.029 4.256 1.00 0.72 N ATOM 1570 CA LYS A 92 46.133 28.835 3.537 1.00 0.85 C ATOM 1571 C LYS A 92 46.016 30.227 4.166 1.00 1.01 C ATOM 1572 O LYS A 92 46.913 31.044 4.089 1.00 1.14 O ATOM 1573 CB LYS A 92 45.796 28.871 2.044 1.00 0.95 C ATOM 1574 CG LYS A 92 46.131 27.513 1.418 1.00 0.84 C ATOM 1575 CD LYS A 92 46.977 27.724 0.160 1.00 0.92 C ATOM 1576 CE LYS A 92 48.374 27.144 0.385 1.00 1.02 C ATOM 1577 NZ LYS A 92 49.225 28.147 1.087 1.00 2.33 N ATOM 0 H LYS A 92 44.409 27.596 3.692 1.00 0.72 H new ATOM 0 HA LYS A 92 47.145 28.437 3.614 1.00 0.85 H new ATOM 0 HB2 LYS A 92 44.739 29.099 1.903 1.00 0.95 H new ATOM 0 HB3 LYS A 92 46.361 29.662 1.550 1.00 0.95 H new ATOM 0 HG2 LYS A 92 46.673 26.895 2.134 1.00 0.84 H new ATOM 0 HG3 LYS A 92 45.214 26.980 1.167 1.00 0.84 H new ATOM 0 HD2 LYS A 92 46.504 27.241 -0.695 1.00 0.92 H new ATOM 0 HD3 LYS A 92 47.045 28.787 -0.072 1.00 0.92 H new ATOM 0 HE2 LYS A 92 48.309 26.230 0.976 1.00 1.02 H new ATOM 0 HE3 LYS A 92 48.825 26.874 -0.570 1.00 1.02 H new ATOM 0 HZ1 LYS A 92 50.175 27.751 1.239 1.00 2.33 H new ATOM 0 HZ2 LYS A 92 49.298 29.007 0.507 1.00 2.33 H new ATOM 0 HZ3 LYS A 92 48.797 28.383 2.005 1.00 2.33 H new ATOM 1591 N GLU A 93 44.898 30.475 4.831 1.00 1.01 N ATOM 1592 CA GLU A 93 44.675 31.749 5.513 1.00 1.18 C ATOM 1593 C GLU A 93 45.367 31.692 6.881 1.00 1.20 C ATOM 1594 O GLU A 93 45.819 32.703 7.375 1.00 1.40 O ATOM 1595 CB GLU A 93 43.163 31.951 5.657 1.00 1.20 C ATOM 1596 CG GLU A 93 42.875 33.035 6.679 1.00 1.99 C ATOM 1597 CD GLU A 93 42.919 34.405 5.999 1.00 2.76 C ATOM 1598 OE1 GLU A 93 42.404 34.515 4.899 1.00 1.99 O ATOM 1599 OE2 GLU A 93 43.465 35.322 6.591 1.00 4.36 O ATOM 0 H GLU A 93 44.127 29.812 4.915 1.00 1.01 H new ATOM 0 HA GLU A 93 45.089 32.587 4.952 1.00 1.18 H new ATOM 0 HB2 GLU A 93 42.732 32.225 4.694 1.00 1.20 H new ATOM 0 HB3 GLU A 93 42.691 31.017 5.963 1.00 1.20 H new ATOM 0 HG2 GLU A 93 41.896 32.873 7.130 1.00 1.99 H new ATOM 0 HG3 GLU A 93 43.608 32.994 7.485 1.00 1.99 H new ATOM 1606 N SER A 94 45.452 30.500 7.464 1.00 1.02 N ATOM 1607 CA SER A 94 46.114 30.281 8.789 1.00 1.08 C ATOM 1608 C SER A 94 45.091 29.850 9.832 1.00 1.02 C ATOM 1609 O SER A 94 43.927 29.656 9.547 1.00 0.98 O ATOM 1610 CB SER A 94 46.726 31.559 9.299 1.00 1.25 C ATOM 1611 OG SER A 94 47.752 31.996 8.414 1.00 1.15 O ATOM 0 H SER A 94 45.072 29.649 7.050 1.00 1.02 H new ATOM 0 HA SER A 94 46.875 29.515 8.640 1.00 1.08 H new ATOM 0 HB2 SER A 94 45.959 32.329 9.388 1.00 1.25 H new ATOM 0 HB3 SER A 94 47.137 31.402 10.296 1.00 1.25 H new ATOM 0 HG SER A 94 47.380 32.637 7.773 1.00 1.15 H new ATOM 1617 N ARG A 95 45.530 29.761 11.060 1.00 1.09 N ATOM 1618 CA ARG A 95 44.606 29.420 12.161 1.00 1.08 C ATOM 1619 C ARG A 95 43.414 30.318 11.977 1.00 1.18 C ATOM 1620 O ARG A 95 43.507 31.525 12.062 1.00 1.57 O ATOM 1621 CB ARG A 95 45.247 29.717 13.507 1.00 1.17 C ATOM 1622 CG ARG A 95 44.633 28.816 14.581 1.00 1.06 C ATOM 1623 CD ARG A 95 45.418 27.506 14.658 1.00 1.56 C ATOM 1624 NE ARG A 95 45.903 27.296 16.052 1.00 2.15 N ATOM 1625 CZ ARG A 95 47.053 27.793 16.423 1.00 2.64 C ATOM 1626 NH1 ARG A 95 47.208 29.085 16.513 1.00 2.39 N ATOM 1627 NH2 ARG A 95 48.046 26.997 16.706 1.00 3.80 N ATOM 0 H ARG A 95 46.499 29.913 11.341 1.00 1.09 H new ATOM 0 HA ARG A 95 44.343 28.362 12.143 1.00 1.08 H new ATOM 0 HB2 ARG A 95 46.323 29.552 13.452 1.00 1.17 H new ATOM 0 HB3 ARG A 95 45.098 30.765 13.769 1.00 1.17 H new ATOM 0 HG2 ARG A 95 44.651 29.320 15.547 1.00 1.06 H new ATOM 0 HG3 ARG A 95 43.588 28.613 14.346 1.00 1.06 H new ATOM 0 HD2 ARG A 95 44.785 26.673 14.353 1.00 1.56 H new ATOM 0 HD3 ARG A 95 46.262 27.535 13.969 1.00 1.56 H new ATOM 0 HE ARG A 95 45.338 26.765 16.715 1.00 2.15 H new ATOM 0 HH11 ARG A 95 46.431 29.708 16.294 1.00 2.39 H new ATOM 0 HH12 ARG A 95 48.106 29.472 16.803 1.00 2.39 H new ATOM 0 HH21 ARG A 95 47.925 25.987 16.638 1.00 3.80 H new ATOM 0 HH22 ARG A 95 48.944 27.385 16.996 1.00 3.80 H new ATOM 1641 N LYS A 96 42.322 29.750 11.664 1.00 0.92 N ATOM 1642 CA LYS A 96 41.127 30.586 11.396 1.00 1.10 C ATOM 1643 C LYS A 96 39.863 29.969 11.976 1.00 0.92 C ATOM 1644 O LYS A 96 38.787 30.198 11.466 1.00 1.51 O ATOM 1645 CB LYS A 96 40.979 30.710 9.890 1.00 1.21 C ATOM 1646 CG LYS A 96 42.053 31.662 9.351 1.00 1.29 C ATOM 1647 CD LYS A 96 41.642 33.117 9.590 1.00 1.05 C ATOM 1648 CE LYS A 96 40.175 33.309 9.194 1.00 1.14 C ATOM 1649 NZ LYS A 96 39.912 34.746 8.902 1.00 0.97 N ATOM 0 H LYS A 96 42.185 28.743 11.577 1.00 0.92 H new ATOM 0 HA LYS A 96 41.261 31.560 11.868 1.00 1.10 H new ATOM 0 HB2 LYS A 96 41.077 29.731 9.422 1.00 1.21 H new ATOM 0 HB3 LYS A 96 39.986 31.085 9.640 1.00 1.21 H new ATOM 0 HG2 LYS A 96 43.006 31.461 9.841 1.00 1.29 H new ATOM 0 HG3 LYS A 96 42.200 31.489 8.285 1.00 1.29 H new ATOM 0 HD2 LYS A 96 41.783 33.377 10.639 1.00 1.05 H new ATOM 0 HD3 LYS A 96 42.277 33.785 9.008 1.00 1.05 H new ATOM 0 HE2 LYS A 96 39.943 32.703 8.318 1.00 1.14 H new ATOM 0 HE3 LYS A 96 39.524 32.968 9.999 1.00 1.14 H new ATOM 0 HZ1 LYS A 96 38.915 34.869 8.634 1.00 0.97 H new ATOM 0 HZ2 LYS A 96 40.116 35.315 9.748 1.00 0.97 H new ATOM 0 HZ3 LYS A 96 40.522 35.059 8.120 1.00 0.97 H new ATOM 1663 N GLU A 97 40.000 29.207 13.030 1.00 1.12 N ATOM 1664 CA GLU A 97 38.842 28.560 13.694 1.00 0.88 C ATOM 1665 C GLU A 97 37.538 28.935 13.029 1.00 0.71 C ATOM 1666 O GLU A 97 37.061 30.049 13.143 1.00 0.76 O ATOM 1667 CB GLU A 97 38.776 29.004 15.137 1.00 1.11 C ATOM 1668 CG GLU A 97 38.053 27.928 15.913 1.00 0.97 C ATOM 1669 CD GLU A 97 37.987 28.301 17.395 1.00 1.28 C ATOM 1670 OE1 GLU A 97 37.753 29.464 17.683 1.00 1.70 O ATOM 1671 OE2 GLU A 97 38.172 27.419 18.218 1.00 1.10 O ATOM 0 H GLU A 97 40.899 29.004 13.467 1.00 1.12 H new ATOM 0 HA GLU A 97 38.981 27.481 13.620 1.00 0.88 H new ATOM 0 HB2 GLU A 97 39.778 29.157 15.537 1.00 1.11 H new ATOM 0 HB3 GLU A 97 38.251 29.955 15.221 1.00 1.11 H new ATOM 0 HG2 GLU A 97 37.045 27.799 15.518 1.00 0.97 H new ATOM 0 HG3 GLU A 97 38.567 26.975 15.793 1.00 0.97 H new ATOM 1678 N GLU A 98 36.960 28.022 12.335 1.00 0.52 N ATOM 1679 CA GLU A 98 35.682 28.332 11.654 1.00 0.38 C ATOM 1680 C GLU A 98 34.723 27.149 11.737 1.00 0.36 C ATOM 1681 O GLU A 98 34.800 26.196 10.986 1.00 0.36 O ATOM 1682 CB GLU A 98 35.964 28.711 10.201 1.00 0.33 C ATOM 1683 CG GLU A 98 35.001 27.998 9.250 1.00 0.32 C ATOM 1684 CD GLU A 98 34.921 28.772 7.932 1.00 0.37 C ATOM 1685 OE1 GLU A 98 34.859 29.990 7.986 1.00 1.00 O ATOM 1686 OE2 GLU A 98 34.925 28.134 6.892 1.00 0.70 O ATOM 0 H GLU A 98 37.310 27.073 12.204 1.00 0.52 H new ATOM 0 HA GLU A 98 35.203 29.174 12.153 1.00 0.38 H new ATOM 0 HB2 GLU A 98 35.869 29.790 10.078 1.00 0.33 H new ATOM 0 HB3 GLU A 98 36.991 28.450 9.947 1.00 0.33 H new ATOM 0 HG2 GLU A 98 35.342 26.979 9.066 1.00 0.32 H new ATOM 0 HG3 GLU A 98 34.012 27.926 9.703 1.00 0.32 H new ATOM 1693 N LEU A 99 33.806 27.233 12.652 1.00 0.38 N ATOM 1694 CA LEU A 99 32.784 26.154 12.821 1.00 0.37 C ATOM 1695 C LEU A 99 32.243 25.751 11.474 1.00 0.31 C ATOM 1696 O LEU A 99 32.564 26.326 10.452 1.00 0.28 O ATOM 1697 CB LEU A 99 31.609 26.681 13.619 1.00 0.40 C ATOM 1698 CG LEU A 99 30.997 27.861 12.866 1.00 0.26 C ATOM 1699 CD1 LEU A 99 29.733 27.395 12.143 1.00 0.26 C ATOM 1700 CD2 LEU A 99 30.657 28.981 13.857 1.00 0.21 C ATOM 0 H LEU A 99 33.714 28.013 13.303 1.00 0.38 H new ATOM 0 HA LEU A 99 33.258 25.312 13.325 1.00 0.37 H new ATOM 0 HB2 LEU A 99 30.866 25.896 13.761 1.00 0.40 H new ATOM 0 HB3 LEU A 99 31.935 26.994 14.611 1.00 0.40 H new ATOM 0 HG LEU A 99 31.709 28.242 12.134 1.00 0.26 H new ATOM 0 HD11 LEU A 99 29.292 28.234 11.604 1.00 0.26 H new ATOM 0 HD12 LEU A 99 29.988 26.604 11.438 1.00 0.26 H new ATOM 0 HD13 LEU A 99 29.017 27.015 12.871 1.00 0.26 H new ATOM 0 HD21 LEU A 99 30.220 29.823 13.319 1.00 0.21 H new ATOM 0 HD22 LEU A 99 29.943 28.611 14.593 1.00 0.21 H new ATOM 0 HD23 LEU A 99 31.565 29.306 14.364 1.00 0.21 H new ATOM 1712 N MET A 100 31.433 24.745 11.463 1.00 0.30 N ATOM 1713 CA MET A 100 30.885 24.278 10.185 1.00 0.25 C ATOM 1714 C MET A 100 29.522 23.650 10.355 1.00 0.27 C ATOM 1715 O MET A 100 29.285 22.826 11.216 1.00 0.32 O ATOM 1716 CB MET A 100 31.841 23.266 9.647 1.00 0.21 C ATOM 1717 CG MET A 100 33.235 23.897 9.631 1.00 0.21 C ATOM 1718 SD MET A 100 34.398 22.796 8.804 1.00 0.20 S ATOM 1719 CE MET A 100 33.281 21.393 8.790 1.00 0.25 C ATOM 0 H MET A 100 31.128 24.227 12.287 1.00 0.30 H new ATOM 0 HA MET A 100 30.763 25.122 9.506 1.00 0.25 H new ATOM 0 HB2 MET A 100 31.835 22.369 10.266 1.00 0.21 H new ATOM 0 HB3 MET A 100 31.549 22.961 8.642 1.00 0.21 H new ATOM 0 HG2 MET A 100 33.203 24.858 9.118 1.00 0.21 H new ATOM 0 HG3 MET A 100 33.567 24.091 10.651 1.00 0.21 H new ATOM 0 HE1 MET A 100 33.764 20.548 8.299 1.00 0.25 H new ATOM 0 HE2 MET A 100 33.026 21.120 9.814 1.00 0.25 H new ATOM 0 HE3 MET A 100 32.373 21.657 8.248 1.00 0.25 H new ATOM 1729 N PHE A 101 28.632 24.041 9.508 1.00 0.23 N ATOM 1730 CA PHE A 101 27.266 23.503 9.543 1.00 0.25 C ATOM 1731 C PHE A 101 27.306 21.987 9.360 1.00 0.22 C ATOM 1732 O PHE A 101 27.997 21.493 8.490 1.00 0.22 O ATOM 1733 CB PHE A 101 26.491 24.072 8.369 1.00 0.27 C ATOM 1734 CG PHE A 101 25.015 23.917 8.597 1.00 0.19 C ATOM 1735 CD1 PHE A 101 24.548 23.454 9.823 1.00 0.50 C ATOM 1736 CD2 PHE A 101 24.121 24.210 7.566 1.00 0.17 C ATOM 1737 CE1 PHE A 101 23.172 23.280 10.024 1.00 0.80 C ATOM 1738 CE2 PHE A 101 22.745 24.045 7.768 1.00 0.38 C ATOM 1739 CZ PHE A 101 22.272 23.579 8.994 1.00 0.74 C ATOM 0 H PHE A 101 28.801 24.729 8.774 1.00 0.23 H new ATOM 0 HA PHE A 101 26.804 23.764 10.495 1.00 0.25 H new ATOM 0 HB2 PHE A 101 26.737 25.126 8.238 1.00 0.27 H new ATOM 0 HB3 PHE A 101 26.780 23.560 7.451 1.00 0.27 H new ATOM 0 HD1 PHE A 101 25.244 23.229 10.618 1.00 0.50 H new ATOM 0 HD2 PHE A 101 24.490 24.563 6.614 1.00 0.17 H new ATOM 0 HE1 PHE A 101 22.806 22.916 10.973 1.00 0.80 H new ATOM 0 HE2 PHE A 101 22.051 24.279 6.974 1.00 0.38 H new ATOM 0 HZ PHE A 101 21.211 23.449 9.149 1.00 0.74 H new ATOM 1749 N PHE A 102 26.565 21.229 10.122 1.00 0.22 N ATOM 1750 CA PHE A 102 26.597 19.767 9.887 1.00 0.21 C ATOM 1751 C PHE A 102 25.195 19.276 9.550 1.00 0.29 C ATOM 1752 O PHE A 102 24.333 19.221 10.393 1.00 0.30 O ATOM 1753 CB PHE A 102 27.111 19.046 11.127 1.00 0.10 C ATOM 1754 CG PHE A 102 28.574 18.756 10.941 1.00 0.15 C ATOM 1755 CD1 PHE A 102 28.982 17.869 9.941 1.00 0.17 C ATOM 1756 CD2 PHE A 102 29.521 19.389 11.752 1.00 0.37 C ATOM 1757 CE1 PHE A 102 30.346 17.617 9.750 1.00 0.22 C ATOM 1758 CE2 PHE A 102 30.884 19.135 11.565 1.00 0.52 C ATOM 1759 CZ PHE A 102 31.298 18.250 10.563 1.00 0.42 C ATOM 0 H PHE A 102 25.957 21.551 10.875 1.00 0.22 H new ATOM 0 HA PHE A 102 27.267 19.555 9.054 1.00 0.21 H new ATOM 0 HB2 PHE A 102 26.957 19.661 12.013 1.00 0.10 H new ATOM 0 HB3 PHE A 102 26.558 18.119 11.282 1.00 0.10 H new ATOM 0 HD1 PHE A 102 28.248 17.380 9.318 1.00 0.17 H new ATOM 0 HD2 PHE A 102 29.200 20.074 12.523 1.00 0.37 H new ATOM 0 HE1 PHE A 102 30.665 16.935 8.976 1.00 0.22 H new ATOM 0 HE2 PHE A 102 31.616 19.621 12.193 1.00 0.52 H new ATOM 0 HZ PHE A 102 32.350 18.054 10.416 1.00 0.42 H new ATOM 1769 N LEU A 103 24.965 18.886 8.326 1.00 0.36 N ATOM 1770 CA LEU A 103 23.632 18.360 7.938 1.00 0.45 C ATOM 1771 C LEU A 103 23.628 16.877 8.257 1.00 0.43 C ATOM 1772 O LEU A 103 23.157 16.064 7.493 1.00 0.46 O ATOM 1773 CB LEU A 103 23.431 18.549 6.443 1.00 0.55 C ATOM 1774 CG LEU A 103 23.668 20.011 6.064 1.00 0.58 C ATOM 1775 CD1 LEU A 103 23.529 20.902 7.304 1.00 0.35 C ATOM 1776 CD2 LEU A 103 25.072 20.169 5.479 1.00 0.75 C ATOM 0 H LEU A 103 25.653 18.911 7.573 1.00 0.36 H new ATOM 0 HA LEU A 103 22.837 18.880 8.472 1.00 0.45 H new ATOM 0 HB2 LEU A 103 24.117 17.906 5.891 1.00 0.55 H new ATOM 0 HB3 LEU A 103 22.420 18.251 6.163 1.00 0.55 H new ATOM 0 HG LEU A 103 22.928 20.310 5.322 1.00 0.58 H new ATOM 0 HD11 LEU A 103 23.699 21.942 7.026 1.00 0.35 H new ATOM 0 HD12 LEU A 103 22.526 20.797 7.717 1.00 0.35 H new ATOM 0 HD13 LEU A 103 24.263 20.602 8.052 1.00 0.35 H new ATOM 0 HD21 LEU A 103 25.239 21.212 5.210 1.00 0.75 H new ATOM 0 HD22 LEU A 103 25.811 19.863 6.219 1.00 0.75 H new ATOM 0 HD23 LEU A 103 25.168 19.545 4.591 1.00 0.75 H new ATOM 1788 N TRP A 104 24.198 16.549 9.378 1.00 0.43 N ATOM 1789 CA TRP A 104 24.320 15.147 9.829 1.00 0.42 C ATOM 1790 C TRP A 104 23.186 14.262 9.290 1.00 0.57 C ATOM 1791 O TRP A 104 22.228 13.970 9.977 1.00 0.64 O ATOM 1792 CB TRP A 104 24.300 15.119 11.356 1.00 0.40 C ATOM 1793 CG TRP A 104 24.367 13.701 11.785 1.00 0.41 C ATOM 1794 CD1 TRP A 104 23.822 13.202 12.909 1.00 0.44 C ATOM 1795 CD2 TRP A 104 25.008 12.598 11.101 1.00 0.42 C ATOM 1796 NE1 TRP A 104 24.062 11.833 12.946 1.00 0.46 N ATOM 1797 CE2 TRP A 104 24.816 11.420 11.849 1.00 0.45 C ATOM 1798 CE3 TRP A 104 25.738 12.511 9.905 1.00 0.42 C ATOM 1799 CZ2 TRP A 104 25.341 10.195 11.406 1.00 0.49 C ATOM 1800 CZ3 TRP A 104 26.249 11.309 9.465 1.00 0.47 C ATOM 1801 CH2 TRP A 104 26.060 10.145 10.209 1.00 0.50 C ATOM 0 H TRP A 104 24.600 17.228 10.024 1.00 0.43 H new ATOM 0 HA TRP A 104 25.258 14.749 9.442 1.00 0.42 H new ATOM 0 HB2 TRP A 104 25.143 15.680 11.759 1.00 0.40 H new ATOM 0 HB3 TRP A 104 23.393 15.590 11.735 1.00 0.40 H new ATOM 0 HD1 TRP A 104 23.288 13.769 13.657 1.00 0.44 H new ATOM 0 HE1 TRP A 104 23.729 11.210 13.682 1.00 0.46 H new ATOM 0 HE3 TRP A 104 25.902 13.403 9.319 1.00 0.42 H new ATOM 0 HZ2 TRP A 104 25.190 9.297 11.987 1.00 0.49 H new ATOM 0 HZ3 TRP A 104 26.800 11.268 8.537 1.00 0.47 H new ATOM 0 HH2 TRP A 104 26.468 9.208 9.861 1.00 0.50 H new ATOM 1812 N ALA A 105 23.313 13.806 8.079 1.00 0.79 N ATOM 1813 CA ALA A 105 22.278 12.912 7.495 1.00 0.96 C ATOM 1814 C ALA A 105 22.846 11.490 7.523 1.00 0.85 C ATOM 1815 O ALA A 105 23.746 11.182 6.800 1.00 1.05 O ATOM 1816 CB ALA A 105 21.994 13.333 6.046 1.00 1.33 C ATOM 0 H ALA A 105 24.097 14.016 7.462 1.00 0.79 H new ATOM 0 HA ALA A 105 21.346 12.968 8.058 1.00 0.96 H new ATOM 0 HB1 ALA A 105 21.235 12.677 5.619 1.00 1.33 H new ATOM 0 HB2 ALA A 105 21.635 14.362 6.030 1.00 1.33 H new ATOM 0 HB3 ALA A 105 22.910 13.259 5.459 1.00 1.33 H new ATOM 1822 N PRO A 106 22.336 10.669 8.379 1.00 0.74 N ATOM 1823 CA PRO A 106 22.842 9.291 8.524 1.00 0.82 C ATOM 1824 C PRO A 106 22.400 8.364 7.395 1.00 1.22 C ATOM 1825 O PRO A 106 22.533 7.160 7.486 1.00 2.97 O ATOM 1826 CB PRO A 106 22.259 8.846 9.851 1.00 0.69 C ATOM 1827 CG PRO A 106 21.042 9.762 10.145 1.00 0.73 C ATOM 1828 CD PRO A 106 21.221 11.016 9.273 1.00 0.83 C ATOM 0 HA PRO A 106 23.931 9.255 8.484 1.00 0.82 H new ATOM 0 HB2 PRO A 106 21.952 7.801 9.806 1.00 0.69 H new ATOM 0 HB3 PRO A 106 23.002 8.926 10.644 1.00 0.69 H new ATOM 0 HG2 PRO A 106 20.107 9.254 9.907 1.00 0.73 H new ATOM 0 HG3 PRO A 106 21.001 10.026 11.202 1.00 0.73 H new ATOM 0 HD2 PRO A 106 20.315 11.245 8.712 1.00 0.83 H new ATOM 0 HD3 PRO A 106 21.452 11.893 9.877 1.00 0.83 H new ATOM 1836 N GLU A 107 21.885 8.899 6.340 1.00 1.34 N ATOM 1837 CA GLU A 107 21.439 8.043 5.201 1.00 1.21 C ATOM 1838 C GLU A 107 20.479 6.943 5.690 1.00 1.16 C ATOM 1839 O GLU A 107 20.102 6.064 4.940 1.00 1.28 O ATOM 1840 CB GLU A 107 22.665 7.387 4.582 1.00 1.45 C ATOM 1841 CG GLU A 107 23.075 8.155 3.326 1.00 1.11 C ATOM 1842 CD GLU A 107 22.954 7.242 2.107 1.00 1.02 C ATOM 1843 OE1 GLU A 107 23.539 6.171 2.133 1.00 1.25 O ATOM 1844 OE2 GLU A 107 22.277 7.626 1.167 1.00 1.45 O ATOM 0 H GLU A 107 21.748 9.901 6.206 1.00 1.34 H new ATOM 0 HA GLU A 107 20.918 8.663 4.471 1.00 1.21 H new ATOM 0 HB2 GLU A 107 23.486 7.377 5.299 1.00 1.45 H new ATOM 0 HB3 GLU A 107 22.448 6.349 4.331 1.00 1.45 H new ATOM 0 HG2 GLU A 107 22.441 9.033 3.200 1.00 1.11 H new ATOM 0 HG3 GLU A 107 24.100 8.514 3.425 1.00 1.11 H new ATOM 1851 N LEU A 108 20.106 6.967 6.941 1.00 1.20 N ATOM 1852 CA LEU A 108 19.208 5.921 7.493 1.00 1.15 C ATOM 1853 C LEU A 108 18.212 6.550 8.483 1.00 0.93 C ATOM 1854 O LEU A 108 17.186 5.974 8.785 1.00 0.84 O ATOM 1855 CB LEU A 108 20.087 4.898 8.203 1.00 1.21 C ATOM 1856 CG LEU A 108 19.986 5.107 9.701 1.00 1.13 C ATOM 1857 CD1 LEU A 108 18.702 4.446 10.177 1.00 1.07 C ATOM 1858 CD2 LEU A 108 21.195 4.476 10.381 1.00 1.28 C ATOM 0 H LEU A 108 20.392 7.680 7.612 1.00 1.20 H new ATOM 0 HA LEU A 108 18.633 5.445 6.699 1.00 1.15 H new ATOM 0 HB2 LEU A 108 19.772 3.887 7.943 1.00 1.21 H new ATOM 0 HB3 LEU A 108 21.122 5.003 7.878 1.00 1.21 H new ATOM 0 HG LEU A 108 19.969 6.169 9.947 1.00 1.13 H new ATOM 0 HD11 LEU A 108 18.601 4.580 11.254 1.00 1.07 H new ATOM 0 HD12 LEU A 108 17.850 4.902 9.673 1.00 1.07 H new ATOM 0 HD13 LEU A 108 18.733 3.381 9.945 1.00 1.07 H new ATOM 0 HD21 LEU A 108 21.125 4.625 11.459 1.00 1.28 H new ATOM 0 HD22 LEU A 108 21.219 3.408 10.163 1.00 1.28 H new ATOM 0 HD23 LEU A 108 22.107 4.943 10.009 1.00 1.28 H new ATOM 1870 N ALA A 109 18.518 7.714 9.000 1.00 0.86 N ATOM 1871 CA ALA A 109 17.612 8.383 9.978 1.00 0.72 C ATOM 1872 C ALA A 109 16.161 8.203 9.556 1.00 0.64 C ATOM 1873 O ALA A 109 15.868 7.759 8.464 1.00 0.66 O ATOM 1874 CB ALA A 109 17.928 9.882 10.038 1.00 0.69 C ATOM 0 H ALA A 109 19.368 8.234 8.782 1.00 0.86 H new ATOM 0 HA ALA A 109 17.766 7.932 10.958 1.00 0.72 H new ATOM 0 HB1 ALA A 109 17.263 10.366 10.754 1.00 0.69 H new ATOM 0 HB2 ALA A 109 18.963 10.024 10.351 1.00 0.69 H new ATOM 0 HB3 ALA A 109 17.783 10.324 9.052 1.00 0.69 H new ATOM 1880 N PRO A 110 15.294 8.577 10.442 1.00 0.65 N ATOM 1881 CA PRO A 110 13.850 8.483 10.213 1.00 0.70 C ATOM 1882 C PRO A 110 13.432 9.494 9.143 1.00 0.66 C ATOM 1883 O PRO A 110 13.729 10.664 9.227 1.00 0.65 O ATOM 1884 CB PRO A 110 13.246 8.769 11.595 1.00 0.84 C ATOM 1885 CG PRO A 110 14.336 9.509 12.406 1.00 0.82 C ATOM 1886 CD PRO A 110 15.681 9.153 11.745 1.00 0.71 C ATOM 0 HA PRO A 110 13.512 7.518 9.835 1.00 0.70 H new ATOM 0 HB2 PRO A 110 12.347 9.379 11.507 1.00 0.84 H new ATOM 0 HB3 PRO A 110 12.955 7.843 12.091 1.00 0.84 H new ATOM 0 HG2 PRO A 110 14.168 10.586 12.391 1.00 0.82 H new ATOM 0 HG3 PRO A 110 14.322 9.199 13.451 1.00 0.82 H new ATOM 0 HD2 PRO A 110 16.311 10.034 11.621 1.00 0.71 H new ATOM 0 HD3 PRO A 110 16.245 8.439 12.346 1.00 0.71 H new ATOM 1894 N LEU A 111 12.777 9.023 8.115 1.00 0.67 N ATOM 1895 CA LEU A 111 12.352 9.910 6.990 1.00 0.67 C ATOM 1896 C LEU A 111 11.959 11.302 7.489 1.00 0.67 C ATOM 1897 O LEU A 111 12.060 12.263 6.766 1.00 0.64 O ATOM 1898 CB LEU A 111 11.164 9.266 6.275 1.00 0.85 C ATOM 1899 CG LEU A 111 11.620 7.971 5.600 1.00 0.86 C ATOM 1900 CD1 LEU A 111 11.015 6.773 6.335 1.00 0.89 C ATOM 1901 CD2 LEU A 111 11.154 7.962 4.143 1.00 0.87 C ATOM 0 H LEU A 111 12.514 8.044 8.005 1.00 0.67 H new ATOM 0 HA LEU A 111 13.192 10.028 6.305 1.00 0.67 H new ATOM 0 HB2 LEU A 111 10.366 9.057 6.988 1.00 0.85 H new ATOM 0 HB3 LEU A 111 10.756 9.952 5.533 1.00 0.85 H new ATOM 0 HG LEU A 111 12.708 7.908 5.634 1.00 0.86 H new ATOM 0 HD11 LEU A 111 11.339 5.850 5.855 1.00 0.89 H new ATOM 0 HD12 LEU A 111 11.347 6.778 7.373 1.00 0.89 H new ATOM 0 HD13 LEU A 111 9.927 6.837 6.301 1.00 0.89 H new ATOM 0 HD21 LEU A 111 11.479 7.039 3.663 1.00 0.87 H new ATOM 0 HD22 LEU A 111 10.066 8.025 4.108 1.00 0.87 H new ATOM 0 HD23 LEU A 111 11.584 8.815 3.618 1.00 0.87 H new ATOM 1913 N LYS A 112 11.505 11.434 8.698 1.00 0.71 N ATOM 1914 CA LYS A 112 11.108 12.789 9.180 1.00 0.70 C ATOM 1915 C LYS A 112 12.275 13.778 9.049 1.00 0.40 C ATOM 1916 O LYS A 112 12.106 14.857 8.534 1.00 0.27 O ATOM 1917 CB LYS A 112 10.668 12.713 10.643 1.00 1.00 C ATOM 1918 CG LYS A 112 11.597 11.776 11.415 1.00 1.12 C ATOM 1919 CD LYS A 112 12.241 12.540 12.576 1.00 1.33 C ATOM 1920 CE LYS A 112 13.678 12.922 12.208 1.00 1.31 C ATOM 1921 NZ LYS A 112 14.492 13.062 13.451 1.00 1.76 N ATOM 0 H LYS A 112 11.391 10.675 9.370 1.00 0.71 H new ATOM 0 HA LYS A 112 10.280 13.141 8.565 1.00 0.70 H new ATOM 0 HB2 LYS A 112 10.686 13.707 11.090 1.00 1.00 H new ATOM 0 HB3 LYS A 112 9.641 12.354 10.705 1.00 1.00 H new ATOM 0 HG2 LYS A 112 11.036 10.922 11.794 1.00 1.12 H new ATOM 0 HG3 LYS A 112 12.368 11.383 10.752 1.00 1.12 H new ATOM 0 HD2 LYS A 112 11.662 13.436 12.800 1.00 1.33 H new ATOM 0 HD3 LYS A 112 12.237 11.925 13.476 1.00 1.33 H new ATOM 0 HE2 LYS A 112 14.113 12.161 11.560 1.00 1.31 H new ATOM 0 HE3 LYS A 112 13.685 13.858 11.649 1.00 1.31 H new ATOM 0 HZ1 LYS A 112 15.443 13.403 13.206 1.00 1.76 H new ATOM 0 HZ2 LYS A 112 14.034 13.742 14.091 1.00 1.76 H new ATOM 0 HZ3 LYS A 112 14.566 12.138 13.923 1.00 1.76 H new ATOM 1935 N SER A 113 13.448 13.434 9.512 1.00 0.48 N ATOM 1936 CA SER A 113 14.598 14.383 9.409 1.00 0.57 C ATOM 1937 C SER A 113 15.213 14.302 8.013 1.00 0.68 C ATOM 1938 O SER A 113 16.055 15.095 7.643 1.00 1.30 O ATOM 1939 CB SER A 113 15.657 14.021 10.450 1.00 0.87 C ATOM 1940 OG SER A 113 16.948 14.170 9.877 1.00 1.37 O ATOM 0 H SER A 113 13.660 12.540 9.956 1.00 0.48 H new ATOM 0 HA SER A 113 14.241 15.397 9.589 1.00 0.57 H new ATOM 0 HB2 SER A 113 15.558 14.664 11.325 1.00 0.87 H new ATOM 0 HB3 SER A 113 15.514 12.995 10.790 1.00 0.87 H new ATOM 0 HG SER A 113 17.366 14.988 10.220 1.00 1.37 H new ATOM 1946 N LYS A 114 14.793 13.351 7.235 1.00 0.24 N ATOM 1947 CA LYS A 114 15.340 13.212 5.860 1.00 0.60 C ATOM 1948 C LYS A 114 14.494 14.060 4.914 1.00 0.68 C ATOM 1949 O LYS A 114 14.935 14.489 3.867 1.00 0.96 O ATOM 1950 CB LYS A 114 15.273 11.744 5.455 1.00 0.79 C ATOM 1951 CG LYS A 114 15.647 10.879 6.663 1.00 0.32 C ATOM 1952 CD LYS A 114 17.129 11.072 6.972 1.00 1.92 C ATOM 1953 CE LYS A 114 17.917 9.870 6.456 1.00 2.06 C ATOM 1954 NZ LYS A 114 19.193 10.341 5.849 1.00 3.91 N ATOM 0 H LYS A 114 14.090 12.659 7.493 1.00 0.24 H new ATOM 0 HA LYS A 114 16.376 13.549 5.818 1.00 0.60 H new ATOM 0 HB2 LYS A 114 14.270 11.494 5.108 1.00 0.79 H new ATOM 0 HB3 LYS A 114 15.954 11.550 4.627 1.00 0.79 H new ATOM 0 HG2 LYS A 114 15.043 11.157 7.527 1.00 0.32 H new ATOM 0 HG3 LYS A 114 15.440 9.830 6.453 1.00 0.32 H new ATOM 0 HD2 LYS A 114 17.493 11.987 6.504 1.00 1.92 H new ATOM 0 HD3 LYS A 114 17.276 11.183 8.046 1.00 1.92 H new ATOM 0 HE2 LYS A 114 18.123 9.178 7.273 1.00 2.06 H new ATOM 0 HE3 LYS A 114 17.329 9.325 5.717 1.00 2.06 H new ATOM 0 HZ1 LYS A 114 19.460 9.709 5.068 1.00 3.91 H new ATOM 0 HZ2 LYS A 114 19.069 11.307 5.485 1.00 3.91 H new ATOM 0 HZ3 LYS A 114 19.943 10.336 6.570 1.00 3.91 H new ATOM 1968 N MET A 115 13.279 14.305 5.300 1.00 0.62 N ATOM 1969 CA MET A 115 12.358 15.130 4.470 1.00 0.82 C ATOM 1970 C MET A 115 12.259 16.514 5.065 1.00 0.67 C ATOM 1971 O MET A 115 11.863 17.463 4.419 1.00 0.69 O ATOM 1972 CB MET A 115 10.955 14.559 4.560 1.00 1.02 C ATOM 1973 CG MET A 115 10.986 13.050 4.314 1.00 1.08 C ATOM 1974 SD MET A 115 9.763 12.620 3.051 1.00 2.14 S ATOM 1975 CE MET A 115 8.320 13.288 3.914 1.00 3.08 C ATOM 0 H MET A 115 12.875 13.963 6.172 1.00 0.62 H new ATOM 0 HA MET A 115 12.734 15.144 3.447 1.00 0.82 H new ATOM 0 HB2 MET A 115 10.532 14.767 5.543 1.00 1.02 H new ATOM 0 HB3 MET A 115 10.310 15.042 3.826 1.00 1.02 H new ATOM 0 HG2 MET A 115 11.981 12.744 3.991 1.00 1.08 H new ATOM 0 HG3 MET A 115 10.772 12.515 5.239 1.00 1.08 H new ATOM 0 HE1 MET A 115 7.437 12.704 3.653 1.00 3.08 H new ATOM 0 HE2 MET A 115 8.484 13.236 4.990 1.00 3.08 H new ATOM 0 HE3 MET A 115 8.169 14.327 3.620 1.00 3.08 H new ATOM 1985 N ILE A 116 12.537 16.611 6.320 1.00 0.56 N ATOM 1986 CA ILE A 116 12.387 17.858 7.014 1.00 0.48 C ATOM 1987 C ILE A 116 13.576 18.764 6.813 1.00 0.41 C ATOM 1988 O ILE A 116 13.461 19.889 6.389 1.00 0.38 O ATOM 1989 CB ILE A 116 12.374 17.491 8.457 1.00 0.46 C ATOM 1990 CG1 ILE A 116 10.972 17.115 8.918 1.00 0.42 C ATOM 1991 CG2 ILE A 116 12.900 18.658 9.225 1.00 0.48 C ATOM 1992 CD1 ILE A 116 10.120 16.648 7.729 1.00 2.63 C ATOM 0 H ILE A 116 12.872 15.839 6.896 1.00 0.56 H new ATOM 0 HA ILE A 116 11.496 18.377 6.659 1.00 0.48 H new ATOM 0 HB ILE A 116 13.001 16.616 8.627 1.00 0.46 H new ATOM 0 HG12 ILE A 116 11.029 16.323 9.665 1.00 0.42 H new ATOM 0 HG13 ILE A 116 10.499 17.972 9.397 1.00 0.42 H new ATOM 0 HG21 ILE A 116 12.904 18.421 10.289 1.00 0.48 H new ATOM 0 HG22 ILE A 116 13.916 18.880 8.899 1.00 0.48 H new ATOM 0 HG23 ILE A 116 12.265 19.526 9.048 1.00 0.48 H new ATOM 0 HD11 ILE A 116 9.122 16.384 8.078 1.00 2.63 H new ATOM 0 HD12 ILE A 116 10.047 17.451 6.996 1.00 2.63 H new ATOM 0 HD13 ILE A 116 10.585 15.777 7.268 1.00 2.63 H new ATOM 2004 N TYR A 117 14.711 18.269 7.177 1.00 0.45 N ATOM 2005 CA TYR A 117 15.949 19.067 7.072 1.00 0.46 C ATOM 2006 C TYR A 117 16.119 19.449 5.623 1.00 0.45 C ATOM 2007 O TYR A 117 16.659 20.480 5.281 1.00 0.47 O ATOM 2008 CB TYR A 117 17.102 18.221 7.549 1.00 0.53 C ATOM 2009 CG TYR A 117 17.108 18.214 9.059 1.00 0.55 C ATOM 2010 CD1 TYR A 117 17.122 19.417 9.769 1.00 0.54 C ATOM 2011 CD2 TYR A 117 17.077 16.998 9.744 1.00 0.59 C ATOM 2012 CE1 TYR A 117 17.104 19.401 11.171 1.00 0.55 C ATOM 2013 CE2 TYR A 117 17.063 16.979 11.144 1.00 0.61 C ATOM 2014 CZ TYR A 117 17.075 18.182 11.858 1.00 0.57 C ATOM 2015 OH TYR A 117 17.055 18.169 13.237 1.00 0.58 O ATOM 0 H TYR A 117 14.837 17.328 7.550 1.00 0.45 H new ATOM 0 HA TYR A 117 15.907 19.969 7.682 1.00 0.46 H new ATOM 0 HB2 TYR A 117 17.008 17.204 7.167 1.00 0.53 H new ATOM 0 HB3 TYR A 117 18.044 18.618 7.170 1.00 0.53 H new ATOM 0 HD1 TYR A 117 17.147 20.358 9.239 1.00 0.54 H new ATOM 0 HD2 TYR A 117 17.064 16.069 9.193 1.00 0.59 H new ATOM 0 HE1 TYR A 117 17.113 20.330 11.721 1.00 0.55 H new ATOM 0 HE2 TYR A 117 17.043 16.037 11.672 1.00 0.61 H new ATOM 0 HH TYR A 117 17.952 18.365 13.579 1.00 0.58 H new ATOM 2025 N ALA A 118 15.597 18.632 4.776 1.00 0.44 N ATOM 2026 CA ALA A 118 15.633 18.917 3.338 1.00 0.44 C ATOM 2027 C ALA A 118 15.203 20.368 3.142 1.00 0.42 C ATOM 2028 O ALA A 118 15.808 21.123 2.408 1.00 0.46 O ATOM 2029 CB ALA A 118 14.620 17.996 2.688 1.00 0.39 C ATOM 0 H ALA A 118 15.136 17.758 5.028 1.00 0.44 H new ATOM 0 HA ALA A 118 16.623 18.766 2.908 1.00 0.44 H new ATOM 0 HB1 ALA A 118 14.608 18.170 1.612 1.00 0.39 H new ATOM 0 HB2 ALA A 118 14.892 16.959 2.885 1.00 0.39 H new ATOM 0 HB3 ALA A 118 13.630 18.196 3.099 1.00 0.39 H new ATOM 2035 N SER A 119 14.151 20.754 3.817 1.00 0.37 N ATOM 2036 CA SER A 119 13.656 22.151 3.704 1.00 0.38 C ATOM 2037 C SER A 119 14.074 22.943 4.943 1.00 0.31 C ATOM 2038 O SER A 119 13.904 24.144 5.009 1.00 0.27 O ATOM 2039 CB SER A 119 12.133 22.141 3.614 1.00 0.56 C ATOM 2040 OG SER A 119 11.717 21.097 2.743 1.00 2.36 O ATOM 0 H SER A 119 13.613 20.155 4.444 1.00 0.37 H new ATOM 0 HA SER A 119 14.078 22.613 2.812 1.00 0.38 H new ATOM 0 HB2 SER A 119 11.700 21.997 4.604 1.00 0.56 H new ATOM 0 HB3 SER A 119 11.773 23.102 3.245 1.00 0.56 H new ATOM 0 HG SER A 119 10.875 21.349 2.309 1.00 2.36 H new ATOM 2046 N SER A 120 14.630 22.286 5.927 1.00 0.32 N ATOM 2047 CA SER A 120 15.063 23.029 7.151 1.00 0.31 C ATOM 2048 C SER A 120 16.308 23.809 6.799 1.00 0.18 C ATOM 2049 O SER A 120 16.602 24.817 7.386 1.00 0.24 O ATOM 2050 CB SER A 120 15.365 22.078 8.305 1.00 0.43 C ATOM 2051 OG SER A 120 15.148 22.755 9.534 1.00 0.80 O ATOM 0 H SER A 120 14.802 21.281 5.939 1.00 0.32 H new ATOM 0 HA SER A 120 14.260 23.691 7.474 1.00 0.31 H new ATOM 0 HB2 SER A 120 14.726 21.197 8.243 1.00 0.43 H new ATOM 0 HB3 SER A 120 16.396 21.729 8.245 1.00 0.43 H new ATOM 0 HG SER A 120 15.330 23.711 9.417 1.00 0.80 H new ATOM 2057 N LYS A 121 17.018 23.355 5.816 1.00 0.10 N ATOM 2058 CA LYS A 121 18.222 24.080 5.366 1.00 0.16 C ATOM 2059 C LYS A 121 17.748 25.169 4.438 1.00 0.18 C ATOM 2060 O LYS A 121 17.753 25.088 3.227 1.00 0.33 O ATOM 2061 CB LYS A 121 19.159 23.152 4.674 1.00 0.24 C ATOM 2062 CG LYS A 121 20.327 22.921 5.614 1.00 0.34 C ATOM 2063 CD LYS A 121 21.071 21.667 5.174 1.00 0.51 C ATOM 2064 CE LYS A 121 21.975 22.022 3.994 1.00 0.72 C ATOM 2065 NZ LYS A 121 21.584 21.210 2.804 1.00 0.96 N ATOM 0 H LYS A 121 16.811 22.500 5.299 1.00 0.10 H new ATOM 0 HA LYS A 121 18.767 24.506 6.209 1.00 0.16 H new ATOM 0 HB2 LYS A 121 18.664 22.211 4.435 1.00 0.24 H new ATOM 0 HB3 LYS A 121 19.501 23.580 3.732 1.00 0.24 H new ATOM 0 HG2 LYS A 121 20.997 23.781 5.602 1.00 0.34 H new ATOM 0 HG3 LYS A 121 19.971 22.809 6.638 1.00 0.34 H new ATOM 0 HD2 LYS A 121 21.664 21.271 5.998 1.00 0.51 H new ATOM 0 HD3 LYS A 121 20.364 20.889 4.887 1.00 0.51 H new ATOM 0 HE2 LYS A 121 21.892 23.085 3.766 1.00 0.72 H new ATOM 0 HE3 LYS A 121 23.017 21.832 4.251 1.00 0.72 H new ATOM 0 HZ1 LYS A 121 22.199 21.452 2.001 1.00 0.96 H new ATOM 0 HZ2 LYS A 121 21.685 20.199 3.025 1.00 0.96 H new ATOM 0 HZ3 LYS A 121 20.595 21.413 2.555 1.00 0.96 H new ATOM 2079 N ASP A 122 17.293 26.150 5.083 1.00 0.12 N ATOM 2080 CA ASP A 122 16.699 27.355 4.468 1.00 0.14 C ATOM 2081 C ASP A 122 16.210 28.141 5.661 1.00 0.09 C ATOM 2082 O ASP A 122 16.364 29.342 5.769 1.00 0.10 O ATOM 2083 CB ASP A 122 15.509 26.957 3.594 1.00 0.23 C ATOM 2084 CG ASP A 122 15.704 27.494 2.176 1.00 0.73 C ATOM 2085 OD1 ASP A 122 16.498 26.919 1.450 1.00 1.33 O ATOM 2086 OD2 ASP A 122 15.061 28.475 1.840 1.00 1.43 O ATOM 0 H ASP A 122 17.301 26.186 6.102 1.00 0.12 H new ATOM 0 HA ASP A 122 17.395 27.907 3.837 1.00 0.14 H new ATOM 0 HB2 ASP A 122 15.410 25.872 3.571 1.00 0.23 H new ATOM 0 HB3 ASP A 122 14.586 27.352 4.019 1.00 0.23 H new ATOM 2091 N ALA A 123 15.676 27.409 6.599 1.00 0.17 N ATOM 2092 CA ALA A 123 15.216 28.011 7.870 1.00 0.27 C ATOM 2093 C ALA A 123 16.473 28.235 8.702 1.00 0.34 C ATOM 2094 O ALA A 123 16.830 29.345 9.042 1.00 0.50 O ATOM 2095 CB ALA A 123 14.305 27.015 8.574 1.00 0.31 C ATOM 0 H ALA A 123 15.539 26.401 6.532 1.00 0.17 H new ATOM 0 HA ALA A 123 14.669 28.942 7.718 1.00 0.27 H new ATOM 0 HB1 ALA A 123 13.956 27.442 9.514 1.00 0.31 H new ATOM 0 HB2 ALA A 123 13.449 26.792 7.937 1.00 0.31 H new ATOM 0 HB3 ALA A 123 14.857 26.097 8.776 1.00 0.31 H new ATOM 2101 N ILE A 124 17.176 27.168 8.969 1.00 0.31 N ATOM 2102 CA ILE A 124 18.447 27.260 9.702 1.00 0.38 C ATOM 2103 C ILE A 124 19.326 28.222 8.939 1.00 0.40 C ATOM 2104 O ILE A 124 20.070 28.977 9.504 1.00 0.53 O ATOM 2105 CB ILE A 124 19.102 25.904 9.701 1.00 0.37 C ATOM 2106 CG1 ILE A 124 20.419 26.005 10.445 1.00 0.46 C ATOM 2107 CG2 ILE A 124 19.345 25.473 8.264 1.00 0.32 C ATOM 2108 CD1 ILE A 124 20.662 24.706 11.190 1.00 0.60 C ATOM 0 H ILE A 124 16.908 26.222 8.699 1.00 0.31 H new ATOM 0 HA ILE A 124 18.291 27.593 10.728 1.00 0.38 H new ATOM 0 HB ILE A 124 18.463 25.168 10.190 1.00 0.37 H new ATOM 0 HG12 ILE A 124 21.233 26.197 9.746 1.00 0.46 H new ATOM 0 HG13 ILE A 124 20.394 26.841 11.143 1.00 0.46 H new ATOM 0 HG21 ILE A 124 19.819 24.492 8.254 1.00 0.32 H new ATOM 0 HG22 ILE A 124 18.394 25.422 7.734 1.00 0.32 H new ATOM 0 HG23 ILE A 124 19.996 26.196 7.773 1.00 0.32 H new ATOM 0 HD11 ILE A 124 21.607 24.767 11.729 1.00 0.60 H new ATOM 0 HD12 ILE A 124 19.851 24.535 11.898 1.00 0.60 H new ATOM 0 HD13 ILE A 124 20.703 23.881 10.479 1.00 0.60 H new ATOM 2120 N LYS A 125 19.223 28.178 7.637 1.00 0.31 N ATOM 2121 CA LYS A 125 20.014 29.086 6.761 1.00 0.39 C ATOM 2122 C LYS A 125 19.687 30.537 7.116 1.00 0.32 C ATOM 2123 O LYS A 125 20.547 31.396 7.149 1.00 0.36 O ATOM 2124 CB LYS A 125 19.588 28.853 5.313 1.00 0.45 C ATOM 2125 CG LYS A 125 20.603 27.974 4.590 1.00 0.97 C ATOM 2126 CD LYS A 125 20.825 26.695 5.384 1.00 0.67 C ATOM 2127 CE LYS A 125 22.286 26.629 5.814 1.00 0.33 C ATOM 2128 NZ LYS A 125 23.091 25.973 4.743 1.00 1.34 N ATOM 0 H LYS A 125 18.610 27.536 7.135 1.00 0.31 H new ATOM 0 HA LYS A 125 21.078 28.892 6.894 1.00 0.39 H new ATOM 0 HB2 LYS A 125 18.606 28.380 5.289 1.00 0.45 H new ATOM 0 HB3 LYS A 125 19.494 29.809 4.798 1.00 0.45 H new ATOM 0 HG2 LYS A 125 20.245 27.735 3.589 1.00 0.97 H new ATOM 0 HG3 LYS A 125 21.545 28.510 4.472 1.00 0.97 H new ATOM 0 HD2 LYS A 125 20.174 26.676 6.258 1.00 0.67 H new ATOM 0 HD3 LYS A 125 20.571 25.826 4.778 1.00 0.67 H new ATOM 0 HE2 LYS A 125 22.665 27.633 6.006 1.00 0.33 H new ATOM 0 HE3 LYS A 125 22.377 26.071 6.746 1.00 0.33 H new ATOM 0 HZ1 LYS A 125 24.088 25.928 5.036 1.00 1.34 H new ATOM 0 HZ2 LYS A 125 22.734 25.010 4.581 1.00 1.34 H new ATOM 0 HZ3 LYS A 125 23.013 26.523 3.864 1.00 1.34 H new ATOM 2142 N LYS A 126 18.434 30.813 7.364 1.00 0.29 N ATOM 2143 CA LYS A 126 18.018 32.212 7.699 1.00 0.27 C ATOM 2144 C LYS A 126 18.573 32.618 9.065 1.00 0.34 C ATOM 2145 O LYS A 126 18.452 33.749 9.491 1.00 0.64 O ATOM 2146 CB LYS A 126 16.491 32.294 7.715 1.00 0.42 C ATOM 2147 CG LYS A 126 15.992 32.722 6.335 1.00 0.68 C ATOM 2148 CD LYS A 126 14.674 33.482 6.485 1.00 0.41 C ATOM 2149 CE LYS A 126 13.557 32.717 5.771 1.00 0.92 C ATOM 2150 NZ LYS A 126 12.551 32.260 6.770 1.00 1.55 N ATOM 0 H LYS A 126 17.677 30.130 7.350 1.00 0.29 H new ATOM 0 HA LYS A 126 18.414 32.893 6.946 1.00 0.27 H new ATOM 0 HB2 LYS A 126 16.067 31.327 7.984 1.00 0.42 H new ATOM 0 HB3 LYS A 126 16.162 33.007 8.470 1.00 0.42 H new ATOM 0 HG2 LYS A 126 16.735 33.353 5.847 1.00 0.68 H new ATOM 0 HG3 LYS A 126 15.850 31.847 5.700 1.00 0.68 H new ATOM 0 HD2 LYS A 126 14.430 33.602 7.540 1.00 0.41 H new ATOM 0 HD3 LYS A 126 14.770 34.483 6.064 1.00 0.41 H new ATOM 0 HE2 LYS A 126 13.082 33.356 5.027 1.00 0.92 H new ATOM 0 HE3 LYS A 126 13.971 31.861 5.238 1.00 0.92 H new ATOM 0 HZ1 LYS A 126 11.792 31.740 6.285 1.00 1.55 H new ATOM 0 HZ2 LYS A 126 13.010 31.636 7.464 1.00 1.55 H new ATOM 0 HZ3 LYS A 126 12.148 33.085 7.259 1.00 1.55 H new ATOM 2164 N LYS A 127 19.190 31.702 9.739 1.00 0.40 N ATOM 2165 CA LYS A 127 19.781 31.991 11.067 1.00 0.46 C ATOM 2166 C LYS A 127 21.280 31.738 10.985 1.00 0.19 C ATOM 2167 O LYS A 127 22.056 32.234 11.777 1.00 0.20 O ATOM 2168 CB LYS A 127 19.180 31.049 12.096 1.00 0.82 C ATOM 2169 CG LYS A 127 17.685 30.880 11.822 1.00 1.41 C ATOM 2170 CD LYS A 127 16.950 32.162 12.212 1.00 1.65 C ATOM 2171 CE LYS A 127 15.797 32.409 11.235 1.00 1.91 C ATOM 2172 NZ LYS A 127 14.530 32.590 11.998 1.00 2.10 N ATOM 0 H LYS A 127 19.314 30.741 9.419 1.00 0.40 H new ATOM 0 HA LYS A 127 19.581 33.023 11.354 1.00 0.46 H new ATOM 0 HB2 LYS A 127 19.680 30.081 12.054 1.00 0.82 H new ATOM 0 HB3 LYS A 127 19.334 31.444 13.100 1.00 0.82 H new ATOM 0 HG2 LYS A 127 17.520 30.659 10.767 1.00 1.41 H new ATOM 0 HG3 LYS A 127 17.293 30.036 12.389 1.00 1.41 H new ATOM 0 HD2 LYS A 127 16.567 32.079 13.229 1.00 1.65 H new ATOM 0 HD3 LYS A 127 17.639 33.007 12.199 1.00 1.65 H new ATOM 0 HE2 LYS A 127 16.000 33.294 10.632 1.00 1.91 H new ATOM 0 HE3 LYS A 127 15.703 31.569 10.547 1.00 1.91 H new ATOM 0 HZ1 LYS A 127 13.746 32.758 11.335 1.00 2.10 H new ATOM 0 HZ2 LYS A 127 14.335 31.734 12.555 1.00 2.10 H new ATOM 0 HZ3 LYS A 127 14.623 33.405 12.637 1.00 2.10 H new ATOM 2186 N PHE A 128 21.688 30.972 10.011 1.00 0.24 N ATOM 2187 CA PHE A 128 23.131 30.676 9.838 1.00 0.37 C ATOM 2188 C PHE A 128 23.721 31.700 8.905 1.00 0.56 C ATOM 2189 O PHE A 128 24.488 31.390 8.017 1.00 0.68 O ATOM 2190 CB PHE A 128 23.302 29.274 9.295 1.00 0.59 C ATOM 2191 CG PHE A 128 23.183 28.330 10.461 1.00 0.20 C ATOM 2192 CD1 PHE A 128 22.780 28.831 11.707 1.00 0.12 C ATOM 2193 CD2 PHE A 128 23.487 26.974 10.319 1.00 0.18 C ATOM 2194 CE1 PHE A 128 22.686 27.984 12.799 1.00 0.31 C ATOM 2195 CE2 PHE A 128 23.391 26.125 11.427 1.00 0.50 C ATOM 2196 CZ PHE A 128 22.991 26.630 12.666 1.00 0.57 C ATOM 0 H PHE A 128 21.074 30.536 9.323 1.00 0.24 H new ATOM 0 HA PHE A 128 23.651 30.728 10.795 1.00 0.37 H new ATOM 0 HB2 PHE A 128 22.542 29.056 8.544 1.00 0.59 H new ATOM 0 HB3 PHE A 128 24.271 29.165 8.809 1.00 0.59 H new ATOM 0 HD1 PHE A 128 22.542 29.879 11.816 1.00 0.12 H new ATOM 0 HD2 PHE A 128 23.794 26.583 9.360 1.00 0.18 H new ATOM 0 HE1 PHE A 128 22.375 28.374 13.757 1.00 0.31 H new ATOM 0 HE2 PHE A 128 23.627 25.076 11.324 1.00 0.50 H new ATOM 0 HZ PHE A 128 22.918 25.973 13.520 1.00 0.57 H new ATOM 2206 N GLN A 129 23.339 32.922 9.139 1.00 0.64 N ATOM 2207 CA GLN A 129 23.835 34.075 8.323 1.00 0.87 C ATOM 2208 C GLN A 129 25.207 33.720 7.745 1.00 0.91 C ATOM 2209 O GLN A 129 25.492 33.945 6.585 1.00 1.39 O ATOM 2210 CB GLN A 129 23.979 35.307 9.224 1.00 0.99 C ATOM 2211 CG GLN A 129 22.746 35.456 10.117 1.00 0.92 C ATOM 2212 CD GLN A 129 21.527 35.812 9.262 1.00 0.97 C ATOM 2213 OE1 GLN A 129 20.520 34.984 9.204 1.00 0.80 O flip ATOM 2214 NE2 GLN A 129 21.490 36.856 8.641 1.00 1.61 N flip ATOM 0 H GLN A 129 22.687 33.181 9.880 1.00 0.64 H new ATOM 0 HA GLN A 129 23.132 34.287 7.517 1.00 0.87 H new ATOM 0 HB2 GLN A 129 24.874 35.214 9.840 1.00 0.99 H new ATOM 0 HB3 GLN A 129 24.104 36.201 8.613 1.00 0.99 H new ATOM 0 HG2 GLN A 129 22.563 34.528 10.658 1.00 0.92 H new ATOM 0 HG3 GLN A 129 22.918 36.232 10.863 1.00 0.92 H new ATOM 0 HE21 GLN A 129 22.276 37.504 8.686 1.00 1.61 H new ATOM 0 HE22 GLN A 129 20.672 37.084 8.075 1.00 1.61 H new ATOM 2223 N GLY A 130 26.039 33.133 8.561 1.00 0.60 N ATOM 2224 CA GLY A 130 27.391 32.706 8.110 1.00 0.57 C ATOM 2225 C GLY A 130 27.629 31.291 8.641 1.00 0.40 C ATOM 2226 O GLY A 130 28.247 31.101 9.668 1.00 0.38 O ATOM 0 H GLY A 130 25.833 32.928 9.539 1.00 0.60 H new ATOM 0 HA2 GLY A 130 27.455 32.723 7.022 1.00 0.57 H new ATOM 0 HA3 GLY A 130 28.153 33.389 8.485 1.00 0.57 H new ATOM 2230 N ILE A 131 27.124 30.292 7.964 1.00 0.32 N ATOM 2231 CA ILE A 131 27.303 28.910 8.444 1.00 0.17 C ATOM 2232 C ILE A 131 28.767 28.596 8.523 1.00 0.12 C ATOM 2233 O ILE A 131 29.185 27.750 9.285 1.00 0.15 O ATOM 2234 CB ILE A 131 26.632 27.947 7.458 1.00 0.17 C ATOM 2235 CG1 ILE A 131 25.576 27.126 8.128 1.00 0.11 C ATOM 2236 CG2 ILE A 131 27.636 26.962 6.950 1.00 0.19 C ATOM 2237 CD1 ILE A 131 26.078 26.770 9.510 1.00 0.03 C ATOM 0 H ILE A 131 26.595 30.385 7.097 1.00 0.32 H new ATOM 0 HA ILE A 131 26.853 28.802 9.431 1.00 0.17 H new ATOM 0 HB ILE A 131 26.206 28.559 6.664 1.00 0.17 H new ATOM 0 HG12 ILE A 131 24.642 27.684 8.192 1.00 0.11 H new ATOM 0 HG13 ILE A 131 25.370 26.224 7.552 1.00 0.11 H new ATOM 0 HG21 ILE A 131 27.154 26.280 6.250 1.00 0.19 H new ATOM 0 HG22 ILE A 131 28.442 27.493 6.443 1.00 0.19 H new ATOM 0 HG23 ILE A 131 28.044 26.395 7.786 1.00 0.19 H new ATOM 0 HD11 ILE A 131 25.329 26.170 10.026 1.00 0.03 H new ATOM 0 HD12 ILE A 131 27.004 26.201 9.425 1.00 0.03 H new ATOM 0 HD13 ILE A 131 26.264 27.683 10.076 1.00 0.03 H new ATOM 2249 N LYS A 132 29.538 29.249 7.722 1.00 0.06 N ATOM 2250 CA LYS A 132 30.997 28.984 7.685 1.00 0.10 C ATOM 2251 C LYS A 132 31.199 27.739 6.857 1.00 0.09 C ATOM 2252 O LYS A 132 32.052 27.685 5.992 1.00 0.12 O ATOM 2253 CB LYS A 132 31.577 28.728 9.077 1.00 0.18 C ATOM 2254 CG LYS A 132 30.902 29.622 10.109 1.00 0.17 C ATOM 2255 CD LYS A 132 30.804 31.046 9.571 1.00 0.13 C ATOM 2256 CE LYS A 132 32.206 31.648 9.488 1.00 0.21 C ATOM 2257 NZ LYS A 132 32.176 32.859 8.623 1.00 0.28 N ATOM 0 H LYS A 132 29.218 29.971 7.076 1.00 0.06 H new ATOM 0 HA LYS A 132 31.502 29.857 7.271 1.00 0.10 H new ATOM 0 HB2 LYS A 132 31.439 27.681 9.348 1.00 0.18 H new ATOM 0 HB3 LYS A 132 32.651 28.917 9.070 1.00 0.18 H new ATOM 0 HG2 LYS A 132 29.907 29.241 10.339 1.00 0.17 H new ATOM 0 HG3 LYS A 132 31.470 29.613 11.039 1.00 0.17 H new ATOM 0 HD2 LYS A 132 30.337 31.044 8.586 1.00 0.13 H new ATOM 0 HD3 LYS A 132 30.173 31.651 10.222 1.00 0.13 H new ATOM 0 HE2 LYS A 132 32.561 31.909 10.485 1.00 0.21 H new ATOM 0 HE3 LYS A 132 32.904 30.916 9.083 1.00 0.21 H new ATOM 0 HZ1 LYS A 132 33.130 33.269 8.566 1.00 0.28 H new ATOM 0 HZ2 LYS A 132 31.855 32.597 7.669 1.00 0.28 H new ATOM 0 HZ3 LYS A 132 31.522 33.559 9.028 1.00 0.28 H new ATOM 2271 N HIS A 133 30.426 26.716 7.113 1.00 0.06 N ATOM 2272 CA HIS A 133 30.637 25.480 6.300 1.00 0.06 C ATOM 2273 C HIS A 133 29.406 24.592 6.201 1.00 0.07 C ATOM 2274 O HIS A 133 29.166 23.762 7.051 1.00 0.11 O ATOM 2275 CB HIS A 133 31.735 24.654 6.936 1.00 0.06 C ATOM 2276 CG HIS A 133 33.039 24.967 6.279 1.00 0.18 C ATOM 2277 ND1 HIS A 133 33.164 25.142 4.911 1.00 0.44 N ATOM 2278 CD2 HIS A 133 34.285 25.147 6.799 1.00 0.24 C ATOM 2279 CE1 HIS A 133 34.454 25.420 4.658 1.00 0.59 C ATOM 2280 NE2 HIS A 133 35.183 25.436 5.776 1.00 0.46 N ATOM 0 H HIS A 133 29.689 26.678 7.817 1.00 0.06 H new ATOM 0 HA HIS A 133 30.889 25.818 5.295 1.00 0.06 H new ATOM 0 HB2 HIS A 133 31.793 24.867 8.003 1.00 0.06 H new ATOM 0 HB3 HIS A 133 31.511 23.592 6.835 1.00 0.06 H new ATOM 0 HD1 HIS A 133 32.415 25.073 4.222 1.00 0.44 H new ATOM 0 HD2 HIS A 133 34.538 25.076 7.847 1.00 0.24 H new ATOM 0 HE1 HIS A 133 34.852 25.607 3.672 1.00 0.59 H new ATOM 2288 N GLU A 134 28.676 24.679 5.131 1.00 0.18 N ATOM 2289 CA GLU A 134 27.545 23.753 4.978 1.00 0.22 C ATOM 2290 C GLU A 134 28.154 22.410 4.613 1.00 0.23 C ATOM 2291 O GLU A 134 28.625 22.195 3.515 1.00 0.30 O ATOM 2292 CB GLU A 134 26.622 24.207 3.878 1.00 0.40 C ATOM 2293 CG GLU A 134 25.610 23.109 3.566 1.00 0.39 C ATOM 2294 CD GLU A 134 25.120 23.258 2.125 1.00 0.78 C ATOM 2295 OE1 GLU A 134 24.912 24.384 1.704 1.00 1.16 O ATOM 2296 OE2 GLU A 134 24.962 22.243 1.466 1.00 1.29 O ATOM 0 H GLU A 134 28.815 25.343 4.369 1.00 0.18 H new ATOM 0 HA GLU A 134 26.956 23.703 5.894 1.00 0.22 H new ATOM 0 HB2 GLU A 134 26.103 25.117 4.179 1.00 0.40 H new ATOM 0 HB3 GLU A 134 27.198 24.448 2.984 1.00 0.40 H new ATOM 0 HG2 GLU A 134 26.066 22.129 3.706 1.00 0.39 H new ATOM 0 HG3 GLU A 134 24.768 23.170 4.255 1.00 0.39 H new ATOM 2303 N CYS A 135 28.183 21.540 5.544 1.00 0.23 N ATOM 2304 CA CYS A 135 28.807 20.200 5.312 1.00 0.31 C ATOM 2305 C CYS A 135 27.778 19.086 5.492 1.00 0.32 C ATOM 2306 O CYS A 135 27.402 18.764 6.599 1.00 0.31 O ATOM 2307 CB CYS A 135 29.938 19.999 6.328 1.00 0.34 C ATOM 2308 SG CYS A 135 30.757 18.416 6.018 1.00 0.98 S ATOM 0 H CYS A 135 27.801 21.681 6.479 1.00 0.23 H new ATOM 0 HA CYS A 135 29.192 20.162 4.293 1.00 0.31 H new ATOM 0 HB2 CYS A 135 30.658 20.814 6.252 1.00 0.34 H new ATOM 0 HB3 CYS A 135 29.538 20.021 7.342 1.00 0.34 H new ATOM 0 HG CYS A 135 30.823 17.738 7.125 1.00 0.98 H new ATOM 2314 N GLN A 136 27.326 18.478 4.425 1.00 0.48 N ATOM 2315 CA GLN A 136 26.334 17.381 4.588 1.00 0.62 C ATOM 2316 C GLN A 136 27.054 16.068 4.836 1.00 0.57 C ATOM 2317 O GLN A 136 28.000 15.718 4.158 1.00 0.78 O ATOM 2318 CB GLN A 136 25.436 17.251 3.353 1.00 0.82 C ATOM 2319 CG GLN A 136 23.977 17.243 3.812 1.00 1.55 C ATOM 2320 CD GLN A 136 23.080 16.546 2.803 1.00 1.11 C ATOM 2321 OE1 GLN A 136 23.547 15.948 1.854 1.00 1.38 O ATOM 2322 NE2 GLN A 136 21.788 16.608 2.977 1.00 1.15 N ATOM 0 H GLN A 136 27.597 18.691 3.465 1.00 0.48 H new ATOM 0 HA GLN A 136 25.703 17.623 5.443 1.00 0.62 H new ATOM 0 HB2 GLN A 136 25.613 18.080 2.667 1.00 0.82 H new ATOM 0 HB3 GLN A 136 25.668 16.334 2.811 1.00 0.82 H new ATOM 0 HG2 GLN A 136 23.901 16.741 4.776 1.00 1.55 H new ATOM 0 HG3 GLN A 136 23.635 18.268 3.958 1.00 1.55 H new ATOM 0 HE21 GLN A 136 21.405 17.112 3.777 1.00 1.15 H new ATOM 0 HE22 GLN A 136 21.162 16.152 2.313 1.00 1.15 H new ATOM 2331 N ALA A 137 26.605 15.339 5.812 1.00 0.53 N ATOM 2332 CA ALA A 137 27.245 14.042 6.126 1.00 0.46 C ATOM 2333 C ALA A 137 26.257 12.916 5.924 1.00 0.55 C ATOM 2334 O ALA A 137 25.400 12.680 6.740 1.00 0.55 O ATOM 2335 CB ALA A 137 27.714 14.021 7.571 1.00 0.30 C ATOM 0 H ALA A 137 25.817 15.589 6.409 1.00 0.53 H new ATOM 0 HA ALA A 137 28.099 13.913 5.461 1.00 0.46 H new ATOM 0 HB1 ALA A 137 28.183 13.061 7.788 1.00 0.30 H new ATOM 0 HB2 ALA A 137 28.436 14.822 7.731 1.00 0.30 H new ATOM 0 HB3 ALA A 137 26.860 14.165 8.233 1.00 0.30 H new ATOM 2341 N ASN A 138 26.415 12.188 4.867 1.00 0.67 N ATOM 2342 CA ASN A 138 25.521 11.027 4.624 1.00 0.77 C ATOM 2343 C ASN A 138 26.301 9.804 5.059 1.00 0.74 C ATOM 2344 O ASN A 138 26.426 8.805 4.379 1.00 0.86 O ATOM 2345 CB ASN A 138 25.127 10.963 3.166 1.00 0.94 C ATOM 2346 CG ASN A 138 24.781 12.384 2.693 1.00 1.18 C ATOM 2347 OD1 ASN A 138 24.433 13.289 3.583 1.00 1.60 O flip ATOM 2348 ND2 ASN A 138 24.827 12.675 1.515 1.00 0.96 N flip ATOM 0 H ASN A 138 27.127 12.344 4.154 1.00 0.67 H new ATOM 0 HA ASN A 138 24.588 11.101 5.183 1.00 0.77 H new ATOM 0 HB2 ASN A 138 25.943 10.553 2.570 1.00 0.94 H new ATOM 0 HB3 ASN A 138 24.272 10.300 3.033 1.00 0.94 H new ATOM 0 HD21 ASN A 138 25.097 11.973 0.826 1.00 0.96 H new ATOM 0 HD22 ASN A 138 24.596 13.622 1.214 1.00 0.96 H new ATOM 2355 N GLY A 139 26.857 9.958 6.212 1.00 0.58 N ATOM 2356 CA GLY A 139 27.709 8.959 6.858 1.00 0.51 C ATOM 2357 C GLY A 139 28.418 9.768 7.920 1.00 0.33 C ATOM 2358 O GLY A 139 28.711 10.926 7.698 1.00 0.33 O ATOM 0 H GLY A 139 26.741 10.805 6.768 1.00 0.58 H new ATOM 0 HA2 GLY A 139 27.125 8.146 7.290 1.00 0.51 H new ATOM 0 HA3 GLY A 139 28.410 8.509 6.155 1.00 0.51 H new ATOM 2362 N PRO A 140 28.697 9.181 9.026 1.00 0.28 N ATOM 2363 CA PRO A 140 29.392 9.897 10.091 1.00 0.34 C ATOM 2364 C PRO A 140 30.839 10.173 9.621 1.00 0.41 C ATOM 2365 O PRO A 140 31.647 10.741 10.327 1.00 0.53 O ATOM 2366 CB PRO A 140 29.328 8.929 11.276 1.00 0.43 C ATOM 2367 CG PRO A 140 29.077 7.530 10.667 1.00 0.35 C ATOM 2368 CD PRO A 140 28.385 7.777 9.308 1.00 0.33 C ATOM 0 HA PRO A 140 28.964 10.864 10.357 1.00 0.34 H new ATOM 0 HB2 PRO A 140 30.257 8.946 11.845 1.00 0.43 H new ATOM 0 HB3 PRO A 140 28.528 9.205 11.963 1.00 0.43 H new ATOM 0 HG2 PRO A 140 30.013 6.988 10.536 1.00 0.35 H new ATOM 0 HG3 PRO A 140 28.448 6.926 11.321 1.00 0.35 H new ATOM 0 HD2 PRO A 140 28.771 7.115 8.533 1.00 0.33 H new ATOM 0 HD3 PRO A 140 27.310 7.607 9.366 1.00 0.33 H new ATOM 2376 N GLU A 141 31.146 9.734 8.415 1.00 0.42 N ATOM 2377 CA GLU A 141 32.496 9.893 7.812 1.00 0.52 C ATOM 2378 C GLU A 141 32.509 11.089 6.878 1.00 0.43 C ATOM 2379 O GLU A 141 33.534 11.702 6.662 1.00 0.63 O ATOM 2380 CB GLU A 141 32.739 8.630 7.029 1.00 0.61 C ATOM 2381 CG GLU A 141 32.092 7.525 7.825 1.00 3.15 C ATOM 2382 CD GLU A 141 32.902 6.233 7.695 1.00 3.87 C ATOM 2383 OE1 GLU A 141 33.654 6.121 6.742 1.00 3.56 O ATOM 2384 OE2 GLU A 141 32.753 5.378 8.552 1.00 4.86 O ATOM 0 H GLU A 141 30.480 9.254 7.809 1.00 0.42 H new ATOM 0 HA GLU A 141 33.262 10.057 8.570 1.00 0.52 H new ATOM 0 HB2 GLU A 141 32.306 8.699 6.031 1.00 0.61 H new ATOM 0 HB3 GLU A 141 33.806 8.448 6.902 1.00 0.61 H new ATOM 0 HG2 GLU A 141 32.023 7.815 8.873 1.00 3.15 H new ATOM 0 HG3 GLU A 141 31.074 7.361 7.472 1.00 3.15 H new ATOM 2391 N ASP A 142 31.379 11.468 6.349 1.00 0.20 N ATOM 2392 CA ASP A 142 31.385 12.671 5.504 1.00 0.19 C ATOM 2393 C ASP A 142 31.672 13.822 6.458 1.00 0.17 C ATOM 2394 O ASP A 142 32.020 14.916 6.061 1.00 0.27 O ATOM 2395 CB ASP A 142 30.034 12.867 4.820 1.00 0.26 C ATOM 2396 CG ASP A 142 30.124 12.433 3.357 1.00 0.46 C ATOM 2397 OD1 ASP A 142 30.575 13.232 2.552 1.00 0.78 O ATOM 2398 OD2 ASP A 142 29.733 11.315 3.063 1.00 0.29 O ATOM 0 H ASP A 142 30.478 11.004 6.466 1.00 0.20 H new ATOM 0 HA ASP A 142 32.126 12.601 4.707 1.00 0.19 H new ATOM 0 HB2 ASP A 142 29.268 12.286 5.334 1.00 0.26 H new ATOM 0 HB3 ASP A 142 29.734 13.913 4.880 1.00 0.26 H new ATOM 2403 N LEU A 143 31.576 13.546 7.743 1.00 0.21 N ATOM 2404 CA LEU A 143 31.891 14.573 8.757 1.00 0.38 C ATOM 2405 C LEU A 143 33.374 14.469 9.056 1.00 0.52 C ATOM 2406 O LEU A 143 33.984 15.377 9.552 1.00 0.53 O ATOM 2407 CB LEU A 143 31.137 14.282 10.039 1.00 0.48 C ATOM 2408 CG LEU A 143 29.646 14.440 9.824 1.00 0.45 C ATOM 2409 CD1 LEU A 143 29.008 13.062 9.814 1.00 0.50 C ATOM 2410 CD2 LEU A 143 29.061 15.259 10.968 1.00 0.60 C ATOM 0 H LEU A 143 31.290 12.643 8.120 1.00 0.21 H new ATOM 0 HA LEU A 143 31.615 15.561 8.388 1.00 0.38 H new ATOM 0 HB2 LEU A 143 31.357 13.269 10.375 1.00 0.48 H new ATOM 0 HB3 LEU A 143 31.471 14.958 10.826 1.00 0.48 H new ATOM 0 HG LEU A 143 29.454 14.946 8.878 1.00 0.45 H new ATOM 0 HD11 LEU A 143 27.933 13.160 9.660 1.00 0.50 H new ATOM 0 HD12 LEU A 143 29.438 12.468 9.007 1.00 0.50 H new ATOM 0 HD13 LEU A 143 29.194 12.568 10.767 1.00 0.50 H new ATOM 0 HD21 LEU A 143 27.988 15.377 10.819 1.00 0.60 H new ATOM 0 HD22 LEU A 143 29.243 14.746 11.913 1.00 0.60 H new ATOM 0 HD23 LEU A 143 29.534 16.241 10.991 1.00 0.60 H new ATOM 2422 N ASN A 144 33.920 13.327 8.770 1.00 0.76 N ATOM 2423 CA ASN A 144 35.339 13.026 9.007 1.00 0.97 C ATOM 2424 C ASN A 144 36.167 14.284 8.993 1.00 0.83 C ATOM 2425 O ASN A 144 35.988 15.139 8.169 1.00 0.56 O ATOM 2426 CB ASN A 144 35.827 12.102 7.901 1.00 1.16 C ATOM 2427 CG ASN A 144 37.277 11.770 8.159 1.00 1.31 C ATOM 2428 OD1 ASN A 144 38.085 11.736 7.255 1.00 1.35 O ATOM 2429 ND2 ASN A 144 37.633 11.514 9.369 1.00 1.48 N ATOM 0 H ASN A 144 33.402 12.551 8.358 1.00 0.76 H new ATOM 0 HA ASN A 144 35.442 12.555 9.984 1.00 0.97 H new ATOM 0 HB2 ASN A 144 35.228 11.191 7.877 1.00 1.16 H new ATOM 0 HB3 ASN A 144 35.716 12.583 6.929 1.00 1.16 H new ATOM 0 HD21 ASN A 144 38.604 11.279 9.576 1.00 1.48 H new ATOM 0 HD22 ASN A 144 36.944 11.546 10.121 1.00 1.48 H new ATOM 2436 N ARG A 145 37.070 14.382 9.907 1.00 1.07 N ATOM 2437 CA ARG A 145 37.948 15.585 9.976 1.00 0.98 C ATOM 2438 C ARG A 145 38.825 15.650 8.732 1.00 0.99 C ATOM 2439 O ARG A 145 39.150 16.710 8.252 1.00 0.90 O ATOM 2440 CB ARG A 145 38.839 15.508 11.211 1.00 1.03 C ATOM 2441 CG ARG A 145 39.206 14.044 11.484 1.00 1.02 C ATOM 2442 CD ARG A 145 40.630 13.958 12.038 1.00 1.44 C ATOM 2443 NE ARG A 145 40.763 12.736 12.884 1.00 1.31 N ATOM 2444 CZ ARG A 145 41.601 11.791 12.542 1.00 1.31 C ATOM 2445 NH1 ARG A 145 42.747 12.100 12.005 1.00 1.43 N ATOM 2446 NH2 ARG A 145 41.287 10.537 12.730 1.00 1.42 N ATOM 0 H ARG A 145 37.248 13.677 10.623 1.00 1.07 H new ATOM 0 HA ARG A 145 37.323 16.476 10.034 1.00 0.98 H new ATOM 0 HB2 ARG A 145 39.742 16.099 11.059 1.00 1.03 H new ATOM 0 HB3 ARG A 145 38.323 15.932 12.072 1.00 1.03 H new ATOM 0 HG2 ARG A 145 38.503 13.610 12.195 1.00 1.02 H new ATOM 0 HG3 ARG A 145 39.128 13.463 10.565 1.00 1.02 H new ATOM 0 HD2 ARG A 145 41.349 13.926 11.219 1.00 1.44 H new ATOM 0 HD3 ARG A 145 40.857 14.847 12.627 1.00 1.44 H new ATOM 0 HE ARG A 145 40.201 12.637 13.729 1.00 1.31 H new ATOM 0 HH11 ARG A 145 42.991 13.078 11.851 1.00 1.43 H new ATOM 0 HH12 ARG A 145 43.400 11.364 11.738 1.00 1.43 H new ATOM 0 HH21 ARG A 145 40.387 10.293 13.144 1.00 1.42 H new ATOM 0 HH22 ARG A 145 41.942 9.802 12.463 1.00 1.42 H new ATOM 2460 N ALA A 146 39.197 14.524 8.204 1.00 1.10 N ATOM 2461 CA ALA A 146 40.026 14.506 6.973 1.00 1.15 C ATOM 2462 C ALA A 146 39.162 15.038 5.842 1.00 1.04 C ATOM 2463 O ALA A 146 39.618 15.672 4.910 1.00 1.03 O ATOM 2464 CB ALA A 146 40.387 13.066 6.645 1.00 1.31 C ATOM 0 H ALA A 146 38.960 13.605 8.576 1.00 1.10 H new ATOM 0 HA ALA A 146 40.930 15.100 7.106 1.00 1.15 H new ATOM 0 HB1 ALA A 146 40.996 13.040 5.742 1.00 1.31 H new ATOM 0 HB2 ALA A 146 40.948 12.634 7.474 1.00 1.31 H new ATOM 0 HB3 ALA A 146 39.476 12.490 6.484 1.00 1.31 H new ATOM 2470 N CYS A 147 37.902 14.755 5.938 1.00 0.99 N ATOM 2471 CA CYS A 147 36.931 15.204 4.901 1.00 0.88 C ATOM 2472 C CYS A 147 36.577 16.643 5.145 1.00 0.70 C ATOM 2473 O CYS A 147 36.342 17.412 4.237 1.00 0.66 O ATOM 2474 CB CYS A 147 35.689 14.392 5.065 1.00 0.88 C ATOM 2475 SG CYS A 147 34.730 14.398 3.532 1.00 0.88 S ATOM 0 H CYS A 147 37.491 14.222 6.704 1.00 0.99 H new ATOM 0 HA CYS A 147 37.359 15.088 3.905 1.00 0.88 H new ATOM 0 HB2 CYS A 147 35.948 13.369 5.336 1.00 0.88 H new ATOM 0 HB3 CYS A 147 35.088 14.795 5.880 1.00 0.88 H new ATOM 0 HG CYS A 147 35.534 14.291 2.516 1.00 0.88 H new ATOM 2481 N ILE A 148 36.571 17.010 6.377 1.00 0.62 N ATOM 2482 CA ILE A 148 36.296 18.367 6.746 1.00 0.49 C ATOM 2483 C ILE A 148 37.568 19.097 6.388 1.00 0.50 C ATOM 2484 O ILE A 148 37.602 20.265 6.092 1.00 0.41 O ATOM 2485 CB ILE A 148 36.093 18.386 8.232 1.00 0.48 C ATOM 2486 CG1 ILE A 148 34.832 17.610 8.624 1.00 0.51 C ATOM 2487 CG2 ILE A 148 36.002 19.817 8.657 1.00 0.38 C ATOM 2488 CD1 ILE A 148 34.008 17.232 7.390 1.00 0.51 C ATOM 0 H ILE A 148 36.755 16.385 7.162 1.00 0.62 H new ATOM 0 HA ILE A 148 35.422 18.805 6.264 1.00 0.49 H new ATOM 0 HB ILE A 148 36.928 17.898 8.735 1.00 0.48 H new ATOM 0 HG12 ILE A 148 35.112 16.708 9.168 1.00 0.51 H new ATOM 0 HG13 ILE A 148 34.225 18.214 9.299 1.00 0.51 H new ATOM 0 HG21 ILE A 148 35.854 19.867 9.736 1.00 0.38 H new ATOM 0 HG22 ILE A 148 36.924 20.334 8.393 1.00 0.38 H new ATOM 0 HG23 ILE A 148 35.161 20.294 8.153 1.00 0.38 H new ATOM 0 HD11 ILE A 148 33.119 16.682 7.700 1.00 0.51 H new ATOM 0 HD12 ILE A 148 33.709 18.137 6.861 1.00 0.51 H new ATOM 0 HD13 ILE A 148 34.609 16.607 6.729 1.00 0.51 H new ATOM 2500 N ALA A 149 38.608 18.313 6.346 1.00 0.63 N ATOM 2501 CA ALA A 149 39.953 18.772 5.938 1.00 0.68 C ATOM 2502 C ALA A 149 39.991 18.728 4.417 1.00 0.71 C ATOM 2503 O ALA A 149 41.017 18.819 3.796 1.00 0.73 O ATOM 2504 CB ALA A 149 40.948 17.782 6.500 1.00 0.78 C ATOM 0 H ALA A 149 38.570 17.324 6.592 1.00 0.63 H new ATOM 0 HA ALA A 149 40.182 19.777 6.293 1.00 0.68 H new ATOM 0 HB1 ALA A 149 41.958 18.083 6.222 1.00 0.78 H new ATOM 0 HB2 ALA A 149 40.863 17.758 7.586 1.00 0.78 H new ATOM 0 HB3 ALA A 149 40.741 16.790 6.098 1.00 0.78 H new ATOM 2510 N GLU A 150 38.841 18.558 3.854 1.00 0.78 N ATOM 2511 CA GLU A 150 38.637 18.489 2.395 1.00 0.86 C ATOM 2512 C GLU A 150 37.542 19.499 2.059 1.00 0.81 C ATOM 2513 O GLU A 150 37.458 20.019 0.964 1.00 0.96 O ATOM 2514 CB GLU A 150 38.167 17.098 2.044 1.00 0.97 C ATOM 2515 CG GLU A 150 36.985 17.186 1.085 1.00 0.98 C ATOM 2516 CD GLU A 150 36.765 15.821 0.431 1.00 1.05 C ATOM 2517 OE1 GLU A 150 36.252 14.942 1.102 1.00 2.19 O ATOM 2518 OE2 GLU A 150 37.120 15.678 -0.728 1.00 0.38 O ATOM 0 H GLU A 150 37.977 18.458 4.386 1.00 0.78 H new ATOM 0 HA GLU A 150 39.551 18.708 1.844 1.00 0.86 H new ATOM 0 HB2 GLU A 150 38.979 16.533 1.586 1.00 0.97 H new ATOM 0 HB3 GLU A 150 37.876 16.562 2.948 1.00 0.97 H new ATOM 0 HG2 GLU A 150 36.088 17.494 1.622 1.00 0.98 H new ATOM 0 HG3 GLU A 150 37.175 17.941 0.323 1.00 0.98 H new ATOM 2525 N LYS A 151 36.730 19.807 3.038 1.00 0.67 N ATOM 2526 CA LYS A 151 35.678 20.814 2.875 1.00 0.60 C ATOM 2527 C LYS A 151 36.398 22.145 3.091 1.00 0.49 C ATOM 2528 O LYS A 151 36.104 23.153 2.480 1.00 0.58 O ATOM 2529 CB LYS A 151 34.612 20.535 3.932 1.00 0.53 C ATOM 2530 CG LYS A 151 34.267 21.804 4.688 1.00 0.31 C ATOM 2531 CD LYS A 151 32.898 21.617 5.345 1.00 0.35 C ATOM 2532 CE LYS A 151 31.859 21.319 4.260 1.00 0.82 C ATOM 2533 NZ LYS A 151 32.182 22.107 3.037 1.00 0.94 N ATOM 0 H LYS A 151 36.766 19.381 3.964 1.00 0.67 H new ATOM 0 HA LYS A 151 35.176 20.813 1.908 1.00 0.60 H new ATOM 0 HB2 LYS A 151 33.717 20.133 3.457 1.00 0.53 H new ATOM 0 HB3 LYS A 151 34.971 19.777 4.628 1.00 0.53 H new ATOM 0 HG2 LYS A 151 35.025 22.014 5.443 1.00 0.31 H new ATOM 0 HG3 LYS A 151 34.249 22.657 4.009 1.00 0.31 H new ATOM 0 HD2 LYS A 151 32.935 20.800 6.065 1.00 0.35 H new ATOM 0 HD3 LYS A 151 32.619 22.515 5.896 1.00 0.35 H new ATOM 0 HE2 LYS A 151 31.853 20.254 4.029 1.00 0.82 H new ATOM 0 HE3 LYS A 151 30.861 21.573 4.617 1.00 0.82 H new ATOM 0 HZ1 LYS A 151 31.330 22.196 2.447 1.00 0.94 H new ATOM 0 HZ2 LYS A 151 32.514 23.054 3.312 1.00 0.94 H new ATOM 0 HZ3 LYS A 151 32.927 21.622 2.498 1.00 0.94 H new ATOM 2547 N LEU A 152 37.426 22.090 3.903 1.00 0.39 N ATOM 2548 CA LEU A 152 38.304 23.266 4.128 1.00 0.25 C ATOM 2549 C LEU A 152 39.574 22.962 3.333 1.00 0.29 C ATOM 2550 O LEU A 152 40.210 23.836 2.783 1.00 0.31 O ATOM 2551 CB LEU A 152 38.677 23.415 5.606 1.00 0.14 C ATOM 2552 CG LEU A 152 37.433 23.416 6.479 1.00 0.25 C ATOM 2553 CD1 LEU A 152 37.578 22.329 7.532 1.00 0.50 C ATOM 2554 CD2 LEU A 152 37.315 24.769 7.172 1.00 0.11 C ATOM 0 H LEU A 152 37.694 21.257 4.428 1.00 0.39 H new ATOM 0 HA LEU A 152 37.806 24.187 3.825 1.00 0.25 H new ATOM 0 HB2 LEU A 152 39.335 22.599 5.904 1.00 0.14 H new ATOM 0 HB3 LEU A 152 39.232 24.342 5.754 1.00 0.14 H new ATOM 0 HG LEU A 152 36.546 23.234 5.872 1.00 0.25 H new ATOM 0 HD11 LEU A 152 36.692 22.317 8.167 1.00 0.50 H new ATOM 0 HD12 LEU A 152 37.687 21.361 7.043 1.00 0.50 H new ATOM 0 HD13 LEU A 152 38.459 22.529 8.142 1.00 0.50 H new ATOM 0 HD21 LEU A 152 36.425 24.779 7.801 1.00 0.11 H new ATOM 0 HD22 LEU A 152 38.197 24.940 7.789 1.00 0.11 H new ATOM 0 HD23 LEU A 152 37.238 25.556 6.422 1.00 0.11 H new ATOM 2566 N GLY A 153 39.923 21.689 3.259 1.00 0.30 N ATOM 2567 CA GLY A 153 41.120 21.261 2.480 1.00 0.36 C ATOM 2568 C GLY A 153 40.834 21.546 1.024 1.00 0.15 C ATOM 2569 O GLY A 153 41.704 21.815 0.219 1.00 0.62 O ATOM 0 H GLY A 153 39.417 20.929 3.714 1.00 0.30 H new ATOM 0 HA2 GLY A 153 42.007 21.802 2.810 1.00 0.36 H new ATOM 0 HA3 GLY A 153 41.318 20.200 2.632 1.00 0.36 H new ATOM 2573 N GLY A 154 39.588 21.492 0.718 1.00 0.26 N ATOM 2574 CA GLY A 154 39.118 21.762 -0.675 1.00 0.36 C ATOM 2575 C GLY A 154 38.786 23.250 -0.804 1.00 0.90 C ATOM 2576 O GLY A 154 38.238 23.699 -1.791 1.00 1.61 O ATOM 0 H GLY A 154 38.845 21.268 1.380 1.00 0.26 H new ATOM 0 HA2 GLY A 154 39.889 21.484 -1.394 1.00 0.36 H new ATOM 0 HA3 GLY A 154 38.239 21.158 -0.900 1.00 0.36 H new ATOM 2580 N SER A 155 39.133 24.012 0.193 1.00 0.67 N ATOM 2581 CA SER A 155 38.874 25.477 0.176 1.00 1.14 C ATOM 2582 C SER A 155 40.189 26.201 0.465 1.00 1.28 C ATOM 2583 O SER A 155 40.205 27.355 0.839 1.00 3.11 O ATOM 2584 CB SER A 155 37.850 25.829 1.251 1.00 1.37 C ATOM 2585 OG SER A 155 36.668 26.327 0.634 1.00 1.75 O ATOM 0 H SER A 155 39.595 23.674 1.037 1.00 0.67 H new ATOM 0 HA SER A 155 38.484 25.778 -0.796 1.00 1.14 H new ATOM 0 HB2 SER A 155 37.617 24.948 1.849 1.00 1.37 H new ATOM 0 HB3 SER A 155 38.261 26.576 1.930 1.00 1.37 H new ATOM 0 HG SER A 155 36.009 26.552 1.324 1.00 1.75 H new ATOM 2591 N LEU A 156 41.285 25.511 0.283 1.00 0.84 N ATOM 2592 CA LEU A 156 42.630 26.103 0.513 1.00 0.81 C ATOM 2593 C LEU A 156 42.903 26.328 1.986 1.00 0.64 C ATOM 2594 O LEU A 156 42.849 27.443 2.460 1.00 0.74 O ATOM 2595 CB LEU A 156 42.729 27.436 -0.209 1.00 1.10 C ATOM 2596 CG LEU A 156 42.690 27.217 -1.722 1.00 2.03 C ATOM 2597 CD1 LEU A 156 41.347 27.703 -2.270 1.00 2.70 C ATOM 2598 CD2 LEU A 156 43.823 28.005 -2.383 1.00 2.85 C ATOM 0 H LEU A 156 41.300 24.538 -0.023 1.00 0.84 H new ATOM 0 HA LEU A 156 43.368 25.399 0.129 1.00 0.81 H new ATOM 0 HB2 LEU A 156 41.907 28.085 0.094 1.00 1.10 H new ATOM 0 HB3 LEU A 156 43.653 27.942 0.070 1.00 1.10 H new ATOM 0 HG LEU A 156 42.812 26.156 -1.939 1.00 2.03 H new ATOM 0 HD11 LEU A 156 41.317 27.548 -3.349 1.00 2.70 H new ATOM 0 HD12 LEU A 156 40.538 27.143 -1.800 1.00 2.70 H new ATOM 0 HD13 LEU A 156 41.228 28.764 -2.052 1.00 2.70 H new ATOM 0 HD21 LEU A 156 43.794 27.848 -3.461 1.00 2.85 H new ATOM 0 HD22 LEU A 156 43.702 29.067 -2.167 1.00 2.85 H new ATOM 0 HD23 LEU A 156 44.781 27.662 -1.992 1.00 2.85 H new ATOM 2610 N ILE A 157 43.237 25.299 2.719 1.00 0.46 N ATOM 2611 CA ILE A 157 43.555 25.522 4.134 1.00 0.39 C ATOM 2612 C ILE A 157 45.049 25.238 4.380 1.00 0.33 C ATOM 2613 O ILE A 157 45.898 25.686 3.639 1.00 0.43 O ATOM 2614 CB ILE A 157 42.662 24.677 5.014 1.00 0.29 C ATOM 2615 CG1 ILE A 157 42.583 23.263 4.474 1.00 0.21 C ATOM 2616 CG2 ILE A 157 41.269 25.297 5.029 1.00 0.31 C ATOM 2617 CD1 ILE A 157 41.824 22.452 5.475 1.00 0.11 C ATOM 0 H ILE A 157 43.299 24.334 2.395 1.00 0.46 H new ATOM 0 HA ILE A 157 43.366 26.564 4.393 1.00 0.39 H new ATOM 0 HB ILE A 157 43.070 24.642 6.024 1.00 0.29 H new ATOM 0 HG12 ILE A 157 42.082 23.248 3.506 1.00 0.21 H new ATOM 0 HG13 ILE A 157 43.581 22.852 4.323 1.00 0.21 H new ATOM 0 HG21 ILE A 157 40.611 24.699 5.660 1.00 0.31 H new ATOM 0 HG22 ILE A 157 41.327 26.311 5.423 1.00 0.31 H new ATOM 0 HG23 ILE A 157 40.872 25.324 4.014 1.00 0.31 H new ATOM 0 HD11 ILE A 157 41.744 21.423 5.124 1.00 0.11 H new ATOM 0 HD12 ILE A 157 42.348 22.470 6.430 1.00 0.11 H new ATOM 0 HD13 ILE A 157 40.826 22.871 5.601 1.00 0.11 H new ATOM 2629 N VAL A 158 45.372 24.525 5.420 1.00 0.23 N ATOM 2630 CA VAL A 158 46.794 24.238 5.744 1.00 0.23 C ATOM 2631 C VAL A 158 46.825 23.173 6.841 1.00 0.22 C ATOM 2632 O VAL A 158 47.759 22.422 6.960 1.00 0.24 O ATOM 2633 CB VAL A 158 47.473 25.520 6.246 1.00 0.34 C ATOM 2634 CG1 VAL A 158 48.670 25.173 7.133 1.00 0.40 C ATOM 2635 CG2 VAL A 158 47.960 26.336 5.050 1.00 0.39 C ATOM 0 H VAL A 158 44.698 24.122 6.071 1.00 0.23 H new ATOM 0 HA VAL A 158 47.323 23.883 4.860 1.00 0.23 H new ATOM 0 HB VAL A 158 46.752 26.097 6.826 1.00 0.34 H new ATOM 0 HG11 VAL A 158 49.142 26.091 7.482 1.00 0.40 H new ATOM 0 HG12 VAL A 158 48.331 24.591 7.990 1.00 0.40 H new ATOM 0 HG13 VAL A 158 49.391 24.590 6.560 1.00 0.40 H new ATOM 0 HG21 VAL A 158 48.443 27.247 5.403 1.00 0.39 H new ATOM 0 HG22 VAL A 158 48.674 25.747 4.474 1.00 0.39 H new ATOM 0 HG23 VAL A 158 47.111 26.597 4.418 1.00 0.39 H new ATOM 2645 N ALA A 159 45.789 23.125 7.632 1.00 0.24 N ATOM 2646 CA ALA A 159 45.671 22.135 8.726 1.00 0.28 C ATOM 2647 C ALA A 159 44.316 21.484 8.604 1.00 0.31 C ATOM 2648 O ALA A 159 43.401 22.036 8.028 1.00 0.29 O ATOM 2649 CB ALA A 159 45.781 22.828 10.063 1.00 0.42 C ATOM 0 H ALA A 159 44.993 23.758 7.557 1.00 0.24 H new ATOM 0 HA ALA A 159 46.466 21.393 8.656 1.00 0.28 H new ATOM 0 HB1 ALA A 159 45.693 22.092 10.862 1.00 0.42 H new ATOM 0 HB2 ALA A 159 46.747 23.329 10.135 1.00 0.42 H new ATOM 0 HB3 ALA A 159 44.983 23.564 10.158 1.00 0.42 H new ATOM 2655 N PHE A 160 44.235 20.277 9.063 1.00 0.38 N ATOM 2656 CA PHE A 160 43.011 19.463 8.922 1.00 0.47 C ATOM 2657 C PHE A 160 43.259 18.751 7.619 1.00 0.45 C ATOM 2658 O PHE A 160 43.289 17.544 7.539 1.00 0.61 O ATOM 2659 CB PHE A 160 41.738 20.314 8.874 1.00 0.46 C ATOM 2660 CG PHE A 160 40.745 19.721 9.835 1.00 0.50 C ATOM 2661 CD1 PHE A 160 41.171 19.341 11.108 1.00 0.59 C ATOM 2662 CD2 PHE A 160 39.414 19.548 9.457 1.00 0.44 C ATOM 2663 CE1 PHE A 160 40.261 18.789 12.015 1.00 0.62 C ATOM 2664 CE2 PHE A 160 38.498 18.995 10.365 1.00 0.47 C ATOM 2665 CZ PHE A 160 38.922 18.615 11.641 1.00 0.56 C ATOM 0 H PHE A 160 44.997 19.804 9.549 1.00 0.38 H new ATOM 0 HA PHE A 160 42.840 18.795 9.766 1.00 0.47 H new ATOM 0 HB2 PHE A 160 41.960 21.346 9.144 1.00 0.46 H new ATOM 0 HB3 PHE A 160 41.328 20.330 7.864 1.00 0.46 H new ATOM 0 HD1 PHE A 160 42.204 19.473 11.393 1.00 0.59 H new ATOM 0 HD2 PHE A 160 39.089 19.839 8.469 1.00 0.44 H new ATOM 0 HE1 PHE A 160 40.590 18.497 13.002 1.00 0.62 H new ATOM 0 HE2 PHE A 160 37.465 18.863 10.078 1.00 0.47 H new ATOM 0 HZ PHE A 160 38.218 18.187 12.339 1.00 0.56 H new ATOM 2675 N GLU A 161 43.545 19.522 6.617 1.00 0.35 N ATOM 2676 CA GLU A 161 43.933 18.963 5.313 1.00 0.37 C ATOM 2677 C GLU A 161 45.465 18.935 5.321 1.00 0.58 C ATOM 2678 O GLU A 161 46.092 18.267 4.526 1.00 0.88 O ATOM 2679 CB GLU A 161 43.449 19.882 4.183 1.00 0.21 C ATOM 2680 CG GLU A 161 43.513 19.167 2.818 1.00 0.24 C ATOM 2681 CD GLU A 161 44.137 17.775 2.947 1.00 2.17 C ATOM 2682 OE1 GLU A 161 43.475 16.893 3.470 1.00 3.43 O ATOM 2683 OE2 GLU A 161 45.257 17.605 2.494 1.00 3.12 O ATOM 0 H GLU A 161 43.524 20.541 6.654 1.00 0.35 H new ATOM 0 HA GLU A 161 43.500 17.975 5.153 1.00 0.37 H new ATOM 0 HB2 GLU A 161 42.426 20.200 4.382 1.00 0.21 H new ATOM 0 HB3 GLU A 161 44.063 20.782 4.154 1.00 0.21 H new ATOM 0 HG2 GLU A 161 42.509 19.080 2.403 1.00 0.24 H new ATOM 0 HG3 GLU A 161 44.096 19.766 2.119 1.00 0.24 H new ATOM 2690 N GLY A 162 46.087 19.695 6.213 1.00 0.52 N ATOM 2691 CA GLY A 162 47.579 19.721 6.222 1.00 0.79 C ATOM 2692 C GLY A 162 48.204 19.241 7.554 1.00 1.03 C ATOM 2693 O GLY A 162 48.598 18.099 7.679 1.00 1.71 O ATOM 0 H GLY A 162 45.630 20.279 6.913 1.00 0.52 H new ATOM 0 HA2 GLY A 162 47.949 19.094 5.411 1.00 0.79 H new ATOM 0 HA3 GLY A 162 47.917 20.737 6.018 1.00 0.79 H new ATOM 2697 N CYS A 163 48.371 20.122 8.523 1.00 0.69 N ATOM 2698 CA CYS A 163 49.053 19.728 9.802 1.00 1.02 C ATOM 2699 C CYS A 163 48.458 18.451 10.426 1.00 1.17 C ATOM 2700 O CYS A 163 49.057 17.399 10.322 1.00 1.28 O ATOM 2701 CB CYS A 163 49.061 20.910 10.783 1.00 1.04 C ATOM 2702 SG CYS A 163 49.423 20.309 12.455 1.00 3.25 S ATOM 0 H CYS A 163 48.064 21.094 8.480 1.00 0.69 H new ATOM 0 HA CYS A 163 50.087 19.477 9.564 1.00 1.02 H new ATOM 0 HB2 CYS A 163 49.808 21.643 10.479 1.00 1.04 H new ATOM 0 HB3 CYS A 163 48.095 21.415 10.768 1.00 1.04 H new ATOM 0 HG CYS A 163 48.542 20.781 13.286 1.00 3.25 H new ATOM 2708 N PRO A 164 47.313 18.552 11.041 1.00 1.16 N ATOM 2709 CA PRO A 164 46.655 17.389 11.663 1.00 1.28 C ATOM 2710 C PRO A 164 46.230 16.372 10.608 1.00 1.13 C ATOM 2711 O PRO A 164 46.301 15.179 10.828 1.00 1.31 O ATOM 2712 CB PRO A 164 45.451 17.990 12.387 1.00 1.27 C ATOM 2713 CG PRO A 164 45.197 19.361 11.733 1.00 1.08 C ATOM 2714 CD PRO A 164 46.562 19.803 11.160 1.00 1.06 C ATOM 0 HA PRO A 164 47.312 16.843 12.340 1.00 1.28 H new ATOM 0 HB2 PRO A 164 44.577 17.345 12.291 1.00 1.27 H new ATOM 0 HB3 PRO A 164 45.652 18.098 13.453 1.00 1.27 H new ATOM 0 HG2 PRO A 164 44.446 19.288 10.946 1.00 1.08 H new ATOM 0 HG3 PRO A 164 44.825 20.081 12.462 1.00 1.08 H new ATOM 0 HD2 PRO A 164 46.450 20.295 10.194 1.00 1.06 H new ATOM 0 HD3 PRO A 164 47.064 20.509 11.822 1.00 1.06 H new ATOM 2722 N VAL A 165 45.801 16.815 9.461 1.00 0.82 N ATOM 2723 CA VAL A 165 45.398 15.823 8.412 1.00 0.75 C ATOM 2724 C VAL A 165 45.531 16.454 7.026 1.00 0.65 C ATOM 2725 O VAL A 165 44.657 16.230 6.205 1.00 0.64 O ATOM 2726 CB VAL A 165 43.948 15.342 8.632 1.00 0.60 C ATOM 2727 CG1 VAL A 165 43.953 13.865 9.031 1.00 0.54 C ATOM 2728 CG2 VAL A 165 43.278 16.148 9.749 1.00 0.61 C ATOM 2729 OXT VAL A 165 46.513 17.144 6.808 1.00 0.63 O ATOM 0 H VAL A 165 45.711 17.797 9.202 1.00 0.82 H new ATOM 0 HA VAL A 165 46.059 14.959 8.485 1.00 0.75 H new ATOM 0 HB VAL A 165 43.394 15.482 7.704 1.00 0.60 H new ATOM 0 HG11 VAL A 165 42.929 13.527 9.186 1.00 0.54 H new ATOM 0 HG12 VAL A 165 44.414 13.276 8.238 1.00 0.54 H new ATOM 0 HG13 VAL A 165 44.520 13.739 9.953 1.00 0.54 H new ATOM 0 HG21 VAL A 165 42.256 15.795 9.890 1.00 0.61 H new ATOM 0 HG22 VAL A 165 43.837 16.020 10.676 1.00 0.61 H new ATOM 0 HG23 VAL A 165 43.263 17.203 9.477 1.00 0.61 H new