USER MOD reduce.3.24.130724 H: found=0, std=0, add=616, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 486 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 230 THR OG1 : rot -155:sc= 1.02 USER MOD Set 1.2: A 233 GLN : amide:sc= -0.674! K(o=0.34!,f=2.2) USER MOD Set 2.1: A 229 LYS NZ :NH3+ 170:sc= 1.24 (180deg=1.09) USER MOD Set 2.2: A 237 MET CE :methyl -165:sc=-0.000111 (180deg=-0.418) USER MOD Single : A 158 HIS : no HD1:sc= -1.67 K(o=-1.7,f=-2.7!) USER MOD Single : A 175 TYR OH : rot 180:sc= 0 USER MOD Single : A 180 THR OG1 : rot 180:sc= 0.0608 USER MOD Single : A 181 SER OG : rot 90:sc= 1.18 USER MOD Single : A 191 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 192 GLN : amide:sc= -0.586 X(o=-0.59,f=-0.61) USER MOD Single : A 198 SER OG : rot 180:sc= -0.0661 USER MOD Single : A 208 SER OG : rot 180:sc= 0 USER MOD Single : A 209 THR OG1 : rot 180:sc= -0.673 USER MOD Single : A 215 ASN : amide:sc= -0.733 K(o=-0.73,f=0) USER MOD Single : A 222 ASN : amide:sc= -0.0117 X(o=-0.012,f=-0.078) USER MOD Single : A 235 THR OG1 : rot 79:sc= 1.26 USER MOD Single : A 238 MET CE :methyl -112:sc= -0.0188 (180deg=-1.72) USER MOD Single : A 241 ASN : amide:sc= -2.78 K(o=-2.8,f=-1.7) USER MOD Single : A 242 SER OG : rot 98:sc= 0.664 USER MOD Single : A 243 SER OG : rot 180:sc= 0 USER MOD Single : A 244 ASN : amide:sc= -1.54 K(o=-1.5,f=-0.16) USER MOD Single : A 248 THR OG1 : rot -160:sc= -4.52! USER MOD Single : A 250 LYS NZ :NH3+ 143:sc= 1.07 (180deg=0.111) USER MOD ----------------------------------------------------------------- ATOM 28 N HIS A 158 -9.605 -7.570 -3.472 1.00 24.25 N ATOM 29 CA HIS A 158 -8.600 -6.581 -3.743 1.00 14.20 C ATOM 30 C HIS A 158 -8.815 -5.769 -4.986 1.00 33.04 C ATOM 31 O HIS A 158 -9.187 -6.280 -6.042 1.00 40.42 O ATOM 32 CB HIS A 158 -7.139 -7.023 -3.547 1.00 32.34 C ATOM 33 CG HIS A 158 -6.609 -8.174 -4.328 1.00 21.42 C ATOM 34 ND1 HIS A 158 -6.012 -9.238 -3.713 1.00 14.21 N ATOM 35 CD2 HIS A 158 -6.411 -8.346 -5.641 1.00 44.11 C ATOM 36 CE1 HIS A 158 -5.451 -10.001 -4.599 1.00 35.30 C ATOM 37 NE2 HIS A 158 -5.676 -9.495 -5.792 1.00 32.41 N ATOM 0 HA HIS A 158 -8.770 -5.884 -2.922 1.00 14.20 H new ATOM 0 HB2 HIS A 158 -6.506 -6.163 -3.764 1.00 32.34 H new ATOM 0 HB3 HIS A 158 -7.008 -7.257 -2.491 1.00 32.34 H new ATOM 0 HD2 HIS A 158 -6.764 -7.701 -6.433 1.00 44.11 H new ATOM 0 HE1 HIS A 158 -4.892 -10.902 -4.392 1.00 35.30 H new ATOM 0 HE2 HIS A 158 -5.359 -9.889 -6.678 1.00 32.41 H new ATOM 46 N ARG A 159 -8.561 -4.499 -4.830 1.00 13.32 N ATOM 47 CA ARG A 159 -8.766 -3.490 -5.845 1.00 41.15 C ATOM 48 C ARG A 159 -7.481 -2.744 -6.057 1.00 20.22 C ATOM 49 O ARG A 159 -6.704 -2.568 -5.104 1.00 74.31 O ATOM 50 CB ARG A 159 -9.843 -2.524 -5.363 1.00 31.34 C ATOM 51 CG ARG A 159 -9.470 -1.781 -4.073 1.00 30.21 C ATOM 52 CD ARG A 159 -10.676 -1.121 -3.448 1.00 23.24 C ATOM 53 NE ARG A 159 -11.703 -2.130 -3.196 1.00 53.13 N ATOM 54 CZ ARG A 159 -12.400 -2.289 -2.079 1.00 61.32 C ATOM 55 NH1 ARG A 159 -12.257 -1.460 -1.051 1.00 62.42 N ATOM 56 NH2 ARG A 159 -13.246 -3.287 -2.003 1.00 72.41 N ATOM 0 H ARG A 159 -8.191 -4.119 -3.959 1.00 13.32 H new ATOM 0 HA ARG A 159 -9.078 -3.952 -6.782 1.00 41.15 H new ATOM 0 HB2 ARG A 159 -10.042 -1.794 -6.148 1.00 31.34 H new ATOM 0 HB3 ARG A 159 -10.768 -3.077 -5.199 1.00 31.34 H new ATOM 0 HG2 ARG A 159 -9.028 -2.480 -3.364 1.00 30.21 H new ATOM 0 HG3 ARG A 159 -8.713 -1.027 -4.291 1.00 30.21 H new ATOM 0 HD2 ARG A 159 -10.395 -0.631 -2.516 1.00 23.24 H new ATOM 0 HD3 ARG A 159 -11.065 -0.347 -4.110 1.00 23.24 H new ATOM 0 HE ARG A 159 -11.904 -2.778 -3.957 1.00 53.13 H new ATOM 0 HH11 ARG A 159 -11.600 -0.682 -1.111 1.00 62.42 H new ATOM 0 HH12 ARG A 159 -12.804 -1.602 -0.202 1.00 62.42 H new ATOM 0 HH21 ARG A 159 -13.358 -3.922 -2.793 1.00 72.41 H new ATOM 0 HH22 ARG A 159 -13.793 -3.429 -1.154 1.00 72.41 H new ATOM 68 N ARG A 160 -7.219 -2.349 -7.266 1.00 10.34 N ATOM 69 CA ARG A 160 -6.036 -1.598 -7.533 1.00 3.43 C ATOM 70 C ARG A 160 -6.318 -0.228 -8.044 1.00 35.34 C ATOM 71 O ARG A 160 -6.940 -0.039 -9.088 1.00 41.13 O ATOM 72 CB ARG A 160 -5.014 -2.349 -8.368 1.00 34.25 C ATOM 73 CG ARG A 160 -5.478 -2.933 -9.678 1.00 54.53 C ATOM 74 CD ARG A 160 -4.343 -3.746 -10.283 1.00 40.22 C ATOM 75 NE ARG A 160 -4.699 -4.378 -11.545 1.00 1.02 N ATOM 76 CZ ARG A 160 -3.903 -5.217 -12.229 1.00 72.41 C ATOM 77 NH1 ARG A 160 -2.727 -5.613 -11.717 1.00 14.11 N ATOM 78 NH2 ARG A 160 -4.308 -5.706 -13.395 1.00 53.32 N ATOM 0 H ARG A 160 -7.807 -2.534 -8.078 1.00 10.34 H new ATOM 0 HA ARG A 160 -5.561 -1.459 -6.562 1.00 3.43 H new ATOM 0 HB2 ARG A 160 -4.187 -1.671 -8.577 1.00 34.25 H new ATOM 0 HB3 ARG A 160 -4.615 -3.161 -7.760 1.00 34.25 H new ATOM 0 HG2 ARG A 160 -6.352 -3.565 -9.521 1.00 54.53 H new ATOM 0 HG3 ARG A 160 -5.778 -2.138 -10.360 1.00 54.53 H new ATOM 0 HD2 ARG A 160 -3.482 -3.096 -10.440 1.00 40.22 H new ATOM 0 HD3 ARG A 160 -4.037 -4.514 -9.573 1.00 40.22 H new ATOM 0 HE ARG A 160 -5.617 -4.169 -11.938 1.00 1.02 H new ATOM 0 HH11 ARG A 160 -2.431 -5.277 -10.801 1.00 14.11 H new ATOM 0 HH12 ARG A 160 -2.130 -6.250 -12.244 1.00 14.11 H new ATOM 0 HH21 ARG A 160 -5.220 -5.444 -13.768 1.00 53.32 H new ATOM 0 HH22 ARG A 160 -3.707 -6.343 -13.917 1.00 53.32 H new ATOM 90 N VAL A 161 -5.866 0.727 -7.301 1.00 53.10 N ATOM 91 CA VAL A 161 -6.058 2.099 -7.635 1.00 4.34 C ATOM 92 C VAL A 161 -4.806 2.695 -8.209 1.00 32.21 C ATOM 93 O VAL A 161 -3.706 2.464 -7.712 1.00 4.21 O ATOM 94 CB VAL A 161 -6.542 2.929 -6.429 1.00 25.15 C ATOM 95 CG1 VAL A 161 -7.916 2.477 -6.037 1.00 74.32 C ATOM 96 CG2 VAL A 161 -5.599 2.782 -5.238 1.00 42.32 C ATOM 0 H VAL A 161 -5.348 0.575 -6.436 1.00 53.10 H new ATOM 0 HA VAL A 161 -6.841 2.132 -8.393 1.00 4.34 H new ATOM 0 HB VAL A 161 -6.559 3.979 -6.720 1.00 25.15 H new ATOM 0 HG11 VAL A 161 -8.262 3.061 -5.184 1.00 74.32 H new ATOM 0 HG12 VAL A 161 -8.599 2.619 -6.875 1.00 74.32 H new ATOM 0 HG13 VAL A 161 -7.888 1.422 -5.766 1.00 74.32 H new ATOM 0 HG21 VAL A 161 -5.969 3.380 -4.405 1.00 42.32 H new ATOM 0 HG22 VAL A 161 -5.550 1.735 -4.940 1.00 42.32 H new ATOM 0 HG23 VAL A 161 -4.603 3.126 -5.518 1.00 42.32 H new ATOM 102 N ARG A 162 -4.975 3.425 -9.269 1.00 44.03 N ATOM 103 CA ARG A 162 -3.880 4.057 -9.938 1.00 65.42 C ATOM 104 C ARG A 162 -3.812 5.480 -9.425 1.00 21.00 C ATOM 105 O ARG A 162 -4.737 6.266 -9.643 1.00 15.34 O ATOM 106 CB ARG A 162 -4.124 4.052 -11.454 1.00 0.12 C ATOM 107 CG ARG A 162 -4.578 2.696 -12.008 1.00 45.12 C ATOM 108 CD ARG A 162 -4.836 2.739 -13.502 1.00 34.45 C ATOM 109 NE ARG A 162 -5.893 3.688 -13.853 1.00 25.22 N ATOM 110 CZ ARG A 162 -6.933 3.423 -14.652 1.00 41.21 C ATOM 111 NH1 ARG A 162 -7.133 2.187 -15.111 1.00 60.12 N ATOM 112 NH2 ARG A 162 -7.784 4.387 -14.965 1.00 42.54 N ATOM 0 H ARG A 162 -5.884 3.600 -9.697 1.00 44.03 H new ATOM 0 HA ARG A 162 -2.945 3.531 -9.746 1.00 65.42 H new ATOM 0 HB2 ARG A 162 -4.879 4.802 -11.693 1.00 0.12 H new ATOM 0 HB3 ARG A 162 -3.206 4.351 -11.960 1.00 0.12 H new ATOM 0 HG2 ARG A 162 -3.816 1.946 -11.795 1.00 45.12 H new ATOM 0 HG3 ARG A 162 -5.487 2.382 -11.494 1.00 45.12 H new ATOM 0 HD2 ARG A 162 -3.917 3.013 -14.020 1.00 34.45 H new ATOM 0 HD3 ARG A 162 -5.113 1.744 -13.850 1.00 34.45 H new ATOM 0 HE ARG A 162 -5.832 4.626 -13.457 1.00 25.22 H new ATOM 0 HH11 ARG A 162 -6.491 1.437 -14.853 1.00 60.12 H new ATOM 0 HH12 ARG A 162 -7.928 1.991 -15.720 1.00 60.12 H new ATOM 0 HH21 ARG A 162 -7.646 5.328 -14.597 1.00 42.54 H new ATOM 0 HH22 ARG A 162 -8.578 4.189 -15.574 1.00 42.54 H new ATOM 124 N LEU A 163 -2.778 5.790 -8.712 1.00 33.22 N ATOM 125 CA LEU A 163 -2.621 7.086 -8.113 1.00 11.35 C ATOM 126 C LEU A 163 -1.710 7.923 -8.961 1.00 75.44 C ATOM 127 O LEU A 163 -0.675 7.435 -9.416 1.00 52.41 O ATOM 128 CB LEU A 163 -2.007 6.960 -6.701 1.00 43.55 C ATOM 129 CG LEU A 163 -2.657 5.938 -5.776 1.00 13.14 C ATOM 130 CD1 LEU A 163 -2.080 6.049 -4.408 1.00 4.21 C ATOM 131 CD2 LEU A 163 -4.170 6.057 -5.750 1.00 41.52 C ATOM 0 H LEU A 163 -2.008 5.148 -8.524 1.00 33.22 H new ATOM 0 HA LEU A 163 -3.603 7.553 -8.038 1.00 11.35 H new ATOM 0 HB2 LEU A 163 -0.953 6.705 -6.807 1.00 43.55 H new ATOM 0 HB3 LEU A 163 -2.052 7.937 -6.219 1.00 43.55 H new ATOM 0 HG LEU A 163 -2.437 4.947 -6.172 1.00 13.14 H new ATOM 0 HD11 LEU A 163 -2.551 5.315 -3.754 1.00 4.21 H new ATOM 0 HD12 LEU A 163 -1.007 5.863 -4.450 1.00 4.21 H new ATOM 0 HD13 LEU A 163 -2.260 7.051 -4.018 1.00 4.21 H new ATOM 0 HD21 LEU A 163 -4.582 5.306 -5.076 1.00 41.52 H new ATOM 0 HD22 LEU A 163 -4.451 7.051 -5.402 1.00 41.52 H new ATOM 0 HD23 LEU A 163 -4.565 5.899 -6.754 1.00 41.52 H new ATOM 139 N LEU A 164 -2.115 9.156 -9.192 1.00 14.22 N ATOM 140 CA LEU A 164 -1.328 10.152 -9.881 1.00 52.32 C ATOM 141 C LEU A 164 -1.332 9.936 -11.387 1.00 60.55 C ATOM 142 O LEU A 164 -0.664 9.052 -11.923 1.00 64.13 O ATOM 143 CB LEU A 164 0.103 10.253 -9.279 1.00 1.13 C ATOM 144 CG LEU A 164 0.985 11.452 -9.673 1.00 72.15 C ATOM 145 CD1 LEU A 164 2.190 11.518 -8.744 1.00 13.13 C ATOM 146 CD2 LEU A 164 1.470 11.337 -11.114 1.00 40.23 C ATOM 0 H LEU A 164 -3.028 9.500 -8.895 1.00 14.22 H new ATOM 0 HA LEU A 164 -1.799 11.122 -9.722 1.00 52.32 H new ATOM 0 HB2 LEU A 164 0.006 10.256 -8.193 1.00 1.13 H new ATOM 0 HB3 LEU A 164 0.641 9.344 -9.549 1.00 1.13 H new ATOM 0 HG LEU A 164 0.386 12.358 -9.585 1.00 72.15 H new ATOM 0 HD11 LEU A 164 2.817 12.366 -9.020 1.00 13.13 H new ATOM 0 HD12 LEU A 164 1.850 11.638 -7.715 1.00 13.13 H new ATOM 0 HD13 LEU A 164 2.767 10.597 -8.830 1.00 13.13 H new ATOM 0 HD21 LEU A 164 2.090 12.199 -11.359 1.00 40.23 H new ATOM 0 HD22 LEU A 164 2.056 10.425 -11.229 1.00 40.23 H new ATOM 0 HD23 LEU A 164 0.612 11.304 -11.785 1.00 40.23 H new ATOM 260 N LEU A 172 2.235 11.212 -3.111 1.00 50.20 N ATOM 261 CA LEU A 172 0.955 10.624 -3.397 1.00 1.44 C ATOM 262 C LEU A 172 -0.019 10.872 -2.270 1.00 5.30 C ATOM 263 O LEU A 172 -1.234 10.827 -2.470 1.00 4.41 O ATOM 264 CB LEU A 172 1.068 9.124 -3.689 1.00 32.43 C ATOM 265 CG LEU A 172 1.790 8.696 -4.980 1.00 63.52 C ATOM 266 CD1 LEU A 172 1.118 9.279 -6.186 1.00 75.25 C ATOM 267 CD2 LEU A 172 3.285 9.022 -4.963 1.00 31.13 C ATOM 0 HA LEU A 172 0.574 11.107 -4.297 1.00 1.44 H new ATOM 0 HB2 LEU A 172 1.581 8.657 -2.848 1.00 32.43 H new ATOM 0 HB3 LEU A 172 0.060 8.711 -3.717 1.00 32.43 H new ATOM 0 HG LEU A 172 1.716 7.610 -5.035 1.00 63.52 H new ATOM 0 HD11 LEU A 172 1.646 8.962 -7.085 1.00 75.25 H new ATOM 0 HD12 LEU A 172 0.086 8.932 -6.230 1.00 75.25 H new ATOM 0 HD13 LEU A 172 1.133 10.367 -6.120 1.00 75.25 H new ATOM 0 HD21 LEU A 172 3.739 8.697 -5.899 1.00 31.13 H new ATOM 0 HD22 LEU A 172 3.422 10.097 -4.848 1.00 31.13 H new ATOM 0 HD23 LEU A 172 3.761 8.504 -4.130 1.00 31.13 H new ATOM 275 N GLY A 173 0.506 11.102 -1.090 1.00 3.11 N ATOM 276 CA GLY A 173 -0.327 11.461 0.023 1.00 75.21 C ATOM 277 C GLY A 173 -0.841 10.279 0.812 1.00 11.23 C ATOM 278 O GLY A 173 -2.024 10.226 1.176 1.00 44.23 O ATOM 0 H GLY A 173 1.503 11.046 -0.880 1.00 3.11 H new ATOM 0 HA2 GLY A 173 0.237 12.113 0.690 1.00 75.21 H new ATOM 0 HA3 GLY A 173 -1.176 12.038 -0.343 1.00 75.21 H new ATOM 282 N PHE A 174 0.025 9.340 1.073 1.00 53.13 N ATOM 283 CA PHE A 174 -0.287 8.215 1.908 1.00 64.32 C ATOM 284 C PHE A 174 1.014 7.600 2.349 1.00 61.41 C ATOM 285 O PHE A 174 2.044 7.771 1.688 1.00 2.45 O ATOM 286 CB PHE A 174 -1.176 7.158 1.185 1.00 25.25 C ATOM 287 CG PHE A 174 -0.514 6.394 0.061 1.00 63.43 C ATOM 288 CD1 PHE A 174 -0.341 6.958 -1.187 1.00 1.25 C ATOM 289 CD2 PHE A 174 -0.073 5.098 0.269 1.00 21.32 C ATOM 290 CE1 PHE A 174 0.266 6.244 -2.203 1.00 43.41 C ATOM 291 CE2 PHE A 174 0.530 4.386 -0.741 1.00 43.23 C ATOM 292 CZ PHE A 174 0.701 4.961 -1.977 1.00 2.51 C ATOM 0 H PHE A 174 0.977 9.335 0.708 1.00 53.13 H new ATOM 0 HA PHE A 174 -0.868 8.559 2.763 1.00 64.32 H new ATOM 0 HB2 PHE A 174 -1.529 6.441 1.926 1.00 25.25 H new ATOM 0 HB3 PHE A 174 -2.055 7.664 0.786 1.00 25.25 H new ATOM 0 HD1 PHE A 174 -0.683 7.966 -1.371 1.00 1.25 H new ATOM 0 HD2 PHE A 174 -0.205 4.640 1.238 1.00 21.32 H new ATOM 0 HE1 PHE A 174 0.398 6.695 -3.175 1.00 43.41 H new ATOM 0 HE2 PHE A 174 0.869 3.376 -0.563 1.00 43.23 H new ATOM 0 HZ PHE A 174 1.177 4.404 -2.771 1.00 2.51 H new ATOM 302 N TYR A 175 0.988 6.939 3.447 1.00 30.02 N ATOM 303 CA TYR A 175 2.142 6.261 3.953 1.00 0.23 C ATOM 304 C TYR A 175 1.797 4.824 4.155 1.00 74.52 C ATOM 305 O TYR A 175 0.612 4.470 4.293 1.00 71.33 O ATOM 306 CB TYR A 175 2.629 6.861 5.274 1.00 15.12 C ATOM 307 CG TYR A 175 3.113 8.294 5.204 1.00 31.02 C ATOM 308 CD1 TYR A 175 2.237 9.356 5.373 1.00 10.15 C ATOM 309 CD2 TYR A 175 4.454 8.581 4.992 1.00 33.21 C ATOM 310 CE1 TYR A 175 2.682 10.659 5.328 1.00 40.24 C ATOM 311 CE2 TYR A 175 4.907 9.884 4.950 1.00 71.30 C ATOM 312 CZ TYR A 175 4.015 10.918 5.121 1.00 34.42 C ATOM 313 OH TYR A 175 4.460 12.228 5.086 1.00 45.40 O ATOM 0 H TYR A 175 0.158 6.847 4.033 1.00 30.02 H new ATOM 0 HA TYR A 175 2.950 6.370 3.229 1.00 0.23 H new ATOM 0 HB2 TYR A 175 1.816 6.806 5.998 1.00 15.12 H new ATOM 0 HB3 TYR A 175 3.440 6.241 5.657 1.00 15.12 H new ATOM 0 HD1 TYR A 175 1.189 9.158 5.543 1.00 10.15 H new ATOM 0 HD2 TYR A 175 5.155 7.771 4.858 1.00 33.21 H new ATOM 0 HE1 TYR A 175 1.985 11.474 5.455 1.00 40.24 H new ATOM 0 HE2 TYR A 175 5.954 10.091 4.784 1.00 71.30 H new ATOM 0 HH TYR A 175 5.428 12.241 4.932 1.00 45.40 H new ATOM 323 N ILE A 176 2.791 3.995 4.176 1.00 61.31 N ATOM 324 CA ILE A 176 2.589 2.589 4.364 1.00 1.41 C ATOM 325 C ILE A 176 3.397 2.114 5.561 1.00 21.23 C ATOM 326 O ILE A 176 4.348 2.771 5.986 1.00 40.10 O ATOM 327 CB ILE A 176 2.954 1.728 3.101 1.00 35.35 C ATOM 328 CG1 ILE A 176 4.485 1.642 2.834 1.00 33.51 C ATOM 329 CG2 ILE A 176 2.208 2.215 1.863 1.00 40.24 C ATOM 330 CD1 ILE A 176 5.189 2.950 2.623 1.00 34.04 C ATOM 0 H ILE A 176 3.767 4.271 4.064 1.00 61.31 H new ATOM 0 HA ILE A 176 1.522 2.446 4.538 1.00 1.41 H new ATOM 0 HB ILE A 176 2.626 0.713 3.325 1.00 35.35 H new ATOM 0 HG12 ILE A 176 4.953 1.132 3.676 1.00 33.51 H new ATOM 0 HG13 ILE A 176 4.646 1.019 1.954 1.00 33.51 H new ATOM 0 HG21 ILE A 176 2.483 1.599 1.007 1.00 40.24 H new ATOM 0 HG22 ILE A 176 1.134 2.142 2.033 1.00 40.24 H new ATOM 0 HG23 ILE A 176 2.474 3.253 1.663 1.00 40.24 H new ATOM 0 HD11 ILE A 176 6.249 2.768 2.446 1.00 34.04 H new ATOM 0 HD12 ILE A 176 4.759 3.459 1.760 1.00 34.04 H new ATOM 0 HD13 ILE A 176 5.071 3.574 3.509 1.00 34.04 H new ATOM 337 N ARG A 177 3.024 1.001 6.076 1.00 53.34 N ATOM 338 CA ARG A 177 3.658 0.410 7.241 1.00 14.31 C ATOM 339 C ARG A 177 3.954 -1.042 7.004 1.00 74.23 C ATOM 340 O ARG A 177 3.294 -1.696 6.206 1.00 3.30 O ATOM 341 CB ARG A 177 2.815 0.556 8.522 1.00 14.12 C ATOM 342 CG ARG A 177 1.373 0.084 8.390 1.00 54.25 C ATOM 343 CD ARG A 177 0.714 -0.138 9.741 1.00 70.11 C ATOM 344 NE ARG A 177 0.620 1.085 10.550 1.00 22.32 N ATOM 345 CZ ARG A 177 0.265 1.113 11.848 1.00 73.45 C ATOM 346 NH1 ARG A 177 0.063 -0.022 12.513 1.00 33.34 N ATOM 347 NH2 ARG A 177 0.123 2.278 12.477 1.00 22.52 N ATOM 0 H ARG A 177 2.252 0.446 5.705 1.00 53.34 H new ATOM 0 HA ARG A 177 4.587 0.960 7.393 1.00 14.31 H new ATOM 0 HB2 ARG A 177 3.295 -0.006 9.323 1.00 14.12 H new ATOM 0 HB3 ARG A 177 2.814 1.604 8.823 1.00 14.12 H new ATOM 0 HG2 ARG A 177 0.802 0.821 7.826 1.00 54.25 H new ATOM 0 HG3 ARG A 177 1.347 -0.844 7.819 1.00 54.25 H new ATOM 0 HD2 ARG A 177 -0.287 -0.541 9.587 1.00 70.11 H new ATOM 0 HD3 ARG A 177 1.279 -0.889 10.294 1.00 70.11 H new ATOM 0 HE ARG A 177 0.839 1.973 10.097 1.00 22.32 H new ATOM 0 HH11 ARG A 177 0.177 -0.918 12.039 1.00 33.34 H new ATOM 0 HH12 ARG A 177 -0.206 0.004 13.497 1.00 33.34 H new ATOM 0 HH21 ARG A 177 0.283 3.151 11.975 1.00 22.52 H new ATOM 0 HH22 ARG A 177 -0.146 2.297 13.461 1.00 22.52 H new ATOM 359 N ASP A 178 4.927 -1.524 7.704 1.00 30.34 N ATOM 360 CA ASP A 178 5.382 -2.899 7.618 1.00 22.51 C ATOM 361 C ASP A 178 4.972 -3.670 8.850 1.00 44.13 C ATOM 362 O ASP A 178 4.926 -3.118 9.963 1.00 51.43 O ATOM 363 CB ASP A 178 6.907 -2.911 7.488 1.00 52.32 C ATOM 364 CG ASP A 178 7.548 -4.271 7.696 1.00 41.35 C ATOM 365 OD1 ASP A 178 7.695 -5.034 6.723 1.00 43.12 O ATOM 366 OD2 ASP A 178 7.952 -4.570 8.843 1.00 22.10 O ATOM 0 H ASP A 178 5.453 -0.966 8.377 1.00 30.34 H new ATOM 0 HA ASP A 178 4.929 -3.372 6.747 1.00 22.51 H new ATOM 0 HB2 ASP A 178 7.177 -2.544 6.498 1.00 52.32 H new ATOM 0 HB3 ASP A 178 7.326 -2.212 8.212 1.00 52.32 H new ATOM 371 N GLY A 179 4.645 -4.897 8.651 1.00 15.40 N ATOM 372 CA GLY A 179 4.336 -5.780 9.713 1.00 43.31 C ATOM 373 C GLY A 179 4.362 -7.173 9.202 1.00 52.13 C ATOM 374 O GLY A 179 4.639 -7.389 8.027 1.00 51.14 O ATOM 0 H GLY A 179 4.584 -5.322 7.726 1.00 15.40 H new ATOM 0 HA2 GLY A 179 5.056 -5.662 10.523 1.00 43.31 H new ATOM 0 HA3 GLY A 179 3.353 -5.547 10.123 1.00 43.31 H new ATOM 378 N THR A 180 4.107 -8.115 10.035 1.00 43.23 N ATOM 379 CA THR A 180 4.026 -9.457 9.590 1.00 71.42 C ATOM 380 C THR A 180 2.619 -9.807 9.182 1.00 54.45 C ATOM 381 O THR A 180 1.677 -9.712 9.977 1.00 12.02 O ATOM 382 CB THR A 180 4.506 -10.428 10.650 1.00 70.54 C ATOM 383 OG1 THR A 180 4.389 -9.841 11.968 1.00 25.42 O ATOM 384 CG2 THR A 180 5.910 -10.951 10.375 1.00 42.33 C ATOM 0 H THR A 180 3.950 -7.980 11.034 1.00 43.23 H new ATOM 0 HA THR A 180 4.680 -9.544 8.723 1.00 71.42 H new ATOM 0 HB THR A 180 3.855 -11.301 10.612 1.00 70.54 H new ATOM 0 HG1 THR A 180 4.701 -10.482 12.640 1.00 25.42 H new ATOM 0 HG21 THR A 180 6.202 -11.642 11.166 1.00 42.33 H new ATOM 0 HG22 THR A 180 5.924 -11.470 9.416 1.00 42.33 H new ATOM 0 HG23 THR A 180 6.610 -10.116 10.346 1.00 42.33 H new ATOM 390 N SER A 181 2.481 -10.220 7.966 1.00 53.23 N ATOM 391 CA SER A 181 1.230 -10.629 7.450 1.00 40.43 C ATOM 392 C SER A 181 1.182 -12.131 7.493 1.00 32.33 C ATOM 393 O SER A 181 1.973 -12.801 6.827 1.00 40.11 O ATOM 394 CB SER A 181 1.071 -10.129 6.001 1.00 14.42 C ATOM 395 OG SER A 181 -0.180 -10.517 5.440 1.00 55.42 O ATOM 0 H SER A 181 3.249 -10.281 7.298 1.00 53.23 H new ATOM 0 HA SER A 181 0.417 -10.211 8.043 1.00 40.43 H new ATOM 0 HB2 SER A 181 1.157 -9.043 5.980 1.00 14.42 H new ATOM 0 HB3 SER A 181 1.882 -10.525 5.389 1.00 14.42 H new ATOM 0 HG SER A 181 -0.848 -9.823 5.620 1.00 55.42 H new ATOM 517 N LYS A 191 3.406 -16.374 7.814 1.00 2.24 N ATOM 518 CA LYS A 191 3.717 -15.044 8.211 1.00 45.14 C ATOM 519 C LYS A 191 4.896 -14.580 7.387 1.00 61.54 C ATOM 520 O LYS A 191 5.892 -15.305 7.249 1.00 12.15 O ATOM 521 CB LYS A 191 4.066 -15.015 9.693 1.00 24.01 C ATOM 522 CG LYS A 191 3.959 -13.681 10.318 1.00 4.44 C ATOM 523 CD LYS A 191 4.272 -13.727 11.809 1.00 72.40 C ATOM 524 CE LYS A 191 3.285 -14.596 12.575 1.00 51.51 C ATOM 525 NZ LYS A 191 3.544 -14.569 14.027 1.00 55.42 N ATOM 0 HA LYS A 191 2.863 -14.386 8.050 1.00 45.14 H new ATOM 0 HB2 LYS A 191 3.409 -15.705 10.222 1.00 24.01 H new ATOM 0 HB3 LYS A 191 5.084 -15.383 9.822 1.00 24.01 H new ATOM 0 HG2 LYS A 191 4.644 -12.992 9.824 1.00 4.44 H new ATOM 0 HG3 LYS A 191 2.952 -13.290 10.170 1.00 4.44 H new ATOM 0 HD2 LYS A 191 5.282 -14.111 11.955 1.00 72.40 H new ATOM 0 HD3 LYS A 191 4.254 -12.715 12.214 1.00 72.40 H new ATOM 0 HE2 LYS A 191 2.270 -14.251 12.380 1.00 51.51 H new ATOM 0 HE3 LYS A 191 3.348 -15.622 12.214 1.00 51.51 H new ATOM 0 HZ1 LYS A 191 2.851 -15.173 14.514 1.00 55.42 H new ATOM 0 HZ2 LYS A 191 4.504 -14.922 14.215 1.00 55.42 H new ATOM 0 HZ3 LYS A 191 3.459 -13.593 14.377 1.00 55.42 H new ATOM 539 N GLN A 192 4.787 -13.417 6.833 1.00 60.31 N ATOM 540 CA GLN A 192 5.820 -12.864 5.985 1.00 33.21 C ATOM 541 C GLN A 192 5.763 -11.353 6.091 1.00 40.50 C ATOM 542 O GLN A 192 4.776 -10.828 6.627 1.00 22.33 O ATOM 543 CB GLN A 192 5.563 -13.284 4.534 1.00 42.40 C ATOM 544 CG GLN A 192 4.281 -12.720 3.937 1.00 71.45 C ATOM 545 CD GLN A 192 4.060 -13.159 2.515 1.00 70.13 C ATOM 546 OE1 GLN A 192 4.457 -14.247 2.116 1.00 14.32 O ATOM 547 NE2 GLN A 192 3.469 -12.309 1.733 1.00 72.50 N ATOM 0 H GLN A 192 3.976 -12.810 6.950 1.00 60.31 H new ATOM 0 HA GLN A 192 6.800 -13.227 6.295 1.00 33.21 H new ATOM 0 HB2 GLN A 192 6.406 -12.966 3.921 1.00 42.40 H new ATOM 0 HB3 GLN A 192 5.525 -14.372 4.484 1.00 42.40 H new ATOM 0 HG2 GLN A 192 3.433 -13.034 4.546 1.00 71.45 H new ATOM 0 HG3 GLN A 192 4.315 -11.631 3.976 1.00 71.45 H new ATOM 0 HE21 GLN A 192 3.152 -11.412 2.101 1.00 72.50 H new ATOM 0 HE22 GLN A 192 3.321 -12.538 0.750 1.00 72.50 H new ATOM 555 N PRO A 193 6.813 -10.621 5.638 1.00 23.42 N ATOM 556 CA PRO A 193 6.769 -9.160 5.598 1.00 23.45 C ATOM 557 C PRO A 193 5.553 -8.700 4.799 1.00 10.24 C ATOM 558 O PRO A 193 5.281 -9.212 3.693 1.00 2.13 O ATOM 559 CB PRO A 193 8.054 -8.787 4.850 1.00 22.21 C ATOM 560 CG PRO A 193 8.977 -9.921 5.113 1.00 2.54 C ATOM 561 CD PRO A 193 8.112 -11.144 5.158 1.00 75.02 C ATOM 0 HA PRO A 193 6.697 -8.704 6.585 1.00 23.45 H new ATOM 0 HB2 PRO A 193 7.871 -8.663 3.783 1.00 22.21 H new ATOM 0 HB3 PRO A 193 8.467 -7.846 5.214 1.00 22.21 H new ATOM 0 HG2 PRO A 193 9.730 -10.003 4.330 1.00 2.54 H new ATOM 0 HG3 PRO A 193 9.509 -9.783 6.054 1.00 2.54 H new ATOM 0 HD2 PRO A 193 8.021 -11.609 4.177 1.00 75.02 H new ATOM 0 HD3 PRO A 193 8.516 -11.899 5.832 1.00 75.02 H new ATOM 569 N GLY A 194 4.832 -7.780 5.346 1.00 71.13 N ATOM 570 CA GLY A 194 3.664 -7.304 4.717 1.00 23.13 C ATOM 571 C GLY A 194 3.483 -5.864 4.943 1.00 12.43 C ATOM 572 O GLY A 194 3.715 -5.358 6.040 1.00 70.31 O ATOM 0 H GLY A 194 5.043 -7.342 6.243 1.00 71.13 H new ATOM 0 HA2 GLY A 194 3.719 -7.502 3.647 1.00 23.13 H new ATOM 0 HA3 GLY A 194 2.798 -7.845 5.097 1.00 23.13 H new ATOM 576 N ILE A 195 3.087 -5.202 3.925 1.00 23.13 N ATOM 577 CA ILE A 195 2.856 -3.822 3.978 1.00 72.04 C ATOM 578 C ILE A 195 1.373 -3.525 4.034 1.00 33.11 C ATOM 579 O ILE A 195 0.568 -4.122 3.319 1.00 72.14 O ATOM 580 CB ILE A 195 3.564 -3.048 2.820 1.00 15.44 C ATOM 581 CG1 ILE A 195 5.080 -2.998 3.033 1.00 53.23 C ATOM 582 CG2 ILE A 195 3.020 -1.650 2.650 1.00 63.21 C ATOM 583 CD1 ILE A 195 5.848 -4.271 2.789 1.00 4.41 C ATOM 0 H ILE A 195 2.912 -5.620 3.011 1.00 23.13 H new ATOM 0 HA ILE A 195 3.306 -3.456 4.901 1.00 72.04 H new ATOM 0 HB ILE A 195 3.354 -3.601 1.904 1.00 15.44 H new ATOM 0 HG12 ILE A 195 5.488 -2.226 2.381 1.00 53.23 H new ATOM 0 HG13 ILE A 195 5.268 -2.681 4.059 1.00 53.23 H new ATOM 0 HG21 ILE A 195 3.544 -1.153 1.834 1.00 63.21 H new ATOM 0 HG22 ILE A 195 1.955 -1.699 2.422 1.00 63.21 H new ATOM 0 HG23 ILE A 195 3.168 -1.087 3.572 1.00 63.21 H new ATOM 0 HD11 ILE A 195 6.908 -4.098 2.975 1.00 4.41 H new ATOM 0 HD12 ILE A 195 5.484 -5.050 3.459 1.00 4.41 H new ATOM 0 HD13 ILE A 195 5.708 -4.588 1.755 1.00 4.41 H new ATOM 590 N PHE A 196 1.032 -2.637 4.915 1.00 31.02 N ATOM 591 CA PHE A 196 -0.318 -2.200 5.125 1.00 22.23 C ATOM 592 C PHE A 196 -0.304 -0.697 4.960 1.00 43.12 C ATOM 593 O PHE A 196 0.778 -0.091 4.947 1.00 31.34 O ATOM 594 CB PHE A 196 -0.766 -2.558 6.568 1.00 33.12 C ATOM 595 CG PHE A 196 -0.626 -4.026 6.928 1.00 22.43 C ATOM 596 CD1 PHE A 196 0.619 -4.565 7.251 1.00 42.44 C ATOM 597 CD2 PHE A 196 -1.727 -4.858 6.942 1.00 35.15 C ATOM 598 CE1 PHE A 196 0.759 -5.899 7.572 1.00 5.33 C ATOM 599 CE2 PHE A 196 -1.594 -6.197 7.267 1.00 71.23 C ATOM 600 CZ PHE A 196 -0.349 -6.717 7.581 1.00 32.04 C ATOM 0 H PHE A 196 1.706 -2.180 5.529 1.00 31.02 H new ATOM 0 HA PHE A 196 -1.005 -2.676 4.426 1.00 22.23 H new ATOM 0 HB2 PHE A 196 -0.181 -1.967 7.273 1.00 33.12 H new ATOM 0 HB3 PHE A 196 -1.808 -2.264 6.694 1.00 33.12 H new ATOM 0 HD1 PHE A 196 1.490 -3.926 7.250 1.00 42.44 H new ATOM 0 HD2 PHE A 196 -2.701 -4.461 6.697 1.00 35.15 H new ATOM 0 HE1 PHE A 196 1.732 -6.300 7.815 1.00 5.33 H new ATOM 0 HE2 PHE A 196 -2.463 -6.838 7.276 1.00 71.23 H new ATOM 0 HZ PHE A 196 -0.247 -7.762 7.833 1.00 32.04 H new ATOM 610 N ILE A 197 -1.442 -0.091 4.831 1.00 41.11 N ATOM 611 CA ILE A 197 -1.498 1.356 4.722 1.00 72.23 C ATOM 612 C ILE A 197 -1.348 1.927 6.121 1.00 64.12 C ATOM 613 O ILE A 197 -1.970 1.458 7.042 1.00 41.10 O ATOM 614 CB ILE A 197 -2.820 1.842 4.078 1.00 75.31 C ATOM 615 CG1 ILE A 197 -3.036 1.190 2.698 1.00 60.41 C ATOM 616 CG2 ILE A 197 -2.859 3.370 3.966 1.00 54.03 C ATOM 617 CD1 ILE A 197 -1.961 1.485 1.670 1.00 2.33 C ATOM 0 H ILE A 197 -2.347 -0.561 4.797 1.00 41.11 H new ATOM 0 HA ILE A 197 -0.694 1.700 4.071 1.00 72.23 H new ATOM 0 HB ILE A 197 -3.635 1.534 4.733 1.00 75.31 H new ATOM 0 HG12 ILE A 197 -3.103 0.110 2.831 1.00 60.41 H new ATOM 0 HG13 ILE A 197 -3.996 1.523 2.303 1.00 60.41 H new ATOM 0 HG21 ILE A 197 -3.800 3.677 3.510 1.00 54.03 H new ATOM 0 HG22 ILE A 197 -2.777 3.810 4.960 1.00 54.03 H new ATOM 0 HG23 ILE A 197 -2.028 3.711 3.348 1.00 54.03 H new ATOM 0 HD11 ILE A 197 -2.204 0.982 0.734 1.00 2.33 H new ATOM 0 HD12 ILE A 197 -1.906 2.560 1.500 1.00 2.33 H new ATOM 0 HD13 ILE A 197 -0.999 1.125 2.036 1.00 2.33 H new ATOM 624 N SER A 198 -0.495 2.874 6.303 1.00 1.22 N ATOM 625 CA SER A 198 -0.272 3.349 7.633 1.00 43.13 C ATOM 626 C SER A 198 -0.988 4.660 7.917 1.00 32.03 C ATOM 627 O SER A 198 -1.408 4.907 9.046 1.00 22.01 O ATOM 628 CB SER A 198 1.209 3.475 7.901 1.00 22.42 C ATOM 629 OG SER A 198 1.793 4.520 7.168 1.00 4.53 O ATOM 0 H SER A 198 0.050 3.329 5.571 1.00 1.22 H new ATOM 0 HA SER A 198 -0.697 2.611 8.314 1.00 43.13 H new ATOM 0 HB2 SER A 198 1.371 3.645 8.965 1.00 22.42 H new ATOM 0 HB3 SER A 198 1.703 2.537 7.650 1.00 22.42 H new ATOM 0 HG SER A 198 2.750 4.567 7.372 1.00 4.53 H new ATOM 635 N ARG A 199 -1.142 5.491 6.901 1.00 63.32 N ATOM 636 CA ARG A 199 -1.729 6.801 7.097 1.00 55.40 C ATOM 637 C ARG A 199 -2.092 7.421 5.762 1.00 20.05 C ATOM 638 O ARG A 199 -1.413 7.188 4.761 1.00 32.15 O ATOM 639 CB ARG A 199 -0.706 7.711 7.819 1.00 70.10 C ATOM 640 CG ARG A 199 -1.195 9.117 8.129 1.00 64.51 C ATOM 641 CD ARG A 199 -2.373 9.097 9.083 1.00 21.54 C ATOM 642 NE ARG A 199 -2.877 10.438 9.352 1.00 14.20 N ATOM 643 CZ ARG A 199 -3.901 10.723 10.156 1.00 43.15 C ATOM 644 NH1 ARG A 199 -4.557 9.748 10.778 1.00 41.32 N ATOM 645 NH2 ARG A 199 -4.280 11.984 10.325 1.00 2.12 N ATOM 0 H ARG A 199 -0.871 5.283 5.940 1.00 63.32 H new ATOM 0 HA ARG A 199 -2.633 6.700 7.698 1.00 55.40 H new ATOM 0 HB2 ARG A 199 -0.413 7.231 8.753 1.00 70.10 H new ATOM 0 HB3 ARG A 199 0.190 7.783 7.203 1.00 70.10 H new ATOM 0 HG2 ARG A 199 -0.382 9.698 8.565 1.00 64.51 H new ATOM 0 HG3 ARG A 199 -1.483 9.616 7.204 1.00 64.51 H new ATOM 0 HD2 ARG A 199 -3.172 8.487 8.661 1.00 21.54 H new ATOM 0 HD3 ARG A 199 -2.074 8.627 10.020 1.00 21.54 H new ATOM 0 HE ARG A 199 -2.410 11.218 8.889 1.00 14.20 H new ATOM 0 HH11 ARG A 199 -4.277 8.777 10.641 1.00 41.32 H new ATOM 0 HH12 ARG A 199 -5.340 9.971 11.392 1.00 41.32 H new ATOM 0 HH21 ARG A 199 -3.788 12.734 9.840 1.00 2.12 H new ATOM 0 HH22 ARG A 199 -5.064 12.203 10.940 1.00 2.12 H new ATOM 657 N LEU A 200 -3.160 8.179 5.748 1.00 33.25 N ATOM 658 CA LEU A 200 -3.532 8.956 4.599 1.00 61.55 C ATOM 659 C LEU A 200 -3.159 10.378 4.836 1.00 44.41 C ATOM 660 O LEU A 200 -3.190 10.856 5.971 1.00 14.40 O ATOM 661 CB LEU A 200 -5.031 8.927 4.344 1.00 70.43 C ATOM 662 CG LEU A 200 -5.650 7.633 3.878 1.00 50.11 C ATOM 663 CD1 LEU A 200 -7.150 7.830 3.761 1.00 21.35 C ATOM 664 CD2 LEU A 200 -5.077 7.238 2.528 1.00 23.13 C ATOM 0 H LEU A 200 -3.797 8.273 6.539 1.00 33.25 H new ATOM 0 HA LEU A 200 -3.015 8.528 3.740 1.00 61.55 H new ATOM 0 HB2 LEU A 200 -5.531 9.222 5.266 1.00 70.43 H new ATOM 0 HB3 LEU A 200 -5.257 9.691 3.600 1.00 70.43 H new ATOM 0 HG LEU A 200 -5.431 6.840 4.594 1.00 50.11 H new ATOM 0 HD11 LEU A 200 -7.614 6.903 3.425 1.00 21.35 H new ATOM 0 HD12 LEU A 200 -7.557 8.108 4.733 1.00 21.35 H new ATOM 0 HD13 LEU A 200 -7.358 8.622 3.041 1.00 21.35 H new ATOM 0 HD21 LEU A 200 -5.530 6.302 2.200 1.00 23.13 H new ATOM 0 HD22 LEU A 200 -5.291 8.020 1.799 1.00 23.13 H new ATOM 0 HD23 LEU A 200 -3.998 7.108 2.615 1.00 23.13 H new ATOM 672 N VAL A 201 -2.790 11.042 3.803 1.00 32.21 N ATOM 673 CA VAL A 201 -2.571 12.438 3.877 1.00 71.41 C ATOM 674 C VAL A 201 -3.731 13.062 3.144 1.00 73.42 C ATOM 675 O VAL A 201 -3.907 12.808 1.943 1.00 43.11 O ATOM 676 CB VAL A 201 -1.241 12.859 3.217 1.00 25.52 C ATOM 677 CG1 VAL A 201 -1.009 14.351 3.381 1.00 20.31 C ATOM 678 CG2 VAL A 201 -0.089 12.075 3.808 1.00 13.13 C ATOM 0 H VAL A 201 -2.631 10.633 2.882 1.00 32.21 H new ATOM 0 HA VAL A 201 -2.504 12.760 4.916 1.00 71.41 H new ATOM 0 HB VAL A 201 -1.301 12.639 2.151 1.00 25.52 H new ATOM 0 HG11 VAL A 201 -0.066 14.627 2.909 1.00 20.31 H new ATOM 0 HG12 VAL A 201 -1.825 14.900 2.911 1.00 20.31 H new ATOM 0 HG13 VAL A 201 -0.969 14.599 4.442 1.00 20.31 H new ATOM 0 HG21 VAL A 201 0.842 12.383 3.333 1.00 13.13 H new ATOM 0 HG22 VAL A 201 -0.030 12.267 4.879 1.00 13.13 H new ATOM 0 HG23 VAL A 201 -0.248 11.010 3.638 1.00 13.13 H new ATOM 684 N PRO A 202 -4.574 13.829 3.843 1.00 14.12 N ATOM 685 CA PRO A 202 -5.757 14.427 3.247 1.00 73.11 C ATOM 686 C PRO A 202 -5.393 15.260 2.013 1.00 75.25 C ATOM 687 O PRO A 202 -4.478 16.107 2.056 1.00 72.22 O ATOM 688 CB PRO A 202 -6.336 15.312 4.363 1.00 42.40 C ATOM 689 CG PRO A 202 -5.248 15.433 5.376 1.00 22.21 C ATOM 690 CD PRO A 202 -4.443 14.178 5.269 1.00 44.54 C ATOM 0 HA PRO A 202 -6.470 13.680 2.898 1.00 73.11 H new ATOM 0 HB2 PRO A 202 -6.626 16.290 3.979 1.00 42.40 H new ATOM 0 HB3 PRO A 202 -7.229 14.863 4.797 1.00 42.40 H new ATOM 0 HG2 PRO A 202 -4.631 16.310 5.182 1.00 22.21 H new ATOM 0 HG3 PRO A 202 -5.660 15.548 6.379 1.00 22.21 H new ATOM 0 HD2 PRO A 202 -3.403 14.339 5.553 1.00 44.54 H new ATOM 0 HD3 PRO A 202 -4.832 13.391 5.916 1.00 44.54 H new ATOM 698 N GLY A 203 -6.071 15.002 0.924 1.00 53.42 N ATOM 699 CA GLY A 203 -5.771 15.687 -0.305 1.00 42.35 C ATOM 700 C GLY A 203 -4.903 14.846 -1.218 1.00 71.32 C ATOM 701 O GLY A 203 -4.715 15.180 -2.387 1.00 42.24 O ATOM 0 H GLY A 203 -6.832 14.325 0.864 1.00 53.42 H new ATOM 0 HA2 GLY A 203 -6.700 15.940 -0.817 1.00 42.35 H new ATOM 0 HA3 GLY A 203 -5.263 16.626 -0.084 1.00 42.35 H new ATOM 705 N GLY A 204 -4.369 13.759 -0.687 1.00 61.32 N ATOM 706 CA GLY A 204 -3.546 12.876 -1.473 1.00 43.12 C ATOM 707 C GLY A 204 -4.370 12.045 -2.416 1.00 75.21 C ATOM 708 O GLY A 204 -5.571 11.945 -2.254 1.00 20.51 O ATOM 0 H GLY A 204 -4.494 13.473 0.284 1.00 61.32 H new ATOM 0 HA2 GLY A 204 -2.822 13.461 -2.040 1.00 43.12 H new ATOM 0 HA3 GLY A 204 -2.978 12.222 -0.811 1.00 43.12 H new ATOM 712 N LEU A 205 -3.723 11.412 -3.366 1.00 10.51 N ATOM 713 CA LEU A 205 -4.384 10.639 -4.383 1.00 4.41 C ATOM 714 C LEU A 205 -5.077 9.415 -3.797 1.00 73.32 C ATOM 715 O LEU A 205 -6.151 9.006 -4.271 1.00 42.13 O ATOM 716 CB LEU A 205 -3.394 10.225 -5.483 1.00 23.20 C ATOM 717 CG LEU A 205 -2.785 11.341 -6.371 1.00 61.54 C ATOM 718 CD1 LEU A 205 -3.865 12.199 -6.996 1.00 42.41 C ATOM 719 CD2 LEU A 205 -1.769 12.191 -5.627 1.00 35.31 C ATOM 0 H LEU A 205 -2.707 11.422 -3.453 1.00 10.51 H new ATOM 0 HA LEU A 205 -5.152 11.272 -4.828 1.00 4.41 H new ATOM 0 HB2 LEU A 205 -2.572 9.690 -5.008 1.00 23.20 H new ATOM 0 HB3 LEU A 205 -3.900 9.516 -6.138 1.00 23.20 H new ATOM 0 HG LEU A 205 -2.245 10.839 -7.174 1.00 61.54 H new ATOM 0 HD11 LEU A 205 -3.405 12.972 -7.612 1.00 42.41 H new ATOM 0 HD12 LEU A 205 -4.511 11.577 -7.616 1.00 42.41 H new ATOM 0 HD13 LEU A 205 -4.458 12.667 -6.210 1.00 42.41 H new ATOM 0 HD21 LEU A 205 -1.375 12.956 -6.296 1.00 35.31 H new ATOM 0 HD22 LEU A 205 -2.250 12.668 -4.773 1.00 35.31 H new ATOM 0 HD23 LEU A 205 -0.952 11.559 -5.277 1.00 35.31 H new ATOM 727 N ALA A 206 -4.477 8.847 -2.762 1.00 3.20 N ATOM 728 CA ALA A 206 -5.035 7.691 -2.075 1.00 10.32 C ATOM 729 C ALA A 206 -6.308 8.082 -1.349 1.00 72.40 C ATOM 730 O ALA A 206 -7.319 7.370 -1.387 1.00 70.51 O ATOM 731 CB ALA A 206 -4.026 7.151 -1.077 1.00 1.24 C ATOM 0 H ALA A 206 -3.591 9.173 -2.375 1.00 3.20 H new ATOM 0 HA ALA A 206 -5.266 6.920 -2.810 1.00 10.32 H new ATOM 0 HB1 ALA A 206 -4.448 6.286 -0.565 1.00 1.24 H new ATOM 0 HB2 ALA A 206 -3.118 6.855 -1.602 1.00 1.24 H new ATOM 0 HB3 ALA A 206 -3.787 7.924 -0.347 1.00 1.24 H new ATOM 737 N GLU A 207 -6.254 9.228 -0.720 1.00 72.14 N ATOM 738 CA GLU A 207 -7.347 9.755 0.051 1.00 50.12 C ATOM 739 C GLU A 207 -8.427 10.297 -0.913 1.00 22.42 C ATOM 740 O GLU A 207 -9.619 10.170 -0.660 1.00 72.12 O ATOM 741 CB GLU A 207 -6.764 10.815 1.015 1.00 4.24 C ATOM 742 CG GLU A 207 -7.686 11.387 2.089 1.00 32.23 C ATOM 743 CD GLU A 207 -8.709 12.363 1.590 1.00 22.31 C ATOM 744 OE1 GLU A 207 -8.319 13.371 0.960 1.00 62.31 O ATOM 745 OE2 GLU A 207 -9.918 12.151 1.842 1.00 5.14 O ATOM 0 H GLU A 207 -5.432 9.832 -0.731 1.00 72.14 H new ATOM 0 HA GLU A 207 -7.843 8.998 0.658 1.00 50.12 H new ATOM 0 HB2 GLU A 207 -5.901 10.374 1.515 1.00 4.24 H new ATOM 0 HB3 GLU A 207 -6.394 11.646 0.414 1.00 4.24 H new ATOM 0 HG2 GLU A 207 -8.202 10.562 2.581 1.00 32.23 H new ATOM 0 HG3 GLU A 207 -7.076 11.879 2.847 1.00 32.23 H new ATOM 752 N SER A 208 -7.976 10.843 -2.034 1.00 70.33 N ATOM 753 CA SER A 208 -8.838 11.356 -3.088 1.00 2.14 C ATOM 754 C SER A 208 -9.764 10.253 -3.620 1.00 25.42 C ATOM 755 O SER A 208 -10.976 10.462 -3.761 1.00 2.44 O ATOM 756 CB SER A 208 -7.978 11.940 -4.226 1.00 73.21 C ATOM 757 OG SER A 208 -8.765 12.510 -5.262 1.00 62.30 O ATOM 0 H SER A 208 -6.982 10.943 -2.239 1.00 70.33 H new ATOM 0 HA SER A 208 -9.464 12.148 -2.676 1.00 2.14 H new ATOM 0 HB2 SER A 208 -7.311 12.700 -3.820 1.00 73.21 H new ATOM 0 HB3 SER A 208 -7.349 11.153 -4.642 1.00 73.21 H new ATOM 0 HG SER A 208 -8.177 12.868 -5.960 1.00 62.30 H new ATOM 763 N THR A 209 -9.206 9.081 -3.908 1.00 43.13 N ATOM 764 CA THR A 209 -10.027 7.983 -4.372 1.00 30.55 C ATOM 765 C THR A 209 -10.801 7.387 -3.187 1.00 0.23 C ATOM 766 O THR A 209 -11.969 6.987 -3.323 1.00 10.01 O ATOM 767 CB THR A 209 -9.204 6.887 -5.157 1.00 35.40 C ATOM 768 OG1 THR A 209 -10.054 5.843 -5.627 1.00 53.51 O ATOM 769 CG2 THR A 209 -8.075 6.291 -4.325 1.00 53.14 C ATOM 0 H THR A 209 -8.210 8.875 -3.829 1.00 43.13 H new ATOM 0 HA THR A 209 -10.739 8.377 -5.097 1.00 30.55 H new ATOM 0 HB THR A 209 -8.755 7.399 -6.008 1.00 35.40 H new ATOM 0 HG1 THR A 209 -9.520 5.179 -6.111 1.00 53.51 H new ATOM 0 HG21 THR A 209 -7.544 5.544 -4.915 1.00 53.14 H new ATOM 0 HG22 THR A 209 -7.383 7.081 -4.031 1.00 53.14 H new ATOM 0 HG23 THR A 209 -8.489 5.821 -3.433 1.00 53.14 H new ATOM 775 N GLY A 210 -10.157 7.366 -2.020 1.00 40.33 N ATOM 776 CA GLY A 210 -10.788 6.886 -0.815 1.00 40.13 C ATOM 777 C GLY A 210 -10.922 5.391 -0.788 1.00 12.52 C ATOM 778 O GLY A 210 -11.686 4.844 -0.008 1.00 32.20 O ATOM 0 H GLY A 210 -9.195 7.680 -1.895 1.00 40.33 H new ATOM 0 HA2 GLY A 210 -10.207 7.210 0.048 1.00 40.13 H new ATOM 0 HA3 GLY A 210 -11.776 7.337 -0.722 1.00 40.13 H new ATOM 782 N LEU A 211 -10.181 4.723 -1.643 1.00 64.44 N ATOM 783 CA LEU A 211 -10.252 3.280 -1.716 1.00 3.33 C ATOM 784 C LEU A 211 -9.114 2.659 -0.955 1.00 23.03 C ATOM 785 O LEU A 211 -8.987 1.442 -0.894 1.00 14.11 O ATOM 786 CB LEU A 211 -10.258 2.803 -3.153 1.00 43.05 C ATOM 787 CG LEU A 211 -11.337 3.419 -4.035 1.00 43.44 C ATOM 788 CD1 LEU A 211 -11.308 2.809 -5.428 1.00 20.21 C ATOM 789 CD2 LEU A 211 -12.724 3.277 -3.411 1.00 1.12 C ATOM 0 H LEU A 211 -9.525 5.153 -2.295 1.00 64.44 H new ATOM 0 HA LEU A 211 -11.189 2.965 -1.257 1.00 3.33 H new ATOM 0 HB2 LEU A 211 -9.284 3.017 -3.594 1.00 43.05 H new ATOM 0 HB3 LEU A 211 -10.380 1.720 -3.159 1.00 43.05 H new ATOM 0 HG LEU A 211 -11.123 4.484 -4.120 1.00 43.44 H new ATOM 0 HD11 LEU A 211 -12.087 3.264 -6.041 1.00 20.21 H new ATOM 0 HD12 LEU A 211 -10.335 2.990 -5.884 1.00 20.21 H new ATOM 0 HD13 LEU A 211 -11.482 1.735 -5.359 1.00 20.21 H new ATOM 0 HD21 LEU A 211 -13.467 3.728 -4.069 1.00 1.12 H new ATOM 0 HD22 LEU A 211 -12.955 2.221 -3.274 1.00 1.12 H new ATOM 0 HD23 LEU A 211 -12.742 3.781 -2.445 1.00 1.12 H new ATOM 797 N LEU A 212 -8.294 3.503 -0.398 1.00 33.14 N ATOM 798 CA LEU A 212 -7.221 3.057 0.469 1.00 54.42 C ATOM 799 C LEU A 212 -7.540 3.461 1.894 1.00 34.02 C ATOM 800 O LEU A 212 -7.914 4.610 2.153 1.00 1.30 O ATOM 801 CB LEU A 212 -5.856 3.665 0.033 1.00 13.33 C ATOM 802 CG LEU A 212 -5.261 3.160 -1.297 1.00 72.23 C ATOM 803 CD1 LEU A 212 -3.964 3.873 -1.631 1.00 3.34 C ATOM 804 CD2 LEU A 212 -4.980 1.707 -1.207 1.00 14.15 C ATOM 0 H LEU A 212 -8.342 4.514 -0.525 1.00 33.14 H new ATOM 0 HA LEU A 212 -7.138 1.972 0.399 1.00 54.42 H new ATOM 0 HB2 LEU A 212 -5.973 4.746 -0.036 1.00 13.33 H new ATOM 0 HB3 LEU A 212 -5.131 3.473 0.824 1.00 13.33 H new ATOM 0 HG LEU A 212 -5.993 3.363 -2.079 1.00 72.23 H new ATOM 0 HD11 LEU A 212 -3.572 3.493 -2.574 1.00 3.34 H new ATOM 0 HD12 LEU A 212 -4.150 4.943 -1.720 1.00 3.34 H new ATOM 0 HD13 LEU A 212 -3.237 3.696 -0.838 1.00 3.34 H new ATOM 0 HD21 LEU A 212 -4.560 1.359 -2.151 1.00 14.15 H new ATOM 0 HD22 LEU A 212 -4.267 1.523 -0.403 1.00 14.15 H new ATOM 0 HD23 LEU A 212 -5.906 1.169 -1.001 1.00 14.15 H new ATOM 812 N ALA A 213 -7.411 2.533 2.798 1.00 24.25 N ATOM 813 CA ALA A 213 -7.632 2.768 4.199 1.00 62.12 C ATOM 814 C ALA A 213 -6.460 2.220 4.984 1.00 44.41 C ATOM 815 O ALA A 213 -5.776 1.321 4.524 1.00 21.35 O ATOM 816 CB ALA A 213 -8.934 2.108 4.647 1.00 22.13 C ATOM 0 H ALA A 213 -7.144 1.573 2.580 1.00 24.25 H new ATOM 0 HA ALA A 213 -7.716 3.839 4.381 1.00 62.12 H new ATOM 0 HB1 ALA A 213 -9.089 2.294 5.710 1.00 22.13 H new ATOM 0 HB2 ALA A 213 -9.767 2.525 4.080 1.00 22.13 H new ATOM 0 HB3 ALA A 213 -8.877 1.034 4.471 1.00 22.13 H new ATOM 822 N VAL A 214 -6.245 2.752 6.168 1.00 70.42 N ATOM 823 CA VAL A 214 -5.134 2.366 7.029 1.00 43.43 C ATOM 824 C VAL A 214 -5.194 0.888 7.452 1.00 40.53 C ATOM 825 O VAL A 214 -4.195 0.256 7.732 1.00 13.24 O ATOM 826 CB VAL A 214 -5.008 3.295 8.255 1.00 15.13 C ATOM 827 CG1 VAL A 214 -4.794 4.729 7.804 1.00 11.13 C ATOM 828 CG2 VAL A 214 -6.212 3.187 9.182 1.00 2.15 C ATOM 0 H VAL A 214 -6.842 3.475 6.570 1.00 70.42 H new ATOM 0 HA VAL A 214 -4.232 2.484 6.429 1.00 43.43 H new ATOM 0 HB VAL A 214 -4.139 2.972 8.829 1.00 15.13 H new ATOM 0 HG11 VAL A 214 -4.706 5.376 8.677 1.00 11.13 H new ATOM 0 HG12 VAL A 214 -3.881 4.792 7.213 1.00 11.13 H new ATOM 0 HG13 VAL A 214 -5.641 5.050 7.198 1.00 11.13 H new ATOM 0 HG21 VAL A 214 -6.079 3.858 10.030 1.00 2.15 H new ATOM 0 HG22 VAL A 214 -7.116 3.463 8.639 1.00 2.15 H new ATOM 0 HG23 VAL A 214 -6.304 2.162 9.541 1.00 2.15 H new ATOM 834 N ASN A 215 -6.376 0.380 7.530 1.00 40.42 N ATOM 835 CA ASN A 215 -6.608 -0.993 7.955 1.00 74.33 C ATOM 836 C ASN A 215 -6.311 -1.995 6.831 1.00 40.02 C ATOM 837 O ASN A 215 -6.217 -3.206 7.079 1.00 73.12 O ATOM 838 CB ASN A 215 -8.050 -1.165 8.442 1.00 54.44 C ATOM 839 CG ASN A 215 -8.426 -0.244 9.598 1.00 54.15 C ATOM 840 OD1 ASN A 215 -9.579 0.159 9.717 1.00 31.21 O ATOM 841 ND2 ASN A 215 -7.488 0.074 10.466 1.00 32.35 N ATOM 0 H ASN A 215 -7.227 0.894 7.303 1.00 40.42 H new ATOM 0 HA ASN A 215 -5.923 -1.200 8.777 1.00 74.33 H new ATOM 0 HB2 ASN A 215 -8.729 -0.982 7.609 1.00 54.44 H new ATOM 0 HB3 ASN A 215 -8.197 -2.200 8.752 1.00 54.44 H new ATOM 0 HD21 ASN A 215 -7.712 0.670 11.263 1.00 32.35 H new ATOM 0 HD22 ASN A 215 -6.538 -0.276 10.341 1.00 32.35 H new ATOM 847 N ASP A 216 -6.184 -1.488 5.609 1.00 25.03 N ATOM 848 CA ASP A 216 -6.028 -2.330 4.414 1.00 12.31 C ATOM 849 C ASP A 216 -4.622 -2.904 4.268 1.00 13.23 C ATOM 850 O ASP A 216 -3.625 -2.288 4.685 1.00 53.13 O ATOM 851 CB ASP A 216 -6.401 -1.562 3.138 1.00 22.51 C ATOM 852 CG ASP A 216 -7.834 -1.070 3.114 1.00 1.11 C ATOM 853 OD1 ASP A 216 -8.692 -1.625 3.844 1.00 40.25 O ATOM 854 OD2 ASP A 216 -8.110 -0.099 2.384 1.00 41.42 O ATOM 0 H ASP A 216 -6.185 -0.487 5.413 1.00 25.03 H new ATOM 0 HA ASP A 216 -6.715 -3.166 4.551 1.00 12.31 H new ATOM 0 HB2 ASP A 216 -5.732 -0.708 3.031 1.00 22.51 H new ATOM 0 HB3 ASP A 216 -6.234 -2.207 2.276 1.00 22.51 H new ATOM 859 N GLU A 217 -4.555 -4.075 3.642 1.00 72.22 N ATOM 860 CA GLU A 217 -3.307 -4.806 3.421 1.00 70.52 C ATOM 861 C GLU A 217 -2.933 -4.756 1.935 1.00 14.54 C ATOM 862 O GLU A 217 -3.773 -5.031 1.074 1.00 32.31 O ATOM 863 CB GLU A 217 -3.464 -6.269 3.881 1.00 15.22 C ATOM 864 CG GLU A 217 -2.207 -7.127 3.752 1.00 30.13 C ATOM 865 CD GLU A 217 -2.442 -8.571 4.155 1.00 41.45 C ATOM 866 OE1 GLU A 217 -2.357 -8.896 5.358 1.00 5.11 O ATOM 867 OE2 GLU A 217 -2.728 -9.405 3.273 1.00 71.04 O ATOM 0 H GLU A 217 -5.376 -4.551 3.268 1.00 72.22 H new ATOM 0 HA GLU A 217 -2.512 -4.340 4.003 1.00 70.52 H new ATOM 0 HB2 GLU A 217 -3.783 -6.274 4.923 1.00 15.22 H new ATOM 0 HB3 GLU A 217 -4.262 -6.732 3.301 1.00 15.22 H new ATOM 0 HG2 GLU A 217 -1.853 -7.094 2.721 1.00 30.13 H new ATOM 0 HG3 GLU A 217 -1.418 -6.704 4.373 1.00 30.13 H new ATOM 874 N VAL A 218 -1.681 -4.435 1.647 1.00 3.35 N ATOM 875 CA VAL A 218 -1.210 -4.268 0.277 1.00 70.54 C ATOM 876 C VAL A 218 -0.837 -5.622 -0.362 1.00 4.11 C ATOM 877 O VAL A 218 -0.237 -6.489 0.273 1.00 34.00 O ATOM 878 CB VAL A 218 -0.001 -3.278 0.200 1.00 24.25 C ATOM 879 CG1 VAL A 218 0.405 -3.014 -1.239 1.00 14.20 C ATOM 880 CG2 VAL A 218 -0.319 -1.964 0.905 1.00 23.20 C ATOM 0 H VAL A 218 -0.962 -4.283 2.354 1.00 3.35 H new ATOM 0 HA VAL A 218 -2.035 -3.839 -0.291 1.00 70.54 H new ATOM 0 HB VAL A 218 0.837 -3.751 0.712 1.00 24.25 H new ATOM 0 HG11 VAL A 218 1.247 -2.323 -1.258 1.00 14.20 H new ATOM 0 HG12 VAL A 218 0.694 -3.952 -1.713 1.00 14.20 H new ATOM 0 HG13 VAL A 218 -0.435 -2.578 -1.780 1.00 14.20 H new ATOM 0 HG21 VAL A 218 0.540 -1.296 0.835 1.00 23.20 H new ATOM 0 HG22 VAL A 218 -1.182 -1.496 0.431 1.00 23.20 H new ATOM 0 HG23 VAL A 218 -0.542 -2.159 1.954 1.00 23.20 H new ATOM 886 N ILE A 219 -1.221 -5.776 -1.616 1.00 11.45 N ATOM 887 CA ILE A 219 -0.989 -6.982 -2.395 1.00 21.33 C ATOM 888 C ILE A 219 0.140 -6.770 -3.423 1.00 4.22 C ATOM 889 O ILE A 219 1.122 -7.535 -3.468 1.00 74.24 O ATOM 890 CB ILE A 219 -2.299 -7.401 -3.155 1.00 4.45 C ATOM 891 CG1 ILE A 219 -3.433 -7.730 -2.167 1.00 62.25 C ATOM 892 CG2 ILE A 219 -2.054 -8.577 -4.101 1.00 4.24 C ATOM 893 CD1 ILE A 219 -3.106 -8.856 -1.224 1.00 44.12 C ATOM 0 H ILE A 219 -1.715 -5.050 -2.135 1.00 11.45 H new ATOM 0 HA ILE A 219 -0.695 -7.771 -1.702 1.00 21.33 H new ATOM 0 HB ILE A 219 -2.606 -6.547 -3.759 1.00 4.45 H new ATOM 0 HG12 ILE A 219 -3.667 -6.838 -1.586 1.00 62.25 H new ATOM 0 HG13 ILE A 219 -4.330 -7.988 -2.730 1.00 62.25 H new ATOM 0 HG21 ILE A 219 -2.984 -8.836 -4.607 1.00 4.24 H new ATOM 0 HG22 ILE A 219 -1.303 -8.299 -4.841 1.00 4.24 H new ATOM 0 HG23 ILE A 219 -1.700 -9.435 -3.530 1.00 4.24 H new ATOM 0 HD11 ILE A 219 -3.951 -9.030 -0.559 1.00 44.12 H new ATOM 0 HD12 ILE A 219 -2.901 -9.761 -1.795 1.00 44.12 H new ATOM 0 HD13 ILE A 219 -2.228 -8.593 -0.634 1.00 44.12 H new ATOM 900 N GLU A 220 0.007 -5.734 -4.221 1.00 74.43 N ATOM 901 CA GLU A 220 0.936 -5.458 -5.297 1.00 12.34 C ATOM 902 C GLU A 220 0.939 -3.976 -5.605 1.00 73.41 C ATOM 903 O GLU A 220 0.044 -3.234 -5.160 1.00 74.00 O ATOM 904 CB GLU A 220 0.525 -6.238 -6.567 1.00 50.23 C ATOM 905 CG GLU A 220 -0.871 -5.929 -7.014 1.00 14.51 C ATOM 906 CD GLU A 220 -1.278 -6.576 -8.301 1.00 4.54 C ATOM 907 OE1 GLU A 220 -1.472 -7.803 -8.315 1.00 43.04 O ATOM 908 OE2 GLU A 220 -1.487 -5.848 -9.292 1.00 23.02 O ATOM 0 H GLU A 220 -0.751 -5.056 -4.143 1.00 74.43 H new ATOM 0 HA GLU A 220 1.933 -5.771 -4.987 1.00 12.34 H new ATOM 0 HB2 GLU A 220 1.220 -6.002 -7.373 1.00 50.23 H new ATOM 0 HB3 GLU A 220 0.611 -7.307 -6.374 1.00 50.23 H new ATOM 0 HG2 GLU A 220 -1.564 -6.240 -6.233 1.00 14.51 H new ATOM 0 HG3 GLU A 220 -0.973 -4.849 -7.119 1.00 14.51 H new ATOM 915 N VAL A 221 1.930 -3.554 -6.347 1.00 70.50 N ATOM 916 CA VAL A 221 2.054 -2.207 -6.792 1.00 32.31 C ATOM 917 C VAL A 221 2.442 -2.201 -8.291 1.00 41.54 C ATOM 918 O VAL A 221 3.413 -2.833 -8.700 1.00 71.33 O ATOM 919 CB VAL A 221 3.087 -1.406 -5.934 1.00 74.34 C ATOM 920 CG1 VAL A 221 4.438 -2.027 -5.999 1.00 45.01 C ATOM 921 CG2 VAL A 221 3.142 0.051 -6.349 1.00 32.14 C ATOM 0 H VAL A 221 2.688 -4.160 -6.662 1.00 70.50 H new ATOM 0 HA VAL A 221 1.094 -1.706 -6.668 1.00 32.31 H new ATOM 0 HB VAL A 221 2.748 -1.444 -4.899 1.00 74.34 H new ATOM 0 HG11 VAL A 221 5.134 -1.448 -5.393 1.00 45.01 H new ATOM 0 HG12 VAL A 221 4.388 -3.047 -5.619 1.00 45.01 H new ATOM 0 HG13 VAL A 221 4.782 -2.041 -7.033 1.00 45.01 H new ATOM 0 HG21 VAL A 221 3.870 0.578 -5.732 1.00 32.14 H new ATOM 0 HG22 VAL A 221 3.436 0.120 -7.396 1.00 32.14 H new ATOM 0 HG23 VAL A 221 2.159 0.504 -6.217 1.00 32.14 H new ATOM 927 N ASN A 222 1.620 -1.543 -9.095 1.00 70.23 N ATOM 928 CA ASN A 222 1.807 -1.380 -10.560 1.00 61.21 C ATOM 929 C ASN A 222 1.626 -2.722 -11.298 1.00 23.11 C ATOM 930 O ASN A 222 1.790 -2.819 -12.504 1.00 43.32 O ATOM 931 CB ASN A 222 3.182 -0.731 -10.856 1.00 22.12 C ATOM 932 CG ASN A 222 3.346 -0.188 -12.274 1.00 61.40 C ATOM 933 OD1 ASN A 222 3.793 -0.878 -13.176 1.00 33.04 O ATOM 934 ND2 ASN A 222 3.018 1.078 -12.461 1.00 64.30 N ATOM 0 H ASN A 222 0.774 -1.088 -8.752 1.00 70.23 H new ATOM 0 HA ASN A 222 1.036 -0.709 -10.938 1.00 61.21 H new ATOM 0 HB2 ASN A 222 3.342 0.084 -10.150 1.00 22.12 H new ATOM 0 HB3 ASN A 222 3.963 -1.469 -10.673 1.00 22.12 H new ATOM 0 HD21 ASN A 222 3.136 1.505 -13.380 1.00 64.30 H new ATOM 0 HD22 ASN A 222 2.647 1.628 -11.687 1.00 64.30 H new ATOM 940 N GLY A 223 1.234 -3.737 -10.554 1.00 3.11 N ATOM 941 CA GLY A 223 1.058 -5.051 -11.113 1.00 2.32 C ATOM 942 C GLY A 223 2.065 -6.012 -10.549 1.00 42.35 C ATOM 943 O GLY A 223 1.929 -7.230 -10.686 1.00 75.32 O ATOM 0 H GLY A 223 1.032 -3.670 -9.556 1.00 3.11 H new ATOM 0 HA2 GLY A 223 0.050 -5.408 -10.902 1.00 2.32 H new ATOM 0 HA3 GLY A 223 1.160 -5.006 -12.197 1.00 2.32 H new ATOM 947 N ILE A 224 3.074 -5.464 -9.907 1.00 12.45 N ATOM 948 CA ILE A 224 4.113 -6.241 -9.309 1.00 61.34 C ATOM 949 C ILE A 224 3.805 -6.434 -7.847 1.00 62.25 C ATOM 950 O ILE A 224 3.624 -5.465 -7.116 1.00 33.35 O ATOM 951 CB ILE A 224 5.481 -5.550 -9.441 1.00 30.35 C ATOM 952 CG1 ILE A 224 5.814 -5.315 -10.918 1.00 35.43 C ATOM 953 CG2 ILE A 224 6.553 -6.400 -8.775 1.00 42.12 C ATOM 954 CD1 ILE A 224 7.128 -4.603 -11.143 1.00 10.31 C ATOM 0 H ILE A 224 3.188 -4.457 -9.790 1.00 12.45 H new ATOM 0 HA ILE A 224 4.160 -7.200 -9.826 1.00 61.34 H new ATOM 0 HB ILE A 224 5.444 -4.582 -8.942 1.00 30.35 H new ATOM 0 HG12 ILE A 224 5.840 -6.276 -11.432 1.00 35.43 H new ATOM 0 HG13 ILE A 224 5.013 -4.732 -11.373 1.00 35.43 H new ATOM 0 HG21 ILE A 224 7.520 -5.907 -8.871 1.00 42.12 H new ATOM 0 HG22 ILE A 224 6.313 -6.526 -7.719 1.00 42.12 H new ATOM 0 HG23 ILE A 224 6.594 -7.377 -9.257 1.00 42.12 H new ATOM 0 HD11 ILE A 224 7.293 -4.474 -12.213 1.00 10.31 H new ATOM 0 HD12 ILE A 224 7.100 -3.627 -10.659 1.00 10.31 H new ATOM 0 HD13 ILE A 224 7.940 -5.195 -10.720 1.00 10.31 H new ATOM 961 N GLU A 225 3.747 -7.668 -7.437 1.00 62.43 N ATOM 962 CA GLU A 225 3.421 -8.049 -6.076 1.00 73.25 C ATOM 963 C GLU A 225 4.379 -7.439 -5.070 1.00 73.45 C ATOM 964 O GLU A 225 5.541 -7.135 -5.385 1.00 64.10 O ATOM 965 CB GLU A 225 3.479 -9.552 -5.939 1.00 65.23 C ATOM 966 CG GLU A 225 4.866 -10.111 -6.177 1.00 23.01 C ATOM 967 CD GLU A 225 4.909 -11.596 -6.007 1.00 23.11 C ATOM 968 OE1 GLU A 225 4.637 -12.326 -6.968 1.00 33.21 O ATOM 969 OE2 GLU A 225 5.212 -12.056 -4.899 1.00 63.02 O ATOM 0 H GLU A 225 3.928 -8.464 -8.049 1.00 62.43 H new ATOM 0 HA GLU A 225 2.417 -7.678 -5.869 1.00 73.25 H new ATOM 0 HB2 GLU A 225 3.145 -9.834 -4.940 1.00 65.23 H new ATOM 0 HB3 GLU A 225 2.784 -10.004 -6.647 1.00 65.23 H new ATOM 0 HG2 GLU A 225 5.193 -9.852 -7.184 1.00 23.01 H new ATOM 0 HG3 GLU A 225 5.568 -9.646 -5.484 1.00 23.01 H new ATOM 976 N VAL A 226 3.894 -7.255 -3.879 1.00 5.21 N ATOM 977 CA VAL A 226 4.714 -6.784 -2.776 1.00 52.04 C ATOM 978 C VAL A 226 4.537 -7.674 -1.580 1.00 10.01 C ATOM 979 O VAL A 226 5.127 -7.447 -0.530 1.00 12.13 O ATOM 980 CB VAL A 226 4.411 -5.329 -2.378 1.00 22.51 C ATOM 981 CG1 VAL A 226 4.710 -4.386 -3.515 1.00 13.12 C ATOM 982 CG2 VAL A 226 2.980 -5.180 -1.926 1.00 42.13 C ATOM 0 H VAL A 226 2.919 -7.424 -3.632 1.00 5.21 H new ATOM 0 HA VAL A 226 5.746 -6.818 -3.124 1.00 52.04 H new ATOM 0 HB VAL A 226 5.060 -5.070 -1.542 1.00 22.51 H new ATOM 0 HG11 VAL A 226 4.487 -3.364 -3.208 1.00 13.12 H new ATOM 0 HG12 VAL A 226 5.763 -4.463 -3.784 1.00 13.12 H new ATOM 0 HG13 VAL A 226 4.096 -4.648 -4.376 1.00 13.12 H new ATOM 0 HG21 VAL A 226 2.792 -4.142 -1.650 1.00 42.13 H new ATOM 0 HG22 VAL A 226 2.311 -5.467 -2.737 1.00 42.13 H new ATOM 0 HG23 VAL A 226 2.802 -5.823 -1.064 1.00 42.13 H new ATOM 988 N ALA A 227 3.746 -8.707 -1.753 1.00 25.44 N ATOM 989 CA ALA A 227 3.462 -9.617 -0.685 1.00 51.04 C ATOM 990 C ALA A 227 4.674 -10.473 -0.374 1.00 71.10 C ATOM 991 O ALA A 227 4.960 -11.447 -1.065 1.00 42.11 O ATOM 992 CB ALA A 227 2.252 -10.476 -1.015 1.00 23.40 C ATOM 0 H ALA A 227 3.287 -8.934 -2.635 1.00 25.44 H new ATOM 0 HA ALA A 227 3.225 -9.036 0.206 1.00 51.04 H new ATOM 0 HB1 ALA A 227 2.055 -11.160 -0.189 1.00 23.40 H new ATOM 0 HB2 ALA A 227 1.383 -9.836 -1.171 1.00 23.40 H new ATOM 0 HB3 ALA A 227 2.449 -11.049 -1.921 1.00 23.40 H new ATOM 998 N GLY A 228 5.397 -10.079 0.641 1.00 44.10 N ATOM 999 CA GLY A 228 6.561 -10.812 1.058 1.00 0.54 C ATOM 1000 C GLY A 228 7.769 -9.943 1.001 1.00 22.23 C ATOM 1001 O GLY A 228 8.808 -10.250 1.590 1.00 3.30 O ATOM 0 H GLY A 228 5.197 -9.248 1.197 1.00 44.10 H new ATOM 0 HA2 GLY A 228 6.420 -11.184 2.073 1.00 0.54 H new ATOM 0 HA3 GLY A 228 6.700 -11.682 0.416 1.00 0.54 H new ATOM 1005 N LYS A 229 7.641 -8.858 0.274 1.00 30.42 N ATOM 1006 CA LYS A 229 8.726 -7.905 0.132 1.00 71.35 C ATOM 1007 C LYS A 229 8.764 -6.939 1.292 1.00 51.04 C ATOM 1008 O LYS A 229 7.802 -6.807 2.034 1.00 40.41 O ATOM 1009 CB LYS A 229 8.597 -7.175 -1.185 1.00 15.13 C ATOM 1010 CG LYS A 229 8.430 -8.150 -2.288 1.00 64.34 C ATOM 1011 CD LYS A 229 8.392 -7.548 -3.642 1.00 30.50 C ATOM 1012 CE LYS A 229 8.113 -8.661 -4.610 1.00 64.44 C ATOM 1013 NZ LYS A 229 7.965 -8.210 -5.996 1.00 72.41 N ATOM 0 H LYS A 229 6.792 -8.609 -0.233 1.00 30.42 H new ATOM 0 HA LYS A 229 9.670 -8.450 0.138 1.00 71.35 H new ATOM 0 HB2 LYS A 229 7.743 -6.499 -1.154 1.00 15.13 H new ATOM 0 HB3 LYS A 229 9.482 -6.563 -1.360 1.00 15.13 H new ATOM 0 HG2 LYS A 229 9.248 -8.869 -2.247 1.00 64.34 H new ATOM 0 HG3 LYS A 229 7.507 -8.707 -2.126 1.00 64.34 H new ATOM 0 HD2 LYS A 229 7.619 -6.782 -3.702 1.00 30.50 H new ATOM 0 HD3 LYS A 229 9.340 -7.063 -3.875 1.00 30.50 H new ATOM 0 HE2 LYS A 229 8.923 -9.388 -4.558 1.00 64.44 H new ATOM 0 HE3 LYS A 229 7.202 -9.176 -4.305 1.00 64.44 H new ATOM 0 HZ1 LYS A 229 7.944 -9.035 -6.629 1.00 72.41 H new ATOM 0 HZ2 LYS A 229 7.078 -7.675 -6.094 1.00 72.41 H new ATOM 0 HZ3 LYS A 229 8.768 -7.599 -6.250 1.00 72.41 H new ATOM 1027 N THR A 230 9.876 -6.275 1.440 1.00 73.12 N ATOM 1028 CA THR A 230 10.093 -5.372 2.538 1.00 0.24 C ATOM 1029 C THR A 230 9.806 -3.939 2.119 1.00 75.35 C ATOM 1030 O THR A 230 9.594 -3.672 0.924 1.00 32.43 O ATOM 1031 CB THR A 230 11.543 -5.497 3.033 1.00 2.24 C ATOM 1032 OG1 THR A 230 12.441 -5.333 1.915 1.00 55.04 O ATOM 1033 CG2 THR A 230 11.774 -6.859 3.675 1.00 41.33 C ATOM 0 H THR A 230 10.665 -6.345 0.797 1.00 73.12 H new ATOM 0 HA THR A 230 9.412 -5.635 3.347 1.00 0.24 H new ATOM 0 HB THR A 230 11.730 -4.725 3.779 1.00 2.24 H new ATOM 0 HG1 THR A 230 13.289 -5.785 2.108 1.00 55.04 H new ATOM 0 HG21 THR A 230 12.806 -6.929 4.019 1.00 41.33 H new ATOM 0 HG22 THR A 230 11.100 -6.981 4.523 1.00 41.33 H new ATOM 0 HG23 THR A 230 11.582 -7.644 2.943 1.00 41.33 H new ATOM 1039 N LEU A 231 9.814 -3.014 3.080 1.00 61.53 N ATOM 1040 CA LEU A 231 9.613 -1.600 2.789 1.00 32.44 C ATOM 1041 C LEU A 231 10.615 -1.086 1.791 1.00 4.11 C ATOM 1042 O LEU A 231 10.266 -0.336 0.894 1.00 64.11 O ATOM 1043 CB LEU A 231 9.641 -0.745 4.045 1.00 63.21 C ATOM 1044 CG LEU A 231 8.464 -0.906 4.979 1.00 1.44 C ATOM 1045 CD1 LEU A 231 8.655 -0.042 6.214 1.00 2.42 C ATOM 1046 CD2 LEU A 231 7.170 -0.526 4.264 1.00 1.34 C ATOM 0 H LEU A 231 9.958 -3.223 4.068 1.00 61.53 H new ATOM 0 HA LEU A 231 8.618 -1.520 2.350 1.00 32.44 H new ATOM 0 HB2 LEU A 231 10.552 -0.974 4.597 1.00 63.21 H new ATOM 0 HB3 LEU A 231 9.704 0.302 3.747 1.00 63.21 H new ATOM 0 HG LEU A 231 8.400 -1.949 5.288 1.00 1.44 H new ATOM 0 HD11 LEU A 231 7.801 -0.166 6.880 1.00 2.42 H new ATOM 0 HD12 LEU A 231 9.566 -0.343 6.732 1.00 2.42 H new ATOM 0 HD13 LEU A 231 8.735 1.004 5.918 1.00 2.42 H new ATOM 0 HD21 LEU A 231 6.329 -0.646 4.946 1.00 1.34 H new ATOM 0 HD22 LEU A 231 7.227 0.512 3.936 1.00 1.34 H new ATOM 0 HD23 LEU A 231 7.030 -1.173 3.398 1.00 1.34 H new ATOM 1054 N ASP A 232 11.845 -1.522 1.934 1.00 61.13 N ATOM 1055 CA ASP A 232 12.929 -1.131 1.031 1.00 31.30 C ATOM 1056 C ASP A 232 12.566 -1.485 -0.411 1.00 73.34 C ATOM 1057 O ASP A 232 12.746 -0.683 -1.333 1.00 23.34 O ATOM 1058 CB ASP A 232 14.213 -1.858 1.433 1.00 44.33 C ATOM 1059 CG ASP A 232 15.414 -1.447 0.624 1.00 41.50 C ATOM 1060 OD1 ASP A 232 15.651 -2.026 -0.447 1.00 64.34 O ATOM 1061 OD2 ASP A 232 16.160 -0.542 1.065 1.00 15.33 O ATOM 0 H ASP A 232 12.134 -2.159 2.677 1.00 61.13 H new ATOM 0 HA ASP A 232 13.082 -0.054 1.101 1.00 31.30 H new ATOM 0 HB2 ASP A 232 14.413 -1.669 2.488 1.00 44.33 H new ATOM 0 HB3 ASP A 232 14.062 -2.932 1.325 1.00 44.33 H new ATOM 1066 N GLN A 233 12.003 -2.673 -0.570 1.00 71.21 N ATOM 1067 CA GLN A 233 11.598 -3.192 -1.861 1.00 21.24 C ATOM 1068 C GLN A 233 10.351 -2.496 -2.401 1.00 2.55 C ATOM 1069 O GLN A 233 10.312 -2.075 -3.552 1.00 10.32 O ATOM 1070 CB GLN A 233 11.364 -4.696 -1.761 1.00 15.24 C ATOM 1071 CG GLN A 233 12.631 -5.496 -1.546 1.00 43.23 C ATOM 1072 CD GLN A 233 12.366 -6.953 -1.284 1.00 32.03 C ATOM 1073 OE1 GLN A 233 12.273 -7.758 -2.203 1.00 31.14 O ATOM 1074 NE2 GLN A 233 12.279 -7.309 -0.035 1.00 1.41 N ATOM 0 H GLN A 233 11.814 -3.309 0.205 1.00 71.21 H new ATOM 0 HA GLN A 233 12.405 -2.991 -2.565 1.00 21.24 H new ATOM 0 HB2 GLN A 233 10.676 -4.894 -0.939 1.00 15.24 H new ATOM 0 HB3 GLN A 233 10.878 -5.041 -2.674 1.00 15.24 H new ATOM 0 HG2 GLN A 233 13.269 -5.400 -2.425 1.00 43.23 H new ATOM 0 HG3 GLN A 233 13.182 -5.075 -0.705 1.00 43.23 H new ATOM 0 HE21 GLN A 233 12.362 -6.609 0.702 1.00 1.41 H new ATOM 0 HE22 GLN A 233 12.128 -8.288 0.207 1.00 1.41 H new ATOM 1082 N VAL A 234 9.343 -2.365 -1.566 1.00 42.05 N ATOM 1083 CA VAL A 234 8.065 -1.793 -1.989 1.00 31.21 C ATOM 1084 C VAL A 234 8.166 -0.291 -2.250 1.00 51.21 C ATOM 1085 O VAL A 234 7.512 0.233 -3.148 1.00 12.11 O ATOM 1086 CB VAL A 234 6.942 -2.081 -0.976 1.00 50.15 C ATOM 1087 CG1 VAL A 234 6.839 -3.563 -0.725 1.00 23.24 C ATOM 1088 CG2 VAL A 234 7.192 -1.347 0.300 1.00 32.33 C ATOM 0 H VAL A 234 9.375 -2.645 -0.586 1.00 42.05 H new ATOM 0 HA VAL A 234 7.810 -2.283 -2.929 1.00 31.21 H new ATOM 0 HB VAL A 234 5.996 -1.733 -1.391 1.00 50.15 H new ATOM 0 HG11 VAL A 234 6.042 -3.756 -0.007 1.00 23.24 H new ATOM 0 HG12 VAL A 234 6.617 -4.076 -1.661 1.00 23.24 H new ATOM 0 HG13 VAL A 234 7.784 -3.931 -0.325 1.00 23.24 H new ATOM 0 HG21 VAL A 234 6.389 -1.561 1.006 1.00 32.33 H new ATOM 0 HG22 VAL A 234 8.143 -1.668 0.724 1.00 32.33 H new ATOM 0 HG23 VAL A 234 7.226 -0.276 0.103 1.00 32.33 H new ATOM 1094 N THR A 235 8.991 0.390 -1.478 1.00 13.33 N ATOM 1095 CA THR A 235 9.166 1.804 -1.632 1.00 75.14 C ATOM 1096 C THR A 235 9.895 2.084 -2.935 1.00 12.22 C ATOM 1097 O THR A 235 9.592 3.055 -3.624 1.00 33.33 O ATOM 1098 CB THR A 235 9.916 2.415 -0.433 1.00 71.11 C ATOM 1099 OG1 THR A 235 9.214 2.070 0.775 1.00 4.31 O ATOM 1100 CG2 THR A 235 9.969 3.923 -0.542 1.00 0.42 C ATOM 0 H THR A 235 9.551 -0.026 -0.734 1.00 13.33 H new ATOM 0 HA THR A 235 8.184 2.276 -1.665 1.00 75.14 H new ATOM 0 HB THR A 235 10.934 2.025 -0.421 1.00 71.11 H new ATOM 0 HG1 THR A 235 9.427 1.147 1.025 1.00 4.31 H new ATOM 0 HG21 THR A 235 10.503 4.331 0.316 1.00 0.42 H new ATOM 0 HG22 THR A 235 10.487 4.204 -1.459 1.00 0.42 H new ATOM 0 HG23 THR A 235 8.955 4.322 -0.561 1.00 0.42 H new ATOM 1106 N ASP A 236 10.828 1.192 -3.298 1.00 73.30 N ATOM 1107 CA ASP A 236 11.556 1.323 -4.564 1.00 52.35 C ATOM 1108 C ASP A 236 10.566 1.268 -5.705 1.00 72.51 C ATOM 1109 O ASP A 236 10.680 2.016 -6.684 1.00 21.20 O ATOM 1110 CB ASP A 236 12.574 0.204 -4.739 1.00 34.41 C ATOM 1111 CG ASP A 236 13.419 0.367 -5.989 1.00 54.33 C ATOM 1112 OD1 ASP A 236 12.974 -0.038 -7.090 1.00 34.42 O ATOM 1113 OD2 ASP A 236 14.547 0.891 -5.890 1.00 34.10 O ATOM 0 H ASP A 236 11.093 0.381 -2.738 1.00 73.30 H new ATOM 0 HA ASP A 236 12.089 2.274 -4.557 1.00 52.35 H new ATOM 0 HB2 ASP A 236 13.227 0.173 -3.866 1.00 34.41 H new ATOM 0 HB3 ASP A 236 12.052 -0.752 -4.781 1.00 34.41 H new ATOM 1118 N MET A 237 9.561 0.387 -5.553 1.00 5.34 N ATOM 1119 CA MET A 237 8.500 0.262 -6.536 1.00 2.11 C ATOM 1120 C MET A 237 7.799 1.594 -6.665 1.00 15.13 C ATOM 1121 O MET A 237 7.634 2.112 -7.734 1.00 61.53 O ATOM 1122 CB MET A 237 7.443 -0.738 -6.101 1.00 74.15 C ATOM 1123 CG MET A 237 7.878 -2.128 -5.791 1.00 14.22 C ATOM 1124 SD MET A 237 8.352 -3.098 -7.204 1.00 3.31 S ATOM 1125 CE MET A 237 8.336 -4.685 -6.396 1.00 63.14 C ATOM 0 H MET A 237 9.472 -0.243 -4.756 1.00 5.34 H new ATOM 0 HA MET A 237 8.956 -0.067 -7.470 1.00 2.11 H new ATOM 0 HB2 MET A 237 6.950 -0.338 -5.215 1.00 74.15 H new ATOM 0 HB3 MET A 237 6.691 -0.792 -6.888 1.00 74.15 H new ATOM 0 HG2 MET A 237 8.720 -2.084 -5.100 1.00 14.22 H new ATOM 0 HG3 MET A 237 7.067 -2.640 -5.273 1.00 14.22 H new ATOM 0 HE1 MET A 237 8.857 -5.414 -7.016 1.00 63.14 H new ATOM 0 HE2 MET A 237 8.836 -4.607 -5.431 1.00 63.14 H new ATOM 0 HE3 MET A 237 7.305 -5.006 -6.246 1.00 63.14 H new ATOM 1135 N MET A 238 7.421 2.147 -5.523 1.00 74.44 N ATOM 1136 CA MET A 238 6.657 3.400 -5.432 1.00 50.44 C ATOM 1137 C MET A 238 7.417 4.585 -6.023 1.00 31.11 C ATOM 1138 O MET A 238 6.822 5.456 -6.661 1.00 34.22 O ATOM 1139 CB MET A 238 6.264 3.663 -3.980 1.00 2.33 C ATOM 1140 CG MET A 238 5.427 2.565 -3.402 1.00 52.13 C ATOM 1141 SD MET A 238 5.050 2.800 -1.677 1.00 1.31 S ATOM 1142 CE MET A 238 4.319 1.217 -1.345 1.00 3.45 C ATOM 0 H MET A 238 7.636 1.738 -4.614 1.00 74.44 H new ATOM 0 HA MET A 238 5.752 3.286 -6.029 1.00 50.44 H new ATOM 0 HB2 MET A 238 7.166 3.782 -3.379 1.00 2.33 H new ATOM 0 HB3 MET A 238 5.715 4.603 -3.921 1.00 2.33 H new ATOM 0 HG2 MET A 238 4.496 2.493 -3.964 1.00 52.13 H new ATOM 0 HG3 MET A 238 5.948 1.616 -3.527 1.00 52.13 H new ATOM 0 HE1 MET A 238 3.255 1.342 -1.145 1.00 3.45 H new ATOM 0 HE2 MET A 238 4.452 0.566 -2.209 1.00 3.45 H new ATOM 0 HE3 MET A 238 4.801 0.769 -0.476 1.00 3.45 H new ATOM 1152 N VAL A 239 8.723 4.607 -5.822 1.00 14.13 N ATOM 1153 CA VAL A 239 9.568 5.633 -6.396 1.00 11.15 C ATOM 1154 C VAL A 239 9.564 5.519 -7.923 1.00 41.21 C ATOM 1155 O VAL A 239 9.491 6.521 -8.638 1.00 35.21 O ATOM 1156 CB VAL A 239 11.022 5.543 -5.850 1.00 25.02 C ATOM 1157 CG1 VAL A 239 11.920 6.558 -6.523 1.00 52.23 C ATOM 1158 CG2 VAL A 239 11.033 5.767 -4.348 1.00 11.22 C ATOM 0 H VAL A 239 9.223 3.918 -5.260 1.00 14.13 H new ATOM 0 HA VAL A 239 9.166 6.604 -6.108 1.00 11.15 H new ATOM 0 HB VAL A 239 11.402 4.545 -6.070 1.00 25.02 H new ATOM 0 HG11 VAL A 239 12.930 6.473 -6.122 1.00 52.23 H new ATOM 0 HG12 VAL A 239 11.939 6.372 -7.597 1.00 52.23 H new ATOM 0 HG13 VAL A 239 11.539 7.562 -6.336 1.00 52.23 H new ATOM 0 HG21 VAL A 239 12.056 5.702 -3.978 1.00 11.22 H new ATOM 0 HG22 VAL A 239 10.629 6.754 -4.124 1.00 11.22 H new ATOM 0 HG23 VAL A 239 10.422 5.006 -3.862 1.00 11.22 H new ATOM 1164 N ALA A 240 9.601 4.299 -8.407 1.00 61.22 N ATOM 1165 CA ALA A 240 9.571 4.045 -9.833 1.00 61.33 C ATOM 1166 C ALA A 240 8.177 4.307 -10.387 1.00 55.20 C ATOM 1167 O ALA A 240 8.009 4.834 -11.480 1.00 50.54 O ATOM 1168 CB ALA A 240 10.013 2.612 -10.119 1.00 62.25 C ATOM 0 H ALA A 240 9.652 3.459 -7.831 1.00 61.22 H new ATOM 0 HA ALA A 240 10.265 4.723 -10.330 1.00 61.33 H new ATOM 0 HB1 ALA A 240 9.987 2.431 -11.194 1.00 62.25 H new ATOM 0 HB2 ALA A 240 11.028 2.464 -9.750 1.00 62.25 H new ATOM 0 HB3 ALA A 240 9.340 1.917 -9.617 1.00 62.25 H new ATOM 1174 N ASN A 241 7.188 3.965 -9.609 1.00 71.41 N ATOM 1175 CA ASN A 241 5.797 4.124 -9.995 1.00 11.52 C ATOM 1176 C ASN A 241 5.274 5.494 -9.658 1.00 14.43 C ATOM 1177 O ASN A 241 4.090 5.690 -9.594 1.00 12.34 O ATOM 1178 CB ASN A 241 4.934 3.051 -9.326 1.00 54.05 C ATOM 1179 CG ASN A 241 5.358 1.662 -9.729 1.00 15.35 C ATOM 1180 OD1 ASN A 241 5.787 1.433 -10.857 1.00 63.01 O ATOM 1181 ND2 ASN A 241 5.290 0.734 -8.801 1.00 52.15 N ATOM 0 H ASN A 241 7.316 3.564 -8.680 1.00 71.41 H new ATOM 0 HA ASN A 241 5.743 4.007 -11.077 1.00 11.52 H new ATOM 0 HB2 ASN A 241 5.002 3.152 -8.243 1.00 54.05 H new ATOM 0 HB3 ASN A 241 3.889 3.205 -9.595 1.00 54.05 H new ATOM 0 HD21 ASN A 241 5.600 -0.216 -9.006 1.00 52.15 H new ATOM 0 HD22 ASN A 241 4.927 0.964 -7.876 1.00 52.15 H new ATOM 1187 N SER A 242 6.152 6.455 -9.490 1.00 40.01 N ATOM 1188 CA SER A 242 5.712 7.816 -9.218 1.00 10.45 C ATOM 1189 C SER A 242 4.939 8.414 -10.418 1.00 51.12 C ATOM 1190 O SER A 242 4.178 9.362 -10.271 1.00 70.42 O ATOM 1191 CB SER A 242 6.869 8.703 -8.778 1.00 71.53 C ATOM 1192 OG SER A 242 7.425 8.227 -7.554 1.00 10.33 O ATOM 0 H SER A 242 7.163 6.330 -9.535 1.00 40.01 H new ATOM 0 HA SER A 242 5.014 7.774 -8.382 1.00 10.45 H new ATOM 0 HB2 SER A 242 7.637 8.719 -9.551 1.00 71.53 H new ATOM 0 HB3 SER A 242 6.522 9.728 -8.652 1.00 71.53 H new ATOM 0 HG SER A 242 8.222 7.690 -7.744 1.00 10.33 H new ATOM 1198 N SER A 243 5.181 7.870 -11.606 1.00 14.12 N ATOM 1199 CA SER A 243 4.471 8.294 -12.805 1.00 32.22 C ATOM 1200 C SER A 243 2.987 7.835 -12.766 1.00 72.34 C ATOM 1201 O SER A 243 2.124 8.438 -13.412 1.00 74.22 O ATOM 1202 CB SER A 243 5.176 7.726 -14.023 1.00 51.21 C ATOM 1203 OG SER A 243 6.544 8.105 -14.012 1.00 4.13 O ATOM 0 H SER A 243 5.867 7.131 -11.763 1.00 14.12 H new ATOM 0 HA SER A 243 4.474 9.383 -12.857 1.00 32.22 H new ATOM 0 HB2 SER A 243 5.091 6.639 -14.029 1.00 51.21 H new ATOM 0 HB3 SER A 243 4.697 8.088 -14.933 1.00 51.21 H new ATOM 0 HG SER A 243 6.993 7.733 -14.800 1.00 4.13 H new ATOM 1209 N ASN A 244 2.725 6.769 -11.997 1.00 14.33 N ATOM 1210 CA ASN A 244 1.377 6.203 -11.788 1.00 22.33 C ATOM 1211 C ASN A 244 1.455 5.099 -10.754 1.00 23.35 C ATOM 1212 O ASN A 244 1.847 3.952 -11.044 1.00 14.24 O ATOM 1213 CB ASN A 244 0.659 5.719 -13.096 1.00 23.44 C ATOM 1214 CG ASN A 244 1.313 4.560 -13.875 1.00 0.24 C ATOM 1215 OD1 ASN A 244 0.613 3.779 -14.530 1.00 11.33 O ATOM 1216 ND2 ASN A 244 2.615 4.449 -13.841 1.00 35.54 N ATOM 0 H ASN A 244 3.454 6.264 -11.492 1.00 14.33 H new ATOM 0 HA ASN A 244 0.748 7.016 -11.424 1.00 22.33 H new ATOM 0 HB2 ASN A 244 -0.355 5.418 -12.832 1.00 23.44 H new ATOM 0 HB3 ASN A 244 0.574 6.572 -13.769 1.00 23.44 H new ATOM 0 HD21 ASN A 244 3.077 3.704 -14.363 1.00 35.54 H new ATOM 0 HD22 ASN A 244 3.169 5.107 -13.293 1.00 35.54 H new ATOM 1222 N LEU A 245 1.144 5.438 -9.543 1.00 11.20 N ATOM 1223 CA LEU A 245 1.308 4.529 -8.473 1.00 71.12 C ATOM 1224 C LEU A 245 0.049 3.692 -8.331 1.00 15.44 C ATOM 1225 O LEU A 245 -0.942 4.141 -7.823 1.00 12.11 O ATOM 1226 CB LEU A 245 1.609 5.310 -7.179 1.00 11.23 C ATOM 1227 CG LEU A 245 2.396 4.555 -6.108 1.00 71.24 C ATOM 1228 CD1 LEU A 245 2.683 5.418 -4.914 1.00 40.42 C ATOM 1229 CD2 LEU A 245 1.697 3.320 -5.693 1.00 13.33 C ATOM 0 H LEU A 245 0.772 6.350 -9.277 1.00 11.20 H new ATOM 0 HA LEU A 245 2.146 3.860 -8.670 1.00 71.12 H new ATOM 0 HB2 LEU A 245 2.164 6.210 -7.442 1.00 11.23 H new ATOM 0 HB3 LEU A 245 0.663 5.634 -6.746 1.00 11.23 H new ATOM 0 HG LEU A 245 3.349 4.275 -6.557 1.00 71.24 H new ATOM 0 HD11 LEU A 245 3.244 4.844 -4.176 1.00 40.42 H new ATOM 0 HD12 LEU A 245 3.270 6.283 -5.223 1.00 40.42 H new ATOM 0 HD13 LEU A 245 1.744 5.755 -4.474 1.00 40.42 H new ATOM 0 HD21 LEU A 245 2.284 2.808 -4.931 1.00 13.33 H new ATOM 0 HD22 LEU A 245 0.718 3.575 -5.287 1.00 13.33 H new ATOM 0 HD23 LEU A 245 1.572 2.665 -6.555 1.00 13.33 H new ATOM 1237 N ILE A 246 0.105 2.491 -8.787 1.00 53.20 N ATOM 1238 CA ILE A 246 -1.033 1.618 -8.712 1.00 72.00 C ATOM 1239 C ILE A 246 -0.856 0.658 -7.547 1.00 2.42 C ATOM 1240 O ILE A 246 0.067 -0.117 -7.538 1.00 34.31 O ATOM 1241 CB ILE A 246 -1.174 0.816 -10.024 1.00 22.12 C ATOM 1242 CG1 ILE A 246 -1.273 1.768 -11.228 1.00 63.22 C ATOM 1243 CG2 ILE A 246 -2.393 -0.108 -9.963 1.00 52.33 C ATOM 1244 CD1 ILE A 246 -1.270 1.072 -12.577 1.00 42.32 C ATOM 0 H ILE A 246 0.931 2.079 -9.222 1.00 53.20 H new ATOM 0 HA ILE A 246 -1.932 2.216 -8.563 1.00 72.00 H new ATOM 0 HB ILE A 246 -0.285 0.198 -10.147 1.00 22.12 H new ATOM 0 HG12 ILE A 246 -2.187 2.355 -11.138 1.00 63.22 H new ATOM 0 HG13 ILE A 246 -0.439 2.469 -11.192 1.00 63.22 H new ATOM 0 HG21 ILE A 246 -2.475 -0.664 -10.897 1.00 52.33 H new ATOM 0 HG22 ILE A 246 -2.279 -0.806 -9.134 1.00 52.33 H new ATOM 0 HG23 ILE A 246 -3.294 0.487 -9.815 1.00 52.33 H new ATOM 0 HD11 ILE A 246 -1.343 1.816 -13.370 1.00 42.32 H new ATOM 0 HD12 ILE A 246 -0.345 0.507 -12.693 1.00 42.32 H new ATOM 0 HD13 ILE A 246 -2.120 0.392 -12.638 1.00 42.32 H new ATOM 1251 N ILE A 247 -1.712 0.730 -6.578 1.00 51.43 N ATOM 1252 CA ILE A 247 -1.642 -0.170 -5.436 1.00 35.25 C ATOM 1253 C ILE A 247 -2.894 -0.980 -5.271 1.00 33.33 C ATOM 1254 O ILE A 247 -4.016 -0.461 -5.346 1.00 3.53 O ATOM 1255 CB ILE A 247 -1.231 0.545 -4.103 1.00 62.52 C ATOM 1256 CG1 ILE A 247 0.266 0.815 -4.101 1.00 5.40 C ATOM 1257 CG2 ILE A 247 -1.643 -0.239 -2.868 1.00 71.12 C ATOM 1258 CD1 ILE A 247 0.778 1.541 -2.879 1.00 50.10 C ATOM 0 H ILE A 247 -2.478 1.402 -6.541 1.00 51.43 H new ATOM 0 HA ILE A 247 -0.835 -0.866 -5.665 1.00 35.25 H new ATOM 0 HB ILE A 247 -1.768 1.492 -4.060 1.00 62.52 H new ATOM 0 HG12 ILE A 247 0.792 -0.135 -4.189 1.00 5.40 H new ATOM 0 HG13 ILE A 247 0.516 1.401 -4.986 1.00 5.40 H new ATOM 0 HG21 ILE A 247 -1.334 0.302 -1.974 1.00 71.12 H new ATOM 0 HG22 ILE A 247 -2.726 -0.363 -2.860 1.00 71.12 H new ATOM 0 HG23 ILE A 247 -1.165 -1.219 -2.883 1.00 71.12 H new ATOM 0 HD11 ILE A 247 1.854 1.688 -2.968 1.00 50.10 H new ATOM 0 HD12 ILE A 247 0.285 2.510 -2.798 1.00 50.10 H new ATOM 0 HD13 ILE A 247 0.565 0.950 -1.989 1.00 50.10 H new ATOM 1265 N THR A 248 -2.689 -2.246 -5.081 1.00 2.30 N ATOM 1266 CA THR A 248 -3.728 -3.179 -4.858 1.00 64.22 C ATOM 1267 C THR A 248 -3.750 -3.535 -3.386 1.00 41.02 C ATOM 1268 O THR A 248 -2.740 -3.982 -2.852 1.00 13.40 O ATOM 1269 CB THR A 248 -3.440 -4.455 -5.649 1.00 12.34 C ATOM 1270 OG1 THR A 248 -3.226 -4.130 -7.018 1.00 64.44 O ATOM 1271 CG2 THR A 248 -4.581 -5.435 -5.544 1.00 23.23 C ATOM 0 H THR A 248 -1.759 -2.664 -5.078 1.00 2.30 H new ATOM 0 HA THR A 248 -4.680 -2.749 -5.169 1.00 64.22 H new ATOM 0 HB THR A 248 -2.548 -4.919 -5.228 1.00 12.34 H new ATOM 0 HG1 THR A 248 -3.357 -4.930 -7.568 1.00 64.44 H new ATOM 0 HG21 THR A 248 -4.345 -6.331 -6.117 1.00 23.23 H new ATOM 0 HG22 THR A 248 -4.735 -5.703 -4.499 1.00 23.23 H new ATOM 0 HG23 THR A 248 -5.489 -4.980 -5.940 1.00 23.23 H new ATOM 1277 N VAL A 249 -4.863 -3.331 -2.740 1.00 24.21 N ATOM 1278 CA VAL A 249 -5.011 -3.693 -1.341 1.00 4.21 C ATOM 1279 C VAL A 249 -6.275 -4.479 -1.144 1.00 43.33 C ATOM 1280 O VAL A 249 -7.164 -4.470 -2.002 1.00 52.52 O ATOM 1281 CB VAL A 249 -5.052 -2.463 -0.356 1.00 64.11 C ATOM 1282 CG1 VAL A 249 -3.769 -1.670 -0.380 1.00 52.41 C ATOM 1283 CG2 VAL A 249 -6.260 -1.565 -0.628 1.00 31.43 C ATOM 0 H VAL A 249 -5.694 -2.912 -3.157 1.00 24.21 H new ATOM 0 HA VAL A 249 -4.124 -4.279 -1.101 1.00 4.21 H new ATOM 0 HB VAL A 249 -5.159 -2.871 0.649 1.00 64.11 H new ATOM 0 HG11 VAL A 249 -3.845 -0.833 0.314 1.00 52.41 H new ATOM 0 HG12 VAL A 249 -2.939 -2.312 -0.085 1.00 52.41 H new ATOM 0 HG13 VAL A 249 -3.594 -1.291 -1.387 1.00 52.41 H new ATOM 0 HG21 VAL A 249 -6.255 -0.728 0.070 1.00 31.43 H new ATOM 0 HG22 VAL A 249 -6.210 -1.187 -1.649 1.00 31.43 H new ATOM 0 HG23 VAL A 249 -7.177 -2.140 -0.499 1.00 31.43 H new ATOM 1289 N LYS A 250 -6.353 -5.125 -0.021 1.00 32.51 N ATOM 1290 CA LYS A 250 -7.534 -5.831 0.408 1.00 14.32 C ATOM 1291 C LYS A 250 -7.855 -5.259 1.735 1.00 62.44 C ATOM 1292 O LYS A 250 -6.934 -4.993 2.518 1.00 61.40 O ATOM 1293 CB LYS A 250 -7.250 -7.265 0.760 1.00 24.10 C ATOM 1294 CG LYS A 250 -6.606 -8.157 -0.244 1.00 12.25 C ATOM 1295 CD LYS A 250 -6.308 -9.498 0.428 1.00 11.33 C ATOM 1296 CE LYS A 250 -5.558 -9.280 1.761 1.00 4.12 C ATOM 1297 NZ LYS A 250 -5.116 -10.552 2.389 1.00 74.54 N ATOM 0 H LYS A 250 -5.581 -5.181 0.643 1.00 32.51 H new ATOM 0 HA LYS A 250 -8.283 -5.758 -0.380 1.00 14.32 H new ATOM 0 HB2 LYS A 250 -6.617 -7.263 1.648 1.00 24.10 H new ATOM 0 HB3 LYS A 250 -8.197 -7.724 1.044 1.00 24.10 H new ATOM 0 HG2 LYS A 250 -7.263 -8.300 -1.102 1.00 12.25 H new ATOM 0 HG3 LYS A 250 -5.686 -7.707 -0.618 1.00 12.25 H new ATOM 0 HD2 LYS A 250 -7.239 -10.035 0.611 1.00 11.33 H new ATOM 0 HD3 LYS A 250 -5.708 -10.119 -0.237 1.00 11.33 H new ATOM 0 HE2 LYS A 250 -4.689 -8.647 1.584 1.00 4.12 H new ATOM 0 HE3 LYS A 250 -6.207 -8.744 2.454 1.00 4.12 H new ATOM 0 HZ1 LYS A 250 -4.187 -10.414 2.836 1.00 74.54 H new ATOM 0 HZ2 LYS A 250 -5.808 -10.842 3.109 1.00 74.54 H new ATOM 0 HZ3 LYS A 250 -5.043 -11.291 1.661 1.00 74.54 H new ATOM 1311 N PRO A 251 -9.093 -5.071 2.056 1.00 42.13 N ATOM 1312 CA PRO A 251 -9.437 -4.587 3.336 1.00 74.23 C ATOM 1313 C PRO A 251 -9.529 -5.719 4.347 1.00 53.03 C ATOM 1314 O PRO A 251 -9.896 -6.841 4.002 1.00 33.11 O ATOM 1315 CB PRO A 251 -10.785 -3.888 3.133 1.00 61.55 C ATOM 1316 CG PRO A 251 -11.273 -4.312 1.771 1.00 25.22 C ATOM 1317 CD PRO A 251 -10.260 -5.278 1.212 1.00 31.12 C ATOM 0 HA PRO A 251 -8.687 -3.907 3.740 1.00 74.23 H new ATOM 0 HB2 PRO A 251 -11.495 -4.176 3.909 1.00 61.55 H new ATOM 0 HB3 PRO A 251 -10.675 -2.805 3.188 1.00 61.55 H new ATOM 0 HG2 PRO A 251 -12.253 -4.783 1.844 1.00 25.22 H new ATOM 0 HG3 PRO A 251 -11.382 -3.448 1.116 1.00 25.22 H new ATOM 0 HD2 PRO A 251 -10.615 -6.307 1.264 1.00 31.12 H new ATOM 0 HD3 PRO A 251 -10.041 -5.069 0.165 1.00 31.12 H new