USER MOD reduce.3.24.130724 H: found=0, std=0, add=866, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 867 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 63 LYS NZ :NH3+ 151:sc= 0.409 (180deg=0) USER MOD Set 1.2: A 154 SER OG : rot 160:sc= 0.575 USER MOD Set 2.1: A 59 HIS : no HD1:sc= -7.1! C(o=-23!,f=-20!) USER MOD Set 2.2: A 152 THR OG1 : rot -176:sc= -1.08 USER MOD Set 2.3: A 157 HIS : no HD1:sc= -14.5! C(o=-23!,f=-24!) USER MOD Set 3.1: A 57 CYS SG : rot -0:sc= -0.413 USER MOD Set 3.2: A 138 SER OG : rot -93:sc= -3.1! USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : A 64 HIS : no HD1:sc= -2.83! C(o=-2.8!,f=-7.5!) USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 66 GLN : amide:sc= -1.2 K(o=-1.2,f=-0.23) USER MOD Single : A 67 SER OG : rot -79:sc= 1.16 USER MOD Single : A 71 SER OG : rot -153:sc= -1.42 USER MOD Single : A 72 SER OG : rot -122:sc= 1.09 USER MOD Single : A 75 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 THR OG1 : rot 180:sc= 0 USER MOD Single : A 81 THR OG1 : rot 180:sc= -0.791 USER MOD Single : A 82 LYS NZ :NH3+ -158:sc= -0.0941 (180deg=-0.466) USER MOD Single : A 90 ASN : amide:sc= -0.0485 K(o=-0.048,f=-1.2) USER MOD Single : A 92 TYR OH : rot -54:sc= 0.461 USER MOD Single : A 94 GLN : amide:sc= 0 K(o=0,f=-0.89) USER MOD Single : A 95 LYS NZ :NH3+ -160:sc= -0.289 (180deg=-0.93) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 SER OG : rot 93:sc= 0.735 USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 108 SER OG : rot -170:sc= 0 USER MOD Single : A 109 GLN : amide:sc= -0.0547 X(o=-0.055,f=0) USER MOD Single : A 111 SER OG : rot 31:sc= -4.5! USER MOD Single : A 113 CYS SG : rot 180:sc= -1.17 USER MOD Single : A 114 SER OG : rot 180:sc= 0 USER MOD Single : A 115 SER OG : rot 180:sc= 0 USER MOD Single : A 117 LYS NZ :NH3+ -147:sc= -0.366 (180deg=-1.65!) USER MOD Single : A 126 SER OG : rot -42:sc= 1.26 USER MOD Single : A 129 GLN : amide:sc= -0.205 X(o=-0.2,f=-0.2) USER MOD Single : A 130 MET CE :methyl 145:sc= -0.63 (180deg=-2.46!) USER MOD Single : A 131 GLN : amide:sc= -1.85 K(o=-1.9,f=-7.9!) USER MOD Single : A 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 143 THR OG1 : rot 180:sc= 0.0299 USER MOD Single : A 146 MET CE :methyl -150:sc= -3.04! (180deg=-6.37!) USER MOD Single : A 147 SER OG : rot 78:sc= -2.98! USER MOD Single : A 162 THR OG1 : rot -66:sc= -1.5 USER MOD ----------------------------------------------------------------- ATOM 39 N ALA A 53 33.983 -0.397 3.959 1.00 0.00 N ATOM 40 CA ALA A 53 34.131 -1.712 3.347 1.00 0.00 C ATOM 41 C ALA A 53 35.354 -1.762 2.437 1.00 0.00 C ATOM 42 O ALA A 53 36.173 -2.675 2.531 1.00 0.00 O ATOM 43 CB ALA A 53 32.876 -2.075 2.567 1.00 0.00 C ATOM 0 HA ALA A 53 34.275 -2.441 4.144 1.00 0.00 H new ATOM 0 HB1 ALA A 53 33.000 -3.059 2.115 1.00 0.00 H new ATOM 0 HB2 ALA A 53 32.020 -2.091 3.242 1.00 0.00 H new ATOM 0 HB3 ALA A 53 32.707 -1.335 1.784 1.00 0.00 H new ATOM 49 N ARG A 54 35.470 -0.772 1.555 1.00 0.00 N ATOM 50 CA ARG A 54 36.594 -0.708 0.628 1.00 0.00 C ATOM 51 C ARG A 54 36.924 0.745 0.283 1.00 0.00 C ATOM 52 O ARG A 54 36.029 1.551 0.028 1.00 0.00 O ATOM 53 CB ARG A 54 36.279 -1.541 -0.632 1.00 0.00 C ATOM 54 CG ARG A 54 36.115 -0.744 -1.925 1.00 0.00 C ATOM 55 CD ARG A 54 34.659 -0.395 -2.182 1.00 0.00 C ATOM 56 NE ARG A 54 33.809 -1.586 -2.198 1.00 0.00 N ATOM 57 CZ ARG A 54 33.830 -2.498 -3.166 1.00 0.00 C ATOM 58 NH1 ARG A 54 34.641 -2.355 -4.208 1.00 0.00 N ATOM 59 NH2 ARG A 54 33.033 -3.556 -3.097 1.00 0.00 N ATOM 0 H ARG A 54 34.802 -0.007 1.464 1.00 0.00 H new ATOM 0 HA ARG A 54 37.478 -1.135 1.102 1.00 0.00 H new ATOM 0 HB2 ARG A 54 37.078 -2.269 -0.774 1.00 0.00 H new ATOM 0 HB3 ARG A 54 35.363 -2.104 -0.454 1.00 0.00 H new ATOM 0 HG2 ARG A 54 36.705 0.171 -1.867 1.00 0.00 H new ATOM 0 HG3 ARG A 54 36.505 -1.323 -2.762 1.00 0.00 H new ATOM 0 HD2 ARG A 54 34.308 0.291 -1.411 1.00 0.00 H new ATOM 0 HD3 ARG A 54 34.573 0.126 -3.136 1.00 0.00 H new ATOM 0 HE ARG A 54 33.163 -1.725 -1.421 1.00 0.00 H new ATOM 0 HH11 ARG A 54 35.253 -1.542 -4.270 1.00 0.00 H new ATOM 0 HH12 ARG A 54 34.652 -3.059 -4.946 1.00 0.00 H new ATOM 0 HH21 ARG A 54 32.404 -3.670 -2.302 1.00 0.00 H new ATOM 0 HH22 ARG A 54 33.049 -4.256 -3.839 1.00 0.00 H new ATOM 73 N VAL A 55 38.214 1.069 0.277 1.00 0.00 N ATOM 74 CA VAL A 55 38.663 2.423 -0.036 1.00 0.00 C ATOM 75 C VAL A 55 39.796 2.405 -1.057 1.00 0.00 C ATOM 76 O VAL A 55 40.359 1.352 -1.351 1.00 0.00 O ATOM 77 CB VAL A 55 39.145 3.159 1.228 1.00 0.00 C ATOM 78 CG1 VAL A 55 37.988 3.388 2.190 1.00 0.00 C ATOM 79 CG2 VAL A 55 40.265 2.382 1.905 1.00 0.00 C ATOM 0 H VAL A 55 38.967 0.413 0.485 1.00 0.00 H new ATOM 0 HA VAL A 55 37.806 2.951 -0.455 1.00 0.00 H new ATOM 0 HB VAL A 55 39.537 4.132 0.931 1.00 0.00 H new ATOM 0 HG11 VAL A 55 38.350 3.909 3.076 1.00 0.00 H new ATOM 0 HG12 VAL A 55 37.223 3.991 1.701 1.00 0.00 H new ATOM 0 HG13 VAL A 55 37.562 2.428 2.482 1.00 0.00 H new ATOM 0 HG21 VAL A 55 40.592 2.918 2.796 1.00 0.00 H new ATOM 0 HG22 VAL A 55 39.903 1.394 2.188 1.00 0.00 H new ATOM 0 HG23 VAL A 55 41.103 2.277 1.216 1.00 0.00 H new ATOM 89 N ARG A 56 40.131 3.577 -1.590 1.00 0.00 N ATOM 90 CA ARG A 56 41.203 3.688 -2.572 1.00 0.00 C ATOM 91 C ARG A 56 42.352 4.515 -2.012 1.00 0.00 C ATOM 92 O ARG A 56 42.178 5.684 -1.668 1.00 0.00 O ATOM 93 CB ARG A 56 40.683 4.321 -3.865 1.00 0.00 C ATOM 94 CG ARG A 56 41.707 4.326 -4.989 1.00 0.00 C ATOM 95 CD ARG A 56 41.045 4.193 -6.352 1.00 0.00 C ATOM 96 NE ARG A 56 41.652 5.083 -7.340 1.00 0.00 N ATOM 97 CZ ARG A 56 41.873 4.750 -8.613 1.00 0.00 C ATOM 98 NH1 ARG A 56 41.524 3.552 -9.068 1.00 0.00 N ATOM 99 NH2 ARG A 56 42.440 5.623 -9.434 1.00 0.00 N ATOM 0 H ARG A 56 39.676 4.460 -1.359 1.00 0.00 H new ATOM 0 HA ARG A 56 41.568 2.685 -2.796 1.00 0.00 H new ATOM 0 HB2 ARG A 56 39.796 3.780 -4.194 1.00 0.00 H new ATOM 0 HB3 ARG A 56 40.374 5.346 -3.660 1.00 0.00 H new ATOM 0 HG2 ARG A 56 42.283 5.251 -4.953 1.00 0.00 H new ATOM 0 HG3 ARG A 56 42.411 3.506 -4.844 1.00 0.00 H new ATOM 0 HD2 ARG A 56 41.124 3.161 -6.695 1.00 0.00 H new ATOM 0 HD3 ARG A 56 39.982 4.419 -6.264 1.00 0.00 H new ATOM 0 HE ARG A 56 41.924 6.018 -7.037 1.00 0.00 H new ATOM 0 HH11 ARG A 56 41.083 2.878 -8.443 1.00 0.00 H new ATOM 0 HH12 ARG A 56 41.697 3.306 -10.043 1.00 0.00 H new ATOM 0 HH21 ARG A 56 42.706 6.546 -9.092 1.00 0.00 H new ATOM 0 HH22 ARG A 56 42.610 5.371 -10.408 1.00 0.00 H new ATOM 113 N CYS A 57 43.524 3.896 -1.912 1.00 0.00 N ATOM 114 CA CYS A 57 44.697 4.574 -1.380 1.00 0.00 C ATOM 115 C CYS A 57 45.944 4.263 -2.199 1.00 0.00 C ATOM 116 O CYS A 57 46.059 3.196 -2.804 1.00 0.00 O ATOM 117 CB CYS A 57 44.928 4.157 0.074 1.00 0.00 C ATOM 118 SG CYS A 57 43.604 4.646 1.205 1.00 0.00 S ATOM 0 H CYS A 57 43.685 2.928 -2.192 1.00 0.00 H new ATOM 0 HA CYS A 57 44.511 5.647 -1.434 1.00 0.00 H new ATOM 0 HB2 CYS A 57 45.044 3.074 0.115 1.00 0.00 H new ATOM 0 HB3 CYS A 57 45.866 4.592 0.420 1.00 0.00 H new ATOM 0 HG CYS A 57 42.685 5.287 0.546 1.00 0.00 H new ATOM 124 N SER A 58 46.886 5.196 -2.186 1.00 0.00 N ATOM 125 CA SER A 58 48.146 5.030 -2.897 1.00 0.00 C ATOM 126 C SER A 58 49.280 4.977 -1.887 1.00 0.00 C ATOM 127 O SER A 58 49.132 5.456 -0.764 1.00 0.00 O ATOM 128 CB SER A 58 48.374 6.180 -3.878 1.00 0.00 C ATOM 129 OG SER A 58 47.142 6.732 -4.315 1.00 0.00 O ATOM 0 H SER A 58 46.800 6.082 -1.687 1.00 0.00 H new ATOM 0 HA SER A 58 48.112 4.102 -3.468 1.00 0.00 H new ATOM 0 HB2 SER A 58 48.974 6.955 -3.401 1.00 0.00 H new ATOM 0 HB3 SER A 58 48.941 5.822 -4.738 1.00 0.00 H new ATOM 0 HG SER A 58 47.316 7.467 -4.940 1.00 0.00 H new ATOM 135 N HIS A 59 50.406 4.390 -2.269 1.00 0.00 N ATOM 136 CA HIS A 59 51.526 4.295 -1.345 1.00 0.00 C ATOM 137 C HIS A 59 52.873 4.251 -2.061 1.00 0.00 C ATOM 138 O HIS A 59 52.969 3.861 -3.225 1.00 0.00 O ATOM 139 CB HIS A 59 51.355 3.062 -0.445 1.00 0.00 C ATOM 140 CG HIS A 59 51.927 1.799 -1.019 1.00 0.00 C ATOM 141 ND1 HIS A 59 53.267 1.480 -0.955 1.00 0.00 N ATOM 142 CD2 HIS A 59 51.330 0.771 -1.668 1.00 0.00 C ATOM 143 CE1 HIS A 59 53.470 0.311 -1.540 1.00 0.00 C ATOM 144 NE2 HIS A 59 52.308 -0.138 -1.980 1.00 0.00 N ATOM 0 H HIS A 59 50.567 3.982 -3.190 1.00 0.00 H new ATOM 0 HA HIS A 59 51.524 5.198 -0.734 1.00 0.00 H new ATOM 0 HB2 HIS A 59 51.830 3.259 0.516 1.00 0.00 H new ATOM 0 HB3 HIS A 59 50.293 2.912 -0.251 1.00 0.00 H new ATOM 0 HD2 HIS A 59 50.278 0.683 -1.897 1.00 0.00 H new ATOM 0 HE1 HIS A 59 54.422 -0.190 -1.641 1.00 0.00 H new ATOM 0 HE2 HIS A 59 52.162 -1.019 -2.473 1.00 0.00 H new ATOM 153 N LEU A 60 53.913 4.646 -1.332 1.00 0.00 N ATOM 154 CA LEU A 60 55.275 4.650 -1.851 1.00 0.00 C ATOM 155 C LEU A 60 56.151 3.747 -0.991 1.00 0.00 C ATOM 156 O LEU A 60 56.289 3.969 0.212 1.00 0.00 O ATOM 157 CB LEU A 60 55.839 6.073 -1.859 1.00 0.00 C ATOM 158 CG LEU A 60 57.065 6.278 -2.753 1.00 0.00 C ATOM 159 CD1 LEU A 60 57.432 7.753 -2.828 1.00 0.00 C ATOM 160 CD2 LEU A 60 58.241 5.459 -2.238 1.00 0.00 C ATOM 0 H LEU A 60 53.835 4.971 -0.368 1.00 0.00 H new ATOM 0 HA LEU A 60 55.265 4.276 -2.875 1.00 0.00 H new ATOM 0 HB2 LEU A 60 55.054 6.757 -2.182 1.00 0.00 H new ATOM 0 HB3 LEU A 60 56.102 6.349 -0.838 1.00 0.00 H new ATOM 0 HG LEU A 60 56.820 5.935 -3.758 1.00 0.00 H new ATOM 0 HD11 LEU A 60 58.306 7.879 -3.468 1.00 0.00 H new ATOM 0 HD12 LEU A 60 56.595 8.316 -3.242 1.00 0.00 H new ATOM 0 HD13 LEU A 60 57.659 8.123 -1.828 1.00 0.00 H new ATOM 0 HD21 LEU A 60 59.104 5.616 -2.884 1.00 0.00 H new ATOM 0 HD22 LEU A 60 58.486 5.772 -1.223 1.00 0.00 H new ATOM 0 HD23 LEU A 60 57.976 4.402 -2.237 1.00 0.00 H new ATOM 172 N LEU A 61 56.720 2.715 -1.603 1.00 0.00 N ATOM 173 CA LEU A 61 57.557 1.769 -0.875 1.00 0.00 C ATOM 174 C LEU A 61 59.041 2.114 -0.997 1.00 0.00 C ATOM 175 O LEU A 61 59.555 2.329 -2.093 1.00 0.00 O ATOM 176 CB LEU A 61 57.299 0.346 -1.389 1.00 0.00 C ATOM 177 CG LEU A 61 58.336 -0.716 -0.992 1.00 0.00 C ATOM 178 CD1 LEU A 61 58.819 -0.507 0.438 1.00 0.00 C ATOM 179 CD2 LEU A 61 57.751 -2.112 -1.157 1.00 0.00 C ATOM 0 H LEU A 61 56.618 2.512 -2.597 1.00 0.00 H new ATOM 0 HA LEU A 61 57.293 1.830 0.181 1.00 0.00 H new ATOM 0 HB2 LEU A 61 56.322 0.023 -1.028 1.00 0.00 H new ATOM 0 HB3 LEU A 61 57.242 0.380 -2.477 1.00 0.00 H new ATOM 0 HG LEU A 61 59.196 -0.613 -1.654 1.00 0.00 H new ATOM 0 HD11 LEU A 61 59.552 -1.273 0.690 1.00 0.00 H new ATOM 0 HD12 LEU A 61 59.278 0.477 0.527 1.00 0.00 H new ATOM 0 HD13 LEU A 61 57.973 -0.575 1.122 1.00 0.00 H new ATOM 0 HD21 LEU A 61 58.496 -2.855 -0.872 1.00 0.00 H new ATOM 0 HD22 LEU A 61 56.873 -2.216 -0.520 1.00 0.00 H new ATOM 0 HD23 LEU A 61 57.464 -2.266 -2.197 1.00 0.00 H new ATOM 191 N VAL A 62 59.722 2.137 0.146 1.00 0.00 N ATOM 192 CA VAL A 62 61.148 2.425 0.192 1.00 0.00 C ATOM 193 C VAL A 62 61.857 1.361 1.030 1.00 0.00 C ATOM 194 O VAL A 62 61.905 1.452 2.257 1.00 0.00 O ATOM 195 CB VAL A 62 61.422 3.833 0.774 1.00 0.00 C ATOM 196 CG1 VAL A 62 62.811 3.917 1.402 1.00 0.00 C ATOM 197 CG2 VAL A 62 61.258 4.893 -0.305 1.00 0.00 C ATOM 0 H VAL A 62 59.302 1.958 1.058 1.00 0.00 H new ATOM 0 HA VAL A 62 61.535 2.407 -0.827 1.00 0.00 H new ATOM 0 HB VAL A 62 60.691 4.017 1.562 1.00 0.00 H new ATOM 0 HG11 VAL A 62 62.970 4.919 1.801 1.00 0.00 H new ATOM 0 HG12 VAL A 62 62.890 3.189 2.209 1.00 0.00 H new ATOM 0 HG13 VAL A 62 63.566 3.703 0.645 1.00 0.00 H new ATOM 0 HG21 VAL A 62 61.454 5.878 0.120 1.00 0.00 H new ATOM 0 HG22 VAL A 62 61.962 4.700 -1.114 1.00 0.00 H new ATOM 0 HG23 VAL A 62 60.240 4.862 -0.694 1.00 0.00 H new ATOM 207 N LYS A 63 62.386 0.342 0.360 1.00 0.00 N ATOM 208 CA LYS A 63 63.074 -0.753 1.046 1.00 0.00 C ATOM 209 C LYS A 63 64.394 -0.292 1.645 1.00 0.00 C ATOM 210 O LYS A 63 64.944 0.738 1.258 1.00 0.00 O ATOM 211 CB LYS A 63 63.319 -1.940 0.099 1.00 0.00 C ATOM 212 CG LYS A 63 62.504 -1.903 -1.186 1.00 0.00 C ATOM 213 CD LYS A 63 62.547 -3.236 -1.916 1.00 0.00 C ATOM 214 CE LYS A 63 61.232 -3.990 -1.783 1.00 0.00 C ATOM 215 NZ LYS A 63 61.370 -5.191 -0.915 1.00 0.00 N ATOM 0 H LYS A 63 62.353 0.249 -0.655 1.00 0.00 H new ATOM 0 HA LYS A 63 62.421 -1.080 1.855 1.00 0.00 H new ATOM 0 HB2 LYS A 63 64.378 -1.970 -0.158 1.00 0.00 H new ATOM 0 HB3 LYS A 63 63.094 -2.865 0.630 1.00 0.00 H new ATOM 0 HG2 LYS A 63 61.470 -1.648 -0.954 1.00 0.00 H new ATOM 0 HG3 LYS A 63 62.887 -1.118 -1.838 1.00 0.00 H new ATOM 0 HD2 LYS A 63 62.765 -3.067 -2.970 1.00 0.00 H new ATOM 0 HD3 LYS A 63 63.358 -3.845 -1.516 1.00 0.00 H new ATOM 0 HE2 LYS A 63 60.473 -3.327 -1.368 1.00 0.00 H new ATOM 0 HE3 LYS A 63 60.885 -4.293 -2.771 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 60.461 -5.390 -0.451 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 61.649 -6.008 -1.495 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 62.096 -5.015 -0.192 1.00 0.00 H new ATOM 229 N HIS A 64 64.893 -1.072 2.598 1.00 0.00 N ATOM 230 CA HIS A 64 66.148 -0.759 3.263 1.00 0.00 C ATOM 231 C HIS A 64 66.987 -2.019 3.466 1.00 0.00 C ATOM 232 O HIS A 64 66.551 -3.126 3.151 1.00 0.00 O ATOM 233 CB HIS A 64 65.881 -0.073 4.606 1.00 0.00 C ATOM 234 CG HIS A 64 64.725 -0.642 5.374 1.00 0.00 C ATOM 235 ND1 HIS A 64 64.688 -1.943 5.827 1.00 0.00 N ATOM 236 CD2 HIS A 64 63.573 -0.068 5.793 1.00 0.00 C ATOM 237 CE1 HIS A 64 63.567 -2.145 6.494 1.00 0.00 C ATOM 238 NE2 HIS A 64 62.873 -1.022 6.489 1.00 0.00 N ATOM 0 H HIS A 64 64.444 -1.927 2.926 1.00 0.00 H new ATOM 0 HA HIS A 64 66.710 -0.076 2.626 1.00 0.00 H new ATOM 0 HB2 HIS A 64 66.779 -0.142 5.220 1.00 0.00 H new ATOM 0 HB3 HIS A 64 65.697 0.987 4.429 1.00 0.00 H new ATOM 0 HD2 HIS A 64 63.262 0.951 5.613 1.00 0.00 H new ATOM 0 HE1 HIS A 64 63.269 -3.071 6.964 1.00 0.00 H new ATOM 0 HE2 HIS A 64 61.964 -0.885 6.931 1.00 0.00 H new ATOM 247 N SER A 65 68.197 -1.839 3.989 1.00 0.00 N ATOM 248 CA SER A 65 69.109 -2.956 4.229 1.00 0.00 C ATOM 249 C SER A 65 68.527 -3.956 5.227 1.00 0.00 C ATOM 250 O SER A 65 69.007 -5.084 5.335 1.00 0.00 O ATOM 251 CB SER A 65 70.453 -2.437 4.743 1.00 0.00 C ATOM 252 OG SER A 65 70.411 -2.197 6.138 1.00 0.00 O ATOM 0 H SER A 65 68.570 -0.928 4.256 1.00 0.00 H new ATOM 0 HA SER A 65 69.254 -3.472 3.280 1.00 0.00 H new ATOM 0 HB2 SER A 65 71.235 -3.163 4.520 1.00 0.00 H new ATOM 0 HB3 SER A 65 70.714 -1.516 4.221 1.00 0.00 H new ATOM 0 HG SER A 65 71.283 -1.867 6.440 1.00 0.00 H new ATOM 258 N GLN A 66 67.498 -3.541 5.958 1.00 0.00 N ATOM 259 CA GLN A 66 66.868 -4.407 6.949 1.00 0.00 C ATOM 260 C GLN A 66 65.667 -5.152 6.365 1.00 0.00 C ATOM 261 O GLN A 66 65.056 -5.978 7.043 1.00 0.00 O ATOM 262 CB GLN A 66 66.420 -3.586 8.158 1.00 0.00 C ATOM 263 CG GLN A 66 67.574 -3.062 8.998 1.00 0.00 C ATOM 264 CD GLN A 66 67.675 -1.550 8.967 1.00 0.00 C ATOM 265 OE1 GLN A 66 68.758 -0.992 8.781 1.00 0.00 O ATOM 266 NE2 GLN A 66 66.546 -0.876 9.152 1.00 0.00 N ATOM 0 H GLN A 66 67.083 -2.612 5.884 1.00 0.00 H new ATOM 0 HA GLN A 66 67.609 -5.144 7.258 1.00 0.00 H new ATOM 0 HB2 GLN A 66 65.821 -2.744 7.813 1.00 0.00 H new ATOM 0 HB3 GLN A 66 65.774 -4.201 8.785 1.00 0.00 H new ATOM 0 HG2 GLN A 66 67.449 -3.393 10.029 1.00 0.00 H new ATOM 0 HG3 GLN A 66 68.508 -3.493 8.636 1.00 0.00 H new ATOM 0 HE21 GLN A 66 65.671 -1.378 9.303 1.00 0.00 H new ATOM 0 HE22 GLN A 66 66.554 0.144 9.143 1.00 0.00 H new ATOM 275 N SER A 67 65.330 -4.866 5.110 1.00 0.00 N ATOM 276 CA SER A 67 64.204 -5.526 4.461 1.00 0.00 C ATOM 277 C SER A 67 64.504 -7.004 4.244 1.00 0.00 C ATOM 278 O SER A 67 65.655 -7.387 4.036 1.00 0.00 O ATOM 279 CB SER A 67 63.890 -4.853 3.124 1.00 0.00 C ATOM 280 OG SER A 67 64.963 -5.001 2.211 1.00 0.00 O ATOM 0 H SER A 67 65.818 -4.186 4.527 1.00 0.00 H new ATOM 0 HA SER A 67 63.334 -5.438 5.112 1.00 0.00 H new ATOM 0 HB2 SER A 67 62.985 -5.287 2.699 1.00 0.00 H new ATOM 0 HB3 SER A 67 63.690 -3.794 3.285 1.00 0.00 H new ATOM 0 HG SER A 67 65.667 -4.353 2.425 1.00 0.00 H new ATOM 286 N ARG A 68 63.465 -7.837 4.289 1.00 0.00 N ATOM 287 CA ARG A 68 63.637 -9.272 4.091 1.00 0.00 C ATOM 288 C ARG A 68 64.363 -9.552 2.776 1.00 0.00 C ATOM 289 O ARG A 68 65.008 -10.589 2.619 1.00 0.00 O ATOM 290 CB ARG A 68 62.282 -9.988 4.123 1.00 0.00 C ATOM 291 CG ARG A 68 61.407 -9.719 2.909 1.00 0.00 C ATOM 292 CD ARG A 68 60.254 -10.707 2.830 1.00 0.00 C ATOM 293 NE ARG A 68 59.146 -10.199 2.024 1.00 0.00 N ATOM 294 CZ ARG A 68 57.899 -10.659 2.104 1.00 0.00 C ATOM 295 NH1 ARG A 68 57.595 -11.631 2.956 1.00 0.00 N ATOM 296 NH2 ARG A 68 56.950 -10.148 1.331 1.00 0.00 N ATOM 0 H ARG A 68 62.503 -7.544 4.460 1.00 0.00 H new ATOM 0 HA ARG A 68 64.248 -9.658 4.907 1.00 0.00 H new ATOM 0 HB2 ARG A 68 62.453 -11.062 4.203 1.00 0.00 H new ATOM 0 HB3 ARG A 68 61.743 -9.683 5.020 1.00 0.00 H new ATOM 0 HG2 ARG A 68 61.015 -8.703 2.958 1.00 0.00 H new ATOM 0 HG3 ARG A 68 62.009 -9.785 2.002 1.00 0.00 H new ATOM 0 HD2 ARG A 68 60.610 -11.645 2.405 1.00 0.00 H new ATOM 0 HD3 ARG A 68 59.898 -10.928 3.836 1.00 0.00 H new ATOM 0 HE ARG A 68 59.339 -9.448 1.361 1.00 0.00 H new ATOM 0 HH11 ARG A 68 58.319 -12.030 3.554 1.00 0.00 H new ATOM 0 HH12 ARG A 68 56.638 -11.979 3.012 1.00 0.00 H new ATOM 0 HH21 ARG A 68 57.175 -9.401 0.674 1.00 0.00 H new ATOM 0 HH22 ARG A 68 55.995 -10.502 1.394 1.00 0.00 H new ATOM 310 N ARG A 69 64.263 -8.611 1.842 1.00 0.00 N ATOM 311 CA ARG A 69 64.919 -8.740 0.546 1.00 0.00 C ATOM 312 C ARG A 69 65.253 -7.361 -0.020 1.00 0.00 C ATOM 313 O ARG A 69 64.462 -6.777 -0.762 1.00 0.00 O ATOM 314 CB ARG A 69 64.037 -9.518 -0.435 1.00 0.00 C ATOM 315 CG ARG A 69 62.626 -8.965 -0.568 1.00 0.00 C ATOM 316 CD ARG A 69 62.064 -9.203 -1.960 1.00 0.00 C ATOM 317 NE ARG A 69 62.093 -7.991 -2.779 1.00 0.00 N ATOM 318 CZ ARG A 69 61.278 -7.771 -3.809 1.00 0.00 C ATOM 319 NH1 ARG A 69 60.372 -8.677 -4.157 1.00 0.00 N ATOM 320 NH2 ARG A 69 61.369 -6.639 -4.494 1.00 0.00 N ATOM 0 H ARG A 69 63.732 -7.748 1.960 1.00 0.00 H new ATOM 0 HA ARG A 69 65.846 -9.295 0.687 1.00 0.00 H new ATOM 0 HB2 ARG A 69 64.512 -9.515 -1.416 1.00 0.00 H new ATOM 0 HB3 ARG A 69 63.980 -10.557 -0.112 1.00 0.00 H new ATOM 0 HG2 ARG A 69 61.979 -9.435 0.172 1.00 0.00 H new ATOM 0 HG3 ARG A 69 62.631 -7.896 -0.354 1.00 0.00 H new ATOM 0 HD2 ARG A 69 62.638 -9.987 -2.453 1.00 0.00 H new ATOM 0 HD3 ARG A 69 61.038 -9.562 -1.880 1.00 0.00 H new ATOM 0 HE ARG A 69 62.778 -7.272 -2.547 1.00 0.00 H new ATOM 0 HH11 ARG A 69 60.296 -9.549 -3.634 1.00 0.00 H new ATOM 0 HH12 ARG A 69 59.752 -8.501 -4.947 1.00 0.00 H new ATOM 0 HH21 ARG A 69 62.062 -5.938 -4.232 1.00 0.00 H new ATOM 0 HH22 ARG A 69 60.746 -6.469 -5.283 1.00 0.00 H new ATOM 334 N PRO A 70 66.432 -6.818 0.327 1.00 0.00 N ATOM 335 CA PRO A 70 66.865 -5.500 -0.146 1.00 0.00 C ATOM 336 C PRO A 70 67.124 -5.484 -1.647 1.00 0.00 C ATOM 337 O PRO A 70 68.263 -5.348 -2.094 1.00 0.00 O ATOM 338 CB PRO A 70 68.158 -5.238 0.630 1.00 0.00 C ATOM 339 CG PRO A 70 68.654 -6.586 1.026 1.00 0.00 C ATOM 340 CD PRO A 70 67.433 -7.446 1.209 1.00 0.00 C ATOM 0 HA PRO A 70 66.102 -4.739 0.019 1.00 0.00 H new ATOM 0 HB2 PRO A 70 68.889 -4.715 0.013 1.00 0.00 H new ATOM 0 HB3 PRO A 70 67.973 -4.614 1.504 1.00 0.00 H new ATOM 0 HG2 PRO A 70 69.310 -7.000 0.260 1.00 0.00 H new ATOM 0 HG3 PRO A 70 69.234 -6.532 1.947 1.00 0.00 H new ATOM 0 HD2 PRO A 70 67.625 -8.481 0.925 1.00 0.00 H new ATOM 0 HD3 PRO A 70 67.102 -7.457 2.247 1.00 0.00 H new ATOM 348 N SER A 71 66.053 -5.624 -2.418 1.00 0.00 N ATOM 349 CA SER A 71 66.144 -5.627 -3.871 1.00 0.00 C ATOM 350 C SER A 71 64.762 -5.454 -4.490 1.00 0.00 C ATOM 351 O SER A 71 63.761 -5.885 -3.921 1.00 0.00 O ATOM 352 CB SER A 71 66.779 -6.929 -4.361 1.00 0.00 C ATOM 353 OG SER A 71 66.537 -7.127 -5.743 1.00 0.00 O ATOM 0 H SER A 71 65.106 -5.738 -2.057 1.00 0.00 H new ATOM 0 HA SER A 71 66.773 -4.792 -4.179 1.00 0.00 H new ATOM 0 HB2 SER A 71 67.853 -6.905 -4.177 1.00 0.00 H new ATOM 0 HB3 SER A 71 66.377 -7.769 -3.794 1.00 0.00 H new ATOM 0 HG SER A 71 66.550 -8.086 -5.943 1.00 0.00 H new ATOM 359 N SER A 72 64.713 -4.819 -5.655 1.00 0.00 N ATOM 360 CA SER A 72 63.447 -4.591 -6.340 1.00 0.00 C ATOM 361 C SER A 72 63.650 -4.498 -7.850 1.00 0.00 C ATOM 362 O SER A 72 64.770 -4.611 -8.347 1.00 0.00 O ATOM 363 CB SER A 72 62.786 -3.312 -5.822 1.00 0.00 C ATOM 364 OG SER A 72 61.405 -3.518 -5.574 1.00 0.00 O ATOM 0 H SER A 72 65.531 -4.454 -6.143 1.00 0.00 H new ATOM 0 HA SER A 72 62.794 -5.439 -6.133 1.00 0.00 H new ATOM 0 HB2 SER A 72 63.279 -2.989 -4.905 1.00 0.00 H new ATOM 0 HB3 SER A 72 62.913 -2.512 -6.551 1.00 0.00 H new ATOM 0 HG SER A 72 60.879 -2.884 -6.105 1.00 0.00 H new ATOM 370 N TRP A 73 62.559 -4.290 -8.573 1.00 0.00 N ATOM 371 CA TRP A 73 62.618 -4.181 -10.025 1.00 0.00 C ATOM 372 C TRP A 73 63.486 -2.997 -10.464 1.00 0.00 C ATOM 373 O TRP A 73 63.857 -2.895 -11.632 1.00 0.00 O ATOM 374 CB TRP A 73 61.205 -4.040 -10.597 1.00 0.00 C ATOM 375 CG TRP A 73 60.559 -2.726 -10.278 1.00 0.00 C ATOM 376 CD1 TRP A 73 60.116 -2.300 -9.057 1.00 0.00 C ATOM 377 CD2 TRP A 73 60.284 -1.664 -11.197 1.00 0.00 C ATOM 378 NE1 TRP A 73 59.582 -1.036 -9.165 1.00 0.00 N ATOM 379 CE2 TRP A 73 59.676 -0.629 -10.465 1.00 0.00 C ATOM 380 CE3 TRP A 73 60.495 -1.485 -12.568 1.00 0.00 C ATOM 381 CZ2 TRP A 73 59.278 0.561 -11.051 1.00 0.00 C ATOM 382 CZ3 TRP A 73 60.095 -0.297 -13.151 1.00 0.00 C ATOM 383 CH2 TRP A 73 59.492 0.713 -12.393 1.00 0.00 C ATOM 0 H TRP A 73 61.623 -4.193 -8.179 1.00 0.00 H new ATOM 0 HA TRP A 73 63.075 -5.091 -10.412 1.00 0.00 H new ATOM 0 HB2 TRP A 73 61.246 -4.162 -11.679 1.00 0.00 H new ATOM 0 HB3 TRP A 73 60.582 -4.846 -10.208 1.00 0.00 H new ATOM 0 HD1 TRP A 73 60.176 -2.871 -8.142 1.00 0.00 H new ATOM 0 HE1 TRP A 73 59.182 -0.493 -8.400 1.00 0.00 H new ATOM 0 HE3 TRP A 73 60.961 -2.259 -13.159 1.00 0.00 H new ATOM 0 HZ2 TRP A 73 58.814 1.343 -10.468 1.00 0.00 H new ATOM 0 HZ3 TRP A 73 60.250 -0.146 -14.209 1.00 0.00 H new ATOM 0 HH2 TRP A 73 59.190 1.630 -12.877 1.00 0.00 H new ATOM 394 N ARG A 74 63.797 -2.101 -9.527 1.00 0.00 N ATOM 395 CA ARG A 74 64.609 -0.929 -9.834 1.00 0.00 C ATOM 396 C ARG A 74 66.034 -1.064 -9.292 1.00 0.00 C ATOM 397 O ARG A 74 66.947 -0.391 -9.769 1.00 0.00 O ATOM 398 CB ARG A 74 63.952 0.329 -9.261 1.00 0.00 C ATOM 399 CG ARG A 74 63.073 1.067 -10.258 1.00 0.00 C ATOM 400 CD ARG A 74 62.155 2.067 -9.567 1.00 0.00 C ATOM 401 NE ARG A 74 62.791 2.696 -8.410 1.00 0.00 N ATOM 402 CZ ARG A 74 63.800 3.560 -8.496 1.00 0.00 C ATOM 403 NH1 ARG A 74 64.290 3.905 -9.680 1.00 0.00 N ATOM 404 NH2 ARG A 74 64.321 4.082 -7.394 1.00 0.00 N ATOM 0 H ARG A 74 63.499 -2.166 -8.554 1.00 0.00 H new ATOM 0 HA ARG A 74 64.673 -0.848 -10.919 1.00 0.00 H new ATOM 0 HB2 ARG A 74 63.351 0.052 -8.395 1.00 0.00 H new ATOM 0 HB3 ARG A 74 64.730 1.005 -8.906 1.00 0.00 H new ATOM 0 HG2 ARG A 74 63.701 1.588 -10.981 1.00 0.00 H new ATOM 0 HG3 ARG A 74 62.473 0.348 -10.817 1.00 0.00 H new ATOM 0 HD2 ARG A 74 61.858 2.837 -10.279 1.00 0.00 H new ATOM 0 HD3 ARG A 74 61.244 1.560 -9.248 1.00 0.00 H new ATOM 0 HE ARG A 74 62.441 2.459 -7.482 1.00 0.00 H new ATOM 0 HH11 ARG A 74 63.893 3.508 -10.532 1.00 0.00 H new ATOM 0 HH12 ARG A 74 65.063 4.568 -9.739 1.00 0.00 H new ATOM 0 HH21 ARG A 74 63.949 3.821 -6.481 1.00 0.00 H new ATOM 0 HH22 ARG A 74 65.094 4.744 -7.459 1.00 0.00 H new ATOM 418 N GLN A 75 66.224 -1.926 -8.296 1.00 0.00 N ATOM 419 CA GLN A 75 67.549 -2.124 -7.707 1.00 0.00 C ATOM 420 C GLN A 75 67.714 -3.540 -7.167 1.00 0.00 C ATOM 421 O GLN A 75 66.777 -4.333 -7.171 1.00 0.00 O ATOM 422 CB GLN A 75 67.794 -1.109 -6.588 1.00 0.00 C ATOM 423 CG GLN A 75 69.072 -0.307 -6.763 1.00 0.00 C ATOM 424 CD GLN A 75 68.942 1.117 -6.260 1.00 0.00 C ATOM 425 OE1 GLN A 75 68.695 2.040 -7.035 1.00 0.00 O ATOM 426 NE2 GLN A 75 69.109 1.303 -4.956 1.00 0.00 N ATOM 0 H GLN A 75 65.486 -2.495 -7.882 1.00 0.00 H new ATOM 0 HA GLN A 75 68.285 -1.973 -8.496 1.00 0.00 H new ATOM 0 HB2 GLN A 75 66.948 -0.423 -6.540 1.00 0.00 H new ATOM 0 HB3 GLN A 75 67.833 -1.635 -5.634 1.00 0.00 H new ATOM 0 HG2 GLN A 75 69.883 -0.803 -6.231 1.00 0.00 H new ATOM 0 HG3 GLN A 75 69.345 -0.292 -7.818 1.00 0.00 H new ATOM 0 HE21 GLN A 75 69.313 0.509 -4.349 1.00 0.00 H new ATOM 0 HE22 GLN A 75 69.034 2.240 -4.561 1.00 0.00 H new ATOM 435 N GLU A 76 68.919 -3.851 -6.701 1.00 0.00 N ATOM 436 CA GLU A 76 69.204 -5.176 -6.160 1.00 0.00 C ATOM 437 C GLU A 76 70.188 -5.118 -4.988 1.00 0.00 C ATOM 438 O GLU A 76 70.631 -6.155 -4.495 1.00 0.00 O ATOM 439 CB GLU A 76 69.759 -6.084 -7.260 1.00 0.00 C ATOM 440 CG GLU A 76 68.926 -7.333 -7.496 1.00 0.00 C ATOM 441 CD GLU A 76 69.719 -8.443 -8.157 1.00 0.00 C ATOM 442 OE1 GLU A 76 69.981 -8.344 -9.373 1.00 0.00 O ATOM 443 OE2 GLU A 76 70.075 -9.415 -7.457 1.00 0.00 O ATOM 0 H GLU A 76 69.710 -3.208 -6.687 1.00 0.00 H new ATOM 0 HA GLU A 76 68.266 -5.584 -5.785 1.00 0.00 H new ATOM 0 HB2 GLU A 76 69.821 -5.518 -8.189 1.00 0.00 H new ATOM 0 HB3 GLU A 76 70.775 -6.379 -6.998 1.00 0.00 H new ATOM 0 HG2 GLU A 76 68.533 -7.689 -6.544 1.00 0.00 H new ATOM 0 HG3 GLU A 76 68.069 -7.082 -8.121 1.00 0.00 H new ATOM 450 N LYS A 77 70.530 -3.912 -4.542 1.00 0.00 N ATOM 451 CA LYS A 77 71.459 -3.751 -3.429 1.00 0.00 C ATOM 452 C LYS A 77 71.071 -2.558 -2.562 1.00 0.00 C ATOM 453 O LYS A 77 71.745 -1.527 -2.568 1.00 0.00 O ATOM 454 CB LYS A 77 72.887 -3.577 -3.954 1.00 0.00 C ATOM 455 CG LYS A 77 73.939 -4.254 -3.088 1.00 0.00 C ATOM 456 CD LYS A 77 73.827 -5.768 -3.159 1.00 0.00 C ATOM 457 CE LYS A 77 74.129 -6.283 -4.558 1.00 0.00 C ATOM 458 NZ LYS A 77 74.150 -7.771 -4.610 1.00 0.00 N ATOM 0 H LYS A 77 70.180 -3.037 -4.932 1.00 0.00 H new ATOM 0 HA LYS A 77 71.412 -4.650 -2.814 1.00 0.00 H new ATOM 0 HB2 LYS A 77 72.946 -3.980 -4.965 1.00 0.00 H new ATOM 0 HB3 LYS A 77 73.114 -2.513 -4.022 1.00 0.00 H new ATOM 0 HG2 LYS A 77 74.933 -3.946 -3.413 1.00 0.00 H new ATOM 0 HG3 LYS A 77 73.826 -3.928 -2.054 1.00 0.00 H new ATOM 0 HD2 LYS A 77 74.518 -6.219 -2.447 1.00 0.00 H new ATOM 0 HD3 LYS A 77 72.823 -6.074 -2.866 1.00 0.00 H new ATOM 0 HE2 LYS A 77 73.379 -5.906 -5.253 1.00 0.00 H new ATOM 0 HE3 LYS A 77 75.093 -5.895 -4.888 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 74.359 -8.082 -5.580 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 74.883 -8.131 -3.966 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 73.222 -8.142 -4.320 1.00 0.00 H new ATOM 472 N ILE A 78 69.981 -2.700 -1.814 1.00 0.00 N ATOM 473 CA ILE A 78 69.513 -1.629 -0.947 1.00 0.00 C ATOM 474 C ILE A 78 70.152 -1.723 0.435 1.00 0.00 C ATOM 475 O ILE A 78 69.723 -2.513 1.275 1.00 0.00 O ATOM 476 CB ILE A 78 67.979 -1.653 -0.805 1.00 0.00 C ATOM 477 CG1 ILE A 78 67.324 -1.794 -2.183 1.00 0.00 C ATOM 478 CG2 ILE A 78 67.494 -0.393 -0.102 1.00 0.00 C ATOM 479 CD1 ILE A 78 65.811 -1.743 -2.146 1.00 0.00 C ATOM 0 H ILE A 78 69.408 -3.544 -1.792 1.00 0.00 H new ATOM 0 HA ILE A 78 69.808 -0.689 -1.412 1.00 0.00 H new ATOM 0 HB ILE A 78 67.693 -2.513 -0.199 1.00 0.00 H new ATOM 0 HG12 ILE A 78 67.690 -0.999 -2.832 1.00 0.00 H new ATOM 0 HG13 ILE A 78 67.636 -2.738 -2.629 1.00 0.00 H new ATOM 0 HG21 ILE A 78 66.408 -0.423 -0.009 1.00 0.00 H new ATOM 0 HG22 ILE A 78 67.942 -0.334 0.890 1.00 0.00 H new ATOM 0 HG23 ILE A 78 67.784 0.482 -0.683 1.00 0.00 H new ATOM 0 HD11 ILE A 78 65.419 -1.849 -3.157 1.00 0.00 H new ATOM 0 HD12 ILE A 78 65.435 -2.555 -1.524 1.00 0.00 H new ATOM 0 HD13 ILE A 78 65.489 -0.788 -1.730 1.00 0.00 H new ATOM 491 N THR A 79 71.179 -0.909 0.663 1.00 0.00 N ATOM 492 CA THR A 79 71.878 -0.899 1.944 1.00 0.00 C ATOM 493 C THR A 79 71.488 0.328 2.763 1.00 0.00 C ATOM 494 O THR A 79 72.269 0.817 3.578 1.00 0.00 O ATOM 495 CB THR A 79 73.391 -0.919 1.724 1.00 0.00 C ATOM 496 OG1 THR A 79 73.722 -1.677 0.574 1.00 0.00 O ATOM 497 CG2 THR A 79 74.158 -1.499 2.893 1.00 0.00 C ATOM 0 H THR A 79 71.545 -0.248 -0.022 1.00 0.00 H new ATOM 0 HA THR A 79 71.588 -1.793 2.497 1.00 0.00 H new ATOM 0 HB THR A 79 73.678 0.125 1.604 1.00 0.00 H new ATOM 0 HG1 THR A 79 74.694 -1.676 0.450 1.00 0.00 H new ATOM 0 HG21 THR A 79 75.225 -1.484 2.672 1.00 0.00 H new ATOM 0 HG22 THR A 79 73.964 -0.905 3.786 1.00 0.00 H new ATOM 0 HG23 THR A 79 73.838 -2.527 3.064 1.00 0.00 H new ATOM 505 N ARG A 80 70.273 0.815 2.538 1.00 0.00 N ATOM 506 CA ARG A 80 69.770 1.982 3.250 1.00 0.00 C ATOM 507 C ARG A 80 69.323 1.598 4.661 1.00 0.00 C ATOM 508 O ARG A 80 68.868 0.479 4.895 1.00 0.00 O ATOM 509 CB ARG A 80 68.617 2.613 2.450 1.00 0.00 C ATOM 510 CG ARG A 80 67.442 3.095 3.290 1.00 0.00 C ATOM 511 CD ARG A 80 66.294 3.573 2.416 1.00 0.00 C ATOM 512 NE ARG A 80 66.755 4.408 1.307 1.00 0.00 N ATOM 513 CZ ARG A 80 67.078 3.939 0.103 1.00 0.00 C ATOM 514 NH1 ARG A 80 66.998 2.641 -0.159 1.00 0.00 N ATOM 515 NH2 ARG A 80 67.485 4.774 -0.844 1.00 0.00 N ATOM 0 H ARG A 80 69.617 0.418 1.866 1.00 0.00 H new ATOM 0 HA ARG A 80 70.568 2.718 3.349 1.00 0.00 H new ATOM 0 HB2 ARG A 80 69.008 3.456 1.881 1.00 0.00 H new ATOM 0 HB3 ARG A 80 68.253 1.882 1.728 1.00 0.00 H new ATOM 0 HG2 ARG A 80 67.098 2.286 3.935 1.00 0.00 H new ATOM 0 HG3 ARG A 80 67.767 3.906 3.942 1.00 0.00 H new ATOM 0 HD2 ARG A 80 65.757 2.711 2.021 1.00 0.00 H new ATOM 0 HD3 ARG A 80 65.587 4.137 3.024 1.00 0.00 H new ATOM 0 HE ARG A 80 66.834 5.412 1.466 1.00 0.00 H new ATOM 0 HH11 ARG A 80 66.687 1.993 0.565 1.00 0.00 H new ATOM 0 HH12 ARG A 80 67.247 2.291 -1.084 1.00 0.00 H new ATOM 0 HH21 ARG A 80 67.550 5.773 -0.649 1.00 0.00 H new ATOM 0 HH22 ARG A 80 67.733 4.417 -1.767 1.00 0.00 H new ATOM 529 N THR A 81 69.459 2.531 5.598 1.00 0.00 N ATOM 530 CA THR A 81 69.072 2.281 6.983 1.00 0.00 C ATOM 531 C THR A 81 67.640 2.738 7.243 1.00 0.00 C ATOM 532 O THR A 81 67.039 3.433 6.423 1.00 0.00 O ATOM 533 CB THR A 81 70.031 2.995 7.940 1.00 0.00 C ATOM 534 OG1 THR A 81 70.730 4.031 7.273 1.00 0.00 O ATOM 535 CG2 THR A 81 71.059 2.069 8.554 1.00 0.00 C ATOM 0 H THR A 81 69.833 3.464 5.425 1.00 0.00 H new ATOM 0 HA THR A 81 69.126 1.207 7.159 1.00 0.00 H new ATOM 0 HB THR A 81 69.401 3.394 8.735 1.00 0.00 H new ATOM 0 HG1 THR A 81 71.336 4.475 7.903 1.00 0.00 H new ATOM 0 HG21 THR A 81 71.707 2.637 9.222 1.00 0.00 H new ATOM 0 HG22 THR A 81 70.552 1.286 9.119 1.00 0.00 H new ATOM 0 HG23 THR A 81 71.659 1.616 7.764 1.00 0.00 H new ATOM 543 N LYS A 82 67.099 2.341 8.391 1.00 0.00 N ATOM 544 CA LYS A 82 65.740 2.707 8.767 1.00 0.00 C ATOM 545 C LYS A 82 65.592 4.227 8.828 1.00 0.00 C ATOM 546 O LYS A 82 64.577 4.779 8.404 1.00 0.00 O ATOM 547 CB LYS A 82 65.376 2.047 10.111 1.00 0.00 C ATOM 548 CG LYS A 82 64.665 2.953 11.111 1.00 0.00 C ATOM 549 CD LYS A 82 65.653 3.628 12.049 1.00 0.00 C ATOM 550 CE LYS A 82 66.152 2.667 13.117 1.00 0.00 C ATOM 551 NZ LYS A 82 65.056 2.229 14.026 1.00 0.00 N ATOM 0 H LYS A 82 67.584 1.764 9.078 1.00 0.00 H new ATOM 0 HA LYS A 82 65.046 2.342 8.010 1.00 0.00 H new ATOM 0 HB2 LYS A 82 64.741 1.184 9.913 1.00 0.00 H new ATOM 0 HB3 LYS A 82 66.290 1.672 10.572 1.00 0.00 H new ATOM 0 HG2 LYS A 82 64.094 3.711 10.575 1.00 0.00 H new ATOM 0 HG3 LYS A 82 63.952 2.368 11.691 1.00 0.00 H new ATOM 0 HD2 LYS A 82 66.499 4.008 11.476 1.00 0.00 H new ATOM 0 HD3 LYS A 82 65.178 4.486 12.524 1.00 0.00 H new ATOM 0 HE2 LYS A 82 66.599 1.795 12.640 1.00 0.00 H new ATOM 0 HE3 LYS A 82 66.937 3.148 13.700 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 65.462 1.899 14.925 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 64.415 3.028 14.208 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 64.525 1.454 13.581 1.00 0.00 H new ATOM 565 N GLU A 83 66.611 4.895 9.358 1.00 0.00 N ATOM 566 CA GLU A 83 66.596 6.348 9.472 1.00 0.00 C ATOM 567 C GLU A 83 66.633 7.000 8.090 1.00 0.00 C ATOM 568 O GLU A 83 65.969 8.008 7.850 1.00 0.00 O ATOM 569 CB GLU A 83 67.782 6.827 10.312 1.00 0.00 C ATOM 570 CG GLU A 83 67.382 7.706 11.486 1.00 0.00 C ATOM 571 CD GLU A 83 67.798 9.152 11.301 1.00 0.00 C ATOM 572 OE1 GLU A 83 67.684 9.662 10.166 1.00 0.00 O ATOM 573 OE2 GLU A 83 68.236 9.775 12.290 1.00 0.00 O ATOM 0 H GLU A 83 67.458 4.453 9.715 1.00 0.00 H new ATOM 0 HA GLU A 83 65.671 6.642 9.967 1.00 0.00 H new ATOM 0 HB2 GLU A 83 68.325 5.959 10.687 1.00 0.00 H new ATOM 0 HB3 GLU A 83 68.469 7.381 9.672 1.00 0.00 H new ATOM 0 HG2 GLU A 83 66.301 7.657 11.620 1.00 0.00 H new ATOM 0 HG3 GLU A 83 67.834 7.316 12.398 1.00 0.00 H new ATOM 580 N GLU A 84 67.414 6.413 7.189 1.00 0.00 N ATOM 581 CA GLU A 84 67.544 6.934 5.833 1.00 0.00 C ATOM 582 C GLU A 84 66.216 6.849 5.082 1.00 0.00 C ATOM 583 O GLU A 84 65.821 7.793 4.398 1.00 0.00 O ATOM 584 CB GLU A 84 68.625 6.163 5.073 1.00 0.00 C ATOM 585 CG GLU A 84 70.040 6.591 5.428 1.00 0.00 C ATOM 586 CD GLU A 84 71.020 6.363 4.294 1.00 0.00 C ATOM 587 OE1 GLU A 84 70.805 6.923 3.199 1.00 0.00 O ATOM 588 OE2 GLU A 84 72.005 5.622 4.501 1.00 0.00 O ATOM 0 H GLU A 84 67.967 5.576 7.374 1.00 0.00 H new ATOM 0 HA GLU A 84 67.832 7.983 5.900 1.00 0.00 H new ATOM 0 HB2 GLU A 84 68.514 5.099 5.279 1.00 0.00 H new ATOM 0 HB3 GLU A 84 68.471 6.298 4.002 1.00 0.00 H new ATOM 0 HG2 GLU A 84 70.040 7.648 5.696 1.00 0.00 H new ATOM 0 HG3 GLU A 84 70.373 6.039 6.307 1.00 0.00 H new ATOM 595 N ALA A 85 65.535 5.715 5.214 1.00 0.00 N ATOM 596 CA ALA A 85 64.253 5.514 4.547 1.00 0.00 C ATOM 597 C ALA A 85 63.240 6.566 4.982 1.00 0.00 C ATOM 598 O ALA A 85 62.509 7.118 4.159 1.00 0.00 O ATOM 599 CB ALA A 85 63.723 4.117 4.832 1.00 0.00 C ATOM 0 H ALA A 85 65.848 4.923 5.775 1.00 0.00 H new ATOM 0 HA ALA A 85 64.408 5.618 3.473 1.00 0.00 H new ATOM 0 HB1 ALA A 85 62.766 3.981 4.328 1.00 0.00 H new ATOM 0 HB2 ALA A 85 64.434 3.376 4.466 1.00 0.00 H new ATOM 0 HB3 ALA A 85 63.588 3.991 5.906 1.00 0.00 H new ATOM 605 N LEU A 86 63.207 6.842 6.279 1.00 0.00 N ATOM 606 CA LEU A 86 62.290 7.831 6.829 1.00 0.00 C ATOM 607 C LEU A 86 62.584 9.212 6.248 1.00 0.00 C ATOM 608 O LEU A 86 61.672 10.006 6.017 1.00 0.00 O ATOM 609 CB LEU A 86 62.406 7.850 8.362 1.00 0.00 C ATOM 610 CG LEU A 86 61.947 9.137 9.057 1.00 0.00 C ATOM 611 CD1 LEU A 86 60.432 9.187 9.142 1.00 0.00 C ATOM 612 CD2 LEU A 86 62.562 9.234 10.446 1.00 0.00 C ATOM 0 H LEU A 86 63.807 6.393 6.971 1.00 0.00 H new ATOM 0 HA LEU A 86 61.270 7.561 6.557 1.00 0.00 H new ATOM 0 HB2 LEU A 86 61.824 7.019 8.760 1.00 0.00 H new ATOM 0 HB3 LEU A 86 63.447 7.668 8.630 1.00 0.00 H new ATOM 0 HG LEU A 86 62.285 9.989 8.466 1.00 0.00 H new ATOM 0 HD11 LEU A 86 60.126 10.108 9.638 1.00 0.00 H new ATOM 0 HD12 LEU A 86 60.010 9.159 8.137 1.00 0.00 H new ATOM 0 HD13 LEU A 86 60.071 8.330 9.711 1.00 0.00 H new ATOM 0 HD21 LEU A 86 62.228 10.153 10.929 1.00 0.00 H new ATOM 0 HD22 LEU A 86 62.250 8.377 11.043 1.00 0.00 H new ATOM 0 HD23 LEU A 86 63.649 9.242 10.363 1.00 0.00 H new ATOM 624 N GLU A 87 63.862 9.490 6.016 1.00 0.00 N ATOM 625 CA GLU A 87 64.278 10.774 5.462 1.00 0.00 C ATOM 626 C GLU A 87 63.621 11.023 4.107 1.00 0.00 C ATOM 627 O GLU A 87 63.085 12.103 3.856 1.00 0.00 O ATOM 628 CB GLU A 87 65.798 10.823 5.320 1.00 0.00 C ATOM 629 CG GLU A 87 66.324 12.173 4.862 1.00 0.00 C ATOM 630 CD GLU A 87 66.756 13.053 6.019 1.00 0.00 C ATOM 631 OE1 GLU A 87 65.871 13.610 6.704 1.00 0.00 O ATOM 632 OE2 GLU A 87 67.977 13.187 6.239 1.00 0.00 O ATOM 0 H GLU A 87 64.628 8.843 6.203 1.00 0.00 H new ATOM 0 HA GLU A 87 63.958 11.557 6.149 1.00 0.00 H new ATOM 0 HB2 GLU A 87 66.252 10.572 6.279 1.00 0.00 H new ATOM 0 HB3 GLU A 87 66.113 10.060 4.608 1.00 0.00 H new ATOM 0 HG2 GLU A 87 67.169 12.021 4.191 1.00 0.00 H new ATOM 0 HG3 GLU A 87 65.551 12.685 4.290 1.00 0.00 H new ATOM 639 N LEU A 88 63.665 10.019 3.237 1.00 0.00 N ATOM 640 CA LEU A 88 63.075 10.132 1.909 1.00 0.00 C ATOM 641 C LEU A 88 61.552 10.146 1.989 1.00 0.00 C ATOM 642 O LEU A 88 60.899 11.026 1.430 1.00 0.00 O ATOM 643 CB LEU A 88 63.537 8.975 1.022 1.00 0.00 C ATOM 644 CG LEU A 88 65.045 8.718 1.024 1.00 0.00 C ATOM 645 CD1 LEU A 88 65.367 7.431 0.283 1.00 0.00 C ATOM 646 CD2 LEU A 88 65.785 9.894 0.404 1.00 0.00 C ATOM 0 H LEU A 88 64.103 9.118 3.428 1.00 0.00 H new ATOM 0 HA LEU A 88 63.408 11.073 1.471 1.00 0.00 H new ATOM 0 HB2 LEU A 88 63.029 8.066 1.343 1.00 0.00 H new ATOM 0 HB3 LEU A 88 63.219 9.173 -0.002 1.00 0.00 H new ATOM 0 HG LEU A 88 65.376 8.610 2.057 1.00 0.00 H new ATOM 0 HD11 LEU A 88 66.444 7.264 0.295 1.00 0.00 H new ATOM 0 HD12 LEU A 88 64.865 6.595 0.770 1.00 0.00 H new ATOM 0 HD13 LEU A 88 65.023 7.509 -0.748 1.00 0.00 H new ATOM 0 HD21 LEU A 88 66.857 9.695 0.413 1.00 0.00 H new ATOM 0 HD22 LEU A 88 65.451 10.033 -0.624 1.00 0.00 H new ATOM 0 HD23 LEU A 88 65.579 10.797 0.978 1.00 0.00 H new ATOM 658 N ILE A 89 60.994 9.162 2.688 1.00 0.00 N ATOM 659 CA ILE A 89 59.547 9.058 2.843 1.00 0.00 C ATOM 660 C ILE A 89 58.959 10.373 3.366 1.00 0.00 C ATOM 661 O ILE A 89 58.049 10.938 2.761 1.00 0.00 O ATOM 662 CB ILE A 89 59.178 7.865 3.774 1.00 0.00 C ATOM 663 CG1 ILE A 89 58.345 6.826 3.008 1.00 0.00 C ATOM 664 CG2 ILE A 89 58.446 8.316 5.035 1.00 0.00 C ATOM 665 CD1 ILE A 89 59.137 6.076 1.958 1.00 0.00 C ATOM 0 H ILE A 89 61.522 8.425 3.156 1.00 0.00 H new ATOM 0 HA ILE A 89 59.110 8.866 1.863 1.00 0.00 H new ATOM 0 HB ILE A 89 60.113 7.406 4.096 1.00 0.00 H new ATOM 0 HG12 ILE A 89 57.928 6.111 3.717 1.00 0.00 H new ATOM 0 HG13 ILE A 89 57.504 7.327 2.529 1.00 0.00 H new ATOM 0 HG21 ILE A 89 58.211 7.447 5.650 1.00 0.00 H new ATOM 0 HG22 ILE A 89 59.081 8.999 5.599 1.00 0.00 H new ATOM 0 HG23 ILE A 89 57.522 8.824 4.758 1.00 0.00 H new ATOM 0 HD11 ILE A 89 58.488 5.359 1.456 1.00 0.00 H new ATOM 0 HD12 ILE A 89 59.532 6.782 1.227 1.00 0.00 H new ATOM 0 HD13 ILE A 89 59.962 5.547 2.434 1.00 0.00 H new ATOM 677 N ASN A 90 59.492 10.861 4.483 1.00 0.00 N ATOM 678 CA ASN A 90 59.018 12.113 5.069 1.00 0.00 C ATOM 679 C ASN A 90 59.139 13.255 4.068 1.00 0.00 C ATOM 680 O ASN A 90 58.202 14.032 3.881 1.00 0.00 O ATOM 681 CB ASN A 90 59.811 12.441 6.336 1.00 0.00 C ATOM 682 CG ASN A 90 59.285 13.675 7.043 1.00 0.00 C ATOM 683 OD1 ASN A 90 58.184 14.147 6.758 1.00 0.00 O ATOM 684 ND2 ASN A 90 60.072 14.204 7.972 1.00 0.00 N ATOM 0 H ASN A 90 60.249 10.412 4.999 1.00 0.00 H new ATOM 0 HA ASN A 90 57.967 11.991 5.331 1.00 0.00 H new ATOM 0 HB2 ASN A 90 59.771 11.591 7.017 1.00 0.00 H new ATOM 0 HB3 ASN A 90 60.859 12.593 6.077 1.00 0.00 H new ATOM 0 HD21 ASN A 90 59.772 15.035 8.482 1.00 0.00 H new ATOM 0 HD22 ASN A 90 60.977 13.780 8.176 1.00 0.00 H new ATOM 691 N GLY A 91 60.295 13.346 3.416 1.00 0.00 N ATOM 692 CA GLY A 91 60.506 14.393 2.433 1.00 0.00 C ATOM 693 C GLY A 91 59.477 14.342 1.322 1.00 0.00 C ATOM 694 O GLY A 91 59.030 15.376 0.829 1.00 0.00 O ATOM 0 H GLY A 91 61.086 12.716 3.550 1.00 0.00 H new ATOM 0 HA2 GLY A 91 60.462 15.365 2.924 1.00 0.00 H new ATOM 0 HA3 GLY A 91 61.505 14.295 2.007 1.00 0.00 H new ATOM 698 N TYR A 92 59.095 13.128 0.940 1.00 0.00 N ATOM 699 CA TYR A 92 58.104 12.930 -0.111 1.00 0.00 C ATOM 700 C TYR A 92 56.761 13.524 0.303 1.00 0.00 C ATOM 701 O TYR A 92 56.060 14.132 -0.507 1.00 0.00 O ATOM 702 CB TYR A 92 57.942 11.437 -0.410 1.00 0.00 C ATOM 703 CG TYR A 92 59.167 10.794 -1.027 1.00 0.00 C ATOM 704 CD1 TYR A 92 60.001 11.506 -1.884 1.00 0.00 C ATOM 705 CD2 TYR A 92 59.490 9.471 -0.752 1.00 0.00 C ATOM 706 CE1 TYR A 92 61.117 10.916 -2.445 1.00 0.00 C ATOM 707 CE2 TYR A 92 60.604 8.875 -1.310 1.00 0.00 C ATOM 708 CZ TYR A 92 61.414 9.602 -2.155 1.00 0.00 C ATOM 709 OH TYR A 92 62.528 9.012 -2.708 1.00 0.00 O ATOM 0 H TYR A 92 59.458 12.264 1.344 1.00 0.00 H new ATOM 0 HA TYR A 92 58.450 13.438 -1.011 1.00 0.00 H new ATOM 0 HB2 TYR A 92 57.699 10.916 0.516 1.00 0.00 H new ATOM 0 HB3 TYR A 92 57.096 11.302 -1.083 1.00 0.00 H new ATOM 0 HD1 TYR A 92 59.772 12.536 -2.114 1.00 0.00 H new ATOM 0 HD2 TYR A 92 58.858 8.898 -0.090 1.00 0.00 H new ATOM 0 HE1 TYR A 92 61.754 11.482 -3.108 1.00 0.00 H new ATOM 0 HE2 TYR A 92 60.839 7.845 -1.085 1.00 0.00 H new ATOM 0 HH TYR A 92 62.503 9.115 -3.682 1.00 0.00 H new ATOM 719 N ILE A 93 56.414 13.343 1.572 1.00 0.00 N ATOM 720 CA ILE A 93 55.159 13.856 2.107 1.00 0.00 C ATOM 721 C ILE A 93 55.150 15.385 2.103 1.00 0.00 C ATOM 722 O ILE A 93 54.100 16.009 1.945 1.00 0.00 O ATOM 723 CB ILE A 93 54.912 13.326 3.544 1.00 0.00 C ATOM 724 CG1 ILE A 93 54.119 12.018 3.488 1.00 0.00 C ATOM 725 CG2 ILE A 93 54.175 14.351 4.400 1.00 0.00 C ATOM 726 CD1 ILE A 93 54.107 11.262 4.798 1.00 0.00 C ATOM 0 H ILE A 93 56.987 12.843 2.252 1.00 0.00 H new ATOM 0 HA ILE A 93 54.354 13.502 1.463 1.00 0.00 H new ATOM 0 HB ILE A 93 55.882 13.143 4.007 1.00 0.00 H new ATOM 0 HG12 ILE A 93 53.092 12.237 3.195 1.00 0.00 H new ATOM 0 HG13 ILE A 93 54.542 11.379 2.713 1.00 0.00 H new ATOM 0 HG21 ILE A 93 54.019 13.946 5.400 1.00 0.00 H new ATOM 0 HG22 ILE A 93 54.768 15.263 4.467 1.00 0.00 H new ATOM 0 HG23 ILE A 93 53.210 14.578 3.946 1.00 0.00 H new ATOM 0 HD11 ILE A 93 53.527 10.346 4.684 1.00 0.00 H new ATOM 0 HD12 ILE A 93 55.129 11.011 5.083 1.00 0.00 H new ATOM 0 HD13 ILE A 93 53.657 11.883 5.572 1.00 0.00 H new ATOM 738 N GLN A 94 56.323 15.981 2.283 1.00 0.00 N ATOM 739 CA GLN A 94 56.448 17.433 2.304 1.00 0.00 C ATOM 740 C GLN A 94 56.109 18.040 0.946 1.00 0.00 C ATOM 741 O GLN A 94 55.249 18.915 0.843 1.00 0.00 O ATOM 742 CB GLN A 94 57.866 17.835 2.716 1.00 0.00 C ATOM 743 CG GLN A 94 58.000 19.304 3.082 1.00 0.00 C ATOM 744 CD GLN A 94 59.324 19.895 2.640 1.00 0.00 C ATOM 745 OE1 GLN A 94 59.582 20.046 1.446 1.00 0.00 O ATOM 746 NE2 GLN A 94 60.173 20.232 3.605 1.00 0.00 N ATOM 0 H GLN A 94 57.202 15.480 2.417 1.00 0.00 H new ATOM 0 HA GLN A 94 55.737 17.819 3.034 1.00 0.00 H new ATOM 0 HB2 GLN A 94 58.174 17.228 3.567 1.00 0.00 H new ATOM 0 HB3 GLN A 94 58.551 17.609 1.899 1.00 0.00 H new ATOM 0 HG2 GLN A 94 57.185 19.865 2.624 1.00 0.00 H new ATOM 0 HG3 GLN A 94 57.898 19.417 4.161 1.00 0.00 H new ATOM 0 HE21 GLN A 94 59.917 20.089 4.582 1.00 0.00 H new ATOM 0 HE22 GLN A 94 61.080 20.634 3.369 1.00 0.00 H new ATOM 755 N LYS A 95 56.795 17.577 -0.094 1.00 0.00 N ATOM 756 CA LYS A 95 56.573 18.083 -1.451 1.00 0.00 C ATOM 757 C LYS A 95 55.101 17.977 -1.848 1.00 0.00 C ATOM 758 O LYS A 95 54.491 18.959 -2.280 1.00 0.00 O ATOM 759 CB LYS A 95 57.432 17.320 -2.471 1.00 0.00 C ATOM 760 CG LYS A 95 58.783 16.859 -1.943 1.00 0.00 C ATOM 761 CD LYS A 95 59.539 17.989 -1.260 1.00 0.00 C ATOM 762 CE LYS A 95 60.110 18.971 -2.269 1.00 0.00 C ATOM 763 NZ LYS A 95 60.709 18.278 -3.444 1.00 0.00 N ATOM 0 H LYS A 95 57.510 16.853 -0.027 1.00 0.00 H new ATOM 0 HA LYS A 95 56.864 19.133 -1.454 1.00 0.00 H new ATOM 0 HB2 LYS A 95 56.875 16.449 -2.816 1.00 0.00 H new ATOM 0 HB3 LYS A 95 57.595 17.959 -3.339 1.00 0.00 H new ATOM 0 HG2 LYS A 95 58.637 16.041 -1.238 1.00 0.00 H new ATOM 0 HG3 LYS A 95 59.381 16.468 -2.766 1.00 0.00 H new ATOM 0 HD2 LYS A 95 58.870 18.515 -0.578 1.00 0.00 H new ATOM 0 HD3 LYS A 95 60.347 17.575 -0.657 1.00 0.00 H new ATOM 0 HE2 LYS A 95 59.321 19.643 -2.608 1.00 0.00 H new ATOM 0 HE3 LYS A 95 60.868 19.587 -1.786 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 61.369 18.921 -3.927 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 61.222 17.432 -3.124 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 59.955 17.997 -4.103 1.00 0.00 H new ATOM 777 N ILE A 96 54.544 16.781 -1.709 1.00 0.00 N ATOM 778 CA ILE A 96 53.150 16.538 -2.063 1.00 0.00 C ATOM 779 C ILE A 96 52.207 17.482 -1.323 1.00 0.00 C ATOM 780 O ILE A 96 51.371 18.145 -1.937 1.00 0.00 O ATOM 781 CB ILE A 96 52.749 15.080 -1.767 1.00 0.00 C ATOM 782 CG1 ILE A 96 53.673 14.120 -2.515 1.00 0.00 C ATOM 783 CG2 ILE A 96 51.297 14.833 -2.153 1.00 0.00 C ATOM 784 CD1 ILE A 96 53.713 12.731 -1.918 1.00 0.00 C ATOM 0 H ILE A 96 55.037 15.962 -1.353 1.00 0.00 H new ATOM 0 HA ILE A 96 53.060 16.725 -3.133 1.00 0.00 H new ATOM 0 HB ILE A 96 52.851 14.902 -0.696 1.00 0.00 H new ATOM 0 HG12 ILE A 96 53.348 14.051 -3.553 1.00 0.00 H new ATOM 0 HG13 ILE A 96 54.682 14.532 -2.523 1.00 0.00 H new ATOM 0 HG21 ILE A 96 51.034 13.798 -1.936 1.00 0.00 H new ATOM 0 HG22 ILE A 96 50.650 15.499 -1.582 1.00 0.00 H new ATOM 0 HG23 ILE A 96 51.166 15.025 -3.218 1.00 0.00 H new ATOM 0 HD11 ILE A 96 54.389 12.104 -2.500 1.00 0.00 H new ATOM 0 HD12 ILE A 96 54.067 12.787 -0.889 1.00 0.00 H new ATOM 0 HD13 ILE A 96 52.712 12.299 -1.935 1.00 0.00 H new ATOM 796 N LYS A 97 52.336 17.533 -0.002 1.00 0.00 N ATOM 797 CA LYS A 97 51.484 18.389 0.815 1.00 0.00 C ATOM 798 C LYS A 97 51.786 19.869 0.584 1.00 0.00 C ATOM 799 O LYS A 97 50.957 20.729 0.878 1.00 0.00 O ATOM 800 CB LYS A 97 51.648 18.047 2.297 1.00 0.00 C ATOM 801 CG LYS A 97 50.656 17.008 2.798 1.00 0.00 C ATOM 802 CD LYS A 97 49.221 17.417 2.503 1.00 0.00 C ATOM 803 CE LYS A 97 48.292 17.065 3.653 1.00 0.00 C ATOM 804 NZ LYS A 97 46.971 17.742 3.527 1.00 0.00 N ATOM 0 H LYS A 97 53.021 16.992 0.525 1.00 0.00 H new ATOM 0 HA LYS A 97 50.452 18.206 0.516 1.00 0.00 H new ATOM 0 HB2 LYS A 97 52.661 17.681 2.466 1.00 0.00 H new ATOM 0 HB3 LYS A 97 51.535 18.957 2.886 1.00 0.00 H new ATOM 0 HG2 LYS A 97 50.865 16.047 2.327 1.00 0.00 H new ATOM 0 HG3 LYS A 97 50.783 16.871 3.872 1.00 0.00 H new ATOM 0 HD2 LYS A 97 49.179 18.490 2.316 1.00 0.00 H new ATOM 0 HD3 LYS A 97 48.880 16.921 1.594 1.00 0.00 H new ATOM 0 HE2 LYS A 97 48.145 15.985 3.684 1.00 0.00 H new ATOM 0 HE3 LYS A 97 48.758 17.350 4.596 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 46.367 17.476 4.330 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 47.108 18.773 3.523 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 46.515 17.450 2.639 1.00 0.00 H new ATOM 818 N SER A 98 52.970 20.165 0.054 1.00 0.00 N ATOM 819 CA SER A 98 53.355 21.548 -0.211 1.00 0.00 C ATOM 820 C SER A 98 52.803 22.024 -1.550 1.00 0.00 C ATOM 821 O SER A 98 52.730 23.225 -1.809 1.00 0.00 O ATOM 822 CB SER A 98 54.877 21.696 -0.193 1.00 0.00 C ATOM 823 OG SER A 98 55.445 21.260 -1.416 1.00 0.00 O ATOM 0 H SER A 98 53.674 19.472 -0.199 1.00 0.00 H new ATOM 0 HA SER A 98 52.929 22.168 0.578 1.00 0.00 H new ATOM 0 HB2 SER A 98 55.142 22.738 -0.016 1.00 0.00 H new ATOM 0 HB3 SER A 98 55.292 21.117 0.632 1.00 0.00 H new ATOM 0 HG SER A 98 55.538 22.023 -2.024 1.00 0.00 H new ATOM 829 N GLY A 99 52.425 21.077 -2.404 1.00 0.00 N ATOM 830 CA GLY A 99 51.897 21.425 -3.708 1.00 0.00 C ATOM 831 C GLY A 99 52.976 21.476 -4.774 1.00 0.00 C ATOM 832 O GLY A 99 52.694 21.772 -5.935 1.00 0.00 O ATOM 0 H GLY A 99 52.476 20.076 -2.215 1.00 0.00 H new ATOM 0 HA2 GLY A 99 51.139 20.697 -3.996 1.00 0.00 H new ATOM 0 HA3 GLY A 99 51.402 22.394 -3.650 1.00 0.00 H new ATOM 836 N GLU A 100 54.214 21.184 -4.379 1.00 0.00 N ATOM 837 CA GLU A 100 55.334 21.197 -5.310 1.00 0.00 C ATOM 838 C GLU A 100 55.344 19.931 -6.159 1.00 0.00 C ATOM 839 O GLU A 100 55.681 19.968 -7.342 1.00 0.00 O ATOM 840 CB GLU A 100 56.656 21.327 -4.549 1.00 0.00 C ATOM 841 CG GLU A 100 57.161 22.757 -4.447 1.00 0.00 C ATOM 842 CD GLU A 100 56.204 23.664 -3.698 1.00 0.00 C ATOM 843 OE1 GLU A 100 55.278 23.140 -3.042 1.00 0.00 O ATOM 844 OE2 GLU A 100 56.378 24.898 -3.767 1.00 0.00 O ATOM 0 H GLU A 100 54.464 20.936 -3.422 1.00 0.00 H new ATOM 0 HA GLU A 100 55.219 22.057 -5.970 1.00 0.00 H new ATOM 0 HB2 GLU A 100 56.529 20.923 -3.545 1.00 0.00 H new ATOM 0 HB3 GLU A 100 57.412 20.718 -5.044 1.00 0.00 H new ATOM 0 HG2 GLU A 100 58.128 22.761 -3.944 1.00 0.00 H new ATOM 0 HG3 GLU A 100 57.321 23.154 -5.450 1.00 0.00 H new ATOM 851 N GLU A 101 54.971 18.810 -5.548 1.00 0.00 N ATOM 852 CA GLU A 101 54.940 17.536 -6.256 1.00 0.00 C ATOM 853 C GLU A 101 53.609 16.821 -6.043 1.00 0.00 C ATOM 854 O GLU A 101 52.778 17.253 -5.244 1.00 0.00 O ATOM 855 CB GLU A 101 56.090 16.642 -5.789 1.00 0.00 C ATOM 856 CG GLU A 101 57.465 17.242 -6.038 1.00 0.00 C ATOM 857 CD GLU A 101 58.128 16.684 -7.282 1.00 0.00 C ATOM 858 OE1 GLU A 101 57.416 16.459 -8.284 1.00 0.00 O ATOM 859 OE2 GLU A 101 59.358 16.474 -7.255 1.00 0.00 O ATOM 0 H GLU A 101 54.688 18.759 -4.570 1.00 0.00 H new ATOM 0 HA GLU A 101 55.054 17.741 -7.321 1.00 0.00 H new ATOM 0 HB2 GLU A 101 55.976 16.444 -4.723 1.00 0.00 H new ATOM 0 HB3 GLU A 101 56.024 15.682 -6.300 1.00 0.00 H new ATOM 0 HG2 GLU A 101 57.373 18.324 -6.134 1.00 0.00 H new ATOM 0 HG3 GLU A 101 58.102 17.051 -5.175 1.00 0.00 H new ATOM 866 N ASP A 102 53.418 15.719 -6.764 1.00 0.00 N ATOM 867 CA ASP A 102 52.194 14.933 -6.658 1.00 0.00 C ATOM 868 C ASP A 102 52.510 13.517 -6.197 1.00 0.00 C ATOM 869 O ASP A 102 53.466 12.903 -6.666 1.00 0.00 O ATOM 870 CB ASP A 102 51.458 14.900 -8.001 1.00 0.00 C ATOM 871 CG ASP A 102 52.395 14.695 -9.176 1.00 0.00 C ATOM 872 OD1 ASP A 102 53.586 14.396 -8.943 1.00 0.00 O ATOM 873 OD2 ASP A 102 51.939 14.836 -10.330 1.00 0.00 O ATOM 0 H ASP A 102 54.098 15.350 -7.429 1.00 0.00 H new ATOM 0 HA ASP A 102 51.547 15.405 -5.919 1.00 0.00 H new ATOM 0 HB2 ASP A 102 50.719 14.099 -7.986 1.00 0.00 H new ATOM 0 HB3 ASP A 102 50.912 15.834 -8.135 1.00 0.00 H new ATOM 878 N PHE A 103 51.707 13.000 -5.271 1.00 0.00 N ATOM 879 CA PHE A 103 51.913 11.661 -4.745 1.00 0.00 C ATOM 880 C PHE A 103 51.953 10.631 -5.870 1.00 0.00 C ATOM 881 O PHE A 103 52.782 9.722 -5.863 1.00 0.00 O ATOM 882 CB PHE A 103 50.803 11.317 -3.756 1.00 0.00 C ATOM 883 CG PHE A 103 51.164 10.199 -2.822 1.00 0.00 C ATOM 884 CD1 PHE A 103 51.458 8.934 -3.307 1.00 0.00 C ATOM 885 CD2 PHE A 103 51.224 10.419 -1.458 1.00 0.00 C ATOM 886 CE1 PHE A 103 51.807 7.910 -2.444 1.00 0.00 C ATOM 887 CE2 PHE A 103 51.567 9.402 -0.590 1.00 0.00 C ATOM 888 CZ PHE A 103 51.862 8.145 -1.083 1.00 0.00 C ATOM 0 H PHE A 103 50.908 13.492 -4.871 1.00 0.00 H new ATOM 0 HA PHE A 103 52.874 11.637 -4.231 1.00 0.00 H new ATOM 0 HB2 PHE A 103 50.559 12.204 -3.172 1.00 0.00 H new ATOM 0 HB3 PHE A 103 49.905 11.043 -4.310 1.00 0.00 H new ATOM 0 HD1 PHE A 103 51.414 8.746 -4.370 1.00 0.00 H new ATOM 0 HD2 PHE A 103 50.999 11.400 -1.066 1.00 0.00 H new ATOM 0 HE1 PHE A 103 52.036 6.929 -2.833 1.00 0.00 H new ATOM 0 HE2 PHE A 103 51.605 9.588 0.473 1.00 0.00 H new ATOM 0 HZ PHE A 103 52.135 7.348 -0.407 1.00 0.00 H new ATOM 898 N GLU A 104 51.054 10.784 -6.834 1.00 0.00 N ATOM 899 CA GLU A 104 50.989 9.871 -7.968 1.00 0.00 C ATOM 900 C GLU A 104 52.319 9.835 -8.714 1.00 0.00 C ATOM 901 O GLU A 104 52.985 8.800 -8.766 1.00 0.00 O ATOM 902 CB GLU A 104 49.867 10.289 -8.920 1.00 0.00 C ATOM 903 CG GLU A 104 48.533 9.623 -8.619 1.00 0.00 C ATOM 904 CD GLU A 104 48.004 8.816 -9.790 1.00 0.00 C ATOM 905 OE1 GLU A 104 48.799 8.077 -10.409 1.00 0.00 O ATOM 906 OE2 GLU A 104 46.796 8.923 -10.087 1.00 0.00 O ATOM 0 H GLU A 104 50.360 11.531 -6.853 1.00 0.00 H new ATOM 0 HA GLU A 104 50.780 8.871 -7.588 1.00 0.00 H new ATOM 0 HB2 GLU A 104 49.743 11.371 -8.869 1.00 0.00 H new ATOM 0 HB3 GLU A 104 50.161 10.049 -9.942 1.00 0.00 H new ATOM 0 HG2 GLU A 104 48.645 8.970 -7.754 1.00 0.00 H new ATOM 0 HG3 GLU A 104 47.803 10.386 -8.350 1.00 0.00 H new ATOM 913 N SER A 105 52.705 10.969 -9.285 1.00 0.00 N ATOM 914 CA SER A 105 53.954 11.057 -10.029 1.00 0.00 C ATOM 915 C SER A 105 55.148 10.859 -9.104 1.00 0.00 C ATOM 916 O SER A 105 56.191 10.359 -9.524 1.00 0.00 O ATOM 917 CB SER A 105 54.058 12.405 -10.745 1.00 0.00 C ATOM 918 OG SER A 105 54.477 12.239 -12.088 1.00 0.00 O ATOM 0 H SER A 105 52.172 11.838 -9.247 1.00 0.00 H new ATOM 0 HA SER A 105 53.961 10.263 -10.776 1.00 0.00 H new ATOM 0 HB2 SER A 105 53.091 12.908 -10.722 1.00 0.00 H new ATOM 0 HB3 SER A 105 54.764 13.047 -10.217 1.00 0.00 H new ATOM 0 HG SER A 105 54.534 13.115 -12.524 1.00 0.00 H new ATOM 924 N LEU A 106 54.992 11.243 -7.840 1.00 0.00 N ATOM 925 CA LEU A 106 56.067 11.087 -6.872 1.00 0.00 C ATOM 926 C LEU A 106 56.371 9.608 -6.653 1.00 0.00 C ATOM 927 O LEU A 106 57.454 9.129 -7.003 1.00 0.00 O ATOM 928 CB LEU A 106 55.692 11.753 -5.544 1.00 0.00 C ATOM 929 CG LEU A 106 56.790 11.753 -4.481 1.00 0.00 C ATOM 930 CD1 LEU A 106 56.778 13.058 -3.701 1.00 0.00 C ATOM 931 CD2 LEU A 106 56.624 10.569 -3.543 1.00 0.00 C ATOM 0 H LEU A 106 54.139 11.660 -7.467 1.00 0.00 H new ATOM 0 HA LEU A 106 56.960 11.574 -7.265 1.00 0.00 H new ATOM 0 HB2 LEU A 106 55.402 12.785 -5.743 1.00 0.00 H new ATOM 0 HB3 LEU A 106 54.816 11.248 -5.138 1.00 0.00 H new ATOM 0 HG LEU A 106 57.754 11.662 -4.982 1.00 0.00 H new ATOM 0 HD11 LEU A 106 57.567 13.040 -2.949 1.00 0.00 H new ATOM 0 HD12 LEU A 106 56.947 13.891 -4.383 1.00 0.00 H new ATOM 0 HD13 LEU A 106 55.812 13.180 -3.211 1.00 0.00 H new ATOM 0 HD21 LEU A 106 57.415 10.585 -2.793 1.00 0.00 H new ATOM 0 HD22 LEU A 106 55.654 10.629 -3.049 1.00 0.00 H new ATOM 0 HD23 LEU A 106 56.684 9.642 -4.113 1.00 0.00 H new ATOM 943 N ALA A 107 55.399 8.878 -6.095 1.00 0.00 N ATOM 944 CA ALA A 107 55.558 7.444 -5.843 1.00 0.00 C ATOM 945 C ALA A 107 56.216 6.756 -7.017 1.00 0.00 C ATOM 946 O ALA A 107 57.183 6.028 -6.852 1.00 0.00 O ATOM 947 CB ALA A 107 54.215 6.789 -5.552 1.00 0.00 C ATOM 0 H ALA A 107 54.496 9.257 -5.810 1.00 0.00 H new ATOM 0 HA ALA A 107 56.199 7.336 -4.968 1.00 0.00 H new ATOM 0 HB1 ALA A 107 54.361 5.725 -5.369 1.00 0.00 H new ATOM 0 HB2 ALA A 107 53.768 7.251 -4.672 1.00 0.00 H new ATOM 0 HB3 ALA A 107 53.552 6.922 -6.407 1.00 0.00 H new ATOM 953 N SER A 108 55.692 6.991 -8.205 1.00 0.00 N ATOM 954 CA SER A 108 56.246 6.384 -9.399 1.00 0.00 C ATOM 955 C SER A 108 57.757 6.611 -9.491 1.00 0.00 C ATOM 956 O SER A 108 58.531 5.659 -9.613 1.00 0.00 O ATOM 957 CB SER A 108 55.561 6.948 -10.644 1.00 0.00 C ATOM 958 OG SER A 108 55.912 6.205 -11.801 1.00 0.00 O ATOM 0 H SER A 108 54.887 7.595 -8.368 1.00 0.00 H new ATOM 0 HA SER A 108 56.066 5.311 -9.341 1.00 0.00 H new ATOM 0 HB2 SER A 108 54.480 6.927 -10.509 1.00 0.00 H new ATOM 0 HB3 SER A 108 55.845 7.992 -10.778 1.00 0.00 H new ATOM 0 HG SER A 108 55.593 6.674 -12.600 1.00 0.00 H new ATOM 964 N GLN A 109 58.166 7.877 -9.434 1.00 0.00 N ATOM 965 CA GLN A 109 59.580 8.243 -9.545 1.00 0.00 C ATOM 966 C GLN A 109 60.407 7.779 -8.355 1.00 0.00 C ATOM 967 O GLN A 109 61.636 7.853 -8.387 1.00 0.00 O ATOM 968 CB GLN A 109 59.714 9.757 -9.695 1.00 0.00 C ATOM 969 CG GLN A 109 59.113 10.298 -10.982 1.00 0.00 C ATOM 970 CD GLN A 109 59.806 11.555 -11.468 1.00 0.00 C ATOM 971 OE1 GLN A 109 60.091 11.702 -12.657 1.00 0.00 O ATOM 972 NE2 GLN A 109 60.083 12.472 -10.547 1.00 0.00 N ATOM 0 H GLN A 109 57.537 8.670 -9.311 1.00 0.00 H new ATOM 0 HA GLN A 109 59.968 7.736 -10.428 1.00 0.00 H new ATOM 0 HB2 GLN A 109 59.231 10.242 -8.847 1.00 0.00 H new ATOM 0 HB3 GLN A 109 60.770 10.025 -9.656 1.00 0.00 H new ATOM 0 HG2 GLN A 109 59.173 9.533 -11.756 1.00 0.00 H new ATOM 0 HG3 GLN A 109 58.055 10.509 -10.824 1.00 0.00 H new ATOM 0 HE21 GLN A 109 59.829 12.309 -9.573 1.00 0.00 H new ATOM 0 HE22 GLN A 109 60.550 13.339 -10.814 1.00 0.00 H new ATOM 981 N PHE A 110 59.752 7.304 -7.310 1.00 0.00 N ATOM 982 CA PHE A 110 60.467 6.839 -6.130 1.00 0.00 C ATOM 983 C PHE A 110 59.931 5.498 -5.638 1.00 0.00 C ATOM 984 O PHE A 110 60.354 5.004 -4.592 1.00 0.00 O ATOM 985 CB PHE A 110 60.393 7.891 -5.024 1.00 0.00 C ATOM 986 CG PHE A 110 60.730 9.274 -5.504 1.00 0.00 C ATOM 987 CD1 PHE A 110 61.990 9.559 -6.006 1.00 0.00 C ATOM 988 CD2 PHE A 110 59.787 10.288 -5.457 1.00 0.00 C ATOM 989 CE1 PHE A 110 62.303 10.829 -6.452 1.00 0.00 C ATOM 990 CE2 PHE A 110 60.095 11.561 -5.901 1.00 0.00 C ATOM 991 CZ PHE A 110 61.355 11.832 -6.399 1.00 0.00 C ATOM 0 H PHE A 110 58.736 7.230 -7.252 1.00 0.00 H new ATOM 0 HA PHE A 110 61.511 6.688 -6.406 1.00 0.00 H new ATOM 0 HB2 PHE A 110 59.389 7.894 -4.600 1.00 0.00 H new ATOM 0 HB3 PHE A 110 61.077 7.615 -4.221 1.00 0.00 H new ATOM 0 HD1 PHE A 110 62.736 8.779 -6.049 1.00 0.00 H new ATOM 0 HD2 PHE A 110 58.800 10.082 -5.069 1.00 0.00 H new ATOM 0 HE1 PHE A 110 63.288 11.037 -6.842 1.00 0.00 H new ATOM 0 HE2 PHE A 110 59.351 12.343 -5.859 1.00 0.00 H new ATOM 0 HZ PHE A 110 61.598 12.826 -6.746 1.00 0.00 H new ATOM 1001 N SER A 111 58.997 4.911 -6.383 1.00 0.00 N ATOM 1002 CA SER A 111 58.419 3.630 -5.989 1.00 0.00 C ATOM 1003 C SER A 111 59.395 2.490 -6.248 1.00 0.00 C ATOM 1004 O SER A 111 59.520 2.013 -7.375 1.00 0.00 O ATOM 1005 CB SER A 111 57.113 3.374 -6.746 1.00 0.00 C ATOM 1006 OG SER A 111 57.194 3.841 -8.081 1.00 0.00 O ATOM 0 H SER A 111 58.628 5.297 -7.252 1.00 0.00 H new ATOM 0 HA SER A 111 58.209 3.674 -4.920 1.00 0.00 H new ATOM 0 HB2 SER A 111 56.892 2.307 -6.744 1.00 0.00 H new ATOM 0 HB3 SER A 111 56.289 3.871 -6.234 1.00 0.00 H new ATOM 0 HG SER A 111 58.119 3.768 -8.397 1.00 0.00 H new ATOM 1012 N ASP A 112 60.077 2.043 -5.196 1.00 0.00 N ATOM 1013 CA ASP A 112 61.027 0.946 -5.322 1.00 0.00 C ATOM 1014 C ASP A 112 60.298 -0.342 -5.681 1.00 0.00 C ATOM 1015 O ASP A 112 60.856 -1.226 -6.330 1.00 0.00 O ATOM 1016 CB ASP A 112 61.809 0.764 -4.020 1.00 0.00 C ATOM 1017 CG ASP A 112 63.116 1.532 -4.018 1.00 0.00 C ATOM 1018 OD1 ASP A 112 63.626 1.837 -5.116 1.00 0.00 O ATOM 1019 OD2 ASP A 112 63.628 1.830 -2.919 1.00 0.00 O ATOM 0 H ASP A 112 59.989 2.422 -4.253 1.00 0.00 H new ATOM 0 HA ASP A 112 61.731 1.186 -6.119 1.00 0.00 H new ATOM 0 HB2 ASP A 112 61.195 1.094 -3.182 1.00 0.00 H new ATOM 0 HB3 ASP A 112 62.013 -0.296 -3.867 1.00 0.00 H new ATOM 1024 N CYS A 113 59.041 -0.434 -5.258 1.00 0.00 N ATOM 1025 CA CYS A 113 58.222 -1.605 -5.537 1.00 0.00 C ATOM 1026 C CYS A 113 57.609 -1.513 -6.930 1.00 0.00 C ATOM 1027 O CYS A 113 57.544 -0.433 -7.522 1.00 0.00 O ATOM 1028 CB CYS A 113 57.118 -1.738 -4.486 1.00 0.00 C ATOM 1029 SG CYS A 113 56.502 -3.424 -4.272 1.00 0.00 S ATOM 0 H CYS A 113 58.568 0.291 -4.719 1.00 0.00 H new ATOM 0 HA CYS A 113 58.859 -2.488 -5.497 1.00 0.00 H new ATOM 0 HB2 CYS A 113 57.496 -1.377 -3.530 1.00 0.00 H new ATOM 0 HB3 CYS A 113 56.286 -1.091 -4.765 1.00 0.00 H new ATOM 0 HG CYS A 113 55.574 -3.435 -3.362 1.00 0.00 H new ATOM 1035 N SER A 114 57.156 -2.648 -7.450 1.00 0.00 N ATOM 1036 CA SER A 114 56.548 -2.692 -8.775 1.00 0.00 C ATOM 1037 C SER A 114 55.254 -1.877 -8.833 1.00 0.00 C ATOM 1038 O SER A 114 54.612 -1.801 -9.877 1.00 0.00 O ATOM 1039 CB SER A 114 56.267 -4.140 -9.177 1.00 0.00 C ATOM 1040 OG SER A 114 55.118 -4.642 -8.517 1.00 0.00 O ATOM 0 H SER A 114 57.198 -3.550 -6.975 1.00 0.00 H new ATOM 0 HA SER A 114 57.255 -2.248 -9.476 1.00 0.00 H new ATOM 0 HB2 SER A 114 56.125 -4.199 -10.256 1.00 0.00 H new ATOM 0 HB3 SER A 114 57.129 -4.761 -8.935 1.00 0.00 H new ATOM 0 HG SER A 114 54.961 -5.569 -8.794 1.00 0.00 H new ATOM 1046 N SER A 115 54.875 -1.259 -7.718 1.00 0.00 N ATOM 1047 CA SER A 115 53.661 -0.453 -7.672 1.00 0.00 C ATOM 1048 C SER A 115 53.758 0.712 -8.650 1.00 0.00 C ATOM 1049 O SER A 115 52.745 1.254 -9.093 1.00 0.00 O ATOM 1050 CB SER A 115 53.422 0.071 -6.254 1.00 0.00 C ATOM 1051 OG SER A 115 52.545 -0.779 -5.537 1.00 0.00 O ATOM 0 H SER A 115 55.389 -1.301 -6.838 1.00 0.00 H new ATOM 0 HA SER A 115 52.819 -1.083 -7.960 1.00 0.00 H new ATOM 0 HB2 SER A 115 54.373 0.147 -5.726 1.00 0.00 H new ATOM 0 HB3 SER A 115 53.002 1.076 -6.300 1.00 0.00 H new ATOM 0 HG SER A 115 52.410 -0.423 -4.634 1.00 0.00 H new ATOM 1057 N ALA A 116 54.988 1.098 -8.970 1.00 0.00 N ATOM 1058 CA ALA A 116 55.239 2.201 -9.884 1.00 0.00 C ATOM 1059 C ALA A 116 54.355 2.152 -11.133 1.00 0.00 C ATOM 1060 O ALA A 116 53.992 3.199 -11.671 1.00 0.00 O ATOM 1061 CB ALA A 116 56.699 2.224 -10.286 1.00 0.00 C ATOM 0 H ALA A 116 55.832 0.657 -8.605 1.00 0.00 H new ATOM 0 HA ALA A 116 54.986 3.117 -9.349 1.00 0.00 H new ATOM 0 HB1 ALA A 116 56.875 3.054 -10.970 1.00 0.00 H new ATOM 0 HB2 ALA A 116 57.319 2.348 -9.398 1.00 0.00 H new ATOM 0 HB3 ALA A 116 56.955 1.286 -10.779 1.00 0.00 H new ATOM 1067 N LYS A 117 54.005 0.950 -11.607 1.00 0.00 N ATOM 1068 CA LYS A 117 53.161 0.846 -12.807 1.00 0.00 C ATOM 1069 C LYS A 117 51.870 1.633 -12.616 1.00 0.00 C ATOM 1070 O LYS A 117 51.318 2.184 -13.568 1.00 0.00 O ATOM 1071 CB LYS A 117 52.836 -0.607 -13.196 1.00 0.00 C ATOM 1072 CG LYS A 117 53.051 -1.635 -12.100 1.00 0.00 C ATOM 1073 CD LYS A 117 52.115 -1.408 -10.924 1.00 0.00 C ATOM 1074 CE LYS A 117 51.648 -2.724 -10.323 1.00 0.00 C ATOM 1075 NZ LYS A 117 51.121 -3.654 -11.362 1.00 0.00 N ATOM 0 H LYS A 117 54.282 0.059 -11.194 1.00 0.00 H new ATOM 0 HA LYS A 117 53.738 1.272 -13.628 1.00 0.00 H new ATOM 0 HB2 LYS A 117 51.796 -0.656 -13.518 1.00 0.00 H new ATOM 0 HB3 LYS A 117 53.449 -0.882 -14.055 1.00 0.00 H new ATOM 0 HG2 LYS A 117 52.893 -2.635 -12.503 1.00 0.00 H new ATOM 0 HG3 LYS A 117 54.084 -1.590 -11.756 1.00 0.00 H new ATOM 0 HD2 LYS A 117 52.623 -0.818 -10.161 1.00 0.00 H new ATOM 0 HD3 LYS A 117 51.251 -0.829 -11.251 1.00 0.00 H new ATOM 0 HE2 LYS A 117 52.478 -3.198 -9.799 1.00 0.00 H new ATOM 0 HE3 LYS A 117 50.872 -2.530 -9.582 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 50.354 -4.228 -10.957 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 50.756 -3.105 -12.166 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 51.885 -4.279 -11.688 1.00 0.00 H new ATOM 1089 N ALA A 118 51.411 1.706 -11.372 1.00 0.00 N ATOM 1090 CA ALA A 118 50.206 2.455 -11.049 1.00 0.00 C ATOM 1091 C ALA A 118 50.577 3.768 -10.366 1.00 0.00 C ATOM 1092 O ALA A 118 49.733 4.630 -10.143 1.00 0.00 O ATOM 1093 CB ALA A 118 49.285 1.629 -10.163 1.00 0.00 C ATOM 0 H ALA A 118 51.856 1.256 -10.572 1.00 0.00 H new ATOM 0 HA ALA A 118 49.673 2.680 -11.973 1.00 0.00 H new ATOM 0 HB1 ALA A 118 48.389 2.205 -9.932 1.00 0.00 H new ATOM 0 HB2 ALA A 118 49.003 0.714 -10.684 1.00 0.00 H new ATOM 0 HB3 ALA A 118 49.802 1.375 -9.238 1.00 0.00 H new ATOM 1099 N ARG A 119 51.863 3.904 -10.040 1.00 0.00 N ATOM 1100 CA ARG A 119 52.384 5.095 -9.382 1.00 0.00 C ATOM 1101 C ARG A 119 52.007 5.100 -7.906 1.00 0.00 C ATOM 1102 O ARG A 119 51.826 6.158 -7.304 1.00 0.00 O ATOM 1103 CB ARG A 119 51.883 6.372 -10.066 1.00 0.00 C ATOM 1104 CG ARG A 119 51.711 6.245 -11.572 1.00 0.00 C ATOM 1105 CD ARG A 119 51.777 7.602 -12.258 1.00 0.00 C ATOM 1106 NE ARG A 119 53.024 7.782 -12.998 1.00 0.00 N ATOM 1107 CZ ARG A 119 53.454 8.957 -13.453 1.00 0.00 C ATOM 1108 NH1 ARG A 119 52.746 10.060 -13.241 1.00 0.00 N ATOM 1109 NH2 ARG A 119 54.597 9.033 -14.122 1.00 0.00 N ATOM 0 H ARG A 119 52.569 3.191 -10.226 1.00 0.00 H new ATOM 0 HA ARG A 119 53.471 5.073 -9.465 1.00 0.00 H new ATOM 0 HB2 ARG A 119 50.928 6.656 -9.625 1.00 0.00 H new ATOM 0 HB3 ARG A 119 52.583 7.181 -9.858 1.00 0.00 H new ATOM 0 HG2 ARG A 119 52.488 5.595 -11.974 1.00 0.00 H new ATOM 0 HG3 ARG A 119 50.754 5.772 -11.791 1.00 0.00 H new ATOM 0 HD2 ARG A 119 50.933 7.705 -12.940 1.00 0.00 H new ATOM 0 HD3 ARG A 119 51.682 8.390 -11.511 1.00 0.00 H new ATOM 0 HE ARG A 119 53.599 6.959 -13.177 1.00 0.00 H new ATOM 0 HH11 ARG A 119 51.867 10.011 -12.727 1.00 0.00 H new ATOM 0 HH12 ARG A 119 53.082 10.957 -13.592 1.00 0.00 H new ATOM 0 HH21 ARG A 119 55.148 8.191 -14.288 1.00 0.00 H new ATOM 0 HH22 ARG A 119 54.925 9.934 -14.470 1.00 0.00 H new ATOM 1123 N GLY A 120 51.904 3.906 -7.329 1.00 0.00 N ATOM 1124 CA GLY A 120 51.563 3.792 -5.922 1.00 0.00 C ATOM 1125 C GLY A 120 50.098 3.476 -5.687 1.00 0.00 C ATOM 1126 O GLY A 120 49.767 2.613 -4.873 1.00 0.00 O ATOM 0 H GLY A 120 52.050 3.018 -7.809 1.00 0.00 H new ATOM 0 HA2 GLY A 120 52.174 3.011 -5.469 1.00 0.00 H new ATOM 0 HA3 GLY A 120 51.812 4.725 -5.417 1.00 0.00 H new ATOM 1130 N ASP A 121 49.214 4.179 -6.393 1.00 0.00 N ATOM 1131 CA ASP A 121 47.776 3.966 -6.245 1.00 0.00 C ATOM 1132 C ASP A 121 47.406 2.512 -6.520 1.00 0.00 C ATOM 1133 O ASP A 121 47.368 2.077 -7.671 1.00 0.00 O ATOM 1134 CB ASP A 121 46.994 4.892 -7.181 1.00 0.00 C ATOM 1135 CG ASP A 121 47.587 4.952 -8.573 1.00 0.00 C ATOM 1136 OD1 ASP A 121 47.507 3.938 -9.298 1.00 0.00 O ATOM 1137 OD2 ASP A 121 48.130 6.016 -8.940 1.00 0.00 O ATOM 0 H ASP A 121 49.467 4.898 -7.071 1.00 0.00 H new ATOM 0 HA ASP A 121 47.509 4.200 -5.214 1.00 0.00 H new ATOM 0 HB2 ASP A 121 45.961 4.549 -7.245 1.00 0.00 H new ATOM 0 HB3 ASP A 121 46.971 5.896 -6.757 1.00 0.00 H new ATOM 1142 N LEU A 122 47.129 1.767 -5.454 1.00 0.00 N ATOM 1143 CA LEU A 122 46.758 0.361 -5.580 1.00 0.00 C ATOM 1144 C LEU A 122 45.296 0.211 -5.996 1.00 0.00 C ATOM 1145 O LEU A 122 44.840 -0.892 -6.302 1.00 0.00 O ATOM 1146 CB LEU A 122 46.995 -0.374 -4.259 1.00 0.00 C ATOM 1147 CG LEU A 122 48.246 0.060 -3.489 1.00 0.00 C ATOM 1148 CD1 LEU A 122 47.862 0.829 -2.233 1.00 0.00 C ATOM 1149 CD2 LEU A 122 49.105 -1.150 -3.136 1.00 0.00 C ATOM 0 H LEU A 122 47.154 2.113 -4.495 1.00 0.00 H new ATOM 0 HA LEU A 122 47.385 -0.079 -6.355 1.00 0.00 H new ATOM 0 HB2 LEU A 122 46.125 -0.228 -3.619 1.00 0.00 H new ATOM 0 HB3 LEU A 122 47.065 -1.442 -4.463 1.00 0.00 H new ATOM 0 HG LEU A 122 48.831 0.720 -4.129 1.00 0.00 H new ATOM 0 HD11 LEU A 122 48.764 1.129 -1.700 1.00 0.00 H new ATOM 0 HD12 LEU A 122 47.292 1.716 -2.509 1.00 0.00 H new ATOM 0 HD13 LEU A 122 47.254 0.194 -1.589 1.00 0.00 H new ATOM 0 HD21 LEU A 122 49.989 -0.822 -2.589 1.00 0.00 H new ATOM 0 HD22 LEU A 122 48.529 -1.837 -2.516 1.00 0.00 H new ATOM 0 HD23 LEU A 122 49.412 -1.658 -4.050 1.00 0.00 H new ATOM 1161 N GLY A 123 44.564 1.321 -6.004 1.00 0.00 N ATOM 1162 CA GLY A 123 43.164 1.279 -6.380 1.00 0.00 C ATOM 1163 C GLY A 123 42.260 0.994 -5.198 1.00 0.00 C ATOM 1164 O GLY A 123 42.736 0.784 -4.081 1.00 0.00 O ATOM 0 H GLY A 123 44.915 2.246 -5.757 1.00 0.00 H new ATOM 0 HA2 GLY A 123 42.882 2.231 -6.829 1.00 0.00 H new ATOM 0 HA3 GLY A 123 43.017 0.512 -7.140 1.00 0.00 H new ATOM 1168 N ALA A 124 40.955 0.986 -5.441 1.00 0.00 N ATOM 1169 CA ALA A 124 39.986 0.722 -4.387 1.00 0.00 C ATOM 1170 C ALA A 124 40.097 -0.716 -3.889 1.00 0.00 C ATOM 1171 O ALA A 124 39.816 -1.660 -4.627 1.00 0.00 O ATOM 1172 CB ALA A 124 38.576 1.002 -4.886 1.00 0.00 C ATOM 0 H ALA A 124 40.544 1.159 -6.359 1.00 0.00 H new ATOM 0 HA ALA A 124 40.203 1.387 -3.551 1.00 0.00 H new ATOM 0 HB1 ALA A 124 37.861 0.801 -4.088 1.00 0.00 H new ATOM 0 HB2 ALA A 124 38.498 2.046 -5.188 1.00 0.00 H new ATOM 0 HB3 ALA A 124 38.358 0.360 -5.739 1.00 0.00 H new ATOM 1178 N PHE A 125 40.504 -0.875 -2.632 1.00 0.00 N ATOM 1179 CA PHE A 125 40.646 -2.201 -2.042 1.00 0.00 C ATOM 1180 C PHE A 125 39.745 -2.358 -0.828 1.00 0.00 C ATOM 1181 O PHE A 125 39.025 -1.435 -0.446 1.00 0.00 O ATOM 1182 CB PHE A 125 42.094 -2.461 -1.632 1.00 0.00 C ATOM 1183 CG PHE A 125 42.710 -1.333 -0.854 1.00 0.00 C ATOM 1184 CD1 PHE A 125 42.454 -1.192 0.500 1.00 0.00 C ATOM 1185 CD2 PHE A 125 43.545 -0.417 -1.474 1.00 0.00 C ATOM 1186 CE1 PHE A 125 43.017 -0.158 1.222 1.00 0.00 C ATOM 1187 CE2 PHE A 125 44.112 0.622 -0.757 1.00 0.00 C ATOM 1188 CZ PHE A 125 43.847 0.750 0.594 1.00 0.00 C ATOM 0 H PHE A 125 40.740 -0.105 -2.006 1.00 0.00 H new ATOM 0 HA PHE A 125 40.351 -2.928 -2.799 1.00 0.00 H new ATOM 0 HB2 PHE A 125 42.135 -3.370 -1.032 1.00 0.00 H new ATOM 0 HB3 PHE A 125 42.689 -2.642 -2.527 1.00 0.00 H new ATOM 0 HD1 PHE A 125 41.806 -1.899 0.997 1.00 0.00 H new ATOM 0 HD2 PHE A 125 43.756 -0.515 -2.529 1.00 0.00 H new ATOM 0 HE1 PHE A 125 42.808 -0.059 2.277 1.00 0.00 H new ATOM 0 HE2 PHE A 125 44.760 1.331 -1.251 1.00 0.00 H new ATOM 0 HZ PHE A 125 44.288 1.559 1.157 1.00 0.00 H new ATOM 1198 N SER A 126 39.804 -3.536 -0.224 1.00 0.00 N ATOM 1199 CA SER A 126 39.002 -3.837 0.956 1.00 0.00 C ATOM 1200 C SER A 126 39.893 -4.125 2.160 1.00 0.00 C ATOM 1201 O SER A 126 40.979 -4.686 2.020 1.00 0.00 O ATOM 1202 CB SER A 126 38.083 -5.031 0.685 1.00 0.00 C ATOM 1203 OG SER A 126 36.719 -4.657 0.781 1.00 0.00 O ATOM 0 H SER A 126 40.401 -4.303 -0.532 1.00 0.00 H new ATOM 0 HA SER A 126 38.390 -2.964 1.182 1.00 0.00 H new ATOM 0 HB2 SER A 126 38.285 -5.431 -0.309 1.00 0.00 H new ATOM 0 HB3 SER A 126 38.296 -5.827 1.398 1.00 0.00 H new ATOM 0 HG SER A 126 36.595 -4.067 1.554 1.00 0.00 H new ATOM 1209 N ARG A 127 39.427 -3.734 3.342 1.00 0.00 N ATOM 1210 CA ARG A 127 40.190 -3.952 4.573 1.00 0.00 C ATOM 1211 C ARG A 127 40.650 -5.405 4.682 1.00 0.00 C ATOM 1212 O ARG A 127 39.860 -6.297 4.989 1.00 0.00 O ATOM 1213 CB ARG A 127 39.387 -3.560 5.830 1.00 0.00 C ATOM 1214 CG ARG A 127 37.874 -3.474 5.644 1.00 0.00 C ATOM 1215 CD ARG A 127 37.216 -4.844 5.722 1.00 0.00 C ATOM 1216 NE ARG A 127 36.470 -5.020 6.967 1.00 0.00 N ATOM 1217 CZ ARG A 127 35.204 -4.645 7.136 1.00 0.00 C ATOM 1218 NH1 ARG A 127 34.536 -4.064 6.146 1.00 0.00 N ATOM 1219 NH2 ARG A 127 34.604 -4.847 8.301 1.00 0.00 N ATOM 0 H ARG A 127 38.530 -3.267 3.477 1.00 0.00 H new ATOM 0 HA ARG A 127 41.065 -3.305 4.519 1.00 0.00 H new ATOM 0 HB2 ARG A 127 39.598 -4.286 6.615 1.00 0.00 H new ATOM 0 HB3 ARG A 127 39.747 -2.594 6.183 1.00 0.00 H new ATOM 0 HG2 ARG A 127 37.450 -2.823 6.409 1.00 0.00 H new ATOM 0 HG3 ARG A 127 37.652 -3.018 4.679 1.00 0.00 H new ATOM 0 HD2 ARG A 127 36.543 -4.972 4.874 1.00 0.00 H new ATOM 0 HD3 ARG A 127 37.979 -5.618 5.643 1.00 0.00 H new ATOM 0 HE ARG A 127 36.949 -5.457 7.754 1.00 0.00 H new ATOM 0 HH11 ARG A 127 34.993 -3.902 5.248 1.00 0.00 H new ATOM 0 HH12 ARG A 127 33.566 -3.779 6.283 1.00 0.00 H new ATOM 0 HH21 ARG A 127 35.112 -5.289 9.067 1.00 0.00 H new ATOM 0 HH22 ARG A 127 33.634 -4.560 8.432 1.00 0.00 H new ATOM 1233 N GLY A 128 41.935 -5.634 4.429 1.00 0.00 N ATOM 1234 CA GLY A 128 42.476 -6.980 4.506 1.00 0.00 C ATOM 1235 C GLY A 128 43.239 -7.387 3.257 1.00 0.00 C ATOM 1236 O GLY A 128 43.749 -8.506 3.176 1.00 0.00 O ATOM 0 H GLY A 128 42.610 -4.914 4.173 1.00 0.00 H new ATOM 0 HA2 GLY A 128 43.139 -7.050 5.369 1.00 0.00 H new ATOM 0 HA3 GLY A 128 41.661 -7.684 4.672 1.00 0.00 H new ATOM 1240 N GLN A 129 43.323 -6.485 2.282 1.00 0.00 N ATOM 1241 CA GLN A 129 44.031 -6.770 1.039 1.00 0.00 C ATOM 1242 C GLN A 129 45.511 -6.425 1.164 1.00 0.00 C ATOM 1243 O GLN A 129 46.377 -7.230 0.820 1.00 0.00 O ATOM 1244 CB GLN A 129 43.408 -5.987 -0.119 1.00 0.00 C ATOM 1245 CG GLN A 129 41.986 -6.410 -0.446 1.00 0.00 C ATOM 1246 CD GLN A 129 41.870 -7.897 -0.720 1.00 0.00 C ATOM 1247 OE1 GLN A 129 41.383 -8.659 0.116 1.00 0.00 O ATOM 1248 NE2 GLN A 129 42.317 -8.318 -1.898 1.00 0.00 N ATOM 0 H GLN A 129 42.910 -5.553 2.329 1.00 0.00 H new ATOM 0 HA GLN A 129 43.942 -7.837 0.836 1.00 0.00 H new ATOM 0 HB2 GLN A 129 43.414 -4.925 0.127 1.00 0.00 H new ATOM 0 HB3 GLN A 129 44.028 -6.113 -1.006 1.00 0.00 H new ATOM 0 HG2 GLN A 129 41.332 -6.145 0.384 1.00 0.00 H new ATOM 0 HG3 GLN A 129 41.637 -5.855 -1.317 1.00 0.00 H new ATOM 0 HE21 GLN A 129 42.713 -7.652 -2.561 1.00 0.00 H new ATOM 0 HE22 GLN A 129 42.264 -9.308 -2.140 1.00 0.00 H new ATOM 1257 N MET A 130 45.795 -5.224 1.657 1.00 0.00 N ATOM 1258 CA MET A 130 47.172 -4.773 1.826 1.00 0.00 C ATOM 1259 C MET A 130 47.744 -5.264 3.152 1.00 0.00 C ATOM 1260 O MET A 130 47.063 -5.946 3.919 1.00 0.00 O ATOM 1261 CB MET A 130 47.241 -3.247 1.763 1.00 0.00 C ATOM 1262 CG MET A 130 46.430 -2.647 0.625 1.00 0.00 C ATOM 1263 SD MET A 130 47.276 -2.762 -0.964 1.00 0.00 S ATOM 1264 CE MET A 130 46.851 -4.433 -1.452 1.00 0.00 C ATOM 0 H MET A 130 45.090 -4.546 1.946 1.00 0.00 H new ATOM 0 HA MET A 130 47.768 -5.191 1.015 1.00 0.00 H new ATOM 0 HB2 MET A 130 46.885 -2.836 2.708 1.00 0.00 H new ATOM 0 HB3 MET A 130 48.282 -2.943 1.656 1.00 0.00 H new ATOM 0 HG2 MET A 130 45.470 -3.158 0.559 1.00 0.00 H new ATOM 0 HG3 MET A 130 46.220 -1.601 0.846 1.00 0.00 H new ATOM 0 HE1 MET A 130 46.722 -4.475 -2.534 1.00 0.00 H new ATOM 0 HE2 MET A 130 47.649 -5.113 -1.155 1.00 0.00 H new ATOM 0 HE3 MET A 130 45.922 -4.729 -0.965 1.00 0.00 H new ATOM 1274 N GLN A 131 49.000 -4.913 3.419 1.00 0.00 N ATOM 1275 CA GLN A 131 49.662 -5.319 4.655 1.00 0.00 C ATOM 1276 C GLN A 131 48.828 -4.925 5.870 1.00 0.00 C ATOM 1277 O GLN A 131 47.919 -4.100 5.769 1.00 0.00 O ATOM 1278 CB GLN A 131 51.054 -4.688 4.754 1.00 0.00 C ATOM 1279 CG GLN A 131 51.847 -4.734 3.457 1.00 0.00 C ATOM 1280 CD GLN A 131 51.884 -6.119 2.841 1.00 0.00 C ATOM 1281 OE1 GLN A 131 50.848 -6.755 2.649 1.00 0.00 O ATOM 1282 NE2 GLN A 131 53.085 -6.595 2.529 1.00 0.00 N ATOM 0 H GLN A 131 49.579 -4.349 2.796 1.00 0.00 H new ATOM 0 HA GLN A 131 49.766 -6.404 4.639 1.00 0.00 H new ATOM 0 HB2 GLN A 131 50.949 -3.649 5.067 1.00 0.00 H new ATOM 0 HB3 GLN A 131 51.620 -5.200 5.532 1.00 0.00 H new ATOM 0 HG2 GLN A 131 51.409 -4.035 2.744 1.00 0.00 H new ATOM 0 HG3 GLN A 131 52.866 -4.398 3.647 1.00 0.00 H new ATOM 0 HE21 GLN A 131 53.918 -6.033 2.706 1.00 0.00 H new ATOM 0 HE22 GLN A 131 53.174 -7.522 2.113 1.00 0.00 H new ATOM 1291 N LYS A 132 49.138 -5.520 7.017 1.00 0.00 N ATOM 1292 CA LYS A 132 48.410 -5.228 8.245 1.00 0.00 C ATOM 1293 C LYS A 132 48.556 -3.759 8.633 1.00 0.00 C ATOM 1294 O LYS A 132 47.567 -3.029 8.698 1.00 0.00 O ATOM 1295 CB LYS A 132 48.894 -6.131 9.383 1.00 0.00 C ATOM 1296 CG LYS A 132 48.354 -7.551 9.302 1.00 0.00 C ATOM 1297 CD LYS A 132 47.368 -7.842 10.424 1.00 0.00 C ATOM 1298 CE LYS A 132 48.083 -8.184 11.722 1.00 0.00 C ATOM 1299 NZ LYS A 132 47.618 -7.335 12.853 1.00 0.00 N ATOM 0 H LYS A 132 49.886 -6.205 7.121 1.00 0.00 H new ATOM 0 HA LYS A 132 47.354 -5.428 8.066 1.00 0.00 H new ATOM 0 HB2 LYS A 132 49.983 -6.164 9.372 1.00 0.00 H new ATOM 0 HB3 LYS A 132 48.598 -5.692 10.336 1.00 0.00 H new ATOM 0 HG2 LYS A 132 47.865 -7.700 8.339 1.00 0.00 H new ATOM 0 HG3 LYS A 132 49.182 -8.259 9.352 1.00 0.00 H new ATOM 0 HD2 LYS A 132 46.726 -6.975 10.579 1.00 0.00 H new ATOM 0 HD3 LYS A 132 46.721 -8.670 10.135 1.00 0.00 H new ATOM 0 HE2 LYS A 132 47.915 -9.234 11.963 1.00 0.00 H new ATOM 0 HE3 LYS A 132 49.157 -8.055 11.589 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 48.130 -7.600 13.719 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 47.801 -6.335 12.635 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 46.598 -7.477 12.997 1.00 0.00 H new ATOM 1313 N PRO A 133 49.793 -3.291 8.885 1.00 0.00 N ATOM 1314 CA PRO A 133 50.038 -1.893 9.251 1.00 0.00 C ATOM 1315 C PRO A 133 49.543 -0.940 8.170 1.00 0.00 C ATOM 1316 O PRO A 133 49.263 0.228 8.436 1.00 0.00 O ATOM 1317 CB PRO A 133 51.563 -1.808 9.393 1.00 0.00 C ATOM 1318 CG PRO A 133 52.092 -3.007 8.680 1.00 0.00 C ATOM 1319 CD PRO A 133 51.040 -4.069 8.822 1.00 0.00 C ATOM 0 HA PRO A 133 49.511 -1.606 10.161 1.00 0.00 H new ATOM 0 HB2 PRO A 133 51.948 -0.888 8.954 1.00 0.00 H new ATOM 0 HB3 PRO A 133 51.861 -1.810 10.441 1.00 0.00 H new ATOM 0 HG2 PRO A 133 52.283 -2.784 7.630 1.00 0.00 H new ATOM 0 HG3 PRO A 133 53.037 -3.333 9.113 1.00 0.00 H new ATOM 0 HD2 PRO A 133 51.044 -4.757 7.977 1.00 0.00 H new ATOM 0 HD3 PRO A 133 51.189 -4.667 9.721 1.00 0.00 H new ATOM 1327 N PHE A 134 49.428 -1.458 6.951 1.00 0.00 N ATOM 1328 CA PHE A 134 48.956 -0.671 5.820 1.00 0.00 C ATOM 1329 C PHE A 134 47.488 -0.316 5.991 1.00 0.00 C ATOM 1330 O PHE A 134 47.124 0.855 6.095 1.00 0.00 O ATOM 1331 CB PHE A 134 49.133 -1.462 4.523 1.00 0.00 C ATOM 1332 CG PHE A 134 49.073 -0.615 3.284 1.00 0.00 C ATOM 1333 CD1 PHE A 134 47.864 -0.380 2.650 1.00 0.00 C ATOM 1334 CD2 PHE A 134 50.225 -0.052 2.754 1.00 0.00 C ATOM 1335 CE1 PHE A 134 47.802 0.399 1.511 1.00 0.00 C ATOM 1336 CE2 PHE A 134 50.169 0.728 1.614 1.00 0.00 C ATOM 1337 CZ PHE A 134 48.955 0.955 0.993 1.00 0.00 C ATOM 0 H PHE A 134 49.657 -2.425 6.722 1.00 0.00 H new ATOM 0 HA PHE A 134 49.542 0.247 5.774 1.00 0.00 H new ATOM 0 HB2 PHE A 134 50.092 -1.980 4.552 1.00 0.00 H new ATOM 0 HB3 PHE A 134 48.359 -2.227 4.467 1.00 0.00 H new ATOM 0 HD1 PHE A 134 46.959 -0.811 3.051 1.00 0.00 H new ATOM 0 HD2 PHE A 134 51.175 -0.225 3.237 1.00 0.00 H new ATOM 0 HE1 PHE A 134 46.853 0.573 1.026 1.00 0.00 H new ATOM 0 HE2 PHE A 134 51.073 1.159 1.209 1.00 0.00 H new ATOM 0 HZ PHE A 134 48.908 1.566 0.104 1.00 0.00 H new ATOM 1347 N GLU A 135 46.652 -1.347 6.014 1.00 0.00 N ATOM 1348 CA GLU A 135 45.212 -1.168 6.162 1.00 0.00 C ATOM 1349 C GLU A 135 44.876 -0.324 7.390 1.00 0.00 C ATOM 1350 O GLU A 135 44.055 0.589 7.315 1.00 0.00 O ATOM 1351 CB GLU A 135 44.517 -2.528 6.259 1.00 0.00 C ATOM 1352 CG GLU A 135 43.271 -2.635 5.396 1.00 0.00 C ATOM 1353 CD GLU A 135 43.584 -2.625 3.912 1.00 0.00 C ATOM 1354 OE1 GLU A 135 44.780 -2.675 3.555 1.00 0.00 O ATOM 1355 OE2 GLU A 135 42.631 -2.570 3.105 1.00 0.00 O ATOM 0 H GLU A 135 46.948 -2.320 5.932 1.00 0.00 H new ATOM 0 HA GLU A 135 44.851 -0.639 5.280 1.00 0.00 H new ATOM 0 HB2 GLU A 135 45.220 -3.308 5.967 1.00 0.00 H new ATOM 0 HB3 GLU A 135 44.247 -2.716 7.298 1.00 0.00 H new ATOM 0 HG2 GLU A 135 42.740 -3.554 5.645 1.00 0.00 H new ATOM 0 HG3 GLU A 135 42.601 -1.807 5.628 1.00 0.00 H new ATOM 1362 N ASP A 136 45.511 -0.632 8.517 1.00 0.00 N ATOM 1363 CA ASP A 136 45.265 0.107 9.753 1.00 0.00 C ATOM 1364 C ASP A 136 45.501 1.601 9.547 1.00 0.00 C ATOM 1365 O ASP A 136 44.597 2.413 9.744 1.00 0.00 O ATOM 1366 CB ASP A 136 46.164 -0.415 10.874 1.00 0.00 C ATOM 1367 CG ASP A 136 45.546 -0.229 12.245 1.00 0.00 C ATOM 1368 OD1 ASP A 136 44.639 0.619 12.378 1.00 0.00 O ATOM 1369 OD2 ASP A 136 45.969 -0.931 13.188 1.00 0.00 O ATOM 0 H ASP A 136 46.196 -1.383 8.601 1.00 0.00 H new ATOM 0 HA ASP A 136 44.223 -0.043 10.036 1.00 0.00 H new ATOM 0 HB2 ASP A 136 46.366 -1.473 10.710 1.00 0.00 H new ATOM 0 HB3 ASP A 136 47.123 0.102 10.838 1.00 0.00 H new ATOM 1374 N ALA A 137 46.716 1.956 9.143 1.00 0.00 N ATOM 1375 CA ALA A 137 47.062 3.352 8.906 1.00 0.00 C ATOM 1376 C ALA A 137 46.135 3.969 7.865 1.00 0.00 C ATOM 1377 O ALA A 137 45.624 5.075 8.048 1.00 0.00 O ATOM 1378 CB ALA A 137 48.513 3.469 8.462 1.00 0.00 C ATOM 0 H ALA A 137 47.476 1.297 8.973 1.00 0.00 H new ATOM 0 HA ALA A 137 46.938 3.900 9.840 1.00 0.00 H new ATOM 0 HB1 ALA A 137 48.757 4.517 8.289 1.00 0.00 H new ATOM 0 HB2 ALA A 137 49.165 3.068 9.239 1.00 0.00 H new ATOM 0 HB3 ALA A 137 48.658 2.906 7.540 1.00 0.00 H new ATOM 1384 N SER A 138 45.914 3.239 6.775 1.00 0.00 N ATOM 1385 CA SER A 138 45.040 3.705 5.705 1.00 0.00 C ATOM 1386 C SER A 138 43.630 3.949 6.234 1.00 0.00 C ATOM 1387 O SER A 138 43.072 5.035 6.077 1.00 0.00 O ATOM 1388 CB SER A 138 45.003 2.675 4.571 1.00 0.00 C ATOM 1389 OG SER A 138 45.621 3.181 3.400 1.00 0.00 O ATOM 0 H SER A 138 46.329 2.322 6.610 1.00 0.00 H new ATOM 0 HA SER A 138 45.434 4.645 5.320 1.00 0.00 H new ATOM 0 HB2 SER A 138 45.509 1.763 4.888 1.00 0.00 H new ATOM 0 HB3 SER A 138 43.969 2.407 4.353 1.00 0.00 H new ATOM 0 HG SER A 138 44.943 3.589 2.822 1.00 0.00 H new ATOM 1395 N PHE A 139 43.067 2.924 6.862 1.00 0.00 N ATOM 1396 CA PHE A 139 41.723 3.003 7.420 1.00 0.00 C ATOM 1397 C PHE A 139 41.661 3.958 8.610 1.00 0.00 C ATOM 1398 O PHE A 139 40.576 4.307 9.077 1.00 0.00 O ATOM 1399 CB PHE A 139 41.258 1.608 7.846 1.00 0.00 C ATOM 1400 CG PHE A 139 40.650 0.815 6.725 1.00 0.00 C ATOM 1401 CD1 PHE A 139 41.405 0.469 5.615 1.00 0.00 C ATOM 1402 CD2 PHE A 139 39.323 0.418 6.779 1.00 0.00 C ATOM 1403 CE1 PHE A 139 40.850 -0.259 4.581 1.00 0.00 C ATOM 1404 CE2 PHE A 139 38.762 -0.311 5.747 1.00 0.00 C ATOM 1405 CZ PHE A 139 39.527 -0.650 4.647 1.00 0.00 C ATOM 0 H PHE A 139 43.524 2.022 6.998 1.00 0.00 H new ATOM 0 HA PHE A 139 41.061 3.393 6.647 1.00 0.00 H new ATOM 0 HB2 PHE A 139 42.107 1.058 8.252 1.00 0.00 H new ATOM 0 HB3 PHE A 139 40.528 1.706 8.650 1.00 0.00 H new ATOM 0 HD1 PHE A 139 42.440 0.773 5.558 1.00 0.00 H new ATOM 0 HD2 PHE A 139 38.721 0.681 7.636 1.00 0.00 H new ATOM 0 HE1 PHE A 139 41.450 -0.522 3.722 1.00 0.00 H new ATOM 0 HE2 PHE A 139 37.727 -0.615 5.800 1.00 0.00 H new ATOM 0 HZ PHE A 139 39.091 -1.220 3.840 1.00 0.00 H new ATOM 1415 N ALA A 140 42.823 4.378 9.104 1.00 0.00 N ATOM 1416 CA ALA A 140 42.881 5.286 10.242 1.00 0.00 C ATOM 1417 C ALA A 140 43.096 6.732 9.801 1.00 0.00 C ATOM 1418 O ALA A 140 42.848 7.664 10.568 1.00 0.00 O ATOM 1419 CB ALA A 140 43.982 4.859 11.201 1.00 0.00 C ATOM 0 H ALA A 140 43.733 4.104 8.734 1.00 0.00 H new ATOM 0 HA ALA A 140 41.920 5.236 10.754 1.00 0.00 H new ATOM 0 HB1 ALA A 140 44.014 5.546 12.047 1.00 0.00 H new ATOM 0 HB2 ALA A 140 43.780 3.850 11.561 1.00 0.00 H new ATOM 0 HB3 ALA A 140 44.941 4.875 10.684 1.00 0.00 H new ATOM 1425 N LEU A 141 43.558 6.920 8.567 1.00 0.00 N ATOM 1426 CA LEU A 141 43.803 8.260 8.045 1.00 0.00 C ATOM 1427 C LEU A 141 42.549 8.824 7.372 1.00 0.00 C ATOM 1428 O LEU A 141 41.643 8.078 7.003 1.00 0.00 O ATOM 1429 CB LEU A 141 44.998 8.240 7.081 1.00 0.00 C ATOM 1430 CG LEU A 141 44.659 8.155 5.591 1.00 0.00 C ATOM 1431 CD1 LEU A 141 44.573 9.550 4.998 1.00 0.00 C ATOM 1432 CD2 LEU A 141 45.702 7.334 4.854 1.00 0.00 C ATOM 0 H LEU A 141 43.769 6.165 7.914 1.00 0.00 H new ATOM 0 HA LEU A 141 44.048 8.920 8.877 1.00 0.00 H new ATOM 0 HB2 LEU A 141 45.589 9.141 7.248 1.00 0.00 H new ATOM 0 HB3 LEU A 141 45.632 7.391 7.338 1.00 0.00 H new ATOM 0 HG LEU A 141 43.693 7.663 5.480 1.00 0.00 H new ATOM 0 HD11 LEU A 141 44.331 9.480 3.937 1.00 0.00 H new ATOM 0 HD12 LEU A 141 43.795 10.116 5.511 1.00 0.00 H new ATOM 0 HD13 LEU A 141 45.530 10.057 5.119 1.00 0.00 H new ATOM 0 HD21 LEU A 141 45.445 7.284 3.796 1.00 0.00 H new ATOM 0 HD22 LEU A 141 46.680 7.801 4.968 1.00 0.00 H new ATOM 0 HD23 LEU A 141 45.731 6.326 5.268 1.00 0.00 H new ATOM 1444 N ARG A 142 42.498 10.148 7.232 1.00 0.00 N ATOM 1445 CA ARG A 142 41.345 10.812 6.622 1.00 0.00 C ATOM 1446 C ARG A 142 41.593 11.147 5.153 1.00 0.00 C ATOM 1447 O ARG A 142 42.719 11.423 4.746 1.00 0.00 O ATOM 1448 CB ARG A 142 41.007 12.089 7.394 1.00 0.00 C ATOM 1449 CG ARG A 142 39.709 12.741 6.946 1.00 0.00 C ATOM 1450 CD ARG A 142 38.512 11.851 7.236 1.00 0.00 C ATOM 1451 NE ARG A 142 37.262 12.449 6.776 1.00 0.00 N ATOM 1452 CZ ARG A 142 36.618 13.415 7.430 1.00 0.00 C ATOM 1453 NH1 ARG A 142 37.104 13.892 8.569 1.00 0.00 N ATOM 1454 NH2 ARG A 142 35.486 13.903 6.942 1.00 0.00 N ATOM 0 H ARG A 142 43.239 10.781 7.532 1.00 0.00 H new ATOM 0 HA ARG A 142 40.504 10.120 6.669 1.00 0.00 H new ATOM 0 HB2 ARG A 142 40.939 11.855 8.456 1.00 0.00 H new ATOM 0 HB3 ARG A 142 41.823 12.802 7.276 1.00 0.00 H new ATOM 0 HG2 ARG A 142 39.585 13.697 7.455 1.00 0.00 H new ATOM 0 HG3 ARG A 142 39.756 12.953 5.878 1.00 0.00 H new ATOM 0 HD2 ARG A 142 38.652 10.885 6.750 1.00 0.00 H new ATOM 0 HD3 ARG A 142 38.451 11.663 8.308 1.00 0.00 H new ATOM 0 HE ARG A 142 36.858 12.108 5.904 1.00 0.00 H new ATOM 0 HH11 ARG A 142 37.975 13.519 8.948 1.00 0.00 H new ATOM 0 HH12 ARG A 142 36.607 14.631 9.066 1.00 0.00 H new ATOM 0 HH21 ARG A 142 35.109 13.539 6.067 1.00 0.00 H new ATOM 0 HH22 ARG A 142 34.992 14.642 7.442 1.00 0.00 H new ATOM 1468 N THR A 143 40.525 11.126 4.361 1.00 0.00 N ATOM 1469 CA THR A 143 40.615 11.428 2.933 1.00 0.00 C ATOM 1470 C THR A 143 41.460 12.674 2.676 1.00 0.00 C ATOM 1471 O THR A 143 41.136 13.765 3.144 1.00 0.00 O ATOM 1472 CB THR A 143 39.216 11.624 2.345 1.00 0.00 C ATOM 1473 OG1 THR A 143 38.333 10.617 2.807 1.00 0.00 O ATOM 1474 CG2 THR A 143 39.194 11.598 0.832 1.00 0.00 C ATOM 0 H THR A 143 39.584 10.902 4.684 1.00 0.00 H new ATOM 0 HA THR A 143 41.100 10.582 2.446 1.00 0.00 H new ATOM 0 HB THR A 143 38.897 12.611 2.679 1.00 0.00 H new ATOM 0 HG1 THR A 143 37.443 10.760 2.422 1.00 0.00 H new ATOM 0 HG21 THR A 143 38.172 11.743 0.480 1.00 0.00 H new ATOM 0 HG22 THR A 143 39.827 12.396 0.445 1.00 0.00 H new ATOM 0 HG23 THR A 143 39.566 10.636 0.479 1.00 0.00 H new ATOM 1482 N GLY A 144 42.542 12.501 1.923 1.00 0.00 N ATOM 1483 CA GLY A 144 43.413 13.619 1.608 1.00 0.00 C ATOM 1484 C GLY A 144 44.588 13.748 2.561 1.00 0.00 C ATOM 1485 O GLY A 144 45.213 14.806 2.638 1.00 0.00 O ATOM 0 H GLY A 144 42.831 11.607 1.526 1.00 0.00 H new ATOM 0 HA2 GLY A 144 43.789 13.503 0.591 1.00 0.00 H new ATOM 0 HA3 GLY A 144 42.832 14.541 1.630 1.00 0.00 H new ATOM 1489 N GLU A 145 44.899 12.675 3.287 1.00 0.00 N ATOM 1490 CA GLU A 145 46.013 12.694 4.230 1.00 0.00 C ATOM 1491 C GLU A 145 47.063 11.650 3.865 1.00 0.00 C ATOM 1492 O GLU A 145 46.815 10.757 3.051 1.00 0.00 O ATOM 1493 CB GLU A 145 45.517 12.451 5.658 1.00 0.00 C ATOM 1494 CG GLU A 145 45.590 13.683 6.545 1.00 0.00 C ATOM 1495 CD GLU A 145 47.009 14.176 6.743 1.00 0.00 C ATOM 1496 OE1 GLU A 145 47.761 13.529 7.503 1.00 0.00 O ATOM 1497 OE2 GLU A 145 47.370 15.209 6.140 1.00 0.00 O ATOM 0 H GLU A 145 44.398 11.788 3.240 1.00 0.00 H new ATOM 0 HA GLU A 145 46.472 13.681 4.176 1.00 0.00 H new ATOM 0 HB2 GLU A 145 44.485 12.101 5.621 1.00 0.00 H new ATOM 0 HB3 GLU A 145 46.108 11.654 6.108 1.00 0.00 H new ATOM 0 HG2 GLU A 145 44.991 14.480 6.104 1.00 0.00 H new ATOM 0 HG3 GLU A 145 45.150 13.454 7.516 1.00 0.00 H new ATOM 1504 N MET A 146 48.236 11.773 4.481 1.00 0.00 N ATOM 1505 CA MET A 146 49.337 10.848 4.240 1.00 0.00 C ATOM 1506 C MET A 146 49.691 10.096 5.518 1.00 0.00 C ATOM 1507 O MET A 146 49.814 10.689 6.588 1.00 0.00 O ATOM 1508 CB MET A 146 50.561 11.606 3.720 1.00 0.00 C ATOM 1509 CG MET A 146 50.969 11.212 2.310 1.00 0.00 C ATOM 1510 SD MET A 146 51.317 12.639 1.263 1.00 0.00 S ATOM 1511 CE MET A 146 49.802 13.573 1.450 1.00 0.00 C ATOM 0 H MET A 146 48.448 12.509 5.154 1.00 0.00 H new ATOM 0 HA MET A 146 49.023 10.126 3.486 1.00 0.00 H new ATOM 0 HB2 MET A 146 50.352 12.676 3.743 1.00 0.00 H new ATOM 0 HB3 MET A 146 51.400 11.431 4.394 1.00 0.00 H new ATOM 0 HG2 MET A 146 51.853 10.576 2.356 1.00 0.00 H new ATOM 0 HG3 MET A 146 50.173 10.620 1.858 1.00 0.00 H new ATOM 0 HE1 MET A 146 49.612 14.144 0.541 1.00 0.00 H new ATOM 0 HE2 MET A 146 48.973 12.889 1.629 1.00 0.00 H new ATOM 0 HE3 MET A 146 49.898 14.256 2.294 1.00 0.00 H new ATOM 1521 N SER A 147 49.850 8.784 5.396 1.00 0.00 N ATOM 1522 CA SER A 147 50.185 7.946 6.538 1.00 0.00 C ATOM 1523 C SER A 147 51.676 8.020 6.847 1.00 0.00 C ATOM 1524 O SER A 147 52.512 7.945 5.947 1.00 0.00 O ATOM 1525 CB SER A 147 49.772 6.497 6.265 1.00 0.00 C ATOM 1526 OG SER A 147 50.851 5.741 5.741 1.00 0.00 O ATOM 0 H SER A 147 49.752 8.278 4.516 1.00 0.00 H new ATOM 0 HA SER A 147 49.639 8.314 7.406 1.00 0.00 H new ATOM 0 HB2 SER A 147 49.419 6.038 7.188 1.00 0.00 H new ATOM 0 HB3 SER A 147 48.939 6.481 5.562 1.00 0.00 H new ATOM 0 HG SER A 147 51.461 5.495 6.467 1.00 0.00 H new ATOM 1532 N GLY A 148 52.003 8.166 8.127 1.00 0.00 N ATOM 1533 CA GLY A 148 53.393 8.245 8.533 1.00 0.00 C ATOM 1534 C GLY A 148 54.200 7.046 8.071 1.00 0.00 C ATOM 1535 O GLY A 148 53.645 6.096 7.520 1.00 0.00 O ATOM 0 H GLY A 148 51.329 8.231 8.890 1.00 0.00 H new ATOM 0 HA2 GLY A 148 53.836 9.155 8.128 1.00 0.00 H new ATOM 0 HA3 GLY A 148 53.448 8.320 9.619 1.00 0.00 H new ATOM 1539 N PRO A 149 55.527 7.062 8.284 1.00 0.00 N ATOM 1540 CA PRO A 149 56.404 5.958 7.880 1.00 0.00 C ATOM 1541 C PRO A 149 55.883 4.603 8.342 1.00 0.00 C ATOM 1542 O PRO A 149 55.796 4.335 9.541 1.00 0.00 O ATOM 1543 CB PRO A 149 57.726 6.285 8.572 1.00 0.00 C ATOM 1544 CG PRO A 149 57.714 7.765 8.740 1.00 0.00 C ATOM 1545 CD PRO A 149 56.273 8.155 8.935 1.00 0.00 C ATOM 0 HA PRO A 149 56.482 5.877 6.796 1.00 0.00 H new ATOM 0 HB2 PRO A 149 57.804 5.779 9.534 1.00 0.00 H new ATOM 0 HB3 PRO A 149 58.577 5.962 7.972 1.00 0.00 H new ATOM 0 HG2 PRO A 149 58.317 8.064 9.597 1.00 0.00 H new ATOM 0 HG3 PRO A 149 58.136 8.259 7.865 1.00 0.00 H new ATOM 0 HD2 PRO A 149 56.020 8.239 9.992 1.00 0.00 H new ATOM 0 HD3 PRO A 149 56.053 9.119 8.477 1.00 0.00 H new ATOM 1553 N VAL A 150 55.542 3.748 7.383 1.00 0.00 N ATOM 1554 CA VAL A 150 55.035 2.417 7.692 1.00 0.00 C ATOM 1555 C VAL A 150 56.081 1.354 7.383 1.00 0.00 C ATOM 1556 O VAL A 150 56.424 1.123 6.224 1.00 0.00 O ATOM 1557 CB VAL A 150 53.751 2.104 6.901 1.00 0.00 C ATOM 1558 CG1 VAL A 150 53.132 0.799 7.376 1.00 0.00 C ATOM 1559 CG2 VAL A 150 52.757 3.251 7.020 1.00 0.00 C ATOM 0 H VAL A 150 55.608 3.954 6.386 1.00 0.00 H new ATOM 0 HA VAL A 150 54.804 2.403 8.757 1.00 0.00 H new ATOM 0 HB VAL A 150 54.014 1.990 5.849 1.00 0.00 H new ATOM 0 HG11 VAL A 150 52.226 0.597 6.804 1.00 0.00 H new ATOM 0 HG12 VAL A 150 53.842 -0.015 7.230 1.00 0.00 H new ATOM 0 HG13 VAL A 150 52.883 0.878 8.434 1.00 0.00 H new ATOM 0 HG21 VAL A 150 51.856 3.012 6.455 1.00 0.00 H new ATOM 0 HG22 VAL A 150 52.499 3.401 8.068 1.00 0.00 H new ATOM 0 HG23 VAL A 150 53.204 4.162 6.622 1.00 0.00 H new ATOM 1569 N PHE A 151 56.591 0.713 8.429 1.00 0.00 N ATOM 1570 CA PHE A 151 57.605 -0.319 8.272 1.00 0.00 C ATOM 1571 C PHE A 151 56.974 -1.668 7.943 1.00 0.00 C ATOM 1572 O PHE A 151 56.147 -2.181 8.697 1.00 0.00 O ATOM 1573 CB PHE A 151 58.447 -0.427 9.543 1.00 0.00 C ATOM 1574 CG PHE A 151 59.154 0.851 9.897 1.00 0.00 C ATOM 1575 CD1 PHE A 151 58.465 1.899 10.484 1.00 0.00 C ATOM 1576 CD2 PHE A 151 60.507 1.004 9.638 1.00 0.00 C ATOM 1577 CE1 PHE A 151 59.109 3.078 10.806 1.00 0.00 C ATOM 1578 CE2 PHE A 151 61.158 2.181 9.958 1.00 0.00 C ATOM 1579 CZ PHE A 151 60.459 3.219 10.543 1.00 0.00 C ATOM 0 H PHE A 151 56.317 0.891 9.395 1.00 0.00 H new ATOM 0 HA PHE A 151 58.249 -0.036 7.439 1.00 0.00 H new ATOM 0 HB2 PHE A 151 57.804 -0.720 10.373 1.00 0.00 H new ATOM 0 HB3 PHE A 151 59.185 -1.219 9.416 1.00 0.00 H new ATOM 0 HD1 PHE A 151 57.411 1.793 10.693 1.00 0.00 H new ATOM 0 HD2 PHE A 151 61.058 0.195 9.181 1.00 0.00 H new ATOM 0 HE1 PHE A 151 58.559 3.888 11.262 1.00 0.00 H new ATOM 0 HE2 PHE A 151 62.212 2.289 9.751 1.00 0.00 H new ATOM 0 HZ PHE A 151 60.966 4.139 10.794 1.00 0.00 H new ATOM 1589 N THR A 152 57.374 -2.237 6.811 1.00 0.00 N ATOM 1590 CA THR A 152 56.856 -3.526 6.374 1.00 0.00 C ATOM 1591 C THR A 152 57.988 -4.425 5.888 1.00 0.00 C ATOM 1592 O THR A 152 59.133 -3.987 5.768 1.00 0.00 O ATOM 1593 CB THR A 152 55.827 -3.333 5.257 1.00 0.00 C ATOM 1594 OG1 THR A 152 56.427 -2.748 4.116 1.00 0.00 O ATOM 1595 CG2 THR A 152 54.660 -2.458 5.665 1.00 0.00 C ATOM 0 H THR A 152 58.058 -1.823 6.178 1.00 0.00 H new ATOM 0 HA THR A 152 56.372 -4.005 7.225 1.00 0.00 H new ATOM 0 HB THR A 152 55.451 -4.332 5.034 1.00 0.00 H new ATOM 0 HG1 THR A 152 55.742 -2.580 3.436 1.00 0.00 H new ATOM 0 HG21 THR A 152 53.968 -2.361 4.829 1.00 0.00 H new ATOM 0 HG22 THR A 152 54.145 -2.911 6.512 1.00 0.00 H new ATOM 0 HG23 THR A 152 55.027 -1.471 5.948 1.00 0.00 H new ATOM 1603 N ASP A 153 57.660 -5.685 5.613 1.00 0.00 N ATOM 1604 CA ASP A 153 58.644 -6.659 5.143 1.00 0.00 C ATOM 1605 C ASP A 153 59.560 -6.069 4.073 1.00 0.00 C ATOM 1606 O ASP A 153 60.716 -6.471 3.942 1.00 0.00 O ATOM 1607 CB ASP A 153 57.938 -7.899 4.593 1.00 0.00 C ATOM 1608 CG ASP A 153 57.508 -8.856 5.688 1.00 0.00 C ATOM 1609 OD1 ASP A 153 56.384 -8.695 6.210 1.00 0.00 O ATOM 1610 OD2 ASP A 153 58.295 -9.765 6.023 1.00 0.00 O ATOM 0 H ASP A 153 56.715 -6.058 5.708 1.00 0.00 H new ATOM 0 HA ASP A 153 59.262 -6.938 5.997 1.00 0.00 H new ATOM 0 HB2 ASP A 153 57.063 -7.591 4.020 1.00 0.00 H new ATOM 0 HB3 ASP A 153 58.605 -8.417 3.903 1.00 0.00 H new ATOM 1615 N SER A 154 59.038 -5.118 3.305 1.00 0.00 N ATOM 1616 CA SER A 154 59.815 -4.484 2.246 1.00 0.00 C ATOM 1617 C SER A 154 60.604 -3.287 2.774 1.00 0.00 C ATOM 1618 O SER A 154 61.769 -3.103 2.426 1.00 0.00 O ATOM 1619 CB SER A 154 58.896 -4.041 1.106 1.00 0.00 C ATOM 1620 OG SER A 154 58.639 -5.111 0.213 1.00 0.00 O ATOM 0 H SER A 154 58.083 -4.770 3.396 1.00 0.00 H new ATOM 0 HA SER A 154 60.526 -5.220 1.870 1.00 0.00 H new ATOM 0 HB2 SER A 154 57.956 -3.671 1.515 1.00 0.00 H new ATOM 0 HB3 SER A 154 59.355 -3.214 0.565 1.00 0.00 H new ATOM 0 HG SER A 154 57.828 -4.919 -0.303 1.00 0.00 H new ATOM 1626 N GLY A 155 59.965 -2.474 3.611 1.00 0.00 N ATOM 1627 CA GLY A 155 60.634 -1.308 4.164 1.00 0.00 C ATOM 1628 C GLY A 155 59.661 -0.274 4.694 1.00 0.00 C ATOM 1629 O GLY A 155 58.673 -0.619 5.339 1.00 0.00 O ATOM 0 H GLY A 155 59.000 -2.601 3.915 1.00 0.00 H new ATOM 0 HA2 GLY A 155 61.298 -1.623 4.969 1.00 0.00 H new ATOM 0 HA3 GLY A 155 61.258 -0.853 3.395 1.00 0.00 H new ATOM 1633 N ILE A 156 59.931 0.998 4.416 1.00 0.00 N ATOM 1634 CA ILE A 156 59.060 2.074 4.869 1.00 0.00 C ATOM 1635 C ILE A 156 58.055 2.433 3.784 1.00 0.00 C ATOM 1636 O ILE A 156 58.401 2.501 2.603 1.00 0.00 O ATOM 1637 CB ILE A 156 59.859 3.333 5.264 1.00 0.00 C ATOM 1638 CG1 ILE A 156 60.947 2.969 6.281 1.00 0.00 C ATOM 1639 CG2 ILE A 156 58.926 4.399 5.827 1.00 0.00 C ATOM 1640 CD1 ILE A 156 61.549 4.164 6.994 1.00 0.00 C ATOM 0 H ILE A 156 60.743 1.307 3.881 1.00 0.00 H new ATOM 0 HA ILE A 156 58.535 1.713 5.754 1.00 0.00 H new ATOM 0 HB ILE A 156 60.341 3.739 4.374 1.00 0.00 H new ATOM 0 HG12 ILE A 156 60.525 2.291 7.023 1.00 0.00 H new ATOM 0 HG13 ILE A 156 61.742 2.426 5.769 1.00 0.00 H new ATOM 0 HG21 ILE A 156 59.505 5.281 6.101 1.00 0.00 H new ATOM 0 HG22 ILE A 156 58.186 4.670 5.074 1.00 0.00 H new ATOM 0 HG23 ILE A 156 58.419 4.009 6.710 1.00 0.00 H new ATOM 0 HD11 ILE A 156 62.310 3.823 7.696 1.00 0.00 H new ATOM 0 HD12 ILE A 156 62.003 4.833 6.263 1.00 0.00 H new ATOM 0 HD13 ILE A 156 60.767 4.696 7.536 1.00 0.00 H new ATOM 1652 N HIS A 157 56.806 2.647 4.180 1.00 0.00 N ATOM 1653 CA HIS A 157 55.762 2.981 3.222 1.00 0.00 C ATOM 1654 C HIS A 157 54.938 4.185 3.660 1.00 0.00 C ATOM 1655 O HIS A 157 54.673 4.384 4.845 1.00 0.00 O ATOM 1656 CB HIS A 157 54.810 1.803 3.027 1.00 0.00 C ATOM 1657 CG HIS A 157 55.450 0.572 2.469 1.00 0.00 C ATOM 1658 ND1 HIS A 157 55.011 -0.037 1.315 1.00 0.00 N ATOM 1659 CD2 HIS A 157 56.483 -0.180 2.919 1.00 0.00 C ATOM 1660 CE1 HIS A 157 55.743 -1.108 1.076 1.00 0.00 C ATOM 1661 NE2 HIS A 157 56.644 -1.218 2.035 1.00 0.00 N ATOM 0 H HIS A 157 56.494 2.596 5.150 1.00 0.00 H new ATOM 0 HA HIS A 157 56.272 3.221 2.289 1.00 0.00 H new ATOM 0 HB2 HIS A 157 54.355 1.557 3.987 1.00 0.00 H new ATOM 0 HB3 HIS A 157 54.003 2.111 2.362 1.00 0.00 H new ATOM 0 HD2 HIS A 157 57.070 0.003 3.807 1.00 0.00 H new ATOM 0 HE1 HIS A 157 55.625 -1.780 0.239 1.00 0.00 H new ATOM 0 HE2 HIS A 157 57.346 -1.955 2.107 1.00 0.00 H new ATOM 1670 N ILE A 158 54.501 4.951 2.672 1.00 0.00 N ATOM 1671 CA ILE A 158 53.654 6.112 2.897 1.00 0.00 C ATOM 1672 C ILE A 158 52.345 5.912 2.151 1.00 0.00 C ATOM 1673 O ILE A 158 52.353 5.602 0.964 1.00 0.00 O ATOM 1674 CB ILE A 158 54.333 7.416 2.424 1.00 0.00 C ATOM 1675 CG1 ILE A 158 55.289 7.920 3.495 1.00 0.00 C ATOM 1676 CG2 ILE A 158 53.297 8.484 2.092 1.00 0.00 C ATOM 1677 CD1 ILE A 158 55.989 9.207 3.115 1.00 0.00 C ATOM 0 H ILE A 158 54.724 4.785 1.691 1.00 0.00 H new ATOM 0 HA ILE A 158 53.473 6.208 3.968 1.00 0.00 H new ATOM 0 HB ILE A 158 54.896 7.201 1.516 1.00 0.00 H new ATOM 0 HG12 ILE A 158 54.736 8.075 4.422 1.00 0.00 H new ATOM 0 HG13 ILE A 158 56.037 7.153 3.695 1.00 0.00 H new ATOM 0 HG21 ILE A 158 53.803 9.391 1.762 1.00 0.00 H new ATOM 0 HG22 ILE A 158 52.644 8.123 1.297 1.00 0.00 H new ATOM 0 HG23 ILE A 158 52.702 8.702 2.979 1.00 0.00 H new ATOM 0 HD11 ILE A 158 56.656 9.511 3.922 1.00 0.00 H new ATOM 0 HD12 ILE A 158 56.569 9.051 2.205 1.00 0.00 H new ATOM 0 HD13 ILE A 158 55.248 9.987 2.944 1.00 0.00 H new ATOM 1689 N ILE A 159 51.224 6.062 2.843 1.00 0.00 N ATOM 1690 CA ILE A 159 49.924 5.862 2.214 1.00 0.00 C ATOM 1691 C ILE A 159 49.099 7.144 2.180 1.00 0.00 C ATOM 1692 O ILE A 159 49.031 7.881 3.160 1.00 0.00 O ATOM 1693 CB ILE A 159 49.125 4.761 2.934 1.00 0.00 C ATOM 1694 CG1 ILE A 159 49.978 3.496 3.065 1.00 0.00 C ATOM 1695 CG2 ILE A 159 47.831 4.463 2.188 1.00 0.00 C ATOM 1696 CD1 ILE A 159 50.438 3.221 4.481 1.00 0.00 C ATOM 0 H ILE A 159 51.187 6.319 3.829 1.00 0.00 H new ATOM 0 HA ILE A 159 50.121 5.555 1.187 1.00 0.00 H new ATOM 0 HB ILE A 159 48.866 5.112 3.933 1.00 0.00 H new ATOM 0 HG12 ILE A 159 49.404 2.642 2.706 1.00 0.00 H new ATOM 0 HG13 ILE A 159 50.851 3.588 2.419 1.00 0.00 H new ATOM 0 HG21 ILE A 159 47.280 3.682 2.712 1.00 0.00 H new ATOM 0 HG22 ILE A 159 47.223 5.366 2.140 1.00 0.00 H new ATOM 0 HG23 ILE A 159 48.063 4.127 1.177 1.00 0.00 H new ATOM 0 HD11 ILE A 159 51.037 2.310 4.499 1.00 0.00 H new ATOM 0 HD12 ILE A 159 51.039 4.058 4.837 1.00 0.00 H new ATOM 0 HD13 ILE A 159 49.570 3.097 5.128 1.00 0.00 H new ATOM 1708 N LEU A 160 48.466 7.388 1.039 1.00 0.00 N ATOM 1709 CA LEU A 160 47.629 8.568 0.857 1.00 0.00 C ATOM 1710 C LEU A 160 46.218 8.155 0.457 1.00 0.00 C ATOM 1711 O LEU A 160 46.028 7.430 -0.520 1.00 0.00 O ATOM 1712 CB LEU A 160 48.237 9.487 -0.208 1.00 0.00 C ATOM 1713 CG LEU A 160 47.299 10.567 -0.754 1.00 0.00 C ATOM 1714 CD1 LEU A 160 48.072 11.837 -1.070 1.00 0.00 C ATOM 1715 CD2 LEU A 160 46.573 10.061 -1.992 1.00 0.00 C ATOM 0 H LEU A 160 48.517 6.781 0.221 1.00 0.00 H new ATOM 0 HA LEU A 160 47.578 9.112 1.800 1.00 0.00 H new ATOM 0 HB2 LEU A 160 49.117 9.973 0.214 1.00 0.00 H new ATOM 0 HB3 LEU A 160 48.581 8.873 -1.040 1.00 0.00 H new ATOM 0 HG LEU A 160 46.558 10.800 0.011 1.00 0.00 H new ATOM 0 HD11 LEU A 160 47.388 12.592 -1.457 1.00 0.00 H new ATOM 0 HD12 LEU A 160 48.548 12.209 -0.162 1.00 0.00 H new ATOM 0 HD13 LEU A 160 48.835 11.622 -1.818 1.00 0.00 H new ATOM 0 HD21 LEU A 160 45.910 10.840 -2.369 1.00 0.00 H new ATOM 0 HD22 LEU A 160 47.301 9.802 -2.760 1.00 0.00 H new ATOM 0 HD23 LEU A 160 45.987 9.179 -1.735 1.00 0.00 H new ATOM 1727 N ARG A 161 45.228 8.611 1.217 1.00 0.00 N ATOM 1728 CA ARG A 161 43.837 8.274 0.932 1.00 0.00 C ATOM 1729 C ARG A 161 43.304 9.095 -0.236 1.00 0.00 C ATOM 1730 O ARG A 161 43.368 10.324 -0.225 1.00 0.00 O ATOM 1731 CB ARG A 161 42.967 8.498 2.168 1.00 0.00 C ATOM 1732 CG ARG A 161 41.583 7.877 2.058 1.00 0.00 C ATOM 1733 CD ARG A 161 41.403 6.730 3.043 1.00 0.00 C ATOM 1734 NE ARG A 161 40.519 7.092 4.149 1.00 0.00 N ATOM 1735 CZ ARG A 161 39.954 6.207 4.965 1.00 0.00 C ATOM 1736 NH1 ARG A 161 40.180 4.908 4.806 1.00 0.00 N ATOM 1737 NH2 ARG A 161 39.163 6.620 5.947 1.00 0.00 N ATOM 0 H ARG A 161 45.361 9.212 2.031 1.00 0.00 H new ATOM 0 HA ARG A 161 43.798 7.220 0.658 1.00 0.00 H new ATOM 0 HB2 ARG A 161 43.474 8.083 3.039 1.00 0.00 H new ATOM 0 HB3 ARG A 161 42.863 9.569 2.340 1.00 0.00 H new ATOM 0 HG2 ARG A 161 40.826 8.639 2.244 1.00 0.00 H new ATOM 0 HG3 ARG A 161 41.427 7.513 1.043 1.00 0.00 H new ATOM 0 HD2 ARG A 161 40.995 5.865 2.521 1.00 0.00 H new ATOM 0 HD3 ARG A 161 42.375 6.435 3.438 1.00 0.00 H new ATOM 0 HE ARG A 161 40.324 8.081 4.304 1.00 0.00 H new ATOM 0 HH11 ARG A 161 40.790 4.585 4.055 1.00 0.00 H new ATOM 0 HH12 ARG A 161 39.744 4.234 5.435 1.00 0.00 H new ATOM 0 HH21 ARG A 161 38.988 7.617 6.076 1.00 0.00 H new ATOM 0 HH22 ARG A 161 38.730 5.941 6.573 1.00 0.00 H new ATOM 1751 N THR A 162 42.777 8.407 -1.245 1.00 0.00 N ATOM 1752 CA THR A 162 42.233 9.078 -2.420 1.00 0.00 C ATOM 1753 C THR A 162 40.714 9.181 -2.335 1.00 0.00 C ATOM 1754 O THR A 162 40.157 10.279 -2.310 1.00 0.00 O ATOM 1755 CB THR A 162 42.638 8.333 -3.694 1.00 0.00 C ATOM 1756 OG1 THR A 162 41.897 7.134 -3.833 1.00 0.00 O ATOM 1757 CG2 THR A 162 44.107 7.971 -3.735 1.00 0.00 C ATOM 0 H THR A 162 42.715 7.389 -1.272 1.00 0.00 H new ATOM 0 HA THR A 162 42.644 10.087 -2.453 1.00 0.00 H new ATOM 0 HB THR A 162 42.427 9.024 -4.510 1.00 0.00 H new ATOM 0 HG1 THR A 162 42.137 6.516 -3.112 1.00 0.00 H new ATOM 0 HG21 THR A 162 44.326 7.445 -4.664 1.00 0.00 H new ATOM 0 HG22 THR A 162 44.707 8.879 -3.682 1.00 0.00 H new ATOM 0 HG23 THR A 162 44.347 7.327 -2.889 1.00 0.00 H new ATOM 1765 N GLU A 163 40.048 8.031 -2.291 1.00 0.00 N ATOM 1766 CA GLU A 163 38.593 7.990 -2.212 1.00 0.00 C ATOM 1767 C GLU A 163 37.962 8.737 -3.384 1.00 0.00 C ATOM 1768 O GLU A 163 38.615 8.832 -4.443 1.00 0.00 O ATOM 1769 CB GLU A 163 38.115 8.594 -0.889 1.00 0.00 C ATOM 1770 CG GLU A 163 37.055 7.761 -0.188 1.00 0.00 C ATOM 1771 CD GLU A 163 37.492 6.325 0.028 1.00 0.00 C ATOM 1772 OE1 GLU A 163 38.546 6.115 0.664 1.00 0.00 O ATOM 1773 OE2 GLU A 163 36.779 5.411 -0.438 1.00 0.00 O ATOM 1774 OXT GLU A 163 36.819 9.219 -3.232 1.00 0.00 O ATOM 0 H GLU A 163 40.494 7.114 -2.309 1.00 0.00 H new ATOM 0 HA GLU A 163 38.281 6.947 -2.260 1.00 0.00 H new ATOM 0 HB2 GLU A 163 38.970 8.713 -0.224 1.00 0.00 H new ATOM 0 HB3 GLU A 163 37.716 9.591 -1.077 1.00 0.00 H new ATOM 0 HG2 GLU A 163 36.820 8.214 0.775 1.00 0.00 H new ATOM 0 HG3 GLU A 163 36.139 7.773 -0.778 1.00 0.00 H new