USER MOD reduce.3.24.130724 H: found=0, std=0, add=1173, rem=0, adj=32 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= 1.86 K(o=2.8,f=-0.11) USER MOD Set 1.2: B 157 GLN : amide:sc= 0.949 K(o=2.8,f=0.92) USER MOD Set 2.1: A 28 ASN : amide:sc= 1.89 K(o=2.9,f=-0.26) USER MOD Set 2.2: A 53 GLN : amide:sc= 1 K(o=2.9,f=1) USER MOD Single : A 16 SER OG : rot -122:sc= 1.01 USER MOD Single : A 24 THR OG1 : rot 67:sc= 1.23 USER MOD Single : A 27 LYS NZ :NH3+ -148:sc= 0.746 (180deg=0.291) USER MOD Single : A 30 HIS : no HD1:sc= -0.185 X(o=-0.18,f=0.022) USER MOD Single : A 31 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 32 TYR OH : rot 180:sc= 0 USER MOD Single : A 33 SER OG : rot -90:sc= 1.36 USER MOD Single : A 38 LYS NZ :NH3+ 155:sc= 1.21 (180deg=0.83) USER MOD Single : A 40 THR OG1 : rot -10:sc= 0.352 USER MOD Single : A 42 THR OG1 : rot -75:sc= 1.2 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= -0.092 X(o=-0.092,f=-0.092) USER MOD Single : A 56 HIS : no HE2:sc= 0.728 K(o=0.73,f=-4!) USER MOD Single : A 58 MET CE :methyl -168:sc= -0.16 (180deg=-0.399) USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 67 LYS NZ :NH3+ 164:sc= 1.06 (180deg=0.91) USER MOD Single : A 70 ASN : amide:sc= 1.16 K(o=1.2,f=-0.0026) USER MOD Single : A 83 SER OG : rot 160:sc= 0 USER MOD Single : A 93 LYS NZ :NH3+ -147:sc= 0.801 (180deg=0.233) 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 82:sc= 1.08 USER MOD Single : B 128 THR OG1 : rot 65:sc= 1.23 USER MOD Single : B 131 LYS NZ :NH3+ -167:sc= 1.26 (180deg=1.18) USER MOD Single : B 134 HIS : no HD1:sc= -0.0317 X(o=-0.032,f=0) USER MOD Single : B 135 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 136 TYR OH : rot 180:sc= 0 USER MOD Single : B 137 SER OG : rot -82:sc= 1.24 USER MOD Single : B 142 LYS NZ :NH3+ 152:sc= 1.23 (180deg=1.19) USER MOD Single : B 144 THR OG1 : rot -21:sc= 1.08 USER MOD Single : B 146 THR OG1 : rot -67:sc= 1.03 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= -0.215 K(o=-0.22,f=-3.3!) USER MOD Single : B 160 HIS : no HE2:sc= 0.995 K(o=0.99,f=-4.3!) USER MOD Single : B 162 MET CE :methyl 174:sc= 0 (180deg=-0.0965) USER MOD Single : B 171 LYS NZ :NH3+ -170:sc= 0.74 (180deg=0.684) USER MOD Single : B 174 ASN : amide:sc= 1.01 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 163:sc= 1.21 USER MOD Single : B 200 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 178 N GLU A 14 -14.038 12.659 -2.987 1.00 1.80 N ATOM 179 CA GLU A 14 -14.721 11.963 -4.091 1.00 1.73 C ATOM 180 C GLU A 14 -14.380 10.473 -4.166 1.00 1.45 C ATOM 181 O GLU A 14 -15.158 9.675 -4.684 1.00 1.62 O ATOM 182 CB GLU A 14 -14.407 12.599 -5.455 1.00 1.97 C ATOM 183 CG GLU A 14 -15.069 13.960 -5.689 1.00 2.74 C ATOM 184 CD GLU A 14 -15.043 14.300 -7.183 1.00 3.36 C ATOM 185 OE1 GLU A 14 -14.060 14.903 -7.675 1.00 3.35 O ATOM 186 OE2 GLU A 14 -16.011 13.935 -7.896 1.00 4.55 O ATOM 0 HA GLU A 14 -15.783 12.067 -3.868 1.00 1.73 H new ATOM 0 HB2 GLU A 14 -13.327 12.714 -5.548 1.00 1.97 H new ATOM 0 HB3 GLU A 14 -14.724 11.915 -6.242 1.00 1.97 H new ATOM 0 HG2 GLU A 14 -16.098 13.941 -5.329 1.00 2.74 H new ATOM 0 HG3 GLU A 14 -14.547 14.731 -5.122 1.00 2.74 H new ATOM 193 N PHE A 15 -13.216 10.101 -3.649 1.00 1.21 N ATOM 194 CA PHE A 15 -12.669 8.748 -3.785 1.00 1.06 C ATOM 195 C PHE A 15 -13.326 7.773 -2.794 1.00 1.07 C ATOM 196 O PHE A 15 -13.703 8.155 -1.678 1.00 1.14 O ATOM 197 CB PHE A 15 -11.141 8.702 -3.612 1.00 0.97 C ATOM 198 CG PHE A 15 -10.234 9.716 -4.299 1.00 1.10 C ATOM 199 CD1 PHE A 15 -10.686 10.637 -5.267 1.00 1.92 C ATOM 200 CD2 PHE A 15 -8.870 9.709 -3.952 1.00 2.25 C ATOM 201 CE1 PHE A 15 -9.800 11.578 -5.818 1.00 2.06 C ATOM 202 CE2 PHE A 15 -7.982 10.642 -4.508 1.00 2.43 C ATOM 203 CZ PHE A 15 -8.450 11.590 -5.430 1.00 1.60 C ATOM 0 H PHE A 15 -12.616 10.732 -3.118 1.00 1.21 H new ATOM 0 HA PHE A 15 -12.900 8.437 -4.804 1.00 1.06 H new ATOM 0 HB2 PHE A 15 -10.940 8.770 -2.543 1.00 0.97 H new ATOM 0 HB3 PHE A 15 -10.814 7.714 -3.935 1.00 0.97 H new ATOM 0 HD1 PHE A 15 -11.718 10.619 -5.586 1.00 1.92 H new ATOM 0 HD2 PHE A 15 -8.502 8.976 -3.249 1.00 2.25 H new ATOM 0 HE1 PHE A 15 -10.158 12.295 -6.542 1.00 2.06 H new ATOM 0 HE2 PHE A 15 -6.939 10.630 -4.227 1.00 2.43 H new ATOM 0 HZ PHE A 15 -7.775 12.326 -5.840 1.00 1.60 H new ATOM 213 N SER A 16 -13.396 6.495 -3.167 1.00 1.09 N ATOM 214 CA SER A 16 -13.766 5.393 -2.273 1.00 1.17 C ATOM 215 C SER A 16 -12.757 5.249 -1.121 1.00 1.01 C ATOM 216 O SER A 16 -11.635 5.761 -1.197 1.00 0.83 O ATOM 217 CB SER A 16 -13.888 4.095 -3.083 1.00 1.33 C ATOM 218 OG SER A 16 -12.620 3.681 -3.552 1.00 2.22 O ATOM 0 H SER A 16 -13.193 6.189 -4.119 1.00 1.09 H new ATOM 0 HA SER A 16 -14.733 5.612 -1.820 1.00 1.17 H new ATOM 0 HB2 SER A 16 -14.326 3.313 -2.463 1.00 1.33 H new ATOM 0 HB3 SER A 16 -14.562 4.248 -3.926 1.00 1.33 H new ATOM 0 HG SER A 16 -12.641 3.606 -4.529 1.00 2.22 H new ATOM 224 N ASP A 17 -13.134 4.565 -0.035 1.00 1.15 N ATOM 225 CA ASP A 17 -12.256 4.419 1.138 1.00 1.14 C ATOM 226 C ASP A 17 -10.949 3.681 0.791 1.00 0.92 C ATOM 227 O ASP A 17 -9.894 4.066 1.293 1.00 0.91 O ATOM 228 CB ASP A 17 -12.996 3.727 2.296 1.00 1.47 C ATOM 229 CG ASP A 17 -14.145 4.576 2.852 1.00 1.67 C ATOM 230 OD1 ASP A 17 -13.914 5.467 3.704 1.00 2.74 O ATOM 231 OD2 ASP A 17 -15.301 4.386 2.403 1.00 1.79 O ATOM 0 H ASP A 17 -14.039 4.104 0.059 1.00 1.15 H new ATOM 0 HA ASP A 17 -11.979 5.422 1.463 1.00 1.14 H new ATOM 0 HB2 ASP A 17 -13.390 2.771 1.951 1.00 1.47 H new ATOM 0 HB3 ASP A 17 -12.289 3.510 3.097 1.00 1.47 H new ATOM 236 N VAL A 18 -10.995 2.698 -0.121 1.00 0.85 N ATOM 237 CA VAL A 18 -9.814 1.995 -0.667 1.00 0.68 C ATOM 238 C VAL A 18 -8.963 2.884 -1.583 1.00 0.60 C ATOM 239 O VAL A 18 -7.738 2.799 -1.567 1.00 0.64 O ATOM 240 CB VAL A 18 -10.254 0.703 -1.392 1.00 0.73 C ATOM 241 CG1 VAL A 18 -11.093 0.950 -2.649 1.00 0.87 C ATOM 242 CG2 VAL A 18 -9.080 -0.188 -1.807 1.00 0.78 C ATOM 0 H VAL A 18 -11.874 2.358 -0.512 1.00 0.85 H new ATOM 0 HA VAL A 18 -9.175 1.730 0.176 1.00 0.68 H new ATOM 0 HB VAL A 18 -10.862 0.201 -0.640 1.00 0.73 H new ATOM 0 HG11 VAL A 18 -11.362 -0.005 -3.100 1.00 0.87 H new ATOM 0 HG12 VAL A 18 -11.999 1.493 -2.381 1.00 0.87 H new ATOM 0 HG13 VAL A 18 -10.515 1.538 -3.362 1.00 0.87 H new ATOM 0 HG21 VAL A 18 -9.459 -1.078 -2.310 1.00 0.78 H new ATOM 0 HG22 VAL A 18 -8.427 0.362 -2.485 1.00 0.78 H new ATOM 0 HG23 VAL A 18 -8.517 -0.484 -0.922 1.00 0.78 H new ATOM 252 N GLU A 19 -9.585 3.766 -2.368 1.00 0.61 N ATOM 253 CA GLU A 19 -8.891 4.598 -3.357 1.00 0.64 C ATOM 254 C GLU A 19 -8.123 5.747 -2.696 1.00 0.73 C ATOM 255 O GLU A 19 -6.969 5.996 -3.051 1.00 0.92 O ATOM 256 CB GLU A 19 -9.914 5.045 -4.407 1.00 0.65 C ATOM 257 CG GLU A 19 -9.332 5.898 -5.541 1.00 0.72 C ATOM 258 CD GLU A 19 -10.383 6.229 -6.613 1.00 0.74 C ATOM 259 OE1 GLU A 19 -11.543 6.565 -6.264 1.00 1.88 O ATOM 260 OE2 GLU A 19 -10.039 6.187 -7.816 1.00 1.71 O ATOM 0 H GLU A 19 -10.592 3.925 -2.336 1.00 0.61 H new ATOM 0 HA GLU A 19 -8.117 4.024 -3.866 1.00 0.64 H new ATOM 0 HB2 GLU A 19 -10.382 4.161 -4.839 1.00 0.65 H new ATOM 0 HB3 GLU A 19 -10.701 5.612 -3.910 1.00 0.65 H new ATOM 0 HG2 GLU A 19 -8.931 6.824 -5.129 1.00 0.72 H new ATOM 0 HG3 GLU A 19 -8.499 5.368 -6.002 1.00 0.72 H new ATOM 267 N ARG A 20 -8.690 6.380 -1.657 1.00 0.70 N ATOM 268 CA ARG A 20 -7.928 7.340 -0.837 1.00 0.87 C ATOM 269 C ARG A 20 -7.014 6.698 0.202 1.00 0.81 C ATOM 270 O ARG A 20 -6.062 7.352 0.615 1.00 0.92 O ATOM 271 CB ARG A 20 -8.801 8.469 -0.284 1.00 1.13 C ATOM 272 CG ARG A 20 -9.854 8.104 0.764 1.00 1.23 C ATOM 273 CD ARG A 20 -10.860 9.259 0.885 1.00 1.66 C ATOM 274 NE ARG A 20 -11.710 9.095 2.069 1.00 2.20 N ATOM 275 CZ ARG A 20 -12.790 8.354 2.192 1.00 2.68 C ATOM 276 NH1 ARG A 20 -13.393 7.786 1.189 1.00 3.84 N ATOM 277 NH2 ARG A 20 -13.262 8.149 3.378 1.00 3.23 N ATOM 0 H ARG A 20 -9.659 6.249 -1.366 1.00 0.70 H new ATOM 0 HA ARG A 20 -7.233 7.816 -1.529 1.00 0.87 H new ATOM 0 HB2 ARG A 20 -8.142 9.221 0.150 1.00 1.13 H new ATOM 0 HB3 ARG A 20 -9.312 8.940 -1.124 1.00 1.13 H new ATOM 0 HG2 ARG A 20 -10.367 7.186 0.478 1.00 1.23 H new ATOM 0 HG3 ARG A 20 -9.378 7.917 1.727 1.00 1.23 H new ATOM 0 HD2 ARG A 20 -10.325 10.207 0.946 1.00 1.66 H new ATOM 0 HD3 ARG A 20 -11.481 9.300 -0.010 1.00 1.66 H new ATOM 0 HE ARG A 20 -11.430 9.619 2.898 1.00 2.20 H new ATOM 0 HH11 ARG A 20 -13.031 7.904 0.243 1.00 3.84 H new ATOM 0 HH12 ARG A 20 -14.228 7.222 1.349 1.00 3.84 H new ATOM 0 HH21 ARG A 20 -12.798 8.558 4.189 1.00 3.23 H new ATOM 0 HH22 ARG A 20 -14.098 7.578 3.502 1.00 3.23 H new ATOM 291 N ALA A 21 -7.212 5.430 0.566 1.00 0.72 N ATOM 292 CA ALA A 21 -6.267 4.683 1.415 1.00 0.78 C ATOM 293 C ALA A 21 -4.837 4.711 0.835 1.00 0.72 C ATOM 294 O ALA A 21 -3.899 5.126 1.502 1.00 0.72 O ATOM 295 CB ALA A 21 -6.720 3.230 1.605 1.00 0.89 C ATOM 0 H ALA A 21 -8.029 4.888 0.284 1.00 0.72 H new ATOM 0 HA ALA A 21 -6.255 5.178 2.386 1.00 0.78 H new ATOM 0 HB1 ALA A 21 -6.003 2.705 2.236 1.00 0.89 H new ATOM 0 HB2 ALA A 21 -7.701 3.214 2.080 1.00 0.89 H new ATOM 0 HB3 ALA A 21 -6.779 2.737 0.634 1.00 0.89 H new ATOM 301 N ILE A 22 -4.684 4.349 -0.439 1.00 0.71 N ATOM 302 CA ILE A 22 -3.420 4.300 -1.186 1.00 0.70 C ATOM 303 C ILE A 22 -2.771 5.690 -1.202 1.00 0.75 C ATOM 304 O ILE A 22 -1.582 5.813 -0.903 1.00 0.85 O ATOM 305 CB ILE A 22 -3.646 3.740 -2.617 1.00 0.63 C ATOM 306 CG1 ILE A 22 -4.341 2.355 -2.616 1.00 0.68 C ATOM 307 CG2 ILE A 22 -2.305 3.652 -3.372 1.00 0.69 C ATOM 308 CD1 ILE A 22 -5.028 2.031 -3.950 1.00 0.71 C ATOM 0 H ILE A 22 -5.480 4.066 -1.011 1.00 0.71 H new ATOM 0 HA ILE A 22 -2.732 3.617 -0.687 1.00 0.70 H new ATOM 0 HB ILE A 22 -4.314 4.435 -3.126 1.00 0.63 H new ATOM 0 HG12 ILE A 22 -3.603 1.584 -2.396 1.00 0.68 H new ATOM 0 HG13 ILE A 22 -5.080 2.326 -1.816 1.00 0.68 H new ATOM 0 HG21 ILE A 22 -2.477 3.258 -4.374 1.00 0.69 H new ATOM 0 HG22 ILE A 22 -1.862 4.645 -3.444 1.00 0.69 H new ATOM 0 HG23 ILE A 22 -1.627 2.990 -2.833 1.00 0.69 H new ATOM 0 HD11 ILE A 22 -5.497 1.049 -3.889 1.00 0.71 H new ATOM 0 HD12 ILE A 22 -5.788 2.784 -4.160 1.00 0.71 H new ATOM 0 HD13 ILE A 22 -4.287 2.030 -4.750 1.00 0.71 H new ATOM 320 N GLU A 23 -3.552 6.755 -1.442 1.00 0.73 N ATOM 321 CA GLU A 23 -3.009 8.113 -1.324 1.00 0.83 C ATOM 322 C GLU A 23 -2.637 8.503 0.108 1.00 0.84 C ATOM 323 O GLU A 23 -1.645 9.194 0.318 1.00 0.90 O ATOM 324 CB GLU A 23 -3.926 9.205 -1.896 1.00 0.99 C ATOM 325 CG GLU A 23 -3.790 9.323 -3.417 1.00 1.51 C ATOM 326 CD GLU A 23 -4.000 10.755 -3.952 1.00 2.11 C ATOM 327 OE1 GLU A 23 -3.518 11.734 -3.321 1.00 2.65 O ATOM 328 OE2 GLU A 23 -4.600 10.910 -5.043 1.00 3.15 O ATOM 0 H GLU A 23 -4.534 6.705 -1.712 1.00 0.73 H new ATOM 0 HA GLU A 23 -2.103 8.063 -1.929 1.00 0.83 H new ATOM 0 HB2 GLU A 23 -4.962 8.981 -1.640 1.00 0.99 H new ATOM 0 HB3 GLU A 23 -3.683 10.162 -1.434 1.00 0.99 H new ATOM 0 HG2 GLU A 23 -2.799 8.977 -3.712 1.00 1.51 H new ATOM 0 HG3 GLU A 23 -4.514 8.659 -3.890 1.00 1.51 H new ATOM 335 N THR A 24 -3.386 8.031 1.101 1.00 0.83 N ATOM 336 CA THR A 24 -3.096 8.284 2.528 1.00 0.96 C ATOM 337 C THR A 24 -1.720 7.726 2.907 1.00 1.05 C ATOM 338 O THR A 24 -1.017 8.325 3.723 1.00 1.11 O ATOM 339 CB THR A 24 -4.172 7.685 3.457 1.00 1.06 C ATOM 340 OG1 THR A 24 -5.464 8.108 3.081 1.00 1.15 O ATOM 341 CG2 THR A 24 -4.014 8.094 4.922 1.00 1.06 C ATOM 0 H THR A 24 -4.217 7.459 0.948 1.00 0.83 H new ATOM 0 HA THR A 24 -3.101 9.365 2.664 1.00 0.96 H new ATOM 0 HB THR A 24 -4.042 6.607 3.356 1.00 1.06 H new ATOM 0 HG1 THR A 24 -5.689 7.733 2.204 1.00 1.15 H new ATOM 0 HG21 THR A 24 -4.805 7.636 5.515 1.00 1.06 H new ATOM 0 HG22 THR A 24 -3.044 7.760 5.291 1.00 1.06 H new ATOM 0 HG23 THR A 24 -4.080 9.179 5.006 1.00 1.06 H new ATOM 349 N LEU A 25 -1.291 6.623 2.277 1.00 1.11 N ATOM 350 CA LEU A 25 0.025 6.032 2.522 1.00 1.24 C ATOM 351 C LEU A 25 1.128 6.952 1.976 1.00 1.04 C ATOM 352 O LEU A 25 2.062 7.301 2.700 1.00 0.96 O ATOM 353 CB LEU A 25 0.171 4.625 1.906 1.00 1.77 C ATOM 354 CG LEU A 25 -0.905 3.534 2.122 1.00 0.68 C ATOM 355 CD1 LEU A 25 -0.211 2.186 2.341 1.00 1.12 C ATOM 356 CD2 LEU A 25 -1.871 3.669 3.294 1.00 1.01 C ATOM 0 H LEU A 25 -1.847 6.120 1.586 1.00 1.11 H new ATOM 0 HA LEU A 25 0.127 5.926 3.602 1.00 1.24 H new ATOM 0 HB2 LEU A 25 0.275 4.759 0.829 1.00 1.77 H new ATOM 0 HB3 LEU A 25 1.114 4.216 2.269 1.00 1.77 H new ATOM 0 HG LEU A 25 -1.507 3.635 1.219 1.00 0.68 H new ATOM 0 HD11 LEU A 25 -0.962 1.411 2.494 1.00 1.12 H new ATOM 0 HD12 LEU A 25 0.391 1.940 1.466 1.00 1.12 H new ATOM 0 HD13 LEU A 25 0.432 2.246 3.219 1.00 1.12 H new ATOM 0 HD21 LEU A 25 -2.557 2.822 3.299 1.00 1.01 H new ATOM 0 HD22 LEU A 25 -1.310 3.687 4.228 1.00 1.01 H new ATOM 0 HD23 LEU A 25 -2.438 4.595 3.194 1.00 1.01 H new ATOM 368 N ILE A 26 1.010 7.387 0.712 1.00 1.07 N ATOM 369 CA ILE A 26 2.032 8.243 0.095 1.00 1.10 C ATOM 370 C ILE A 26 2.027 9.657 0.667 1.00 0.82 C ATOM 371 O ILE A 26 3.092 10.179 0.974 1.00 0.82 O ATOM 372 CB ILE A 26 1.986 8.219 -1.446 1.00 1.52 C ATOM 373 CG1 ILE A 26 3.277 8.866 -1.986 1.00 2.73 C ATOM 374 CG2 ILE A 26 0.755 8.909 -2.041 1.00 1.06 C ATOM 375 CD1 ILE A 26 3.563 8.500 -3.438 1.00 3.05 C ATOM 0 H ILE A 26 0.224 7.162 0.102 1.00 1.07 H new ATOM 0 HA ILE A 26 2.995 7.809 0.365 1.00 1.10 H new ATOM 0 HB ILE A 26 1.911 7.176 -1.753 1.00 1.52 H new ATOM 0 HG12 ILE A 26 3.198 9.950 -1.899 1.00 2.73 H new ATOM 0 HG13 ILE A 26 4.119 8.557 -1.366 1.00 2.73 H new ATOM 0 HG21 ILE A 26 0.795 8.850 -3.129 1.00 1.06 H new ATOM 0 HG22 ILE A 26 -0.148 8.414 -1.684 1.00 1.06 H new ATOM 0 HG23 ILE A 26 0.740 9.955 -1.734 1.00 1.06 H new ATOM 0 HD11 ILE A 26 4.484 8.985 -3.761 1.00 3.05 H new ATOM 0 HD12 ILE A 26 3.672 7.419 -3.526 1.00 3.05 H new ATOM 0 HD13 ILE A 26 2.737 8.833 -4.067 1.00 3.05 H new ATOM 387 N LYS A 27 0.870 10.261 0.945 1.00 0.72 N ATOM 388 CA LYS A 27 0.814 11.565 1.617 1.00 0.62 C ATOM 389 C LYS A 27 1.425 11.534 3.022 1.00 0.47 C ATOM 390 O LYS A 27 1.902 12.567 3.483 1.00 0.58 O ATOM 391 CB LYS A 27 -0.616 12.130 1.586 1.00 0.93 C ATOM 392 CG LYS A 27 -1.113 12.509 0.172 1.00 1.26 C ATOM 393 CD LYS A 27 -0.154 13.453 -0.574 1.00 1.75 C ATOM 394 CE LYS A 27 -0.803 14.131 -1.790 1.00 2.29 C ATOM 395 NZ LYS A 27 -1.030 13.209 -2.930 1.00 3.77 N ATOM 0 H LYS A 27 -0.043 9.869 0.716 1.00 0.72 H new ATOM 0 HA LYS A 27 1.444 12.256 1.056 1.00 0.62 H new ATOM 0 HB2 LYS A 27 -1.296 11.393 2.013 1.00 0.93 H new ATOM 0 HB3 LYS A 27 -0.661 13.013 2.224 1.00 0.93 H new ATOM 0 HG2 LYS A 27 -1.248 11.600 -0.415 1.00 1.26 H new ATOM 0 HG3 LYS A 27 -2.091 12.984 0.253 1.00 1.26 H new ATOM 0 HD2 LYS A 27 0.202 14.219 0.115 1.00 1.75 H new ATOM 0 HD3 LYS A 27 0.719 12.889 -0.902 1.00 1.75 H new ATOM 0 HE2 LYS A 27 -1.756 14.565 -1.488 1.00 2.29 H new ATOM 0 HE3 LYS A 27 -0.168 14.954 -2.119 1.00 2.29 H new ATOM 0 HZ1 LYS A 27 -0.940 13.733 -3.824 1.00 3.77 H new ATOM 0 HZ2 LYS A 27 -0.325 12.445 -2.904 1.00 3.77 H new ATOM 0 HZ3 LYS A 27 -1.985 12.802 -2.862 1.00 3.77 H new ATOM 409 N ASN A 28 1.571 10.360 3.647 1.00 0.51 N ATOM 410 CA ASN A 28 2.391 10.221 4.851 1.00 0.52 C ATOM 411 C ASN A 28 3.902 10.042 4.609 1.00 0.52 C ATOM 412 O ASN A 28 4.686 10.475 5.453 1.00 0.60 O ATOM 413 CB ASN A 28 1.776 9.160 5.788 1.00 0.53 C ATOM 414 CG ASN A 28 0.663 9.720 6.654 1.00 0.61 C ATOM 415 OD1 ASN A 28 0.902 10.255 7.726 1.00 0.77 O ATOM 416 ND2 ASN A 28 -0.572 9.604 6.237 1.00 0.65 N ATOM 0 H ASN A 28 1.131 9.494 3.337 1.00 0.51 H new ATOM 0 HA ASN A 28 2.361 11.185 5.358 1.00 0.52 H new ATOM 0 HB2 ASN A 28 1.387 8.335 5.191 1.00 0.53 H new ATOM 0 HB3 ASN A 28 2.557 8.749 6.428 1.00 0.53 H new ATOM 0 HD21 ASN A 28 -1.339 9.961 6.807 1.00 0.65 H new ATOM 0 HD22 ASN A 28 -0.768 9.157 5.341 1.00 0.65 H new ATOM 423 N PHE A 29 4.340 9.560 3.441 1.00 0.50 N ATOM 424 CA PHE A 29 5.724 9.776 2.990 1.00 0.57 C ATOM 425 C PHE A 29 6.004 11.276 2.789 1.00 0.64 C ATOM 426 O PHE A 29 7.054 11.760 3.205 1.00 0.84 O ATOM 427 CB PHE A 29 6.013 8.971 1.710 1.00 0.59 C ATOM 428 CG PHE A 29 7.448 9.058 1.214 1.00 0.58 C ATOM 429 CD1 PHE A 29 7.845 10.078 0.325 1.00 1.90 C ATOM 430 CD2 PHE A 29 8.384 8.091 1.617 1.00 1.80 C ATOM 431 CE1 PHE A 29 9.172 10.131 -0.142 1.00 1.88 C ATOM 432 CE2 PHE A 29 9.704 8.127 1.131 1.00 1.86 C ATOM 433 CZ PHE A 29 10.100 9.154 0.261 1.00 0.69 C ATOM 0 H PHE A 29 3.764 9.022 2.794 1.00 0.50 H new ATOM 0 HA PHE A 29 6.399 9.415 3.766 1.00 0.57 H new ATOM 0 HB2 PHE A 29 5.769 7.924 1.893 1.00 0.59 H new ATOM 0 HB3 PHE A 29 5.348 9.320 0.920 1.00 0.59 H new ATOM 0 HD1 PHE A 29 7.130 10.820 0.002 1.00 1.90 H new ATOM 0 HD2 PHE A 29 8.088 7.313 2.306 1.00 1.80 H new ATOM 0 HE1 PHE A 29 9.478 10.922 -0.810 1.00 1.88 H new ATOM 0 HE2 PHE A 29 10.411 7.366 1.427 1.00 1.86 H new ATOM 0 HZ PHE A 29 11.117 9.194 -0.099 1.00 0.69 H new ATOM 443 N HIS A 30 5.060 12.048 2.233 1.00 0.59 N ATOM 444 CA HIS A 30 5.199 13.511 2.110 1.00 0.73 C ATOM 445 C HIS A 30 5.309 14.175 3.493 1.00 0.60 C ATOM 446 O HIS A 30 6.251 14.931 3.740 1.00 0.75 O ATOM 447 CB HIS A 30 4.028 14.129 1.328 1.00 1.02 C ATOM 448 CG HIS A 30 3.948 13.792 -0.139 1.00 1.34 C ATOM 449 ND1 HIS A 30 3.623 14.691 -1.128 1.00 2.62 N ATOM 450 CD2 HIS A 30 4.093 12.567 -0.740 1.00 0.86 C ATOM 451 CE1 HIS A 30 3.596 14.039 -2.297 1.00 2.63 C ATOM 452 NE2 HIS A 30 3.858 12.734 -2.107 1.00 1.55 N ATOM 0 H HIS A 30 4.185 11.683 1.858 1.00 0.59 H new ATOM 0 HA HIS A 30 6.118 13.697 1.554 1.00 0.73 H new ATOM 0 HB2 HIS A 30 3.098 13.815 1.802 1.00 1.02 H new ATOM 0 HB3 HIS A 30 4.086 15.213 1.427 1.00 1.02 H new ATOM 0 HD2 HIS A 30 4.344 11.640 -0.245 1.00 0.86 H new ATOM 0 HE1 HIS A 30 3.393 14.495 -3.255 1.00 2.63 H new ATOM 0 HE2 HIS A 30 3.881 12.007 -2.822 1.00 1.55 H new ATOM 460 N GLN A 31 4.402 13.839 4.418 1.00 0.54 N ATOM 461 CA GLN A 31 4.383 14.378 5.783 1.00 0.62 C ATOM 462 C GLN A 31 5.671 14.102 6.594 1.00 0.59 C ATOM 463 O GLN A 31 5.975 14.873 7.502 1.00 0.79 O ATOM 464 CB GLN A 31 3.130 13.834 6.503 1.00 0.81 C ATOM 465 CG GLN A 31 2.701 14.706 7.695 1.00 1.97 C ATOM 466 CD GLN A 31 1.481 14.161 8.440 1.00 3.00 C ATOM 467 OE1 GLN A 31 1.501 13.921 9.644 1.00 4.30 O ATOM 468 NE2 GLN A 31 0.360 13.979 7.776 1.00 3.40 N ATOM 0 H GLN A 31 3.649 13.175 4.236 1.00 0.54 H new ATOM 0 HA GLN A 31 4.342 15.465 5.710 1.00 0.62 H new ATOM 0 HB2 GLN A 31 2.307 13.770 5.791 1.00 0.81 H new ATOM 0 HB3 GLN A 31 3.329 12.821 6.853 1.00 0.81 H new ATOM 0 HG2 GLN A 31 3.535 14.791 8.392 1.00 1.97 H new ATOM 0 HG3 GLN A 31 2.480 15.712 7.338 1.00 1.97 H new ATOM 0 HE21 GLN A 31 0.323 14.173 6.775 1.00 3.40 H new ATOM 0 HE22 GLN A 31 -0.472 13.644 8.262 1.00 3.40 H new ATOM 477 N TYR A 32 6.435 13.038 6.297 1.00 0.55 N ATOM 478 CA TYR A 32 7.635 12.650 7.067 1.00 0.64 C ATOM 479 C TYR A 32 8.981 12.676 6.321 1.00 0.79 C ATOM 480 O TYR A 32 10.010 12.512 6.964 1.00 1.10 O ATOM 481 CB TYR A 32 7.387 11.310 7.773 1.00 0.53 C ATOM 482 CG TYR A 32 6.559 11.466 9.034 1.00 0.54 C ATOM 483 CD1 TYR A 32 5.154 11.439 8.968 1.00 1.88 C ATOM 484 CD2 TYR A 32 7.202 11.661 10.273 1.00 1.81 C ATOM 485 CE1 TYR A 32 4.393 11.608 10.139 1.00 1.97 C ATOM 486 CE2 TYR A 32 6.445 11.784 11.455 1.00 1.82 C ATOM 487 CZ TYR A 32 5.034 11.762 11.386 1.00 0.81 C ATOM 488 OH TYR A 32 4.281 11.906 12.505 1.00 1.01 O ATOM 0 H TYR A 32 6.239 12.417 5.512 1.00 0.55 H new ATOM 0 HA TYR A 32 7.768 13.446 7.799 1.00 0.64 H new ATOM 0 HB2 TYR A 32 6.878 10.631 7.089 1.00 0.53 H new ATOM 0 HB3 TYR A 32 8.344 10.852 8.024 1.00 0.53 H new ATOM 0 HD1 TYR A 32 4.660 11.289 8.019 1.00 1.88 H new ATOM 0 HD2 TYR A 32 8.280 11.716 10.317 1.00 1.81 H new ATOM 0 HE1 TYR A 32 3.315 11.620 10.083 1.00 1.97 H new ATOM 0 HE2 TYR A 32 6.940 11.894 12.408 1.00 1.82 H new ATOM 0 HH TYR A 32 4.868 12.000 13.284 1.00 1.01 H new ATOM 498 N SER A 33 9.035 12.949 5.016 1.00 0.73 N ATOM 499 CA SER A 33 10.294 13.098 4.245 1.00 0.82 C ATOM 500 C SER A 33 10.987 14.459 4.460 1.00 0.89 C ATOM 501 O SER A 33 11.506 15.064 3.523 1.00 1.25 O ATOM 502 CB SER A 33 10.065 12.778 2.756 1.00 0.87 C ATOM 503 OG SER A 33 8.905 13.410 2.249 1.00 1.76 O ATOM 0 H SER A 33 8.199 13.077 4.446 1.00 0.73 H new ATOM 0 HA SER A 33 10.996 12.363 4.639 1.00 0.82 H new ATOM 0 HB2 SER A 33 10.933 13.097 2.179 1.00 0.87 H new ATOM 0 HB3 SER A 33 9.976 11.699 2.627 1.00 0.87 H new ATOM 0 HG SER A 33 8.132 12.820 2.369 1.00 1.76 H new ATOM 509 N VAL A 34 10.957 15.003 5.680 1.00 0.92 N ATOM 510 CA VAL A 34 11.292 16.416 5.940 1.00 1.10 C ATOM 511 C VAL A 34 12.803 16.646 5.992 1.00 1.15 C ATOM 512 O VAL A 34 13.307 17.527 5.291 1.00 1.47 O ATOM 513 CB VAL A 34 10.623 16.923 7.235 1.00 1.35 C ATOM 514 CG1 VAL A 34 10.779 18.441 7.378 1.00 2.39 C ATOM 515 CG2 VAL A 34 9.121 16.605 7.271 1.00 2.79 C ATOM 0 H VAL A 34 10.701 14.481 6.518 1.00 0.92 H new ATOM 0 HA VAL A 34 10.898 16.992 5.102 1.00 1.10 H new ATOM 0 HB VAL A 34 11.125 16.407 8.054 1.00 1.35 H new ATOM 0 HG11 VAL A 34 10.298 18.771 8.299 1.00 2.39 H new ATOM 0 HG12 VAL A 34 11.838 18.697 7.410 1.00 2.39 H new ATOM 0 HG13 VAL A 34 10.312 18.937 6.527 1.00 2.39 H new ATOM 0 HG21 VAL A 34 8.692 16.980 8.200 1.00 2.79 H new ATOM 0 HG22 VAL A 34 8.628 17.083 6.425 1.00 2.79 H new ATOM 0 HG23 VAL A 34 8.976 15.526 7.214 1.00 2.79 H new ATOM 525 N GLU A 35 13.544 15.834 6.750 1.00 1.10 N ATOM 526 CA GLU A 35 15.007 15.935 6.832 1.00 1.36 C ATOM 527 C GLU A 35 15.682 15.286 5.621 1.00 1.51 C ATOM 528 O GLU A 35 16.662 15.828 5.108 1.00 1.79 O ATOM 529 CB GLU A 35 15.509 15.337 8.152 1.00 1.55 C ATOM 530 CG GLU A 35 16.890 15.888 8.527 1.00 2.11 C ATOM 531 CD GLU A 35 17.253 15.486 9.955 1.00 2.67 C ATOM 532 OE1 GLU A 35 16.630 16.016 10.909 1.00 3.36 O ATOM 533 OE2 GLU A 35 18.123 14.601 10.135 1.00 3.65 O ATOM 0 H GLU A 35 13.150 15.089 7.324 1.00 1.10 H new ATOM 0 HA GLU A 35 15.279 16.990 6.816 1.00 1.36 H new ATOM 0 HB2 GLU A 35 14.798 15.560 8.948 1.00 1.55 H new ATOM 0 HB3 GLU A 35 15.560 14.252 8.065 1.00 1.55 H new ATOM 0 HG2 GLU A 35 17.641 15.509 7.834 1.00 2.11 H new ATOM 0 HG3 GLU A 35 16.892 16.974 8.436 1.00 2.11 H new ATOM 540 N GLY A 36 15.078 14.222 5.076 1.00 1.56 N ATOM 541 CA GLY A 36 15.384 13.659 3.752 1.00 1.90 C ATOM 542 C GLY A 36 15.007 14.553 2.558 1.00 1.72 C ATOM 543 O GLY A 36 14.989 14.090 1.412 1.00 2.32 O ATOM 0 H GLY A 36 14.339 13.712 5.559 1.00 1.56 H new ATOM 0 HA2 GLY A 36 16.452 13.446 3.703 1.00 1.90 H new ATOM 0 HA3 GLY A 36 14.864 12.706 3.651 1.00 1.90 H new ATOM 547 N GLY A 37 14.704 15.830 2.816 1.00 2.16 N ATOM 548 CA GLY A 37 14.688 16.911 1.834 1.00 2.53 C ATOM 549 C GLY A 37 13.532 16.876 0.837 1.00 2.33 C ATOM 550 O GLY A 37 13.645 17.505 -0.214 1.00 3.11 O ATOM 0 H GLY A 37 14.454 16.147 3.753 1.00 2.16 H new ATOM 0 HA2 GLY A 37 14.657 17.862 2.366 1.00 2.53 H new ATOM 0 HA3 GLY A 37 15.625 16.887 1.278 1.00 2.53 H new ATOM 554 N LYS A 38 12.451 16.143 1.136 1.00 1.84 N ATOM 555 CA LYS A 38 11.292 15.836 0.269 1.00 1.70 C ATOM 556 C LYS A 38 11.629 15.039 -1.003 1.00 1.97 C ATOM 557 O LYS A 38 10.752 14.793 -1.826 1.00 2.30 O ATOM 558 CB LYS A 38 10.456 17.104 -0.005 1.00 1.93 C ATOM 559 CG LYS A 38 9.983 17.855 1.256 1.00 2.17 C ATOM 560 CD LYS A 38 8.807 17.175 1.969 1.00 2.51 C ATOM 561 CE LYS A 38 8.442 17.986 3.218 1.00 3.09 C ATOM 562 NZ LYS A 38 7.133 17.578 3.771 1.00 4.36 N ATOM 0 H LYS A 38 12.351 15.715 2.056 1.00 1.84 H new ATOM 0 HA LYS A 38 10.668 15.144 0.835 1.00 1.70 H new ATOM 0 HB2 LYS A 38 11.047 17.786 -0.616 1.00 1.93 H new ATOM 0 HB3 LYS A 38 9.582 16.825 -0.593 1.00 1.93 H new ATOM 0 HG2 LYS A 38 10.818 17.942 1.952 1.00 2.17 H new ATOM 0 HG3 LYS A 38 9.692 18.868 0.978 1.00 2.17 H new ATOM 0 HD2 LYS A 38 7.949 17.108 1.300 1.00 2.51 H new ATOM 0 HD3 LYS A 38 9.074 16.156 2.247 1.00 2.51 H new ATOM 0 HE2 LYS A 38 9.214 17.855 3.976 1.00 3.09 H new ATOM 0 HE3 LYS A 38 8.417 19.047 2.969 1.00 3.09 H new ATOM 0 HZ1 LYS A 38 7.099 17.804 4.786 1.00 4.36 H new ATOM 0 HZ2 LYS A 38 6.373 18.089 3.277 1.00 4.36 H new ATOM 0 HZ3 LYS A 38 7.004 16.554 3.639 1.00 4.36 H new ATOM 576 N GLU A 39 12.879 14.589 -1.144 1.00 2.14 N ATOM 577 CA GLU A 39 13.324 13.633 -2.171 1.00 2.45 C ATOM 578 C GLU A 39 13.420 12.191 -1.642 1.00 1.91 C ATOM 579 O GLU A 39 13.331 11.242 -2.423 1.00 1.96 O ATOM 580 CB GLU A 39 14.672 14.078 -2.773 1.00 3.20 C ATOM 581 CG GLU A 39 15.816 14.243 -1.764 1.00 4.75 C ATOM 582 CD GLU A 39 17.167 14.410 -2.469 1.00 5.73 C ATOM 583 OE1 GLU A 39 17.751 13.387 -2.896 1.00 6.40 O ATOM 584 OE2 GLU A 39 17.681 15.553 -2.553 1.00 6.42 O ATOM 0 H GLU A 39 13.636 14.887 -0.529 1.00 2.14 H new ATOM 0 HA GLU A 39 12.563 13.632 -2.952 1.00 2.45 H new ATOM 0 HB2 GLU A 39 14.974 13.349 -3.525 1.00 3.20 H new ATOM 0 HB3 GLU A 39 14.525 15.026 -3.290 1.00 3.20 H new ATOM 0 HG2 GLU A 39 15.624 15.111 -1.133 1.00 4.75 H new ATOM 0 HG3 GLU A 39 15.852 13.374 -1.108 1.00 4.75 H new ATOM 591 N THR A 40 13.624 12.029 -0.327 1.00 1.51 N ATOM 592 CA THR A 40 13.853 10.744 0.356 1.00 1.13 C ATOM 593 C THR A 40 13.354 10.767 1.809 1.00 1.00 C ATOM 594 O THR A 40 13.030 11.820 2.350 1.00 1.30 O ATOM 595 CB THR A 40 15.348 10.351 0.351 1.00 1.17 C ATOM 596 OG1 THR A 40 16.160 11.338 0.961 1.00 1.25 O ATOM 597 CG2 THR A 40 15.924 10.130 -1.046 1.00 1.44 C ATOM 0 H THR A 40 13.635 12.820 0.317 1.00 1.51 H new ATOM 0 HA THR A 40 13.283 10.003 -0.204 1.00 1.13 H new ATOM 0 HB THR A 40 15.367 9.415 0.909 1.00 1.17 H new ATOM 0 HG1 THR A 40 15.630 12.148 1.114 1.00 1.25 H new ATOM 0 HG21 THR A 40 16.976 9.858 -0.967 1.00 1.44 H new ATOM 0 HG22 THR A 40 15.378 9.328 -1.542 1.00 1.44 H new ATOM 0 HG23 THR A 40 15.829 11.047 -1.628 1.00 1.44 H new ATOM 605 N LEU A 41 13.342 9.605 2.461 1.00 0.84 N ATOM 606 CA LEU A 41 13.096 9.409 3.899 1.00 0.76 C ATOM 607 C LEU A 41 14.447 9.378 4.660 1.00 0.90 C ATOM 608 O LEU A 41 15.490 9.159 4.038 1.00 1.34 O ATOM 609 CB LEU A 41 12.306 8.080 4.021 1.00 0.83 C ATOM 610 CG LEU A 41 11.146 7.957 5.025 1.00 0.67 C ATOM 611 CD1 LEU A 41 11.626 7.980 6.470 1.00 1.02 C ATOM 612 CD2 LEU A 41 10.083 9.046 4.864 1.00 0.65 C ATOM 0 H LEU A 41 13.513 8.723 1.978 1.00 0.84 H new ATOM 0 HA LEU A 41 12.519 10.220 4.343 1.00 0.76 H new ATOM 0 HB2 LEU A 41 11.904 7.851 3.034 1.00 0.83 H new ATOM 0 HB3 LEU A 41 13.026 7.297 4.261 1.00 0.83 H new ATOM 0 HG LEU A 41 10.698 6.990 4.796 1.00 0.67 H new ATOM 0 HD11 LEU A 41 10.770 7.890 7.139 1.00 1.02 H new ATOM 0 HD12 LEU A 41 12.308 7.147 6.640 1.00 1.02 H new ATOM 0 HD13 LEU A 41 12.143 8.919 6.667 1.00 1.02 H new ATOM 0 HD21 LEU A 41 9.296 8.898 5.603 1.00 0.65 H new ATOM 0 HD22 LEU A 41 10.540 10.025 5.011 1.00 0.65 H new ATOM 0 HD23 LEU A 41 9.655 8.992 3.863 1.00 0.65 H new ATOM 624 N THR A 42 14.470 9.544 5.990 1.00 0.80 N ATOM 625 CA THR A 42 15.673 9.288 6.820 1.00 0.86 C ATOM 626 C THR A 42 15.365 8.466 8.087 1.00 0.91 C ATOM 627 O THR A 42 14.251 8.549 8.608 1.00 0.89 O ATOM 628 CB THR A 42 16.444 10.568 7.198 1.00 0.92 C ATOM 629 OG1 THR A 42 15.708 11.433 8.034 1.00 1.24 O ATOM 630 CG2 THR A 42 16.918 11.371 5.994 1.00 0.94 C ATOM 0 H THR A 42 13.662 9.858 6.527 1.00 0.80 H new ATOM 0 HA THR A 42 16.320 8.692 6.176 1.00 0.86 H new ATOM 0 HB THR A 42 17.311 10.189 7.739 1.00 0.92 H new ATOM 0 HG1 THR A 42 15.025 11.896 7.505 1.00 1.24 H new ATOM 0 HG21 THR A 42 17.452 12.257 6.335 1.00 0.94 H new ATOM 0 HG22 THR A 42 17.583 10.758 5.387 1.00 0.94 H new ATOM 0 HG23 THR A 42 16.058 11.674 5.397 1.00 0.94 H new ATOM 638 N PRO A 43 16.313 7.663 8.619 1.00 0.99 N ATOM 639 CA PRO A 43 16.110 6.831 9.815 1.00 1.02 C ATOM 640 C PRO A 43 15.583 7.562 11.060 1.00 1.01 C ATOM 641 O PRO A 43 14.754 7.006 11.775 1.00 1.02 O ATOM 642 CB PRO A 43 17.488 6.230 10.106 1.00 1.15 C ATOM 643 CG PRO A 43 18.102 6.084 8.719 1.00 1.15 C ATOM 644 CD PRO A 43 17.612 7.351 8.026 1.00 1.07 C ATOM 0 HA PRO A 43 15.328 6.101 9.605 1.00 1.02 H new ATOM 0 HB2 PRO A 43 18.085 6.881 10.744 1.00 1.15 H new ATOM 0 HB3 PRO A 43 17.409 5.269 10.615 1.00 1.15 H new ATOM 0 HG2 PRO A 43 19.190 6.033 8.757 1.00 1.15 H new ATOM 0 HG3 PRO A 43 17.758 5.182 8.213 1.00 1.15 H new ATOM 0 HD2 PRO A 43 18.314 8.172 8.173 1.00 1.07 H new ATOM 0 HD3 PRO A 43 17.522 7.197 6.951 1.00 1.07 H new ATOM 652 N SER A 44 16.015 8.799 11.325 1.00 1.04 N ATOM 653 CA SER A 44 15.602 9.554 12.522 1.00 1.08 C ATOM 654 C SER A 44 14.104 9.888 12.529 1.00 1.04 C ATOM 655 O SER A 44 13.445 9.747 13.559 1.00 1.07 O ATOM 656 CB SER A 44 16.438 10.831 12.664 1.00 1.18 C ATOM 657 OG SER A 44 17.811 10.502 12.806 1.00 1.42 O ATOM 0 H SER A 44 16.659 9.308 10.720 1.00 1.04 H new ATOM 0 HA SER A 44 15.783 8.907 13.380 1.00 1.08 H new ATOM 0 HB2 SER A 44 16.297 11.466 11.790 1.00 1.18 H new ATOM 0 HB3 SER A 44 16.101 11.401 13.530 1.00 1.18 H new ATOM 0 HG SER A 44 18.337 11.324 12.894 1.00 1.42 H new ATOM 663 N GLU A 45 13.536 10.245 11.374 1.00 1.00 N ATOM 664 CA GLU A 45 12.092 10.482 11.204 1.00 0.95 C ATOM 665 C GLU A 45 11.294 9.201 10.896 1.00 0.86 C ATOM 666 O GLU A 45 10.107 9.129 11.207 1.00 0.83 O ATOM 667 CB GLU A 45 11.852 11.652 10.234 1.00 1.05 C ATOM 668 CG GLU A 45 12.420 11.471 8.816 1.00 1.00 C ATOM 669 CD GLU A 45 12.782 12.794 8.111 1.00 1.18 C ATOM 670 OE1 GLU A 45 12.420 13.894 8.607 1.00 2.11 O ATOM 671 OE2 GLU A 45 13.524 12.720 7.100 1.00 1.58 O ATOM 0 H GLU A 45 14.070 10.381 10.516 1.00 1.00 H new ATOM 0 HA GLU A 45 11.681 10.794 12.164 1.00 0.95 H new ATOM 0 HB2 GLU A 45 10.778 11.821 10.156 1.00 1.05 H new ATOM 0 HB3 GLU A 45 12.286 12.553 10.667 1.00 1.05 H new ATOM 0 HG2 GLU A 45 13.310 10.845 8.870 1.00 1.00 H new ATOM 0 HG3 GLU A 45 11.690 10.936 8.209 1.00 1.00 H new ATOM 678 N LEU A 46 11.949 8.143 10.400 1.00 0.84 N ATOM 679 CA LEU A 46 11.411 6.778 10.353 1.00 0.79 C ATOM 680 C LEU A 46 11.107 6.257 11.774 1.00 0.74 C ATOM 681 O LEU A 46 9.974 5.869 12.061 1.00 0.73 O ATOM 682 CB LEU A 46 12.436 5.917 9.589 1.00 0.83 C ATOM 683 CG LEU A 46 12.100 4.473 9.201 1.00 0.84 C ATOM 684 CD1 LEU A 46 11.804 3.579 10.393 1.00 2.50 C ATOM 685 CD2 LEU A 46 10.941 4.352 8.233 1.00 1.87 C ATOM 0 H LEU A 46 12.889 8.215 10.011 1.00 0.84 H new ATOM 0 HA LEU A 46 10.455 6.739 9.830 1.00 0.79 H new ATOM 0 HB2 LEU A 46 12.682 6.449 8.670 1.00 0.83 H new ATOM 0 HB3 LEU A 46 13.344 5.886 10.192 1.00 0.83 H new ATOM 0 HG LEU A 46 13.013 4.136 8.710 1.00 0.84 H new ATOM 0 HD11 LEU A 46 11.574 2.572 10.044 1.00 2.50 H new ATOM 0 HD12 LEU A 46 12.674 3.547 11.048 1.00 2.50 H new ATOM 0 HD13 LEU A 46 10.951 3.976 10.943 1.00 2.50 H new ATOM 0 HD21 LEU A 46 10.764 3.301 8.007 1.00 1.87 H new ATOM 0 HD22 LEU A 46 10.046 4.782 8.682 1.00 1.87 H new ATOM 0 HD23 LEU A 46 11.178 4.886 7.313 1.00 1.87 H new ATOM 697 N ARG A 47 12.072 6.300 12.707 1.00 0.75 N ATOM 698 CA ARG A 47 11.821 5.928 14.117 1.00 0.77 C ATOM 699 C ARG A 47 10.914 6.911 14.872 1.00 0.85 C ATOM 700 O ARG A 47 10.441 6.561 15.949 1.00 1.15 O ATOM 701 CB ARG A 47 13.084 5.457 14.874 1.00 0.93 C ATOM 702 CG ARG A 47 14.298 6.393 14.942 1.00 1.56 C ATOM 703 CD ARG A 47 15.625 5.704 14.549 1.00 1.15 C ATOM 704 NE ARG A 47 16.717 6.685 14.658 1.00 2.66 N ATOM 705 CZ ARG A 47 17.863 6.707 14.012 1.00 3.90 C ATOM 706 NH1 ARG A 47 18.316 5.687 13.350 1.00 3.92 N ATOM 707 NH2 ARG A 47 18.571 7.796 14.023 1.00 5.49 N ATOM 0 H ARG A 47 13.032 6.587 12.515 1.00 0.75 H new ATOM 0 HA ARG A 47 11.212 5.025 14.073 1.00 0.77 H new ATOM 0 HB2 ARG A 47 12.788 5.226 15.897 1.00 0.93 H new ATOM 0 HB3 ARG A 47 13.413 4.523 14.418 1.00 0.93 H new ATOM 0 HG2 ARG A 47 14.129 7.244 14.282 1.00 1.56 H new ATOM 0 HG3 ARG A 47 14.387 6.788 15.954 1.00 1.56 H new ATOM 0 HD2 ARG A 47 15.816 4.852 15.202 1.00 1.15 H new ATOM 0 HD3 ARG A 47 15.564 5.319 13.531 1.00 1.15 H new ATOM 0 HE ARG A 47 16.566 7.446 15.320 1.00 2.66 H new ATOM 0 HH11 ARG A 47 17.777 4.821 13.315 1.00 3.92 H new ATOM 0 HH12 ARG A 47 19.211 5.751 12.864 1.00 3.92 H new ATOM 0 HH21 ARG A 47 18.236 8.617 14.527 1.00 5.49 H new ATOM 0 HH22 ARG A 47 19.462 7.830 13.527 1.00 5.49 H new ATOM 721 N ASP A 48 10.632 8.094 14.319 1.00 0.78 N ATOM 722 CA ASP A 48 9.554 8.983 14.789 1.00 0.81 C ATOM 723 C ASP A 48 8.168 8.510 14.312 1.00 0.75 C ATOM 724 O ASP A 48 7.319 8.174 15.142 1.00 0.90 O ATOM 725 CB ASP A 48 9.846 10.441 14.399 1.00 0.94 C ATOM 726 CG ASP A 48 9.046 11.443 15.239 1.00 1.11 C ATOM 727 OD1 ASP A 48 9.246 11.497 16.473 1.00 1.81 O ATOM 728 OD2 ASP A 48 8.298 12.263 14.660 1.00 1.88 O ATOM 0 H ASP A 48 11.148 8.470 13.524 1.00 0.78 H new ATOM 0 HA ASP A 48 9.528 8.936 15.878 1.00 0.81 H new ATOM 0 HB2 ASP A 48 10.911 10.640 14.519 1.00 0.94 H new ATOM 0 HB3 ASP A 48 9.611 10.586 13.345 1.00 0.94 H new ATOM 733 N LEU A 49 7.924 8.388 12.994 1.00 0.66 N ATOM 734 CA LEU A 49 6.580 8.036 12.509 1.00 0.63 C ATOM 735 C LEU A 49 6.141 6.621 12.885 1.00 0.58 C ATOM 736 O LEU A 49 4.941 6.380 12.994 1.00 0.65 O ATOM 737 CB LEU A 49 6.350 8.363 11.016 1.00 0.66 C ATOM 738 CG LEU A 49 6.295 7.228 9.976 1.00 0.69 C ATOM 739 CD1 LEU A 49 5.656 7.733 8.681 1.00 0.83 C ATOM 740 CD2 LEU A 49 7.681 6.703 9.626 1.00 0.79 C ATOM 0 H LEU A 49 8.622 8.524 12.263 1.00 0.66 H new ATOM 0 HA LEU A 49 5.912 8.701 13.056 1.00 0.63 H new ATOM 0 HB2 LEU A 49 5.411 8.912 10.946 1.00 0.66 H new ATOM 0 HB3 LEU A 49 7.142 9.046 10.708 1.00 0.66 H new ATOM 0 HG LEU A 49 5.708 6.425 10.422 1.00 0.69 H new ATOM 0 HD11 LEU A 49 5.622 6.923 7.952 1.00 0.83 H new ATOM 0 HD12 LEU A 49 4.643 8.080 8.886 1.00 0.83 H new ATOM 0 HD13 LEU A 49 6.247 8.557 8.281 1.00 0.83 H new ATOM 0 HD21 LEU A 49 7.592 5.904 8.890 1.00 0.79 H new ATOM 0 HD22 LEU A 49 8.283 7.512 9.213 1.00 0.79 H new ATOM 0 HD23 LEU A 49 8.161 6.316 10.525 1.00 0.79 H new ATOM 752 N VAL A 50 7.068 5.690 13.119 1.00 0.56 N ATOM 753 CA VAL A 50 6.689 4.324 13.504 1.00 0.56 C ATOM 754 C VAL A 50 6.176 4.258 14.950 1.00 0.59 C ATOM 755 O VAL A 50 5.194 3.562 15.206 1.00 0.66 O ATOM 756 CB VAL A 50 7.834 3.329 13.229 1.00 0.57 C ATOM 757 CG1 VAL A 50 7.529 1.922 13.753 1.00 0.59 C ATOM 758 CG2 VAL A 50 8.065 3.194 11.722 1.00 0.61 C ATOM 0 H VAL A 50 8.073 5.850 13.051 1.00 0.56 H new ATOM 0 HA VAL A 50 5.852 4.021 12.875 1.00 0.56 H new ATOM 0 HB VAL A 50 8.709 3.728 13.742 1.00 0.57 H new ATOM 0 HG11 VAL A 50 8.368 1.262 13.533 1.00 0.59 H new ATOM 0 HG12 VAL A 50 7.371 1.961 14.831 1.00 0.59 H new ATOM 0 HG13 VAL A 50 6.630 1.540 13.269 1.00 0.59 H new ATOM 0 HG21 VAL A 50 8.876 2.489 11.540 1.00 0.61 H new ATOM 0 HG22 VAL A 50 7.154 2.831 11.245 1.00 0.61 H new ATOM 0 HG23 VAL A 50 8.329 4.166 11.306 1.00 0.61 H new ATOM 768 N THR A 51 6.754 5.021 15.888 1.00 0.64 N ATOM 769 CA THR A 51 6.210 5.103 17.266 1.00 0.77 C ATOM 770 C THR A 51 4.985 6.015 17.364 1.00 0.77 C ATOM 771 O THR A 51 4.058 5.710 18.113 1.00 0.97 O ATOM 772 CB THR A 51 7.283 5.425 18.327 1.00 0.94 C ATOM 773 OG1 THR A 51 6.765 5.340 19.642 1.00 1.19 O ATOM 774 CG2 THR A 51 7.921 6.803 18.197 1.00 0.86 C ATOM 0 H THR A 51 7.588 5.587 15.729 1.00 0.64 H new ATOM 0 HA THR A 51 5.859 4.099 17.503 1.00 0.77 H new ATOM 0 HB THR A 51 8.047 4.670 18.142 1.00 0.94 H new ATOM 0 HG1 THR A 51 7.473 5.549 20.287 1.00 1.19 H new ATOM 0 HG21 THR A 51 8.661 6.937 18.986 1.00 0.86 H new ATOM 0 HG22 THR A 51 8.407 6.889 17.225 1.00 0.86 H new ATOM 0 HG23 THR A 51 7.152 7.570 18.287 1.00 0.86 H new ATOM 782 N GLN A 52 4.915 7.087 16.568 1.00 0.65 N ATOM 783 CA GLN A 52 3.768 8.003 16.571 1.00 0.68 C ATOM 784 C GLN A 52 2.549 7.477 15.793 1.00 0.73 C ATOM 785 O GLN A 52 1.411 7.749 16.194 1.00 0.98 O ATOM 786 CB GLN A 52 4.211 9.371 16.027 1.00 0.65 C ATOM 787 CG GLN A 52 5.205 10.098 16.948 1.00 0.90 C ATOM 788 CD GLN A 52 4.629 10.429 18.320 1.00 1.56 C ATOM 789 OE1 GLN A 52 4.980 9.842 19.337 1.00 2.39 O ATOM 790 NE2 GLN A 52 3.696 11.345 18.418 1.00 2.85 N ATOM 0 H GLN A 52 5.648 7.344 15.906 1.00 0.65 H new ATOM 0 HA GLN A 52 3.435 8.094 17.605 1.00 0.68 H new ATOM 0 HB2 GLN A 52 4.668 9.234 15.047 1.00 0.65 H new ATOM 0 HB3 GLN A 52 3.332 10.000 15.884 1.00 0.65 H new ATOM 0 HG2 GLN A 52 6.092 9.477 17.075 1.00 0.90 H new ATOM 0 HG3 GLN A 52 5.528 11.021 16.466 1.00 0.90 H new ATOM 0 HE21 GLN A 52 3.386 11.848 17.587 1.00 2.85 H new ATOM 0 HE22 GLN A 52 3.280 11.554 19.326 1.00 2.85 H new ATOM 799 N GLN A 53 2.765 6.741 14.694 1.00 0.57 N ATOM 800 CA GLN A 53 1.711 6.345 13.751 1.00 0.61 C ATOM 801 C GLN A 53 1.614 4.841 13.430 1.00 0.69 C ATOM 802 O GLN A 53 0.677 4.473 12.730 1.00 0.96 O ATOM 803 CB GLN A 53 1.783 7.138 12.432 1.00 0.76 C ATOM 804 CG GLN A 53 2.211 8.612 12.491 1.00 0.88 C ATOM 805 CD GLN A 53 1.552 9.417 11.379 1.00 1.23 C ATOM 806 OE1 GLN A 53 0.568 10.118 11.584 1.00 1.54 O ATOM 807 NE2 GLN A 53 2.011 9.289 10.155 1.00 2.10 N ATOM 0 H GLN A 53 3.690 6.400 14.432 1.00 0.57 H new ATOM 0 HA GLN A 53 0.802 6.593 14.298 1.00 0.61 H new ATOM 0 HB2 GLN A 53 2.474 6.618 11.768 1.00 0.76 H new ATOM 0 HB3 GLN A 53 0.799 7.096 11.965 1.00 0.76 H new ATOM 0 HG2 GLN A 53 1.941 9.034 13.459 1.00 0.88 H new ATOM 0 HG3 GLN A 53 3.295 8.683 12.403 1.00 0.88 H new ATOM 0 HE21 GLN A 53 2.830 8.707 9.975 1.00 2.10 H new ATOM 0 HE22 GLN A 53 1.549 9.771 9.384 1.00 2.10 H new ATOM 816 N LEU A 54 2.504 3.964 13.922 1.00 0.60 N ATOM 817 CA LEU A 54 2.275 2.504 13.915 1.00 0.64 C ATOM 818 C LEU A 54 2.398 1.858 15.324 1.00 0.72 C ATOM 819 O LEU A 54 3.031 0.803 15.444 1.00 0.74 O ATOM 820 CB LEU A 54 3.244 1.828 12.911 1.00 0.60 C ATOM 821 CG LEU A 54 3.168 2.249 11.436 1.00 0.58 C ATOM 822 CD1 LEU A 54 4.241 1.499 10.643 1.00 0.60 C ATOM 823 CD2 LEU A 54 1.826 1.910 10.780 1.00 0.62 C ATOM 0 H LEU A 54 3.396 4.240 14.333 1.00 0.60 H new ATOM 0 HA LEU A 54 1.245 2.340 13.599 1.00 0.64 H new ATOM 0 HB2 LEU A 54 4.262 2.008 13.257 1.00 0.60 H new ATOM 0 HB3 LEU A 54 3.077 0.752 12.960 1.00 0.60 H new ATOM 0 HG LEU A 54 3.306 3.330 11.421 1.00 0.58 H new ATOM 0 HD11 LEU A 54 4.192 1.794 9.595 1.00 0.60 H new ATOM 0 HD12 LEU A 54 5.225 1.742 11.043 1.00 0.60 H new ATOM 0 HD13 LEU A 54 4.071 0.426 10.726 1.00 0.60 H new ATOM 0 HD21 LEU A 54 1.838 2.233 9.739 1.00 0.62 H new ATOM 0 HD22 LEU A 54 1.661 0.833 10.824 1.00 0.62 H new ATOM 0 HD23 LEU A 54 1.022 2.422 11.310 1.00 0.62 H new ATOM 835 N PRO A 55 1.792 2.407 16.403 1.00 0.81 N ATOM 836 CA PRO A 55 1.942 1.847 17.749 1.00 0.92 C ATOM 837 C PRO A 55 1.114 0.575 17.979 1.00 1.00 C ATOM 838 O PRO A 55 1.453 -0.222 18.854 1.00 1.09 O ATOM 839 CB PRO A 55 1.518 2.971 18.699 1.00 1.04 C ATOM 840 CG PRO A 55 0.463 3.725 17.893 1.00 1.04 C ATOM 841 CD PRO A 55 0.999 3.631 16.467 1.00 0.87 C ATOM 0 HA PRO A 55 2.970 1.525 17.915 1.00 0.92 H new ATOM 0 HB2 PRO A 55 1.110 2.579 19.631 1.00 1.04 H new ATOM 0 HB3 PRO A 55 2.358 3.613 18.964 1.00 1.04 H new ATOM 0 HG2 PRO A 55 -0.522 3.267 17.986 1.00 1.04 H new ATOM 0 HG3 PRO A 55 0.366 4.760 18.222 1.00 1.04 H new ATOM 0 HD2 PRO A 55 0.182 3.602 15.746 1.00 0.87 H new ATOM 0 HD3 PRO A 55 1.608 4.501 16.223 1.00 0.87 H new ATOM 849 N HIS A 56 0.026 0.364 17.232 1.00 1.04 N ATOM 850 CA HIS A 56 -0.783 -0.858 17.299 1.00 1.19 C ATOM 851 C HIS A 56 -0.213 -1.942 16.380 1.00 1.22 C ATOM 852 O HIS A 56 -0.202 -3.117 16.750 1.00 1.32 O ATOM 853 CB HIS A 56 -2.245 -0.548 16.949 1.00 1.30 C ATOM 854 CG HIS A 56 -2.777 0.682 17.619 1.00 1.41 C ATOM 855 ND1 HIS A 56 -2.808 1.934 17.062 1.00 1.36 N ATOM 856 CD2 HIS A 56 -3.238 0.788 18.903 1.00 1.66 C ATOM 857 CE1 HIS A 56 -3.272 2.780 17.986 1.00 1.59 C ATOM 858 NE2 HIS A 56 -3.551 2.134 19.134 1.00 1.76 N ATOM 0 H HIS A 56 -0.322 1.044 16.556 1.00 1.04 H new ATOM 0 HA HIS A 56 -0.749 -1.240 18.319 1.00 1.19 H new ATOM 0 HB2 HIS A 56 -2.334 -0.430 15.869 1.00 1.30 H new ATOM 0 HB3 HIS A 56 -2.865 -1.400 17.228 1.00 1.30 H new ATOM 0 HD1 HIS A 56 -2.527 2.176 16.112 1.00 1.36 H new ATOM 0 HD2 HIS A 56 -3.342 -0.021 19.611 1.00 1.66 H new ATOM 0 HE1 HIS A 56 -3.406 3.841 17.833 1.00 1.59 H new ATOM 866 N LEU A 57 0.298 -1.547 15.206 1.00 1.20 N ATOM 867 CA LEU A 57 0.891 -2.459 14.224 1.00 1.20 C ATOM 868 C LEU A 57 2.157 -3.136 14.783 1.00 1.34 C ATOM 869 O LEU A 57 2.288 -4.358 14.671 1.00 1.64 O ATOM 870 CB LEU A 57 1.161 -1.681 12.915 1.00 1.07 C ATOM 871 CG LEU A 57 0.974 -2.450 11.592 1.00 1.08 C ATOM 872 CD1 LEU A 57 1.825 -3.716 11.491 1.00 1.46 C ATOM 873 CD2 LEU A 57 -0.489 -2.824 11.343 1.00 1.41 C ATOM 0 H LEU A 57 0.310 -0.571 14.910 1.00 1.20 H new ATOM 0 HA LEU A 57 0.194 -3.267 14.004 1.00 1.20 H new ATOM 0 HB2 LEU A 57 0.505 -0.811 12.897 1.00 1.07 H new ATOM 0 HB3 LEU A 57 2.185 -1.308 12.948 1.00 1.07 H new ATOM 0 HG LEU A 57 1.312 -1.752 10.826 1.00 1.08 H new ATOM 0 HD11 LEU A 57 1.640 -4.203 10.534 1.00 1.46 H new ATOM 0 HD12 LEU A 57 2.880 -3.452 11.566 1.00 1.46 H new ATOM 0 HD13 LEU A 57 1.563 -4.396 12.301 1.00 1.46 H new ATOM 0 HD21 LEU A 57 -0.571 -3.364 10.400 1.00 1.41 H new ATOM 0 HD22 LEU A 57 -0.846 -3.457 12.156 1.00 1.41 H new ATOM 0 HD23 LEU A 57 -1.093 -1.918 11.296 1.00 1.41 H new ATOM 885 N MET A 58 3.044 -2.380 15.446 1.00 1.31 N ATOM 886 CA MET A 58 4.163 -2.931 16.226 1.00 1.86 C ATOM 887 C MET A 58 4.464 -2.111 17.495 1.00 1.90 C ATOM 888 O MET A 58 4.475 -0.880 17.431 1.00 2.06 O ATOM 889 CB MET A 58 5.430 -3.071 15.363 1.00 2.21 C ATOM 890 CG MET A 58 6.072 -1.753 14.904 1.00 2.11 C ATOM 891 SD MET A 58 7.594 -1.959 13.933 1.00 2.25 S ATOM 892 CE MET A 58 8.682 -2.715 15.175 1.00 3.96 C ATOM 0 H MET A 58 3.005 -1.361 15.456 1.00 1.31 H new ATOM 0 HA MET A 58 3.850 -3.923 16.551 1.00 1.86 H new ATOM 0 HB2 MET A 58 6.171 -3.638 15.927 1.00 2.21 H new ATOM 0 HB3 MET A 58 5.183 -3.660 14.480 1.00 2.21 H new ATOM 0 HG2 MET A 58 5.347 -1.198 14.308 1.00 2.11 H new ATOM 0 HG3 MET A 58 6.295 -1.146 15.782 1.00 2.11 H new ATOM 0 HE1 MET A 58 9.709 -2.710 14.810 1.00 3.96 H new ATOM 0 HE2 MET A 58 8.624 -2.147 16.104 1.00 3.96 H new ATOM 0 HE3 MET A 58 8.367 -3.742 15.358 1.00 3.96 H new ATOM 902 N PRO A 59 4.769 -2.744 18.643 1.00 1.96 N ATOM 903 CA PRO A 59 5.252 -2.035 19.822 1.00 1.95 C ATOM 904 C PRO A 59 6.733 -1.658 19.719 1.00 1.61 C ATOM 905 O PRO A 59 7.553 -2.365 19.129 1.00 1.61 O ATOM 906 CB PRO A 59 5.015 -2.982 20.998 1.00 2.41 C ATOM 907 CG PRO A 59 5.119 -4.368 20.360 1.00 2.53 C ATOM 908 CD PRO A 59 4.631 -4.167 18.925 1.00 2.30 C ATOM 0 HA PRO A 59 4.723 -1.089 19.939 1.00 1.95 H new ATOM 0 HB2 PRO A 59 5.759 -2.843 21.782 1.00 2.41 H new ATOM 0 HB3 PRO A 59 4.038 -2.821 21.453 1.00 2.41 H new ATOM 0 HG2 PRO A 59 6.144 -4.739 20.382 1.00 2.53 H new ATOM 0 HG3 PRO A 59 4.505 -5.096 20.890 1.00 2.53 H new ATOM 0 HD2 PRO A 59 5.221 -4.761 18.227 1.00 2.30 H new ATOM 0 HD3 PRO A 59 3.594 -4.486 18.818 1.00 2.30 H new ATOM 916 N SER A 60 7.103 -0.603 20.443 1.00 1.67 N ATOM 917 CA SER A 60 8.496 -0.253 20.751 1.00 1.61 C ATOM 918 C SER A 60 9.243 -1.363 21.505 1.00 1.82 C ATOM 919 O SER A 60 10.474 -1.415 21.458 1.00 1.83 O ATOM 920 CB SER A 60 8.489 1.001 21.618 1.00 1.98 C ATOM 921 OG SER A 60 8.125 2.119 20.834 1.00 2.27 O ATOM 0 H SER A 60 6.429 0.050 20.843 1.00 1.67 H new ATOM 0 HA SER A 60 9.015 -0.099 19.805 1.00 1.61 H new ATOM 0 HB2 SER A 60 7.788 0.880 22.444 1.00 1.98 H new ATOM 0 HB3 SER A 60 9.475 1.157 22.057 1.00 1.98 H new ATOM 0 HG SER A 60 8.120 2.923 21.394 1.00 2.27 H new ATOM 959 N LEU A 64 12.065 -0.825 17.462 1.00 1.87 N ATOM 960 CA LEU A 64 11.682 -0.384 16.111 1.00 1.49 C ATOM 961 C LEU A 64 12.874 -0.126 15.174 1.00 1.25 C ATOM 962 O LEU A 64 12.702 -0.083 13.959 1.00 1.36 O ATOM 963 CB LEU A 64 10.653 0.762 16.167 1.00 1.28 C ATOM 964 CG LEU A 64 10.914 1.930 17.134 1.00 0.97 C ATOM 965 CD1 LEU A 64 12.263 2.606 16.922 1.00 1.07 C ATOM 966 CD2 LEU A 64 9.824 2.977 16.928 1.00 1.26 C ATOM 0 HA LEU A 64 11.177 -1.225 15.637 1.00 1.49 H new ATOM 0 HB2 LEU A 64 10.561 1.176 15.163 1.00 1.28 H new ATOM 0 HB3 LEU A 64 9.686 0.328 16.423 1.00 1.28 H new ATOM 0 HG LEU A 64 10.913 1.516 18.142 1.00 0.97 H new ATOM 0 HD11 LEU A 64 12.379 3.420 17.638 1.00 1.07 H new ATOM 0 HD12 LEU A 64 13.061 1.878 17.067 1.00 1.07 H new ATOM 0 HD13 LEU A 64 12.315 3.004 15.909 1.00 1.07 H new ATOM 0 HD21 LEU A 64 9.991 3.814 17.605 1.00 1.26 H new ATOM 0 HD22 LEU A 64 9.851 3.332 15.898 1.00 1.26 H new ATOM 0 HD23 LEU A 64 8.850 2.533 17.133 1.00 1.26 H new ATOM 978 N GLU A 65 14.097 -0.055 15.698 1.00 1.12 N ATOM 979 CA GLU A 65 15.330 -0.072 14.911 1.00 1.01 C ATOM 980 C GLU A 65 15.547 -1.340 14.069 1.00 1.07 C ATOM 981 O GLU A 65 16.318 -1.296 13.106 1.00 1.07 O ATOM 982 CB GLU A 65 16.539 0.339 15.755 1.00 1.03 C ATOM 983 CG GLU A 65 17.055 -0.642 16.813 1.00 1.26 C ATOM 984 CD GLU A 65 16.077 -0.981 17.949 1.00 2.06 C ATOM 985 OE1 GLU A 65 15.207 -0.139 18.282 1.00 3.47 O ATOM 986 OE2 GLU A 65 16.188 -2.078 18.552 1.00 2.95 O ATOM 0 H GLU A 65 14.262 0.017 16.702 1.00 1.12 H new ATOM 0 HA GLU A 65 15.206 0.696 14.147 1.00 1.01 H new ATOM 0 HB2 GLU A 65 17.362 0.556 15.074 1.00 1.03 H new ATOM 0 HB3 GLU A 65 16.290 1.272 16.260 1.00 1.03 H new ATOM 0 HG2 GLU A 65 17.337 -1.569 16.314 1.00 1.26 H new ATOM 0 HG3 GLU A 65 17.962 -0.228 17.253 1.00 1.26 H new ATOM 993 N GLU A 66 14.809 -2.428 14.335 1.00 1.17 N ATOM 994 CA GLU A 66 14.724 -3.583 13.434 1.00 1.26 C ATOM 995 C GLU A 66 14.237 -3.167 12.031 1.00 1.27 C ATOM 996 O GLU A 66 14.617 -3.753 11.018 1.00 1.36 O ATOM 997 CB GLU A 66 13.814 -4.675 14.052 1.00 1.39 C ATOM 998 CG GLU A 66 12.301 -4.404 13.937 1.00 2.57 C ATOM 999 CD GLU A 66 11.385 -5.533 14.435 1.00 2.95 C ATOM 1000 OE1 GLU A 66 11.846 -6.554 14.999 1.00 3.05 O ATOM 1001 OE2 GLU A 66 10.167 -5.448 14.155 1.00 3.88 O ATOM 0 H GLU A 66 14.253 -2.530 15.184 1.00 1.17 H new ATOM 0 HA GLU A 66 15.724 -4.000 13.312 1.00 1.26 H new ATOM 0 HB2 GLU A 66 14.035 -5.627 13.569 1.00 1.39 H new ATOM 0 HB3 GLU A 66 14.069 -4.785 15.106 1.00 1.39 H new ATOM 0 HG2 GLU A 66 12.069 -3.498 14.497 1.00 2.57 H new ATOM 0 HG3 GLU A 66 12.064 -4.202 12.892 1.00 2.57 H new ATOM 1008 N LYS A 67 13.406 -2.120 11.951 1.00 1.23 N ATOM 1009 CA LYS A 67 12.774 -1.657 10.712 1.00 1.34 C ATOM 1010 C LYS A 67 13.698 -0.774 9.877 1.00 1.33 C ATOM 1011 O LYS A 67 13.711 -0.898 8.654 1.00 1.51 O ATOM 1012 CB LYS A 67 11.417 -1.023 11.068 1.00 1.45 C ATOM 1013 CG LYS A 67 10.401 -2.021 11.623 1.00 1.47 C ATOM 1014 CD LYS A 67 10.136 -3.172 10.640 1.00 1.54 C ATOM 1015 CE LYS A 67 8.769 -3.770 10.933 1.00 1.70 C ATOM 1016 NZ LYS A 67 8.820 -4.944 11.839 1.00 2.25 N ATOM 0 H LYS A 67 13.150 -1.560 12.764 1.00 1.23 H new ATOM 0 HA LYS A 67 12.580 -2.501 10.050 1.00 1.34 H new ATOM 0 HB2 LYS A 67 11.576 -0.233 11.802 1.00 1.45 H new ATOM 0 HB3 LYS A 67 11.001 -0.551 10.178 1.00 1.45 H new ATOM 0 HG2 LYS A 67 10.767 -2.426 12.566 1.00 1.47 H new ATOM 0 HG3 LYS A 67 9.466 -1.505 11.839 1.00 1.47 H new ATOM 0 HD2 LYS A 67 10.175 -2.807 9.614 1.00 1.54 H new ATOM 0 HD3 LYS A 67 10.909 -3.935 10.736 1.00 1.54 H new ATOM 0 HE2 LYS A 67 8.134 -3.004 11.378 1.00 1.70 H new ATOM 0 HE3 LYS A 67 8.301 -4.065 9.994 1.00 1.70 H new ATOM 0 HZ1 LYS A 67 7.869 -5.136 12.213 1.00 2.25 H new ATOM 0 HZ2 LYS A 67 9.159 -5.774 11.312 1.00 2.25 H new ATOM 0 HZ3 LYS A 67 9.468 -4.746 12.628 1.00 2.25 H new ATOM 1030 N ILE A 68 14.572 -0.003 10.519 1.00 1.19 N ATOM 1031 CA ILE A 68 15.688 0.682 9.851 1.00 1.21 C ATOM 1032 C ILE A 68 16.708 -0.357 9.356 1.00 1.30 C ATOM 1033 O ILE A 68 17.108 -0.318 8.191 1.00 1.54 O ATOM 1034 CB ILE A 68 16.294 1.760 10.775 1.00 1.09 C ATOM 1035 CG1 ILE A 68 15.247 2.855 11.107 1.00 1.11 C ATOM 1036 CG2 ILE A 68 17.506 2.453 10.141 1.00 1.29 C ATOM 1037 CD1 ILE A 68 14.537 2.563 12.431 1.00 1.05 C ATOM 0 H ILE A 68 14.530 0.168 11.524 1.00 1.19 H new ATOM 0 HA ILE A 68 15.331 1.216 8.970 1.00 1.21 H new ATOM 0 HB ILE A 68 16.608 1.239 11.679 1.00 1.09 H new ATOM 0 HG12 ILE A 68 15.739 3.826 11.162 1.00 1.11 H new ATOM 0 HG13 ILE A 68 14.513 2.914 10.304 1.00 1.11 H new ATOM 0 HG21 ILE A 68 17.897 3.203 10.829 1.00 1.29 H new ATOM 0 HG22 ILE A 68 18.279 1.714 9.932 1.00 1.29 H new ATOM 0 HG23 ILE A 68 17.204 2.936 9.211 1.00 1.29 H new ATOM 0 HD11 ILE A 68 13.810 3.349 12.635 1.00 1.05 H new ATOM 0 HD12 ILE A 68 14.025 1.603 12.365 1.00 1.05 H new ATOM 0 HD13 ILE A 68 15.270 2.529 13.237 1.00 1.05 H new ATOM 1049 N ALA A 69 17.010 -1.376 10.169 1.00 1.23 N ATOM 1050 CA ALA A 69 17.880 -2.489 9.783 1.00 1.37 C ATOM 1051 C ALA A 69 17.338 -3.336 8.606 1.00 1.57 C ATOM 1052 O ALA A 69 18.113 -4.015 7.931 1.00 1.76 O ATOM 1053 CB ALA A 69 18.150 -3.330 11.036 1.00 1.31 C ATOM 0 H ALA A 69 16.653 -1.450 11.122 1.00 1.23 H new ATOM 0 HA ALA A 69 18.813 -2.081 9.394 1.00 1.37 H new ATOM 0 HB1 ALA A 69 18.797 -4.169 10.779 1.00 1.31 H new ATOM 0 HB2 ALA A 69 18.638 -2.713 11.790 1.00 1.31 H new ATOM 0 HB3 ALA A 69 17.207 -3.707 11.431 1.00 1.31 H new ATOM 1059 N ASN A 70 16.035 -3.272 8.295 1.00 1.59 N ATOM 1060 CA ASN A 70 15.465 -3.876 7.083 1.00 1.78 C ATOM 1061 C ASN A 70 15.675 -3.020 5.816 1.00 1.78 C ATOM 1062 O ASN A 70 15.893 -3.590 4.746 1.00 1.96 O ATOM 1063 CB ASN A 70 13.977 -4.200 7.305 1.00 1.87 C ATOM 1064 CG ASN A 70 13.759 -5.576 7.905 1.00 2.06 C ATOM 1065 OD1 ASN A 70 13.501 -6.542 7.204 1.00 2.85 O ATOM 1066 ND2 ASN A 70 13.853 -5.724 9.199 1.00 1.87 N ATOM 0 H ASN A 70 15.346 -2.799 8.879 1.00 1.59 H new ATOM 0 HA ASN A 70 16.009 -4.803 6.901 1.00 1.78 H new ATOM 0 HB2 ASN A 70 13.540 -3.448 7.963 1.00 1.87 H new ATOM 0 HB3 ASN A 70 13.450 -4.136 6.353 1.00 1.87 H new ATOM 0 HD21 ASN A 70 13.711 -6.643 9.619 1.00 1.87 H new ATOM 0 HD22 ASN A 70 14.068 -4.921 9.790 1.00 1.87 H new ATOM 1073 N LEU A 71 15.652 -1.681 5.902 1.00 1.61 N ATOM 1074 CA LEU A 71 15.891 -0.799 4.742 1.00 1.54 C ATOM 1075 C LEU A 71 17.374 -0.462 4.491 1.00 1.61 C ATOM 1076 O LEU A 71 17.729 -0.042 3.385 1.00 1.74 O ATOM 1077 CB LEU A 71 14.957 0.415 4.758 1.00 1.53 C ATOM 1078 CG LEU A 71 15.032 1.364 5.963 1.00 1.59 C ATOM 1079 CD1 LEU A 71 16.316 2.194 6.028 1.00 1.57 C ATOM 1080 CD2 LEU A 71 13.856 2.322 5.835 1.00 1.98 C ATOM 0 H LEU A 71 15.469 -1.179 6.771 1.00 1.61 H new ATOM 0 HA LEU A 71 15.625 -1.377 3.857 1.00 1.54 H new ATOM 0 HB2 LEU A 71 15.153 1.000 3.859 1.00 1.53 H new ATOM 0 HB3 LEU A 71 13.933 0.050 4.683 1.00 1.53 H new ATOM 0 HG LEU A 71 15.013 0.757 6.868 1.00 1.59 H new ATOM 0 HD11 LEU A 71 16.289 2.837 6.908 1.00 1.57 H new ATOM 0 HD12 LEU A 71 17.177 1.528 6.091 1.00 1.57 H new ATOM 0 HD13 LEU A 71 16.398 2.809 5.131 1.00 1.57 H new ATOM 0 HD21 LEU A 71 13.863 3.021 6.671 1.00 1.98 H new ATOM 0 HD22 LEU A 71 13.937 2.875 4.899 1.00 1.98 H new ATOM 0 HD23 LEU A 71 12.924 1.757 5.843 1.00 1.98 H new ATOM 1180 N LEU A 79 16.600 6.211 0.062 1.00 1.58 N ATOM 1181 CA LEU A 79 15.265 5.984 0.619 1.00 1.49 C ATOM 1182 C LEU A 79 14.179 6.745 -0.169 1.00 1.66 C ATOM 1183 O LEU A 79 13.500 7.617 0.373 1.00 2.86 O ATOM 1184 CB LEU A 79 15.244 6.353 2.117 1.00 1.43 C ATOM 1185 CG LEU A 79 16.048 5.446 3.063 1.00 1.54 C ATOM 1186 CD1 LEU A 79 17.554 5.724 3.065 1.00 2.13 C ATOM 1187 CD2 LEU A 79 15.543 5.637 4.497 1.00 2.51 C ATOM 0 HA LEU A 79 15.033 4.923 0.524 1.00 1.49 H new ATOM 0 HB2 LEU A 79 15.619 7.371 2.222 1.00 1.43 H new ATOM 0 HB3 LEU A 79 14.207 6.359 2.451 1.00 1.43 H new ATOM 0 HG LEU A 79 15.900 4.430 2.698 1.00 1.54 H new ATOM 0 HD11 LEU A 79 18.049 5.043 3.757 1.00 2.13 H new ATOM 0 HD12 LEU A 79 17.953 5.575 2.062 1.00 2.13 H new ATOM 0 HD13 LEU A 79 17.734 6.753 3.377 1.00 2.13 H new ATOM 0 HD21 LEU A 79 16.111 4.995 5.171 1.00 2.51 H new ATOM 0 HD22 LEU A 79 15.672 6.678 4.793 1.00 2.51 H new ATOM 0 HD23 LEU A 79 14.487 5.373 4.549 1.00 2.51 H new ATOM 1199 N GLU A 80 14.030 6.444 -1.458 1.00 0.96 N ATOM 1200 CA GLU A 80 12.922 6.949 -2.288 1.00 1.01 C ATOM 1201 C GLU A 80 11.578 6.287 -1.901 1.00 0.74 C ATOM 1202 O GLU A 80 11.554 5.368 -1.079 1.00 0.69 O ATOM 1203 CB GLU A 80 13.272 6.763 -3.775 1.00 1.42 C ATOM 1204 CG GLU A 80 14.498 7.596 -4.174 1.00 2.00 C ATOM 1205 CD GLU A 80 14.608 7.756 -5.694 1.00 2.84 C ATOM 1206 OE1 GLU A 80 14.900 6.755 -6.394 1.00 3.00 O ATOM 1207 OE2 GLU A 80 14.422 8.889 -6.193 1.00 4.13 O ATOM 0 H GLU A 80 14.676 5.839 -1.965 1.00 0.96 H new ATOM 0 HA GLU A 80 12.790 8.015 -2.105 1.00 1.01 H new ATOM 0 HB2 GLU A 80 13.466 5.709 -3.975 1.00 1.42 H new ATOM 0 HB3 GLU A 80 12.419 7.052 -4.389 1.00 1.42 H new ATOM 0 HG2 GLU A 80 14.436 8.580 -3.709 1.00 2.00 H new ATOM 0 HG3 GLU A 80 15.401 7.119 -3.793 1.00 2.00 H new ATOM 1214 N PHE A 81 10.442 6.728 -2.459 1.00 0.82 N ATOM 1215 CA PHE A 81 9.114 6.244 -2.042 1.00 0.86 C ATOM 1216 C PHE A 81 8.983 4.709 -2.058 1.00 0.84 C ATOM 1217 O PHE A 81 8.449 4.140 -1.104 1.00 0.91 O ATOM 1218 CB PHE A 81 8.010 6.890 -2.894 1.00 1.21 C ATOM 1219 CG PHE A 81 6.636 6.306 -2.613 1.00 1.60 C ATOM 1220 CD1 PHE A 81 5.995 6.561 -1.385 1.00 2.55 C ATOM 1221 CD2 PHE A 81 6.043 5.428 -3.542 1.00 2.60 C ATOM 1222 CE1 PHE A 81 4.782 5.916 -1.077 1.00 3.09 C ATOM 1223 CE2 PHE A 81 4.816 4.809 -3.245 1.00 3.09 C ATOM 1224 CZ PHE A 81 4.184 5.056 -2.014 1.00 2.90 C ATOM 0 H PHE A 81 10.414 7.423 -3.205 1.00 0.82 H new ATOM 0 HA PHE A 81 8.994 6.548 -1.002 1.00 0.86 H new ATOM 0 HB2 PHE A 81 7.990 7.963 -2.703 1.00 1.21 H new ATOM 0 HB3 PHE A 81 8.247 6.758 -3.950 1.00 1.21 H new ATOM 0 HD1 PHE A 81 6.434 7.251 -0.680 1.00 2.55 H new ATOM 0 HD2 PHE A 81 6.532 5.230 -4.484 1.00 2.60 H new ATOM 0 HE1 PHE A 81 4.311 6.082 -0.120 1.00 3.09 H new ATOM 0 HE2 PHE A 81 4.359 4.144 -3.963 1.00 3.09 H new ATOM 0 HZ PHE A 81 3.239 4.585 -1.788 1.00 2.90 H new ATOM 1234 N ARG A 82 9.530 4.009 -3.066 1.00 0.87 N ATOM 1235 CA ARG A 82 9.457 2.537 -3.107 1.00 0.99 C ATOM 1236 C ARG A 82 10.242 1.855 -1.963 1.00 0.98 C ATOM 1237 O ARG A 82 9.857 0.771 -1.532 1.00 1.16 O ATOM 1238 CB ARG A 82 9.791 1.977 -4.497 1.00 1.19 C ATOM 1239 CG ARG A 82 9.013 0.663 -4.708 1.00 2.17 C ATOM 1240 CD ARG A 82 9.569 -0.107 -5.898 1.00 2.48 C ATOM 1241 NE ARG A 82 10.765 -0.872 -5.507 1.00 2.94 N ATOM 1242 CZ ARG A 82 11.764 -1.254 -6.272 1.00 3.55 C ATOM 1243 NH1 ARG A 82 11.827 -0.989 -7.541 1.00 4.11 N ATOM 1244 NH2 ARG A 82 12.735 -1.935 -5.748 1.00 4.50 N ATOM 0 H ARG A 82 10.022 4.431 -3.854 1.00 0.87 H new ATOM 0 HA ARG A 82 8.415 2.278 -2.922 1.00 0.99 H new ATOM 0 HB2 ARG A 82 9.525 2.700 -5.268 1.00 1.19 H new ATOM 0 HB3 ARG A 82 10.863 1.798 -4.583 1.00 1.19 H new ATOM 0 HG2 ARG A 82 9.076 0.049 -3.810 1.00 2.17 H new ATOM 0 HG3 ARG A 82 7.958 0.882 -4.871 1.00 2.17 H new ATOM 0 HD2 ARG A 82 8.809 -0.784 -6.287 1.00 2.48 H new ATOM 0 HD3 ARG A 82 9.820 0.586 -6.701 1.00 2.48 H new ATOM 0 HE ARG A 82 10.826 -1.138 -4.524 1.00 2.94 H new ATOM 0 HH11 ARG A 82 11.078 -0.461 -7.989 1.00 4.11 H new ATOM 0 HH12 ARG A 82 12.625 -1.309 -8.090 1.00 4.11 H new ATOM 0 HH21 ARG A 82 12.717 -2.167 -4.755 1.00 4.50 H new ATOM 0 HH22 ARG A 82 13.517 -2.238 -6.329 1.00 4.50 H new ATOM 1258 N SER A 83 11.260 2.505 -1.387 1.00 0.88 N ATOM 1259 CA SER A 83 11.976 2.012 -0.192 1.00 0.96 C ATOM 1260 C SER A 83 11.079 2.020 1.058 1.00 0.83 C ATOM 1261 O SER A 83 11.036 1.028 1.787 1.00 0.86 O ATOM 1262 CB SER A 83 13.244 2.850 0.034 1.00 1.07 C ATOM 1263 OG SER A 83 13.935 2.489 1.213 1.00 2.52 O ATOM 0 H SER A 83 11.617 3.395 -1.735 1.00 0.88 H new ATOM 0 HA SER A 83 12.260 0.975 -0.369 1.00 0.96 H new ATOM 0 HB2 SER A 83 13.909 2.733 -0.822 1.00 1.07 H new ATOM 0 HB3 SER A 83 12.973 3.905 0.085 1.00 1.07 H new ATOM 0 HG SER A 83 14.863 2.799 1.156 1.00 2.52 H new ATOM 1269 N PHE A 84 10.295 3.092 1.255 1.00 0.74 N ATOM 1270 CA PHE A 84 9.251 3.190 2.292 1.00 0.67 C ATOM 1271 C PHE A 84 8.121 2.174 2.042 1.00 0.65 C ATOM 1272 O PHE A 84 7.724 1.439 2.945 1.00 0.65 O ATOM 1273 CB PHE A 84 8.710 4.624 2.298 1.00 0.66 C ATOM 1274 CG PHE A 84 7.629 4.938 3.321 1.00 0.60 C ATOM 1275 CD1 PHE A 84 7.991 5.436 4.588 1.00 2.17 C ATOM 1276 CD2 PHE A 84 6.265 4.851 2.975 1.00 1.82 C ATOM 1277 CE1 PHE A 84 7.006 5.887 5.485 1.00 2.12 C ATOM 1278 CE2 PHE A 84 5.279 5.307 3.870 1.00 1.87 C ATOM 1279 CZ PHE A 84 5.649 5.831 5.120 1.00 0.60 C ATOM 0 H PHE A 84 10.370 3.935 0.685 1.00 0.74 H new ATOM 0 HA PHE A 84 9.679 2.953 3.266 1.00 0.67 H new ATOM 0 HB2 PHE A 84 9.546 5.303 2.466 1.00 0.66 H new ATOM 0 HB3 PHE A 84 8.315 4.844 1.306 1.00 0.66 H new ATOM 0 HD1 PHE A 84 9.032 5.472 4.873 1.00 2.17 H new ATOM 0 HD2 PHE A 84 5.976 4.434 2.022 1.00 1.82 H new ATOM 0 HE1 PHE A 84 7.291 6.275 6.452 1.00 2.12 H new ATOM 0 HE2 PHE A 84 4.236 5.254 3.595 1.00 1.87 H new ATOM 0 HZ PHE A 84 4.891 6.191 5.800 1.00 0.60 H new ATOM 1289 N TRP A 85 7.638 2.098 0.796 1.00 0.66 N ATOM 1290 CA TRP A 85 6.567 1.197 0.354 1.00 0.66 C ATOM 1291 C TRP A 85 6.891 -0.284 0.601 1.00 0.70 C ATOM 1292 O TRP A 85 6.051 -1.017 1.113 1.00 0.75 O ATOM 1293 CB TRP A 85 6.324 1.458 -1.134 1.00 0.73 C ATOM 1294 CG TRP A 85 5.204 0.694 -1.756 1.00 0.74 C ATOM 1295 CD1 TRP A 85 5.345 -0.427 -2.497 1.00 0.84 C ATOM 1296 CD2 TRP A 85 3.768 0.948 -1.676 1.00 0.69 C ATOM 1297 NE1 TRP A 85 4.104 -0.858 -2.916 1.00 0.87 N ATOM 1298 CE2 TRP A 85 3.093 -0.068 -2.415 1.00 0.79 C ATOM 1299 CE3 TRP A 85 2.967 1.917 -1.034 1.00 0.64 C ATOM 1300 CZ2 TRP A 85 1.696 -0.142 -2.487 1.00 0.88 C ATOM 1301 CZ3 TRP A 85 1.562 1.855 -1.105 1.00 0.69 C ATOM 1302 CH2 TRP A 85 0.930 0.818 -1.805 1.00 0.83 C ATOM 0 H TRP A 85 7.995 2.683 0.041 1.00 0.66 H new ATOM 0 HA TRP A 85 5.671 1.403 0.939 1.00 0.66 H new ATOM 0 HB2 TRP A 85 6.131 2.522 -1.269 1.00 0.73 H new ATOM 0 HB3 TRP A 85 7.240 1.228 -1.678 1.00 0.73 H new ATOM 0 HD1 TRP A 85 6.283 -0.910 -2.726 1.00 0.84 H new ATOM 0 HE1 TRP A 85 3.953 -1.664 -3.523 1.00 0.87 H new ATOM 0 HE3 TRP A 85 3.438 2.716 -0.481 1.00 0.64 H new ATOM 0 HZ2 TRP A 85 1.216 -0.924 -3.057 1.00 0.88 H new ATOM 0 HZ3 TRP A 85 0.967 2.612 -0.616 1.00 0.69 H new ATOM 0 HH2 TRP A 85 -0.148 0.757 -1.820 1.00 0.83 H new ATOM 1313 N GLU A 86 8.127 -0.719 0.345 1.00 0.73 N ATOM 1314 CA GLU A 86 8.587 -2.084 0.649 1.00 0.77 C ATOM 1315 C GLU A 86 8.482 -2.447 2.142 1.00 0.73 C ATOM 1316 O GLU A 86 8.293 -3.620 2.474 1.00 0.78 O ATOM 1317 CB GLU A 86 10.039 -2.239 0.175 1.00 0.83 C ATOM 1318 CG GLU A 86 10.125 -2.486 -1.336 1.00 0.96 C ATOM 1319 CD GLU A 86 11.554 -2.368 -1.884 1.00 2.33 C ATOM 1320 OE1 GLU A 86 12.536 -2.630 -1.141 1.00 3.77 O ATOM 1321 OE2 GLU A 86 11.694 -2.058 -3.093 1.00 3.25 O ATOM 0 H GLU A 86 8.845 -0.133 -0.082 1.00 0.73 H new ATOM 0 HA GLU A 86 7.928 -2.772 0.120 1.00 0.77 H new ATOM 0 HB2 GLU A 86 10.601 -1.340 0.428 1.00 0.83 H new ATOM 0 HB3 GLU A 86 10.507 -3.068 0.705 1.00 0.83 H new ATOM 0 HG2 GLU A 86 9.738 -3.480 -1.558 1.00 0.96 H new ATOM 0 HG3 GLU A 86 9.484 -1.771 -1.852 1.00 0.96 H new ATOM 1328 N LEU A 87 8.537 -1.460 3.047 1.00 0.67 N ATOM 1329 CA LEU A 87 8.296 -1.667 4.478 1.00 0.62 C ATOM 1330 C LEU A 87 6.809 -1.660 4.858 1.00 0.52 C ATOM 1331 O LEU A 87 6.427 -2.297 5.838 1.00 0.56 O ATOM 1332 CB LEU A 87 9.088 -0.649 5.315 1.00 0.75 C ATOM 1333 CG LEU A 87 10.083 -1.372 6.236 1.00 1.24 C ATOM 1334 CD1 LEU A 87 11.343 -1.776 5.469 1.00 1.60 C ATOM 1335 CD2 LEU A 87 10.462 -0.476 7.405 1.00 1.60 C ATOM 0 H LEU A 87 8.751 -0.493 2.804 1.00 0.67 H new ATOM 0 HA LEU A 87 8.655 -2.670 4.707 1.00 0.62 H new ATOM 0 HB2 LEU A 87 9.623 0.035 4.656 1.00 0.75 H new ATOM 0 HB3 LEU A 87 8.402 -0.047 5.911 1.00 0.75 H new ATOM 0 HG LEU A 87 9.601 -2.274 6.613 1.00 1.24 H new ATOM 0 HD11 LEU A 87 12.031 -2.286 6.143 1.00 1.60 H new ATOM 0 HD12 LEU A 87 11.073 -2.445 4.652 1.00 1.60 H new ATOM 0 HD13 LEU A 87 11.824 -0.885 5.065 1.00 1.60 H new ATOM 0 HD21 LEU A 87 11.167 -0.999 8.051 1.00 1.60 H new ATOM 0 HD22 LEU A 87 10.923 0.437 7.029 1.00 1.60 H new ATOM 0 HD23 LEU A 87 9.568 -0.223 7.975 1.00 1.60 H new ATOM 1347 N ILE A 88 5.946 -1.028 4.061 1.00 0.48 N ATOM 1348 CA ILE A 88 4.500 -1.286 4.129 1.00 0.44 C ATOM 1349 C ILE A 88 4.220 -2.731 3.671 1.00 0.52 C ATOM 1350 O ILE A 88 3.399 -3.422 4.270 1.00 0.53 O ATOM 1351 CB ILE A 88 3.698 -0.251 3.311 1.00 0.46 C ATOM 1352 CG1 ILE A 88 4.090 1.211 3.624 1.00 0.48 C ATOM 1353 CG2 ILE A 88 2.207 -0.430 3.627 1.00 0.49 C ATOM 1354 CD1 ILE A 88 3.405 2.231 2.716 1.00 0.56 C ATOM 0 H ILE A 88 6.218 -0.336 3.363 1.00 0.48 H new ATOM 0 HA ILE A 88 4.166 -1.178 5.161 1.00 0.44 H new ATOM 0 HB ILE A 88 3.921 -0.429 2.259 1.00 0.46 H new ATOM 0 HG12 ILE A 88 3.839 1.433 4.661 1.00 0.48 H new ATOM 0 HG13 ILE A 88 5.170 1.318 3.528 1.00 0.48 H new ATOM 0 HG21 ILE A 88 1.625 0.294 3.057 1.00 0.49 H new ATOM 0 HG22 ILE A 88 1.896 -1.439 3.356 1.00 0.49 H new ATOM 0 HG23 ILE A 88 2.039 -0.272 4.692 1.00 0.49 H new ATOM 0 HD11 ILE A 88 3.725 3.236 2.991 1.00 0.56 H new ATOM 0 HD12 ILE A 88 3.676 2.035 1.679 1.00 0.56 H new ATOM 0 HD13 ILE A 88 2.324 2.151 2.830 1.00 0.56 H new ATOM 1366 N GLY A 89 4.994 -3.237 2.705 1.00 0.63 N ATOM 1367 CA GLY A 89 5.039 -4.656 2.334 1.00 0.79 C ATOM 1368 C GLY A 89 5.453 -5.601 3.478 1.00 0.82 C ATOM 1369 O GLY A 89 5.024 -6.756 3.482 1.00 0.98 O ATOM 0 H GLY A 89 5.621 -2.658 2.146 1.00 0.63 H new ATOM 0 HA2 GLY A 89 4.056 -4.955 1.970 1.00 0.79 H new ATOM 0 HA3 GLY A 89 5.737 -4.780 1.506 1.00 0.79 H new ATOM 1373 N GLU A 90 6.216 -5.120 4.469 1.00 0.73 N ATOM 1374 CA GLU A 90 6.591 -5.826 5.702 1.00 0.78 C ATOM 1375 C GLU A 90 5.512 -5.690 6.802 1.00 0.70 C ATOM 1376 O GLU A 90 5.235 -6.666 7.504 1.00 0.77 O ATOM 1377 CB GLU A 90 7.976 -5.294 6.122 1.00 0.86 C ATOM 1378 CG GLU A 90 8.557 -5.822 7.436 1.00 1.21 C ATOM 1379 CD GLU A 90 8.996 -7.294 7.410 1.00 1.32 C ATOM 1380 OE1 GLU A 90 9.543 -7.752 6.377 1.00 2.34 O ATOM 1381 OE2 GLU A 90 8.835 -7.968 8.460 1.00 2.54 O ATOM 0 H GLU A 90 6.609 -4.179 4.430 1.00 0.73 H new ATOM 0 HA GLU A 90 6.655 -6.901 5.532 1.00 0.78 H new ATOM 0 HB2 GLU A 90 8.682 -5.523 5.324 1.00 0.86 H new ATOM 0 HB3 GLU A 90 7.914 -4.208 6.192 1.00 0.86 H new ATOM 0 HG2 GLU A 90 9.415 -5.208 7.708 1.00 1.21 H new ATOM 0 HG3 GLU A 90 7.812 -5.695 8.222 1.00 1.21 H new ATOM 1388 N ALA A 91 4.827 -4.540 6.912 1.00 0.60 N ATOM 1389 CA ALA A 91 3.584 -4.417 7.697 1.00 0.55 C ATOM 1390 C ALA A 91 2.482 -5.380 7.194 1.00 0.59 C ATOM 1391 O ALA A 91 1.807 -6.026 7.995 1.00 0.64 O ATOM 1392 CB ALA A 91 3.099 -2.954 7.682 1.00 0.51 C ATOM 0 H ALA A 91 5.116 -3.672 6.462 1.00 0.60 H new ATOM 0 HA ALA A 91 3.802 -4.706 8.725 1.00 0.55 H new ATOM 0 HB1 ALA A 91 2.181 -2.869 8.263 1.00 0.51 H new ATOM 0 HB2 ALA A 91 3.865 -2.312 8.118 1.00 0.51 H new ATOM 0 HB3 ALA A 91 2.908 -2.645 6.654 1.00 0.51 H new ATOM 1398 N ALA A 92 2.374 -5.566 5.875 1.00 0.66 N ATOM 1399 CA ALA A 92 1.521 -6.556 5.206 1.00 0.89 C ATOM 1400 C ALA A 92 1.945 -8.030 5.420 1.00 1.06 C ATOM 1401 O ALA A 92 1.326 -8.940 4.862 1.00 1.55 O ATOM 1402 CB ALA A 92 1.402 -6.185 3.725 1.00 0.99 C ATOM 0 H ALA A 92 2.905 -5.003 5.211 1.00 0.66 H new ATOM 0 HA ALA A 92 0.539 -6.512 5.677 1.00 0.89 H new ATOM 0 HB1 ALA A 92 0.770 -6.914 3.217 1.00 0.99 H new ATOM 0 HB2 ALA A 92 0.959 -5.194 3.633 1.00 0.99 H new ATOM 0 HB3 ALA A 92 2.392 -6.183 3.270 1.00 0.99 H new ATOM 1408 N LYS A 93 3.025 -8.293 6.175 1.00 0.91 N ATOM 1409 CA LYS A 93 3.299 -9.622 6.753 1.00 0.98 C ATOM 1410 C LYS A 93 2.718 -9.757 8.172 1.00 0.96 C ATOM 1411 O LYS A 93 2.205 -10.821 8.509 1.00 1.01 O ATOM 1412 CB LYS A 93 4.803 -9.954 6.701 1.00 1.11 C ATOM 1413 CG LYS A 93 5.498 -9.782 5.334 1.00 1.30 C ATOM 1414 CD LYS A 93 4.753 -10.400 4.137 1.00 1.33 C ATOM 1415 CE LYS A 93 5.591 -10.495 2.849 1.00 1.27 C ATOM 1416 NZ LYS A 93 6.273 -9.226 2.504 1.00 2.04 N ATOM 0 H LYS A 93 3.732 -7.593 6.402 1.00 0.91 H new ATOM 0 HA LYS A 93 2.788 -10.363 6.138 1.00 0.98 H new ATOM 0 HB2 LYS A 93 5.317 -9.324 7.427 1.00 1.11 H new ATOM 0 HB3 LYS A 93 4.936 -10.986 7.024 1.00 1.11 H new ATOM 0 HG2 LYS A 93 5.635 -8.717 5.146 1.00 1.30 H new ATOM 0 HG3 LYS A 93 6.492 -10.226 5.391 1.00 1.30 H new ATOM 0 HD2 LYS A 93 4.415 -11.399 4.411 1.00 1.33 H new ATOM 0 HD3 LYS A 93 3.861 -9.807 3.933 1.00 1.33 H new ATOM 0 HE2 LYS A 93 6.337 -11.281 2.965 1.00 1.27 H new ATOM 0 HE3 LYS A 93 4.944 -10.789 2.023 1.00 1.27 H new ATOM 0 HZ1 LYS A 93 6.333 -9.134 1.470 1.00 2.04 H new ATOM 0 HZ2 LYS A 93 5.734 -8.426 2.892 1.00 2.04 H new ATOM 0 HZ3 LYS A 93 7.231 -9.226 2.908 1.00 2.04 H new ATOM 1430 N SER A 94 2.701 -8.683 8.971 1.00 1.08 N ATOM 1431 CA SER A 94 2.070 -8.647 10.308 1.00 1.13 C ATOM 1432 C SER A 94 0.537 -8.672 10.280 1.00 1.12 C ATOM 1433 O SER A 94 -0.093 -9.110 11.248 1.00 1.33 O ATOM 1434 CB SER A 94 2.471 -7.382 11.066 1.00 1.18 C ATOM 1435 OG SER A 94 3.863 -7.326 11.255 1.00 1.55 O ATOM 0 H SER A 94 3.131 -7.796 8.707 1.00 1.08 H new ATOM 0 HA SER A 94 2.427 -9.552 10.798 1.00 1.13 H new ATOM 0 HB2 SER A 94 2.140 -6.503 10.513 1.00 1.18 H new ATOM 0 HB3 SER A 94 1.968 -7.359 12.033 1.00 1.18 H new ATOM 0 HG SER A 94 4.094 -6.507 11.741 1.00 1.55 H new ATOM 1441 N VAL A 95 -0.077 -8.211 9.190 1.00 1.08 N ATOM 1442 CA VAL A 95 -1.510 -8.372 8.909 1.00 1.29 C ATOM 1443 C VAL A 95 -1.688 -8.830 7.460 1.00 1.51 C ATOM 1444 O VAL A 95 -1.235 -8.160 6.538 1.00 1.63 O ATOM 1445 CB VAL A 95 -2.305 -7.102 9.280 1.00 1.38 C ATOM 1446 CG1 VAL A 95 -1.871 -5.819 8.557 1.00 1.30 C ATOM 1447 CG2 VAL A 95 -3.805 -7.315 9.064 1.00 1.84 C ATOM 0 H VAL A 95 0.418 -7.702 8.458 1.00 1.08 H new ATOM 0 HA VAL A 95 -1.933 -9.151 9.543 1.00 1.29 H new ATOM 0 HB VAL A 95 -2.079 -6.946 10.335 1.00 1.38 H new ATOM 0 HG11 VAL A 95 -2.492 -4.987 8.889 1.00 1.30 H new ATOM 0 HG12 VAL A 95 -0.827 -5.607 8.787 1.00 1.30 H new ATOM 0 HG13 VAL A 95 -1.986 -5.951 7.481 1.00 1.30 H new ATOM 0 HG21 VAL A 95 -4.344 -6.406 9.332 1.00 1.84 H new ATOM 0 HG22 VAL A 95 -3.992 -7.552 8.017 1.00 1.84 H new ATOM 0 HG23 VAL A 95 -4.149 -8.139 9.689 1.00 1.84 H new ATOM 1457 N LYS A 96 -2.261 -10.024 7.274 1.00 1.78 N ATOM 1458 CA LYS A 96 -2.318 -10.759 5.997 1.00 2.37 C ATOM 1459 C LYS A 96 -3.618 -11.567 5.867 1.00 2.85 C ATOM 1460 O LYS A 96 -4.509 -11.442 6.710 1.00 2.76 O ATOM 1461 CB LYS A 96 -1.068 -11.660 6.003 1.00 2.56 C ATOM 1462 CG LYS A 96 -0.476 -11.996 4.629 1.00 2.47 C ATOM 1463 CD LYS A 96 0.663 -12.991 4.871 1.00 2.80 C ATOM 1464 CE LYS A 96 1.367 -13.390 3.570 1.00 3.13 C ATOM 1465 NZ LYS A 96 2.358 -14.465 3.805 1.00 3.88 N ATOM 0 H LYS A 96 -2.716 -10.528 8.035 1.00 1.78 H new ATOM 0 HA LYS A 96 -2.322 -10.089 5.137 1.00 2.37 H new ATOM 0 HB2 LYS A 96 -0.297 -11.174 6.600 1.00 2.56 H new ATOM 0 HB3 LYS A 96 -1.320 -12.593 6.507 1.00 2.56 H new ATOM 0 HG2 LYS A 96 -1.235 -12.428 3.976 1.00 2.47 H new ATOM 0 HG3 LYS A 96 -0.106 -11.097 4.137 1.00 2.47 H new ATOM 0 HD2 LYS A 96 1.389 -12.551 5.555 1.00 2.80 H new ATOM 0 HD3 LYS A 96 0.267 -13.883 5.357 1.00 2.80 H new ATOM 0 HE2 LYS A 96 0.628 -13.726 2.842 1.00 3.13 H new ATOM 0 HE3 LYS A 96 1.865 -12.520 3.141 1.00 3.13 H new ATOM 0 HZ1 LYS A 96 2.819 -14.715 2.907 1.00 3.88 H new ATOM 0 HZ2 LYS A 96 3.075 -14.134 4.482 1.00 3.88 H new ATOM 0 HZ3 LYS A 96 1.877 -15.302 4.192 1.00 3.88 H new ATOM 1794 N GLU B 118 -9.796 2.932 15.803 1.00 2.48 N ATOM 1795 CA GLU B 118 -8.886 2.716 16.934 1.00 2.02 C ATOM 1796 C GLU B 118 -7.424 3.036 16.589 1.00 1.60 C ATOM 1797 O GLU B 118 -6.605 3.329 17.461 1.00 1.55 O ATOM 1798 CB GLU B 118 -8.982 1.252 17.414 1.00 2.38 C ATOM 1799 CG GLU B 118 -10.403 0.668 17.519 1.00 3.31 C ATOM 1800 CD GLU B 118 -10.834 -0.050 16.230 1.00 4.73 C ATOM 1801 OE1 GLU B 118 -11.321 0.620 15.286 1.00 6.22 O ATOM 1802 OE2 GLU B 118 -10.706 -1.294 16.154 1.00 4.99 O ATOM 0 HA GLU B 118 -9.197 3.400 17.724 1.00 2.02 H new ATOM 0 HB2 GLU B 118 -8.404 0.628 16.732 1.00 2.38 H new ATOM 0 HB3 GLU B 118 -8.508 1.179 18.393 1.00 2.38 H new ATOM 0 HG2 GLU B 118 -10.445 -0.032 18.354 1.00 3.31 H new ATOM 0 HG3 GLU B 118 -11.108 1.470 17.739 1.00 3.31 H new ATOM 1809 N PHE B 119 -7.121 2.980 15.299 1.00 1.46 N ATOM 1810 CA PHE B 119 -5.790 3.069 14.695 1.00 1.16 C ATOM 1811 C PHE B 119 -5.443 4.497 14.248 1.00 1.04 C ATOM 1812 O PHE B 119 -6.328 5.341 14.075 1.00 1.18 O ATOM 1813 CB PHE B 119 -5.702 2.071 13.531 1.00 1.09 C ATOM 1814 CG PHE B 119 -6.111 0.657 13.899 1.00 1.35 C ATOM 1815 CD1 PHE B 119 -5.176 -0.210 14.492 1.00 1.68 C ATOM 1816 CD2 PHE B 119 -7.435 0.223 13.692 1.00 2.75 C ATOM 1817 CE1 PHE B 119 -5.563 -1.504 14.884 1.00 1.84 C ATOM 1818 CE2 PHE B 119 -7.825 -1.068 14.091 1.00 3.12 C ATOM 1819 CZ PHE B 119 -6.889 -1.929 14.690 1.00 2.13 C ATOM 0 H PHE B 119 -7.848 2.863 14.593 1.00 1.46 H new ATOM 0 HA PHE B 119 -5.048 2.809 15.450 1.00 1.16 H new ATOM 0 HB2 PHE B 119 -6.336 2.421 12.717 1.00 1.09 H new ATOM 0 HB3 PHE B 119 -4.679 2.056 13.155 1.00 1.09 H new ATOM 0 HD1 PHE B 119 -4.159 0.118 14.647 1.00 1.68 H new ATOM 0 HD2 PHE B 119 -8.152 0.883 13.226 1.00 2.75 H new ATOM 0 HE1 PHE B 119 -4.842 -2.171 15.334 1.00 1.84 H new ATOM 0 HE2 PHE B 119 -8.842 -1.397 13.937 1.00 3.12 H new ATOM 0 HZ PHE B 119 -7.189 -2.919 15.002 1.00 2.13 H new ATOM 1829 N SER B 120 -4.156 4.782 14.061 1.00 0.86 N ATOM 1830 CA SER B 120 -3.651 6.028 13.461 1.00 0.82 C ATOM 1831 C SER B 120 -4.182 6.187 12.027 1.00 0.77 C ATOM 1832 O SER B 120 -4.464 5.183 11.377 1.00 0.75 O ATOM 1833 CB SER B 120 -2.115 6.016 13.457 1.00 0.82 C ATOM 1834 OG SER B 120 -1.598 5.461 14.660 1.00 2.04 O ATOM 0 H SER B 120 -3.411 4.139 14.328 1.00 0.86 H new ATOM 0 HA SER B 120 -4.001 6.872 14.055 1.00 0.82 H new ATOM 0 HB2 SER B 120 -1.756 5.439 12.605 1.00 0.82 H new ATOM 0 HB3 SER B 120 -1.742 7.033 13.334 1.00 0.82 H new ATOM 0 HG SER B 120 -1.615 4.483 14.603 1.00 2.04 H new ATOM 1840 N ASP B 121 -4.308 7.408 11.496 1.00 0.79 N ATOM 1841 CA ASP B 121 -4.897 7.650 10.160 1.00 0.79 C ATOM 1842 C ASP B 121 -4.196 6.867 9.027 1.00 0.65 C ATOM 1843 O ASP B 121 -4.854 6.361 8.121 1.00 0.66 O ATOM 1844 CB ASP B 121 -4.888 9.152 9.826 1.00 0.96 C ATOM 1845 CG ASP B 121 -5.831 9.974 10.704 1.00 1.60 C ATOM 1846 OD1 ASP B 121 -7.044 10.054 10.395 1.00 2.12 O ATOM 1847 OD2 ASP B 121 -5.352 10.591 11.688 1.00 2.90 O ATOM 0 H ASP B 121 -4.008 8.258 11.973 1.00 0.79 H new ATOM 0 HA ASP B 121 -5.922 7.284 10.217 1.00 0.79 H new ATOM 0 HB2 ASP B 121 -3.874 9.535 9.937 1.00 0.96 H new ATOM 0 HB3 ASP B 121 -5.167 9.286 8.781 1.00 0.96 H new ATOM 1852 N VAL B 122 -2.874 6.701 9.113 1.00 0.59 N ATOM 1853 CA VAL B 122 -2.050 5.921 8.162 1.00 0.53 C ATOM 1854 C VAL B 122 -2.117 4.407 8.421 1.00 0.53 C ATOM 1855 O VAL B 122 -1.934 3.591 7.522 1.00 0.61 O ATOM 1856 CB VAL B 122 -0.604 6.450 8.253 1.00 0.55 C ATOM 1857 CG1 VAL B 122 0.090 6.044 9.555 1.00 0.58 C ATOM 1858 CG2 VAL B 122 0.307 6.030 7.100 1.00 0.69 C ATOM 0 H VAL B 122 -2.323 7.114 9.865 1.00 0.59 H new ATOM 0 HA VAL B 122 -2.441 6.054 7.153 1.00 0.53 H new ATOM 0 HB VAL B 122 -0.741 7.530 8.207 1.00 0.55 H new ATOM 0 HG11 VAL B 122 1.104 6.443 9.566 1.00 0.58 H new ATOM 0 HG12 VAL B 122 -0.466 6.443 10.403 1.00 0.58 H new ATOM 0 HG13 VAL B 122 0.127 4.957 9.624 1.00 0.58 H new ATOM 0 HG21 VAL B 122 1.302 6.449 7.251 1.00 0.69 H new ATOM 0 HG22 VAL B 122 0.373 4.943 7.066 1.00 0.69 H new ATOM 0 HG23 VAL B 122 -0.103 6.398 6.160 1.00 0.69 H new ATOM 1868 N GLU B 123 -2.412 4.022 9.659 1.00 0.56 N ATOM 1869 CA GLU B 123 -2.428 2.647 10.165 1.00 0.60 C ATOM 1870 C GLU B 123 -3.759 1.959 9.824 1.00 0.58 C ATOM 1871 O GLU B 123 -3.760 0.854 9.277 1.00 0.68 O ATOM 1872 CB GLU B 123 -2.124 2.763 11.663 1.00 0.77 C ATOM 1873 CG GLU B 123 -1.880 1.491 12.481 1.00 0.92 C ATOM 1874 CD GLU B 123 -1.544 1.850 13.944 1.00 1.37 C ATOM 1875 OE1 GLU B 123 -2.136 2.817 14.492 1.00 2.54 O ATOM 1876 OE2 GLU B 123 -0.720 1.149 14.574 1.00 1.98 O ATOM 0 H GLU B 123 -2.661 4.698 10.381 1.00 0.56 H new ATOM 0 HA GLU B 123 -1.682 2.004 9.699 1.00 0.60 H new ATOM 0 HB2 GLU B 123 -1.242 3.395 11.770 1.00 0.77 H new ATOM 0 HB3 GLU B 123 -2.955 3.295 12.125 1.00 0.77 H new ATOM 0 HG2 GLU B 123 -2.765 0.855 12.450 1.00 0.92 H new ATOM 0 HG3 GLU B 123 -1.062 0.920 12.042 1.00 0.92 H new ATOM 1883 N ARG B 124 -4.892 2.670 9.983 1.00 0.54 N ATOM 1884 CA ARG B 124 -6.181 2.254 9.397 1.00 0.55 C ATOM 1885 C ARG B 124 -6.126 2.194 7.869 1.00 0.47 C ATOM 1886 O ARG B 124 -6.840 1.386 7.277 1.00 0.49 O ATOM 1887 CB ARG B 124 -7.355 3.143 9.862 1.00 0.73 C ATOM 1888 CG ARG B 124 -7.259 4.617 9.444 1.00 1.21 C ATOM 1889 CD ARG B 124 -8.543 5.392 9.764 1.00 1.73 C ATOM 1890 NE ARG B 124 -8.422 6.821 9.435 1.00 2.48 N ATOM 1891 CZ ARG B 124 -8.248 7.368 8.246 1.00 3.54 C ATOM 1892 NH1 ARG B 124 -8.298 6.697 7.131 1.00 4.53 N ATOM 1893 NH2 ARG B 124 -7.998 8.640 8.178 1.00 4.23 N ATOM 0 H ARG B 124 -4.940 3.539 10.515 1.00 0.54 H new ATOM 0 HA ARG B 124 -6.365 1.245 9.767 1.00 0.55 H new ATOM 0 HB2 ARG B 124 -8.283 2.729 9.467 1.00 0.73 H new ATOM 0 HB3 ARG B 124 -7.420 3.093 10.949 1.00 0.73 H new ATOM 0 HG2 ARG B 124 -6.417 5.084 9.955 1.00 1.21 H new ATOM 0 HG3 ARG B 124 -7.056 4.678 8.375 1.00 1.21 H new ATOM 0 HD2 ARG B 124 -9.375 4.961 9.207 1.00 1.73 H new ATOM 0 HD3 ARG B 124 -8.778 5.283 10.823 1.00 1.73 H new ATOM 0 HE ARG B 124 -8.480 7.468 10.221 1.00 2.48 H new ATOM 0 HH11 ARG B 124 -8.480 5.693 7.147 1.00 4.53 H new ATOM 0 HH12 ARG B 124 -8.155 7.175 6.241 1.00 4.53 H new ATOM 0 HH21 ARG B 124 -7.940 9.195 9.032 1.00 4.23 H new ATOM 0 HH22 ARG B 124 -7.860 9.085 7.271 1.00 4.23 H new ATOM 1907 N ALA B 125 -5.286 3.011 7.225 1.00 0.45 N ATOM 1908 CA ALA B 125 -5.195 3.058 5.770 1.00 0.47 C ATOM 1909 C ALA B 125 -4.603 1.759 5.182 1.00 0.46 C ATOM 1910 O ALA B 125 -5.180 1.208 4.244 1.00 0.49 O ATOM 1911 CB ALA B 125 -4.450 4.320 5.333 1.00 0.49 C ATOM 0 H ALA B 125 -4.654 3.655 7.700 1.00 0.45 H new ATOM 0 HA ALA B 125 -6.202 3.118 5.358 1.00 0.47 H new ATOM 0 HB1 ALA B 125 -4.387 4.347 4.245 1.00 0.49 H new ATOM 0 HB2 ALA B 125 -4.987 5.200 5.687 1.00 0.49 H new ATOM 0 HB3 ALA B 125 -3.445 4.314 5.755 1.00 0.49 H new ATOM 1917 N ILE B 126 -3.524 1.215 5.769 1.00 0.48 N ATOM 1918 CA ILE B 126 -2.885 -0.032 5.300 1.00 0.51 C ATOM 1919 C ILE B 126 -3.858 -1.209 5.465 1.00 0.53 C ATOM 1920 O ILE B 126 -4.070 -1.976 4.527 1.00 0.57 O ATOM 1921 CB ILE B 126 -1.533 -0.297 6.020 1.00 0.54 C ATOM 1922 CG1 ILE B 126 -0.538 0.873 5.853 1.00 0.55 C ATOM 1923 CG2 ILE B 126 -0.887 -1.594 5.491 1.00 0.64 C ATOM 1924 CD1 ILE B 126 0.548 0.908 6.938 1.00 0.70 C ATOM 0 H ILE B 126 -3.068 1.626 6.583 1.00 0.48 H new ATOM 0 HA ILE B 126 -2.651 0.079 4.241 1.00 0.51 H new ATOM 0 HB ILE B 126 -1.757 -0.398 7.082 1.00 0.54 H new ATOM 0 HG12 ILE B 126 -0.062 0.799 4.875 1.00 0.55 H new ATOM 0 HG13 ILE B 126 -1.088 1.814 5.869 1.00 0.55 H new ATOM 0 HG21 ILE B 126 0.059 -1.765 6.005 1.00 0.64 H new ATOM 0 HG22 ILE B 126 -1.557 -2.435 5.673 1.00 0.64 H new ATOM 0 HG23 ILE B 126 -0.706 -1.500 4.420 1.00 0.64 H new ATOM 0 HD11 ILE B 126 1.212 1.754 6.761 1.00 0.70 H new ATOM 0 HD12 ILE B 126 0.081 1.013 7.917 1.00 0.70 H new ATOM 0 HD13 ILE B 126 1.123 -0.018 6.907 1.00 0.70 H new ATOM 1936 N GLU B 127 -4.528 -1.288 6.619 1.00 0.52 N ATOM 1937 CA GLU B 127 -5.574 -2.282 6.903 1.00 0.57 C ATOM 1938 C GLU B 127 -6.728 -2.201 5.898 1.00 0.59 C ATOM 1939 O GLU B 127 -7.187 -3.198 5.346 1.00 0.69 O ATOM 1940 CB GLU B 127 -6.155 -2.023 8.305 1.00 0.65 C ATOM 1941 CG GLU B 127 -5.433 -2.774 9.424 1.00 1.48 C ATOM 1942 CD GLU B 127 -6.043 -4.162 9.688 1.00 1.99 C ATOM 1943 OE1 GLU B 127 -6.378 -4.867 8.713 1.00 2.91 O ATOM 1944 OE2 GLU B 127 -6.203 -4.566 10.871 1.00 2.85 O ATOM 0 H GLU B 127 -4.357 -0.652 7.398 1.00 0.52 H new ATOM 0 HA GLU B 127 -5.113 -3.268 6.835 1.00 0.57 H new ATOM 0 HB2 GLU B 127 -6.113 -0.954 8.513 1.00 0.65 H new ATOM 0 HB3 GLU B 127 -7.207 -2.308 8.310 1.00 0.65 H new ATOM 0 HG2 GLU B 127 -4.381 -2.886 9.162 1.00 1.48 H new ATOM 0 HG3 GLU B 127 -5.473 -2.183 10.339 1.00 1.48 H new ATOM 1951 N THR B 128 -7.175 -0.981 5.616 1.00 0.55 N ATOM 1952 CA THR B 128 -8.335 -0.736 4.748 1.00 0.63 C ATOM 1953 C THR B 128 -8.074 -1.245 3.336 1.00 0.67 C ATOM 1954 O THR B 128 -8.954 -1.848 2.718 1.00 0.81 O ATOM 1955 CB THR B 128 -8.679 0.765 4.730 1.00 0.66 C ATOM 1956 OG1 THR B 128 -9.169 1.133 6.001 1.00 0.69 O ATOM 1957 CG2 THR B 128 -9.728 1.194 3.704 1.00 0.76 C ATOM 0 H THR B 128 -6.747 -0.130 5.980 1.00 0.55 H new ATOM 0 HA THR B 128 -9.187 -1.284 5.150 1.00 0.63 H new ATOM 0 HB THR B 128 -7.749 1.262 4.453 1.00 0.66 H new ATOM 0 HG1 THR B 128 -8.457 1.036 6.667 1.00 0.69 H new ATOM 0 HG21 THR B 128 -9.892 2.269 3.779 1.00 0.76 H new ATOM 0 HG22 THR B 128 -9.377 0.950 2.701 1.00 0.76 H new ATOM 0 HG23 THR B 128 -10.663 0.670 3.899 1.00 0.76 H new ATOM 1965 N LEU B 129 -6.860 -1.031 2.821 1.00 0.59 N ATOM 1966 CA LEU B 129 -6.532 -1.451 1.463 1.00 0.67 C ATOM 1967 C LEU B 129 -6.082 -2.917 1.335 1.00 0.79 C ATOM 1968 O LEU B 129 -6.354 -3.523 0.299 1.00 1.00 O ATOM 1969 CB LEU B 129 -5.698 -0.388 0.771 1.00 1.06 C ATOM 1970 CG LEU B 129 -4.208 -0.375 1.114 1.00 0.63 C ATOM 1971 CD1 LEU B 129 -3.437 -1.068 0.008 1.00 1.32 C ATOM 1972 CD2 LEU B 129 -3.760 1.076 1.104 1.00 1.35 C ATOM 0 H LEU B 129 -6.097 -0.574 3.321 1.00 0.59 H new ATOM 0 HA LEU B 129 -7.451 -1.504 0.879 1.00 0.67 H new ATOM 0 HB2 LEU B 129 -5.801 -0.518 -0.306 1.00 1.06 H new ATOM 0 HB3 LEU B 129 -6.115 0.589 1.016 1.00 1.06 H new ATOM 0 HG LEU B 129 -4.037 -0.864 2.073 1.00 0.63 H new ATOM 0 HD11 LEU B 129 -2.374 -1.062 0.247 1.00 1.32 H new ATOM 0 HD12 LEU B 129 -3.782 -2.098 -0.086 1.00 1.32 H new ATOM 0 HD13 LEU B 129 -3.600 -0.543 -0.933 1.00 1.32 H new ATOM 0 HD21 LEU B 129 -2.698 1.131 1.345 1.00 1.35 H new ATOM 0 HD22 LEU B 129 -3.930 1.503 0.115 1.00 1.35 H new ATOM 0 HD23 LEU B 129 -4.329 1.638 1.845 1.00 1.35 H new ATOM 1984 N ILE B 130 -5.506 -3.530 2.382 1.00 0.77 N ATOM 1985 CA ILE B 130 -5.254 -4.984 2.386 1.00 0.96 C ATOM 1986 C ILE B 130 -6.558 -5.782 2.484 1.00 0.95 C ATOM 1987 O ILE B 130 -6.765 -6.718 1.709 1.00 1.01 O ATOM 1988 CB ILE B 130 -4.208 -5.409 3.446 1.00 1.20 C ATOM 1989 CG1 ILE B 130 -3.721 -6.846 3.157 1.00 1.56 C ATOM 1990 CG2 ILE B 130 -4.696 -5.331 4.897 1.00 1.54 C ATOM 1991 CD1 ILE B 130 -2.292 -7.080 3.646 1.00 2.38 C ATOM 0 H ILE B 130 -5.208 -3.048 3.230 1.00 0.77 H new ATOM 0 HA ILE B 130 -4.806 -5.229 1.423 1.00 0.96 H new ATOM 0 HB ILE B 130 -3.397 -4.686 3.356 1.00 1.20 H new ATOM 0 HG12 ILE B 130 -4.390 -7.559 3.640 1.00 1.56 H new ATOM 0 HG13 ILE B 130 -3.772 -7.037 2.085 1.00 1.56 H new ATOM 0 HG21 ILE B 130 -3.897 -5.647 5.567 1.00 1.54 H new ATOM 0 HG22 ILE B 130 -4.981 -4.305 5.130 1.00 1.54 H new ATOM 0 HG23 ILE B 130 -5.558 -5.985 5.027 1.00 1.54 H new ATOM 0 HD11 ILE B 130 -1.993 -8.104 3.421 1.00 2.38 H new ATOM 0 HD12 ILE B 130 -1.617 -6.387 3.144 1.00 2.38 H new ATOM 0 HD13 ILE B 130 -2.245 -6.917 4.723 1.00 2.38 H new ATOM 2003 N LYS B 131 -7.501 -5.368 3.343 1.00 0.94 N ATOM 2004 CA LYS B 131 -8.814 -6.024 3.466 1.00 1.06 C ATOM 2005 C LYS B 131 -9.634 -5.979 2.181 1.00 0.91 C ATOM 2006 O LYS B 131 -10.404 -6.902 1.925 1.00 0.91 O ATOM 2007 CB LYS B 131 -9.601 -5.420 4.640 1.00 1.26 C ATOM 2008 CG LYS B 131 -9.048 -5.787 6.025 1.00 1.54 C ATOM 2009 CD LYS B 131 -8.898 -7.303 6.228 1.00 2.34 C ATOM 2010 CE LYS B 131 -8.623 -7.656 7.688 1.00 2.56 C ATOM 2011 NZ LYS B 131 -7.235 -7.336 8.087 1.00 4.21 N ATOM 0 H LYS B 131 -7.377 -4.573 3.970 1.00 0.94 H new ATOM 0 HA LYS B 131 -8.622 -7.079 3.663 1.00 1.06 H new ATOM 0 HB2 LYS B 131 -9.606 -4.335 4.539 1.00 1.26 H new ATOM 0 HB3 LYS B 131 -10.638 -5.751 4.576 1.00 1.26 H new ATOM 0 HG2 LYS B 131 -8.077 -5.310 6.161 1.00 1.54 H new ATOM 0 HG3 LYS B 131 -9.710 -5.387 6.793 1.00 1.54 H new ATOM 0 HD2 LYS B 131 -9.807 -7.805 5.898 1.00 2.34 H new ATOM 0 HD3 LYS B 131 -8.084 -7.674 5.605 1.00 2.34 H new ATOM 0 HE2 LYS B 131 -9.318 -7.113 8.329 1.00 2.56 H new ATOM 0 HE3 LYS B 131 -8.809 -8.719 7.845 1.00 2.56 H new ATOM 0 HZ1 LYS B 131 -7.024 -7.785 9.001 1.00 4.21 H new ATOM 0 HZ2 LYS B 131 -6.576 -7.692 7.366 1.00 4.21 H new ATOM 0 HZ3 LYS B 131 -7.128 -6.305 8.175 1.00 4.21 H new ATOM 2025 N ASN B 132 -9.401 -5.008 1.301 1.00 0.82 N ATOM 2026 CA ASN B 132 -10.094 -4.975 0.017 1.00 0.78 C ATOM 2027 C ASN B 132 -9.675 -6.102 -0.953 1.00 0.75 C ATOM 2028 O ASN B 132 -10.489 -6.488 -1.791 1.00 0.79 O ATOM 2029 CB ASN B 132 -10.025 -3.553 -0.570 1.00 0.78 C ATOM 2030 CG ASN B 132 -11.226 -2.721 -0.159 1.00 0.80 C ATOM 2031 OD1 ASN B 132 -12.205 -2.616 -0.887 1.00 1.07 O ATOM 2032 ND2 ASN B 132 -11.212 -2.109 0.997 1.00 0.81 N ATOM 0 H ASN B 132 -8.745 -4.242 1.451 1.00 0.82 H new ATOM 0 HA ASN B 132 -11.146 -5.203 0.189 1.00 0.78 H new ATOM 0 HB2 ASN B 132 -9.111 -3.064 -0.234 1.00 0.78 H new ATOM 0 HB3 ASN B 132 -9.975 -3.609 -1.657 1.00 0.78 H new ATOM 0 HD21 ASN B 132 -12.013 -1.549 1.287 1.00 0.81 H new ATOM 0 HD22 ASN B 132 -10.400 -2.192 1.608 1.00 0.81 H new ATOM 2039 N PHE B 133 -8.494 -6.716 -0.792 1.00 0.75 N ATOM 2040 CA PHE B 133 -8.174 -7.990 -1.459 1.00 0.78 C ATOM 2041 C PHE B 133 -8.993 -9.156 -0.882 1.00 0.89 C ATOM 2042 O PHE B 133 -9.503 -9.984 -1.636 1.00 1.07 O ATOM 2043 CB PHE B 133 -6.670 -8.275 -1.349 1.00 0.83 C ATOM 2044 CG PHE B 133 -6.229 -9.616 -1.917 1.00 0.81 C ATOM 2045 CD1 PHE B 133 -6.035 -9.774 -3.303 1.00 1.85 C ATOM 2046 CD2 PHE B 133 -5.980 -10.701 -1.054 1.00 1.89 C ATOM 2047 CE1 PHE B 133 -5.562 -10.993 -3.825 1.00 1.86 C ATOM 2048 CE2 PHE B 133 -5.525 -11.925 -1.575 1.00 1.92 C ATOM 2049 CZ PHE B 133 -5.304 -12.064 -2.955 1.00 0.89 C ATOM 0 H PHE B 133 -7.743 -6.352 -0.206 1.00 0.75 H new ATOM 0 HA PHE B 133 -8.443 -7.897 -2.511 1.00 0.78 H new ATOM 0 HB2 PHE B 133 -6.126 -7.483 -1.863 1.00 0.83 H new ATOM 0 HB3 PHE B 133 -6.382 -8.229 -0.299 1.00 0.83 H new ATOM 0 HD1 PHE B 133 -6.251 -8.953 -3.971 1.00 1.85 H new ATOM 0 HD2 PHE B 133 -6.139 -10.593 0.009 1.00 1.89 H new ATOM 0 HE1 PHE B 133 -5.399 -11.103 -4.887 1.00 1.86 H new ATOM 0 HE2 PHE B 133 -5.345 -12.759 -0.913 1.00 1.92 H new ATOM 0 HZ PHE B 133 -4.934 -12.999 -3.349 1.00 0.89 H new ATOM 2059 N HIS B 134 -9.195 -9.206 0.440 1.00 0.83 N ATOM 2060 CA HIS B 134 -10.054 -10.217 1.073 1.00 0.86 C ATOM 2061 C HIS B 134 -11.500 -10.105 0.555 1.00 0.77 C ATOM 2062 O HIS B 134 -12.109 -11.089 0.138 1.00 0.84 O ATOM 2063 CB HIS B 134 -10.064 -10.064 2.602 1.00 0.92 C ATOM 2064 CG HIS B 134 -8.774 -10.262 3.358 1.00 1.20 C ATOM 2065 ND1 HIS B 134 -8.704 -10.967 4.534 1.00 2.35 N ATOM 2066 CD2 HIS B 134 -7.537 -9.700 3.152 1.00 0.83 C ATOM 2067 CE1 HIS B 134 -7.465 -10.857 5.024 1.00 2.42 C ATOM 2068 NE2 HIS B 134 -6.710 -10.093 4.213 1.00 1.37 N ATOM 0 H HIS B 134 -8.771 -8.552 1.098 1.00 0.83 H new ATOM 0 HA HIS B 134 -9.644 -11.193 0.814 1.00 0.86 H new ATOM 0 HB2 HIS B 134 -10.432 -9.064 2.832 1.00 0.92 H new ATOM 0 HB3 HIS B 134 -10.792 -10.771 3.000 1.00 0.92 H new ATOM 0 HD2 HIS B 134 -7.253 -9.069 2.322 1.00 0.83 H new ATOM 0 HE1 HIS B 134 -7.120 -11.315 5.939 1.00 2.42 H new ATOM 0 HE2 HIS B 134 -5.729 -9.848 4.345 1.00 1.37 H new ATOM 2076 N GLN B 135 -12.042 -8.886 0.515 1.00 0.72 N ATOM 2077 CA GLN B 135 -13.427 -8.606 0.141 1.00 0.76 C ATOM 2078 C GLN B 135 -13.768 -8.916 -1.333 1.00 0.71 C ATOM 2079 O GLN B 135 -14.935 -9.161 -1.654 1.00 0.83 O ATOM 2080 CB GLN B 135 -13.676 -7.137 0.508 1.00 0.92 C ATOM 2081 CG GLN B 135 -15.160 -6.798 0.646 1.00 1.42 C ATOM 2082 CD GLN B 135 -15.367 -5.603 1.572 1.00 2.04 C ATOM 2083 OE1 GLN B 135 -14.810 -4.528 1.384 1.00 3.40 O ATOM 2084 NE2 GLN B 135 -16.108 -5.756 2.644 1.00 2.31 N ATOM 0 H GLN B 135 -11.514 -8.045 0.748 1.00 0.72 H new ATOM 0 HA GLN B 135 -14.095 -9.274 0.684 1.00 0.76 H new ATOM 0 HB2 GLN B 135 -13.169 -6.912 1.446 1.00 0.92 H new ATOM 0 HB3 GLN B 135 -13.233 -6.498 -0.255 1.00 0.92 H new ATOM 0 HG2 GLN B 135 -15.579 -6.578 -0.336 1.00 1.42 H new ATOM 0 HG3 GLN B 135 -15.699 -7.662 1.036 1.00 1.42 H new ATOM 0 HE21 GLN B 135 -16.579 -6.644 2.816 1.00 2.31 H new ATOM 0 HE22 GLN B 135 -16.213 -4.987 3.305 1.00 2.31 H new ATOM 2093 N TYR B 136 -12.763 -8.953 -2.215 1.00 0.69 N ATOM 2094 CA TYR B 136 -12.910 -9.216 -3.654 1.00 0.75 C ATOM 2095 C TYR B 136 -12.272 -10.529 -4.147 1.00 0.93 C ATOM 2096 O TYR B 136 -12.331 -10.806 -5.335 1.00 1.30 O ATOM 2097 CB TYR B 136 -12.420 -7.993 -4.448 1.00 0.64 C ATOM 2098 CG TYR B 136 -13.479 -6.922 -4.636 1.00 0.67 C ATOM 2099 CD1 TYR B 136 -13.702 -5.946 -3.644 1.00 2.04 C ATOM 2100 CD2 TYR B 136 -14.225 -6.894 -5.830 1.00 1.60 C ATOM 2101 CE1 TYR B 136 -14.659 -4.932 -3.853 1.00 2.11 C ATOM 2102 CE2 TYR B 136 -15.154 -5.861 -6.057 1.00 1.59 C ATOM 2103 CZ TYR B 136 -15.370 -4.878 -5.073 1.00 0.82 C ATOM 2104 OH TYR B 136 -16.256 -3.882 -5.323 1.00 0.92 O ATOM 0 H TYR B 136 -11.793 -8.796 -1.940 1.00 0.69 H new ATOM 0 HA TYR B 136 -13.973 -9.372 -3.836 1.00 0.75 H new ATOM 0 HB2 TYR B 136 -11.563 -7.557 -3.935 1.00 0.64 H new ATOM 0 HB3 TYR B 136 -12.072 -8.322 -5.427 1.00 0.64 H new ATOM 0 HD1 TYR B 136 -13.139 -5.975 -2.723 1.00 2.04 H new ATOM 0 HD2 TYR B 136 -14.084 -7.666 -6.572 1.00 1.60 H new ATOM 0 HE1 TYR B 136 -14.848 -4.199 -3.083 1.00 2.11 H new ATOM 0 HE2 TYR B 136 -15.702 -5.823 -6.987 1.00 1.59 H new ATOM 0 HH TYR B 136 -16.648 -4.008 -6.212 1.00 0.92 H new ATOM 2114 N SER B 137 -11.704 -11.380 -3.288 1.00 0.85 N ATOM 2115 CA SER B 137 -11.090 -12.667 -3.688 1.00 0.98 C ATOM 2116 C SER B 137 -12.100 -13.829 -3.782 1.00 1.01 C ATOM 2117 O SER B 137 -11.809 -14.956 -3.387 1.00 1.39 O ATOM 2118 CB SER B 137 -9.867 -12.986 -2.806 1.00 1.07 C ATOM 2119 OG SER B 137 -10.067 -12.637 -1.454 1.00 1.92 O ATOM 0 H SER B 137 -11.653 -11.201 -2.285 1.00 0.85 H new ATOM 0 HA SER B 137 -10.729 -12.548 -4.710 1.00 0.98 H new ATOM 0 HB2 SER B 137 -9.643 -14.051 -2.873 1.00 1.07 H new ATOM 0 HB3 SER B 137 -8.998 -12.453 -3.190 1.00 1.07 H new ATOM 0 HG SER B 137 -9.899 -11.679 -1.335 1.00 1.92 H new ATOM 2125 N VAL B 138 -13.328 -13.585 -4.253 1.00 0.97 N ATOM 2126 CA VAL B 138 -14.457 -14.526 -4.078 1.00 1.11 C ATOM 2127 C VAL B 138 -14.437 -15.676 -5.092 1.00 1.09 C ATOM 2128 O VAL B 138 -14.621 -16.835 -4.701 1.00 1.33 O ATOM 2129 CB VAL B 138 -15.808 -13.781 -4.093 1.00 1.35 C ATOM 2130 CG1 VAL B 138 -16.985 -14.727 -3.824 1.00 2.39 C ATOM 2131 CG2 VAL B 138 -15.852 -12.690 -3.011 1.00 2.87 C ATOM 0 H VAL B 138 -13.574 -12.737 -4.764 1.00 0.97 H new ATOM 0 HA VAL B 138 -14.333 -14.984 -3.097 1.00 1.11 H new ATOM 0 HB VAL B 138 -15.897 -13.345 -5.088 1.00 1.35 H new ATOM 0 HG11 VAL B 138 -17.917 -14.163 -3.843 1.00 2.39 H new ATOM 0 HG12 VAL B 138 -17.013 -15.500 -4.592 1.00 2.39 H new ATOM 0 HG13 VAL B 138 -16.862 -15.191 -2.846 1.00 2.39 H new ATOM 0 HG21 VAL B 138 -16.816 -12.182 -3.046 1.00 2.87 H new ATOM 0 HG22 VAL B 138 -15.717 -13.145 -2.030 1.00 2.87 H new ATOM 0 HG23 VAL B 138 -15.055 -11.968 -3.189 1.00 2.87 H new ATOM 2141 N GLU B 139 -14.176 -15.407 -6.375 1.00 0.99 N ATOM 2142 CA GLU B 139 -13.984 -16.455 -7.398 1.00 1.15 C ATOM 2143 C GLU B 139 -12.547 -17.007 -7.371 1.00 1.24 C ATOM 2144 O GLU B 139 -12.313 -18.175 -7.687 1.00 1.47 O ATOM 2145 CB GLU B 139 -14.391 -15.924 -8.784 1.00 1.30 C ATOM 2146 CG GLU B 139 -14.802 -17.045 -9.755 1.00 1.76 C ATOM 2147 CD GLU B 139 -15.455 -16.516 -11.044 1.00 2.35 C ATOM 2148 OE1 GLU B 139 -16.405 -15.696 -10.966 1.00 3.61 O ATOM 2149 OE2 GLU B 139 -15.103 -16.975 -12.161 1.00 2.85 O ATOM 0 H GLU B 139 -14.091 -14.458 -6.740 1.00 0.99 H new ATOM 0 HA GLU B 139 -14.636 -17.297 -7.168 1.00 1.15 H new ATOM 0 HB2 GLU B 139 -15.220 -15.225 -8.671 1.00 1.30 H new ATOM 0 HB3 GLU B 139 -13.559 -15.365 -9.213 1.00 1.30 H new ATOM 0 HG2 GLU B 139 -13.922 -17.633 -10.015 1.00 1.76 H new ATOM 0 HG3 GLU B 139 -15.497 -17.717 -9.252 1.00 1.76 H new ATOM 2156 N GLY B 140 -11.589 -16.208 -6.892 1.00 1.24 N ATOM 2157 CA GLY B 140 -10.227 -16.630 -6.539 1.00 1.51 C ATOM 2158 C GLY B 140 -10.079 -17.325 -5.171 1.00 1.33 C ATOM 2159 O GLY B 140 -8.981 -17.355 -4.606 1.00 2.21 O ATOM 0 H GLY B 140 -11.745 -15.213 -6.733 1.00 1.24 H new ATOM 0 HA2 GLY B 140 -9.864 -17.307 -7.312 1.00 1.51 H new ATOM 0 HA3 GLY B 140 -9.579 -15.754 -6.553 1.00 1.51 H new ATOM 2163 N GLY B 141 -11.164 -17.884 -4.622 1.00 1.69 N ATOM 2164 CA GLY B 141 -11.123 -18.854 -3.519 1.00 1.91 C ATOM 2165 C GLY B 141 -10.602 -18.331 -2.172 1.00 1.80 C ATOM 2166 O GLY B 141 -10.062 -19.112 -1.387 1.00 2.54 O ATOM 0 H GLY B 141 -12.111 -17.672 -4.936 1.00 1.69 H new ATOM 0 HA2 GLY B 141 -12.130 -19.244 -3.368 1.00 1.91 H new ATOM 0 HA3 GLY B 141 -10.499 -19.694 -3.825 1.00 1.91 H new ATOM 2170 N LYS B 142 -10.715 -17.022 -1.917 1.00 1.49 N ATOM 2171 CA LYS B 142 -10.208 -16.292 -0.733 1.00 1.36 C ATOM 2172 C LYS B 142 -8.692 -16.371 -0.518 1.00 1.49 C ATOM 2173 O LYS B 142 -8.187 -16.027 0.550 1.00 1.92 O ATOM 2174 CB LYS B 142 -11.046 -16.656 0.507 1.00 1.64 C ATOM 2175 CG LYS B 142 -12.480 -16.112 0.419 1.00 1.80 C ATOM 2176 CD LYS B 142 -12.538 -14.618 0.757 1.00 2.29 C ATOM 2177 CE LYS B 142 -13.982 -14.145 0.632 1.00 2.91 C ATOM 2178 NZ LYS B 142 -14.125 -12.752 1.097 1.00 4.45 N ATOM 0 H LYS B 142 -11.192 -16.399 -2.569 1.00 1.49 H new ATOM 0 HA LYS B 142 -10.347 -15.229 -0.931 1.00 1.36 H new ATOM 0 HB2 LYS B 142 -11.077 -17.740 0.617 1.00 1.64 H new ATOM 0 HB3 LYS B 142 -10.563 -16.258 1.399 1.00 1.64 H new ATOM 0 HG2 LYS B 142 -12.870 -16.274 -0.586 1.00 1.80 H new ATOM 0 HG3 LYS B 142 -13.123 -16.666 1.103 1.00 1.80 H new ATOM 0 HD2 LYS B 142 -12.170 -14.445 1.768 1.00 2.29 H new ATOM 0 HD3 LYS B 142 -11.895 -14.053 0.082 1.00 2.29 H new ATOM 0 HE2 LYS B 142 -14.304 -14.220 -0.407 1.00 2.91 H new ATOM 0 HE3 LYS B 142 -14.633 -14.796 1.216 1.00 2.91 H new ATOM 0 HZ1 LYS B 142 -14.918 -12.300 0.599 1.00 4.45 H new ATOM 0 HZ2 LYS B 142 -14.309 -12.745 2.121 1.00 4.45 H new ATOM 0 HZ3 LYS B 142 -13.249 -12.228 0.899 1.00 4.45 H new ATOM 2192 N GLU B 143 -7.966 -16.789 -1.551 1.00 1.51 N ATOM 2193 CA GLU B 143 -6.501 -16.848 -1.602 1.00 1.73 C ATOM 2194 C GLU B 143 -5.904 -16.054 -2.774 1.00 1.40 C ATOM 2195 O GLU B 143 -4.719 -15.722 -2.756 1.00 1.41 O ATOM 2196 CB GLU B 143 -6.045 -18.318 -1.609 1.00 2.35 C ATOM 2197 CG GLU B 143 -6.673 -19.217 -2.693 1.00 4.01 C ATOM 2198 CD GLU B 143 -6.143 -20.649 -2.580 1.00 4.58 C ATOM 2199 OE1 GLU B 143 -4.911 -20.837 -2.707 1.00 4.77 O ATOM 2200 OE2 GLU B 143 -6.924 -21.607 -2.338 1.00 5.39 O ATOM 0 H GLU B 143 -8.399 -17.111 -2.417 1.00 1.51 H new ATOM 0 HA GLU B 143 -6.117 -16.361 -0.706 1.00 1.73 H new ATOM 0 HB2 GLU B 143 -4.962 -18.341 -1.729 1.00 2.35 H new ATOM 0 HB3 GLU B 143 -6.267 -18.751 -0.633 1.00 2.35 H new ATOM 0 HG2 GLU B 143 -7.758 -19.216 -2.590 1.00 4.01 H new ATOM 0 HG3 GLU B 143 -6.446 -18.817 -3.681 1.00 4.01 H new ATOM 2207 N THR B 144 -6.715 -15.734 -3.786 1.00 1.22 N ATOM 2208 CA THR B 144 -6.303 -15.054 -5.024 1.00 1.09 C ATOM 2209 C THR B 144 -7.415 -14.152 -5.572 1.00 1.01 C ATOM 2210 O THR B 144 -8.551 -14.229 -5.109 1.00 1.15 O ATOM 2211 CB THR B 144 -5.883 -16.069 -6.106 1.00 1.25 C ATOM 2212 OG1 THR B 144 -6.939 -16.951 -6.421 1.00 1.20 O ATOM 2213 CG2 THR B 144 -4.704 -16.947 -5.688 1.00 1.52 C ATOM 0 H THR B 144 -7.712 -15.947 -3.768 1.00 1.22 H new ATOM 0 HA THR B 144 -5.445 -14.431 -4.769 1.00 1.09 H new ATOM 0 HB THR B 144 -5.600 -15.454 -6.960 1.00 1.25 H new ATOM 0 HG1 THR B 144 -7.582 -16.969 -5.682 1.00 1.20 H new ATOM 0 HG21 THR B 144 -4.461 -17.638 -6.495 1.00 1.52 H new ATOM 0 HG22 THR B 144 -3.839 -16.318 -5.476 1.00 1.52 H new ATOM 0 HG23 THR B 144 -4.970 -17.512 -4.795 1.00 1.52 H new ATOM 2221 N LEU B 145 -7.137 -13.347 -6.601 1.00 1.03 N ATOM 2222 CA LEU B 145 -8.181 -12.724 -7.431 1.00 1.04 C ATOM 2223 C LEU B 145 -8.506 -13.605 -8.656 1.00 1.21 C ATOM 2224 O LEU B 145 -7.747 -14.506 -9.019 1.00 1.61 O ATOM 2225 CB LEU B 145 -7.750 -11.308 -7.893 1.00 1.47 C ATOM 2226 CG LEU B 145 -7.669 -10.152 -6.864 1.00 0.60 C ATOM 2227 CD1 LEU B 145 -8.122 -8.860 -7.549 1.00 1.32 C ATOM 2228 CD2 LEU B 145 -8.571 -10.335 -5.640 1.00 0.67 C ATOM 0 H LEU B 145 -6.187 -13.107 -6.884 1.00 1.03 H new ATOM 0 HA LEU B 145 -9.079 -12.631 -6.821 1.00 1.04 H new ATOM 0 HB2 LEU B 145 -6.767 -11.402 -8.354 1.00 1.47 H new ATOM 0 HB3 LEU B 145 -8.441 -10.998 -8.677 1.00 1.47 H new ATOM 0 HG LEU B 145 -6.635 -10.128 -6.520 1.00 0.60 H new ATOM 0 HD11 LEU B 145 -8.071 -8.035 -6.839 1.00 1.32 H new ATOM 0 HD12 LEU B 145 -7.470 -8.650 -8.397 1.00 1.32 H new ATOM 0 HD13 LEU B 145 -9.148 -8.974 -7.900 1.00 1.32 H new ATOM 0 HD21 LEU B 145 -8.454 -9.483 -4.971 1.00 0.67 H new ATOM 0 HD22 LEU B 145 -9.610 -10.404 -5.961 1.00 0.67 H new ATOM 0 HD23 LEU B 145 -8.292 -11.249 -5.116 1.00 0.67 H new ATOM 2240 N THR B 146 -9.606 -13.302 -9.348 1.00 1.16 N ATOM 2241 CA THR B 146 -9.774 -13.603 -10.782 1.00 1.20 C ATOM 2242 C THR B 146 -9.723 -12.320 -11.622 1.00 0.97 C ATOM 2243 O THR B 146 -10.106 -11.253 -11.133 1.00 0.84 O ATOM 2244 CB THR B 146 -11.093 -14.327 -11.097 1.00 1.47 C ATOM 2245 OG1 THR B 146 -12.196 -13.625 -10.579 1.00 1.60 O ATOM 2246 CG2 THR B 146 -11.117 -15.757 -10.579 1.00 1.66 C ATOM 0 H THR B 146 -10.414 -12.838 -8.932 1.00 1.16 H new ATOM 0 HA THR B 146 -8.947 -14.265 -11.038 1.00 1.20 H new ATOM 0 HB THR B 146 -11.162 -14.363 -12.184 1.00 1.47 H new ATOM 0 HG1 THR B 146 -12.170 -13.652 -9.600 1.00 1.60 H new ATOM 0 HG21 THR B 146 -12.072 -16.219 -10.830 1.00 1.66 H new ATOM 0 HG22 THR B 146 -10.308 -16.324 -11.039 1.00 1.66 H new ATOM 0 HG23 THR B 146 -10.989 -15.754 -9.497 1.00 1.66 H new ATOM 2254 N PRO B 147 -9.337 -12.395 -12.911 1.00 1.01 N ATOM 2255 CA PRO B 147 -9.537 -11.316 -13.883 1.00 1.05 C ATOM 2256 C PRO B 147 -10.961 -10.735 -13.907 1.00 1.06 C ATOM 2257 O PRO B 147 -11.117 -9.529 -14.096 1.00 1.06 O ATOM 2258 CB PRO B 147 -9.207 -11.960 -15.232 1.00 1.25 C ATOM 2259 CG PRO B 147 -8.127 -12.975 -14.877 1.00 1.27 C ATOM 2260 CD PRO B 147 -8.606 -13.496 -13.526 1.00 1.12 C ATOM 0 HA PRO B 147 -8.909 -10.463 -13.627 1.00 1.05 H new ATOM 0 HB2 PRO B 147 -10.081 -12.439 -15.674 1.00 1.25 H new ATOM 0 HB3 PRO B 147 -8.848 -11.225 -15.952 1.00 1.25 H new ATOM 0 HG2 PRO B 147 -8.057 -13.771 -15.619 1.00 1.27 H new ATOM 0 HG3 PRO B 147 -7.142 -12.514 -14.810 1.00 1.27 H new ATOM 0 HD2 PRO B 147 -9.246 -14.370 -13.649 1.00 1.12 H new ATOM 0 HD3 PRO B 147 -7.764 -13.802 -12.904 1.00 1.12 H new ATOM 2268 N SER B 148 -11.986 -11.563 -13.666 1.00 1.13 N ATOM 2269 CA SER B 148 -13.393 -11.149 -13.610 1.00 1.25 C ATOM 2270 C SER B 148 -13.643 -10.092 -12.527 1.00 1.08 C ATOM 2271 O SER B 148 -14.168 -9.015 -12.810 1.00 1.08 O ATOM 2272 CB SER B 148 -14.301 -12.358 -13.335 1.00 1.50 C ATOM 2273 OG SER B 148 -14.071 -13.430 -14.233 1.00 1.67 O ATOM 0 H SER B 148 -11.857 -12.561 -13.501 1.00 1.13 H new ATOM 0 HA SER B 148 -13.628 -10.714 -14.581 1.00 1.25 H new ATOM 0 HB2 SER B 148 -14.140 -12.704 -12.314 1.00 1.50 H new ATOM 0 HB3 SER B 148 -15.344 -12.048 -13.405 1.00 1.50 H new ATOM 0 HG SER B 148 -14.671 -14.174 -14.015 1.00 1.67 H new ATOM 2279 N GLU B 149 -13.254 -10.370 -11.281 1.00 1.03 N ATOM 2280 CA GLU B 149 -13.493 -9.472 -10.139 1.00 0.98 C ATOM 2281 C GLU B 149 -12.422 -8.377 -9.988 1.00 0.85 C ATOM 2282 O GLU B 149 -12.721 -7.302 -9.467 1.00 0.83 O ATOM 2283 CB GLU B 149 -13.765 -10.295 -8.873 1.00 1.06 C ATOM 2284 CG GLU B 149 -12.586 -11.159 -8.404 1.00 0.95 C ATOM 2285 CD GLU B 149 -13.046 -12.441 -7.682 1.00 1.14 C ATOM 2286 OE1 GLU B 149 -14.142 -12.465 -7.060 1.00 2.36 O ATOM 2287 OE2 GLU B 149 -12.330 -13.461 -7.824 1.00 1.23 O ATOM 0 H GLU B 149 -12.762 -11.227 -11.030 1.00 1.03 H new ATOM 0 HA GLU B 149 -14.397 -8.895 -10.335 1.00 0.98 H new ATOM 0 HB2 GLU B 149 -14.043 -9.616 -8.067 1.00 1.06 H new ATOM 0 HB3 GLU B 149 -14.623 -10.943 -9.054 1.00 1.06 H new ATOM 0 HG2 GLU B 149 -11.973 -11.430 -9.264 1.00 0.95 H new ATOM 0 HG3 GLU B 149 -11.955 -10.575 -7.734 1.00 0.95 H new ATOM 2294 N LEU B 150 -11.226 -8.579 -10.558 1.00 0.80 N ATOM 2295 CA LEU B 150 -10.244 -7.525 -10.847 1.00 0.71 C ATOM 2296 C LEU B 150 -10.893 -6.398 -11.675 1.00 0.70 C ATOM 2297 O LEU B 150 -10.904 -5.243 -11.249 1.00 0.67 O ATOM 2298 CB LEU B 150 -9.052 -8.205 -11.560 1.00 0.78 C ATOM 2299 CG LEU B 150 -7.835 -7.392 -12.041 1.00 0.95 C ATOM 2300 CD1 LEU B 150 -8.153 -6.234 -12.980 1.00 2.54 C ATOM 2301 CD2 LEU B 150 -6.999 -6.829 -10.906 1.00 1.64 C ATOM 0 H LEU B 150 -10.906 -9.506 -10.839 1.00 0.80 H new ATOM 0 HA LEU B 150 -9.883 -7.042 -9.939 1.00 0.71 H new ATOM 0 HB2 LEU B 150 -8.674 -8.972 -10.885 1.00 0.78 H new ATOM 0 HB3 LEU B 150 -9.455 -8.719 -12.433 1.00 0.78 H new ATOM 0 HG LEU B 150 -7.275 -8.145 -12.596 1.00 0.95 H new ATOM 0 HD11 LEU B 150 -7.229 -5.728 -13.259 1.00 2.54 H new ATOM 0 HD12 LEU B 150 -8.642 -6.616 -13.876 1.00 2.54 H new ATOM 0 HD13 LEU B 150 -8.815 -5.529 -12.477 1.00 2.54 H new ATOM 0 HD21 LEU B 150 -6.159 -6.268 -11.316 1.00 1.64 H new ATOM 0 HD22 LEU B 150 -7.613 -6.168 -10.295 1.00 1.64 H new ATOM 0 HD23 LEU B 150 -6.623 -7.646 -10.291 1.00 1.64 H new ATOM 2313 N ARG B 151 -11.491 -6.703 -12.838 1.00 0.76 N ATOM 2314 CA ARG B 151 -12.153 -5.665 -13.655 1.00 0.79 C ATOM 2315 C ARG B 151 -13.500 -5.192 -13.110 1.00 0.85 C ATOM 2316 O ARG B 151 -14.008 -4.179 -13.584 1.00 1.11 O ATOM 2317 CB ARG B 151 -12.095 -5.938 -15.166 1.00 0.89 C ATOM 2318 CG ARG B 151 -12.756 -7.202 -15.730 1.00 1.65 C ATOM 2319 CD ARG B 151 -11.902 -7.800 -16.869 1.00 1.25 C ATOM 2320 NE ARG B 151 -12.615 -8.885 -17.562 1.00 2.53 N ATOM 2321 CZ ARG B 151 -13.477 -8.785 -18.557 1.00 2.93 C ATOM 2322 NH1 ARG B 151 -13.935 -7.654 -19.008 1.00 3.24 N ATOM 2323 NH2 ARG B 151 -13.922 -9.855 -19.137 1.00 4.32 N ATOM 0 H ARG B 151 -11.532 -7.643 -13.232 1.00 0.76 H new ATOM 0 HA ARG B 151 -11.535 -4.774 -13.540 1.00 0.79 H new ATOM 0 HB2 ARG B 151 -12.543 -5.082 -15.670 1.00 0.89 H new ATOM 0 HB3 ARG B 151 -11.044 -5.963 -15.454 1.00 0.89 H new ATOM 0 HG2 ARG B 151 -12.881 -7.939 -14.936 1.00 1.65 H new ATOM 0 HG3 ARG B 151 -13.752 -6.963 -16.102 1.00 1.65 H new ATOM 0 HD2 ARG B 151 -11.645 -7.017 -17.583 1.00 1.25 H new ATOM 0 HD3 ARG B 151 -10.965 -8.180 -16.462 1.00 1.25 H new ATOM 0 HE ARG B 151 -12.419 -9.830 -17.233 1.00 2.53 H new ATOM 0 HH11 ARG B 151 -13.629 -6.776 -18.589 1.00 3.24 H new ATOM 0 HH12 ARG B 151 -14.600 -7.645 -19.781 1.00 3.24 H new ATOM 0 HH21 ARG B 151 -13.606 -10.773 -18.825 1.00 4.32 H new ATOM 0 HH22 ARG B 151 -14.588 -9.779 -19.906 1.00 4.32 H new ATOM 2337 N ASP B 152 -14.078 -5.876 -12.123 1.00 0.82 N ATOM 2338 CA ASP B 152 -15.159 -5.312 -11.301 1.00 0.88 C ATOM 2339 C ASP B 152 -14.632 -4.241 -10.324 1.00 0.83 C ATOM 2340 O ASP B 152 -15.045 -3.086 -10.435 1.00 0.99 O ATOM 2341 CB ASP B 152 -15.955 -6.421 -10.595 1.00 1.05 C ATOM 2342 CG ASP B 152 -17.317 -5.933 -10.080 1.00 1.50 C ATOM 2343 OD1 ASP B 152 -18.228 -5.705 -10.914 1.00 2.01 O ATOM 2344 OD2 ASP B 152 -17.518 -5.864 -8.843 1.00 2.70 O ATOM 0 H ASP B 152 -13.816 -6.829 -11.869 1.00 0.82 H new ATOM 0 HA ASP B 152 -15.855 -4.800 -11.966 1.00 0.88 H new ATOM 0 HB2 ASP B 152 -16.108 -7.250 -11.286 1.00 1.05 H new ATOM 0 HB3 ASP B 152 -15.371 -6.806 -9.759 1.00 1.05 H new ATOM 2349 N LEU B 153 -13.681 -4.552 -9.422 1.00 0.74 N ATOM 2350 CA LEU B 153 -13.258 -3.571 -8.403 1.00 0.74 C ATOM 2351 C LEU B 153 -12.544 -2.349 -8.979 1.00 0.70 C ATOM 2352 O LEU B 153 -12.649 -1.270 -8.400 1.00 0.81 O ATOM 2353 CB LEU B 153 -12.509 -4.189 -7.196 1.00 0.77 C ATOM 2354 CG LEU B 153 -10.991 -3.978 -7.021 1.00 0.89 C ATOM 2355 CD1 LEU B 153 -10.586 -4.286 -5.577 1.00 1.02 C ATOM 2356 CD2 LEU B 153 -10.177 -4.896 -7.925 1.00 0.92 C ATOM 0 H LEU B 153 -13.201 -5.451 -9.377 1.00 0.74 H new ATOM 0 HA LEU B 153 -14.198 -3.198 -7.996 1.00 0.74 H new ATOM 0 HB2 LEU B 153 -12.991 -3.815 -6.293 1.00 0.77 H new ATOM 0 HB3 LEU B 153 -12.682 -5.265 -7.227 1.00 0.77 H new ATOM 0 HG LEU B 153 -10.786 -2.940 -7.282 1.00 0.89 H new ATOM 0 HD11 LEU B 153 -9.513 -4.135 -5.460 1.00 1.02 H new ATOM 0 HD12 LEU B 153 -11.122 -3.622 -4.899 1.00 1.02 H new ATOM 0 HD13 LEU B 153 -10.835 -5.321 -5.342 1.00 1.02 H new ATOM 0 HD21 LEU B 153 -9.114 -4.712 -7.768 1.00 0.92 H new ATOM 0 HD22 LEU B 153 -10.405 -5.935 -7.688 1.00 0.92 H new ATOM 0 HD23 LEU B 153 -10.429 -4.698 -8.967 1.00 0.92 H new ATOM 2368 N VAL B 154 -11.852 -2.473 -10.115 1.00 0.61 N ATOM 2369 CA VAL B 154 -11.139 -1.324 -10.689 1.00 0.60 C ATOM 2370 C VAL B 154 -12.116 -0.255 -11.205 1.00 0.63 C ATOM 2371 O VAL B 154 -11.945 0.917 -10.884 1.00 0.69 O ATOM 2372 CB VAL B 154 -10.107 -1.768 -11.745 1.00 0.61 C ATOM 2373 CG1 VAL B 154 -9.465 -0.571 -12.453 1.00 0.69 C ATOM 2374 CG2 VAL B 154 -8.963 -2.557 -11.099 1.00 0.60 C ATOM 0 H VAL B 154 -11.769 -3.339 -10.648 1.00 0.61 H new ATOM 0 HA VAL B 154 -10.567 -0.849 -9.892 1.00 0.60 H new ATOM 0 HB VAL B 154 -10.657 -2.382 -12.458 1.00 0.61 H new ATOM 0 HG11 VAL B 154 -8.744 -0.927 -13.189 1.00 0.69 H new ATOM 0 HG12 VAL B 154 -10.237 0.012 -12.954 1.00 0.69 H new ATOM 0 HG13 VAL B 154 -8.956 0.055 -11.720 1.00 0.69 H new ATOM 0 HG21 VAL B 154 -8.250 -2.858 -11.866 1.00 0.60 H new ATOM 0 HG22 VAL B 154 -8.460 -1.931 -10.362 1.00 0.60 H new ATOM 0 HG23 VAL B 154 -9.364 -3.444 -10.609 1.00 0.60 H new ATOM 2384 N THR B 155 -13.192 -0.623 -11.912 1.00 0.68 N ATOM 2385 CA THR B 155 -14.225 0.364 -12.315 1.00 0.83 C ATOM 2386 C THR B 155 -15.148 0.761 -11.156 1.00 0.78 C ATOM 2387 O THR B 155 -15.531 1.929 -11.034 1.00 1.01 O ATOM 2388 CB THR B 155 -15.015 -0.092 -13.554 1.00 1.04 C ATOM 2389 OG1 THR B 155 -15.871 0.936 -13.999 1.00 1.29 O ATOM 2390 CG2 THR B 155 -15.893 -1.324 -13.345 1.00 1.01 C ATOM 0 H THR B 155 -13.377 -1.579 -12.217 1.00 0.68 H new ATOM 0 HA THR B 155 -13.686 1.267 -12.600 1.00 0.83 H new ATOM 0 HB THR B 155 -14.241 -0.345 -14.279 1.00 1.04 H new ATOM 0 HG1 THR B 155 -16.365 0.631 -14.788 1.00 1.29 H new ATOM 0 HG21 THR B 155 -16.408 -1.566 -14.275 1.00 1.01 H new ATOM 0 HG22 THR B 155 -15.271 -2.167 -13.045 1.00 1.01 H new ATOM 0 HG23 THR B 155 -16.627 -1.120 -12.566 1.00 1.01 H new ATOM 2398 N GLN B 156 -15.469 -0.176 -10.254 1.00 0.62 N ATOM 2399 CA GLN B 156 -16.382 0.086 -9.139 1.00 0.68 C ATOM 2400 C GLN B 156 -15.740 0.880 -7.986 1.00 0.70 C ATOM 2401 O GLN B 156 -16.475 1.573 -7.277 1.00 1.01 O ATOM 2402 CB GLN B 156 -17.015 -1.232 -8.643 1.00 0.80 C ATOM 2403 CG GLN B 156 -17.956 -1.923 -9.659 1.00 1.17 C ATOM 2404 CD GLN B 156 -19.315 -1.241 -9.812 1.00 1.53 C ATOM 2405 OE1 GLN B 156 -19.457 -0.035 -9.647 1.00 1.93 O ATOM 2406 NE2 GLN B 156 -20.366 -1.952 -10.149 1.00 2.26 N ATOM 0 H GLN B 156 -15.105 -1.129 -10.278 1.00 0.62 H new ATOM 0 HA GLN B 156 -17.170 0.733 -9.525 1.00 0.68 H new ATOM 0 HB2 GLN B 156 -16.216 -1.925 -8.379 1.00 0.80 H new ATOM 0 HB3 GLN B 156 -17.575 -1.029 -7.730 1.00 0.80 H new ATOM 0 HG2 GLN B 156 -17.465 -1.953 -10.631 1.00 1.17 H new ATOM 0 HG3 GLN B 156 -18.112 -2.956 -9.349 1.00 1.17 H new ATOM 0 HE21 GLN B 156 -20.277 -2.958 -10.293 1.00 2.26 H new ATOM 0 HE22 GLN B 156 -21.272 -1.499 -10.267 1.00 2.26 H new ATOM 2415 N GLN B 157 -14.411 0.831 -7.802 1.00 0.56 N ATOM 2416 CA GLN B 157 -13.707 1.515 -6.703 1.00 0.64 C ATOM 2417 C GLN B 157 -12.553 2.452 -7.109 1.00 0.61 C ATOM 2418 O GLN B 157 -12.279 3.354 -6.318 1.00 0.78 O ATOM 2419 CB GLN B 157 -13.198 0.513 -5.650 1.00 0.79 C ATOM 2420 CG GLN B 157 -14.252 -0.468 -5.110 1.00 0.91 C ATOM 2421 CD GLN B 157 -13.957 -0.870 -3.669 1.00 1.03 C ATOM 2422 OE1 GLN B 157 -14.371 -0.220 -2.710 1.00 1.38 O ATOM 2423 NE2 GLN B 157 -13.199 -1.926 -3.464 1.00 1.81 N ATOM 0 H GLN B 157 -13.787 0.310 -8.418 1.00 0.56 H new ATOM 0 HA GLN B 157 -14.477 2.164 -6.286 1.00 0.64 H new ATOM 0 HB2 GLN B 157 -12.380 -0.062 -6.085 1.00 0.79 H new ATOM 0 HB3 GLN B 157 -12.783 1.072 -4.811 1.00 0.79 H new ATOM 0 HG2 GLN B 157 -15.239 -0.009 -5.166 1.00 0.91 H new ATOM 0 HG3 GLN B 157 -14.278 -1.358 -5.739 1.00 0.91 H new ATOM 0 HE21 GLN B 157 -12.854 -2.468 -4.256 1.00 1.81 H new ATOM 0 HE22 GLN B 157 -12.957 -2.203 -2.513 1.00 1.81 H new ATOM 2432 N LEU B 158 -11.906 2.300 -8.283 1.00 0.51 N ATOM 2433 CA LEU B 158 -10.769 3.142 -8.730 1.00 0.52 C ATOM 2434 C LEU B 158 -11.061 4.032 -9.977 1.00 0.58 C ATOM 2435 O LEU B 158 -10.267 4.032 -10.927 1.00 0.64 O ATOM 2436 CB LEU B 158 -9.510 2.272 -8.988 1.00 0.56 C ATOM 2437 CG LEU B 158 -9.035 1.324 -7.880 1.00 0.58 C ATOM 2438 CD1 LEU B 158 -7.828 0.530 -8.377 1.00 0.66 C ATOM 2439 CD2 LEU B 158 -8.581 2.066 -6.622 1.00 0.67 C ATOM 0 H LEU B 158 -12.160 1.580 -8.959 1.00 0.51 H new ATOM 0 HA LEU B 158 -10.593 3.833 -7.906 1.00 0.52 H new ATOM 0 HB2 LEU B 158 -9.698 1.673 -9.879 1.00 0.56 H new ATOM 0 HB3 LEU B 158 -8.685 2.944 -9.225 1.00 0.56 H new ATOM 0 HG LEU B 158 -9.884 0.686 -7.634 1.00 0.58 H new ATOM 0 HD11 LEU B 158 -7.488 -0.145 -7.591 1.00 0.66 H new ATOM 0 HD12 LEU B 158 -8.110 -0.049 -9.256 1.00 0.66 H new ATOM 0 HD13 LEU B 158 -7.023 1.217 -8.639 1.00 0.66 H new ATOM 0 HD21 LEU B 158 -8.256 1.345 -5.872 1.00 0.67 H new ATOM 0 HD22 LEU B 158 -7.753 2.730 -6.870 1.00 0.67 H new ATOM 0 HD23 LEU B 158 -9.410 2.652 -6.226 1.00 0.67 H new ATOM 2451 N PRO B 159 -12.155 4.821 -10.038 1.00 0.65 N ATOM 2452 CA PRO B 159 -12.435 5.673 -11.196 1.00 0.85 C ATOM 2453 C PRO B 159 -11.500 6.890 -11.312 1.00 0.93 C ATOM 2454 O PRO B 159 -11.335 7.409 -12.416 1.00 1.10 O ATOM 2455 CB PRO B 159 -13.898 6.098 -11.037 1.00 1.01 C ATOM 2456 CG PRO B 159 -14.086 6.124 -9.524 1.00 0.89 C ATOM 2457 CD PRO B 159 -13.213 4.964 -9.051 1.00 0.68 C ATOM 0 HA PRO B 159 -12.258 5.124 -12.121 1.00 0.85 H new ATOM 0 HB2 PRO B 159 -14.085 7.074 -11.484 1.00 1.01 H new ATOM 0 HB3 PRO B 159 -14.577 5.393 -11.516 1.00 1.01 H new ATOM 0 HG2 PRO B 159 -13.765 7.073 -9.093 1.00 0.89 H new ATOM 0 HG3 PRO B 159 -15.130 5.984 -9.244 1.00 0.89 H new ATOM 0 HD2 PRO B 159 -12.799 5.167 -8.063 1.00 0.68 H new ATOM 0 HD3 PRO B 159 -13.796 4.046 -8.970 1.00 0.68 H new ATOM 2465 N HIS B 160 -10.894 7.369 -10.222 1.00 0.90 N ATOM 2466 CA HIS B 160 -9.963 8.502 -10.235 1.00 1.06 C ATOM 2467 C HIS B 160 -8.510 8.070 -10.495 1.00 1.13 C ATOM 2468 O HIS B 160 -7.816 8.690 -11.307 1.00 1.20 O ATOM 2469 CB HIS B 160 -10.087 9.291 -8.918 1.00 1.12 C ATOM 2470 CG HIS B 160 -11.499 9.613 -8.517 1.00 1.14 C ATOM 2471 ND1 HIS B 160 -12.273 8.862 -7.670 1.00 1.02 N ATOM 2472 CD2 HIS B 160 -12.248 10.691 -8.904 1.00 1.38 C ATOM 2473 CE1 HIS B 160 -13.463 9.463 -7.557 1.00 1.17 C ATOM 2474 NE2 HIS B 160 -13.502 10.591 -8.286 1.00 1.41 N ATOM 0 H HIS B 160 -11.038 6.975 -9.292 1.00 0.90 H new ATOM 0 HA HIS B 160 -10.238 9.150 -11.067 1.00 1.06 H new ATOM 0 HB2 HIS B 160 -9.617 8.717 -8.119 1.00 1.12 H new ATOM 0 HB3 HIS B 160 -9.528 10.222 -9.012 1.00 1.12 H new ATOM 0 HD1 HIS B 160 -11.991 7.998 -7.208 1.00 1.02 H new ATOM 0 HD2 HIS B 160 -11.929 11.480 -9.569 1.00 1.38 H new ATOM 0 HE1 HIS B 160 -14.282 9.091 -6.960 1.00 1.17 H new ATOM 2482 N LEU B 161 -8.046 7.031 -9.789 1.00 1.19 N ATOM 2483 CA LEU B 161 -6.616 6.779 -9.539 1.00 1.57 C ATOM 2484 C LEU B 161 -5.887 5.949 -10.617 1.00 1.92 C ATOM 2485 O LEU B 161 -4.734 6.241 -10.930 1.00 2.28 O ATOM 2486 CB LEU B 161 -6.510 6.163 -8.131 1.00 1.69 C ATOM 2487 CG LEU B 161 -5.084 5.856 -7.638 1.00 1.48 C ATOM 2488 CD1 LEU B 161 -4.166 7.077 -7.610 1.00 2.58 C ATOM 2489 CD2 LEU B 161 -5.155 5.301 -6.214 1.00 2.52 C ATOM 0 H LEU B 161 -8.658 6.332 -9.369 1.00 1.19 H new ATOM 0 HA LEU B 161 -6.084 7.729 -9.596 1.00 1.57 H new ATOM 0 HB2 LEU B 161 -6.981 6.843 -7.421 1.00 1.69 H new ATOM 0 HB3 LEU B 161 -7.086 5.238 -8.116 1.00 1.69 H new ATOM 0 HG LEU B 161 -4.666 5.140 -8.346 1.00 1.48 H new ATOM 0 HD11 LEU B 161 -3.179 6.782 -7.252 1.00 2.58 H new ATOM 0 HD12 LEU B 161 -4.079 7.490 -8.615 1.00 2.58 H new ATOM 0 HD13 LEU B 161 -4.584 7.831 -6.943 1.00 2.58 H new ATOM 0 HD21 LEU B 161 -4.148 5.081 -5.859 1.00 2.52 H new ATOM 0 HD22 LEU B 161 -5.618 6.039 -5.559 1.00 2.52 H new ATOM 0 HD23 LEU B 161 -5.749 4.387 -6.209 1.00 2.52 H new ATOM 2501 N MET B 162 -6.527 4.939 -11.214 1.00 1.93 N ATOM 2502 CA MET B 162 -6.009 4.263 -12.420 1.00 2.24 C ATOM 2503 C MET B 162 -7.161 3.860 -13.362 1.00 2.28 C ATOM 2504 O MET B 162 -7.596 2.704 -13.371 1.00 2.69 O ATOM 2505 CB MET B 162 -5.018 3.129 -12.092 1.00 2.76 C ATOM 2506 CG MET B 162 -5.451 2.013 -11.145 1.00 2.43 C ATOM 2507 SD MET B 162 -4.186 0.710 -11.140 1.00 3.34 S ATOM 2508 CE MET B 162 -5.038 -0.574 -10.205 1.00 4.62 C ATOM 0 H MET B 162 -7.415 4.564 -10.881 1.00 1.93 H new ATOM 0 HA MET B 162 -5.404 4.979 -12.976 1.00 2.24 H new ATOM 0 HB2 MET B 162 -4.727 2.665 -13.034 1.00 2.76 H new ATOM 0 HB3 MET B 162 -4.123 3.587 -11.672 1.00 2.76 H new ATOM 0 HG2 MET B 162 -5.588 2.407 -10.138 1.00 2.43 H new ATOM 0 HG3 MET B 162 -6.411 1.604 -11.461 1.00 2.43 H new ATOM 0 HE1 MET B 162 -4.436 -1.483 -10.203 1.00 4.62 H new ATOM 0 HE2 MET B 162 -5.189 -0.237 -9.179 1.00 4.62 H new ATOM 0 HE3 MET B 162 -6.004 -0.779 -10.666 1.00 4.62 H new ATOM 2518 N PRO B 163 -7.707 4.829 -14.124 1.00 2.16 N ATOM 2519 CA PRO B 163 -9.016 4.718 -14.760 1.00 2.32 C ATOM 2520 C PRO B 163 -9.082 3.743 -15.940 1.00 2.23 C ATOM 2521 O PRO B 163 -8.083 3.393 -16.576 1.00 2.18 O ATOM 2522 CB PRO B 163 -9.373 6.140 -15.211 1.00 2.56 C ATOM 2523 CG PRO B 163 -8.011 6.792 -15.432 1.00 2.50 C ATOM 2524 CD PRO B 163 -7.175 6.174 -14.318 1.00 2.25 C ATOM 0 HA PRO B 163 -9.724 4.300 -14.044 1.00 2.32 H new ATOM 0 HB2 PRO B 163 -9.969 6.135 -16.124 1.00 2.56 H new ATOM 0 HB3 PRO B 163 -9.953 6.668 -14.454 1.00 2.56 H new ATOM 0 HG2 PRO B 163 -7.606 6.566 -16.418 1.00 2.50 H new ATOM 0 HG3 PRO B 163 -8.061 7.878 -15.349 1.00 2.50 H new ATOM 0 HD2 PRO B 163 -6.120 6.142 -14.592 1.00 2.25 H new ATOM 0 HD3 PRO B 163 -7.249 6.760 -13.402 1.00 2.25 H new ATOM 2575 N LEU B 168 -9.229 -0.982 -18.732 1.00 1.90 N ATOM 2576 CA LEU B 168 -8.789 -1.698 -17.517 1.00 1.47 C ATOM 2577 C LEU B 168 -8.374 -3.155 -17.785 1.00 1.31 C ATOM 2578 O LEU B 168 -7.652 -3.738 -16.990 1.00 1.25 O ATOM 2579 CB LEU B 168 -9.772 -1.532 -16.343 1.00 1.26 C ATOM 2580 CG LEU B 168 -11.264 -1.798 -16.591 1.00 1.20 C ATOM 2581 CD1 LEU B 168 -11.550 -3.110 -17.312 1.00 1.28 C ATOM 2582 CD2 LEU B 168 -11.986 -1.820 -15.246 1.00 1.67 C ATOM 0 HA LEU B 168 -7.870 -1.209 -17.194 1.00 1.47 H new ATOM 0 HB2 LEU B 168 -9.446 -2.195 -15.542 1.00 1.26 H new ATOM 0 HB3 LEU B 168 -9.675 -0.512 -15.971 1.00 1.26 H new ATOM 0 HG LEU B 168 -11.619 -0.998 -17.240 1.00 1.20 H new ATOM 0 HD11 LEU B 168 -12.625 -3.223 -17.449 1.00 1.28 H new ATOM 0 HD12 LEU B 168 -11.059 -3.105 -18.285 1.00 1.28 H new ATOM 0 HD13 LEU B 168 -11.170 -3.942 -16.718 1.00 1.28 H new ATOM 0 HD21 LEU B 168 -13.048 -2.008 -15.406 1.00 1.67 H new ATOM 0 HD22 LEU B 168 -11.568 -2.609 -14.621 1.00 1.67 H new ATOM 0 HD23 LEU B 168 -11.859 -0.858 -14.749 1.00 1.67 H new ATOM 2594 N GLU B 169 -8.716 -3.718 -18.941 1.00 1.38 N ATOM 2595 CA GLU B 169 -8.129 -4.954 -19.477 1.00 1.31 C ATOM 2596 C GLU B 169 -6.594 -4.911 -19.641 1.00 1.26 C ATOM 2597 O GLU B 169 -5.957 -5.962 -19.565 1.00 1.19 O ATOM 2598 CB GLU B 169 -8.840 -5.328 -20.787 1.00 1.43 C ATOM 2599 CG GLU B 169 -8.738 -4.195 -21.807 1.00 1.54 C ATOM 2600 CD GLU B 169 -9.513 -4.486 -23.086 1.00 1.87 C ATOM 2601 OE1 GLU B 169 -10.755 -4.309 -23.088 1.00 2.47 O ATOM 2602 OE2 GLU B 169 -8.885 -4.820 -24.119 1.00 2.74 O ATOM 0 H GLU B 169 -9.429 -3.320 -19.552 1.00 1.38 H new ATOM 0 HA GLU B 169 -8.294 -5.735 -18.735 1.00 1.31 H new ATOM 0 HB2 GLU B 169 -8.397 -6.235 -21.199 1.00 1.43 H new ATOM 0 HB3 GLU B 169 -9.888 -5.548 -20.586 1.00 1.43 H new ATOM 0 HG2 GLU B 169 -9.114 -3.274 -21.361 1.00 1.54 H new ATOM 0 HG3 GLU B 169 -7.690 -4.025 -22.053 1.00 1.54 H new ATOM 2609 N GLU B 170 -5.960 -3.730 -19.742 1.00 1.32 N ATOM 2610 CA GLU B 170 -4.492 -3.611 -19.781 1.00 1.32 C ATOM 2611 C GLU B 170 -3.856 -4.168 -18.496 1.00 1.23 C ATOM 2612 O GLU B 170 -2.728 -4.660 -18.503 1.00 1.26 O ATOM 2613 CB GLU B 170 -4.064 -2.145 -20.036 1.00 1.40 C ATOM 2614 CG GLU B 170 -4.003 -1.255 -18.776 1.00 2.32 C ATOM 2615 CD GLU B 170 -3.522 0.185 -19.010 1.00 2.67 C ATOM 2616 OE1 GLU B 170 -2.823 0.469 -20.017 1.00 2.87 O ATOM 2617 OE2 GLU B 170 -3.745 1.023 -18.103 1.00 3.65 O ATOM 0 H GLU B 170 -6.447 -2.836 -19.799 1.00 1.32 H new ATOM 0 HA GLU B 170 -4.126 -4.212 -20.613 1.00 1.32 H new ATOM 0 HB2 GLU B 170 -3.082 -2.146 -20.510 1.00 1.40 H new ATOM 0 HB3 GLU B 170 -4.760 -1.697 -20.746 1.00 1.40 H new ATOM 0 HG2 GLU B 170 -4.996 -1.220 -18.328 1.00 2.32 H new ATOM 0 HG3 GLU B 170 -3.342 -1.728 -18.050 1.00 2.32 H new ATOM 2624 N LYS B 171 -4.610 -4.121 -17.392 1.00 1.18 N ATOM 2625 CA LYS B 171 -4.212 -4.580 -16.061 1.00 1.14 C ATOM 2626 C LYS B 171 -4.136 -6.109 -16.004 1.00 1.03 C ATOM 2627 O LYS B 171 -3.183 -6.661 -15.461 1.00 1.12 O ATOM 2628 CB LYS B 171 -5.189 -3.952 -15.040 1.00 1.21 C ATOM 2629 CG LYS B 171 -5.266 -2.428 -15.078 1.00 1.45 C ATOM 2630 CD LYS B 171 -3.876 -1.839 -14.859 1.00 1.65 C ATOM 2631 CE LYS B 171 -4.011 -0.411 -14.378 1.00 1.90 C ATOM 2632 NZ LYS B 171 -4.468 0.507 -15.453 1.00 2.96 N ATOM 0 H LYS B 171 -5.558 -3.744 -17.405 1.00 1.18 H new ATOM 0 HA LYS B 171 -3.203 -4.251 -15.810 1.00 1.14 H new ATOM 0 HB2 LYS B 171 -6.186 -4.356 -15.217 1.00 1.21 H new ATOM 0 HB3 LYS B 171 -4.893 -4.261 -14.038 1.00 1.21 H new ATOM 0 HG2 LYS B 171 -5.665 -2.098 -16.037 1.00 1.45 H new ATOM 0 HG3 LYS B 171 -5.949 -2.069 -14.308 1.00 1.45 H new ATOM 0 HD2 LYS B 171 -3.328 -2.432 -14.127 1.00 1.65 H new ATOM 0 HD3 LYS B 171 -3.304 -1.870 -15.787 1.00 1.65 H new ATOM 0 HE2 LYS B 171 -4.717 -0.375 -13.548 1.00 1.90 H new ATOM 0 HE3 LYS B 171 -3.050 -0.067 -13.994 1.00 1.90 H new ATOM 0 HZ1 LYS B 171 -4.384 1.491 -15.128 1.00 2.96 H new ATOM 0 HZ2 LYS B 171 -3.880 0.370 -16.300 1.00 2.96 H new ATOM 0 HZ3 LYS B 171 -5.461 0.303 -15.685 1.00 2.96 H new ATOM 2646 N ILE B 172 -5.072 -6.786 -16.672 1.00 0.95 N ATOM 2647 CA ILE B 172 -5.117 -8.249 -16.847 1.00 0.93 C ATOM 2648 C ILE B 172 -4.069 -8.728 -17.870 1.00 1.08 C ATOM 2649 O ILE B 172 -3.497 -9.811 -17.717 1.00 1.21 O ATOM 2650 CB ILE B 172 -6.556 -8.670 -17.212 1.00 0.93 C ATOM 2651 CG1 ILE B 172 -7.547 -8.276 -16.083 1.00 0.86 C ATOM 2652 CG2 ILE B 172 -6.703 -10.170 -17.483 1.00 1.09 C ATOM 2653 CD1 ILE B 172 -8.332 -7.035 -16.489 1.00 1.07 C ATOM 0 H ILE B 172 -5.854 -6.315 -17.127 1.00 0.95 H new ATOM 0 HA ILE B 172 -4.851 -8.739 -15.910 1.00 0.93 H new ATOM 0 HB ILE B 172 -6.789 -8.139 -18.135 1.00 0.93 H new ATOM 0 HG12 ILE B 172 -8.232 -9.101 -15.884 1.00 0.86 H new ATOM 0 HG13 ILE B 172 -7.001 -8.085 -15.159 1.00 0.86 H new ATOM 0 HG21 ILE B 172 -7.740 -10.395 -17.733 1.00 1.09 H new ATOM 0 HG22 ILE B 172 -6.059 -10.454 -18.315 1.00 1.09 H new ATOM 0 HG23 ILE B 172 -6.415 -10.730 -16.594 1.00 1.09 H new ATOM 0 HD11 ILE B 172 -9.025 -6.766 -15.692 1.00 1.07 H new ATOM 0 HD12 ILE B 172 -7.642 -6.210 -16.665 1.00 1.07 H new ATOM 0 HD13 ILE B 172 -8.892 -7.241 -17.401 1.00 1.07 H new ATOM 2665 N ALA B 173 -3.744 -7.890 -18.861 1.00 1.14 N ATOM 2666 CA ALA B 173 -2.648 -8.119 -19.803 1.00 1.29 C ATOM 2667 C ALA B 173 -1.245 -7.898 -19.188 1.00 1.35 C ATOM 2668 O ALA B 173 -0.271 -8.483 -19.671 1.00 1.50 O ATOM 2669 CB ALA B 173 -2.879 -7.218 -21.023 1.00 1.41 C ATOM 0 H ALA B 173 -4.246 -7.019 -19.032 1.00 1.14 H new ATOM 0 HA ALA B 173 -2.656 -9.169 -20.094 1.00 1.29 H new ATOM 0 HB1 ALA B 173 -2.075 -7.368 -21.744 1.00 1.41 H new ATOM 0 HB2 ALA B 173 -3.833 -7.470 -21.486 1.00 1.41 H new ATOM 0 HB3 ALA B 173 -2.893 -6.175 -20.707 1.00 1.41 H new ATOM 2675 N ASN B 174 -1.119 -7.099 -18.119 1.00 1.33 N ATOM 2676 CA ASN B 174 0.149 -6.834 -17.420 1.00 1.46 C ATOM 2677 C ASN B 174 0.492 -7.938 -16.405 1.00 1.39 C ATOM 2678 O ASN B 174 1.631 -8.411 -16.376 1.00 1.55 O ATOM 2679 CB ASN B 174 0.102 -5.449 -16.744 1.00 1.61 C ATOM 2680 CG ASN B 174 0.723 -4.352 -17.593 1.00 1.81 C ATOM 2681 OD1 ASN B 174 1.885 -4.007 -17.427 1.00 2.33 O ATOM 2682 ND2 ASN B 174 -0.011 -3.793 -18.525 1.00 2.13 N ATOM 0 H ASN B 174 -1.912 -6.608 -17.706 1.00 1.33 H new ATOM 0 HA ASN B 174 0.946 -6.835 -18.163 1.00 1.46 H new ATOM 0 HB2 ASN B 174 -0.935 -5.191 -16.529 1.00 1.61 H new ATOM 0 HB3 ASN B 174 0.623 -5.500 -15.788 1.00 1.61 H new ATOM 0 HD21 ASN B 174 0.386 -3.065 -19.118 1.00 2.13 H new ATOM 0 HD22 ASN B 174 -0.979 -4.087 -18.657 1.00 2.13 H new ATOM 2689 N LEU B 175 -0.490 -8.396 -15.615 1.00 1.24 N ATOM 2690 CA LEU B 175 -0.320 -9.484 -14.632 1.00 1.20 C ATOM 2691 C LEU B 175 -0.115 -10.880 -15.250 1.00 1.30 C ATOM 2692 O LEU B 175 0.199 -11.829 -14.536 1.00 1.47 O ATOM 2693 CB LEU B 175 -1.449 -9.451 -13.596 1.00 1.13 C ATOM 2694 CG LEU B 175 -2.869 -9.689 -14.137 1.00 1.33 C ATOM 2695 CD1 LEU B 175 -3.246 -11.152 -14.379 1.00 1.40 C ATOM 2696 CD2 LEU B 175 -3.838 -9.109 -13.118 1.00 1.90 C ATOM 0 H LEU B 175 -1.437 -8.019 -15.639 1.00 1.24 H new ATOM 0 HA LEU B 175 0.622 -9.290 -14.119 1.00 1.20 H new ATOM 0 HB2 LEU B 175 -1.240 -10.204 -12.836 1.00 1.13 H new ATOM 0 HB3 LEU B 175 -1.429 -8.482 -13.098 1.00 1.13 H new ATOM 0 HG LEU B 175 -2.914 -9.213 -15.116 1.00 1.33 H new ATOM 0 HD11 LEU B 175 -4.266 -11.207 -14.759 1.00 1.40 H new ATOM 0 HD12 LEU B 175 -2.563 -11.588 -15.108 1.00 1.40 H new ATOM 0 HD13 LEU B 175 -3.178 -11.705 -13.442 1.00 1.40 H new ATOM 0 HD21 LEU B 175 -4.861 -9.257 -13.464 1.00 1.90 H new ATOM 0 HD22 LEU B 175 -3.702 -9.611 -12.160 1.00 1.90 H new ATOM 0 HD23 LEU B 175 -3.646 -8.043 -12.999 1.00 1.90 H new ATOM 2796 N LEU B 183 -2.862 -15.346 -8.825 1.00 1.61 N ATOM 2797 CA LEU B 183 -3.115 -13.940 -8.460 1.00 1.75 C ATOM 2798 C LEU B 183 -3.189 -13.743 -6.932 1.00 2.03 C ATOM 2799 O LEU B 183 -4.206 -13.300 -6.400 1.00 3.39 O ATOM 2800 CB LEU B 183 -4.389 -13.408 -9.155 1.00 1.79 C ATOM 2801 CG LEU B 183 -4.270 -13.060 -10.645 1.00 2.12 C ATOM 2802 CD1 LEU B 183 -4.271 -14.273 -11.576 1.00 2.28 C ATOM 2803 CD2 LEU B 183 -5.456 -12.167 -11.026 1.00 2.98 C ATOM 0 HA LEU B 183 -2.266 -13.356 -8.816 1.00 1.75 H new ATOM 0 HB2 LEU B 183 -5.175 -14.155 -9.042 1.00 1.79 H new ATOM 0 HB3 LEU B 183 -4.719 -12.516 -8.623 1.00 1.79 H new ATOM 0 HG LEU B 183 -3.307 -12.566 -10.773 1.00 2.12 H new ATOM 0 HD11 LEU B 183 -4.184 -13.938 -12.610 1.00 2.28 H new ATOM 0 HD12 LEU B 183 -3.429 -14.920 -11.332 1.00 2.28 H new ATOM 0 HD13 LEU B 183 -5.202 -14.827 -11.451 1.00 2.28 H new ATOM 0 HD21 LEU B 183 -5.391 -11.907 -12.083 1.00 2.98 H new ATOM 0 HD22 LEU B 183 -6.388 -12.701 -10.840 1.00 2.98 H new ATOM 0 HD23 LEU B 183 -5.433 -11.257 -10.427 1.00 2.98 H new ATOM 2815 N GLU B 184 -2.118 -14.083 -6.217 1.00 1.08 N ATOM 2816 CA GLU B 184 -2.001 -13.902 -4.761 1.00 1.09 C ATOM 2817 C GLU B 184 -1.884 -12.404 -4.384 1.00 0.92 C ATOM 2818 O GLU B 184 -1.782 -11.532 -5.256 1.00 0.89 O ATOM 2819 CB GLU B 184 -0.811 -14.731 -4.238 1.00 1.27 C ATOM 2820 CG GLU B 184 -0.931 -16.241 -4.525 1.00 1.89 C ATOM 2821 CD GLU B 184 0.269 -17.048 -4.007 1.00 2.30 C ATOM 2822 OE1 GLU B 184 1.413 -16.537 -4.035 1.00 2.34 O ATOM 2823 OE2 GLU B 184 0.086 -18.235 -3.633 1.00 3.79 O ATOM 0 H GLU B 184 -1.288 -14.501 -6.637 1.00 1.08 H new ATOM 0 HA GLU B 184 -2.909 -14.264 -4.280 1.00 1.09 H new ATOM 0 HB2 GLU B 184 0.107 -14.357 -4.690 1.00 1.27 H new ATOM 0 HB3 GLU B 184 -0.721 -14.581 -3.162 1.00 1.27 H new ATOM 0 HG2 GLU B 184 -1.843 -16.621 -4.065 1.00 1.89 H new ATOM 0 HG3 GLU B 184 -1.028 -16.394 -5.600 1.00 1.89 H new ATOM 2830 N PHE B 185 -1.878 -12.067 -3.088 1.00 1.04 N ATOM 2831 CA PHE B 185 -1.827 -10.668 -2.635 1.00 1.23 C ATOM 2832 C PHE B 185 -0.592 -9.915 -3.163 1.00 1.23 C ATOM 2833 O PHE B 185 -0.705 -8.744 -3.514 1.00 1.35 O ATOM 2834 CB PHE B 185 -1.912 -10.582 -1.102 1.00 1.56 C ATOM 2835 CG PHE B 185 -1.820 -9.153 -0.592 1.00 1.99 C ATOM 2836 CD1 PHE B 185 -2.919 -8.283 -0.725 1.00 2.94 C ATOM 2837 CD2 PHE B 185 -0.609 -8.664 -0.064 1.00 2.80 C ATOM 2838 CE1 PHE B 185 -2.803 -6.930 -0.363 1.00 3.57 C ATOM 2839 CE2 PHE B 185 -0.496 -7.315 0.317 1.00 3.32 C ATOM 2840 CZ PHE B 185 -1.592 -6.446 0.164 1.00 3.36 C ATOM 0 H PHE B 185 -1.908 -12.748 -2.329 1.00 1.04 H new ATOM 0 HA PHE B 185 -2.699 -10.171 -3.059 1.00 1.23 H new ATOM 0 HB2 PHE B 185 -2.851 -11.023 -0.768 1.00 1.56 H new ATOM 0 HB3 PHE B 185 -1.108 -11.173 -0.663 1.00 1.56 H new ATOM 0 HD1 PHE B 185 -3.857 -8.658 -1.108 1.00 2.94 H new ATOM 0 HD2 PHE B 185 0.236 -9.327 0.049 1.00 2.80 H new ATOM 0 HE1 PHE B 185 -3.643 -6.263 -0.489 1.00 3.57 H new ATOM 0 HE2 PHE B 185 0.432 -6.946 0.727 1.00 3.32 H new ATOM 0 HZ PHE B 185 -1.504 -5.409 0.451 1.00 3.36 H new ATOM 2850 N ARG B 186 0.562 -10.573 -3.334 1.00 1.24 N ATOM 2851 CA ARG B 186 1.761 -9.969 -3.949 1.00 1.42 C ATOM 2852 C ARG B 186 1.562 -9.578 -5.432 1.00 1.43 C ATOM 2853 O ARG B 186 2.290 -8.725 -5.931 1.00 1.80 O ATOM 2854 CB ARG B 186 2.978 -10.877 -3.706 1.00 1.49 C ATOM 2855 CG ARG B 186 4.301 -10.142 -3.992 1.00 1.81 C ATOM 2856 CD ARG B 186 5.492 -11.072 -3.798 1.00 2.57 C ATOM 2857 NE ARG B 186 5.586 -12.081 -4.870 1.00 3.36 N ATOM 2858 CZ ARG B 186 6.489 -13.038 -4.948 1.00 4.41 C ATOM 2859 NH1 ARG B 186 7.461 -13.151 -4.093 1.00 4.95 N ATOM 2860 NH2 ARG B 186 6.428 -13.921 -5.895 1.00 5.47 N ATOM 0 H ARG B 186 0.695 -11.544 -3.050 1.00 1.24 H new ATOM 0 HA ARG B 186 1.952 -9.015 -3.458 1.00 1.42 H new ATOM 0 HB2 ARG B 186 2.971 -11.227 -2.674 1.00 1.49 H new ATOM 0 HB3 ARG B 186 2.907 -11.760 -4.342 1.00 1.49 H new ATOM 0 HG2 ARG B 186 4.296 -9.759 -5.013 1.00 1.81 H new ATOM 0 HG3 ARG B 186 4.394 -9.282 -3.329 1.00 1.81 H new ATOM 0 HD2 ARG B 186 6.410 -10.485 -3.771 1.00 2.57 H new ATOM 0 HD3 ARG B 186 5.407 -11.574 -2.834 1.00 2.57 H new ATOM 0 HE ARG B 186 4.892 -12.034 -5.616 1.00 3.36 H new ATOM 0 HH11 ARG B 186 7.546 -12.484 -3.326 1.00 4.95 H new ATOM 0 HH12 ARG B 186 8.139 -13.907 -4.189 1.00 4.95 H new ATOM 0 HH21 ARG B 186 5.678 -13.878 -6.585 1.00 5.47 H new ATOM 0 HH22 ARG B 186 7.130 -14.659 -5.950 1.00 5.47 H new ATOM 2874 N SER B 187 0.568 -10.125 -6.140 1.00 1.18 N ATOM 2875 CA SER B 187 0.142 -9.605 -7.455 1.00 1.16 C ATOM 2876 C SER B 187 -0.780 -8.387 -7.298 1.00 0.91 C ATOM 2877 O SER B 187 -0.516 -7.339 -7.889 1.00 0.91 O ATOM 2878 CB SER B 187 -0.514 -10.713 -8.289 1.00 1.28 C ATOM 2879 OG SER B 187 -0.899 -10.231 -9.563 1.00 3.22 O ATOM 0 H SER B 187 0.035 -10.936 -5.825 1.00 1.18 H new ATOM 0 HA SER B 187 1.028 -9.268 -7.993 1.00 1.16 H new ATOM 0 HB2 SER B 187 0.181 -11.544 -8.406 1.00 1.28 H new ATOM 0 HB3 SER B 187 -1.387 -11.099 -7.764 1.00 1.28 H new ATOM 0 HG SER B 187 -1.313 -10.956 -10.076 1.00 3.22 H new ATOM 2885 N PHE B 188 -1.790 -8.466 -6.415 1.00 0.82 N ATOM 2886 CA PHE B 188 -2.678 -7.334 -6.087 1.00 0.67 C ATOM 2887 C PHE B 188 -1.868 -6.078 -5.680 1.00 0.67 C ATOM 2888 O PHE B 188 -2.064 -4.987 -6.212 1.00 0.65 O ATOM 2889 CB PHE B 188 -3.633 -7.743 -4.958 1.00 0.67 C ATOM 2890 CG PHE B 188 -4.709 -6.718 -4.635 1.00 0.70 C ATOM 2891 CD1 PHE B 188 -5.906 -6.704 -5.376 1.00 1.82 C ATOM 2892 CD2 PHE B 188 -4.543 -5.812 -3.568 1.00 2.07 C ATOM 2893 CE1 PHE B 188 -6.954 -5.832 -5.026 1.00 1.80 C ATOM 2894 CE2 PHE B 188 -5.587 -4.935 -3.219 1.00 2.18 C ATOM 2895 CZ PHE B 188 -6.795 -4.953 -3.939 1.00 0.94 C ATOM 0 H PHE B 188 -2.016 -9.320 -5.905 1.00 0.82 H new ATOM 0 HA PHE B 188 -3.254 -7.079 -6.977 1.00 0.67 H new ATOM 0 HB2 PHE B 188 -4.115 -8.682 -5.230 1.00 0.67 H new ATOM 0 HB3 PHE B 188 -3.049 -7.933 -4.057 1.00 0.67 H new ATOM 0 HD1 PHE B 188 -6.021 -7.368 -6.220 1.00 1.82 H new ATOM 0 HD2 PHE B 188 -3.614 -5.791 -3.018 1.00 2.07 H new ATOM 0 HE1 PHE B 188 -7.876 -5.838 -5.589 1.00 1.80 H new ATOM 0 HE2 PHE B 188 -5.460 -4.247 -2.396 1.00 2.18 H new ATOM 0 HZ PHE B 188 -7.601 -4.292 -3.657 1.00 0.94 H new ATOM 2905 N TRP B 189 -0.902 -6.255 -4.774 1.00 0.76 N ATOM 2906 CA TRP B 189 -0.012 -5.237 -4.207 1.00 0.79 C ATOM 2907 C TRP B 189 0.988 -4.647 -5.215 1.00 0.82 C ATOM 2908 O TRP B 189 1.290 -3.455 -5.150 1.00 0.82 O ATOM 2909 CB TRP B 189 0.716 -5.885 -3.023 1.00 0.86 C ATOM 2910 CG TRP B 189 1.719 -5.027 -2.320 1.00 0.99 C ATOM 2911 CD1 TRP B 189 3.060 -5.128 -2.471 1.00 1.17 C ATOM 2912 CD2 TRP B 189 1.498 -3.935 -1.367 1.00 1.06 C ATOM 2913 NE1 TRP B 189 3.688 -4.180 -1.692 1.00 1.34 N ATOM 2914 CE2 TRP B 189 2.779 -3.416 -0.998 1.00 1.29 C ATOM 2915 CE3 TRP B 189 0.364 -3.317 -0.780 1.00 1.09 C ATOM 2916 CZ2 TRP B 189 2.931 -2.333 -0.126 1.00 1.50 C ATOM 2917 CZ3 TRP B 189 0.514 -2.223 0.089 1.00 1.31 C ATOM 2918 CH2 TRP B 189 1.786 -1.717 0.398 1.00 1.50 C ATOM 0 H TRP B 189 -0.707 -7.180 -4.390 1.00 0.76 H new ATOM 0 HA TRP B 189 -0.614 -4.385 -3.893 1.00 0.79 H new ATOM 0 HB2 TRP B 189 -0.030 -6.207 -2.296 1.00 0.86 H new ATOM 0 HB3 TRP B 189 1.222 -6.782 -3.380 1.00 0.86 H new ATOM 0 HD1 TRP B 189 3.562 -5.843 -3.106 1.00 1.17 H new ATOM 0 HE1 TRP B 189 4.699 -4.060 -1.637 1.00 1.34 H new ATOM 0 HE3 TRP B 189 -0.624 -3.691 -1.003 1.00 1.09 H new ATOM 0 HZ2 TRP B 189 3.915 -1.977 0.140 1.00 1.50 H new ATOM 0 HZ3 TRP B 189 -0.362 -1.765 0.525 1.00 1.31 H new ATOM 0 HH2 TRP B 189 1.883 -0.853 1.039 1.00 1.50 H new ATOM 2929 N GLU B 190 1.477 -5.415 -6.195 1.00 0.91 N ATOM 2930 CA GLU B 190 2.280 -4.855 -7.297 1.00 0.93 C ATOM 2931 C GLU B 190 1.427 -4.052 -8.295 1.00 0.91 C ATOM 2932 O GLU B 190 1.944 -3.121 -8.917 1.00 0.95 O ATOM 2933 CB GLU B 190 3.120 -5.945 -7.983 1.00 0.97 C ATOM 2934 CG GLU B 190 4.313 -6.417 -7.128 1.00 1.14 C ATOM 2935 CD GLU B 190 5.350 -5.315 -6.867 1.00 1.68 C ATOM 2936 OE1 GLU B 190 5.997 -4.836 -7.831 1.00 2.76 O ATOM 2937 OE2 GLU B 190 5.524 -4.907 -5.692 1.00 2.54 O ATOM 0 H GLU B 190 1.333 -6.423 -6.251 1.00 0.91 H new ATOM 0 HA GLU B 190 2.977 -4.140 -6.859 1.00 0.93 H new ATOM 0 HB2 GLU B 190 2.482 -6.799 -8.208 1.00 0.97 H new ATOM 0 HB3 GLU B 190 3.491 -5.564 -8.935 1.00 0.97 H new ATOM 0 HG2 GLU B 190 3.941 -6.789 -6.173 1.00 1.14 H new ATOM 0 HG3 GLU B 190 4.801 -7.253 -7.628 1.00 1.14 H new ATOM 2944 N LEU B 191 0.114 -4.303 -8.379 1.00 0.83 N ATOM 2945 CA LEU B 191 -0.821 -3.433 -9.103 1.00 0.74 C ATOM 2946 C LEU B 191 -1.312 -2.219 -8.297 1.00 0.66 C ATOM 2947 O LEU B 191 -1.636 -1.195 -8.896 1.00 0.70 O ATOM 2948 CB LEU B 191 -1.981 -4.244 -9.699 1.00 0.84 C ATOM 2949 CG LEU B 191 -1.871 -4.279 -11.233 1.00 1.28 C ATOM 2950 CD1 LEU B 191 -0.824 -5.283 -11.716 1.00 1.77 C ATOM 2951 CD2 LEU B 191 -3.223 -4.628 -11.830 1.00 1.66 C ATOM 0 H LEU B 191 -0.329 -5.114 -7.947 1.00 0.83 H new ATOM 0 HA LEU B 191 -0.250 -3.001 -9.924 1.00 0.74 H new ATOM 0 HB2 LEU B 191 -1.966 -5.259 -9.303 1.00 0.84 H new ATOM 0 HB3 LEU B 191 -2.933 -3.801 -9.405 1.00 0.84 H new ATOM 0 HG LEU B 191 -1.554 -3.290 -11.563 1.00 1.28 H new ATOM 0 HD11 LEU B 191 -0.784 -5.271 -12.805 1.00 1.77 H new ATOM 0 HD12 LEU B 191 0.152 -5.013 -11.314 1.00 1.77 H new ATOM 0 HD13 LEU B 191 -1.093 -6.282 -11.374 1.00 1.77 H new ATOM 0 HD21 LEU B 191 -3.145 -4.653 -12.917 1.00 1.66 H new ATOM 0 HD22 LEU B 191 -3.540 -5.605 -11.466 1.00 1.66 H new ATOM 0 HD23 LEU B 191 -3.956 -3.876 -11.536 1.00 1.66 H new ATOM 2963 N ILE B 192 -1.280 -2.253 -6.962 1.00 0.61 N ATOM 2964 CA ILE B 192 -1.294 -1.003 -6.177 1.00 0.58 C ATOM 2965 C ILE B 192 -0.002 -0.211 -6.439 1.00 0.68 C ATOM 2966 O ILE B 192 -0.032 1.010 -6.570 1.00 0.68 O ATOM 2967 CB ILE B 192 -1.496 -1.248 -4.669 1.00 0.58 C ATOM 2968 CG1 ILE B 192 -2.770 -2.055 -4.360 1.00 0.52 C ATOM 2969 CG2 ILE B 192 -1.640 0.130 -3.996 1.00 0.63 C ATOM 2970 CD1 ILE B 192 -2.828 -2.544 -2.908 1.00 0.61 C ATOM 0 H ILE B 192 -1.245 -3.108 -6.407 1.00 0.61 H new ATOM 0 HA ILE B 192 -2.152 -0.417 -6.507 1.00 0.58 H new ATOM 0 HB ILE B 192 -0.644 -1.819 -4.301 1.00 0.58 H new ATOM 0 HG12 ILE B 192 -3.644 -1.437 -4.565 1.00 0.52 H new ATOM 0 HG13 ILE B 192 -2.822 -2.913 -5.030 1.00 0.52 H new ATOM 0 HG21 ILE B 192 -1.785 -0.002 -2.924 1.00 0.63 H new ATOM 0 HG22 ILE B 192 -0.738 0.716 -4.171 1.00 0.63 H new ATOM 0 HG23 ILE B 192 -2.499 0.652 -4.417 1.00 0.63 H new ATOM 0 HD11 ILE B 192 -3.748 -3.106 -2.750 1.00 0.61 H new ATOM 0 HD12 ILE B 192 -1.971 -3.186 -2.706 1.00 0.61 H new ATOM 0 HD13 ILE B 192 -2.806 -1.687 -2.234 1.00 0.61 H new ATOM 2982 N GLY B 193 1.118 -0.913 -6.621 1.00 0.80 N ATOM 2983 CA GLY B 193 2.366 -0.340 -7.133 1.00 0.98 C ATOM 2984 C GLY B 193 2.198 0.377 -8.483 1.00 1.01 C ATOM 2985 O GLY B 193 2.788 1.439 -8.676 1.00 1.10 O ATOM 0 H GLY B 193 1.185 -1.910 -6.414 1.00 0.80 H new ATOM 0 HA2 GLY B 193 2.761 0.365 -6.402 1.00 0.98 H new ATOM 0 HA3 GLY B 193 3.105 -1.134 -7.241 1.00 0.98 H new ATOM 2989 N GLU B 194 1.339 -0.131 -9.377 1.00 0.97 N ATOM 2990 CA GLU B 194 0.950 0.517 -10.634 1.00 1.06 C ATOM 2991 C GLU B 194 -0.014 1.700 -10.412 1.00 0.93 C ATOM 2992 O GLU B 194 0.161 2.738 -11.055 1.00 0.97 O ATOM 2993 CB GLU B 194 0.365 -0.558 -11.564 1.00 1.17 C ATOM 2994 CG GLU B 194 -0.261 -0.034 -12.857 1.00 1.58 C ATOM 2995 CD GLU B 194 0.716 0.607 -13.853 1.00 1.55 C ATOM 2996 OE1 GLU B 194 1.935 0.311 -13.843 1.00 1.88 O ATOM 2997 OE2 GLU B 194 0.241 1.388 -14.714 1.00 3.10 O ATOM 0 H GLU B 194 0.882 -1.033 -9.240 1.00 0.97 H new ATOM 0 HA GLU B 194 1.828 0.961 -11.104 1.00 1.06 H new ATOM 0 HB2 GLU B 194 1.157 -1.261 -11.822 1.00 1.17 H new ATOM 0 HB3 GLU B 194 -0.392 -1.118 -11.014 1.00 1.17 H new ATOM 0 HG2 GLU B 194 -0.770 -0.860 -13.354 1.00 1.58 H new ATOM 0 HG3 GLU B 194 -1.024 0.701 -12.599 1.00 1.58 H new ATOM 3004 N ALA B 195 -0.977 1.610 -9.483 1.00 0.82 N ATOM 3005 CA ALA B 195 -1.749 2.781 -9.026 1.00 0.72 C ATOM 3006 C ALA B 195 -0.830 3.918 -8.508 1.00 0.77 C ATOM 3007 O ALA B 195 -1.031 5.084 -8.846 1.00 0.77 O ATOM 3008 CB ALA B 195 -2.790 2.350 -7.972 1.00 0.63 C ATOM 0 H ALA B 195 -1.243 0.735 -9.030 1.00 0.82 H new ATOM 0 HA ALA B 195 -2.283 3.193 -9.882 1.00 0.72 H new ATOM 0 HB1 ALA B 195 -3.355 3.221 -7.641 1.00 0.63 H new ATOM 0 HB2 ALA B 195 -3.472 1.621 -8.411 1.00 0.63 H new ATOM 0 HB3 ALA B 195 -2.280 1.902 -7.119 1.00 0.63 H new ATOM 3014 N ALA B 196 0.250 3.593 -7.787 1.00 0.85 N ATOM 3015 CA ALA B 196 1.282 4.548 -7.359 1.00 1.00 C ATOM 3016 C ALA B 196 2.209 5.053 -8.489 1.00 1.14 C ATOM 3017 O ALA B 196 3.058 5.910 -8.244 1.00 1.31 O ATOM 3018 CB ALA B 196 2.063 3.981 -6.172 1.00 1.04 C ATOM 0 H ALA B 196 0.436 2.639 -7.478 1.00 0.85 H new ATOM 0 HA ALA B 196 0.754 5.447 -7.040 1.00 1.00 H new ATOM 0 HB1 ALA B 196 2.825 4.696 -5.863 1.00 1.04 H new ATOM 0 HB2 ALA B 196 1.381 3.796 -5.342 1.00 1.04 H new ATOM 0 HB3 ALA B 196 2.541 3.046 -6.464 1.00 1.04 H new ATOM 3024 N LYS B 197 2.068 4.584 -9.738 1.00 1.17 N ATOM 3025 CA LYS B 197 2.657 5.273 -10.906 1.00 1.26 C ATOM 3026 C LYS B 197 1.779 6.441 -11.404 1.00 1.11 C ATOM 3027 O LYS B 197 2.249 7.228 -12.228 1.00 1.35 O ATOM 3028 CB LYS B 197 3.055 4.275 -12.015 1.00 1.40 C ATOM 3029 CG LYS B 197 3.958 3.102 -11.573 1.00 1.67 C ATOM 3030 CD LYS B 197 5.299 3.497 -10.924 1.00 1.15 C ATOM 3031 CE LYS B 197 6.095 2.273 -10.436 1.00 1.19 C ATOM 3032 NZ LYS B 197 6.699 1.495 -11.549 1.00 2.01 N ATOM 0 H LYS B 197 1.554 3.734 -9.969 1.00 1.17 H new ATOM 0 HA LYS B 197 3.586 5.739 -10.578 1.00 1.26 H new ATOM 0 HB2 LYS B 197 2.145 3.863 -12.451 1.00 1.40 H new ATOM 0 HB3 LYS B 197 3.566 4.824 -12.805 1.00 1.40 H new ATOM 0 HG2 LYS B 197 3.402 2.486 -10.867 1.00 1.67 H new ATOM 0 HG3 LYS B 197 4.166 2.480 -12.444 1.00 1.67 H new ATOM 0 HD2 LYS B 197 5.898 4.054 -11.644 1.00 1.15 H new ATOM 0 HD3 LYS B 197 5.110 4.164 -10.083 1.00 1.15 H new ATOM 0 HE2 LYS B 197 6.884 2.605 -9.761 1.00 1.19 H new ATOM 0 HE3 LYS B 197 5.436 1.623 -9.861 1.00 1.19 H new ATOM 0 HZ1 LYS B 197 7.222 0.684 -11.162 1.00 2.01 H new ATOM 0 HZ2 LYS B 197 5.947 1.152 -12.181 1.00 2.01 H new ATOM 0 HZ3 LYS B 197 7.351 2.104 -12.084 1.00 2.01 H new ATOM 3046 N SER B 198 0.557 6.617 -10.880 1.00 0.85 N ATOM 3047 CA SER B 198 -0.274 7.822 -11.090 1.00 0.82 C ATOM 3048 C SER B 198 0.026 8.965 -10.108 1.00 1.05 C ATOM 3049 O SER B 198 -0.261 10.122 -10.426 1.00 1.38 O ATOM 3050 CB SER B 198 -1.769 7.504 -10.941 1.00 1.28 C ATOM 3051 OG SER B 198 -2.223 6.532 -11.862 1.00 1.76 O ATOM 0 H SER B 198 0.107 5.918 -10.289 1.00 0.85 H new ATOM 0 HA SER B 198 -0.025 8.142 -12.102 1.00 0.82 H new ATOM 0 HB2 SER B 198 -1.960 7.153 -9.927 1.00 1.28 H new ATOM 0 HB3 SER B 198 -2.344 8.420 -11.075 1.00 1.28 H new ATOM 0 HG SER B 198 -3.083 6.172 -11.560 1.00 1.76 H new ATOM 3057 N VAL B 199 0.565 8.675 -8.916 1.00 1.25 N ATOM 3058 CA VAL B 199 0.690 9.633 -7.798 1.00 1.62 C ATOM 3059 C VAL B 199 1.982 9.406 -7.001 1.00 1.81 C ATOM 3060 O VAL B 199 2.268 8.281 -6.597 1.00 1.89 O ATOM 3061 CB VAL B 199 -0.575 9.579 -6.910 1.00 1.80 C ATOM 3062 CG1 VAL B 199 -0.840 8.212 -6.262 1.00 1.75 C ATOM 3063 CG2 VAL B 199 -0.547 10.644 -5.813 1.00 2.39 C ATOM 0 H VAL B 199 0.935 7.751 -8.693 1.00 1.25 H new ATOM 0 HA VAL B 199 0.764 10.641 -8.206 1.00 1.62 H new ATOM 0 HB VAL B 199 -1.392 9.774 -7.605 1.00 1.80 H new ATOM 0 HG11 VAL B 199 -1.746 8.265 -5.658 1.00 1.75 H new ATOM 0 HG12 VAL B 199 -0.967 7.459 -7.040 1.00 1.75 H new ATOM 0 HG13 VAL B 199 0.004 7.940 -5.628 1.00 1.75 H new ATOM 0 HG21 VAL B 199 -1.454 10.571 -5.212 1.00 2.39 H new ATOM 0 HG22 VAL B 199 0.324 10.488 -5.176 1.00 2.39 H new ATOM 0 HG23 VAL B 199 -0.491 11.633 -6.268 1.00 2.39 H new ATOM 3073 N LYS B 200 2.785 10.463 -6.817 1.00 2.02 N ATOM 3074 CA LYS B 200 4.188 10.404 -6.356 1.00 2.55 C ATOM 3075 C LYS B 200 4.621 11.600 -5.503 1.00 3.10 C ATOM 3076 O LYS B 200 3.872 12.562 -5.314 1.00 3.19 O ATOM 3077 CB LYS B 200 5.084 10.249 -7.607 1.00 2.47 C ATOM 3078 CG LYS B 200 5.461 8.791 -7.926 1.00 2.50 C ATOM 3079 CD LYS B 200 6.123 8.764 -9.312 1.00 2.92 C ATOM 3080 CE LYS B 200 6.659 7.381 -9.693 1.00 3.48 C ATOM 3081 NZ LYS B 200 7.131 7.368 -11.098 1.00 4.11 N ATOM 0 H LYS B 200 2.469 11.417 -6.990 1.00 2.02 H new ATOM 0 HA LYS B 200 4.291 9.549 -5.687 1.00 2.55 H new ATOM 0 HB2 LYS B 200 4.569 10.677 -8.467 1.00 2.47 H new ATOM 0 HB3 LYS B 200 5.997 10.827 -7.462 1.00 2.47 H new ATOM 0 HG2 LYS B 200 6.142 8.400 -7.171 1.00 2.50 H new ATOM 0 HG3 LYS B 200 4.574 8.157 -7.915 1.00 2.50 H new ATOM 0 HD2 LYS B 200 5.399 9.086 -10.061 1.00 2.92 H new ATOM 0 HD3 LYS B 200 6.942 9.483 -9.331 1.00 2.92 H new ATOM 0 HE2 LYS B 200 7.477 7.107 -9.027 1.00 3.48 H new ATOM 0 HE3 LYS B 200 5.877 6.634 -9.561 1.00 3.48 H new ATOM 0 HZ1 LYS B 200 7.490 6.421 -11.335 1.00 4.11 H new ATOM 0 HZ2 LYS B 200 6.342 7.608 -11.732 1.00 4.11 H new ATOM 0 HZ3 LYS B 200 7.893 8.066 -11.215 1.00 4.11 H new