USER MOD reduce.3.24.130724 H: found=0, std=0, add=1173, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 1175 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: B 132 ASN : amide:sc= 2.03 K(o=2.7,f=-0.17) USER MOD Set 1.2: B 157 GLN : amide:sc= 0.642 K(o=2.7,f=1.2) USER MOD Set 2.1: A 28 ASN : amide:sc= 1.33 K(o=1.7,f=0.089) USER MOD Set 2.2: A 53 GLN : amide:sc= 0.374 K(o=1.7,f=0.88) USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 24 THR OG1 : rot 60:sc= 0.234 USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 HIS : no HE2:sc= 0.609 K(o=0.61,f=-2.2!) USER MOD Single : A 31 GLN : amide:sc= 0 K(o=0,f=-0.52) USER MOD Single : A 32 TYR OH : rot 180:sc= 0 USER MOD Single : A 33 SER OG : rot -90:sc= 0.949 USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 THR OG1 : rot -31:sc= 1.25 USER MOD Single : A 42 THR OG1 : rot 170:sc= -0.21 USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 51 THR OG1 : rot 180:sc= 0 USER MOD Single : A 52 GLN : amide:sc= -0.0364 X(o=-0.036,f=-0.45) USER MOD Single : A 56 HIS : no HE2:sc= 1.09 K(o=1.1,f=-3.5!) USER MOD Single : A 58 MET CE :methyl 168:sc= -0.7 (180deg=-1.04) USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 67 LYS NZ :NH3+ 172:sc= 1.79 (180deg=1.68) USER MOD Single : A 70 ASN : amide:sc= 1.13 K(o=1.1,f=0) USER MOD Single : A 83 SER OG : rot 180:sc=-0.00687 USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 120 SER OG : rot -132:sc= 1.29 USER MOD Single : B 128 THR OG1 : rot 63:sc= 0.563 USER MOD Single : B 131 LYS NZ :NH3+ 163:sc= -0.0345 (180deg=-0.29) USER MOD Single : B 134 HIS : no HE2:sc= 0.599 K(o=0.6,f=-2.7!) USER MOD Single : B 135 GLN : amide:sc= -0.144 X(o=-0.14,f=-0.18) USER MOD Single : B 136 TYR OH : rot 180:sc= 0 USER MOD Single : B 137 SER OG : rot -83:sc= 0.782 USER MOD Single : B 142 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 144 THR OG1 : rot 180:sc= 0 USER MOD Single : B 146 THR OG1 : rot -81:sc= 0.595 USER MOD Single : B 148 SER OG : rot 180:sc= 0 USER MOD Single : B 155 THR OG1 : rot 180:sc= 0 USER MOD Single : B 156 GLN : amide:sc= -0.211 K(o=-0.21,f=-1.1) USER MOD Single : B 160 HIS : no HD1:sc= -0.0763 K(o=-0.076,f=-4.2!) USER MOD Single : B 162 MET CE :methyl 157:sc= -0.329 (180deg=-1.39) USER MOD Single : B 171 LYS NZ :NH3+ -172:sc= 1.72 (180deg=1.37) USER MOD Single : B 174 ASN : amide:sc= 1.03 K(o=1,f=0) USER MOD Single : B 187 SER OG : rot 180:sc= 0 USER MOD Single : B 197 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 198 SER OG : rot 180:sc= 0 USER MOD Single : B 200 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 178 N GLU A 14 -15.467 12.595 -2.809 1.00 2.81 N ATOM 179 CA GLU A 14 -16.288 11.850 -3.780 1.00 2.84 C ATOM 180 C GLU A 14 -15.808 10.401 -4.027 1.00 2.42 C ATOM 181 O GLU A 14 -16.511 9.618 -4.675 1.00 2.45 O ATOM 182 CB GLU A 14 -16.380 12.673 -5.087 1.00 3.27 C ATOM 183 CG GLU A 14 -17.068 14.038 -4.879 1.00 4.29 C ATOM 184 CD GLU A 14 -17.201 14.848 -6.177 1.00 4.82 C ATOM 185 OE1 GLU A 14 -18.202 14.673 -6.916 1.00 6.19 O ATOM 186 OE2 GLU A 14 -16.320 15.698 -6.462 1.00 4.33 O ATOM 0 HA GLU A 14 -17.284 11.726 -3.354 1.00 2.84 H new ATOM 0 HB2 GLU A 14 -15.377 12.832 -5.484 1.00 3.27 H new ATOM 0 HB3 GLU A 14 -16.931 12.102 -5.834 1.00 3.27 H new ATOM 0 HG2 GLU A 14 -18.059 13.878 -4.454 1.00 4.29 H new ATOM 0 HG3 GLU A 14 -16.499 14.618 -4.152 1.00 4.29 H new ATOM 193 N PHE A 15 -14.637 10.032 -3.492 1.00 2.16 N ATOM 194 CA PHE A 15 -13.913 8.784 -3.791 1.00 1.78 C ATOM 195 C PHE A 15 -14.323 7.645 -2.834 1.00 1.55 C ATOM 196 O PHE A 15 -14.628 7.896 -1.659 1.00 1.53 O ATOM 197 CB PHE A 15 -12.375 8.976 -3.741 1.00 1.65 C ATOM 198 CG PHE A 15 -11.665 9.985 -4.652 1.00 1.89 C ATOM 199 CD1 PHE A 15 -12.248 11.188 -5.112 1.00 3.31 C ATOM 200 CD2 PHE A 15 -10.333 9.707 -5.024 1.00 1.86 C ATOM 201 CE1 PHE A 15 -11.535 12.050 -5.966 1.00 3.54 C ATOM 202 CE2 PHE A 15 -9.624 10.560 -5.887 1.00 2.05 C ATOM 203 CZ PHE A 15 -10.227 11.732 -6.366 1.00 2.42 C ATOM 0 H PHE A 15 -14.147 10.615 -2.813 1.00 2.16 H new ATOM 0 HA PHE A 15 -14.192 8.507 -4.808 1.00 1.78 H new ATOM 0 HB2 PHE A 15 -12.122 9.242 -2.715 1.00 1.65 H new ATOM 0 HB3 PHE A 15 -11.927 8.002 -3.937 1.00 1.65 H new ATOM 0 HD1 PHE A 15 -13.250 11.448 -4.805 1.00 3.31 H new ATOM 0 HD2 PHE A 15 -9.849 8.822 -4.638 1.00 1.86 H new ATOM 0 HE1 PHE A 15 -11.997 12.962 -6.316 1.00 3.54 H new ATOM 0 HE2 PHE A 15 -8.615 10.313 -6.181 1.00 2.05 H new ATOM 0 HZ PHE A 15 -9.689 12.385 -7.037 1.00 2.42 H new ATOM 213 N SER A 16 -14.256 6.388 -3.292 1.00 1.44 N ATOM 214 CA SER A 16 -14.468 5.205 -2.439 1.00 1.31 C ATOM 215 C SER A 16 -13.429 5.144 -1.310 1.00 0.98 C ATOM 216 O SER A 16 -12.331 5.685 -1.439 1.00 0.82 O ATOM 217 CB SER A 16 -14.409 3.915 -3.269 1.00 1.36 C ATOM 218 OG SER A 16 -15.542 3.812 -4.109 1.00 2.32 O ATOM 0 H SER A 16 -14.053 6.160 -4.265 1.00 1.44 H new ATOM 0 HA SER A 16 -15.460 5.294 -1.995 1.00 1.31 H new ATOM 0 HB2 SER A 16 -13.501 3.905 -3.871 1.00 1.36 H new ATOM 0 HB3 SER A 16 -14.361 3.051 -2.606 1.00 1.36 H new ATOM 0 HG SER A 16 -15.487 2.985 -4.632 1.00 2.32 H new ATOM 224 N ASP A 17 -13.732 4.470 -0.198 1.00 1.00 N ATOM 225 CA ASP A 17 -12.831 4.425 0.967 1.00 0.85 C ATOM 226 C ASP A 17 -11.439 3.862 0.634 1.00 0.65 C ATOM 227 O ASP A 17 -10.446 4.378 1.146 1.00 0.61 O ATOM 228 CB ASP A 17 -13.472 3.644 2.128 1.00 1.17 C ATOM 229 CG ASP A 17 -14.625 4.387 2.807 1.00 1.49 C ATOM 230 OD1 ASP A 17 -14.694 5.635 2.719 1.00 2.18 O ATOM 231 OD2 ASP A 17 -15.468 3.732 3.461 1.00 2.36 O ATOM 0 H ASP A 17 -14.597 3.944 -0.075 1.00 1.00 H new ATOM 0 HA ASP A 17 -12.680 5.459 1.277 1.00 0.85 H new ATOM 0 HB2 ASP A 17 -13.838 2.688 1.753 1.00 1.17 H new ATOM 0 HB3 ASP A 17 -12.706 3.422 2.872 1.00 1.17 H new ATOM 236 N VAL A 18 -11.348 2.893 -0.284 1.00 0.66 N ATOM 237 CA VAL A 18 -10.076 2.349 -0.810 1.00 0.52 C ATOM 238 C VAL A 18 -9.346 3.348 -1.727 1.00 0.51 C ATOM 239 O VAL A 18 -8.119 3.404 -1.766 1.00 0.55 O ATOM 240 CB VAL A 18 -10.355 1.015 -1.535 1.00 0.62 C ATOM 241 CG1 VAL A 18 -11.073 1.190 -2.876 1.00 0.72 C ATOM 242 CG2 VAL A 18 -9.092 0.189 -1.786 1.00 0.71 C ATOM 0 H VAL A 18 -12.170 2.451 -0.695 1.00 0.66 H new ATOM 0 HA VAL A 18 -9.406 2.169 0.030 1.00 0.52 H new ATOM 0 HB VAL A 18 -11.007 0.483 -0.843 1.00 0.62 H new ATOM 0 HG11 VAL A 18 -11.237 0.213 -3.331 1.00 0.72 H new ATOM 0 HG12 VAL A 18 -12.033 1.681 -2.714 1.00 0.72 H new ATOM 0 HG13 VAL A 18 -10.461 1.801 -3.539 1.00 0.72 H new ATOM 0 HG21 VAL A 18 -9.358 -0.736 -2.298 1.00 0.71 H new ATOM 0 HG22 VAL A 18 -8.400 0.761 -2.405 1.00 0.71 H new ATOM 0 HG23 VAL A 18 -8.617 -0.048 -0.834 1.00 0.71 H new ATOM 252 N GLU A 19 -10.115 4.169 -2.441 1.00 0.69 N ATOM 253 CA GLU A 19 -9.695 5.084 -3.508 1.00 0.90 C ATOM 254 C GLU A 19 -9.126 6.398 -2.961 1.00 0.94 C ATOM 255 O GLU A 19 -8.225 6.987 -3.566 1.00 1.33 O ATOM 256 CB GLU A 19 -10.915 5.273 -4.417 1.00 1.17 C ATOM 257 CG GLU A 19 -10.641 5.964 -5.756 1.00 1.43 C ATOM 258 CD GLU A 19 -11.911 6.160 -6.600 1.00 1.66 C ATOM 259 OE1 GLU A 19 -13.030 6.342 -6.049 1.00 2.76 O ATOM 260 OE2 GLU A 19 -11.773 6.219 -7.842 1.00 1.76 O ATOM 0 H GLU A 19 -11.121 4.218 -2.279 1.00 0.69 H new ATOM 0 HA GLU A 19 -8.866 4.668 -4.081 1.00 0.90 H new ATOM 0 HB2 GLU A 19 -11.353 4.295 -4.616 1.00 1.17 H new ATOM 0 HB3 GLU A 19 -11.663 5.852 -3.876 1.00 1.17 H new ATOM 0 HG2 GLU A 19 -10.181 6.935 -5.571 1.00 1.43 H new ATOM 0 HG3 GLU A 19 -9.922 5.373 -6.323 1.00 1.43 H new ATOM 267 N ARG A 20 -9.568 6.798 -1.762 1.00 0.69 N ATOM 268 CA ARG A 20 -8.830 7.743 -0.912 1.00 0.63 C ATOM 269 C ARG A 20 -7.696 7.068 -0.130 1.00 0.62 C ATOM 270 O ARG A 20 -6.607 7.628 -0.093 1.00 1.01 O ATOM 271 CB ARG A 20 -9.782 8.567 -0.030 1.00 0.73 C ATOM 272 CG ARG A 20 -10.667 7.757 0.927 1.00 1.00 C ATOM 273 CD ARG A 20 -11.493 8.697 1.810 1.00 1.45 C ATOM 274 NE ARG A 20 -12.416 7.965 2.692 1.00 2.04 N ATOM 275 CZ ARG A 20 -13.139 8.483 3.666 1.00 2.82 C ATOM 276 NH1 ARG A 20 -13.105 9.742 3.977 1.00 3.56 N ATOM 277 NH2 ARG A 20 -13.943 7.727 4.348 1.00 3.44 N ATOM 0 H ARG A 20 -10.446 6.477 -1.354 1.00 0.69 H new ATOM 0 HA ARG A 20 -8.332 8.455 -1.570 1.00 0.63 H new ATOM 0 HB2 ARG A 20 -9.189 9.268 0.558 1.00 0.73 H new ATOM 0 HB3 ARG A 20 -10.427 9.160 -0.678 1.00 0.73 H new ATOM 0 HG2 ARG A 20 -11.330 7.106 0.357 1.00 1.00 H new ATOM 0 HG3 ARG A 20 -10.046 7.113 1.550 1.00 1.00 H new ATOM 0 HD2 ARG A 20 -10.822 9.307 2.415 1.00 1.45 H new ATOM 0 HD3 ARG A 20 -12.062 9.380 1.178 1.00 1.45 H new ATOM 0 HE ARG A 20 -12.505 6.961 2.535 1.00 2.04 H new ATOM 0 HH11 ARG A 20 -12.500 10.379 3.459 1.00 3.56 H new ATOM 0 HH12 ARG A 20 -13.684 10.095 4.739 1.00 3.56 H new ATOM 0 HH21 ARG A 20 -14.016 6.733 4.131 1.00 3.44 H new ATOM 0 HH22 ARG A 20 -14.503 8.127 5.101 1.00 3.44 H new ATOM 291 N ALA A 21 -7.884 5.859 0.416 1.00 0.52 N ATOM 292 CA ALA A 21 -6.911 5.240 1.329 1.00 0.54 C ATOM 293 C ALA A 21 -5.488 5.093 0.749 1.00 0.49 C ATOM 294 O ALA A 21 -4.523 5.343 1.475 1.00 0.44 O ATOM 295 CB ALA A 21 -7.432 3.892 1.827 1.00 0.59 C ATOM 0 H ALA A 21 -8.709 5.285 0.240 1.00 0.52 H new ATOM 0 HA ALA A 21 -6.811 5.933 2.164 1.00 0.54 H new ATOM 0 HB1 ALA A 21 -6.701 3.446 2.502 1.00 0.59 H new ATOM 0 HB2 ALA A 21 -8.373 4.039 2.357 1.00 0.59 H new ATOM 0 HB3 ALA A 21 -7.594 3.228 0.978 1.00 0.59 H new ATOM 301 N ILE A 22 -5.332 4.749 -0.542 1.00 0.51 N ATOM 302 CA ILE A 22 -4.001 4.628 -1.173 1.00 0.50 C ATOM 303 C ILE A 22 -3.296 5.993 -1.142 1.00 0.51 C ATOM 304 O ILE A 22 -2.119 6.067 -0.799 1.00 0.57 O ATOM 305 CB ILE A 22 -4.052 4.044 -2.616 1.00 0.51 C ATOM 306 CG1 ILE A 22 -4.848 2.725 -2.734 1.00 0.61 C ATOM 307 CG2 ILE A 22 -2.621 3.810 -3.140 1.00 0.54 C ATOM 308 CD1 ILE A 22 -5.478 2.547 -4.121 1.00 0.72 C ATOM 0 H ILE A 22 -6.110 4.549 -1.171 1.00 0.51 H new ATOM 0 HA ILE A 22 -3.426 3.907 -0.592 1.00 0.50 H new ATOM 0 HB ILE A 22 -4.577 4.787 -3.217 1.00 0.51 H new ATOM 0 HG12 ILE A 22 -4.186 1.884 -2.528 1.00 0.61 H new ATOM 0 HG13 ILE A 22 -5.632 2.707 -1.977 1.00 0.61 H new ATOM 0 HG21 ILE A 22 -2.665 3.402 -4.150 1.00 0.54 H new ATOM 0 HG22 ILE A 22 -2.080 4.756 -3.155 1.00 0.54 H new ATOM 0 HG23 ILE A 22 -2.105 3.107 -2.487 1.00 0.54 H new ATOM 0 HD11 ILE A 22 -6.026 1.606 -4.153 1.00 0.72 H new ATOM 0 HD12 ILE A 22 -6.162 3.372 -4.319 1.00 0.72 H new ATOM 0 HD13 ILE A 22 -4.694 2.536 -4.878 1.00 0.72 H new ATOM 320 N GLU A 23 -4.023 7.088 -1.396 1.00 0.50 N ATOM 321 CA GLU A 23 -3.472 8.440 -1.264 1.00 0.54 C ATOM 322 C GLU A 23 -3.254 8.855 0.191 1.00 0.51 C ATOM 323 O GLU A 23 -2.251 9.497 0.482 1.00 0.53 O ATOM 324 CB GLU A 23 -4.344 9.501 -1.952 1.00 0.79 C ATOM 325 CG GLU A 23 -4.102 9.550 -3.458 1.00 1.34 C ATOM 326 CD GLU A 23 -4.759 10.801 -4.053 1.00 2.07 C ATOM 327 OE1 GLU A 23 -4.125 11.879 -4.063 1.00 2.52 O ATOM 328 OE2 GLU A 23 -5.925 10.735 -4.516 1.00 3.26 O ATOM 0 H GLU A 23 -4.998 7.062 -1.695 1.00 0.50 H new ATOM 0 HA GLU A 23 -2.505 8.392 -1.764 1.00 0.54 H new ATOM 0 HB2 GLU A 23 -5.395 9.286 -1.760 1.00 0.79 H new ATOM 0 HB3 GLU A 23 -4.134 10.479 -1.519 1.00 0.79 H new ATOM 0 HG2 GLU A 23 -3.031 9.559 -3.663 1.00 1.34 H new ATOM 0 HG3 GLU A 23 -4.509 8.656 -3.930 1.00 1.34 H new ATOM 335 N THR A 24 -4.142 8.472 1.112 1.00 0.55 N ATOM 336 CA THR A 24 -4.046 8.832 2.537 1.00 0.66 C ATOM 337 C THR A 24 -2.716 8.354 3.116 1.00 0.69 C ATOM 338 O THR A 24 -2.009 9.113 3.784 1.00 0.82 O ATOM 339 CB THR A 24 -5.188 8.192 3.352 1.00 0.67 C ATOM 340 OG1 THR A 24 -6.457 8.528 2.836 1.00 0.86 O ATOM 341 CG2 THR A 24 -5.190 8.586 4.828 1.00 0.86 C ATOM 0 H THR A 24 -4.956 7.898 0.892 1.00 0.55 H new ATOM 0 HA THR A 24 -4.119 9.918 2.604 1.00 0.66 H new ATOM 0 HB THR A 24 -5.000 7.122 3.268 1.00 0.67 H new ATOM 0 HG1 THR A 24 -6.526 8.217 1.909 1.00 0.86 H new ATOM 0 HG21 THR A 24 -6.022 8.096 5.334 1.00 0.86 H new ATOM 0 HG22 THR A 24 -4.252 8.276 5.289 1.00 0.86 H new ATOM 0 HG23 THR A 24 -5.298 9.667 4.916 1.00 0.86 H new ATOM 349 N LEU A 25 -2.332 7.106 2.829 1.00 0.67 N ATOM 350 CA LEU A 25 -1.088 6.552 3.365 1.00 0.80 C ATOM 351 C LEU A 25 0.158 6.965 2.569 1.00 0.65 C ATOM 352 O LEU A 25 1.206 7.187 3.172 1.00 0.69 O ATOM 353 CB LEU A 25 -1.238 5.066 3.635 1.00 1.25 C ATOM 354 CG LEU A 25 -1.269 4.146 2.410 1.00 0.52 C ATOM 355 CD1 LEU A 25 0.059 3.419 2.303 1.00 0.97 C ATOM 356 CD2 LEU A 25 -2.318 3.079 2.656 1.00 0.86 C ATOM 0 H LEU A 25 -2.860 6.467 2.234 1.00 0.67 H new ATOM 0 HA LEU A 25 -0.899 7.008 4.337 1.00 0.80 H new ATOM 0 HB2 LEU A 25 -0.415 4.751 4.277 1.00 1.25 H new ATOM 0 HB3 LEU A 25 -2.158 4.913 4.199 1.00 1.25 H new ATOM 0 HG LEU A 25 -1.474 4.732 1.514 1.00 0.52 H new ATOM 0 HD11 LEU A 25 0.045 2.762 1.433 1.00 0.97 H new ATOM 0 HD12 LEU A 25 0.864 4.146 2.196 1.00 0.97 H new ATOM 0 HD13 LEU A 25 0.223 2.826 3.203 1.00 0.97 H new ATOM 0 HD21 LEU A 25 -2.362 2.408 1.798 1.00 0.86 H new ATOM 0 HD22 LEU A 25 -2.056 2.510 3.548 1.00 0.86 H new ATOM 0 HD23 LEU A 25 -3.290 3.551 2.798 1.00 0.86 H new ATOM 368 N ILE A 26 0.028 7.187 1.256 1.00 0.60 N ATOM 369 CA ILE A 26 1.082 7.802 0.438 1.00 0.69 C ATOM 370 C ILE A 26 1.391 9.232 0.903 1.00 0.55 C ATOM 371 O ILE A 26 2.557 9.556 1.118 1.00 0.54 O ATOM 372 CB ILE A 26 0.711 7.708 -1.062 1.00 0.91 C ATOM 373 CG1 ILE A 26 0.996 6.298 -1.632 1.00 1.70 C ATOM 374 CG2 ILE A 26 1.382 8.783 -1.931 1.00 1.26 C ATOM 375 CD1 ILE A 26 2.455 5.823 -1.540 1.00 1.88 C ATOM 0 H ILE A 26 -0.811 6.945 0.729 1.00 0.60 H new ATOM 0 HA ILE A 26 2.010 7.247 0.572 1.00 0.69 H new ATOM 0 HB ILE A 26 -0.362 7.896 -1.106 1.00 0.91 H new ATOM 0 HG12 ILE A 26 0.366 5.580 -1.107 1.00 1.70 H new ATOM 0 HG13 ILE A 26 0.693 6.282 -2.679 1.00 1.70 H new ATOM 0 HG21 ILE A 26 1.076 8.655 -2.969 1.00 1.26 H new ATOM 0 HG22 ILE A 26 1.082 9.771 -1.583 1.00 1.26 H new ATOM 0 HG23 ILE A 26 2.465 8.686 -1.858 1.00 1.26 H new ATOM 0 HD11 ILE A 26 2.540 4.824 -1.968 1.00 1.88 H new ATOM 0 HD12 ILE A 26 3.097 6.510 -2.091 1.00 1.88 H new ATOM 0 HD13 ILE A 26 2.764 5.797 -0.495 1.00 1.88 H new ATOM 387 N LYS A 27 0.388 10.077 1.175 1.00 0.50 N ATOM 388 CA LYS A 27 0.615 11.428 1.717 1.00 0.54 C ATOM 389 C LYS A 27 1.368 11.416 3.042 1.00 0.46 C ATOM 390 O LYS A 27 2.120 12.351 3.298 1.00 0.52 O ATOM 391 CB LYS A 27 -0.705 12.217 1.840 1.00 0.74 C ATOM 392 CG LYS A 27 -1.244 12.801 0.519 1.00 0.96 C ATOM 393 CD LYS A 27 -0.192 13.660 -0.208 1.00 1.45 C ATOM 394 CE LYS A 27 -0.770 14.486 -1.361 1.00 1.98 C ATOM 395 NZ LYS A 27 0.327 15.124 -2.131 1.00 3.74 N ATOM 0 H LYS A 27 -0.595 9.849 1.028 1.00 0.50 H new ATOM 0 HA LYS A 27 1.254 11.940 0.997 1.00 0.54 H new ATOM 0 HB2 LYS A 27 -1.464 11.561 2.265 1.00 0.74 H new ATOM 0 HB3 LYS A 27 -0.557 13.034 2.547 1.00 0.74 H new ATOM 0 HG2 LYS A 27 -1.561 11.988 -0.134 1.00 0.96 H new ATOM 0 HG3 LYS A 27 -2.127 13.407 0.725 1.00 0.96 H new ATOM 0 HD2 LYS A 27 0.277 14.332 0.511 1.00 1.45 H new ATOM 0 HD3 LYS A 27 0.593 13.010 -0.595 1.00 1.45 H new ATOM 0 HE2 LYS A 27 -1.361 13.846 -2.017 1.00 1.98 H new ATOM 0 HE3 LYS A 27 -1.443 15.250 -0.970 1.00 1.98 H new ATOM 0 HZ1 LYS A 27 -0.075 15.682 -2.911 1.00 3.74 H new ATOM 0 HZ2 LYS A 27 0.873 15.749 -1.504 1.00 3.74 H new ATOM 0 HZ3 LYS A 27 0.953 14.389 -2.518 1.00 3.74 H new ATOM 409 N ASN A 28 1.286 10.351 3.842 1.00 0.41 N ATOM 410 CA ASN A 28 2.053 10.282 5.085 1.00 0.42 C ATOM 411 C ASN A 28 3.570 10.101 4.888 1.00 0.40 C ATOM 412 O ASN A 28 4.322 10.548 5.755 1.00 0.49 O ATOM 413 CB ASN A 28 1.430 9.268 6.062 1.00 0.48 C ATOM 414 CG ASN A 28 0.270 9.868 6.836 1.00 0.62 C ATOM 415 OD1 ASN A 28 0.421 10.315 7.967 1.00 0.82 O ATOM 416 ND2 ASN A 28 -0.906 9.919 6.259 1.00 0.71 N ATOM 0 H ASN A 28 0.704 9.535 3.654 1.00 0.41 H new ATOM 0 HA ASN A 28 1.978 11.266 5.549 1.00 0.42 H new ATOM 0 HB2 ASN A 28 1.084 8.395 5.508 1.00 0.48 H new ATOM 0 HB3 ASN A 28 2.192 8.921 6.760 1.00 0.48 H new ATOM 0 HD21 ASN A 28 -1.698 10.332 6.751 1.00 0.71 H new ATOM 0 HD22 ASN A 28 -1.029 9.546 5.318 1.00 0.71 H new ATOM 423 N PHE A 29 4.037 9.589 3.739 1.00 0.37 N ATOM 424 CA PHE A 29 5.445 9.731 3.333 1.00 0.42 C ATOM 425 C PHE A 29 5.818 11.217 3.253 1.00 0.49 C ATOM 426 O PHE A 29 6.777 11.656 3.884 1.00 0.59 O ATOM 427 CB PHE A 29 5.668 9.037 1.975 1.00 0.47 C ATOM 428 CG PHE A 29 7.050 9.178 1.355 1.00 0.50 C ATOM 429 CD1 PHE A 29 7.380 10.317 0.596 1.00 1.99 C ATOM 430 CD2 PHE A 29 7.979 8.130 1.455 1.00 1.65 C ATOM 431 CE1 PHE A 29 8.625 10.410 -0.051 1.00 2.08 C ATOM 432 CE2 PHE A 29 9.212 8.202 0.783 1.00 1.63 C ATOM 433 CZ PHE A 29 9.538 9.346 0.036 1.00 0.71 C ATOM 0 H PHE A 29 3.461 9.073 3.074 1.00 0.37 H new ATOM 0 HA PHE A 29 6.086 9.255 4.075 1.00 0.42 H new ATOM 0 HB2 PHE A 29 5.456 7.975 2.097 1.00 0.47 H new ATOM 0 HB3 PHE A 29 4.936 9.429 1.268 1.00 0.47 H new ATOM 0 HD1 PHE A 29 6.670 11.127 0.510 1.00 1.99 H new ATOM 0 HD2 PHE A 29 7.745 7.262 2.053 1.00 1.65 H new ATOM 0 HE1 PHE A 29 8.878 11.297 -0.613 1.00 2.08 H new ATOM 0 HE2 PHE A 29 9.908 7.378 0.841 1.00 1.63 H new ATOM 0 HZ PHE A 29 10.490 9.407 -0.471 1.00 0.71 H new ATOM 443 N HIS A 30 5.020 12.011 2.535 1.00 0.53 N ATOM 444 CA HIS A 30 5.269 13.433 2.274 1.00 0.69 C ATOM 445 C HIS A 30 5.012 14.346 3.491 1.00 0.74 C ATOM 446 O HIS A 30 5.554 15.447 3.554 1.00 1.04 O ATOM 447 CB HIS A 30 4.447 13.854 1.049 1.00 0.84 C ATOM 448 CG HIS A 30 4.732 13.022 -0.181 1.00 1.02 C ATOM 449 ND1 HIS A 30 5.822 13.137 -1.018 1.00 1.90 N ATOM 450 CD2 HIS A 30 3.977 11.984 -0.657 1.00 0.67 C ATOM 451 CE1 HIS A 30 5.695 12.227 -1.998 1.00 1.97 C ATOM 452 NE2 HIS A 30 4.569 11.512 -1.832 1.00 1.16 N ATOM 0 H HIS A 30 4.158 11.674 2.106 1.00 0.53 H new ATOM 0 HA HIS A 30 6.332 13.559 2.069 1.00 0.69 H new ATOM 0 HB2 HIS A 30 3.386 13.781 1.290 1.00 0.84 H new ATOM 0 HB3 HIS A 30 4.652 14.901 0.826 1.00 0.84 H new ATOM 0 HD1 HIS A 30 6.591 13.798 -0.911 1.00 1.90 H new ATOM 0 HD2 HIS A 30 3.077 11.596 -0.202 1.00 0.67 H new ATOM 0 HE1 HIS A 30 6.399 12.089 -2.806 1.00 1.97 H new ATOM 460 N GLN A 31 4.239 13.897 4.488 1.00 0.61 N ATOM 461 CA GLN A 31 4.122 14.571 5.790 1.00 0.67 C ATOM 462 C GLN A 31 5.376 14.373 6.667 1.00 0.61 C ATOM 463 O GLN A 31 5.823 15.330 7.306 1.00 0.77 O ATOM 464 CB GLN A 31 2.863 14.095 6.544 1.00 0.78 C ATOM 465 CG GLN A 31 1.518 14.493 5.901 1.00 1.36 C ATOM 466 CD GLN A 31 1.221 15.992 5.900 1.00 2.13 C ATOM 467 OE1 GLN A 31 1.913 16.810 6.496 1.00 3.02 O ATOM 468 NE2 GLN A 31 0.168 16.417 5.246 1.00 3.08 N ATOM 0 H GLN A 31 3.674 13.051 4.415 1.00 0.61 H new ATOM 0 HA GLN A 31 4.031 15.638 5.585 1.00 0.67 H new ATOM 0 HB2 GLN A 31 2.899 13.009 6.628 1.00 0.78 H new ATOM 0 HB3 GLN A 31 2.894 14.494 7.558 1.00 0.78 H new ATOM 0 HG2 GLN A 31 1.504 14.135 4.872 1.00 1.36 H new ATOM 0 HG3 GLN A 31 0.714 13.979 6.428 1.00 1.36 H new ATOM 0 HE21 GLN A 31 -0.422 15.754 4.743 1.00 3.08 H new ATOM 0 HE22 GLN A 31 -0.062 17.411 5.240 1.00 3.08 H new ATOM 477 N TYR A 32 5.957 13.163 6.700 1.00 0.65 N ATOM 478 CA TYR A 32 7.091 12.830 7.583 1.00 0.67 C ATOM 479 C TYR A 32 8.486 13.038 6.984 1.00 0.73 C ATOM 480 O TYR A 32 9.428 13.199 7.756 1.00 0.96 O ATOM 481 CB TYR A 32 6.943 11.411 8.153 1.00 0.61 C ATOM 482 CG TYR A 32 6.248 11.392 9.500 1.00 0.62 C ATOM 483 CD1 TYR A 32 4.849 11.519 9.570 1.00 1.87 C ATOM 484 CD2 TYR A 32 7.002 11.268 10.686 1.00 1.86 C ATOM 485 CE1 TYR A 32 4.204 11.520 10.820 1.00 1.85 C ATOM 486 CE2 TYR A 32 6.355 11.203 11.936 1.00 1.95 C ATOM 487 CZ TYR A 32 4.952 11.346 12.007 1.00 0.79 C ATOM 488 OH TYR A 32 4.328 11.309 13.215 1.00 0.92 O ATOM 0 H TYR A 32 5.654 12.385 6.114 1.00 0.65 H new ATOM 0 HA TYR A 32 7.032 13.562 8.388 1.00 0.67 H new ATOM 0 HB2 TYR A 32 6.380 10.798 7.449 1.00 0.61 H new ATOM 0 HB3 TYR A 32 7.930 10.958 8.251 1.00 0.61 H new ATOM 0 HD1 TYR A 32 4.270 11.616 8.664 1.00 1.87 H new ATOM 0 HD2 TYR A 32 8.080 11.223 10.636 1.00 1.86 H new ATOM 0 HE1 TYR A 32 3.134 11.654 10.873 1.00 1.85 H new ATOM 0 HE2 TYR A 32 6.930 11.044 12.836 1.00 1.95 H new ATOM 0 HH TYR A 32 4.993 11.182 13.923 1.00 0.92 H new ATOM 498 N SER A 33 8.639 13.071 5.659 1.00 0.70 N ATOM 499 CA SER A 33 9.921 13.292 4.964 1.00 0.74 C ATOM 500 C SER A 33 10.380 14.756 5.008 1.00 0.89 C ATOM 501 O SER A 33 10.480 15.439 3.987 1.00 1.16 O ATOM 502 CB SER A 33 9.874 12.751 3.528 1.00 0.75 C ATOM 503 OG SER A 33 8.689 13.119 2.855 1.00 1.79 O ATOM 0 H SER A 33 7.857 12.942 5.017 1.00 0.70 H new ATOM 0 HA SER A 33 10.675 12.725 5.510 1.00 0.74 H new ATOM 0 HB2 SER A 33 10.735 13.124 2.973 1.00 0.75 H new ATOM 0 HB3 SER A 33 9.955 11.664 3.549 1.00 0.75 H new ATOM 0 HG SER A 33 8.005 12.432 2.997 1.00 1.79 H new ATOM 509 N VAL A 34 10.664 15.277 6.202 1.00 0.95 N ATOM 510 CA VAL A 34 11.196 16.643 6.368 1.00 1.08 C ATOM 511 C VAL A 34 12.725 16.663 6.367 1.00 1.16 C ATOM 512 O VAL A 34 13.327 17.586 5.817 1.00 1.35 O ATOM 513 CB VAL A 34 10.590 17.371 7.578 1.00 1.33 C ATOM 514 CG1 VAL A 34 9.066 17.451 7.449 1.00 2.50 C ATOM 515 CG2 VAL A 34 10.926 16.718 8.919 1.00 2.04 C ATOM 0 H VAL A 34 10.535 14.774 7.080 1.00 0.95 H new ATOM 0 HA VAL A 34 10.879 17.212 5.494 1.00 1.08 H new ATOM 0 HB VAL A 34 11.036 18.365 7.572 1.00 1.33 H new ATOM 0 HG11 VAL A 34 8.654 17.970 8.315 1.00 2.50 H new ATOM 0 HG12 VAL A 34 8.806 17.996 6.542 1.00 2.50 H new ATOM 0 HG13 VAL A 34 8.652 16.444 7.399 1.00 2.50 H new ATOM 0 HG21 VAL A 34 10.464 17.287 9.726 1.00 2.04 H new ATOM 0 HG22 VAL A 34 10.546 15.696 8.932 1.00 2.04 H new ATOM 0 HG23 VAL A 34 12.007 16.705 9.057 1.00 2.04 H new ATOM 525 N GLU A 35 13.383 15.611 6.864 1.00 1.18 N ATOM 526 CA GLU A 35 14.830 15.451 6.692 1.00 1.40 C ATOM 527 C GLU A 35 15.144 14.927 5.279 1.00 1.60 C ATOM 528 O GLU A 35 16.044 15.456 4.621 1.00 1.88 O ATOM 529 CB GLU A 35 15.387 14.532 7.786 1.00 1.48 C ATOM 530 CG GLU A 35 16.907 14.653 7.948 1.00 1.94 C ATOM 531 CD GLU A 35 17.305 15.930 8.695 1.00 2.29 C ATOM 532 OE1 GLU A 35 17.297 15.920 9.951 1.00 2.78 O ATOM 533 OE2 GLU A 35 17.660 16.942 8.042 1.00 3.16 O ATOM 0 H GLU A 35 12.937 14.858 7.388 1.00 1.18 H new ATOM 0 HA GLU A 35 15.320 16.420 6.794 1.00 1.40 H new ATOM 0 HB2 GLU A 35 14.905 14.770 8.734 1.00 1.48 H new ATOM 0 HB3 GLU A 35 15.133 13.499 7.550 1.00 1.48 H new ATOM 0 HG2 GLU A 35 17.284 13.785 8.488 1.00 1.94 H new ATOM 0 HG3 GLU A 35 17.378 14.646 6.965 1.00 1.94 H new ATOM 540 N GLY A 36 14.326 14.003 4.759 1.00 1.68 N ATOM 541 CA GLY A 36 14.393 13.463 3.392 1.00 2.07 C ATOM 542 C GLY A 36 13.893 14.378 2.257 1.00 1.88 C ATOM 543 O GLY A 36 13.743 13.912 1.125 1.00 2.51 O ATOM 0 H GLY A 36 13.566 13.593 5.302 1.00 1.68 H new ATOM 0 HA2 GLY A 36 15.429 13.197 3.182 1.00 2.07 H new ATOM 0 HA3 GLY A 36 13.815 12.539 3.363 1.00 2.07 H new ATOM 547 N GLY A 37 13.619 15.661 2.525 1.00 2.19 N ATOM 548 CA GLY A 37 13.369 16.676 1.489 1.00 2.35 C ATOM 549 C GLY A 37 12.090 16.469 0.664 1.00 2.11 C ATOM 550 O GLY A 37 12.106 16.689 -0.547 1.00 2.61 O ATOM 0 H GLY A 37 13.564 16.029 3.475 1.00 2.19 H new ATOM 0 HA2 GLY A 37 13.319 17.655 1.967 1.00 2.35 H new ATOM 0 HA3 GLY A 37 14.221 16.696 0.809 1.00 2.35 H new ATOM 554 N LYS A 38 11.020 15.970 1.294 1.00 1.96 N ATOM 555 CA LYS A 38 9.681 15.626 0.759 1.00 1.84 C ATOM 556 C LYS A 38 9.612 14.600 -0.385 1.00 1.74 C ATOM 557 O LYS A 38 8.519 14.205 -0.794 1.00 1.85 O ATOM 558 CB LYS A 38 8.858 16.904 0.486 1.00 2.07 C ATOM 559 CG LYS A 38 7.456 16.781 1.109 1.00 2.58 C ATOM 560 CD LYS A 38 6.521 17.955 0.778 1.00 3.19 C ATOM 561 CE LYS A 38 6.971 19.277 1.413 1.00 3.22 C ATOM 562 NZ LYS A 38 6.000 20.374 1.168 1.00 4.26 N ATOM 0 H LYS A 38 11.067 15.774 2.294 1.00 1.96 H new ATOM 0 HA LYS A 38 9.212 15.061 1.565 1.00 1.84 H new ATOM 0 HB2 LYS A 38 9.372 17.771 0.900 1.00 2.07 H new ATOM 0 HB3 LYS A 38 8.773 17.067 -0.588 1.00 2.07 H new ATOM 0 HG2 LYS A 38 6.996 15.855 0.764 1.00 2.58 H new ATOM 0 HG3 LYS A 38 7.556 16.703 2.192 1.00 2.58 H new ATOM 0 HD2 LYS A 38 6.469 18.077 -0.304 1.00 3.19 H new ATOM 0 HD3 LYS A 38 5.514 17.718 1.121 1.00 3.19 H new ATOM 0 HE2 LYS A 38 7.097 19.138 2.487 1.00 3.22 H new ATOM 0 HE3 LYS A 38 7.944 19.559 1.011 1.00 3.22 H new ATOM 0 HZ1 LYS A 38 6.344 21.248 1.614 1.00 4.26 H new ATOM 0 HZ2 LYS A 38 5.898 20.525 0.144 1.00 4.26 H new ATOM 0 HZ3 LYS A 38 5.077 20.118 1.574 1.00 4.26 H new ATOM 576 N GLU A 39 10.763 14.158 -0.888 1.00 1.72 N ATOM 577 CA GLU A 39 10.924 13.301 -2.074 1.00 1.73 C ATOM 578 C GLU A 39 11.681 11.985 -1.771 1.00 1.45 C ATOM 579 O GLU A 39 11.616 11.034 -2.556 1.00 1.50 O ATOM 580 CB GLU A 39 11.643 14.115 -3.169 1.00 2.19 C ATOM 581 CG GLU A 39 10.812 15.291 -3.721 1.00 3.47 C ATOM 582 CD GLU A 39 11.650 16.244 -4.588 1.00 3.91 C ATOM 583 OE1 GLU A 39 12.180 15.832 -5.644 1.00 3.85 O ATOM 584 OE2 GLU A 39 11.816 17.434 -4.223 1.00 5.00 O ATOM 0 H GLU A 39 11.658 14.397 -0.461 1.00 1.72 H new ATOM 0 HA GLU A 39 9.934 12.997 -2.415 1.00 1.73 H new ATOM 0 HB2 GLU A 39 12.578 14.502 -2.765 1.00 2.19 H new ATOM 0 HB3 GLU A 39 11.903 13.449 -3.992 1.00 2.19 H new ATOM 0 HG2 GLU A 39 9.983 14.901 -4.312 1.00 3.47 H new ATOM 0 HG3 GLU A 39 10.378 15.847 -2.890 1.00 3.47 H new ATOM 591 N THR A 40 12.365 11.909 -0.620 1.00 1.24 N ATOM 592 CA THR A 40 13.078 10.731 -0.078 1.00 1.08 C ATOM 593 C THR A 40 12.767 10.575 1.424 1.00 0.93 C ATOM 594 O THR A 40 12.019 11.378 1.974 1.00 1.05 O ATOM 595 CB THR A 40 14.597 10.805 -0.329 1.00 1.13 C ATOM 596 OG1 THR A 40 15.230 11.665 0.590 1.00 1.11 O ATOM 597 CG2 THR A 40 14.971 11.320 -1.714 1.00 1.38 C ATOM 0 H THR A 40 12.443 12.716 -0.000 1.00 1.24 H new ATOM 0 HA THR A 40 12.719 9.848 -0.607 1.00 1.08 H new ATOM 0 HB THR A 40 14.930 9.773 -0.222 1.00 1.13 H new ATOM 0 HG1 THR A 40 14.613 12.383 0.845 1.00 1.11 H new ATOM 0 HG21 THR A 40 16.056 11.343 -1.813 1.00 1.38 H new ATOM 0 HG22 THR A 40 14.551 10.660 -2.473 1.00 1.38 H new ATOM 0 HG23 THR A 40 14.573 12.326 -1.848 1.00 1.38 H new ATOM 605 N LEU A 41 13.286 9.551 2.112 1.00 0.84 N ATOM 606 CA LEU A 41 12.897 9.210 3.490 1.00 0.79 C ATOM 607 C LEU A 41 14.130 8.749 4.290 1.00 0.88 C ATOM 608 O LEU A 41 14.816 7.820 3.865 1.00 1.33 O ATOM 609 CB LEU A 41 11.811 8.121 3.351 1.00 1.03 C ATOM 610 CG LEU A 41 10.881 7.788 4.526 1.00 0.67 C ATOM 611 CD1 LEU A 41 11.614 7.326 5.780 1.00 0.77 C ATOM 612 CD2 LEU A 41 9.968 8.962 4.903 1.00 0.70 C ATOM 0 H LEU A 41 13.995 8.928 1.726 1.00 0.84 H new ATOM 0 HA LEU A 41 12.500 10.059 4.047 1.00 0.79 H new ATOM 0 HB2 LEU A 41 11.177 8.405 2.511 1.00 1.03 H new ATOM 0 HB3 LEU A 41 12.317 7.197 3.070 1.00 1.03 H new ATOM 0 HG LEU A 41 10.280 6.958 4.156 1.00 0.67 H new ATOM 0 HD11 LEU A 41 10.890 7.110 6.566 1.00 0.77 H new ATOM 0 HD12 LEU A 41 12.186 6.426 5.556 1.00 0.77 H new ATOM 0 HD13 LEU A 41 12.290 8.112 6.116 1.00 0.77 H new ATOM 0 HD21 LEU A 41 9.331 8.674 5.739 1.00 0.70 H new ATOM 0 HD22 LEU A 41 10.577 9.819 5.190 1.00 0.70 H new ATOM 0 HD23 LEU A 41 9.346 9.229 4.048 1.00 0.70 H new ATOM 624 N THR A 42 14.451 9.384 5.419 1.00 0.72 N ATOM 625 CA THR A 42 15.641 9.028 6.223 1.00 0.75 C ATOM 626 C THR A 42 15.357 7.921 7.256 1.00 0.79 C ATOM 627 O THR A 42 14.314 7.951 7.913 1.00 0.68 O ATOM 628 CB THR A 42 16.288 10.245 6.906 1.00 0.86 C ATOM 629 OG1 THR A 42 15.397 10.886 7.790 1.00 1.25 O ATOM 630 CG2 THR A 42 16.761 11.300 5.908 1.00 0.94 C ATOM 0 H THR A 42 13.905 10.153 5.806 1.00 0.72 H new ATOM 0 HA THR A 42 16.357 8.633 5.503 1.00 0.75 H new ATOM 0 HB THR A 42 17.142 9.838 7.447 1.00 0.86 H new ATOM 0 HG1 THR A 42 15.884 11.549 8.322 1.00 1.25 H new ATOM 0 HG21 THR A 42 17.209 12.135 6.446 1.00 0.94 H new ATOM 0 HG22 THR A 42 17.501 10.862 5.238 1.00 0.94 H new ATOM 0 HG23 THR A 42 15.911 11.657 5.326 1.00 0.94 H new ATOM 638 N PRO A 43 16.269 6.950 7.478 1.00 1.04 N ATOM 639 CA PRO A 43 16.129 5.902 8.492 1.00 1.25 C ATOM 640 C PRO A 43 15.758 6.390 9.901 1.00 1.24 C ATOM 641 O PRO A 43 14.960 5.730 10.567 1.00 1.33 O ATOM 642 CB PRO A 43 17.479 5.176 8.485 1.00 1.59 C ATOM 643 CG PRO A 43 17.885 5.256 7.021 1.00 1.64 C ATOM 644 CD PRO A 43 17.438 6.667 6.660 1.00 1.26 C ATOM 0 HA PRO A 43 15.285 5.260 8.239 1.00 1.25 H new ATOM 0 HB2 PRO A 43 18.206 5.663 9.135 1.00 1.59 H new ATOM 0 HB3 PRO A 43 17.387 4.145 8.825 1.00 1.59 H new ATOM 0 HG2 PRO A 43 18.958 5.118 6.884 1.00 1.64 H new ATOM 0 HG3 PRO A 43 17.386 4.500 6.415 1.00 1.64 H new ATOM 0 HD2 PRO A 43 18.232 7.388 6.855 1.00 1.26 H new ATOM 0 HD3 PRO A 43 17.196 6.738 5.600 1.00 1.26 H new ATOM 652 N SER A 44 16.247 7.548 10.360 1.00 1.22 N ATOM 653 CA SER A 44 15.872 8.066 11.687 1.00 1.40 C ATOM 654 C SER A 44 14.442 8.630 11.764 1.00 1.15 C ATOM 655 O SER A 44 13.815 8.502 12.818 1.00 1.16 O ATOM 656 CB SER A 44 16.917 9.055 12.213 1.00 1.73 C ATOM 657 OG SER A 44 17.026 10.196 11.391 1.00 1.57 O ATOM 0 H SER A 44 16.896 8.140 9.842 1.00 1.22 H new ATOM 0 HA SER A 44 15.862 7.202 12.351 1.00 1.40 H new ATOM 0 HB2 SER A 44 16.650 9.361 13.224 1.00 1.73 H new ATOM 0 HB3 SER A 44 17.886 8.559 12.276 1.00 1.73 H new ATOM 0 HG SER A 44 17.701 10.803 11.761 1.00 1.57 H new ATOM 663 N GLU A 45 13.870 9.155 10.668 1.00 0.99 N ATOM 664 CA GLU A 45 12.450 9.569 10.623 1.00 0.81 C ATOM 665 C GLU A 45 11.503 8.397 10.284 1.00 0.67 C ATOM 666 O GLU A 45 10.354 8.376 10.723 1.00 0.64 O ATOM 667 CB GLU A 45 12.262 10.846 9.775 1.00 0.81 C ATOM 668 CG GLU A 45 12.111 10.689 8.253 1.00 0.77 C ATOM 669 CD GLU A 45 12.567 11.936 7.466 1.00 1.01 C ATOM 670 OE1 GLU A 45 12.332 13.091 7.892 1.00 1.62 O ATOM 671 OE2 GLU A 45 13.263 11.750 6.440 1.00 1.86 O ATOM 0 H GLU A 45 14.371 9.305 9.792 1.00 0.99 H new ATOM 0 HA GLU A 45 12.144 9.857 11.629 1.00 0.81 H new ATOM 0 HB2 GLU A 45 11.378 11.365 10.146 1.00 0.81 H new ATOM 0 HB3 GLU A 45 13.116 11.498 9.960 1.00 0.81 H new ATOM 0 HG2 GLU A 45 12.691 9.827 7.924 1.00 0.77 H new ATOM 0 HG3 GLU A 45 11.068 10.480 8.017 1.00 0.77 H new ATOM 678 N LEU A 46 12.022 7.345 9.635 1.00 0.72 N ATOM 679 CA LEU A 46 11.391 6.019 9.531 1.00 0.77 C ATOM 680 C LEU A 46 11.202 5.393 10.928 1.00 0.87 C ATOM 681 O LEU A 46 10.117 4.945 11.294 1.00 0.90 O ATOM 682 CB LEU A 46 12.289 5.139 8.634 1.00 0.92 C ATOM 683 CG LEU A 46 11.614 3.966 7.907 1.00 1.13 C ATOM 684 CD1 LEU A 46 12.699 3.171 7.183 1.00 1.72 C ATOM 685 CD2 LEU A 46 10.876 2.989 8.821 1.00 1.29 C ATOM 0 H LEU A 46 12.920 7.394 9.153 1.00 0.72 H new ATOM 0 HA LEU A 46 10.398 6.103 9.089 1.00 0.77 H new ATOM 0 HB2 LEU A 46 12.752 5.781 7.884 1.00 0.92 H new ATOM 0 HB3 LEU A 46 13.094 4.738 9.250 1.00 0.92 H new ATOM 0 HG LEU A 46 10.872 4.407 7.242 1.00 1.13 H new ATOM 0 HD11 LEU A 46 12.245 2.331 6.658 1.00 1.72 H new ATOM 0 HD12 LEU A 46 13.205 3.817 6.465 1.00 1.72 H new ATOM 0 HD13 LEU A 46 13.422 2.798 7.908 1.00 1.72 H new ATOM 0 HD21 LEU A 46 10.431 2.195 8.221 1.00 1.29 H new ATOM 0 HD22 LEU A 46 11.578 2.556 9.533 1.00 1.29 H new ATOM 0 HD23 LEU A 46 10.091 3.518 9.361 1.00 1.29 H new ATOM 697 N ARG A 47 12.250 5.421 11.756 1.00 0.99 N ATOM 698 CA ARG A 47 12.220 4.966 13.156 1.00 1.13 C ATOM 699 C ARG A 47 11.360 5.871 14.056 1.00 1.09 C ATOM 700 O ARG A 47 11.045 5.474 15.173 1.00 1.29 O ATOM 701 CB ARG A 47 13.685 4.875 13.640 1.00 1.44 C ATOM 702 CG ARG A 47 13.931 3.819 14.724 1.00 1.83 C ATOM 703 CD ARG A 47 15.387 3.873 15.218 1.00 1.61 C ATOM 704 NE ARG A 47 15.618 2.930 16.327 1.00 2.95 N ATOM 705 CZ ARG A 47 15.229 3.079 17.579 1.00 3.65 C ATOM 706 NH1 ARG A 47 14.619 4.141 18.007 1.00 4.40 N ATOM 707 NH2 ARG A 47 15.429 2.126 18.432 1.00 4.86 N ATOM 0 H ARG A 47 13.165 5.768 11.469 1.00 0.99 H new ATOM 0 HA ARG A 47 11.742 3.988 13.218 1.00 1.13 H new ATOM 0 HB2 ARG A 47 14.324 4.655 12.785 1.00 1.44 H new ATOM 0 HB3 ARG A 47 13.989 5.849 14.023 1.00 1.44 H new ATOM 0 HG2 ARG A 47 13.252 3.985 15.560 1.00 1.83 H new ATOM 0 HG3 ARG A 47 13.713 2.827 14.328 1.00 1.83 H new ATOM 0 HD2 ARG A 47 16.061 3.639 14.394 1.00 1.61 H new ATOM 0 HD3 ARG A 47 15.624 4.885 15.545 1.00 1.61 H new ATOM 0 HE ARG A 47 16.130 2.076 16.104 1.00 2.95 H new ATOM 0 HH11 ARG A 47 14.420 4.908 17.365 1.00 4.40 H new ATOM 0 HH12 ARG A 47 14.338 4.208 18.985 1.00 4.40 H new ATOM 0 HH21 ARG A 47 15.886 1.264 18.135 1.00 4.86 H new ATOM 0 HH22 ARG A 47 15.130 2.237 19.401 1.00 4.86 H new ATOM 721 N ASP A 48 10.997 7.076 13.607 1.00 1.07 N ATOM 722 CA ASP A 48 10.083 7.995 14.299 1.00 1.10 C ATOM 723 C ASP A 48 8.604 7.729 13.967 1.00 1.05 C ATOM 724 O ASP A 48 7.835 7.394 14.872 1.00 1.37 O ATOM 725 CB ASP A 48 10.504 9.441 14.020 1.00 1.09 C ATOM 726 CG ASP A 48 9.767 10.440 14.908 1.00 1.20 C ATOM 727 OD1 ASP A 48 10.021 10.466 16.135 1.00 2.31 O ATOM 728 OD2 ASP A 48 8.991 11.264 14.375 1.00 1.93 O ATOM 0 H ASP A 48 11.341 7.453 12.724 1.00 1.07 H new ATOM 0 HA ASP A 48 10.162 7.815 15.371 1.00 1.10 H new ATOM 0 HB2 ASP A 48 11.578 9.541 14.178 1.00 1.09 H new ATOM 0 HB3 ASP A 48 10.312 9.678 12.973 1.00 1.09 H new ATOM 733 N LEU A 49 8.188 7.798 12.690 1.00 0.74 N ATOM 734 CA LEU A 49 6.755 7.713 12.345 1.00 0.62 C ATOM 735 C LEU A 49 6.100 6.391 12.759 1.00 0.65 C ATOM 736 O LEU A 49 4.891 6.330 12.964 1.00 0.69 O ATOM 737 CB LEU A 49 6.471 8.061 10.866 1.00 0.62 C ATOM 738 CG LEU A 49 6.300 6.936 9.834 1.00 0.68 C ATOM 739 CD1 LEU A 49 5.693 7.499 8.548 1.00 0.76 C ATOM 740 CD2 LEU A 49 7.636 6.302 9.475 1.00 0.84 C ATOM 0 H LEU A 49 8.811 7.911 11.890 1.00 0.74 H new ATOM 0 HA LEU A 49 6.277 8.485 12.948 1.00 0.62 H new ATOM 0 HB2 LEU A 49 5.563 8.664 10.843 1.00 0.62 H new ATOM 0 HB3 LEU A 49 7.285 8.698 10.520 1.00 0.62 H new ATOM 0 HG LEU A 49 5.649 6.184 10.279 1.00 0.68 H new ATOM 0 HD11 LEU A 49 5.574 6.696 7.820 1.00 0.76 H new ATOM 0 HD12 LEU A 49 4.719 7.938 8.767 1.00 0.76 H new ATOM 0 HD13 LEU A 49 6.352 8.265 8.139 1.00 0.76 H new ATOM 0 HD21 LEU A 49 7.478 5.510 8.743 1.00 0.84 H new ATOM 0 HD22 LEU A 49 8.297 7.060 9.053 1.00 0.84 H new ATOM 0 HD23 LEU A 49 8.092 5.882 10.371 1.00 0.84 H new ATOM 752 N VAL A 50 6.898 5.335 12.906 1.00 0.71 N ATOM 753 CA VAL A 50 6.429 4.004 13.284 1.00 0.76 C ATOM 754 C VAL A 50 5.975 3.938 14.752 1.00 0.79 C ATOM 755 O VAL A 50 4.912 3.386 15.029 1.00 0.84 O ATOM 756 CB VAL A 50 7.545 2.995 12.965 1.00 0.78 C ATOM 757 CG1 VAL A 50 7.318 1.624 13.591 1.00 0.76 C ATOM 758 CG2 VAL A 50 7.697 2.793 11.453 1.00 0.82 C ATOM 0 H VAL A 50 7.907 5.382 12.763 1.00 0.71 H new ATOM 0 HA VAL A 50 5.540 3.753 12.706 1.00 0.76 H new ATOM 0 HB VAL A 50 8.447 3.432 13.393 1.00 0.78 H new ATOM 0 HG11 VAL A 50 8.142 0.962 13.326 1.00 0.76 H new ATOM 0 HG12 VAL A 50 7.267 1.723 14.675 1.00 0.76 H new ATOM 0 HG13 VAL A 50 6.382 1.205 13.220 1.00 0.76 H new ATOM 0 HG21 VAL A 50 8.494 2.074 11.260 1.00 0.82 H new ATOM 0 HG22 VAL A 50 6.761 2.417 11.040 1.00 0.82 H new ATOM 0 HG23 VAL A 50 7.945 3.744 10.982 1.00 0.82 H new ATOM 768 N THR A 51 6.710 4.540 15.695 1.00 0.80 N ATOM 769 CA THR A 51 6.272 4.619 17.112 1.00 0.86 C ATOM 770 C THR A 51 5.186 5.682 17.318 1.00 0.72 C ATOM 771 O THR A 51 4.294 5.505 18.153 1.00 0.85 O ATOM 772 CB THR A 51 7.454 4.761 18.097 1.00 1.07 C ATOM 773 OG1 THR A 51 7.005 5.159 19.373 1.00 1.03 O ATOM 774 CG2 THR A 51 8.529 5.769 17.692 1.00 1.33 C ATOM 0 H THR A 51 7.611 4.982 15.512 1.00 0.80 H new ATOM 0 HA THR A 51 5.811 3.660 17.351 1.00 0.86 H new ATOM 0 HB THR A 51 7.899 3.766 18.094 1.00 1.07 H new ATOM 0 HG1 THR A 51 7.771 5.240 19.979 1.00 1.03 H new ATOM 0 HG21 THR A 51 9.311 5.791 18.451 1.00 1.33 H new ATOM 0 HG22 THR A 51 8.960 5.476 16.735 1.00 1.33 H new ATOM 0 HG23 THR A 51 8.083 6.760 17.602 1.00 1.33 H new ATOM 782 N GLN A 52 5.193 6.745 16.504 1.00 0.59 N ATOM 783 CA GLN A 52 4.170 7.795 16.534 1.00 0.61 C ATOM 784 C GLN A 52 2.813 7.344 15.969 1.00 0.64 C ATOM 785 O GLN A 52 1.775 7.676 16.545 1.00 0.92 O ATOM 786 CB GLN A 52 4.674 9.024 15.754 1.00 0.75 C ATOM 787 CG GLN A 52 5.931 9.683 16.344 1.00 1.31 C ATOM 788 CD GLN A 52 5.663 10.353 17.683 1.00 1.59 C ATOM 789 OE1 GLN A 52 5.514 9.702 18.707 1.00 2.45 O ATOM 790 NE2 GLN A 52 5.537 11.659 17.735 1.00 2.20 N ATOM 0 H GLN A 52 5.915 6.901 15.801 1.00 0.59 H new ATOM 0 HA GLN A 52 4.003 8.043 17.582 1.00 0.61 H new ATOM 0 HB2 GLN A 52 4.884 8.725 14.727 1.00 0.75 H new ATOM 0 HB3 GLN A 52 3.876 9.765 15.714 1.00 0.75 H new ATOM 0 HG2 GLN A 52 6.709 8.929 16.468 1.00 1.31 H new ATOM 0 HG3 GLN A 52 6.313 10.423 15.641 1.00 1.31 H new ATOM 0 HE21 GLN A 52 5.658 12.217 16.890 1.00 2.20 H new ATOM 0 HE22 GLN A 52 5.318 12.115 18.621 1.00 2.20 H new ATOM 799 N GLN A 53 2.799 6.619 14.843 1.00 0.54 N ATOM 800 CA GLN A 53 1.579 6.369 14.061 1.00 0.69 C ATOM 801 C GLN A 53 1.169 4.893 13.933 1.00 0.81 C ATOM 802 O GLN A 53 0.023 4.664 13.553 1.00 1.00 O ATOM 803 CB GLN A 53 1.669 7.014 12.662 1.00 0.78 C ATOM 804 CG GLN A 53 2.186 8.465 12.633 1.00 0.86 C ATOM 805 CD GLN A 53 1.549 9.297 11.525 1.00 1.15 C ATOM 806 OE1 GLN A 53 0.702 10.143 11.772 1.00 1.48 O ATOM 807 NE2 GLN A 53 1.926 9.124 10.278 1.00 2.05 N ATOM 0 H GLN A 53 3.634 6.188 14.447 1.00 0.54 H new ATOM 0 HA GLN A 53 0.789 6.842 14.644 1.00 0.69 H new ATOM 0 HB2 GLN A 53 2.322 6.402 12.040 1.00 0.78 H new ATOM 0 HB3 GLN A 53 0.679 6.990 12.206 1.00 0.78 H new ATOM 0 HG2 GLN A 53 1.987 8.936 13.595 1.00 0.86 H new ATOM 0 HG3 GLN A 53 3.268 8.458 12.500 1.00 0.86 H new ATOM 0 HE21 GLN A 53 2.631 8.423 10.051 1.00 2.05 H new ATOM 0 HE22 GLN A 53 1.513 9.691 9.537 1.00 2.05 H new ATOM 816 N LEU A 54 2.038 3.912 14.235 1.00 0.80 N ATOM 817 CA LEU A 54 1.731 2.470 14.122 1.00 0.89 C ATOM 818 C LEU A 54 1.761 1.696 15.473 1.00 1.03 C ATOM 819 O LEU A 54 2.439 0.670 15.546 1.00 1.05 O ATOM 820 CB LEU A 54 2.687 1.798 13.101 1.00 0.86 C ATOM 821 CG LEU A 54 2.767 2.351 11.672 1.00 0.76 C ATOM 822 CD1 LEU A 54 3.783 1.527 10.876 1.00 0.79 C ATOM 823 CD2 LEU A 54 1.441 2.263 10.915 1.00 0.83 C ATOM 0 H LEU A 54 2.984 4.097 14.568 1.00 0.80 H new ATOM 0 HA LEU A 54 0.700 2.415 13.772 1.00 0.89 H new ATOM 0 HB2 LEU A 54 3.692 1.831 13.522 1.00 0.86 H new ATOM 0 HB3 LEU A 54 2.405 0.747 13.031 1.00 0.86 H new ATOM 0 HG LEU A 54 3.048 3.400 11.764 1.00 0.76 H new ATOM 0 HD11 LEU A 54 3.847 1.913 9.858 1.00 0.79 H new ATOM 0 HD12 LEU A 54 4.761 1.596 11.352 1.00 0.79 H new ATOM 0 HD13 LEU A 54 3.465 0.485 10.850 1.00 0.79 H new ATOM 0 HD21 LEU A 54 1.567 2.671 9.912 1.00 0.83 H new ATOM 0 HD22 LEU A 54 1.130 1.221 10.847 1.00 0.83 H new ATOM 0 HD23 LEU A 54 0.680 2.835 11.446 1.00 0.83 H new ATOM 835 N PRO A 55 1.087 2.113 16.567 1.00 1.12 N ATOM 836 CA PRO A 55 1.125 1.376 17.838 1.00 1.33 C ATOM 837 C PRO A 55 0.327 0.056 17.828 1.00 1.46 C ATOM 838 O PRO A 55 0.673 -0.893 18.534 1.00 1.64 O ATOM 839 CB PRO A 55 0.567 2.357 18.873 1.00 1.42 C ATOM 840 CG PRO A 55 -0.405 3.210 18.063 1.00 1.26 C ATOM 841 CD PRO A 55 0.292 3.322 16.709 1.00 1.08 C ATOM 0 HA PRO A 55 2.143 1.055 18.057 1.00 1.33 H new ATOM 0 HB2 PRO A 55 0.063 1.838 19.688 1.00 1.42 H new ATOM 0 HB3 PRO A 55 1.356 2.962 19.320 1.00 1.42 H new ATOM 0 HG2 PRO A 55 -1.383 2.737 17.977 1.00 1.26 H new ATOM 0 HG3 PRO A 55 -0.563 4.187 18.519 1.00 1.26 H new ATOM 0 HD2 PRO A 55 -0.435 3.408 15.902 1.00 1.08 H new ATOM 0 HD3 PRO A 55 0.922 4.211 16.667 1.00 1.08 H new ATOM 849 N HIS A 56 -0.747 -0.031 17.042 1.00 1.46 N ATOM 850 CA HIS A 56 -1.563 -1.239 16.885 1.00 1.68 C ATOM 851 C HIS A 56 -1.014 -2.171 15.796 1.00 1.84 C ATOM 852 O HIS A 56 -1.144 -3.394 15.899 1.00 2.11 O ATOM 853 CB HIS A 56 -3.009 -0.837 16.584 1.00 1.72 C ATOM 854 CG HIS A 56 -3.564 0.185 17.535 1.00 1.63 C ATOM 855 ND1 HIS A 56 -3.736 1.518 17.266 1.00 1.53 N ATOM 856 CD2 HIS A 56 -3.940 -0.025 18.832 1.00 1.70 C ATOM 857 CE1 HIS A 56 -4.213 2.102 18.373 1.00 1.54 C ATOM 858 NE2 HIS A 56 -4.361 1.200 19.366 1.00 1.64 N ATOM 0 H HIS A 56 -1.083 0.754 16.483 1.00 1.46 H new ATOM 0 HA HIS A 56 -1.527 -1.799 17.819 1.00 1.68 H new ATOM 0 HB2 HIS A 56 -3.063 -0.443 15.569 1.00 1.72 H new ATOM 0 HB3 HIS A 56 -3.638 -1.727 16.614 1.00 1.72 H new ATOM 0 HD1 HIS A 56 -3.536 1.983 16.380 1.00 1.53 H new ATOM 0 HD2 HIS A 56 -3.917 -0.970 19.354 1.00 1.70 H new ATOM 0 HE1 HIS A 56 -4.447 3.153 18.459 1.00 1.54 H new ATOM 866 N LEU A 57 -0.399 -1.607 14.753 1.00 1.74 N ATOM 867 CA LEU A 57 0.254 -2.368 13.683 1.00 1.74 C ATOM 868 C LEU A 57 1.618 -2.922 14.135 1.00 1.76 C ATOM 869 O LEU A 57 1.987 -4.025 13.740 1.00 1.90 O ATOM 870 CB LEU A 57 0.393 -1.469 12.434 1.00 1.57 C ATOM 871 CG LEU A 57 0.110 -2.121 11.068 1.00 1.71 C ATOM 872 CD1 LEU A 57 0.946 -3.371 10.798 1.00 1.88 C ATOM 873 CD2 LEU A 57 -1.363 -2.479 10.889 1.00 2.08 C ATOM 0 H LEU A 57 -0.340 -0.597 14.626 1.00 1.74 H new ATOM 0 HA LEU A 57 -0.363 -3.231 13.433 1.00 1.74 H new ATOM 0 HB2 LEU A 57 -0.281 -0.621 12.551 1.00 1.57 H new ATOM 0 HB3 LEU A 57 1.407 -1.070 12.415 1.00 1.57 H new ATOM 0 HG LEU A 57 0.395 -1.355 10.346 1.00 1.71 H new ATOM 0 HD11 LEU A 57 0.691 -3.774 9.818 1.00 1.88 H new ATOM 0 HD12 LEU A 57 2.005 -3.112 10.820 1.00 1.88 H new ATOM 0 HD13 LEU A 57 0.739 -4.119 11.563 1.00 1.88 H new ATOM 0 HD21 LEU A 57 -1.510 -2.936 9.910 1.00 2.08 H new ATOM 0 HD22 LEU A 57 -1.664 -3.182 11.666 1.00 2.08 H new ATOM 0 HD23 LEU A 57 -1.969 -1.576 10.963 1.00 2.08 H new ATOM 885 N MET A 58 2.366 -2.173 14.956 1.00 1.73 N ATOM 886 CA MET A 58 3.725 -2.513 15.392 1.00 1.84 C ATOM 887 C MET A 58 3.902 -2.334 16.916 1.00 2.17 C ATOM 888 O MET A 58 3.630 -1.247 17.441 1.00 2.76 O ATOM 889 CB MET A 58 4.751 -1.642 14.645 1.00 1.81 C ATOM 890 CG MET A 58 4.772 -1.748 13.114 1.00 2.25 C ATOM 891 SD MET A 58 5.851 -3.026 12.424 1.00 2.47 S ATOM 892 CE MET A 58 4.808 -4.493 12.592 1.00 4.17 C ATOM 0 H MET A 58 2.033 -1.291 15.345 1.00 1.73 H new ATOM 0 HA MET A 58 3.892 -3.564 15.157 1.00 1.84 H new ATOM 0 HB2 MET A 58 4.568 -0.601 14.910 1.00 1.81 H new ATOM 0 HB3 MET A 58 5.744 -1.895 15.016 1.00 1.81 H new ATOM 0 HG2 MET A 58 3.755 -1.933 12.768 1.00 2.25 H new ATOM 0 HG3 MET A 58 5.077 -0.784 12.707 1.00 2.25 H new ATOM 0 HE1 MET A 58 5.242 -5.315 12.023 1.00 4.17 H new ATOM 0 HE2 MET A 58 4.742 -4.774 13.643 1.00 4.17 H new ATOM 0 HE3 MET A 58 3.810 -4.275 12.212 1.00 4.17 H new ATOM 902 N PRO A 59 4.407 -3.351 17.642 1.00 2.06 N ATOM 903 CA PRO A 59 4.628 -3.265 19.084 1.00 2.42 C ATOM 904 C PRO A 59 5.826 -2.379 19.448 1.00 2.22 C ATOM 905 O PRO A 59 6.640 -1.991 18.605 1.00 2.07 O ATOM 906 CB PRO A 59 4.834 -4.706 19.562 1.00 2.72 C ATOM 907 CG PRO A 59 5.422 -5.401 18.333 1.00 2.47 C ATOM 908 CD PRO A 59 4.798 -4.666 17.149 1.00 2.07 C ATOM 0 HA PRO A 59 3.775 -2.794 19.572 1.00 2.42 H new ATOM 0 HB2 PRO A 59 5.511 -4.754 20.415 1.00 2.72 H new ATOM 0 HB3 PRO A 59 3.896 -5.165 19.874 1.00 2.72 H new ATOM 0 HG2 PRO A 59 6.510 -5.329 18.318 1.00 2.47 H new ATOM 0 HG3 PRO A 59 5.173 -6.462 18.319 1.00 2.47 H new ATOM 0 HD2 PRO A 59 5.509 -4.577 16.328 1.00 2.07 H new ATOM 0 HD3 PRO A 59 3.935 -5.210 16.765 1.00 2.07 H new ATOM 916 N SER A 60 5.952 -2.089 20.740 1.00 2.64 N ATOM 917 CA SER A 60 7.109 -1.409 21.320 1.00 2.64 C ATOM 918 C SER A 60 8.382 -2.266 21.313 1.00 2.25 C ATOM 919 O SER A 60 8.326 -3.498 21.240 1.00 3.03 O ATOM 920 CB SER A 60 6.742 -0.930 22.727 1.00 3.20 C ATOM 921 OG SER A 60 6.205 0.385 22.644 1.00 3.47 O ATOM 0 H SER A 60 5.238 -2.325 21.429 1.00 2.64 H new ATOM 0 HA SER A 60 7.353 -0.550 20.694 1.00 2.64 H new ATOM 0 HB2 SER A 60 6.015 -1.606 23.177 1.00 3.20 H new ATOM 0 HB3 SER A 60 7.623 -0.937 23.369 1.00 3.20 H new ATOM 0 HG SER A 60 5.966 0.698 23.541 1.00 3.47 H new ATOM 959 N LEU A 64 10.217 -0.992 14.377 1.00 2.81 N ATOM 960 CA LEU A 64 10.794 0.184 13.723 1.00 2.11 C ATOM 961 C LEU A 64 12.177 -0.099 13.146 1.00 1.89 C ATOM 962 O LEU A 64 12.371 -0.029 11.937 1.00 1.92 O ATOM 963 CB LEU A 64 10.758 1.442 14.630 1.00 1.61 C ATOM 964 CG LEU A 64 10.418 1.293 16.128 1.00 1.42 C ATOM 965 CD1 LEU A 64 11.567 0.681 16.925 1.00 2.16 C ATOM 966 CD2 LEU A 64 10.141 2.664 16.734 1.00 1.25 C ATOM 0 HA LEU A 64 10.155 0.416 12.871 1.00 2.11 H new ATOM 0 HB2 LEU A 64 11.735 1.920 14.564 1.00 1.61 H new ATOM 0 HB3 LEU A 64 10.035 2.134 14.199 1.00 1.61 H new ATOM 0 HG LEU A 64 9.548 0.639 16.184 1.00 1.42 H new ATOM 0 HD11 LEU A 64 11.279 0.597 17.973 1.00 2.16 H new ATOM 0 HD12 LEU A 64 11.796 -0.309 16.531 1.00 2.16 H new ATOM 0 HD13 LEU A 64 12.448 1.318 16.841 1.00 2.16 H new ATOM 0 HD21 LEU A 64 9.902 2.553 17.792 1.00 1.25 H new ATOM 0 HD22 LEU A 64 11.024 3.295 16.626 1.00 1.25 H new ATOM 0 HD23 LEU A 64 9.299 3.127 16.218 1.00 1.25 H new ATOM 978 N GLU A 65 13.144 -0.470 13.977 1.00 1.84 N ATOM 979 CA GLU A 65 14.530 -0.656 13.533 1.00 1.74 C ATOM 980 C GLU A 65 14.762 -1.914 12.685 1.00 1.77 C ATOM 981 O GLU A 65 15.738 -1.974 11.941 1.00 1.71 O ATOM 982 CB GLU A 65 15.506 -0.445 14.689 1.00 1.77 C ATOM 983 CG GLU A 65 15.303 -1.397 15.863 1.00 1.90 C ATOM 984 CD GLU A 65 16.305 -1.162 17.003 1.00 1.97 C ATOM 985 OE1 GLU A 65 16.724 0.002 17.236 1.00 2.39 O ATOM 986 OE2 GLU A 65 16.680 -2.159 17.663 1.00 2.80 O ATOM 0 H GLU A 65 12.997 -0.650 14.970 1.00 1.84 H new ATOM 0 HA GLU A 65 14.750 0.132 12.813 1.00 1.74 H new ATOM 0 HB2 GLU A 65 16.524 -0.559 14.315 1.00 1.77 H new ATOM 0 HB3 GLU A 65 15.411 0.580 15.047 1.00 1.77 H new ATOM 0 HG2 GLU A 65 14.290 -1.281 16.247 1.00 1.90 H new ATOM 0 HG3 GLU A 65 15.395 -2.425 15.511 1.00 1.90 H new ATOM 993 N GLU A 66 13.814 -2.853 12.685 1.00 1.94 N ATOM 994 CA GLU A 66 13.761 -3.989 11.760 1.00 2.11 C ATOM 995 C GLU A 66 13.619 -3.521 10.297 1.00 1.92 C ATOM 996 O GLU A 66 14.103 -4.171 9.370 1.00 2.00 O ATOM 997 CB GLU A 66 12.603 -4.928 12.163 1.00 2.44 C ATOM 998 CG GLU A 66 11.237 -4.234 12.268 1.00 3.25 C ATOM 999 CD GLU A 66 10.067 -5.214 12.180 1.00 3.99 C ATOM 1000 OE1 GLU A 66 9.580 -5.715 13.219 1.00 4.17 O ATOM 1001 OE2 GLU A 66 9.567 -5.431 11.050 1.00 5.05 O ATOM 0 H GLU A 66 13.039 -2.845 13.348 1.00 1.94 H new ATOM 0 HA GLU A 66 14.701 -4.537 11.826 1.00 2.11 H new ATOM 0 HB2 GLU A 66 12.533 -5.734 11.433 1.00 2.44 H new ATOM 0 HB3 GLU A 66 12.840 -5.387 13.123 1.00 2.44 H new ATOM 0 HG2 GLU A 66 11.181 -3.692 13.212 1.00 3.25 H new ATOM 0 HG3 GLU A 66 11.147 -3.496 11.471 1.00 3.25 H new ATOM 1008 N LYS A 67 13.012 -2.348 10.074 1.00 1.74 N ATOM 1009 CA LYS A 67 12.808 -1.740 8.754 1.00 1.67 C ATOM 1010 C LYS A 67 14.100 -1.093 8.253 1.00 1.50 C ATOM 1011 O LYS A 67 14.477 -1.279 7.101 1.00 1.58 O ATOM 1012 CB LYS A 67 11.652 -0.730 8.862 1.00 1.69 C ATOM 1013 CG LYS A 67 10.359 -1.281 9.442 1.00 1.74 C ATOM 1014 CD LYS A 67 9.831 -2.458 8.621 1.00 1.83 C ATOM 1015 CE LYS A 67 8.357 -2.600 8.938 1.00 1.90 C ATOM 1016 NZ LYS A 67 8.134 -3.192 10.278 1.00 2.10 N ATOM 0 H LYS A 67 12.637 -1.778 10.833 1.00 1.74 H new ATOM 0 HA LYS A 67 12.542 -2.501 8.020 1.00 1.67 H new ATOM 0 HB2 LYS A 67 11.979 0.107 9.478 1.00 1.69 H new ATOM 0 HB3 LYS A 67 11.445 -0.333 7.868 1.00 1.69 H new ATOM 0 HG2 LYS A 67 10.528 -1.601 10.470 1.00 1.74 H new ATOM 0 HG3 LYS A 67 9.608 -0.492 9.473 1.00 1.74 H new ATOM 0 HD2 LYS A 67 9.980 -2.282 7.556 1.00 1.83 H new ATOM 0 HD3 LYS A 67 10.368 -3.373 8.871 1.00 1.83 H new ATOM 0 HE2 LYS A 67 7.879 -1.621 8.890 1.00 1.90 H new ATOM 0 HE3 LYS A 67 7.882 -3.224 8.182 1.00 1.90 H new ATOM 0 HZ1 LYS A 67 7.122 -3.148 10.513 1.00 2.10 H new ATOM 0 HZ2 LYS A 67 8.446 -4.184 10.276 1.00 2.10 H new ATOM 0 HZ3 LYS A 67 8.677 -2.660 10.987 1.00 2.10 H new ATOM 1030 N ILE A 68 14.835 -0.438 9.157 1.00 1.36 N ATOM 1031 CA ILE A 68 16.197 0.057 8.917 1.00 1.25 C ATOM 1032 C ILE A 68 17.162 -1.125 8.693 1.00 1.37 C ATOM 1033 O ILE A 68 18.017 -1.065 7.810 1.00 1.38 O ATOM 1034 CB ILE A 68 16.640 1.006 10.065 1.00 1.21 C ATOM 1035 CG1 ILE A 68 15.799 2.309 10.110 1.00 1.14 C ATOM 1036 CG2 ILE A 68 18.116 1.408 9.903 1.00 1.29 C ATOM 1037 CD1 ILE A 68 14.520 2.229 10.950 1.00 1.22 C ATOM 0 H ILE A 68 14.494 -0.232 10.096 1.00 1.36 H new ATOM 0 HA ILE A 68 16.217 0.652 8.004 1.00 1.25 H new ATOM 0 HB ILE A 68 16.490 0.449 10.990 1.00 1.21 H new ATOM 0 HG12 ILE A 68 16.423 3.112 10.502 1.00 1.14 H new ATOM 0 HG13 ILE A 68 15.529 2.584 9.090 1.00 1.14 H new ATOM 0 HG21 ILE A 68 18.404 2.072 10.718 1.00 1.29 H new ATOM 0 HG22 ILE A 68 18.741 0.515 9.925 1.00 1.29 H new ATOM 0 HG23 ILE A 68 18.251 1.922 8.951 1.00 1.29 H new ATOM 0 HD11 ILE A 68 14.003 3.188 10.918 1.00 1.22 H new ATOM 0 HD12 ILE A 68 13.869 1.453 10.548 1.00 1.22 H new ATOM 0 HD13 ILE A 68 14.777 1.989 11.982 1.00 1.22 H new ATOM 1049 N ALA A 69 16.986 -2.243 9.402 1.00 1.59 N ATOM 1050 CA ALA A 69 17.755 -3.470 9.185 1.00 1.83 C ATOM 1051 C ALA A 69 17.481 -4.118 7.807 1.00 1.83 C ATOM 1052 O ALA A 69 18.408 -4.636 7.186 1.00 1.91 O ATOM 1053 CB ALA A 69 17.483 -4.424 10.355 1.00 2.11 C ATOM 0 H ALA A 69 16.298 -2.322 10.151 1.00 1.59 H new ATOM 0 HA ALA A 69 18.817 -3.225 9.160 1.00 1.83 H new ATOM 0 HB1 ALA A 69 18.047 -5.345 10.212 1.00 2.11 H new ATOM 0 HB2 ALA A 69 17.790 -3.952 11.288 1.00 2.11 H new ATOM 0 HB3 ALA A 69 16.418 -4.654 10.397 1.00 2.11 H new ATOM 1059 N ASN A 70 16.259 -4.014 7.267 1.00 1.78 N ATOM 1060 CA ASN A 70 15.920 -4.492 5.913 1.00 1.85 C ATOM 1061 C ASN A 70 16.471 -3.583 4.793 1.00 1.60 C ATOM 1062 O ASN A 70 16.512 -3.998 3.632 1.00 1.88 O ATOM 1063 CB ASN A 70 14.395 -4.685 5.792 1.00 2.07 C ATOM 1064 CG ASN A 70 13.948 -6.062 6.247 1.00 2.55 C ATOM 1065 OD1 ASN A 70 13.700 -6.954 5.446 1.00 3.52 O ATOM 1066 ND2 ASN A 70 13.852 -6.293 7.531 1.00 2.19 N ATOM 0 H ASN A 70 15.470 -3.593 7.758 1.00 1.78 H new ATOM 0 HA ASN A 70 16.412 -5.455 5.774 1.00 1.85 H new ATOM 0 HB2 ASN A 70 13.887 -3.926 6.387 1.00 2.07 H new ATOM 0 HB3 ASN A 70 14.093 -4.532 4.756 1.00 2.07 H new ATOM 0 HD21 ASN A 70 13.571 -7.215 7.864 1.00 2.19 H new ATOM 0 HD22 ASN A 70 14.058 -5.551 8.200 1.00 2.19 H new ATOM 1073 N LEU A 71 16.892 -2.359 5.132 1.00 1.28 N ATOM 1074 CA LEU A 71 17.441 -1.345 4.221 1.00 1.29 C ATOM 1075 C LEU A 71 18.964 -1.409 4.019 1.00 1.52 C ATOM 1076 O LEU A 71 19.490 -0.814 3.079 1.00 1.78 O ATOM 1077 CB LEU A 71 17.007 0.036 4.752 1.00 1.56 C ATOM 1078 CG LEU A 71 15.694 0.517 4.137 1.00 1.82 C ATOM 1079 CD1 LEU A 71 15.203 1.750 4.896 1.00 2.26 C ATOM 1080 CD2 LEU A 71 15.913 0.871 2.670 1.00 3.23 C ATOM 0 H LEU A 71 16.858 -2.031 6.097 1.00 1.28 H new ATOM 0 HA LEU A 71 17.040 -1.541 3.226 1.00 1.29 H new ATOM 0 HB2 LEU A 71 16.900 -0.013 5.836 1.00 1.56 H new ATOM 0 HB3 LEU A 71 17.790 0.764 4.542 1.00 1.56 H new ATOM 0 HG LEU A 71 14.948 -0.275 4.206 1.00 1.82 H new ATOM 0 HD11 LEU A 71 14.266 2.096 4.460 1.00 2.26 H new ATOM 0 HD12 LEU A 71 15.043 1.493 5.943 1.00 2.26 H new ATOM 0 HD13 LEU A 71 15.950 2.541 4.827 1.00 2.26 H new ATOM 0 HD21 LEU A 71 14.974 1.214 2.234 1.00 3.23 H new ATOM 0 HD22 LEU A 71 16.659 1.662 2.594 1.00 3.23 H new ATOM 0 HD23 LEU A 71 16.263 -0.010 2.131 1.00 3.23 H new ATOM 1180 N LEU A 79 17.122 7.659 -0.157 1.00 1.83 N ATOM 1181 CA LEU A 79 16.001 6.770 -0.516 1.00 1.51 C ATOM 1182 C LEU A 79 15.194 7.288 -1.716 1.00 1.56 C ATOM 1183 O LEU A 79 15.435 8.385 -2.211 1.00 2.15 O ATOM 1184 CB LEU A 79 15.079 6.591 0.719 1.00 1.50 C ATOM 1185 CG LEU A 79 15.054 5.146 1.233 1.00 1.89 C ATOM 1186 CD1 LEU A 79 16.315 4.825 2.033 1.00 2.27 C ATOM 1187 CD2 LEU A 79 13.841 4.875 2.123 1.00 2.39 C ATOM 0 HA LEU A 79 16.420 5.810 -0.817 1.00 1.51 H new ATOM 0 HB2 LEU A 79 15.416 7.251 1.518 1.00 1.50 H new ATOM 0 HB3 LEU A 79 14.066 6.898 0.459 1.00 1.50 H new ATOM 0 HG LEU A 79 14.999 4.510 0.349 1.00 1.89 H new ATOM 0 HD11 LEU A 79 16.270 3.794 2.385 1.00 2.27 H new ATOM 0 HD12 LEU A 79 17.191 4.954 1.398 1.00 2.27 H new ATOM 0 HD13 LEU A 79 16.385 5.498 2.888 1.00 2.27 H new ATOM 0 HD21 LEU A 79 13.864 3.840 2.464 1.00 2.39 H new ATOM 0 HD22 LEU A 79 13.866 5.542 2.985 1.00 2.39 H new ATOM 0 HD23 LEU A 79 12.927 5.050 1.555 1.00 2.39 H new ATOM 1199 N GLU A 80 14.187 6.535 -2.148 1.00 1.20 N ATOM 1200 CA GLU A 80 13.112 6.995 -3.035 1.00 1.20 C ATOM 1201 C GLU A 80 11.746 6.485 -2.518 1.00 0.99 C ATOM 1202 O GLU A 80 11.678 5.547 -1.719 1.00 1.00 O ATOM 1203 CB GLU A 80 13.362 6.521 -4.481 1.00 1.50 C ATOM 1204 CG GLU A 80 14.699 6.954 -5.113 1.00 1.81 C ATOM 1205 CD GLU A 80 14.795 8.412 -5.590 1.00 3.35 C ATOM 1206 OE1 GLU A 80 13.797 9.171 -5.644 1.00 4.39 O ATOM 1207 OE2 GLU A 80 15.918 8.834 -5.954 1.00 4.48 O ATOM 0 H GLU A 80 14.089 5.555 -1.884 1.00 1.20 H new ATOM 0 HA GLU A 80 13.099 8.085 -3.036 1.00 1.20 H new ATOM 0 HB2 GLU A 80 13.310 5.432 -4.499 1.00 1.50 H new ATOM 0 HB3 GLU A 80 12.550 6.889 -5.108 1.00 1.50 H new ATOM 0 HG2 GLU A 80 15.492 6.781 -4.385 1.00 1.81 H new ATOM 0 HG3 GLU A 80 14.900 6.303 -5.964 1.00 1.81 H new ATOM 1214 N PHE A 81 10.655 7.092 -2.993 1.00 0.95 N ATOM 1215 CA PHE A 81 9.247 6.800 -2.660 1.00 0.89 C ATOM 1216 C PHE A 81 8.920 5.295 -2.589 1.00 0.77 C ATOM 1217 O PHE A 81 8.317 4.821 -1.622 1.00 0.79 O ATOM 1218 CB PHE A 81 8.423 7.526 -3.740 1.00 1.08 C ATOM 1219 CG PHE A 81 6.914 7.354 -3.785 1.00 1.30 C ATOM 1220 CD1 PHE A 81 6.361 6.234 -4.440 1.00 2.30 C ATOM 1221 CD2 PHE A 81 6.062 8.392 -3.348 1.00 2.27 C ATOM 1222 CE1 PHE A 81 4.976 6.158 -4.673 1.00 2.62 C ATOM 1223 CE2 PHE A 81 4.685 8.327 -3.613 1.00 2.57 C ATOM 1224 CZ PHE A 81 4.140 7.218 -4.282 1.00 2.17 C ATOM 0 H PHE A 81 10.731 7.854 -3.667 1.00 0.95 H new ATOM 0 HA PHE A 81 9.011 7.150 -1.655 1.00 0.89 H new ATOM 0 HB2 PHE A 81 8.625 8.592 -3.640 1.00 1.08 H new ATOM 0 HB3 PHE A 81 8.814 7.217 -4.709 1.00 1.08 H new ATOM 0 HD1 PHE A 81 7.005 5.430 -4.765 1.00 2.30 H new ATOM 0 HD2 PHE A 81 6.470 9.235 -2.810 1.00 2.27 H new ATOM 0 HE1 PHE A 81 4.555 5.286 -5.152 1.00 2.62 H new ATOM 0 HE2 PHE A 81 4.040 9.135 -3.301 1.00 2.57 H new ATOM 0 HZ PHE A 81 3.082 7.180 -4.495 1.00 2.17 H new ATOM 1234 N ARG A 82 9.377 4.510 -3.577 1.00 0.79 N ATOM 1235 CA ARG A 82 9.089 3.069 -3.676 1.00 0.91 C ATOM 1236 C ARG A 82 9.749 2.233 -2.568 1.00 0.90 C ATOM 1237 O ARG A 82 9.177 1.231 -2.149 1.00 0.98 O ATOM 1238 CB ARG A 82 9.454 2.589 -5.090 1.00 1.17 C ATOM 1239 CG ARG A 82 8.991 1.148 -5.366 1.00 2.02 C ATOM 1240 CD ARG A 82 9.096 0.781 -6.855 1.00 2.83 C ATOM 1241 NE ARG A 82 10.473 0.891 -7.376 1.00 3.14 N ATOM 1242 CZ ARG A 82 11.487 0.069 -7.186 1.00 3.47 C ATOM 1243 NH1 ARG A 82 11.401 -1.021 -6.486 1.00 3.88 N ATOM 1244 NH2 ARG A 82 12.631 0.351 -7.728 1.00 4.46 N ATOM 0 H ARG A 82 9.962 4.860 -4.336 1.00 0.79 H new ATOM 0 HA ARG A 82 8.022 2.918 -3.513 1.00 0.91 H new ATOM 0 HB2 ARG A 82 9.004 3.258 -5.824 1.00 1.17 H new ATOM 0 HB3 ARG A 82 10.534 2.651 -5.223 1.00 1.17 H new ATOM 0 HG2 ARG A 82 9.594 0.455 -4.779 1.00 2.02 H new ATOM 0 HG3 ARG A 82 7.959 1.030 -5.036 1.00 2.02 H new ATOM 0 HD2 ARG A 82 8.738 -0.238 -6.999 1.00 2.83 H new ATOM 0 HD3 ARG A 82 8.441 1.433 -7.432 1.00 2.83 H new ATOM 0 HE ARG A 82 10.665 1.707 -7.957 1.00 3.14 H new ATOM 0 HH11 ARG A 82 10.516 -1.278 -6.050 1.00 3.88 H new ATOM 0 HH12 ARG A 82 12.219 -1.620 -6.372 1.00 3.88 H new ATOM 0 HH21 ARG A 82 12.735 1.196 -8.290 1.00 4.46 H new ATOM 0 HH22 ARG A 82 13.427 -0.272 -7.593 1.00 4.46 H new ATOM 1258 N SER A 83 10.885 2.661 -2.018 1.00 0.89 N ATOM 1259 CA SER A 83 11.576 1.937 -0.937 1.00 0.96 C ATOM 1260 C SER A 83 10.830 2.024 0.404 1.00 0.82 C ATOM 1261 O SER A 83 10.799 1.049 1.155 1.00 0.88 O ATOM 1262 CB SER A 83 13.011 2.450 -0.842 1.00 1.14 C ATOM 1263 OG SER A 83 13.809 1.668 0.021 1.00 1.97 O ATOM 0 H SER A 83 11.357 3.519 -2.305 1.00 0.89 H new ATOM 0 HA SER A 83 11.594 0.874 -1.179 1.00 0.96 H new ATOM 0 HB2 SER A 83 13.457 2.458 -1.836 1.00 1.14 H new ATOM 0 HB3 SER A 83 13.002 3.481 -0.489 1.00 1.14 H new ATOM 0 HG SER A 83 14.718 2.034 0.048 1.00 1.97 H new ATOM 1269 N PHE A 84 10.128 3.133 0.676 1.00 0.71 N ATOM 1270 CA PHE A 84 9.163 3.206 1.784 1.00 0.64 C ATOM 1271 C PHE A 84 7.932 2.320 1.507 1.00 0.59 C ATOM 1272 O PHE A 84 7.475 1.614 2.402 1.00 0.57 O ATOM 1273 CB PHE A 84 8.747 4.664 1.993 1.00 0.64 C ATOM 1274 CG PHE A 84 7.708 4.897 3.081 1.00 0.61 C ATOM 1275 CD1 PHE A 84 8.109 5.127 4.413 1.00 1.71 C ATOM 1276 CD2 PHE A 84 6.341 4.981 2.746 1.00 1.65 C ATOM 1277 CE1 PHE A 84 7.160 5.481 5.390 1.00 1.74 C ATOM 1278 CE2 PHE A 84 5.392 5.332 3.723 1.00 1.63 C ATOM 1279 CZ PHE A 84 5.802 5.586 5.042 1.00 0.64 C ATOM 0 H PHE A 84 10.211 3.997 0.141 1.00 0.71 H new ATOM 0 HA PHE A 84 9.635 2.832 2.692 1.00 0.64 H new ATOM 0 HB2 PHE A 84 9.636 5.247 2.233 1.00 0.64 H new ATOM 0 HB3 PHE A 84 8.356 5.051 1.052 1.00 0.64 H new ATOM 0 HD1 PHE A 84 9.150 5.031 4.685 1.00 1.71 H new ATOM 0 HD2 PHE A 84 6.021 4.775 1.735 1.00 1.65 H new ATOM 0 HE1 PHE A 84 7.474 5.672 6.405 1.00 1.74 H new ATOM 0 HE2 PHE A 84 4.347 5.406 3.459 1.00 1.63 H new ATOM 0 HZ PHE A 84 5.073 5.862 5.790 1.00 0.64 H new ATOM 1289 N TRP A 85 7.421 2.293 0.267 1.00 0.61 N ATOM 1290 CA TRP A 85 6.289 1.436 -0.126 1.00 0.61 C ATOM 1291 C TRP A 85 6.579 -0.067 0.065 1.00 0.64 C ATOM 1292 O TRP A 85 5.724 -0.796 0.574 1.00 0.64 O ATOM 1293 CB TRP A 85 5.889 1.746 -1.574 1.00 0.66 C ATOM 1294 CG TRP A 85 4.716 0.962 -2.063 1.00 0.69 C ATOM 1295 CD1 TRP A 85 4.781 -0.179 -2.789 1.00 0.83 C ATOM 1296 CD2 TRP A 85 3.297 1.210 -1.823 1.00 0.67 C ATOM 1297 NE1 TRP A 85 3.505 -0.661 -3.005 1.00 0.88 N ATOM 1298 CE2 TRP A 85 2.557 0.144 -2.414 1.00 0.81 C ATOM 1299 CE3 TRP A 85 2.560 2.208 -1.146 1.00 0.62 C ATOM 1300 CZ2 TRP A 85 1.166 0.048 -2.300 1.00 0.90 C ATOM 1301 CZ3 TRP A 85 1.159 2.136 -1.060 1.00 0.72 C ATOM 1302 CH2 TRP A 85 0.464 1.050 -1.612 1.00 0.85 C ATOM 0 H TRP A 85 7.782 2.867 -0.495 1.00 0.61 H new ATOM 0 HA TRP A 85 5.455 1.664 0.538 1.00 0.61 H new ATOM 0 HB2 TRP A 85 5.662 2.809 -1.658 1.00 0.66 H new ATOM 0 HB3 TRP A 85 6.741 1.550 -2.225 1.00 0.66 H new ATOM 0 HD1 TRP A 85 5.690 -0.641 -3.144 1.00 0.83 H new ATOM 0 HE1 TRP A 85 3.292 -1.506 -3.535 1.00 0.88 H new ATOM 0 HE3 TRP A 85 3.080 3.037 -0.689 1.00 0.62 H new ATOM 0 HZ2 TRP A 85 0.638 -0.787 -2.736 1.00 0.90 H new ATOM 0 HZ3 TRP A 85 0.612 2.924 -0.564 1.00 0.72 H new ATOM 0 HH2 TRP A 85 -0.609 0.985 -1.508 1.00 0.85 H new ATOM 1313 N GLU A 86 7.800 -0.533 -0.234 1.00 0.70 N ATOM 1314 CA GLU A 86 8.236 -1.905 0.095 1.00 0.73 C ATOM 1315 C GLU A 86 8.122 -2.209 1.603 1.00 0.69 C ATOM 1316 O GLU A 86 7.802 -3.332 1.995 1.00 0.75 O ATOM 1317 CB GLU A 86 9.694 -2.155 -0.342 1.00 0.79 C ATOM 1318 CG GLU A 86 9.962 -2.032 -1.850 1.00 0.97 C ATOM 1319 CD GLU A 86 10.922 -3.113 -2.375 1.00 1.67 C ATOM 1320 OE1 GLU A 86 10.536 -4.314 -2.404 1.00 2.17 O ATOM 1321 OE2 GLU A 86 12.050 -2.791 -2.816 1.00 3.07 O ATOM 0 H GLU A 86 8.512 0.023 -0.708 1.00 0.70 H new ATOM 0 HA GLU A 86 7.566 -2.568 -0.453 1.00 0.73 H new ATOM 0 HB2 GLU A 86 10.338 -1.450 0.183 1.00 0.79 H new ATOM 0 HB3 GLU A 86 9.986 -3.154 -0.019 1.00 0.79 H new ATOM 0 HG2 GLU A 86 9.017 -2.099 -2.389 1.00 0.97 H new ATOM 0 HG3 GLU A 86 10.380 -1.048 -2.061 1.00 0.97 H new ATOM 1328 N LEU A 87 8.339 -1.202 2.455 1.00 0.65 N ATOM 1329 CA LEU A 87 8.307 -1.304 3.917 1.00 0.64 C ATOM 1330 C LEU A 87 6.890 -1.157 4.504 1.00 0.67 C ATOM 1331 O LEU A 87 6.625 -1.690 5.583 1.00 0.81 O ATOM 1332 CB LEU A 87 9.341 -0.322 4.504 1.00 0.83 C ATOM 1333 CG LEU A 87 10.785 -0.690 4.099 1.00 1.95 C ATOM 1334 CD1 LEU A 87 11.751 0.457 4.370 1.00 1.95 C ATOM 1335 CD2 LEU A 87 11.298 -1.893 4.885 1.00 2.89 C ATOM 0 H LEU A 87 8.550 -0.258 2.133 1.00 0.65 H new ATOM 0 HA LEU A 87 8.593 -2.313 4.214 1.00 0.64 H new ATOM 0 HB2 LEU A 87 9.115 0.688 4.163 1.00 0.83 H new ATOM 0 HB3 LEU A 87 9.260 -0.317 5.591 1.00 0.83 H new ATOM 0 HG LEU A 87 10.746 -0.916 3.033 1.00 1.95 H new ATOM 0 HD11 LEU A 87 12.758 0.163 4.073 1.00 1.95 H new ATOM 0 HD12 LEU A 87 11.445 1.333 3.798 1.00 1.95 H new ATOM 0 HD13 LEU A 87 11.742 0.697 5.433 1.00 1.95 H new ATOM 0 HD21 LEU A 87 12.317 -2.123 4.574 1.00 2.89 H new ATOM 0 HD22 LEU A 87 11.287 -1.663 5.950 1.00 2.89 H new ATOM 0 HD23 LEU A 87 10.657 -2.753 4.693 1.00 2.89 H new ATOM 1347 N ILE A 88 5.948 -0.541 3.781 1.00 0.63 N ATOM 1348 CA ILE A 88 4.507 -0.735 4.035 1.00 0.64 C ATOM 1349 C ILE A 88 4.093 -2.173 3.669 1.00 0.66 C ATOM 1350 O ILE A 88 3.328 -2.803 4.398 1.00 0.70 O ATOM 1351 CB ILE A 88 3.641 0.278 3.259 1.00 0.64 C ATOM 1352 CG1 ILE A 88 4.044 1.748 3.475 1.00 0.65 C ATOM 1353 CG2 ILE A 88 2.175 0.112 3.699 1.00 0.66 C ATOM 1354 CD1 ILE A 88 3.252 2.712 2.592 1.00 0.69 C ATOM 0 H ILE A 88 6.153 0.098 3.013 1.00 0.63 H new ATOM 0 HA ILE A 88 4.337 -0.566 5.098 1.00 0.64 H new ATOM 0 HB ILE A 88 3.788 0.061 2.201 1.00 0.64 H new ATOM 0 HG12 ILE A 88 3.892 2.012 4.522 1.00 0.65 H new ATOM 0 HG13 ILE A 88 5.108 1.863 3.268 1.00 0.65 H new ATOM 0 HG21 ILE A 88 1.550 0.823 3.158 1.00 0.66 H new ATOM 0 HG22 ILE A 88 1.842 -0.903 3.481 1.00 0.66 H new ATOM 0 HG23 ILE A 88 2.093 0.299 4.770 1.00 0.66 H new ATOM 0 HD11 ILE A 88 3.577 3.734 2.786 1.00 0.69 H new ATOM 0 HD12 ILE A 88 3.424 2.469 1.543 1.00 0.69 H new ATOM 0 HD13 ILE A 88 2.189 2.621 2.816 1.00 0.69 H new ATOM 1366 N GLY A 89 4.662 -2.734 2.599 1.00 0.68 N ATOM 1367 CA GLY A 89 4.531 -4.163 2.280 1.00 0.75 C ATOM 1368 C GLY A 89 4.998 -5.074 3.427 1.00 0.79 C ATOM 1369 O GLY A 89 4.362 -6.089 3.716 1.00 0.95 O ATOM 0 H GLY A 89 5.227 -2.213 1.928 1.00 0.68 H new ATOM 0 HA2 GLY A 89 3.490 -4.385 2.047 1.00 0.75 H new ATOM 0 HA3 GLY A 89 5.112 -4.386 1.385 1.00 0.75 H new ATOM 1373 N GLU A 90 6.039 -4.669 4.161 1.00 0.77 N ATOM 1374 CA GLU A 90 6.487 -5.319 5.386 1.00 0.87 C ATOM 1375 C GLU A 90 5.522 -5.075 6.569 1.00 0.87 C ATOM 1376 O GLU A 90 5.342 -5.988 7.369 1.00 0.99 O ATOM 1377 CB GLU A 90 7.926 -4.844 5.639 1.00 1.02 C ATOM 1378 CG GLU A 90 8.669 -5.546 6.772 1.00 1.32 C ATOM 1379 CD GLU A 90 9.112 -6.991 6.488 1.00 1.32 C ATOM 1380 OE1 GLU A 90 9.288 -7.385 5.312 1.00 2.65 O ATOM 1381 OE2 GLU A 90 9.367 -7.735 7.465 1.00 2.18 O ATOM 0 H GLU A 90 6.605 -3.859 3.909 1.00 0.77 H new ATOM 0 HA GLU A 90 6.481 -6.404 5.280 1.00 0.87 H new ATOM 0 HB2 GLU A 90 8.498 -4.974 4.720 1.00 1.02 H new ATOM 0 HB3 GLU A 90 7.903 -3.775 5.852 1.00 1.02 H new ATOM 0 HG2 GLU A 90 9.552 -4.958 7.021 1.00 1.32 H new ATOM 0 HG3 GLU A 90 8.029 -5.549 7.654 1.00 1.32 H new ATOM 1388 N ALA A 91 4.818 -3.933 6.672 1.00 0.75 N ATOM 1389 CA ALA A 91 3.704 -3.779 7.635 1.00 0.72 C ATOM 1390 C ALA A 91 2.608 -4.841 7.400 1.00 0.72 C ATOM 1391 O ALA A 91 2.147 -5.475 8.349 1.00 0.84 O ATOM 1392 CB ALA A 91 3.113 -2.350 7.617 1.00 0.62 C ATOM 0 H ALA A 91 4.997 -3.105 6.104 1.00 0.75 H new ATOM 0 HA ALA A 91 4.119 -3.941 8.630 1.00 0.72 H new ATOM 0 HB1 ALA A 91 2.299 -2.284 8.339 1.00 0.62 H new ATOM 0 HB2 ALA A 91 3.890 -1.632 7.879 1.00 0.62 H new ATOM 0 HB3 ALA A 91 2.733 -2.126 6.620 1.00 0.62 H new ATOM 1398 N ALA A 92 2.259 -5.133 6.139 1.00 0.67 N ATOM 1399 CA ALA A 92 1.316 -6.212 5.821 1.00 0.80 C ATOM 1400 C ALA A 92 1.843 -7.630 6.129 1.00 1.03 C ATOM 1401 O ALA A 92 1.068 -8.582 6.071 1.00 1.27 O ATOM 1402 CB ALA A 92 0.834 -6.112 4.373 1.00 0.78 C ATOM 0 H ALA A 92 2.616 -4.636 5.323 1.00 0.67 H new ATOM 0 HA ALA A 92 0.470 -6.063 6.492 1.00 0.80 H new ATOM 0 HB1 ALA A 92 0.137 -6.924 4.165 1.00 0.78 H new ATOM 0 HB2 ALA A 92 0.334 -5.156 4.221 1.00 0.78 H new ATOM 0 HB3 ALA A 92 1.688 -6.185 3.699 1.00 0.78 H new ATOM 1408 N LYS A 93 3.115 -7.824 6.519 1.00 1.09 N ATOM 1409 CA LYS A 93 3.565 -9.109 7.094 1.00 1.29 C ATOM 1410 C LYS A 93 3.014 -9.350 8.506 1.00 1.24 C ATOM 1411 O LYS A 93 3.091 -10.479 8.980 1.00 1.49 O ATOM 1412 CB LYS A 93 5.098 -9.255 7.042 1.00 1.51 C ATOM 1413 CG LYS A 93 5.678 -9.285 5.617 1.00 1.61 C ATOM 1414 CD LYS A 93 5.304 -10.566 4.847 1.00 1.36 C ATOM 1415 CE LYS A 93 6.015 -10.721 3.494 1.00 1.51 C ATOM 1416 NZ LYS A 93 5.763 -9.585 2.583 1.00 2.01 N ATOM 0 H LYS A 93 3.846 -7.116 6.449 1.00 1.09 H new ATOM 0 HA LYS A 93 3.145 -9.892 6.463 1.00 1.29 H new ATOM 0 HB2 LYS A 93 5.550 -8.428 7.589 1.00 1.51 H new ATOM 0 HB3 LYS A 93 5.383 -10.172 7.558 1.00 1.51 H new ATOM 0 HG2 LYS A 93 5.318 -8.417 5.065 1.00 1.61 H new ATOM 0 HG3 LYS A 93 6.764 -9.202 5.670 1.00 1.61 H new ATOM 0 HD2 LYS A 93 5.538 -11.431 5.468 1.00 1.36 H new ATOM 0 HD3 LYS A 93 4.227 -10.575 4.681 1.00 1.36 H new ATOM 0 HE2 LYS A 93 7.088 -10.816 3.661 1.00 1.51 H new ATOM 0 HE3 LYS A 93 5.683 -11.644 3.018 1.00 1.51 H new ATOM 0 HZ1 LYS A 93 6.266 -9.741 1.686 1.00 2.01 H new ATOM 0 HZ2 LYS A 93 4.742 -9.507 2.399 1.00 2.01 H new ATOM 0 HZ3 LYS A 93 6.103 -8.706 3.022 1.00 2.01 H new ATOM 1430 N SER A 94 2.382 -8.354 9.137 1.00 1.01 N ATOM 1431 CA SER A 94 1.660 -8.493 10.413 1.00 1.04 C ATOM 1432 C SER A 94 0.138 -8.270 10.307 1.00 1.01 C ATOM 1433 O SER A 94 -0.534 -8.129 11.331 1.00 1.35 O ATOM 1434 CB SER A 94 2.314 -7.631 11.498 1.00 1.26 C ATOM 1435 OG SER A 94 3.619 -8.127 11.751 1.00 1.60 O ATOM 0 H SER A 94 2.356 -7.404 8.767 1.00 1.01 H new ATOM 0 HA SER A 94 1.751 -9.538 10.709 1.00 1.04 H new ATOM 0 HB2 SER A 94 2.361 -6.591 11.176 1.00 1.26 H new ATOM 0 HB3 SER A 94 1.718 -7.655 12.410 1.00 1.26 H new ATOM 0 HG SER A 94 4.048 -7.581 12.443 1.00 1.60 H new ATOM 1441 N VAL A 95 -0.428 -8.259 9.089 1.00 1.00 N ATOM 1442 CA VAL A 95 -1.886 -8.352 8.858 1.00 1.20 C ATOM 1443 C VAL A 95 -2.206 -9.015 7.505 1.00 1.35 C ATOM 1444 O VAL A 95 -2.126 -8.392 6.448 1.00 1.32 O ATOM 1445 CB VAL A 95 -2.577 -6.983 9.059 1.00 1.38 C ATOM 1446 CG1 VAL A 95 -2.004 -5.823 8.231 1.00 1.38 C ATOM 1447 CG2 VAL A 95 -4.089 -7.096 8.838 1.00 1.82 C ATOM 0 H VAL A 95 0.114 -8.185 8.228 1.00 1.00 H new ATOM 0 HA VAL A 95 -2.309 -9.013 9.614 1.00 1.20 H new ATOM 0 HB VAL A 95 -2.364 -6.723 10.096 1.00 1.38 H new ATOM 0 HG11 VAL A 95 -2.561 -4.911 8.448 1.00 1.38 H new ATOM 0 HG12 VAL A 95 -0.955 -5.677 8.487 1.00 1.38 H new ATOM 0 HG13 VAL A 95 -2.090 -6.056 7.170 1.00 1.38 H new ATOM 0 HG21 VAL A 95 -4.552 -6.120 8.985 1.00 1.82 H new ATOM 0 HG22 VAL A 95 -4.284 -7.441 7.822 1.00 1.82 H new ATOM 0 HG23 VAL A 95 -4.508 -7.808 9.549 1.00 1.82 H new ATOM 1457 N LYS A 96 -2.541 -10.311 7.550 1.00 1.71 N ATOM 1458 CA LYS A 96 -2.980 -11.158 6.417 1.00 2.06 C ATOM 1459 C LYS A 96 -3.946 -12.269 6.874 1.00 2.77 C ATOM 1460 O LYS A 96 -4.131 -12.475 8.079 1.00 3.12 O ATOM 1461 CB LYS A 96 -1.777 -11.697 5.594 1.00 2.13 C ATOM 1462 CG LYS A 96 -0.377 -11.733 6.230 1.00 2.45 C ATOM 1463 CD LYS A 96 -0.306 -12.620 7.478 1.00 2.94 C ATOM 1464 CE LYS A 96 1.129 -12.760 7.996 1.00 4.37 C ATOM 1465 NZ LYS A 96 1.172 -13.411 9.328 1.00 5.64 N ATOM 0 H LYS A 96 -2.514 -10.833 8.426 1.00 1.71 H new ATOM 0 HA LYS A 96 -3.548 -10.524 5.736 1.00 2.06 H new ATOM 0 HB2 LYS A 96 -2.022 -12.714 5.286 1.00 2.13 H new ATOM 0 HB3 LYS A 96 -1.708 -11.097 4.687 1.00 2.13 H new ATOM 0 HG2 LYS A 96 0.341 -12.094 5.494 1.00 2.45 H new ATOM 0 HG3 LYS A 96 -0.079 -10.719 6.495 1.00 2.45 H new ATOM 0 HD2 LYS A 96 -0.935 -12.197 8.261 1.00 2.94 H new ATOM 0 HD3 LYS A 96 -0.706 -13.607 7.246 1.00 2.94 H new ATOM 0 HE2 LYS A 96 1.716 -13.344 7.287 1.00 4.37 H new ATOM 0 HE3 LYS A 96 1.591 -11.775 8.058 1.00 4.37 H new ATOM 0 HZ1 LYS A 96 2.159 -13.488 9.645 1.00 5.64 H new ATOM 0 HZ2 LYS A 96 0.633 -12.841 10.011 1.00 5.64 H new ATOM 0 HZ3 LYS A 96 0.754 -14.361 9.264 1.00 5.64 H new ATOM 1794 N GLU B 118 -10.245 4.301 16.009 1.00 3.54 N ATOM 1795 CA GLU B 118 -9.270 4.306 17.125 1.00 3.15 C ATOM 1796 C GLU B 118 -7.798 4.450 16.697 1.00 2.64 C ATOM 1797 O GLU B 118 -6.929 4.861 17.474 1.00 2.57 O ATOM 1798 CB GLU B 118 -9.413 3.020 17.967 1.00 3.33 C ATOM 1799 CG GLU B 118 -10.848 2.658 18.380 1.00 4.38 C ATOM 1800 CD GLU B 118 -11.535 1.746 17.360 1.00 5.32 C ATOM 1801 OE1 GLU B 118 -12.165 2.266 16.407 1.00 6.77 O ATOM 1802 OE2 GLU B 118 -11.459 0.503 17.497 1.00 5.23 O ATOM 0 HA GLU B 118 -9.516 5.195 17.706 1.00 3.15 H new ATOM 0 HB2 GLU B 118 -8.995 2.187 17.401 1.00 3.33 H new ATOM 0 HB3 GLU B 118 -8.810 3.127 18.869 1.00 3.33 H new ATOM 0 HG2 GLU B 118 -10.830 2.164 19.351 1.00 4.38 H new ATOM 0 HG3 GLU B 118 -11.431 3.571 18.498 1.00 4.38 H new ATOM 1809 N PHE B 119 -7.538 4.092 15.447 1.00 2.35 N ATOM 1810 CA PHE B 119 -6.222 4.088 14.803 1.00 1.98 C ATOM 1811 C PHE B 119 -5.916 5.447 14.154 1.00 1.81 C ATOM 1812 O PHE B 119 -6.832 6.185 13.776 1.00 1.91 O ATOM 1813 CB PHE B 119 -6.133 2.966 13.752 1.00 1.83 C ATOM 1814 CG PHE B 119 -6.629 1.592 14.175 1.00 2.19 C ATOM 1815 CD1 PHE B 119 -8.004 1.297 14.146 1.00 3.63 C ATOM 1816 CD2 PHE B 119 -5.720 0.582 14.536 1.00 2.03 C ATOM 1817 CE1 PHE B 119 -8.467 0.010 14.472 1.00 4.06 C ATOM 1818 CE2 PHE B 119 -6.178 -0.709 14.851 1.00 2.28 C ATOM 1819 CZ PHE B 119 -7.552 -0.995 14.826 1.00 3.04 C ATOM 0 H PHE B 119 -8.276 3.779 14.817 1.00 2.35 H new ATOM 0 HA PHE B 119 -5.476 3.904 15.576 1.00 1.98 H new ATOM 0 HB2 PHE B 119 -6.699 3.277 12.874 1.00 1.83 H new ATOM 0 HB3 PHE B 119 -5.092 2.871 13.443 1.00 1.83 H new ATOM 0 HD1 PHE B 119 -8.711 2.066 13.871 1.00 3.63 H new ATOM 0 HD2 PHE B 119 -4.663 0.800 14.572 1.00 2.03 H new ATOM 0 HE1 PHE B 119 -9.525 -0.205 14.450 1.00 4.06 H new ATOM 0 HE2 PHE B 119 -5.471 -1.483 15.113 1.00 2.28 H new ATOM 0 HZ PHE B 119 -7.904 -1.984 15.078 1.00 3.04 H new ATOM 1829 N SER B 120 -4.631 5.753 13.970 1.00 1.60 N ATOM 1830 CA SER B 120 -4.186 6.920 13.199 1.00 1.44 C ATOM 1831 C SER B 120 -4.655 6.842 11.737 1.00 1.26 C ATOM 1832 O SER B 120 -4.882 5.752 11.204 1.00 1.16 O ATOM 1833 CB SER B 120 -2.659 7.066 13.282 1.00 1.31 C ATOM 1834 OG SER B 120 -2.008 6.130 12.446 1.00 1.76 O ATOM 0 H SER B 120 -3.865 5.198 14.352 1.00 1.60 H new ATOM 0 HA SER B 120 -4.642 7.807 13.638 1.00 1.44 H new ATOM 0 HB2 SER B 120 -2.372 8.077 12.993 1.00 1.31 H new ATOM 0 HB3 SER B 120 -2.333 6.925 14.313 1.00 1.31 H new ATOM 0 HG SER B 120 -1.294 5.684 12.948 1.00 1.76 H new ATOM 1840 N ASP B 121 -4.766 7.992 11.064 1.00 1.27 N ATOM 1841 CA ASP B 121 -5.272 8.108 9.683 1.00 1.20 C ATOM 1842 C ASP B 121 -4.506 7.224 8.672 1.00 0.98 C ATOM 1843 O ASP B 121 -5.088 6.732 7.708 1.00 1.02 O ATOM 1844 CB ASP B 121 -5.203 9.598 9.293 1.00 1.32 C ATOM 1845 CG ASP B 121 -6.035 10.013 8.074 1.00 2.77 C ATOM 1846 OD1 ASP B 121 -7.092 9.398 7.801 1.00 3.53 O ATOM 1847 OD2 ASP B 121 -5.694 11.045 7.444 1.00 4.05 O ATOM 0 H ASP B 121 -4.502 8.890 11.469 1.00 1.27 H new ATOM 0 HA ASP B 121 -6.298 7.741 9.649 1.00 1.20 H new ATOM 0 HB2 ASP B 121 -5.526 10.192 10.148 1.00 1.32 H new ATOM 0 HB3 ASP B 121 -4.161 9.855 9.102 1.00 1.32 H new ATOM 1852 N VAL B 122 -3.219 6.954 8.934 1.00 0.78 N ATOM 1853 CA VAL B 122 -2.352 6.049 8.155 1.00 0.60 C ATOM 1854 C VAL B 122 -2.475 4.576 8.572 1.00 0.63 C ATOM 1855 O VAL B 122 -2.411 3.686 7.727 1.00 0.59 O ATOM 1856 CB VAL B 122 -0.890 6.542 8.256 1.00 0.59 C ATOM 1857 CG1 VAL B 122 -0.339 6.546 9.687 1.00 0.83 C ATOM 1858 CG2 VAL B 122 0.093 5.749 7.390 1.00 0.55 C ATOM 0 H VAL B 122 -2.731 7.375 9.725 1.00 0.78 H new ATOM 0 HA VAL B 122 -2.685 6.081 7.118 1.00 0.60 H new ATOM 0 HB VAL B 122 -0.958 7.565 7.885 1.00 0.59 H new ATOM 0 HG11 VAL B 122 0.691 6.903 9.679 1.00 0.83 H new ATOM 0 HG12 VAL B 122 -0.947 7.203 10.309 1.00 0.83 H new ATOM 0 HG13 VAL B 122 -0.369 5.534 10.091 1.00 0.83 H new ATOM 0 HG21 VAL B 122 1.097 6.155 7.515 1.00 0.55 H new ATOM 0 HG22 VAL B 122 0.084 4.702 7.695 1.00 0.55 H new ATOM 0 HG23 VAL B 122 -0.201 5.825 6.343 1.00 0.55 H new ATOM 1868 N GLU B 123 -2.677 4.303 9.861 1.00 0.78 N ATOM 1869 CA GLU B 123 -2.730 2.948 10.418 1.00 0.87 C ATOM 1870 C GLU B 123 -4.037 2.235 10.060 1.00 0.82 C ATOM 1871 O GLU B 123 -4.021 1.041 9.751 1.00 0.86 O ATOM 1872 CB GLU B 123 -2.486 3.049 11.926 1.00 1.06 C ATOM 1873 CG GLU B 123 -2.512 1.709 12.665 1.00 1.27 C ATOM 1874 CD GLU B 123 -2.118 1.872 14.140 1.00 1.56 C ATOM 1875 OE1 GLU B 123 -2.770 2.657 14.874 1.00 2.70 O ATOM 1876 OE2 GLU B 123 -1.183 1.166 14.579 1.00 1.74 O ATOM 0 H GLU B 123 -2.811 5.031 10.563 1.00 0.78 H new ATOM 0 HA GLU B 123 -1.950 2.326 9.978 1.00 0.87 H new ATOM 0 HB2 GLU B 123 -1.519 3.523 12.094 1.00 1.06 H new ATOM 0 HB3 GLU B 123 -3.242 3.704 12.360 1.00 1.06 H new ATOM 0 HG2 GLU B 123 -3.510 1.276 12.600 1.00 1.27 H new ATOM 0 HG3 GLU B 123 -1.829 1.011 12.180 1.00 1.27 H new ATOM 1883 N ARG B 124 -5.151 2.975 9.988 1.00 0.79 N ATOM 1884 CA ARG B 124 -6.383 2.475 9.360 1.00 0.73 C ATOM 1885 C ARG B 124 -6.233 2.286 7.849 1.00 0.50 C ATOM 1886 O ARG B 124 -6.693 1.264 7.351 1.00 0.53 O ATOM 1887 CB ARG B 124 -7.607 3.329 9.741 1.00 0.94 C ATOM 1888 CG ARG B 124 -7.507 4.847 9.497 1.00 1.31 C ATOM 1889 CD ARG B 124 -8.235 5.364 8.247 1.00 2.63 C ATOM 1890 NE ARG B 124 -8.461 6.819 8.350 1.00 2.90 N ATOM 1891 CZ ARG B 124 -9.384 7.412 9.086 1.00 3.17 C ATOM 1892 NH1 ARG B 124 -10.309 6.766 9.733 1.00 3.62 N ATOM 1893 NH2 ARG B 124 -9.373 8.699 9.227 1.00 3.84 N ATOM 0 H ARG B 124 -5.225 3.923 10.357 1.00 0.79 H new ATOM 0 HA ARG B 124 -6.565 1.479 9.764 1.00 0.73 H new ATOM 0 HB2 ARG B 124 -8.467 2.953 9.187 1.00 0.94 H new ATOM 0 HB3 ARG B 124 -7.815 3.169 10.799 1.00 0.94 H new ATOM 0 HG2 ARG B 124 -7.906 5.365 10.369 1.00 1.31 H new ATOM 0 HG3 ARG B 124 -6.454 5.117 9.421 1.00 1.31 H new ATOM 0 HD2 ARG B 124 -7.646 5.143 7.357 1.00 2.63 H new ATOM 0 HD3 ARG B 124 -9.189 4.848 8.134 1.00 2.63 H new ATOM 0 HE ARG B 124 -7.848 7.422 7.802 1.00 2.90 H new ATOM 0 HH11 ARG B 124 -10.347 5.748 9.687 1.00 3.62 H new ATOM 0 HH12 ARG B 124 -10.996 7.278 10.286 1.00 3.62 H new ATOM 0 HH21 ARG B 124 -8.651 9.256 8.770 1.00 3.84 H new ATOM 0 HH22 ARG B 124 -10.086 9.156 9.795 1.00 3.84 H new ATOM 1907 N ALA B 125 -5.553 3.200 7.144 1.00 0.53 N ATOM 1908 CA ALA B 125 -5.468 3.219 5.677 1.00 0.47 C ATOM 1909 C ALA B 125 -4.880 1.932 5.066 1.00 0.43 C ATOM 1910 O ALA B 125 -5.486 1.338 4.184 1.00 0.40 O ATOM 1911 CB ALA B 125 -4.641 4.430 5.236 1.00 0.49 C ATOM 0 H ALA B 125 -5.037 3.961 7.585 1.00 0.53 H new ATOM 0 HA ALA B 125 -6.490 3.287 5.305 1.00 0.47 H new ATOM 0 HB1 ALA B 125 -4.575 4.449 4.148 1.00 0.49 H new ATOM 0 HB2 ALA B 125 -5.120 5.345 5.586 1.00 0.49 H new ATOM 0 HB3 ALA B 125 -3.639 4.360 5.659 1.00 0.49 H new ATOM 1917 N ILE B 126 -3.723 1.468 5.545 1.00 0.49 N ATOM 1918 CA ILE B 126 -3.036 0.257 5.060 1.00 0.52 C ATOM 1919 C ILE B 126 -3.986 -0.937 5.197 1.00 0.52 C ATOM 1920 O ILE B 126 -4.171 -1.695 4.246 1.00 0.56 O ATOM 1921 CB ILE B 126 -1.675 0.022 5.779 1.00 0.58 C ATOM 1922 CG1 ILE B 126 -0.736 1.248 5.702 1.00 0.63 C ATOM 1923 CG2 ILE B 126 -0.971 -1.220 5.192 1.00 0.65 C ATOM 1924 CD1 ILE B 126 0.317 1.265 6.819 1.00 0.73 C ATOM 0 H ILE B 126 -3.221 1.933 6.301 1.00 0.49 H new ATOM 0 HA ILE B 126 -2.783 0.387 4.008 1.00 0.52 H new ATOM 0 HB ILE B 126 -1.899 -0.143 6.833 1.00 0.58 H new ATOM 0 HG12 ILE B 126 -0.233 1.254 4.735 1.00 0.63 H new ATOM 0 HG13 ILE B 126 -1.331 2.159 5.757 1.00 0.63 H new ATOM 0 HG21 ILE B 126 -0.020 -1.375 5.702 1.00 0.65 H new ATOM 0 HG22 ILE B 126 -1.604 -2.096 5.331 1.00 0.65 H new ATOM 0 HG23 ILE B 126 -0.791 -1.067 4.128 1.00 0.65 H new ATOM 0 HD11 ILE B 126 0.946 2.149 6.712 1.00 0.73 H new ATOM 0 HD12 ILE B 126 -0.181 1.289 7.788 1.00 0.73 H new ATOM 0 HD13 ILE B 126 0.935 0.369 6.751 1.00 0.73 H new ATOM 1936 N GLU B 127 -4.687 -1.044 6.329 1.00 0.50 N ATOM 1937 CA GLU B 127 -5.686 -2.096 6.522 1.00 0.52 C ATOM 1938 C GLU B 127 -6.976 -1.908 5.716 1.00 0.49 C ATOM 1939 O GLU B 127 -7.600 -2.899 5.345 1.00 0.55 O ATOM 1940 CB GLU B 127 -5.997 -2.303 8.006 1.00 0.70 C ATOM 1941 CG GLU B 127 -4.855 -3.078 8.662 1.00 1.70 C ATOM 1942 CD GLU B 127 -5.241 -3.586 10.052 1.00 2.44 C ATOM 1943 OE1 GLU B 127 -6.243 -4.328 10.181 1.00 2.61 O ATOM 1944 OE2 GLU B 127 -4.576 -3.220 11.048 1.00 3.79 O ATOM 0 H GLU B 127 -4.581 -0.415 7.125 1.00 0.50 H new ATOM 0 HA GLU B 127 -5.223 -2.999 6.123 1.00 0.52 H new ATOM 0 HB2 GLU B 127 -6.127 -1.340 8.499 1.00 0.70 H new ATOM 0 HB3 GLU B 127 -6.934 -2.849 8.120 1.00 0.70 H new ATOM 0 HG2 GLU B 127 -4.578 -3.922 8.030 1.00 1.70 H new ATOM 0 HG3 GLU B 127 -3.977 -2.436 8.740 1.00 1.70 H new ATOM 1951 N THR B 128 -7.341 -0.671 5.372 1.00 0.49 N ATOM 1952 CA THR B 128 -8.430 -0.374 4.422 1.00 0.58 C ATOM 1953 C THR B 128 -8.091 -0.914 3.029 1.00 0.61 C ATOM 1954 O THR B 128 -8.991 -1.367 2.322 1.00 0.71 O ATOM 1955 CB THR B 128 -8.734 1.137 4.360 1.00 0.64 C ATOM 1956 OG1 THR B 128 -9.085 1.618 5.636 1.00 0.70 O ATOM 1957 CG2 THR B 128 -9.891 1.523 3.439 1.00 0.73 C ATOM 0 H THR B 128 -6.889 0.164 5.745 1.00 0.49 H new ATOM 0 HA THR B 128 -9.328 -0.876 4.782 1.00 0.58 H new ATOM 0 HB THR B 128 -7.815 1.575 3.970 1.00 0.64 H new ATOM 0 HG1 THR B 128 -8.328 1.506 6.248 1.00 0.70 H new ATOM 0 HG21 THR B 128 -10.029 2.604 3.461 1.00 0.73 H new ATOM 0 HG22 THR B 128 -9.666 1.207 2.420 1.00 0.73 H new ATOM 0 HG23 THR B 128 -10.804 1.034 3.777 1.00 0.73 H new ATOM 1965 N LEU B 129 -6.806 -0.950 2.643 1.00 0.59 N ATOM 1966 CA LEU B 129 -6.388 -1.583 1.386 1.00 0.71 C ATOM 1967 C LEU B 129 -6.506 -3.109 1.505 1.00 0.64 C ATOM 1968 O LEU B 129 -7.069 -3.758 0.625 1.00 0.76 O ATOM 1969 CB LEU B 129 -4.950 -1.226 0.951 1.00 1.09 C ATOM 1970 CG LEU B 129 -4.377 0.204 1.077 1.00 0.58 C ATOM 1971 CD1 LEU B 129 -3.438 0.460 -0.106 1.00 1.12 C ATOM 1972 CD2 LEU B 129 -5.338 1.387 1.088 1.00 0.99 C ATOM 0 H LEU B 129 -6.040 -0.548 3.184 1.00 0.59 H new ATOM 0 HA LEU B 129 -7.058 -1.193 0.619 1.00 0.71 H new ATOM 0 HB2 LEU B 129 -4.283 -1.880 1.512 1.00 1.09 H new ATOM 0 HB3 LEU B 129 -4.863 -1.506 -0.099 1.00 1.09 H new ATOM 0 HG LEU B 129 -3.923 0.183 2.068 1.00 0.58 H new ATOM 0 HD11 LEU B 129 -3.025 1.466 -0.032 1.00 1.12 H new ATOM 0 HD12 LEU B 129 -2.626 -0.267 -0.090 1.00 1.12 H new ATOM 0 HD13 LEU B 129 -3.994 0.364 -1.039 1.00 1.12 H new ATOM 0 HD21 LEU B 129 -4.773 2.314 1.182 1.00 0.99 H new ATOM 0 HD22 LEU B 129 -5.907 1.402 0.159 1.00 0.99 H new ATOM 0 HD23 LEU B 129 -6.022 1.292 1.931 1.00 0.99 H new ATOM 1984 N ILE B 130 -6.001 -3.665 2.613 1.00 0.59 N ATOM 1985 CA ILE B 130 -5.984 -5.110 2.870 1.00 0.72 C ATOM 1986 C ILE B 130 -7.396 -5.694 2.902 1.00 0.64 C ATOM 1987 O ILE B 130 -7.679 -6.600 2.120 1.00 0.66 O ATOM 1988 CB ILE B 130 -5.168 -5.433 4.146 1.00 0.91 C ATOM 1989 CG1 ILE B 130 -3.657 -5.134 3.984 1.00 1.54 C ATOM 1990 CG2 ILE B 130 -5.365 -6.894 4.578 1.00 1.21 C ATOM 1991 CD1 ILE B 130 -3.030 -5.612 2.668 1.00 1.74 C ATOM 0 H ILE B 130 -5.587 -3.116 3.367 1.00 0.59 H new ATOM 0 HA ILE B 130 -5.477 -5.599 2.038 1.00 0.72 H new ATOM 0 HB ILE B 130 -5.553 -4.773 4.923 1.00 0.91 H new ATOM 0 HG12 ILE B 130 -3.505 -4.058 4.069 1.00 1.54 H new ATOM 0 HG13 ILE B 130 -3.121 -5.598 4.812 1.00 1.54 H new ATOM 0 HG21 ILE B 130 -4.779 -7.090 5.476 1.00 1.21 H new ATOM 0 HG22 ILE B 130 -6.420 -7.073 4.786 1.00 1.21 H new ATOM 0 HG23 ILE B 130 -5.036 -7.557 3.778 1.00 1.21 H new ATOM 0 HD11 ILE B 130 -1.971 -5.354 2.655 1.00 1.74 H new ATOM 0 HD12 ILE B 130 -3.141 -6.693 2.583 1.00 1.74 H new ATOM 0 HD13 ILE B 130 -3.532 -5.129 1.829 1.00 1.74 H new ATOM 2003 N LYS B 131 -8.314 -5.141 3.708 1.00 0.60 N ATOM 2004 CA LYS B 131 -9.727 -5.567 3.758 1.00 0.62 C ATOM 2005 C LYS B 131 -10.340 -5.687 2.361 1.00 0.57 C ATOM 2006 O LYS B 131 -11.051 -6.650 2.079 1.00 0.59 O ATOM 2007 CB LYS B 131 -10.542 -4.555 4.586 1.00 0.67 C ATOM 2008 CG LYS B 131 -10.348 -4.662 6.106 1.00 0.87 C ATOM 2009 CD LYS B 131 -10.939 -5.963 6.679 1.00 1.19 C ATOM 2010 CE LYS B 131 -11.000 -5.970 8.215 1.00 1.81 C ATOM 2011 NZ LYS B 131 -11.873 -4.895 8.744 1.00 2.81 N ATOM 0 H LYS B 131 -8.098 -4.379 4.350 1.00 0.60 H new ATOM 0 HA LYS B 131 -9.758 -6.552 4.223 1.00 0.62 H new ATOM 0 HB2 LYS B 131 -10.273 -3.547 4.270 1.00 0.67 H new ATOM 0 HB3 LYS B 131 -11.600 -4.689 4.359 1.00 0.67 H new ATOM 0 HG2 LYS B 131 -9.284 -4.615 6.339 1.00 0.87 H new ATOM 0 HG3 LYS B 131 -10.818 -3.807 6.591 1.00 0.87 H new ATOM 0 HD2 LYS B 131 -11.943 -6.106 6.280 1.00 1.19 H new ATOM 0 HD3 LYS B 131 -10.339 -6.808 6.341 1.00 1.19 H new ATOM 0 HE2 LYS B 131 -11.368 -6.937 8.558 1.00 1.81 H new ATOM 0 HE3 LYS B 131 -9.994 -5.851 8.618 1.00 1.81 H new ATOM 0 HZ1 LYS B 131 -12.118 -5.102 9.733 1.00 2.81 H new ATOM 0 HZ2 LYS B 131 -11.372 -3.985 8.694 1.00 2.81 H new ATOM 0 HZ3 LYS B 131 -12.743 -4.843 8.176 1.00 2.81 H new ATOM 2025 N ASN B 132 -10.005 -4.757 1.466 1.00 0.55 N ATOM 2026 CA ASN B 132 -10.551 -4.703 0.118 1.00 0.55 C ATOM 2027 C ASN B 132 -10.018 -5.772 -0.853 1.00 0.55 C ATOM 2028 O ASN B 132 -10.728 -6.099 -1.803 1.00 0.58 O ATOM 2029 CB ASN B 132 -10.447 -3.257 -0.409 1.00 0.61 C ATOM 2030 CG ASN B 132 -11.639 -2.442 0.047 1.00 0.68 C ATOM 2031 OD1 ASN B 132 -12.725 -2.564 -0.498 1.00 1.04 O ATOM 2032 ND2 ASN B 132 -11.499 -1.624 1.059 1.00 0.60 N ATOM 0 H ASN B 132 -9.337 -4.012 1.664 1.00 0.55 H new ATOM 0 HA ASN B 132 -11.604 -4.978 0.180 1.00 0.55 H new ATOM 0 HB2 ASN B 132 -9.526 -2.798 -0.050 1.00 0.61 H new ATOM 0 HB3 ASN B 132 -10.397 -3.263 -1.498 1.00 0.61 H new ATOM 0 HD21 ASN B 132 -12.298 -1.086 1.395 1.00 0.60 H new ATOM 0 HD22 ASN B 132 -10.591 -1.524 1.512 1.00 0.60 H new ATOM 2039 N PHE B 133 -8.854 -6.384 -0.600 1.00 0.56 N ATOM 2040 CA PHE B 133 -8.442 -7.610 -1.302 1.00 0.61 C ATOM 2041 C PHE B 133 -9.405 -8.767 -0.993 1.00 0.56 C ATOM 2042 O PHE B 133 -9.934 -9.406 -1.906 1.00 0.64 O ATOM 2043 CB PHE B 133 -6.999 -7.974 -0.907 1.00 0.71 C ATOM 2044 CG PHE B 133 -6.511 -9.320 -1.420 1.00 0.73 C ATOM 2045 CD1 PHE B 133 -6.701 -10.484 -0.655 1.00 2.03 C ATOM 2046 CD2 PHE B 133 -5.845 -9.413 -2.650 1.00 1.65 C ATOM 2047 CE1 PHE B 133 -6.246 -11.730 -1.119 1.00 2.12 C ATOM 2048 CE2 PHE B 133 -5.348 -10.648 -3.102 1.00 1.63 C ATOM 2049 CZ PHE B 133 -5.569 -11.812 -2.346 1.00 0.89 C ATOM 0 H PHE B 133 -8.178 -6.050 0.087 1.00 0.56 H new ATOM 0 HA PHE B 133 -8.477 -7.430 -2.377 1.00 0.61 H new ATOM 0 HB2 PHE B 133 -6.330 -7.197 -1.277 1.00 0.71 H new ATOM 0 HB3 PHE B 133 -6.924 -7.968 0.180 1.00 0.71 H new ATOM 0 HD1 PHE B 133 -7.202 -10.420 0.300 1.00 2.03 H new ATOM 0 HD2 PHE B 133 -5.713 -8.529 -3.255 1.00 1.65 H new ATOM 0 HE1 PHE B 133 -6.417 -12.621 -0.534 1.00 2.12 H new ATOM 0 HE2 PHE B 133 -4.797 -10.702 -4.029 1.00 1.63 H new ATOM 0 HZ PHE B 133 -5.219 -12.767 -2.708 1.00 0.89 H new ATOM 2059 N HIS B 134 -9.670 -9.020 0.292 1.00 0.54 N ATOM 2060 CA HIS B 134 -10.474 -10.162 0.747 1.00 0.63 C ATOM 2061 C HIS B 134 -11.968 -9.970 0.454 1.00 0.56 C ATOM 2062 O HIS B 134 -12.625 -10.888 -0.032 1.00 0.67 O ATOM 2063 CB HIS B 134 -10.223 -10.397 2.239 1.00 0.82 C ATOM 2064 CG HIS B 134 -8.772 -10.622 2.581 1.00 0.99 C ATOM 2065 ND1 HIS B 134 -8.050 -11.787 2.430 1.00 1.80 N ATOM 2066 CD2 HIS B 134 -7.897 -9.665 3.013 1.00 0.68 C ATOM 2067 CE1 HIS B 134 -6.778 -11.530 2.768 1.00 1.82 C ATOM 2068 NE2 HIS B 134 -6.637 -10.252 3.151 1.00 1.05 N ATOM 0 H HIS B 134 -9.330 -8.433 1.054 1.00 0.54 H new ATOM 0 HA HIS B 134 -10.165 -11.045 0.188 1.00 0.63 H new ATOM 0 HB2 HIS B 134 -10.590 -9.538 2.800 1.00 0.82 H new ATOM 0 HB3 HIS B 134 -10.802 -11.261 2.564 1.00 0.82 H new ATOM 0 HD1 HIS B 134 -8.418 -12.685 2.117 1.00 1.80 H new ATOM 0 HD2 HIS B 134 -8.139 -8.632 3.213 1.00 0.68 H new ATOM 0 HE1 HIS B 134 -5.976 -12.253 2.736 1.00 1.82 H new ATOM 2076 N GLN B 135 -12.499 -8.761 0.662 1.00 0.58 N ATOM 2077 CA GLN B 135 -13.899 -8.436 0.360 1.00 0.70 C ATOM 2078 C GLN B 135 -14.290 -8.589 -1.126 1.00 0.73 C ATOM 2079 O GLN B 135 -15.472 -8.791 -1.407 1.00 0.92 O ATOM 2080 CB GLN B 135 -14.204 -7.013 0.864 1.00 0.92 C ATOM 2081 CG GLN B 135 -14.956 -6.999 2.201 1.00 1.60 C ATOM 2082 CD GLN B 135 -14.199 -7.566 3.405 1.00 3.00 C ATOM 2083 OE1 GLN B 135 -14.038 -8.769 3.581 1.00 4.21 O ATOM 2084 NE2 GLN B 135 -13.767 -6.751 4.336 1.00 3.92 N ATOM 0 H GLN B 135 -11.970 -7.978 1.045 1.00 0.58 H new ATOM 0 HA GLN B 135 -14.511 -9.171 0.883 1.00 0.70 H new ATOM 0 HB2 GLN B 135 -13.269 -6.464 0.974 1.00 0.92 H new ATOM 0 HB3 GLN B 135 -14.796 -6.487 0.115 1.00 0.92 H new ATOM 0 HG2 GLN B 135 -15.237 -5.970 2.426 1.00 1.60 H new ATOM 0 HG3 GLN B 135 -15.881 -7.563 2.080 1.00 1.60 H new ATOM 0 HE21 GLN B 135 -13.883 -5.744 4.226 1.00 3.92 H new ATOM 0 HE22 GLN B 135 -13.315 -7.124 5.171 1.00 3.92 H new ATOM 2093 N TYR B 136 -13.349 -8.506 -2.076 1.00 0.67 N ATOM 2094 CA TYR B 136 -13.628 -8.670 -3.518 1.00 0.73 C ATOM 2095 C TYR B 136 -13.293 -10.035 -4.130 1.00 0.79 C ATOM 2096 O TYR B 136 -13.872 -10.370 -5.166 1.00 1.01 O ATOM 2097 CB TYR B 136 -12.995 -7.534 -4.337 1.00 0.68 C ATOM 2098 CG TYR B 136 -13.999 -6.449 -4.672 1.00 0.68 C ATOM 2099 CD1 TYR B 136 -14.297 -5.443 -3.735 1.00 2.11 C ATOM 2100 CD2 TYR B 136 -14.672 -6.475 -5.910 1.00 1.74 C ATOM 2101 CE1 TYR B 136 -15.259 -4.462 -4.042 1.00 2.11 C ATOM 2102 CE2 TYR B 136 -15.602 -5.469 -6.233 1.00 1.78 C ATOM 2103 CZ TYR B 136 -15.912 -4.467 -5.294 1.00 0.77 C ATOM 2104 OH TYR B 136 -16.856 -3.535 -5.584 1.00 0.85 O ATOM 0 H TYR B 136 -12.367 -8.323 -1.870 1.00 0.67 H new ATOM 0 HA TYR B 136 -14.715 -8.617 -3.576 1.00 0.73 H new ATOM 0 HB2 TYR B 136 -12.166 -7.101 -3.777 1.00 0.68 H new ATOM 0 HB3 TYR B 136 -12.579 -7.940 -5.259 1.00 0.68 H new ATOM 0 HD1 TYR B 136 -13.789 -5.423 -2.782 1.00 2.11 H new ATOM 0 HD2 TYR B 136 -14.473 -7.270 -6.614 1.00 1.74 H new ATOM 0 HE1 TYR B 136 -15.499 -3.700 -3.315 1.00 2.11 H new ATOM 0 HE2 TYR B 136 -16.078 -5.466 -7.202 1.00 1.78 H new ATOM 0 HH TYR B 136 -17.200 -3.688 -6.489 1.00 0.85 H new ATOM 2114 N SER B 137 -12.402 -10.820 -3.520 1.00 0.71 N ATOM 2115 CA SER B 137 -11.901 -12.095 -4.060 1.00 0.79 C ATOM 2116 C SER B 137 -12.876 -13.259 -3.838 1.00 0.88 C ATOM 2117 O SER B 137 -12.620 -14.185 -3.064 1.00 1.12 O ATOM 2118 CB SER B 137 -10.493 -12.397 -3.526 1.00 0.84 C ATOM 2119 OG SER B 137 -10.334 -12.026 -2.174 1.00 1.72 O ATOM 0 H SER B 137 -11.996 -10.585 -2.614 1.00 0.71 H new ATOM 0 HA SER B 137 -11.827 -11.983 -5.142 1.00 0.79 H new ATOM 0 HB2 SER B 137 -10.289 -13.462 -3.633 1.00 0.84 H new ATOM 0 HB3 SER B 137 -9.757 -11.869 -4.133 1.00 0.84 H new ATOM 0 HG SER B 137 -10.125 -11.070 -2.119 1.00 1.72 H new ATOM 2125 N VAL B 138 -14.019 -13.222 -4.526 1.00 0.90 N ATOM 2126 CA VAL B 138 -15.068 -14.250 -4.429 1.00 1.00 C ATOM 2127 C VAL B 138 -14.657 -15.521 -5.177 1.00 1.05 C ATOM 2128 O VAL B 138 -14.750 -16.608 -4.603 1.00 1.33 O ATOM 2129 CB VAL B 138 -16.431 -13.713 -4.913 1.00 1.18 C ATOM 2130 CG1 VAL B 138 -17.529 -14.782 -4.828 1.00 2.56 C ATOM 2131 CG2 VAL B 138 -16.894 -12.516 -4.073 1.00 2.13 C ATOM 0 H VAL B 138 -14.249 -12.470 -5.175 1.00 0.90 H new ATOM 0 HA VAL B 138 -15.186 -14.512 -3.378 1.00 1.00 H new ATOM 0 HB VAL B 138 -16.280 -13.414 -5.950 1.00 1.18 H new ATOM 0 HG11 VAL B 138 -18.472 -14.363 -5.178 1.00 2.56 H new ATOM 0 HG12 VAL B 138 -17.257 -15.634 -5.451 1.00 2.56 H new ATOM 0 HG13 VAL B 138 -17.639 -15.109 -3.794 1.00 2.56 H new ATOM 0 HG21 VAL B 138 -17.857 -12.164 -4.442 1.00 2.13 H new ATOM 0 HG22 VAL B 138 -16.993 -12.820 -3.031 1.00 2.13 H new ATOM 0 HG23 VAL B 138 -16.161 -11.713 -4.149 1.00 2.13 H new ATOM 2141 N GLU B 139 -14.138 -15.413 -6.405 1.00 0.98 N ATOM 2142 CA GLU B 139 -13.604 -16.561 -7.159 1.00 1.18 C ATOM 2143 C GLU B 139 -12.224 -16.973 -6.618 1.00 1.41 C ATOM 2144 O GLU B 139 -11.946 -18.166 -6.462 1.00 1.76 O ATOM 2145 CB GLU B 139 -13.551 -16.214 -8.659 1.00 1.23 C ATOM 2146 CG GLU B 139 -13.162 -17.391 -9.572 1.00 2.06 C ATOM 2147 CD GLU B 139 -14.211 -18.506 -9.602 1.00 2.63 C ATOM 2148 OE1 GLU B 139 -15.250 -18.356 -10.290 1.00 2.65 O ATOM 2149 OE2 GLU B 139 -14.020 -19.548 -8.929 1.00 3.97 O ATOM 0 H GLU B 139 -14.075 -14.528 -6.908 1.00 0.98 H new ATOM 0 HA GLU B 139 -14.266 -17.418 -7.031 1.00 1.18 H new ATOM 0 HB2 GLU B 139 -14.527 -15.839 -8.967 1.00 1.23 H new ATOM 0 HB3 GLU B 139 -12.837 -15.404 -8.807 1.00 1.23 H new ATOM 0 HG2 GLU B 139 -13.007 -17.020 -10.585 1.00 2.06 H new ATOM 0 HG3 GLU B 139 -12.212 -17.805 -9.235 1.00 2.06 H new ATOM 2156 N GLY B 140 -11.392 -15.997 -6.235 1.00 1.40 N ATOM 2157 CA GLY B 140 -10.112 -16.211 -5.548 1.00 1.76 C ATOM 2158 C GLY B 140 -10.211 -16.797 -4.126 1.00 1.66 C ATOM 2159 O GLY B 140 -9.204 -17.227 -3.555 1.00 2.29 O ATOM 0 H GLY B 140 -11.595 -15.011 -6.398 1.00 1.40 H new ATOM 0 HA2 GLY B 140 -9.501 -16.879 -6.155 1.00 1.76 H new ATOM 0 HA3 GLY B 140 -9.585 -15.258 -5.493 1.00 1.76 H new ATOM 2163 N GLY B 141 -11.413 -16.864 -3.543 1.00 2.20 N ATOM 2164 CA GLY B 141 -11.674 -17.509 -2.250 1.00 2.47 C ATOM 2165 C GLY B 141 -10.988 -16.834 -1.059 1.00 2.17 C ATOM 2166 O GLY B 141 -10.493 -17.525 -0.170 1.00 2.69 O ATOM 0 H GLY B 141 -12.250 -16.463 -3.966 1.00 2.20 H new ATOM 0 HA2 GLY B 141 -12.750 -17.523 -2.075 1.00 2.47 H new ATOM 0 HA3 GLY B 141 -11.346 -18.547 -2.302 1.00 2.47 H new ATOM 2170 N LYS B 142 -10.893 -15.498 -1.065 1.00 1.93 N ATOM 2171 CA LYS B 142 -10.193 -14.655 -0.068 1.00 1.65 C ATOM 2172 C LYS B 142 -8.681 -14.882 0.098 1.00 1.34 C ATOM 2173 O LYS B 142 -8.059 -14.185 0.898 1.00 1.43 O ATOM 2174 CB LYS B 142 -10.924 -14.677 1.282 1.00 1.96 C ATOM 2175 CG LYS B 142 -12.400 -14.272 1.143 1.00 2.04 C ATOM 2176 CD LYS B 142 -13.016 -13.792 2.461 1.00 3.03 C ATOM 2177 CE LYS B 142 -12.914 -14.823 3.591 1.00 3.72 C ATOM 2178 NZ LYS B 142 -13.406 -14.261 4.867 1.00 5.02 N ATOM 0 H LYS B 142 -11.323 -14.939 -1.802 1.00 1.93 H new ATOM 0 HA LYS B 142 -10.240 -13.655 -0.498 1.00 1.65 H new ATOM 0 HB2 LYS B 142 -10.861 -15.676 1.712 1.00 1.96 H new ATOM 0 HB3 LYS B 142 -10.426 -14.000 1.975 1.00 1.96 H new ATOM 0 HG2 LYS B 142 -12.485 -13.480 0.399 1.00 2.04 H new ATOM 0 HG3 LYS B 142 -12.971 -15.122 0.770 1.00 2.04 H new ATOM 0 HD2 LYS B 142 -12.520 -12.873 2.772 1.00 3.03 H new ATOM 0 HD3 LYS B 142 -14.065 -13.548 2.296 1.00 3.03 H new ATOM 0 HE2 LYS B 142 -13.493 -15.710 3.333 1.00 3.72 H new ATOM 0 HE3 LYS B 142 -11.878 -15.141 3.705 1.00 3.72 H new ATOM 0 HZ1 LYS B 142 -13.326 -14.978 5.616 1.00 5.02 H new ATOM 0 HZ2 LYS B 142 -12.837 -13.429 5.122 1.00 5.02 H new ATOM 0 HZ3 LYS B 142 -14.402 -13.980 4.761 1.00 5.02 H new ATOM 2192 N GLU B 143 -8.083 -15.822 -0.635 1.00 1.34 N ATOM 2193 CA GLU B 143 -6.654 -16.181 -0.553 1.00 1.41 C ATOM 2194 C GLU B 143 -5.876 -15.844 -1.839 1.00 1.22 C ATOM 2195 O GLU B 143 -4.673 -15.582 -1.768 1.00 1.27 O ATOM 2196 CB GLU B 143 -6.529 -17.674 -0.190 1.00 1.95 C ATOM 2197 CG GLU B 143 -6.825 -17.934 1.297 1.00 3.11 C ATOM 2198 CD GLU B 143 -7.074 -19.421 1.573 1.00 3.84 C ATOM 2199 OE1 GLU B 143 -6.118 -20.196 1.812 1.00 3.97 O ATOM 2200 OE2 GLU B 143 -8.253 -19.846 1.523 1.00 4.91 O ATOM 0 H GLU B 143 -8.590 -16.376 -1.326 1.00 1.34 H new ATOM 0 HA GLU B 143 -6.197 -15.576 0.230 1.00 1.41 H new ATOM 0 HB2 GLU B 143 -7.218 -18.255 -0.803 1.00 1.95 H new ATOM 0 HB3 GLU B 143 -5.523 -18.021 -0.425 1.00 1.95 H new ATOM 0 HG2 GLU B 143 -5.987 -17.587 1.901 1.00 3.11 H new ATOM 0 HG3 GLU B 143 -7.698 -17.356 1.601 1.00 3.11 H new ATOM 2207 N THR B 144 -6.555 -15.783 -2.993 1.00 1.07 N ATOM 2208 CA THR B 144 -6.024 -15.267 -4.278 1.00 0.94 C ATOM 2209 C THR B 144 -7.005 -14.250 -4.890 1.00 0.85 C ATOM 2210 O THR B 144 -8.010 -13.926 -4.264 1.00 0.94 O ATOM 2211 CB THR B 144 -5.634 -16.377 -5.283 1.00 0.96 C ATOM 2212 OG1 THR B 144 -6.726 -16.850 -6.039 1.00 1.03 O ATOM 2213 CG2 THR B 144 -4.997 -17.610 -4.639 1.00 1.21 C ATOM 0 H THR B 144 -7.522 -16.100 -3.068 1.00 1.07 H new ATOM 0 HA THR B 144 -5.088 -14.757 -4.051 1.00 0.94 H new ATOM 0 HB THR B 144 -4.907 -15.872 -5.919 1.00 0.96 H new ATOM 0 HG1 THR B 144 -6.419 -17.547 -6.656 1.00 1.03 H new ATOM 0 HG21 THR B 144 -4.754 -18.339 -5.412 1.00 1.21 H new ATOM 0 HG22 THR B 144 -4.086 -17.318 -4.116 1.00 1.21 H new ATOM 0 HG23 THR B 144 -5.697 -18.052 -3.930 1.00 1.21 H new ATOM 2221 N LEU B 145 -6.724 -13.700 -6.077 1.00 0.84 N ATOM 2222 CA LEU B 145 -7.508 -12.637 -6.724 1.00 0.83 C ATOM 2223 C LEU B 145 -7.515 -12.906 -8.239 1.00 0.94 C ATOM 2224 O LEU B 145 -6.448 -12.913 -8.849 1.00 1.48 O ATOM 2225 CB LEU B 145 -6.804 -11.314 -6.340 1.00 1.22 C ATOM 2226 CG LEU B 145 -7.466 -9.948 -6.585 1.00 0.70 C ATOM 2227 CD1 LEU B 145 -7.949 -9.729 -8.015 1.00 0.79 C ATOM 2228 CD2 LEU B 145 -8.662 -9.705 -5.655 1.00 0.74 C ATOM 0 H LEU B 145 -5.920 -13.990 -6.633 1.00 0.84 H new ATOM 0 HA LEU B 145 -8.551 -12.592 -6.410 1.00 0.83 H new ATOM 0 HB2 LEU B 145 -6.583 -11.371 -5.274 1.00 1.22 H new ATOM 0 HB3 LEU B 145 -5.848 -11.301 -6.864 1.00 1.22 H new ATOM 0 HG LEU B 145 -6.663 -9.241 -6.377 1.00 0.70 H new ATOM 0 HD11 LEU B 145 -8.402 -8.741 -8.099 1.00 0.79 H new ATOM 0 HD12 LEU B 145 -7.104 -9.799 -8.699 1.00 0.79 H new ATOM 0 HD13 LEU B 145 -8.687 -10.490 -8.270 1.00 0.79 H new ATOM 0 HD21 LEU B 145 -9.095 -8.727 -5.867 1.00 0.74 H new ATOM 0 HD22 LEU B 145 -9.413 -10.478 -5.819 1.00 0.74 H new ATOM 0 HD23 LEU B 145 -8.329 -9.737 -4.618 1.00 0.74 H new ATOM 2240 N THR B 146 -8.668 -13.169 -8.860 1.00 0.78 N ATOM 2241 CA THR B 146 -8.705 -13.559 -10.287 1.00 0.78 C ATOM 2242 C THR B 146 -8.697 -12.353 -11.248 1.00 0.78 C ATOM 2243 O THR B 146 -9.324 -11.335 -10.951 1.00 0.66 O ATOM 2244 CB THR B 146 -9.861 -14.513 -10.622 1.00 0.81 C ATOM 2245 OG1 THR B 146 -11.122 -13.950 -10.337 1.00 1.10 O ATOM 2246 CG2 THR B 146 -9.749 -15.828 -9.855 1.00 0.98 C ATOM 0 H THR B 146 -9.582 -13.122 -8.410 1.00 0.78 H new ATOM 0 HA THR B 146 -7.775 -14.105 -10.445 1.00 0.78 H new ATOM 0 HB THR B 146 -9.782 -14.698 -11.693 1.00 0.81 H new ATOM 0 HG1 THR B 146 -11.309 -14.036 -9.379 1.00 1.10 H new ATOM 0 HG21 THR B 146 -10.585 -16.476 -10.119 1.00 0.98 H new ATOM 0 HG22 THR B 146 -8.812 -16.321 -10.113 1.00 0.98 H new ATOM 0 HG23 THR B 146 -9.770 -15.627 -8.784 1.00 0.98 H new ATOM 2254 N PRO B 147 -8.056 -12.433 -12.435 1.00 1.01 N ATOM 2255 CA PRO B 147 -7.990 -11.329 -13.409 1.00 1.22 C ATOM 2256 C PRO B 147 -9.336 -10.715 -13.839 1.00 1.22 C ATOM 2257 O PRO B 147 -9.381 -9.534 -14.186 1.00 1.35 O ATOM 2258 CB PRO B 147 -7.259 -11.927 -14.615 1.00 1.59 C ATOM 2259 CG PRO B 147 -6.308 -12.932 -13.981 1.00 1.59 C ATOM 2260 CD PRO B 147 -7.166 -13.509 -12.864 1.00 1.23 C ATOM 0 HA PRO B 147 -7.485 -10.481 -12.945 1.00 1.22 H new ATOM 0 HB2 PRO B 147 -7.950 -12.408 -15.307 1.00 1.59 H new ATOM 0 HB3 PRO B 147 -6.722 -11.165 -15.179 1.00 1.59 H new ATOM 0 HG2 PRO B 147 -5.990 -13.697 -14.689 1.00 1.59 H new ATOM 0 HG3 PRO B 147 -5.405 -12.456 -13.599 1.00 1.59 H new ATOM 0 HD2 PRO B 147 -7.736 -14.369 -13.216 1.00 1.23 H new ATOM 0 HD3 PRO B 147 -6.546 -13.855 -12.036 1.00 1.23 H new ATOM 2268 N SER B 148 -10.440 -11.470 -13.796 1.00 1.20 N ATOM 2269 CA SER B 148 -11.776 -10.933 -14.101 1.00 1.39 C ATOM 2270 C SER B 148 -12.360 -10.090 -12.956 1.00 1.18 C ATOM 2271 O SER B 148 -12.885 -8.999 -13.200 1.00 1.34 O ATOM 2272 CB SER B 148 -12.729 -12.067 -14.480 1.00 1.65 C ATOM 2273 OG SER B 148 -13.872 -11.532 -15.114 1.00 2.33 O ATOM 0 H SER B 148 -10.436 -12.460 -13.552 1.00 1.20 H new ATOM 0 HA SER B 148 -11.661 -10.260 -14.950 1.00 1.39 H new ATOM 0 HB2 SER B 148 -12.228 -12.770 -15.145 1.00 1.65 H new ATOM 0 HB3 SER B 148 -13.021 -12.623 -13.589 1.00 1.65 H new ATOM 0 HG SER B 148 -14.481 -12.260 -15.358 1.00 2.33 H new ATOM 2279 N GLU B 149 -12.216 -10.524 -11.696 1.00 0.91 N ATOM 2280 CA GLU B 149 -12.659 -9.742 -10.526 1.00 0.76 C ATOM 2281 C GLU B 149 -11.692 -8.584 -10.190 1.00 0.62 C ATOM 2282 O GLU B 149 -12.094 -7.585 -9.595 1.00 0.63 O ATOM 2283 CB GLU B 149 -13.053 -10.661 -9.352 1.00 0.82 C ATOM 2284 CG GLU B 149 -11.909 -11.214 -8.489 1.00 0.62 C ATOM 2285 CD GLU B 149 -12.256 -12.558 -7.822 1.00 0.71 C ATOM 2286 OE1 GLU B 149 -13.434 -12.807 -7.467 1.00 1.72 O ATOM 2287 OE2 GLU B 149 -11.334 -13.402 -7.708 1.00 1.44 O ATOM 0 H GLU B 149 -11.792 -11.421 -11.457 1.00 0.91 H new ATOM 0 HA GLU B 149 -13.583 -9.223 -10.782 1.00 0.76 H new ATOM 0 HB2 GLU B 149 -13.732 -10.109 -8.702 1.00 0.82 H new ATOM 0 HB3 GLU B 149 -13.613 -11.505 -9.755 1.00 0.82 H new ATOM 0 HG2 GLU B 149 -11.022 -11.341 -9.109 1.00 0.62 H new ATOM 0 HG3 GLU B 149 -11.658 -10.486 -7.718 1.00 0.62 H new ATOM 2294 N LEU B 150 -10.444 -8.663 -10.675 1.00 0.62 N ATOM 2295 CA LEU B 150 -9.508 -7.539 -10.774 1.00 0.65 C ATOM 2296 C LEU B 150 -10.097 -6.396 -11.628 1.00 0.71 C ATOM 2297 O LEU B 150 -10.153 -5.259 -11.170 1.00 0.74 O ATOM 2298 CB LEU B 150 -8.170 -8.063 -11.344 1.00 0.74 C ATOM 2299 CG LEU B 150 -6.902 -7.265 -10.989 1.00 0.97 C ATOM 2300 CD1 LEU B 150 -5.706 -7.896 -11.700 1.00 1.46 C ATOM 2301 CD2 LEU B 150 -6.940 -5.798 -11.409 1.00 1.13 C ATOM 0 H LEU B 150 -10.049 -9.538 -11.019 1.00 0.62 H new ATOM 0 HA LEU B 150 -9.329 -7.116 -9.785 1.00 0.65 H new ATOM 0 HB2 LEU B 150 -8.033 -9.088 -11.000 1.00 0.74 H new ATOM 0 HB3 LEU B 150 -8.255 -8.100 -12.430 1.00 0.74 H new ATOM 0 HG LEU B 150 -6.829 -7.298 -9.902 1.00 0.97 H new ATOM 0 HD11 LEU B 150 -4.802 -7.338 -11.456 1.00 1.46 H new ATOM 0 HD12 LEU B 150 -5.594 -8.930 -11.375 1.00 1.46 H new ATOM 0 HD13 LEU B 150 -5.868 -7.870 -12.778 1.00 1.46 H new ATOM 0 HD21 LEU B 150 -6.008 -5.313 -11.120 1.00 1.13 H new ATOM 0 HD22 LEU B 150 -7.064 -5.732 -12.490 1.00 1.13 H new ATOM 0 HD23 LEU B 150 -7.776 -5.300 -10.917 1.00 1.13 H new ATOM 2313 N ARG B 151 -10.606 -6.667 -12.840 1.00 0.78 N ATOM 2314 CA ARG B 151 -11.279 -5.623 -13.647 1.00 0.88 C ATOM 2315 C ARG B 151 -12.512 -5.068 -12.924 1.00 0.95 C ATOM 2316 O ARG B 151 -12.688 -3.852 -12.896 1.00 1.23 O ATOM 2317 CB ARG B 151 -11.646 -6.151 -15.044 1.00 0.92 C ATOM 2318 CG ARG B 151 -10.386 -6.333 -15.897 1.00 1.93 C ATOM 2319 CD ARG B 151 -10.666 -6.928 -17.280 1.00 1.62 C ATOM 2320 NE ARG B 151 -11.339 -5.982 -18.195 1.00 2.36 N ATOM 2321 CZ ARG B 151 -12.629 -5.904 -18.475 1.00 2.70 C ATOM 2322 NH1 ARG B 151 -13.515 -6.731 -17.995 1.00 3.46 N ATOM 2323 NH2 ARG B 151 -13.048 -4.956 -19.256 1.00 3.58 N ATOM 0 H ARG B 151 -10.568 -7.585 -13.283 1.00 0.78 H new ATOM 0 HA ARG B 151 -10.574 -4.801 -13.776 1.00 0.88 H new ATOM 0 HB2 ARG B 151 -12.171 -7.102 -14.953 1.00 0.92 H new ATOM 0 HB3 ARG B 151 -12.327 -5.456 -15.535 1.00 0.92 H new ATOM 0 HG2 ARG B 151 -9.896 -5.367 -16.018 1.00 1.93 H new ATOM 0 HG3 ARG B 151 -9.688 -6.980 -15.366 1.00 1.93 H new ATOM 0 HD2 ARG B 151 -9.725 -7.249 -17.727 1.00 1.62 H new ATOM 0 HD3 ARG B 151 -11.286 -7.818 -17.167 1.00 1.62 H new ATOM 0 HE ARG B 151 -10.736 -5.308 -18.667 1.00 2.36 H new ATOM 0 HH11 ARG B 151 -13.225 -7.484 -17.371 1.00 3.46 H new ATOM 0 HH12 ARG B 151 -14.499 -6.625 -18.244 1.00 3.46 H new ATOM 0 HH21 ARG B 151 -12.385 -4.285 -19.644 1.00 3.58 H new ATOM 0 HH22 ARG B 151 -14.040 -4.882 -19.482 1.00 3.58 H new ATOM 2337 N ASP B 152 -13.298 -5.944 -12.287 1.00 0.81 N ATOM 2338 CA ASP B 152 -14.513 -5.586 -11.540 1.00 0.81 C ATOM 2339 C ASP B 152 -14.228 -4.580 -10.415 1.00 0.78 C ATOM 2340 O ASP B 152 -14.785 -3.482 -10.443 1.00 0.93 O ATOM 2341 CB ASP B 152 -15.196 -6.857 -11.005 1.00 0.90 C ATOM 2342 CG ASP B 152 -16.585 -6.619 -10.400 1.00 1.16 C ATOM 2343 OD1 ASP B 152 -17.497 -6.164 -11.128 1.00 1.80 O ATOM 2344 OD2 ASP B 152 -16.829 -7.037 -9.246 1.00 2.21 O ATOM 0 H ASP B 152 -13.104 -6.945 -12.275 1.00 0.81 H new ATOM 0 HA ASP B 152 -15.196 -5.088 -12.228 1.00 0.81 H new ATOM 0 HB2 ASP B 152 -15.285 -7.577 -11.818 1.00 0.90 H new ATOM 0 HB3 ASP B 152 -14.555 -7.309 -10.248 1.00 0.90 H new ATOM 2349 N LEU B 153 -13.321 -4.867 -9.466 1.00 0.67 N ATOM 2350 CA LEU B 153 -13.071 -3.906 -8.380 1.00 0.65 C ATOM 2351 C LEU B 153 -12.381 -2.622 -8.850 1.00 0.69 C ATOM 2352 O LEU B 153 -12.550 -1.586 -8.212 1.00 0.79 O ATOM 2353 CB LEU B 153 -12.417 -4.537 -7.131 1.00 0.67 C ATOM 2354 CG LEU B 153 -10.937 -4.271 -6.831 1.00 0.87 C ATOM 2355 CD1 LEU B 153 -10.596 -4.740 -5.416 1.00 1.12 C ATOM 2356 CD2 LEU B 153 -10.021 -5.012 -7.798 1.00 0.90 C ATOM 0 H LEU B 153 -12.768 -5.723 -9.427 1.00 0.67 H new ATOM 0 HA LEU B 153 -14.061 -3.592 -8.048 1.00 0.65 H new ATOM 0 HB2 LEU B 153 -12.989 -4.209 -6.263 1.00 0.67 H new ATOM 0 HB3 LEU B 153 -12.545 -5.617 -7.207 1.00 0.67 H new ATOM 0 HG LEU B 153 -10.780 -3.198 -6.937 1.00 0.87 H new ATOM 0 HD11 LEU B 153 -9.543 -4.547 -5.213 1.00 1.12 H new ATOM 0 HD12 LEU B 153 -11.210 -4.199 -4.696 1.00 1.12 H new ATOM 0 HD13 LEU B 153 -10.792 -5.809 -5.330 1.00 1.12 H new ATOM 0 HD21 LEU B 153 -8.981 -4.797 -7.551 1.00 0.90 H new ATOM 0 HD22 LEU B 153 -10.199 -6.084 -7.718 1.00 0.90 H new ATOM 0 HD23 LEU B 153 -10.227 -4.685 -8.817 1.00 0.90 H new ATOM 2368 N VAL B 154 -11.647 -2.642 -9.965 1.00 0.64 N ATOM 2369 CA VAL B 154 -10.992 -1.425 -10.460 1.00 0.66 C ATOM 2370 C VAL B 154 -12.001 -0.475 -11.118 1.00 0.63 C ATOM 2371 O VAL B 154 -11.883 0.736 -10.938 1.00 0.67 O ATOM 2372 CB VAL B 154 -9.813 -1.756 -11.390 1.00 0.80 C ATOM 2373 CG1 VAL B 154 -9.136 -0.497 -11.935 1.00 1.01 C ATOM 2374 CG2 VAL B 154 -8.698 -2.509 -10.656 1.00 0.81 C ATOM 0 H VAL B 154 -11.491 -3.473 -10.536 1.00 0.64 H new ATOM 0 HA VAL B 154 -10.576 -0.900 -9.600 1.00 0.66 H new ATOM 0 HB VAL B 154 -10.255 -2.355 -12.187 1.00 0.80 H new ATOM 0 HG11 VAL B 154 -8.310 -0.781 -12.586 1.00 1.01 H new ATOM 0 HG12 VAL B 154 -9.860 0.089 -12.502 1.00 1.01 H new ATOM 0 HG13 VAL B 154 -8.756 0.100 -11.106 1.00 1.01 H new ATOM 0 HG21 VAL B 154 -7.885 -2.723 -11.350 1.00 0.81 H new ATOM 0 HG22 VAL B 154 -8.323 -1.896 -9.836 1.00 0.81 H new ATOM 0 HG23 VAL B 154 -9.091 -3.445 -10.259 1.00 0.81 H new ATOM 2384 N THR B 155 -13.038 -0.973 -11.806 1.00 0.65 N ATOM 2385 CA THR B 155 -14.151 -0.094 -12.230 1.00 0.74 C ATOM 2386 C THR B 155 -15.081 0.256 -11.069 1.00 0.77 C ATOM 2387 O THR B 155 -15.435 1.424 -10.911 1.00 1.03 O ATOM 2388 CB THR B 155 -14.895 -0.594 -13.483 1.00 0.87 C ATOM 2389 OG1 THR B 155 -15.838 0.368 -13.924 1.00 1.10 O ATOM 2390 CG2 THR B 155 -15.602 -1.936 -13.367 1.00 0.87 C ATOM 0 H THR B 155 -13.135 -1.951 -12.078 1.00 0.65 H new ATOM 0 HA THR B 155 -13.690 0.842 -12.546 1.00 0.74 H new ATOM 0 HB THR B 155 -14.090 -0.745 -14.202 1.00 0.87 H new ATOM 0 HG1 THR B 155 -16.299 0.033 -14.721 1.00 1.10 H new ATOM 0 HG21 THR B 155 -16.087 -2.175 -14.314 1.00 0.87 H new ATOM 0 HG22 THR B 155 -14.874 -2.711 -13.126 1.00 0.87 H new ATOM 0 HG23 THR B 155 -16.352 -1.885 -12.578 1.00 0.87 H new ATOM 2398 N GLN B 156 -15.437 -0.700 -10.208 1.00 0.73 N ATOM 2399 CA GLN B 156 -16.401 -0.461 -9.126 1.00 0.91 C ATOM 2400 C GLN B 156 -15.824 0.297 -7.916 1.00 1.01 C ATOM 2401 O GLN B 156 -16.609 0.878 -7.163 1.00 1.45 O ATOM 2402 CB GLN B 156 -17.108 -1.769 -8.716 1.00 1.08 C ATOM 2403 CG GLN B 156 -17.857 -2.495 -9.857 1.00 1.47 C ATOM 2404 CD GLN B 156 -18.920 -1.671 -10.586 1.00 1.91 C ATOM 2405 OE1 GLN B 156 -19.344 -0.595 -10.167 1.00 2.10 O ATOM 2406 NE2 GLN B 156 -19.363 -2.110 -11.739 1.00 2.80 N ATOM 0 H GLN B 156 -15.071 -1.652 -10.238 1.00 0.73 H new ATOM 0 HA GLN B 156 -17.149 0.217 -9.537 1.00 0.91 H new ATOM 0 HB2 GLN B 156 -16.366 -2.450 -8.299 1.00 1.08 H new ATOM 0 HB3 GLN B 156 -17.819 -1.546 -7.920 1.00 1.08 H new ATOM 0 HG2 GLN B 156 -17.124 -2.836 -10.588 1.00 1.47 H new ATOM 0 HG3 GLN B 156 -18.333 -3.385 -9.445 1.00 1.47 H new ATOM 0 HE21 GLN B 156 -19.027 -2.999 -12.109 1.00 2.80 H new ATOM 0 HE22 GLN B 156 -20.043 -1.562 -12.266 1.00 2.80 H new ATOM 2415 N GLN B 157 -14.496 0.366 -7.738 1.00 0.68 N ATOM 2416 CA GLN B 157 -13.852 1.147 -6.666 1.00 0.70 C ATOM 2417 C GLN B 157 -12.762 2.145 -7.094 1.00 0.69 C ATOM 2418 O GLN B 157 -12.475 3.026 -6.295 1.00 0.82 O ATOM 2419 CB GLN B 157 -13.256 0.242 -5.578 1.00 0.79 C ATOM 2420 CG GLN B 157 -14.193 -0.808 -4.971 1.00 0.90 C ATOM 2421 CD GLN B 157 -13.783 -1.129 -3.539 1.00 1.15 C ATOM 2422 OE1 GLN B 157 -13.960 -0.344 -2.619 1.00 1.59 O ATOM 2423 NE2 GLN B 157 -13.166 -2.260 -3.288 1.00 1.94 N ATOM 0 H GLN B 157 -13.831 -0.122 -8.338 1.00 0.68 H new ATOM 0 HA GLN B 157 -14.685 1.741 -6.291 1.00 0.70 H new ATOM 0 HB2 GLN B 157 -12.393 -0.274 -5.999 1.00 0.79 H new ATOM 0 HB3 GLN B 157 -12.887 0.876 -4.772 1.00 0.79 H new ATOM 0 HG2 GLN B 157 -15.219 -0.441 -4.988 1.00 0.90 H new ATOM 0 HG3 GLN B 157 -14.170 -1.716 -5.574 1.00 0.90 H new ATOM 0 HE21 GLN B 157 -13.006 -2.931 -4.039 1.00 1.94 H new ATOM 0 HE22 GLN B 157 -12.846 -2.467 -2.342 1.00 1.94 H new ATOM 2432 N LEU B 158 -12.149 2.065 -8.288 1.00 0.62 N ATOM 2433 CA LEU B 158 -11.125 3.041 -8.727 1.00 0.65 C ATOM 2434 C LEU B 158 -11.490 3.792 -10.043 1.00 0.67 C ATOM 2435 O LEU B 158 -10.621 3.927 -10.913 1.00 0.67 O ATOM 2436 CB LEU B 158 -9.750 2.329 -8.840 1.00 0.69 C ATOM 2437 CG LEU B 158 -9.221 1.577 -7.602 1.00 0.78 C ATOM 2438 CD1 LEU B 158 -8.003 0.734 -7.980 1.00 0.91 C ATOM 2439 CD2 LEU B 158 -8.754 2.514 -6.489 1.00 0.80 C ATOM 0 H LEU B 158 -12.343 1.333 -8.971 1.00 0.62 H new ATOM 0 HA LEU B 158 -11.076 3.820 -7.966 1.00 0.65 H new ATOM 0 HB2 LEU B 158 -9.809 1.617 -9.663 1.00 0.69 H new ATOM 0 HB3 LEU B 158 -9.008 3.077 -9.118 1.00 0.69 H new ATOM 0 HG LEU B 158 -10.056 0.973 -7.248 1.00 0.78 H new ATOM 0 HD11 LEU B 158 -7.637 0.207 -7.099 1.00 0.91 H new ATOM 0 HD12 LEU B 158 -8.285 0.010 -8.745 1.00 0.91 H new ATOM 0 HD13 LEU B 158 -7.217 1.383 -8.367 1.00 0.91 H new ATOM 0 HD21 LEU B 158 -8.393 1.926 -5.645 1.00 0.80 H new ATOM 0 HD22 LEU B 158 -7.948 3.147 -6.861 1.00 0.80 H new ATOM 0 HD23 LEU B 158 -9.587 3.139 -6.166 1.00 0.80 H new ATOM 2451 N PRO B 159 -12.713 4.338 -10.229 1.00 0.82 N ATOM 2452 CA PRO B 159 -13.085 5.060 -11.452 1.00 0.90 C ATOM 2453 C PRO B 159 -12.443 6.451 -11.577 1.00 0.91 C ATOM 2454 O PRO B 159 -12.193 6.906 -12.698 1.00 0.87 O ATOM 2455 CB PRO B 159 -14.611 5.172 -11.403 1.00 1.22 C ATOM 2456 CG PRO B 159 -14.886 5.248 -9.905 1.00 1.28 C ATOM 2457 CD PRO B 159 -13.861 4.275 -9.336 1.00 1.07 C ATOM 0 HA PRO B 159 -12.722 4.518 -12.325 1.00 0.90 H new ATOM 0 HB2 PRO B 159 -14.970 6.057 -11.927 1.00 1.22 H new ATOM 0 HB3 PRO B 159 -15.096 4.311 -11.862 1.00 1.22 H new ATOM 0 HG2 PRO B 159 -14.748 6.257 -9.517 1.00 1.28 H new ATOM 0 HG3 PRO B 159 -15.906 4.951 -9.663 1.00 1.28 H new ATOM 0 HD2 PRO B 159 -13.581 4.552 -8.320 1.00 1.07 H new ATOM 0 HD3 PRO B 159 -14.265 3.264 -9.290 1.00 1.07 H new ATOM 2465 N HIS B 160 -12.147 7.131 -10.465 1.00 1.13 N ATOM 2466 CA HIS B 160 -11.479 8.435 -10.478 1.00 1.37 C ATOM 2467 C HIS B 160 -9.973 8.261 -10.721 1.00 1.37 C ATOM 2468 O HIS B 160 -9.387 9.008 -11.508 1.00 1.51 O ATOM 2469 CB HIS B 160 -11.742 9.187 -9.159 1.00 1.61 C ATOM 2470 CG HIS B 160 -13.188 9.274 -8.740 1.00 1.73 C ATOM 2471 ND1 HIS B 160 -13.793 8.493 -7.786 1.00 1.65 N ATOM 2472 CD2 HIS B 160 -14.117 10.190 -9.159 1.00 2.00 C ATOM 2473 CE1 HIS B 160 -15.045 8.936 -7.614 1.00 1.86 C ATOM 2474 NE2 HIS B 160 -15.309 9.953 -8.456 1.00 2.09 N ATOM 0 H HIS B 160 -12.365 6.791 -9.528 1.00 1.13 H new ATOM 0 HA HIS B 160 -11.888 9.030 -11.294 1.00 1.37 H new ATOM 0 HB2 HIS B 160 -11.180 8.698 -8.364 1.00 1.61 H new ATOM 0 HB3 HIS B 160 -11.347 10.199 -9.253 1.00 1.61 H new ATOM 0 HD2 HIS B 160 -13.960 10.960 -9.900 1.00 2.00 H new ATOM 0 HE1 HIS B 160 -15.746 8.533 -6.898 1.00 1.86 H new ATOM 0 HE2 HIS B 160 -16.194 10.450 -8.562 1.00 2.09 H new ATOM 2482 N LEU B 161 -9.351 7.259 -10.083 1.00 1.29 N ATOM 2483 CA LEU B 161 -7.897 7.046 -10.113 1.00 1.43 C ATOM 2484 C LEU B 161 -7.392 6.281 -11.356 1.00 1.38 C ATOM 2485 O LEU B 161 -6.322 6.617 -11.866 1.00 1.61 O ATOM 2486 CB LEU B 161 -7.474 6.372 -8.790 1.00 1.49 C ATOM 2487 CG LEU B 161 -5.964 6.078 -8.651 1.00 0.99 C ATOM 2488 CD1 LEU B 161 -5.073 7.313 -8.788 1.00 2.12 C ATOM 2489 CD2 LEU B 161 -5.666 5.461 -7.287 1.00 1.81 C ATOM 0 H LEU B 161 -9.849 6.566 -9.525 1.00 1.29 H new ATOM 0 HA LEU B 161 -7.416 8.020 -10.203 1.00 1.43 H new ATOM 0 HB2 LEU B 161 -7.780 7.011 -7.962 1.00 1.49 H new ATOM 0 HB3 LEU B 161 -8.021 5.434 -8.688 1.00 1.49 H new ATOM 0 HG LEU B 161 -5.735 5.397 -9.470 1.00 0.99 H new ATOM 0 HD11 LEU B 161 -4.028 7.022 -8.678 1.00 2.12 H new ATOM 0 HD12 LEU B 161 -5.223 7.763 -9.769 1.00 2.12 H new ATOM 0 HD13 LEU B 161 -5.332 8.036 -8.014 1.00 2.12 H new ATOM 0 HD21 LEU B 161 -4.598 5.260 -7.204 1.00 1.81 H new ATOM 0 HD22 LEU B 161 -5.967 6.154 -6.501 1.00 1.81 H new ATOM 0 HD23 LEU B 161 -6.220 4.529 -7.180 1.00 1.81 H new ATOM 2501 N MET B 162 -8.123 5.265 -11.837 1.00 1.18 N ATOM 2502 CA MET B 162 -7.674 4.362 -12.913 1.00 1.26 C ATOM 2503 C MET B 162 -8.607 4.460 -14.141 1.00 1.28 C ATOM 2504 O MET B 162 -9.796 4.141 -14.014 1.00 1.66 O ATOM 2505 CB MET B 162 -7.604 2.912 -12.397 1.00 1.41 C ATOM 2506 CG MET B 162 -6.745 2.672 -11.144 1.00 2.39 C ATOM 2507 SD MET B 162 -4.980 2.302 -11.376 1.00 3.10 S ATOM 2508 CE MET B 162 -4.321 3.910 -11.892 1.00 4.32 C ATOM 0 H MET B 162 -9.055 5.042 -11.487 1.00 1.18 H new ATOM 0 HA MET B 162 -6.676 4.669 -13.225 1.00 1.26 H new ATOM 0 HB2 MET B 162 -8.619 2.576 -12.185 1.00 1.41 H new ATOM 0 HB3 MET B 162 -7.221 2.282 -13.200 1.00 1.41 H new ATOM 0 HG2 MET B 162 -6.820 3.558 -10.513 1.00 2.39 H new ATOM 0 HG3 MET B 162 -7.189 1.846 -10.588 1.00 2.39 H new ATOM 0 HE1 MET B 162 -3.253 3.951 -11.678 1.00 4.32 H new ATOM 0 HE2 MET B 162 -4.482 4.043 -12.962 1.00 4.32 H new ATOM 0 HE3 MET B 162 -4.831 4.704 -11.347 1.00 4.32 H new ATOM 2518 N PRO B 163 -8.119 4.876 -15.328 1.00 1.58 N ATOM 2519 CA PRO B 163 -8.981 5.286 -16.441 1.00 2.02 C ATOM 2520 C PRO B 163 -9.692 4.143 -17.180 1.00 1.59 C ATOM 2521 O PRO B 163 -9.184 3.025 -17.327 1.00 1.43 O ATOM 2522 CB PRO B 163 -8.102 6.103 -17.391 1.00 2.90 C ATOM 2523 CG PRO B 163 -6.709 5.543 -17.122 1.00 2.98 C ATOM 2524 CD PRO B 163 -6.741 5.243 -15.626 1.00 2.19 C ATOM 0 HA PRO B 163 -9.809 5.867 -16.035 1.00 2.02 H new ATOM 0 HB2 PRO B 163 -8.398 5.970 -18.432 1.00 2.90 H new ATOM 0 HB3 PRO B 163 -8.158 7.170 -17.177 1.00 2.90 H new ATOM 0 HG2 PRO B 163 -6.515 4.646 -17.709 1.00 2.98 H new ATOM 0 HG3 PRO B 163 -5.930 6.263 -17.372 1.00 2.98 H new ATOM 0 HD2 PRO B 163 -6.057 4.433 -15.374 1.00 2.19 H new ATOM 0 HD3 PRO B 163 -6.433 6.113 -15.045 1.00 2.19 H new ATOM 2575 N LEU B 168 -7.690 -0.593 -15.980 1.00 2.73 N ATOM 2576 CA LEU B 168 -8.231 -1.814 -15.386 1.00 2.05 C ATOM 2577 C LEU B 168 -7.775 -3.105 -16.078 1.00 1.74 C ATOM 2578 O LEU B 168 -7.624 -4.115 -15.401 1.00 1.63 O ATOM 2579 CB LEU B 168 -9.758 -1.670 -15.207 1.00 1.58 C ATOM 2580 CG LEU B 168 -10.625 -1.216 -16.397 1.00 1.21 C ATOM 2581 CD1 LEU B 168 -10.926 -2.342 -17.376 1.00 1.32 C ATOM 2582 CD2 LEU B 168 -11.972 -0.731 -15.869 1.00 1.37 C ATOM 0 HA LEU B 168 -7.800 -1.931 -14.392 1.00 2.05 H new ATOM 0 HB2 LEU B 168 -10.140 -2.636 -14.875 1.00 1.58 H new ATOM 0 HB3 LEU B 168 -9.926 -0.964 -14.393 1.00 1.58 H new ATOM 0 HG LEU B 168 -10.063 -0.438 -16.913 1.00 1.21 H new ATOM 0 HD11 LEU B 168 -11.540 -1.960 -18.192 1.00 1.32 H new ATOM 0 HD12 LEU B 168 -9.992 -2.734 -17.778 1.00 1.32 H new ATOM 0 HD13 LEU B 168 -11.462 -3.139 -16.860 1.00 1.32 H new ATOM 0 HD21 LEU B 168 -12.594 -0.407 -16.703 1.00 1.37 H new ATOM 0 HD22 LEU B 168 -12.469 -1.544 -15.339 1.00 1.37 H new ATOM 0 HD23 LEU B 168 -11.816 0.105 -15.187 1.00 1.37 H new ATOM 2594 N GLU B 169 -7.513 -3.092 -17.388 1.00 1.92 N ATOM 2595 CA GLU B 169 -6.949 -4.247 -18.106 1.00 1.84 C ATOM 2596 C GLU B 169 -5.416 -4.310 -18.112 1.00 1.93 C ATOM 2597 O GLU B 169 -4.846 -5.399 -18.106 1.00 1.92 O ATOM 2598 CB GLU B 169 -7.545 -4.388 -19.509 1.00 2.02 C ATOM 2599 CG GLU B 169 -7.382 -3.139 -20.372 1.00 2.35 C ATOM 2600 CD GLU B 169 -7.811 -3.425 -21.813 1.00 2.46 C ATOM 2601 OE1 GLU B 169 -8.965 -3.865 -22.030 1.00 2.42 O ATOM 2602 OE2 GLU B 169 -6.973 -3.269 -22.738 1.00 3.51 O ATOM 0 H GLU B 169 -7.685 -2.282 -17.984 1.00 1.92 H new ATOM 0 HA GLU B 169 -7.253 -5.119 -17.527 1.00 1.84 H new ATOM 0 HB2 GLU B 169 -7.072 -5.231 -20.012 1.00 2.02 H new ATOM 0 HB3 GLU B 169 -8.606 -4.623 -19.422 1.00 2.02 H new ATOM 0 HG2 GLU B 169 -7.981 -2.326 -19.962 1.00 2.35 H new ATOM 0 HG3 GLU B 169 -6.343 -2.810 -20.354 1.00 2.35 H new ATOM 2609 N GLU B 170 -4.722 -3.171 -18.058 1.00 2.06 N ATOM 2610 CA GLU B 170 -3.256 -3.130 -18.137 1.00 2.09 C ATOM 2611 C GLU B 170 -2.583 -3.781 -16.917 1.00 1.97 C ATOM 2612 O GLU B 170 -1.454 -4.257 -16.983 1.00 2.00 O ATOM 2613 CB GLU B 170 -2.781 -1.708 -18.448 1.00 2.23 C ATOM 2614 CG GLU B 170 -3.073 -0.669 -17.365 1.00 3.07 C ATOM 2615 CD GLU B 170 -1.862 -0.391 -16.471 1.00 4.14 C ATOM 2616 OE1 GLU B 170 -0.890 0.255 -16.938 1.00 4.32 O ATOM 2617 OE2 GLU B 170 -1.913 -0.754 -15.278 1.00 5.53 O ATOM 0 H GLU B 170 -5.156 -2.253 -17.959 1.00 2.06 H new ATOM 0 HA GLU B 170 -2.931 -3.750 -18.973 1.00 2.09 H new ATOM 0 HB2 GLU B 170 -1.706 -1.732 -18.624 1.00 2.23 H new ATOM 0 HB3 GLU B 170 -3.249 -1.382 -19.377 1.00 2.23 H new ATOM 0 HG2 GLU B 170 -3.393 0.261 -17.836 1.00 3.07 H new ATOM 0 HG3 GLU B 170 -3.902 -1.016 -16.749 1.00 3.07 H new ATOM 2624 N LYS B 171 -3.331 -3.908 -15.819 1.00 1.84 N ATOM 2625 CA LYS B 171 -2.989 -4.673 -14.616 1.00 1.70 C ATOM 2626 C LYS B 171 -2.861 -6.175 -14.920 1.00 1.56 C ATOM 2627 O LYS B 171 -1.918 -6.818 -14.466 1.00 1.63 O ATOM 2628 CB LYS B 171 -4.079 -4.358 -13.570 1.00 1.56 C ATOM 2629 CG LYS B 171 -4.227 -2.879 -13.260 1.00 1.71 C ATOM 2630 CD LYS B 171 -2.961 -2.350 -12.581 1.00 2.16 C ATOM 2631 CE LYS B 171 -3.302 -0.975 -12.062 1.00 2.12 C ATOM 2632 NZ LYS B 171 -3.489 -0.022 -13.183 1.00 2.22 N ATOM 0 H LYS B 171 -4.242 -3.455 -15.740 1.00 1.84 H new ATOM 0 HA LYS B 171 -2.012 -4.387 -14.227 1.00 1.70 H new ATOM 0 HB2 LYS B 171 -5.034 -4.741 -13.929 1.00 1.56 H new ATOM 0 HB3 LYS B 171 -3.848 -4.891 -12.648 1.00 1.56 H new ATOM 0 HG2 LYS B 171 -4.414 -2.324 -14.180 1.00 1.71 H new ATOM 0 HG3 LYS B 171 -5.089 -2.721 -12.612 1.00 1.71 H new ATOM 0 HD2 LYS B 171 -2.652 -3.007 -11.768 1.00 2.16 H new ATOM 0 HD3 LYS B 171 -2.131 -2.305 -13.287 1.00 2.16 H new ATOM 0 HE2 LYS B 171 -4.211 -1.022 -11.463 1.00 2.12 H new ATOM 0 HE3 LYS B 171 -2.507 -0.621 -11.406 1.00 2.12 H new ATOM 0 HZ1 LYS B 171 -3.588 0.942 -12.806 1.00 2.22 H new ATOM 0 HZ2 LYS B 171 -2.664 -0.063 -13.815 1.00 2.22 H new ATOM 0 HZ3 LYS B 171 -4.346 -0.276 -13.715 1.00 2.22 H new ATOM 2646 N ILE B 172 -3.736 -6.712 -15.775 1.00 1.46 N ATOM 2647 CA ILE B 172 -3.695 -8.092 -16.285 1.00 1.46 C ATOM 2648 C ILE B 172 -2.568 -8.250 -17.320 1.00 1.62 C ATOM 2649 O ILE B 172 -1.872 -9.267 -17.323 1.00 1.65 O ATOM 2650 CB ILE B 172 -5.078 -8.512 -16.853 1.00 1.44 C ATOM 2651 CG1 ILE B 172 -6.194 -8.470 -15.781 1.00 1.33 C ATOM 2652 CG2 ILE B 172 -5.030 -9.937 -17.418 1.00 1.55 C ATOM 2653 CD1 ILE B 172 -6.914 -7.125 -15.679 1.00 1.29 C ATOM 0 H ILE B 172 -4.523 -6.180 -16.147 1.00 1.46 H new ATOM 0 HA ILE B 172 -3.473 -8.766 -15.458 1.00 1.46 H new ATOM 0 HB ILE B 172 -5.307 -7.792 -17.639 1.00 1.44 H new ATOM 0 HG12 ILE B 172 -6.927 -9.246 -16.005 1.00 1.33 H new ATOM 0 HG13 ILE B 172 -5.760 -8.712 -14.811 1.00 1.33 H new ATOM 0 HG21 ILE B 172 -6.011 -10.206 -17.809 1.00 1.55 H new ATOM 0 HG22 ILE B 172 -4.293 -9.986 -18.220 1.00 1.55 H new ATOM 0 HG23 ILE B 172 -4.751 -10.633 -16.627 1.00 1.55 H new ATOM 0 HD11 ILE B 172 -7.680 -7.180 -14.906 1.00 1.29 H new ATOM 0 HD12 ILE B 172 -6.196 -6.346 -15.423 1.00 1.29 H new ATOM 0 HD13 ILE B 172 -7.380 -6.889 -16.635 1.00 1.29 H new ATOM 2665 N ALA B 173 -2.323 -7.224 -18.140 1.00 1.80 N ATOM 2666 CA ALA B 173 -1.208 -7.192 -19.091 1.00 2.06 C ATOM 2667 C ALA B 173 0.180 -7.053 -18.415 1.00 2.15 C ATOM 2668 O ALA B 173 1.193 -7.422 -19.008 1.00 2.43 O ATOM 2669 CB ALA B 173 -1.475 -6.068 -20.097 1.00 2.18 C ATOM 0 H ALA B 173 -2.900 -6.383 -18.162 1.00 1.80 H new ATOM 0 HA ALA B 173 -1.161 -8.153 -19.604 1.00 2.06 H new ATOM 0 HB1 ALA B 173 -0.658 -6.023 -20.817 1.00 2.18 H new ATOM 0 HB2 ALA B 173 -2.411 -6.263 -20.621 1.00 2.18 H new ATOM 0 HB3 ALA B 173 -1.546 -5.117 -19.569 1.00 2.18 H new ATOM 2675 N ASN B 174 0.251 -6.559 -17.173 1.00 2.00 N ATOM 2676 CA ASN B 174 1.466 -6.582 -16.346 1.00 2.08 C ATOM 2677 C ASN B 174 1.655 -7.926 -15.615 1.00 1.82 C ATOM 2678 O ASN B 174 2.793 -8.379 -15.459 1.00 2.00 O ATOM 2679 CB ASN B 174 1.453 -5.390 -15.369 1.00 2.24 C ATOM 2680 CG ASN B 174 1.983 -4.114 -16.000 1.00 2.68 C ATOM 2681 OD1 ASN B 174 3.183 -3.873 -16.030 1.00 3.41 O ATOM 2682 ND2 ASN B 174 1.139 -3.271 -16.536 1.00 2.58 N ATOM 0 H ASN B 174 -0.546 -6.125 -16.706 1.00 2.00 H new ATOM 0 HA ASN B 174 2.328 -6.482 -17.006 1.00 2.08 H new ATOM 0 HB2 ASN B 174 0.434 -5.222 -15.019 1.00 2.24 H new ATOM 0 HB3 ASN B 174 2.054 -5.635 -14.494 1.00 2.24 H new ATOM 0 HD21 ASN B 174 1.481 -2.417 -16.977 1.00 2.58 H new ATOM 0 HD22 ASN B 174 0.138 -3.467 -16.514 1.00 2.58 H new ATOM 2689 N LEU B 175 0.563 -8.578 -15.197 1.00 1.49 N ATOM 2690 CA LEU B 175 0.565 -9.935 -14.626 1.00 1.27 C ATOM 2691 C LEU B 175 0.993 -11.005 -15.650 1.00 1.60 C ATOM 2692 O LEU B 175 1.774 -11.895 -15.327 1.00 1.93 O ATOM 2693 CB LEU B 175 -0.847 -10.234 -14.086 1.00 1.24 C ATOM 2694 CG LEU B 175 -1.167 -9.657 -12.710 1.00 1.97 C ATOM 2695 CD1 LEU B 175 -2.675 -9.784 -12.462 1.00 2.46 C ATOM 2696 CD2 LEU B 175 -0.411 -10.401 -11.617 1.00 3.14 C ATOM 0 H LEU B 175 -0.370 -8.169 -15.247 1.00 1.49 H new ATOM 0 HA LEU B 175 1.299 -9.974 -13.821 1.00 1.27 H new ATOM 0 HB2 LEU B 175 -1.577 -9.850 -14.799 1.00 1.24 H new ATOM 0 HB3 LEU B 175 -0.979 -11.315 -14.045 1.00 1.24 H new ATOM 0 HG LEU B 175 -0.861 -8.611 -12.685 1.00 1.97 H new ATOM 0 HD11 LEU B 175 -2.918 -9.375 -11.481 1.00 2.46 H new ATOM 0 HD12 LEU B 175 -3.218 -9.233 -13.230 1.00 2.46 H new ATOM 0 HD13 LEU B 175 -2.963 -10.835 -12.498 1.00 2.46 H new ATOM 0 HD21 LEU B 175 -0.657 -9.970 -10.647 1.00 3.14 H new ATOM 0 HD22 LEU B 175 -0.696 -11.453 -11.629 1.00 3.14 H new ATOM 0 HD23 LEU B 175 0.661 -10.313 -11.792 1.00 3.14 H new ATOM 2796 N LEU B 183 -2.497 -16.310 -8.661 1.00 1.42 N ATOM 2797 CA LEU B 183 -2.154 -15.152 -7.821 1.00 1.27 C ATOM 2798 C LEU B 183 -1.961 -15.515 -6.340 1.00 1.40 C ATOM 2799 O LEU B 183 -2.372 -16.580 -5.885 1.00 2.08 O ATOM 2800 CB LEU B 183 -3.207 -14.024 -7.990 1.00 1.30 C ATOM 2801 CG LEU B 183 -2.763 -12.963 -9.013 1.00 1.59 C ATOM 2802 CD1 LEU B 183 -3.139 -13.349 -10.442 1.00 1.88 C ATOM 2803 CD2 LEU B 183 -3.326 -11.573 -8.711 1.00 2.30 C ATOM 0 HA LEU B 183 -1.188 -14.787 -8.170 1.00 1.27 H new ATOM 0 HB2 LEU B 183 -4.155 -14.459 -8.308 1.00 1.30 H new ATOM 0 HB3 LEU B 183 -3.383 -13.546 -7.026 1.00 1.30 H new ATOM 0 HG LEU B 183 -1.677 -12.923 -8.924 1.00 1.59 H new ATOM 0 HD11 LEU B 183 -2.806 -12.571 -11.129 1.00 1.88 H new ATOM 0 HD12 LEU B 183 -2.659 -14.292 -10.702 1.00 1.88 H new ATOM 0 HD13 LEU B 183 -4.221 -13.460 -10.516 1.00 1.88 H new ATOM 0 HD21 LEU B 183 -2.979 -10.868 -9.466 1.00 2.30 H new ATOM 0 HD22 LEU B 183 -4.415 -11.611 -8.724 1.00 2.30 H new ATOM 0 HD23 LEU B 183 -2.986 -11.248 -7.728 1.00 2.30 H new ATOM 2815 N GLU B 184 -1.366 -14.593 -5.587 1.00 1.01 N ATOM 2816 CA GLU B 184 -1.300 -14.569 -4.118 1.00 1.05 C ATOM 2817 C GLU B 184 -1.535 -13.133 -3.613 1.00 0.97 C ATOM 2818 O GLU B 184 -1.476 -12.178 -4.393 1.00 0.95 O ATOM 2819 CB GLU B 184 0.064 -15.073 -3.615 1.00 1.22 C ATOM 2820 CG GLU B 184 0.325 -16.554 -3.921 1.00 1.54 C ATOM 2821 CD GLU B 184 1.533 -17.134 -3.170 1.00 2.00 C ATOM 2822 OE1 GLU B 184 2.300 -16.401 -2.500 1.00 2.32 O ATOM 2823 OE2 GLU B 184 1.709 -18.374 -3.197 1.00 2.82 O ATOM 0 H GLU B 184 -0.888 -13.794 -6.004 1.00 1.01 H new ATOM 0 HA GLU B 184 -2.075 -15.231 -3.731 1.00 1.05 H new ATOM 0 HB2 GLU B 184 0.853 -14.473 -4.068 1.00 1.22 H new ATOM 0 HB3 GLU B 184 0.124 -14.917 -2.538 1.00 1.22 H new ATOM 0 HG2 GLU B 184 -0.563 -17.131 -3.664 1.00 1.54 H new ATOM 0 HG3 GLU B 184 0.483 -16.672 -4.993 1.00 1.54 H new ATOM 2830 N PHE B 185 -1.763 -12.972 -2.307 1.00 1.04 N ATOM 2831 CA PHE B 185 -2.035 -11.694 -1.630 1.00 1.08 C ATOM 2832 C PHE B 185 -1.046 -10.568 -1.993 1.00 1.01 C ATOM 2833 O PHE B 185 -1.477 -9.479 -2.381 1.00 1.03 O ATOM 2834 CB PHE B 185 -2.078 -12.008 -0.127 1.00 1.33 C ATOM 2835 CG PHE B 185 -2.125 -10.843 0.839 1.00 1.47 C ATOM 2836 CD1 PHE B 185 -0.915 -10.281 1.297 1.00 2.44 C ATOM 2837 CD2 PHE B 185 -3.347 -10.411 1.396 1.00 2.45 C ATOM 2838 CE1 PHE B 185 -0.921 -9.320 2.322 1.00 2.77 C ATOM 2839 CE2 PHE B 185 -3.337 -9.491 2.454 1.00 2.76 C ATOM 2840 CZ PHE B 185 -2.131 -8.949 2.926 1.00 2.36 C ATOM 0 H PHE B 185 -1.764 -13.761 -1.661 1.00 1.04 H new ATOM 0 HA PHE B 185 -2.987 -11.285 -1.968 1.00 1.08 H new ATOM 0 HB2 PHE B 185 -2.952 -12.632 0.059 1.00 1.33 H new ATOM 0 HB3 PHE B 185 -1.200 -12.608 0.115 1.00 1.33 H new ATOM 0 HD1 PHE B 185 0.021 -10.591 0.857 1.00 2.44 H new ATOM 0 HD2 PHE B 185 -4.283 -10.786 1.010 1.00 2.45 H new ATOM 0 HE1 PHE B 185 0.005 -8.868 2.644 1.00 2.77 H new ATOM 0 HE2 PHE B 185 -4.269 -9.195 2.912 1.00 2.76 H new ATOM 0 HZ PHE B 185 -2.135 -8.250 3.750 1.00 2.36 H new ATOM 2850 N ARG B 186 0.273 -10.825 -1.979 1.00 1.01 N ATOM 2851 CA ARG B 186 1.278 -9.810 -2.367 1.00 1.11 C ATOM 2852 C ARG B 186 1.127 -9.345 -3.822 1.00 1.05 C ATOM 2853 O ARG B 186 1.390 -8.182 -4.108 1.00 1.14 O ATOM 2854 CB ARG B 186 2.704 -10.316 -2.073 1.00 1.31 C ATOM 2855 CG ARG B 186 3.758 -9.227 -2.359 1.00 1.97 C ATOM 2856 CD ARG B 186 5.168 -9.643 -1.934 1.00 2.69 C ATOM 2857 NE ARG B 186 5.684 -10.779 -2.721 1.00 2.94 N ATOM 2858 CZ ARG B 186 6.250 -10.733 -3.914 1.00 3.39 C ATOM 2859 NH1 ARG B 186 6.339 -9.648 -4.625 1.00 3.95 N ATOM 2860 NH2 ARG B 186 6.755 -11.802 -4.449 1.00 4.29 N ATOM 0 H ARG B 186 0.671 -11.723 -1.705 1.00 1.01 H new ATOM 0 HA ARG B 186 1.095 -8.928 -1.753 1.00 1.11 H new ATOM 0 HB2 ARG B 186 2.774 -10.627 -1.031 1.00 1.31 H new ATOM 0 HB3 ARG B 186 2.913 -11.195 -2.683 1.00 1.31 H new ATOM 0 HG2 ARG B 186 3.757 -8.997 -3.425 1.00 1.97 H new ATOM 0 HG3 ARG B 186 3.480 -8.312 -1.836 1.00 1.97 H new ATOM 0 HD2 ARG B 186 5.842 -8.794 -2.043 1.00 2.69 H new ATOM 0 HD3 ARG B 186 5.161 -9.911 -0.877 1.00 2.69 H new ATOM 0 HE ARG B 186 5.594 -11.702 -2.297 1.00 2.94 H new ATOM 0 HH11 ARG B 186 5.960 -8.771 -4.267 1.00 3.95 H new ATOM 0 HH12 ARG B 186 6.788 -9.674 -5.541 1.00 3.95 H new ATOM 0 HH21 ARG B 186 6.717 -12.690 -3.948 1.00 4.29 H new ATOM 0 HH22 ARG B 186 7.189 -11.755 -5.371 1.00 4.29 H new ATOM 2874 N SER B 187 0.657 -10.191 -4.741 1.00 0.98 N ATOM 2875 CA SER B 187 0.553 -9.841 -6.168 1.00 1.00 C ATOM 2876 C SER B 187 -0.424 -8.679 -6.429 1.00 0.89 C ATOM 2877 O SER B 187 -0.161 -7.839 -7.292 1.00 0.96 O ATOM 2878 CB SER B 187 0.181 -11.085 -6.979 1.00 1.10 C ATOM 2879 OG SER B 187 0.331 -10.823 -8.358 1.00 1.95 O ATOM 0 H SER B 187 0.338 -11.135 -4.523 1.00 0.98 H new ATOM 0 HA SER B 187 1.529 -9.483 -6.494 1.00 1.00 H new ATOM 0 HB2 SER B 187 0.815 -11.922 -6.688 1.00 1.10 H new ATOM 0 HB3 SER B 187 -0.848 -11.375 -6.765 1.00 1.10 H new ATOM 0 HG SER B 187 0.093 -11.623 -8.871 1.00 1.95 H new ATOM 2885 N PHE B 188 -1.490 -8.556 -5.626 1.00 0.78 N ATOM 2886 CA PHE B 188 -2.385 -7.387 -5.621 1.00 0.72 C ATOM 2887 C PHE B 188 -1.672 -6.124 -5.088 1.00 0.67 C ATOM 2888 O PHE B 188 -1.826 -5.046 -5.656 1.00 0.64 O ATOM 2889 CB PHE B 188 -3.593 -7.712 -4.741 1.00 0.71 C ATOM 2890 CG PHE B 188 -4.643 -6.616 -4.624 1.00 0.70 C ATOM 2891 CD1 PHE B 188 -5.695 -6.550 -5.556 1.00 1.68 C ATOM 2892 CD2 PHE B 188 -4.637 -5.737 -3.521 1.00 1.98 C ATOM 2893 CE1 PHE B 188 -6.760 -5.650 -5.366 1.00 1.71 C ATOM 2894 CE2 PHE B 188 -5.703 -4.839 -3.330 1.00 1.97 C ATOM 2895 CZ PHE B 188 -6.764 -4.798 -4.248 1.00 0.77 C ATOM 0 H PHE B 188 -1.760 -9.273 -4.953 1.00 0.78 H new ATOM 0 HA PHE B 188 -2.697 -7.176 -6.644 1.00 0.72 H new ATOM 0 HB2 PHE B 188 -4.073 -8.608 -5.133 1.00 0.71 H new ATOM 0 HB3 PHE B 188 -3.235 -7.954 -3.740 1.00 0.71 H new ATOM 0 HD1 PHE B 188 -5.685 -7.194 -6.423 1.00 1.68 H new ATOM 0 HD2 PHE B 188 -3.813 -5.753 -2.823 1.00 1.98 H new ATOM 0 HE1 PHE B 188 -7.572 -5.614 -6.077 1.00 1.71 H new ATOM 0 HE2 PHE B 188 -5.705 -4.179 -2.475 1.00 1.97 H new ATOM 0 HZ PHE B 188 -7.584 -4.112 -4.095 1.00 0.77 H new ATOM 2905 N TRP B 189 -0.853 -6.243 -4.034 1.00 0.69 N ATOM 2906 CA TRP B 189 -0.090 -5.123 -3.452 1.00 0.65 C ATOM 2907 C TRP B 189 0.898 -4.502 -4.458 1.00 0.64 C ATOM 2908 O TRP B 189 0.998 -3.279 -4.555 1.00 0.61 O ATOM 2909 CB TRP B 189 0.630 -5.596 -2.176 1.00 0.71 C ATOM 2910 CG TRP B 189 1.399 -4.526 -1.468 1.00 0.74 C ATOM 2911 CD1 TRP B 189 2.722 -4.279 -1.617 1.00 0.87 C ATOM 2912 CD2 TRP B 189 0.894 -3.491 -0.570 1.00 0.72 C ATOM 2913 NE1 TRP B 189 3.064 -3.149 -0.900 1.00 0.94 N ATOM 2914 CE2 TRP B 189 1.968 -2.601 -0.273 1.00 0.86 C ATOM 2915 CE3 TRP B 189 -0.369 -3.183 -0.012 1.00 0.68 C ATOM 2916 CZ2 TRP B 189 1.786 -1.432 0.472 1.00 0.97 C ATOM 2917 CZ3 TRP B 189 -0.551 -2.024 0.765 1.00 0.78 C ATOM 2918 CH2 TRP B 189 0.513 -1.135 0.982 1.00 0.93 C ATOM 0 H TRP B 189 -0.698 -7.129 -3.554 1.00 0.69 H new ATOM 0 HA TRP B 189 -0.794 -4.333 -3.192 1.00 0.65 H new ATOM 0 HB2 TRP B 189 -0.108 -6.011 -1.490 1.00 0.71 H new ATOM 0 HB3 TRP B 189 1.312 -6.405 -2.437 1.00 0.71 H new ATOM 0 HD1 TRP B 189 3.405 -4.874 -2.206 1.00 0.87 H new ATOM 0 HE1 TRP B 189 4.009 -2.769 -0.842 1.00 0.94 H new ATOM 0 HE3 TRP B 189 -1.204 -3.846 -0.185 1.00 0.68 H new ATOM 0 HZ2 TRP B 189 2.616 -0.765 0.653 1.00 0.97 H new ATOM 0 HZ3 TRP B 189 -1.518 -1.817 1.198 1.00 0.78 H new ATOM 0 HH2 TRP B 189 0.352 -0.224 1.540 1.00 0.93 H new ATOM 2929 N GLU B 190 1.557 -5.319 -5.288 1.00 0.70 N ATOM 2930 CA GLU B 190 2.402 -4.832 -6.398 1.00 0.71 C ATOM 2931 C GLU B 190 1.601 -4.070 -7.475 1.00 0.65 C ATOM 2932 O GLU B 190 2.156 -3.248 -8.207 1.00 0.66 O ATOM 2933 CB GLU B 190 3.125 -6.007 -7.080 1.00 0.82 C ATOM 2934 CG GLU B 190 3.935 -6.937 -6.164 1.00 1.01 C ATOM 2935 CD GLU B 190 5.097 -6.270 -5.418 1.00 1.79 C ATOM 2936 OE1 GLU B 190 5.472 -5.115 -5.726 1.00 2.31 O ATOM 2937 OE2 GLU B 190 5.707 -6.928 -4.539 1.00 2.96 O ATOM 0 H GLU B 190 1.523 -6.336 -5.214 1.00 0.70 H new ATOM 0 HA GLU B 190 3.117 -4.142 -5.949 1.00 0.71 H new ATOM 0 HB2 GLU B 190 2.381 -6.607 -7.604 1.00 0.82 H new ATOM 0 HB3 GLU B 190 3.798 -5.601 -7.836 1.00 0.82 H new ATOM 0 HG2 GLU B 190 3.259 -7.377 -5.431 1.00 1.01 H new ATOM 0 HG3 GLU B 190 4.332 -7.756 -6.764 1.00 1.01 H new ATOM 2944 N LEU B 191 0.297 -4.342 -7.593 1.00 0.66 N ATOM 2945 CA LEU B 191 -0.628 -3.670 -8.511 1.00 0.68 C ATOM 2946 C LEU B 191 -1.256 -2.396 -7.915 1.00 0.63 C ATOM 2947 O LEU B 191 -1.524 -1.453 -8.661 1.00 0.71 O ATOM 2948 CB LEU B 191 -1.649 -4.703 -9.031 1.00 0.86 C ATOM 2949 CG LEU B 191 -0.991 -5.790 -9.910 1.00 1.64 C ATOM 2950 CD1 LEU B 191 -1.947 -6.951 -10.162 1.00 1.76 C ATOM 2951 CD2 LEU B 191 -0.594 -5.241 -11.276 1.00 2.27 C ATOM 0 H LEU B 191 -0.159 -5.062 -7.032 1.00 0.66 H new ATOM 0 HA LEU B 191 -0.072 -3.289 -9.368 1.00 0.68 H new ATOM 0 HB2 LEU B 191 -2.146 -5.176 -8.184 1.00 0.86 H new ATOM 0 HB3 LEU B 191 -2.419 -4.190 -9.607 1.00 0.86 H new ATOM 0 HG LEU B 191 -0.110 -6.126 -9.363 1.00 1.64 H new ATOM 0 HD11 LEU B 191 -1.455 -7.699 -10.783 1.00 1.76 H new ATOM 0 HD12 LEU B 191 -2.233 -7.400 -9.211 1.00 1.76 H new ATOM 0 HD13 LEU B 191 -2.838 -6.585 -10.672 1.00 1.76 H new ATOM 0 HD21 LEU B 191 -0.134 -6.033 -11.867 1.00 2.27 H new ATOM 0 HD22 LEU B 191 -1.481 -4.872 -11.791 1.00 2.27 H new ATOM 0 HD23 LEU B 191 0.117 -4.425 -11.148 1.00 2.27 H new ATOM 2963 N ILE B 192 -1.372 -2.288 -6.583 1.00 0.57 N ATOM 2964 CA ILE B 192 -1.514 -0.982 -5.909 1.00 0.54 C ATOM 2965 C ILE B 192 -0.238 -0.146 -6.121 1.00 0.57 C ATOM 2966 O ILE B 192 -0.316 1.057 -6.360 1.00 0.64 O ATOM 2967 CB ILE B 192 -1.789 -1.124 -4.396 1.00 0.48 C ATOM 2968 CG1 ILE B 192 -2.966 -2.044 -4.018 1.00 0.50 C ATOM 2969 CG2 ILE B 192 -2.077 0.270 -3.812 1.00 0.49 C ATOM 2970 CD1 ILE B 192 -3.025 -2.315 -2.514 1.00 0.52 C ATOM 0 H ILE B 192 -1.371 -3.087 -5.949 1.00 0.57 H new ATOM 0 HA ILE B 192 -2.375 -0.482 -6.353 1.00 0.54 H new ATOM 0 HB ILE B 192 -0.893 -1.589 -3.985 1.00 0.48 H new ATOM 0 HG12 ILE B 192 -3.901 -1.586 -4.340 1.00 0.50 H new ATOM 0 HG13 ILE B 192 -2.873 -2.989 -4.553 1.00 0.50 H new ATOM 0 HG21 ILE B 192 -2.273 0.183 -2.743 1.00 0.49 H new ATOM 0 HG22 ILE B 192 -1.214 0.917 -3.971 1.00 0.49 H new ATOM 0 HG23 ILE B 192 -2.948 0.699 -4.307 1.00 0.49 H new ATOM 0 HD11 ILE B 192 -3.870 -2.968 -2.295 1.00 0.52 H new ATOM 0 HD12 ILE B 192 -2.101 -2.798 -2.195 1.00 0.52 H new ATOM 0 HD13 ILE B 192 -3.146 -1.373 -1.979 1.00 0.52 H new ATOM 2982 N GLY B 193 0.933 -0.790 -6.122 1.00 0.57 N ATOM 2983 CA GLY B 193 2.212 -0.169 -6.491 1.00 0.62 C ATOM 2984 C GLY B 193 2.198 0.494 -7.878 1.00 0.65 C ATOM 2985 O GLY B 193 2.818 1.542 -8.061 1.00 0.73 O ATOM 0 H GLY B 193 1.022 -1.772 -5.863 1.00 0.57 H new ATOM 0 HA2 GLY B 193 2.472 0.580 -5.743 1.00 0.62 H new ATOM 0 HA3 GLY B 193 2.994 -0.928 -6.468 1.00 0.62 H new ATOM 2989 N GLU B 194 1.427 -0.046 -8.830 1.00 0.64 N ATOM 2990 CA GLU B 194 1.165 0.548 -10.140 1.00 0.71 C ATOM 2991 C GLU B 194 0.075 1.642 -10.091 1.00 0.75 C ATOM 2992 O GLU B 194 0.195 2.625 -10.823 1.00 0.88 O ATOM 2993 CB GLU B 194 0.825 -0.613 -11.090 1.00 0.80 C ATOM 2994 CG GLU B 194 0.576 -0.222 -12.545 1.00 1.00 C ATOM 2995 CD GLU B 194 1.798 0.385 -13.255 1.00 1.27 C ATOM 2996 OE1 GLU B 194 2.898 -0.222 -13.229 1.00 2.33 O ATOM 2997 OE2 GLU B 194 1.657 1.476 -13.861 1.00 2.59 O ATOM 0 H GLU B 194 0.953 -0.940 -8.701 1.00 0.64 H new ATOM 0 HA GLU B 194 2.043 1.081 -10.505 1.00 0.71 H new ATOM 0 HB2 GLU B 194 1.642 -1.334 -11.061 1.00 0.80 H new ATOM 0 HB3 GLU B 194 -0.062 -1.121 -10.712 1.00 0.80 H new ATOM 0 HG2 GLU B 194 0.252 -1.105 -13.096 1.00 1.00 H new ATOM 0 HG3 GLU B 194 -0.244 0.495 -12.581 1.00 1.00 H new ATOM 3004 N ALA B 195 -0.927 1.561 -9.198 1.00 0.69 N ATOM 3005 CA ALA B 195 -1.829 2.698 -8.914 1.00 0.74 C ATOM 3006 C ALA B 195 -1.035 3.926 -8.415 1.00 0.79 C ATOM 3007 O ALA B 195 -1.221 5.030 -8.928 1.00 0.89 O ATOM 3008 CB ALA B 195 -2.951 2.303 -7.921 1.00 0.70 C ATOM 0 H ALA B 195 -1.135 0.721 -8.659 1.00 0.69 H new ATOM 0 HA ALA B 195 -2.314 2.976 -9.850 1.00 0.74 H new ATOM 0 HB1 ALA B 195 -3.594 3.164 -7.737 1.00 0.70 H new ATOM 0 HB2 ALA B 195 -3.543 1.492 -8.345 1.00 0.70 H new ATOM 0 HB3 ALA B 195 -2.506 1.974 -6.982 1.00 0.70 H new ATOM 3014 N ALA B 196 -0.087 3.736 -7.488 1.00 0.77 N ATOM 3015 CA ALA B 196 0.760 4.814 -6.961 1.00 0.86 C ATOM 3016 C ALA B 196 1.694 5.440 -8.018 1.00 0.95 C ATOM 3017 O ALA B 196 1.969 6.638 -7.961 1.00 1.44 O ATOM 3018 CB ALA B 196 1.556 4.285 -5.765 1.00 0.84 C ATOM 0 H ALA B 196 0.115 2.823 -7.080 1.00 0.77 H new ATOM 0 HA ALA B 196 0.101 5.623 -6.646 1.00 0.86 H new ATOM 0 HB1 ALA B 196 2.188 5.080 -5.368 1.00 0.84 H new ATOM 0 HB2 ALA B 196 0.868 3.947 -4.990 1.00 0.84 H new ATOM 0 HB3 ALA B 196 2.181 3.451 -6.084 1.00 0.84 H new ATOM 3024 N LYS B 197 2.120 4.681 -9.038 1.00 0.77 N ATOM 3025 CA LYS B 197 2.859 5.219 -10.202 1.00 0.88 C ATOM 3026 C LYS B 197 2.028 6.177 -11.079 1.00 0.98 C ATOM 3027 O LYS B 197 2.601 6.825 -11.952 1.00 1.31 O ATOM 3028 CB LYS B 197 3.466 4.065 -11.024 1.00 0.97 C ATOM 3029 CG LYS B 197 4.650 3.388 -10.315 1.00 1.01 C ATOM 3030 CD LYS B 197 5.118 2.161 -11.107 1.00 1.78 C ATOM 3031 CE LYS B 197 6.262 1.419 -10.402 1.00 1.52 C ATOM 3032 NZ LYS B 197 6.726 0.280 -11.230 1.00 2.24 N ATOM 0 H LYS B 197 1.964 3.674 -9.084 1.00 0.77 H new ATOM 0 HA LYS B 197 3.667 5.834 -9.806 1.00 0.88 H new ATOM 0 HB2 LYS B 197 2.694 3.322 -11.223 1.00 0.97 H new ATOM 0 HB3 LYS B 197 3.797 4.447 -11.990 1.00 0.97 H new ATOM 0 HG2 LYS B 197 5.472 4.096 -10.210 1.00 1.01 H new ATOM 0 HG3 LYS B 197 4.357 3.089 -9.309 1.00 1.01 H new ATOM 0 HD2 LYS B 197 4.279 1.480 -11.249 1.00 1.78 H new ATOM 0 HD3 LYS B 197 5.446 2.474 -12.098 1.00 1.78 H new ATOM 0 HE2 LYS B 197 7.090 2.104 -10.218 1.00 1.52 H new ATOM 0 HE3 LYS B 197 5.925 1.057 -9.430 1.00 1.52 H new ATOM 0 HZ1 LYS B 197 7.500 -0.213 -10.740 1.00 2.24 H new ATOM 0 HZ2 LYS B 197 5.938 -0.381 -11.384 1.00 2.24 H new ATOM 0 HZ3 LYS B 197 7.066 0.633 -12.147 1.00 2.24 H new ATOM 3046 N SER B 198 0.721 6.312 -10.815 1.00 0.84 N ATOM 3047 CA SER B 198 -0.191 7.304 -11.412 1.00 0.91 C ATOM 3048 C SER B 198 -0.677 8.388 -10.421 1.00 0.92 C ATOM 3049 O SER B 198 -1.573 9.160 -10.770 1.00 1.28 O ATOM 3050 CB SER B 198 -1.390 6.591 -12.063 1.00 1.06 C ATOM 3051 OG SER B 198 -1.016 5.895 -13.243 1.00 1.33 O ATOM 0 H SER B 198 0.246 5.704 -10.148 1.00 0.84 H new ATOM 0 HA SER B 198 0.386 7.834 -12.170 1.00 0.91 H new ATOM 0 HB2 SER B 198 -1.826 5.890 -11.351 1.00 1.06 H new ATOM 0 HB3 SER B 198 -2.161 7.323 -12.302 1.00 1.06 H new ATOM 0 HG SER B 198 -1.803 5.454 -13.626 1.00 1.33 H new ATOM 3057 N VAL B 199 -0.139 8.474 -9.190 1.00 0.91 N ATOM 3058 CA VAL B 199 -0.493 9.549 -8.233 1.00 1.05 C ATOM 3059 C VAL B 199 0.656 9.923 -7.277 1.00 1.18 C ATOM 3060 O VAL B 199 0.890 9.286 -6.248 1.00 1.22 O ATOM 3061 CB VAL B 199 -1.823 9.228 -7.511 1.00 1.13 C ATOM 3062 CG1 VAL B 199 -1.872 7.914 -6.721 1.00 1.13 C ATOM 3063 CG2 VAL B 199 -2.243 10.381 -6.598 1.00 1.52 C ATOM 0 H VAL B 199 0.546 7.810 -8.830 1.00 0.91 H new ATOM 0 HA VAL B 199 -0.657 10.457 -8.814 1.00 1.05 H new ATOM 0 HB VAL B 199 -2.527 9.095 -8.332 1.00 1.13 H new ATOM 0 HG11 VAL B 199 -2.854 7.802 -6.261 1.00 1.13 H new ATOM 0 HG12 VAL B 199 -1.690 7.077 -7.395 1.00 1.13 H new ATOM 0 HG13 VAL B 199 -1.107 7.928 -5.944 1.00 1.13 H new ATOM 0 HG21 VAL B 199 -3.181 10.130 -6.103 1.00 1.52 H new ATOM 0 HG22 VAL B 199 -1.471 10.551 -5.848 1.00 1.52 H new ATOM 0 HG23 VAL B 199 -2.377 11.285 -7.192 1.00 1.52 H new ATOM 3073 N LYS B 200 1.351 11.023 -7.594 1.00 1.49 N ATOM 3074 CA LYS B 200 2.594 11.517 -6.957 1.00 1.84 C ATOM 3075 C LYS B 200 2.610 13.061 -6.870 1.00 2.28 C ATOM 3076 O LYS B 200 1.588 13.699 -7.133 1.00 2.22 O ATOM 3077 CB LYS B 200 3.770 10.933 -7.775 1.00 1.91 C ATOM 3078 CG LYS B 200 4.153 9.525 -7.284 1.00 1.42 C ATOM 3079 CD LYS B 200 5.188 8.871 -8.205 1.00 2.01 C ATOM 3080 CE LYS B 200 5.789 7.651 -7.494 1.00 2.39 C ATOM 3081 NZ LYS B 200 7.034 7.168 -8.137 1.00 3.14 N ATOM 0 H LYS B 200 1.046 11.636 -8.350 1.00 1.49 H new ATOM 0 HA LYS B 200 2.673 11.187 -5.921 1.00 1.84 H new ATOM 0 HB2 LYS B 200 3.496 10.890 -8.829 1.00 1.91 H new ATOM 0 HB3 LYS B 200 4.633 11.594 -7.697 1.00 1.91 H new ATOM 0 HG2 LYS B 200 4.553 9.588 -6.272 1.00 1.42 H new ATOM 0 HG3 LYS B 200 3.261 8.900 -7.236 1.00 1.42 H new ATOM 0 HD2 LYS B 200 4.720 8.568 -9.142 1.00 2.01 H new ATOM 0 HD3 LYS B 200 5.973 9.585 -8.456 1.00 2.01 H new ATOM 0 HE2 LYS B 200 5.998 7.908 -6.455 1.00 2.39 H new ATOM 0 HE3 LYS B 200 5.055 6.845 -7.482 1.00 2.39 H new ATOM 0 HZ1 LYS B 200 7.396 6.344 -7.617 1.00 3.14 H new ATOM 0 HZ2 LYS B 200 6.834 6.896 -9.121 1.00 3.14 H new ATOM 0 HZ3 LYS B 200 7.747 7.925 -8.126 1.00 3.14 H new