USER MOD reduce.3.24.130724 H: found=0, std=0, add=777, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 780 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 37 THR OG1 : rot 160:sc= 0.0067 USER MOD Set 1.2: A 69 THR OG1 : rot 150:sc= 0 USER MOD Set 2.1: A 12 MET CE :methyl 154:sc= -0.132 (180deg=-0.676) USER MOD Set 2.2: A 68 THR OG1 : rot 127:sc= 1.28 USER MOD Single : A 13 TYR OH : rot -97:sc= 1.2 USER MOD Single : A 16 THR OG1 : rot 180:sc= -0.197 USER MOD Single : A 19 GLN : amide:sc= 1.65 K(o=1.6,f=-4.9!) USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 25 SER OG : rot 45:sc= 1.05 USER MOD Single : A 28 LYS NZ :NH3+ -160:sc= 0.596 (180deg=0.273!) USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 35 ASN : amide:sc= -0.353 K(o=-0.35,f=-3.5!) USER MOD Single : A 38 GLN : amide:sc= 0 X(o=0,f=-0.24) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 SER OG : rot 180:sc= 0.0391 USER MOD Single : A 50 SER OG : rot -130:sc= 0.103 USER MOD Single : A 55 SER OG : rot 180:sc= -0.348 USER MOD Single : A 63 LYS NZ :NH3+ 169:sc= 1.16 (180deg=0.87) USER MOD Single : A 65 THR OG1 : rot 180:sc= -0.171 USER MOD Single : A 67 SER OG : rot 31:sc= 0.527 USER MOD Single : A 71 LYS NZ :NH3+ -118:sc= -0.0019 (180deg=-1.93!) USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 93 MET CE :methyl -178:sc= -0.637 (180deg=-0.665) USER MOD Single : A 94 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 98 THR OG1 : rot 180:sc= 0 USER MOD Single : A 100 TYR OH : rot 180:sc= 0 USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 ASN : amide:sc= -2.86! K(o=-2.9!,f=-0.38) USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.0105) USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 SER OG : rot 35:sc= 0.687 USER MOD Single : A 125 ASN : amide:sc= -0.158 X(o=-0.16,f=-0.16) USER MOD Single : A 127 TYR OH : rot 180:sc= 0 USER MOD Single : A 128 TYR OH : rot 128:sc= 1.2 USER MOD Single : A 129 ASN : amide:sc= 0 K(o=0,f=-1) USER MOD ----------------------------------------------------------------- ATOM 109 N GLY A 10 20.826 4.797 -0.875 1.00 0.00 N ATOM 110 CA GLY A 10 20.323 3.905 0.151 1.00 0.00 C ATOM 111 C GLY A 10 19.008 4.368 0.734 1.00 0.00 C ATOM 112 O GLY A 10 19.013 5.005 1.788 1.00 0.00 O ATOM 0 HA2 GLY A 10 20.198 2.908 -0.270 1.00 0.00 H new ATOM 0 HA3 GLY A 10 21.061 3.823 0.949 1.00 0.00 H new ATOM 116 N ALA A 11 17.888 4.043 0.085 1.00 0.00 N ATOM 117 CA ALA A 11 16.580 4.049 0.715 1.00 0.00 C ATOM 118 C ALA A 11 16.050 2.620 0.660 1.00 0.00 C ATOM 119 O ALA A 11 16.033 2.008 -0.408 1.00 0.00 O ATOM 120 CB ALA A 11 15.640 5.035 0.009 1.00 0.00 C ATOM 0 H ALA A 11 17.870 3.768 -0.897 1.00 0.00 H new ATOM 0 HA ALA A 11 16.646 4.381 1.751 1.00 0.00 H new ATOM 0 HB1 ALA A 11 14.666 5.023 0.498 1.00 0.00 H new ATOM 0 HB2 ALA A 11 16.060 6.039 0.062 1.00 0.00 H new ATOM 0 HB3 ALA A 11 15.525 4.744 -1.035 1.00 0.00 H new ATOM 126 N MET A 12 15.616 2.098 1.804 1.00 0.00 N ATOM 127 CA MET A 12 14.512 1.149 1.822 1.00 0.00 C ATOM 128 C MET A 12 13.230 1.945 1.691 1.00 0.00 C ATOM 129 O MET A 12 13.214 3.124 2.060 1.00 0.00 O ATOM 130 CB MET A 12 14.432 0.404 3.156 1.00 0.00 C ATOM 131 CG MET A 12 15.727 -0.336 3.454 1.00 0.00 C ATOM 132 SD MET A 12 15.528 -1.851 4.421 1.00 0.00 S ATOM 133 CE MET A 12 14.560 -2.855 3.259 1.00 0.00 C ATOM 0 H MET A 12 16.008 2.314 2.720 1.00 0.00 H new ATOM 0 HA MET A 12 14.658 0.429 1.016 1.00 0.00 H new ATOM 0 HB2 MET A 12 14.222 1.112 3.958 1.00 0.00 H new ATOM 0 HB3 MET A 12 13.604 -0.304 3.131 1.00 0.00 H new ATOM 0 HG2 MET A 12 16.212 -0.585 2.510 1.00 0.00 H new ATOM 0 HG3 MET A 12 16.398 0.335 3.990 1.00 0.00 H new ATOM 0 HE1 MET A 12 14.734 -3.912 3.459 1.00 0.00 H new ATOM 0 HE2 MET A 12 13.500 -2.632 3.381 1.00 0.00 H new ATOM 0 HE3 MET A 12 14.864 -2.625 2.238 1.00 0.00 H new ATOM 143 N TYR A 13 12.161 1.269 1.290 1.00 0.00 N ATOM 144 CA TYR A 13 10.815 1.794 1.281 1.00 0.00 C ATOM 145 C TYR A 13 9.915 0.718 1.920 1.00 0.00 C ATOM 146 O TYR A 13 10.208 -0.484 1.837 1.00 0.00 O ATOM 147 CB TYR A 13 10.448 2.170 -0.168 1.00 0.00 C ATOM 148 CG TYR A 13 11.348 3.202 -0.855 1.00 0.00 C ATOM 149 CD1 TYR A 13 11.493 4.480 -0.281 1.00 0.00 C ATOM 150 CD2 TYR A 13 11.955 2.944 -2.110 1.00 0.00 C ATOM 151 CE1 TYR A 13 12.243 5.477 -0.928 1.00 0.00 C ATOM 152 CE2 TYR A 13 12.683 3.952 -2.788 1.00 0.00 C ATOM 153 CZ TYR A 13 12.838 5.224 -2.181 1.00 0.00 C ATOM 154 OH TYR A 13 13.530 6.225 -2.786 1.00 0.00 O ATOM 0 H TYR A 13 12.216 0.308 0.952 1.00 0.00 H new ATOM 0 HA TYR A 13 10.692 2.708 1.862 1.00 0.00 H new ATOM 0 HB2 TYR A 13 10.452 1.260 -0.768 1.00 0.00 H new ATOM 0 HB3 TYR A 13 9.427 2.551 -0.174 1.00 0.00 H new ATOM 0 HD1 TYR A 13 11.023 4.696 0.667 1.00 0.00 H new ATOM 0 HD2 TYR A 13 11.861 1.965 -2.555 1.00 0.00 H new ATOM 0 HE1 TYR A 13 12.364 6.444 -0.462 1.00 0.00 H new ATOM 0 HE2 TYR A 13 13.116 3.754 -3.757 1.00 0.00 H new ATOM 0 HH TYR A 13 12.955 6.670 -3.443 1.00 0.00 H new ATOM 164 N GLU A 14 8.871 1.133 2.637 1.00 0.00 N ATOM 165 CA GLU A 14 7.930 0.255 3.325 1.00 0.00 C ATOM 166 C GLU A 14 6.569 0.947 3.332 1.00 0.00 C ATOM 167 O GLU A 14 6.460 2.079 3.793 1.00 0.00 O ATOM 168 CB GLU A 14 8.435 -0.048 4.746 1.00 0.00 C ATOM 169 CG GLU A 14 7.412 -0.817 5.599 1.00 0.00 C ATOM 170 CD GLU A 14 8.036 -1.367 6.880 1.00 0.00 C ATOM 171 OE1 GLU A 14 8.168 -0.604 7.864 1.00 0.00 O ATOM 172 OE2 GLU A 14 8.418 -2.560 6.910 1.00 0.00 O ATOM 0 H GLU A 14 8.651 2.122 2.758 1.00 0.00 H new ATOM 0 HA GLU A 14 7.839 -0.704 2.814 1.00 0.00 H new ATOM 0 HB2 GLU A 14 9.355 -0.629 4.682 1.00 0.00 H new ATOM 0 HB3 GLU A 14 8.683 0.889 5.244 1.00 0.00 H new ATOM 0 HG2 GLU A 14 6.583 -0.157 5.854 1.00 0.00 H new ATOM 0 HG3 GLU A 14 6.998 -1.639 5.015 1.00 0.00 H new ATOM 179 N VAL A 15 5.550 0.313 2.765 1.00 0.00 N ATOM 180 CA VAL A 15 4.197 0.832 2.647 1.00 0.00 C ATOM 181 C VAL A 15 3.340 0.175 3.726 1.00 0.00 C ATOM 182 O VAL A 15 3.582 -0.973 4.112 1.00 0.00 O ATOM 183 CB VAL A 15 3.686 0.593 1.204 1.00 0.00 C ATOM 184 CG1 VAL A 15 3.768 -0.864 0.725 1.00 0.00 C ATOM 185 CG2 VAL A 15 2.253 1.079 1.000 1.00 0.00 C ATOM 0 H VAL A 15 5.651 -0.617 2.358 1.00 0.00 H new ATOM 0 HA VAL A 15 4.152 1.909 2.811 1.00 0.00 H new ATOM 0 HB VAL A 15 4.375 1.184 0.601 1.00 0.00 H new ATOM 0 HG11 VAL A 15 3.389 -0.934 -0.295 1.00 0.00 H new ATOM 0 HG12 VAL A 15 4.805 -1.197 0.750 1.00 0.00 H new ATOM 0 HG13 VAL A 15 3.168 -1.496 1.379 1.00 0.00 H new ATOM 0 HG21 VAL A 15 1.946 0.887 -0.028 1.00 0.00 H new ATOM 0 HG22 VAL A 15 1.588 0.549 1.682 1.00 0.00 H new ATOM 0 HG23 VAL A 15 2.200 2.149 1.200 1.00 0.00 H new ATOM 195 N THR A 16 2.308 0.881 4.180 1.00 0.00 N ATOM 196 CA THR A 16 1.241 0.297 4.963 1.00 0.00 C ATOM 197 C THR A 16 -0.084 0.562 4.285 1.00 0.00 C ATOM 198 O THR A 16 -0.239 1.461 3.447 1.00 0.00 O ATOM 199 CB THR A 16 1.254 0.837 6.408 1.00 0.00 C ATOM 200 OG1 THR A 16 1.223 2.250 6.431 1.00 0.00 O ATOM 201 CG2 THR A 16 2.470 0.355 7.197 1.00 0.00 C ATOM 0 H THR A 16 2.195 1.880 4.010 1.00 0.00 H new ATOM 0 HA THR A 16 1.392 -0.781 5.025 1.00 0.00 H new ATOM 0 HB THR A 16 0.355 0.445 6.882 1.00 0.00 H new ATOM 0 HG1 THR A 16 1.230 2.562 7.360 1.00 0.00 H new ATOM 0 HG21 THR A 16 2.433 0.762 8.207 1.00 0.00 H new ATOM 0 HG22 THR A 16 2.465 -0.734 7.244 1.00 0.00 H new ATOM 0 HG23 THR A 16 3.381 0.692 6.703 1.00 0.00 H new ATOM 209 N ILE A 17 -1.050 -0.228 4.723 1.00 0.00 N ATOM 210 CA ILE A 17 -2.456 0.026 4.598 1.00 0.00 C ATOM 211 C ILE A 17 -3.032 -0.254 5.979 1.00 0.00 C ATOM 212 O ILE A 17 -2.551 -1.151 6.676 1.00 0.00 O ATOM 213 CB ILE A 17 -3.035 -0.851 3.470 1.00 0.00 C ATOM 214 CG1 ILE A 17 -4.547 -0.656 3.276 1.00 0.00 C ATOM 215 CG2 ILE A 17 -2.844 -2.353 3.710 1.00 0.00 C ATOM 216 CD1 ILE A 17 -4.961 0.780 2.995 1.00 0.00 C ATOM 0 H ILE A 17 -0.853 -1.108 5.199 1.00 0.00 H new ATOM 0 HA ILE A 17 -2.705 1.047 4.310 1.00 0.00 H new ATOM 0 HB ILE A 17 -2.478 -0.524 2.592 1.00 0.00 H new ATOM 0 HG12 ILE A 17 -4.880 -1.286 2.451 1.00 0.00 H new ATOM 0 HG13 ILE A 17 -5.064 -1.003 4.171 1.00 0.00 H new ATOM 0 HG21 ILE A 17 -3.274 -2.912 2.879 1.00 0.00 H new ATOM 0 HG22 ILE A 17 -1.780 -2.577 3.786 1.00 0.00 H new ATOM 0 HG23 ILE A 17 -3.342 -2.640 4.636 1.00 0.00 H new ATOM 0 HD11 ILE A 17 -6.043 0.829 2.871 1.00 0.00 H new ATOM 0 HD12 ILE A 17 -4.662 1.415 3.829 1.00 0.00 H new ATOM 0 HD13 ILE A 17 -4.475 1.127 2.083 1.00 0.00 H new ATOM 228 N GLU A 18 -4.035 0.519 6.364 1.00 0.00 N ATOM 229 CA GLU A 18 -4.806 0.418 7.589 1.00 0.00 C ATOM 230 C GLU A 18 -6.252 0.571 7.123 1.00 0.00 C ATOM 231 O GLU A 18 -6.701 1.676 6.794 1.00 0.00 O ATOM 232 CB GLU A 18 -4.372 1.531 8.560 1.00 0.00 C ATOM 233 CG GLU A 18 -3.074 1.216 9.329 1.00 0.00 C ATOM 234 CD GLU A 18 -3.257 0.923 10.823 1.00 0.00 C ATOM 235 OE1 GLU A 18 -3.996 1.659 11.517 1.00 0.00 O ATOM 236 OE2 GLU A 18 -2.577 0.004 11.340 1.00 0.00 O ATOM 0 H GLU A 18 -4.354 1.293 5.781 1.00 0.00 H new ATOM 0 HA GLU A 18 -4.666 -0.517 8.132 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -4.236 2.456 8.000 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -5.174 1.708 9.277 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -2.593 0.356 8.862 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -2.392 2.060 9.221 1.00 0.00 H new ATOM 243 N GLN A 19 -6.939 -0.559 6.962 1.00 0.00 N ATOM 244 CA GLN A 19 -8.323 -0.615 6.526 1.00 0.00 C ATOM 245 C GLN A 19 -9.190 -0.342 7.756 1.00 0.00 C ATOM 246 O GLN A 19 -9.233 -1.184 8.659 1.00 0.00 O ATOM 247 CB GLN A 19 -8.614 -1.992 5.890 1.00 0.00 C ATOM 248 CG GLN A 19 -7.747 -2.258 4.649 1.00 0.00 C ATOM 249 CD GLN A 19 -8.345 -3.295 3.694 1.00 0.00 C ATOM 250 OE1 GLN A 19 -9.024 -2.921 2.739 1.00 0.00 O ATOM 251 NE2 GLN A 19 -8.059 -4.575 3.903 1.00 0.00 N ATOM 0 H GLN A 19 -6.535 -1.479 7.137 1.00 0.00 H new ATOM 0 HA GLN A 19 -8.541 0.130 5.761 1.00 0.00 H new ATOM 0 HB2 GLN A 19 -8.438 -2.775 6.628 1.00 0.00 H new ATOM 0 HB3 GLN A 19 -9.667 -2.046 5.613 1.00 0.00 H new ATOM 0 HG2 GLN A 19 -7.601 -1.322 4.110 1.00 0.00 H new ATOM 0 HG3 GLN A 19 -6.762 -2.597 4.970 1.00 0.00 H new ATOM 0 HE21 GLN A 19 -7.493 -4.846 4.707 1.00 0.00 H new ATOM 0 HE22 GLN A 19 -8.406 -5.287 3.260 1.00 0.00 H new ATOM 260 N SER A 20 -9.839 0.828 7.839 1.00 0.00 N ATOM 261 CA SER A 20 -10.804 1.088 8.910 1.00 0.00 C ATOM 262 C SER A 20 -12.093 1.712 8.393 1.00 0.00 C ATOM 263 O SER A 20 -12.187 2.095 7.226 1.00 0.00 O ATOM 264 CB SER A 20 -10.186 1.919 10.047 1.00 0.00 C ATOM 265 OG SER A 20 -8.823 1.592 10.279 1.00 0.00 O ATOM 0 H SER A 20 -9.714 1.600 7.184 1.00 0.00 H new ATOM 0 HA SER A 20 -11.073 0.117 9.326 1.00 0.00 H new ATOM 0 HB2 SER A 20 -10.266 2.978 9.804 1.00 0.00 H new ATOM 0 HB3 SER A 20 -10.756 1.758 10.962 1.00 0.00 H new ATOM 0 HG SER A 20 -8.473 2.146 11.008 1.00 0.00 H new ATOM 271 N GLY A 21 -13.130 1.694 9.228 1.00 0.00 N ATOM 272 CA GLY A 21 -14.484 1.532 8.730 1.00 0.00 C ATOM 273 C GLY A 21 -14.625 0.145 8.093 1.00 0.00 C ATOM 274 O GLY A 21 -13.711 -0.685 8.162 1.00 0.00 O ATOM 0 H GLY A 21 -13.055 1.789 10.241 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -15.200 1.646 9.544 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -14.710 2.307 7.997 1.00 0.00 H new ATOM 278 N ASP A 22 -15.785 -0.150 7.515 1.00 0.00 N ATOM 279 CA ASP A 22 -16.108 -1.513 7.097 1.00 0.00 C ATOM 280 C ASP A 22 -15.359 -1.883 5.810 1.00 0.00 C ATOM 281 O ASP A 22 -15.544 -1.208 4.805 1.00 0.00 O ATOM 282 CB ASP A 22 -17.625 -1.659 6.903 1.00 0.00 C ATOM 283 CG ASP A 22 -18.040 -3.133 6.854 1.00 0.00 C ATOM 284 OD1 ASP A 22 -17.138 -4.000 6.740 1.00 0.00 O ATOM 285 OD2 ASP A 22 -19.243 -3.418 7.048 1.00 0.00 O ATOM 0 H ASP A 22 -16.517 0.534 7.325 1.00 0.00 H new ATOM 0 HA ASP A 22 -15.787 -2.200 7.880 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -18.148 -1.159 7.718 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -17.925 -1.163 5.980 1.00 0.00 H new ATOM 290 N PHE A 23 -14.523 -2.928 5.798 1.00 0.00 N ATOM 291 CA PHE A 23 -13.851 -3.399 4.577 1.00 0.00 C ATOM 292 C PHE A 23 -14.396 -4.750 4.098 1.00 0.00 C ATOM 293 O PHE A 23 -13.723 -5.446 3.334 1.00 0.00 O ATOM 294 CB PHE A 23 -12.315 -3.354 4.707 1.00 0.00 C ATOM 295 CG PHE A 23 -11.662 -4.140 5.831 1.00 0.00 C ATOM 296 CD1 PHE A 23 -11.277 -5.480 5.636 1.00 0.00 C ATOM 297 CD2 PHE A 23 -11.396 -3.519 7.069 1.00 0.00 C ATOM 298 CE1 PHE A 23 -10.662 -6.196 6.678 1.00 0.00 C ATOM 299 CE2 PHE A 23 -10.764 -4.229 8.105 1.00 0.00 C ATOM 300 CZ PHE A 23 -10.407 -5.574 7.913 1.00 0.00 C ATOM 0 H PHE A 23 -14.293 -3.471 6.630 1.00 0.00 H new ATOM 0 HA PHE A 23 -14.094 -2.696 3.781 1.00 0.00 H new ATOM 0 HB2 PHE A 23 -11.892 -3.706 3.766 1.00 0.00 H new ATOM 0 HB3 PHE A 23 -12.022 -2.310 4.818 1.00 0.00 H new ATOM 0 HD1 PHE A 23 -11.454 -5.959 4.684 1.00 0.00 H new ATOM 0 HD2 PHE A 23 -11.680 -2.489 7.223 1.00 0.00 H new ATOM 0 HE1 PHE A 23 -10.384 -7.229 6.529 1.00 0.00 H new ATOM 0 HE2 PHE A 23 -10.554 -3.742 9.046 1.00 0.00 H new ATOM 0 HZ PHE A 23 -9.938 -6.129 8.712 1.00 0.00 H new ATOM 310 N ARG A 24 -15.594 -5.159 4.531 1.00 0.00 N ATOM 311 CA ARG A 24 -16.131 -6.494 4.255 1.00 0.00 C ATOM 312 C ARG A 24 -16.778 -6.652 2.871 1.00 0.00 C ATOM 313 O ARG A 24 -17.039 -7.799 2.489 1.00 0.00 O ATOM 314 CB ARG A 24 -17.129 -6.866 5.361 1.00 0.00 C ATOM 315 CG ARG A 24 -16.439 -7.025 6.723 1.00 0.00 C ATOM 316 CD ARG A 24 -17.460 -6.992 7.861 1.00 0.00 C ATOM 317 NE ARG A 24 -16.863 -7.453 9.121 1.00 0.00 N ATOM 318 CZ ARG A 24 -16.066 -6.774 9.955 1.00 0.00 C ATOM 319 NH1 ARG A 24 -15.751 -5.507 9.721 1.00 0.00 N ATOM 320 NH2 ARG A 24 -15.596 -7.401 11.030 1.00 0.00 N ATOM 0 H ARG A 24 -16.219 -4.572 5.084 1.00 0.00 H new ATOM 0 HA ARG A 24 -15.281 -7.177 4.246 1.00 0.00 H new ATOM 0 HB2 ARG A 24 -17.898 -6.096 5.431 1.00 0.00 H new ATOM 0 HB3 ARG A 24 -17.633 -7.796 5.098 1.00 0.00 H new ATOM 0 HG2 ARG A 24 -15.890 -7.966 6.749 1.00 0.00 H new ATOM 0 HG3 ARG A 24 -15.710 -6.227 6.861 1.00 0.00 H new ATOM 0 HD2 ARG A 24 -17.839 -5.977 7.984 1.00 0.00 H new ATOM 0 HD3 ARG A 24 -18.313 -7.622 7.607 1.00 0.00 H new ATOM 0 HE ARG A 24 -17.083 -8.411 9.395 1.00 0.00 H new ATOM 0 HH11 ARG A 24 -16.118 -5.035 8.895 1.00 0.00 H new ATOM 0 HH12 ARG A 24 -15.142 -5.005 10.367 1.00 0.00 H new ATOM 0 HH21 ARG A 24 -15.845 -8.375 11.202 1.00 0.00 H new ATOM 0 HH22 ARG A 24 -14.987 -6.908 11.682 1.00 0.00 H new ATOM 334 N SER A 25 -17.002 -5.568 2.125 1.00 0.00 N ATOM 335 CA SER A 25 -17.799 -5.524 0.896 1.00 0.00 C ATOM 336 C SER A 25 -17.063 -4.872 -0.301 1.00 0.00 C ATOM 337 O SER A 25 -17.696 -4.336 -1.217 1.00 0.00 O ATOM 338 CB SER A 25 -19.128 -4.827 1.245 1.00 0.00 C ATOM 339 OG SER A 25 -18.941 -3.720 2.115 1.00 0.00 O ATOM 0 H SER A 25 -16.616 -4.657 2.372 1.00 0.00 H new ATOM 0 HA SER A 25 -17.987 -6.538 0.544 1.00 0.00 H new ATOM 0 HB2 SER A 25 -19.611 -4.489 0.328 1.00 0.00 H new ATOM 0 HB3 SER A 25 -19.801 -5.545 1.713 1.00 0.00 H new ATOM 0 HG SER A 25 -18.184 -3.182 1.802 1.00 0.00 H new ATOM 345 N PHE A 26 -15.723 -4.885 -0.349 1.00 0.00 N ATOM 346 CA PHE A 26 -14.924 -4.056 -1.256 1.00 0.00 C ATOM 347 C PHE A 26 -13.976 -4.933 -2.069 1.00 0.00 C ATOM 348 O PHE A 26 -13.763 -6.096 -1.728 1.00 0.00 O ATOM 349 CB PHE A 26 -14.173 -2.977 -0.452 1.00 0.00 C ATOM 350 CG PHE A 26 -15.109 -1.979 0.197 1.00 0.00 C ATOM 351 CD1 PHE A 26 -15.803 -2.309 1.375 1.00 0.00 C ATOM 352 CD2 PHE A 26 -15.339 -0.738 -0.421 1.00 0.00 C ATOM 353 CE1 PHE A 26 -16.793 -1.447 1.870 1.00 0.00 C ATOM 354 CE2 PHE A 26 -16.299 0.145 0.102 1.00 0.00 C ATOM 355 CZ PHE A 26 -17.062 -0.234 1.216 1.00 0.00 C ATOM 0 H PHE A 26 -15.157 -5.483 0.253 1.00 0.00 H new ATOM 0 HA PHE A 26 -15.578 -3.545 -1.962 1.00 0.00 H new ATOM 0 HB2 PHE A 26 -13.569 -3.457 0.318 1.00 0.00 H new ATOM 0 HB3 PHE A 26 -13.486 -2.449 -1.113 1.00 0.00 H new ATOM 0 HD1 PHE A 26 -15.574 -3.226 1.898 1.00 0.00 H new ATOM 0 HD2 PHE A 26 -14.776 -0.462 -1.301 1.00 0.00 H new ATOM 0 HE1 PHE A 26 -17.349 -1.717 2.756 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -16.449 1.113 -0.353 1.00 0.00 H new ATOM 0 HZ PHE A 26 -17.856 0.407 1.571 1.00 0.00 H new ATOM 365 N ILE A 27 -13.357 -4.366 -3.104 1.00 0.00 N ATOM 366 CA ILE A 27 -12.445 -5.044 -4.008 1.00 0.00 C ATOM 367 C ILE A 27 -11.105 -4.307 -3.916 1.00 0.00 C ATOM 368 O ILE A 27 -10.851 -3.336 -4.631 1.00 0.00 O ATOM 369 CB ILE A 27 -13.012 -5.059 -5.452 1.00 0.00 C ATOM 370 CG1 ILE A 27 -14.409 -5.715 -5.563 1.00 0.00 C ATOM 371 CG2 ILE A 27 -12.064 -5.816 -6.397 1.00 0.00 C ATOM 372 CD1 ILE A 27 -15.527 -4.677 -5.695 1.00 0.00 C ATOM 0 H ILE A 27 -13.486 -3.382 -3.340 1.00 0.00 H new ATOM 0 HA ILE A 27 -12.312 -6.090 -3.731 1.00 0.00 H new ATOM 0 HB ILE A 27 -13.104 -4.010 -5.735 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -14.429 -6.380 -6.427 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -14.590 -6.331 -4.682 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -12.479 -5.816 -7.405 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -11.090 -5.326 -6.405 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -11.950 -6.844 -6.052 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -16.488 -5.185 -5.770 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -15.527 -4.028 -4.819 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -15.363 -4.077 -6.590 1.00 0.00 H new ATOM 384 N LYS A 28 -10.243 -4.719 -2.988 1.00 0.00 N ATOM 385 CA LYS A 28 -8.954 -4.070 -2.822 1.00 0.00 C ATOM 386 C LYS A 28 -8.049 -4.424 -3.998 1.00 0.00 C ATOM 387 O LYS A 28 -8.061 -5.550 -4.508 1.00 0.00 O ATOM 388 CB LYS A 28 -8.258 -4.472 -1.519 1.00 0.00 C ATOM 389 CG LYS A 28 -8.958 -4.206 -0.177 1.00 0.00 C ATOM 390 CD LYS A 28 -9.716 -5.397 0.417 1.00 0.00 C ATOM 391 CE LYS A 28 -11.213 -5.313 0.135 1.00 0.00 C ATOM 392 NZ LYS A 28 -11.827 -6.645 0.202 1.00 0.00 N ATOM 0 H LYS A 28 -10.416 -5.493 -2.347 1.00 0.00 H new ATOM 0 HA LYS A 28 -9.137 -2.996 -2.783 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -8.052 -5.541 -1.574 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -7.295 -3.963 -1.492 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -8.210 -3.877 0.544 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -9.658 -3.381 -0.309 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -9.319 -6.324 0.002 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -9.550 -5.433 1.494 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -11.688 -4.651 0.859 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -11.379 -4.879 -0.851 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -12.734 -6.635 -0.307 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -11.192 -7.343 -0.236 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -11.991 -6.902 1.196 1.00 0.00 H new ATOM 406 N SER A 29 -7.192 -3.480 -4.365 1.00 0.00 N ATOM 407 CA SER A 29 -6.095 -3.623 -5.305 1.00 0.00 C ATOM 408 C SER A 29 -4.978 -2.724 -4.784 1.00 0.00 C ATOM 409 O SER A 29 -5.242 -1.548 -4.523 1.00 0.00 O ATOM 410 CB SER A 29 -6.557 -3.123 -6.683 1.00 0.00 C ATOM 411 OG SER A 29 -6.955 -4.169 -7.549 1.00 0.00 O ATOM 0 H SER A 29 -7.251 -2.534 -3.988 1.00 0.00 H new ATOM 0 HA SER A 29 -5.764 -4.657 -5.399 1.00 0.00 H new ATOM 0 HB2 SER A 29 -7.390 -2.432 -6.552 1.00 0.00 H new ATOM 0 HB3 SER A 29 -5.747 -2.562 -7.149 1.00 0.00 H new ATOM 0 HG SER A 29 -7.240 -3.792 -8.408 1.00 0.00 H new ATOM 417 N VAL A 30 -3.759 -3.245 -4.650 1.00 0.00 N ATOM 418 CA VAL A 30 -2.540 -2.450 -4.575 1.00 0.00 C ATOM 419 C VAL A 30 -1.550 -3.061 -5.563 1.00 0.00 C ATOM 420 O VAL A 30 -1.291 -4.263 -5.545 1.00 0.00 O ATOM 421 CB VAL A 30 -1.961 -2.373 -3.148 1.00 0.00 C ATOM 422 CG1 VAL A 30 -0.743 -1.438 -3.099 1.00 0.00 C ATOM 423 CG2 VAL A 30 -3.005 -1.927 -2.115 1.00 0.00 C ATOM 0 H VAL A 30 -3.591 -4.249 -4.590 1.00 0.00 H new ATOM 0 HA VAL A 30 -2.757 -1.414 -4.837 1.00 0.00 H new ATOM 0 HB VAL A 30 -1.648 -3.384 -2.886 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -0.353 -1.401 -2.082 1.00 0.00 H new ATOM 0 HG12 VAL A 30 0.030 -1.812 -3.770 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -1.040 -0.437 -3.410 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -2.546 -1.889 -1.127 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -3.379 -0.938 -2.379 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -3.832 -2.637 -2.104 1.00 0.00 H new ATOM 433 N VAL A 31 -1.014 -2.245 -6.460 1.00 0.00 N ATOM 434 CA VAL A 31 0.126 -2.571 -7.304 1.00 0.00 C ATOM 435 C VAL A 31 1.350 -2.087 -6.528 1.00 0.00 C ATOM 436 O VAL A 31 1.359 -0.913 -6.141 1.00 0.00 O ATOM 437 CB VAL A 31 -0.001 -1.783 -8.627 1.00 0.00 C ATOM 438 CG1 VAL A 31 1.052 -2.196 -9.671 1.00 0.00 C ATOM 439 CG2 VAL A 31 -1.396 -1.913 -9.250 1.00 0.00 C ATOM 0 H VAL A 31 -1.374 -1.305 -6.625 1.00 0.00 H new ATOM 0 HA VAL A 31 0.191 -3.634 -7.538 1.00 0.00 H new ATOM 0 HB VAL A 31 0.172 -0.743 -8.352 1.00 0.00 H new ATOM 0 HG11 VAL A 31 0.914 -1.609 -10.579 1.00 0.00 H new ATOM 0 HG12 VAL A 31 2.050 -2.017 -9.272 1.00 0.00 H new ATOM 0 HG13 VAL A 31 0.939 -3.255 -9.903 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -1.435 -1.342 -10.177 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -1.604 -2.962 -9.461 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -2.142 -1.528 -8.555 1.00 0.00 H new ATOM 449 N VAL A 32 2.394 -2.899 -6.344 1.00 0.00 N ATOM 450 CA VAL A 32 3.679 -2.399 -5.858 1.00 0.00 C ATOM 451 C VAL A 32 4.829 -2.975 -6.691 1.00 0.00 C ATOM 452 O VAL A 32 4.739 -4.055 -7.280 1.00 0.00 O ATOM 453 CB VAL A 32 3.780 -2.519 -4.321 1.00 0.00 C ATOM 454 CG1 VAL A 32 3.788 -3.968 -3.853 1.00 0.00 C ATOM 455 CG2 VAL A 32 4.992 -1.785 -3.722 1.00 0.00 C ATOM 0 H VAL A 32 2.373 -3.903 -6.524 1.00 0.00 H new ATOM 0 HA VAL A 32 3.764 -1.324 -6.019 1.00 0.00 H new ATOM 0 HB VAL A 32 2.879 -2.028 -3.952 1.00 0.00 H new ATOM 0 HG11 VAL A 32 3.860 -3.999 -2.766 1.00 0.00 H new ATOM 0 HG12 VAL A 32 2.867 -4.458 -4.169 1.00 0.00 H new ATOM 0 HG13 VAL A 32 4.642 -4.486 -4.288 1.00 0.00 H new ATOM 0 HG21 VAL A 32 4.997 -1.914 -2.640 1.00 0.00 H new ATOM 0 HG22 VAL A 32 5.910 -2.197 -4.140 1.00 0.00 H new ATOM 0 HG23 VAL A 32 4.929 -0.723 -3.961 1.00 0.00 H new ATOM 465 N VAL A 33 5.906 -2.204 -6.785 1.00 0.00 N ATOM 466 CA VAL A 33 7.112 -2.448 -7.566 1.00 0.00 C ATOM 467 C VAL A 33 8.265 -2.100 -6.613 1.00 0.00 C ATOM 468 O VAL A 33 8.057 -1.325 -5.677 1.00 0.00 O ATOM 469 CB VAL A 33 7.095 -1.509 -8.800 1.00 0.00 C ATOM 470 CG1 VAL A 33 8.359 -1.637 -9.671 1.00 0.00 C ATOM 471 CG2 VAL A 33 5.870 -1.656 -9.725 1.00 0.00 C ATOM 0 H VAL A 33 5.962 -1.322 -6.276 1.00 0.00 H new ATOM 0 HA VAL A 33 7.202 -3.470 -7.935 1.00 0.00 H new ATOM 0 HB VAL A 33 7.048 -0.524 -8.336 1.00 0.00 H new ATOM 0 HG11 VAL A 33 8.288 -0.955 -10.518 1.00 0.00 H new ATOM 0 HG12 VAL A 33 9.237 -1.386 -9.076 1.00 0.00 H new ATOM 0 HG13 VAL A 33 8.448 -2.660 -10.035 1.00 0.00 H new ATOM 0 HG21 VAL A 33 5.955 -0.956 -10.556 1.00 0.00 H new ATOM 0 HG22 VAL A 33 5.826 -2.674 -10.112 1.00 0.00 H new ATOM 0 HG23 VAL A 33 4.961 -1.442 -9.162 1.00 0.00 H new ATOM 481 N ALA A 34 9.479 -2.603 -6.850 1.00 0.00 N ATOM 482 CA ALA A 34 10.675 -1.951 -6.332 1.00 0.00 C ATOM 483 C ALA A 34 11.762 -2.025 -7.388 1.00 0.00 C ATOM 484 O ALA A 34 12.064 -3.113 -7.883 1.00 0.00 O ATOM 485 CB ALA A 34 11.157 -2.586 -5.028 1.00 0.00 C ATOM 0 H ALA A 34 9.655 -3.450 -7.391 1.00 0.00 H new ATOM 0 HA ALA A 34 10.434 -0.912 -6.106 1.00 0.00 H new ATOM 0 HB1 ALA A 34 12.050 -2.068 -4.679 1.00 0.00 H new ATOM 0 HB2 ALA A 34 10.374 -2.507 -4.274 1.00 0.00 H new ATOM 0 HB3 ALA A 34 11.391 -3.637 -5.200 1.00 0.00 H new ATOM 491 N ASN A 35 12.355 -0.883 -7.720 1.00 0.00 N ATOM 492 CA ASN A 35 13.527 -0.818 -8.587 1.00 0.00 C ATOM 493 C ASN A 35 14.750 -1.210 -7.762 1.00 0.00 C ATOM 494 O ASN A 35 15.081 -0.492 -6.819 1.00 0.00 O ATOM 495 CB ASN A 35 13.668 0.609 -9.143 1.00 0.00 C ATOM 496 CG ASN A 35 14.847 0.807 -10.093 1.00 0.00 C ATOM 497 OD1 ASN A 35 15.792 0.029 -10.152 1.00 0.00 O ATOM 498 ND2 ASN A 35 14.837 1.894 -10.845 1.00 0.00 N ATOM 0 H ASN A 35 12.035 0.029 -7.394 1.00 0.00 H new ATOM 0 HA ASN A 35 13.429 -1.501 -9.430 1.00 0.00 H new ATOM 0 HB2 ASN A 35 12.749 0.874 -9.666 1.00 0.00 H new ATOM 0 HB3 ASN A 35 13.771 1.302 -8.308 1.00 0.00 H new ATOM 0 HD21 ASN A 35 15.616 2.086 -11.475 1.00 0.00 H new ATOM 0 HD22 ASN A 35 14.050 2.541 -10.795 1.00 0.00 H new ATOM 505 N GLY A 36 15.413 -2.317 -8.097 1.00 0.00 N ATOM 506 CA GLY A 36 16.794 -2.582 -7.717 1.00 0.00 C ATOM 507 C GLY A 36 16.994 -3.754 -6.756 1.00 0.00 C ATOM 508 O GLY A 36 18.142 -4.146 -6.539 1.00 0.00 O ATOM 0 H GLY A 36 14.995 -3.066 -8.650 1.00 0.00 H new ATOM 0 HA2 GLY A 36 17.372 -2.772 -8.621 1.00 0.00 H new ATOM 0 HA3 GLY A 36 17.206 -1.683 -7.258 1.00 0.00 H new ATOM 512 N THR A 37 15.927 -4.317 -6.182 1.00 0.00 N ATOM 513 CA THR A 37 16.009 -5.384 -5.187 1.00 0.00 C ATOM 514 C THR A 37 14.690 -6.184 -5.153 1.00 0.00 C ATOM 515 O THR A 37 13.817 -5.976 -6.003 1.00 0.00 O ATOM 516 CB THR A 37 16.436 -4.759 -3.845 1.00 0.00 C ATOM 517 OG1 THR A 37 16.946 -5.730 -2.952 1.00 0.00 O ATOM 518 CG2 THR A 37 15.288 -3.987 -3.203 1.00 0.00 C ATOM 0 H THR A 37 14.970 -4.039 -6.400 1.00 0.00 H new ATOM 0 HA THR A 37 16.768 -6.124 -5.441 1.00 0.00 H new ATOM 0 HB THR A 37 17.240 -4.055 -4.063 1.00 0.00 H new ATOM 0 HG1 THR A 37 17.490 -5.290 -2.266 1.00 0.00 H new ATOM 0 HG21 THR A 37 15.621 -3.558 -2.258 1.00 0.00 H new ATOM 0 HG22 THR A 37 14.968 -3.188 -3.871 1.00 0.00 H new ATOM 0 HG23 THR A 37 14.452 -4.663 -3.020 1.00 0.00 H new ATOM 526 N GLN A 38 14.544 -7.109 -4.200 1.00 0.00 N ATOM 527 CA GLN A 38 13.367 -7.956 -4.032 1.00 0.00 C ATOM 528 C GLN A 38 12.421 -7.351 -2.984 1.00 0.00 C ATOM 529 O GLN A 38 12.689 -6.300 -2.396 1.00 0.00 O ATOM 530 CB GLN A 38 13.795 -9.394 -3.671 1.00 0.00 C ATOM 531 CG GLN A 38 13.674 -10.392 -4.834 1.00 0.00 C ATOM 532 CD GLN A 38 13.991 -11.808 -4.353 1.00 0.00 C ATOM 533 OE1 GLN A 38 14.926 -12.033 -3.588 1.00 0.00 O ATOM 534 NE2 GLN A 38 13.262 -12.815 -4.790 1.00 0.00 N ATOM 0 H GLN A 38 15.267 -7.292 -3.504 1.00 0.00 H new ATOM 0 HA GLN A 38 12.818 -8.006 -4.972 1.00 0.00 H new ATOM 0 HB2 GLN A 38 14.828 -9.379 -3.325 1.00 0.00 H new ATOM 0 HB3 GLN A 38 13.185 -9.746 -2.839 1.00 0.00 H new ATOM 0 HG2 GLN A 38 12.666 -10.358 -5.248 1.00 0.00 H new ATOM 0 HG3 GLN A 38 14.357 -10.111 -5.636 1.00 0.00 H new ATOM 0 HE21 GLN A 38 12.483 -12.643 -5.425 1.00 0.00 H new ATOM 0 HE22 GLN A 38 13.477 -13.767 -4.493 1.00 0.00 H new ATOM 543 N LEU A 39 11.277 -8.004 -2.786 1.00 0.00 N ATOM 544 CA LEU A 39 10.123 -7.546 -2.020 1.00 0.00 C ATOM 545 C LEU A 39 9.925 -8.507 -0.850 1.00 0.00 C ATOM 546 O LEU A 39 10.469 -9.612 -0.874 1.00 0.00 O ATOM 547 CB LEU A 39 8.912 -7.554 -2.961 1.00 0.00 C ATOM 548 CG LEU A 39 8.759 -6.324 -3.872 1.00 0.00 C ATOM 549 CD1 LEU A 39 8.151 -5.136 -3.150 1.00 0.00 C ATOM 550 CD2 LEU A 39 10.053 -5.819 -4.517 1.00 0.00 C ATOM 0 H LEU A 39 11.123 -8.930 -3.185 1.00 0.00 H new ATOM 0 HA LEU A 39 10.259 -6.539 -1.625 1.00 0.00 H new ATOM 0 HB2 LEU A 39 8.971 -8.442 -3.590 1.00 0.00 H new ATOM 0 HB3 LEU A 39 8.009 -7.650 -2.358 1.00 0.00 H new ATOM 0 HG LEU A 39 8.101 -6.703 -4.654 1.00 0.00 H new ATOM 0 HD11 LEU A 39 8.066 -4.296 -3.839 1.00 0.00 H new ATOM 0 HD12 LEU A 39 7.161 -5.403 -2.779 1.00 0.00 H new ATOM 0 HD13 LEU A 39 8.788 -4.854 -2.312 1.00 0.00 H new ATOM 0 HD21 LEU A 39 9.835 -4.950 -5.138 1.00 0.00 H new ATOM 0 HD22 LEU A 39 10.763 -5.539 -3.738 1.00 0.00 H new ATOM 0 HD23 LEU A 39 10.484 -6.608 -5.134 1.00 0.00 H new ATOM 562 N LYS A 40 9.183 -8.112 0.182 1.00 0.00 N ATOM 563 CA LYS A 40 9.074 -8.854 1.433 1.00 0.00 C ATOM 564 C LYS A 40 7.626 -8.807 1.871 1.00 0.00 C ATOM 565 O LYS A 40 7.043 -7.718 1.910 1.00 0.00 O ATOM 566 CB LYS A 40 9.991 -8.210 2.482 1.00 0.00 C ATOM 567 CG LYS A 40 10.140 -9.070 3.743 1.00 0.00 C ATOM 568 CD LYS A 40 10.884 -8.278 4.826 1.00 0.00 C ATOM 569 CE LYS A 40 11.125 -9.167 6.049 1.00 0.00 C ATOM 570 NZ LYS A 40 11.126 -8.391 7.306 1.00 0.00 N ATOM 0 H LYS A 40 8.632 -7.254 0.171 1.00 0.00 H new ATOM 0 HA LYS A 40 9.382 -9.892 1.308 1.00 0.00 H new ATOM 0 HB2 LYS A 40 10.975 -8.040 2.044 1.00 0.00 H new ATOM 0 HB3 LYS A 40 9.592 -7.234 2.758 1.00 0.00 H new ATOM 0 HG2 LYS A 40 9.158 -9.369 4.108 1.00 0.00 H new ATOM 0 HG3 LYS A 40 10.685 -9.984 3.509 1.00 0.00 H new ATOM 0 HD2 LYS A 40 11.835 -7.916 4.435 1.00 0.00 H new ATOM 0 HD3 LYS A 40 10.303 -7.401 5.112 1.00 0.00 H new ATOM 0 HE2 LYS A 40 10.352 -9.934 6.097 1.00 0.00 H new ATOM 0 HE3 LYS A 40 12.079 -9.682 5.940 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 11.292 -9.031 8.109 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 11.880 -7.675 7.272 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 10.206 -7.920 7.424 1.00 0.00 H new ATOM 584 N ASP A 41 7.052 -9.966 2.164 1.00 0.00 N ATOM 585 CA ASP A 41 5.715 -10.053 2.727 1.00 0.00 C ATOM 586 C ASP A 41 5.794 -9.784 4.225 1.00 0.00 C ATOM 587 O ASP A 41 6.414 -10.557 4.959 1.00 0.00 O ATOM 588 CB ASP A 41 5.043 -11.401 2.447 1.00 0.00 C ATOM 589 CG ASP A 41 3.534 -11.181 2.511 1.00 0.00 C ATOM 590 OD1 ASP A 41 3.054 -10.726 3.573 1.00 0.00 O ATOM 591 OD2 ASP A 41 2.872 -11.317 1.455 1.00 0.00 O ATOM 0 H ASP A 41 7.501 -10.870 2.018 1.00 0.00 H new ATOM 0 HA ASP A 41 5.091 -9.300 2.244 1.00 0.00 H new ATOM 0 HB2 ASP A 41 5.335 -11.779 1.467 1.00 0.00 H new ATOM 0 HB3 ASP A 41 5.354 -12.145 3.181 1.00 0.00 H new ATOM 596 N GLY A 42 5.210 -8.678 4.690 1.00 0.00 N ATOM 597 CA GLY A 42 5.222 -8.284 6.093 1.00 0.00 C ATOM 598 C GLY A 42 4.154 -8.984 6.934 1.00 0.00 C ATOM 599 O GLY A 42 3.980 -8.625 8.100 1.00 0.00 O ATOM 0 H GLY A 42 4.709 -8.023 4.090 1.00 0.00 H new ATOM 0 HA2 GLY A 42 6.204 -8.500 6.514 1.00 0.00 H new ATOM 0 HA3 GLY A 42 5.077 -7.206 6.160 1.00 0.00 H new ATOM 603 N ALA A 43 3.449 -9.989 6.405 1.00 0.00 N ATOM 604 CA ALA A 43 2.785 -10.981 7.241 1.00 0.00 C ATOM 605 C ALA A 43 3.854 -11.725 8.043 1.00 0.00 C ATOM 606 O ALA A 43 3.908 -11.657 9.273 1.00 0.00 O ATOM 607 CB ALA A 43 1.971 -11.949 6.373 1.00 0.00 C ATOM 0 H ALA A 43 3.326 -10.133 5.403 1.00 0.00 H new ATOM 0 HA ALA A 43 2.090 -10.495 7.926 1.00 0.00 H new ATOM 0 HB1 ALA A 43 1.480 -12.685 7.010 1.00 0.00 H new ATOM 0 HB2 ALA A 43 1.218 -11.392 5.815 1.00 0.00 H new ATOM 0 HB3 ALA A 43 2.636 -12.459 5.676 1.00 0.00 H new ATOM 613 N THR A 44 4.716 -12.448 7.336 1.00 0.00 N ATOM 614 CA THR A 44 5.451 -13.576 7.885 1.00 0.00 C ATOM 615 C THR A 44 6.948 -13.476 7.593 1.00 0.00 C ATOM 616 O THR A 44 7.749 -14.006 8.366 1.00 0.00 O ATOM 617 CB THR A 44 4.789 -14.880 7.380 1.00 0.00 C ATOM 618 OG1 THR A 44 4.240 -14.748 6.078 1.00 0.00 O ATOM 619 CG2 THR A 44 3.618 -15.241 8.299 1.00 0.00 C ATOM 0 H THR A 44 4.925 -12.263 6.355 1.00 0.00 H new ATOM 0 HA THR A 44 5.395 -13.574 8.974 1.00 0.00 H new ATOM 0 HB THR A 44 5.572 -15.638 7.370 1.00 0.00 H new ATOM 0 HG1 THR A 44 3.836 -15.598 5.806 1.00 0.00 H new ATOM 0 HG21 THR A 44 3.149 -16.159 7.947 1.00 0.00 H new ATOM 0 HG22 THR A 44 3.985 -15.388 9.315 1.00 0.00 H new ATOM 0 HG23 THR A 44 2.886 -14.433 8.290 1.00 0.00 H new ATOM 627 N GLY A 45 7.347 -12.687 6.594 1.00 0.00 N ATOM 628 CA GLY A 45 8.733 -12.410 6.263 1.00 0.00 C ATOM 629 C GLY A 45 9.214 -13.312 5.141 1.00 0.00 C ATOM 630 O GLY A 45 10.281 -13.921 5.246 1.00 0.00 O ATOM 0 H GLY A 45 6.688 -12.211 5.977 1.00 0.00 H new ATOM 0 HA2 GLY A 45 8.838 -11.366 5.966 1.00 0.00 H new ATOM 0 HA3 GLY A 45 9.357 -12.555 7.145 1.00 0.00 H new ATOM 634 N GLU A 46 8.404 -13.421 4.091 1.00 0.00 N ATOM 635 CA GLU A 46 8.676 -14.264 2.933 1.00 0.00 C ATOM 636 C GLU A 46 9.213 -13.349 1.833 1.00 0.00 C ATOM 637 O GLU A 46 8.660 -12.268 1.610 1.00 0.00 O ATOM 638 CB GLU A 46 7.411 -15.043 2.505 1.00 0.00 C ATOM 639 CG GLU A 46 6.574 -15.501 3.715 1.00 0.00 C ATOM 640 CD GLU A 46 5.629 -16.670 3.434 1.00 0.00 C ATOM 641 OE1 GLU A 46 6.071 -17.838 3.569 1.00 0.00 O ATOM 642 OE2 GLU A 46 4.424 -16.475 3.161 1.00 0.00 O ATOM 0 H GLU A 46 7.522 -12.914 4.021 1.00 0.00 H new ATOM 0 HA GLU A 46 9.418 -15.029 3.163 1.00 0.00 H new ATOM 0 HB2 GLU A 46 6.799 -14.413 1.859 1.00 0.00 H new ATOM 0 HB3 GLU A 46 7.703 -15.913 1.917 1.00 0.00 H new ATOM 0 HG2 GLU A 46 7.251 -15.785 4.521 1.00 0.00 H new ATOM 0 HG3 GLU A 46 5.987 -14.656 4.074 1.00 0.00 H new ATOM 649 N SER A 47 10.314 -13.724 1.184 1.00 0.00 N ATOM 650 CA SER A 47 10.886 -12.958 0.085 1.00 0.00 C ATOM 651 C SER A 47 10.062 -13.189 -1.180 1.00 0.00 C ATOM 652 O SER A 47 9.779 -14.331 -1.555 1.00 0.00 O ATOM 653 CB SER A 47 12.356 -13.334 -0.112 1.00 0.00 C ATOM 654 OG SER A 47 12.563 -14.730 0.009 1.00 0.00 O ATOM 0 H SER A 47 10.834 -14.572 1.409 1.00 0.00 H new ATOM 0 HA SER A 47 10.853 -11.894 0.319 1.00 0.00 H new ATOM 0 HB2 SER A 47 12.687 -13.001 -1.096 1.00 0.00 H new ATOM 0 HB3 SER A 47 12.967 -12.811 0.624 1.00 0.00 H new ATOM 0 HG SER A 47 13.512 -14.933 -0.124 1.00 0.00 H new ATOM 660 N LEU A 48 9.700 -12.101 -1.849 1.00 0.00 N ATOM 661 CA LEU A 48 8.867 -12.056 -3.038 1.00 0.00 C ATOM 662 C LEU A 48 9.649 -11.386 -4.168 1.00 0.00 C ATOM 663 O LEU A 48 10.707 -10.792 -3.949 1.00 0.00 O ATOM 664 CB LEU A 48 7.578 -11.275 -2.753 1.00 0.00 C ATOM 665 CG LEU A 48 6.794 -11.683 -1.498 1.00 0.00 C ATOM 666 CD1 LEU A 48 5.615 -10.722 -1.382 1.00 0.00 C ATOM 667 CD2 LEU A 48 6.297 -13.129 -1.556 1.00 0.00 C ATOM 0 H LEU A 48 10.000 -11.171 -1.555 1.00 0.00 H new ATOM 0 HA LEU A 48 8.596 -13.070 -3.332 1.00 0.00 H new ATOM 0 HB2 LEU A 48 7.831 -10.218 -2.669 1.00 0.00 H new ATOM 0 HB3 LEU A 48 6.919 -11.377 -3.615 1.00 0.00 H new ATOM 0 HG LEU A 48 7.449 -11.628 -0.628 1.00 0.00 H new ATOM 0 HD11 LEU A 48 5.026 -10.974 -0.500 1.00 0.00 H new ATOM 0 HD12 LEU A 48 5.985 -9.701 -1.291 1.00 0.00 H new ATOM 0 HD13 LEU A 48 4.990 -10.804 -2.271 1.00 0.00 H new ATOM 0 HD21 LEU A 48 5.750 -13.363 -0.643 1.00 0.00 H new ATOM 0 HD22 LEU A 48 5.638 -13.253 -2.416 1.00 0.00 H new ATOM 0 HD23 LEU A 48 7.148 -13.803 -1.651 1.00 0.00 H new ATOM 679 N ALA A 49 9.121 -11.474 -5.385 1.00 0.00 N ATOM 680 CA ALA A 49 9.780 -11.158 -6.642 1.00 0.00 C ATOM 681 C ALA A 49 8.937 -10.102 -7.366 1.00 0.00 C ATOM 682 O ALA A 49 7.809 -10.385 -7.766 1.00 0.00 O ATOM 683 CB ALA A 49 9.867 -12.459 -7.446 1.00 0.00 C ATOM 0 H ALA A 49 8.161 -11.788 -5.525 1.00 0.00 H new ATOM 0 HA ALA A 49 10.784 -10.757 -6.501 1.00 0.00 H new ATOM 0 HB1 ALA A 49 10.357 -12.265 -8.400 1.00 0.00 H new ATOM 0 HB2 ALA A 49 10.443 -13.195 -6.885 1.00 0.00 H new ATOM 0 HB3 ALA A 49 8.863 -12.844 -7.625 1.00 0.00 H new ATOM 689 N SER A 50 9.432 -8.868 -7.452 1.00 0.00 N ATOM 690 CA SER A 50 8.684 -7.740 -8.018 1.00 0.00 C ATOM 691 C SER A 50 8.426 -7.898 -9.533 1.00 0.00 C ATOM 692 O SER A 50 9.112 -8.687 -10.200 1.00 0.00 O ATOM 693 CB SER A 50 9.363 -6.407 -7.621 1.00 0.00 C ATOM 694 OG SER A 50 9.345 -5.324 -8.545 1.00 0.00 O ATOM 0 H SER A 50 10.367 -8.619 -7.130 1.00 0.00 H new ATOM 0 HA SER A 50 7.684 -7.727 -7.585 1.00 0.00 H new ATOM 0 HB2 SER A 50 8.896 -6.061 -6.699 1.00 0.00 H new ATOM 0 HB3 SER A 50 10.405 -6.625 -7.388 1.00 0.00 H new ATOM 0 HG SER A 50 10.252 -4.967 -8.648 1.00 0.00 H new ATOM 700 N PRO A 51 7.500 -7.095 -10.095 1.00 0.00 N ATOM 701 CA PRO A 51 6.466 -6.371 -9.355 1.00 0.00 C ATOM 702 C PRO A 51 5.424 -7.355 -8.810 1.00 0.00 C ATOM 703 O PRO A 51 5.491 -8.553 -9.083 1.00 0.00 O ATOM 704 CB PRO A 51 5.903 -5.372 -10.359 1.00 0.00 C ATOM 705 CG PRO A 51 5.991 -6.126 -11.675 1.00 0.00 C ATOM 706 CD PRO A 51 7.295 -6.914 -11.525 1.00 0.00 C ATOM 0 HA PRO A 51 6.839 -5.847 -8.475 1.00 0.00 H new ATOM 0 HB2 PRO A 51 4.876 -5.095 -10.120 1.00 0.00 H new ATOM 0 HB3 PRO A 51 6.485 -4.451 -10.382 1.00 0.00 H new ATOM 0 HG2 PRO A 51 5.135 -6.784 -11.823 1.00 0.00 H new ATOM 0 HG3 PRO A 51 6.023 -5.449 -12.528 1.00 0.00 H new ATOM 0 HD2 PRO A 51 7.229 -7.876 -12.033 1.00 0.00 H new ATOM 0 HD3 PRO A 51 8.129 -6.374 -11.972 1.00 0.00 H new ATOM 714 N VAL A 52 4.500 -6.876 -7.979 1.00 0.00 N ATOM 715 CA VAL A 52 3.536 -7.721 -7.298 1.00 0.00 C ATOM 716 C VAL A 52 2.244 -6.957 -7.086 1.00 0.00 C ATOM 717 O VAL A 52 2.239 -5.735 -6.910 1.00 0.00 O ATOM 718 CB VAL A 52 4.168 -8.246 -6.005 1.00 0.00 C ATOM 719 CG1 VAL A 52 4.574 -7.138 -5.031 1.00 0.00 C ATOM 720 CG2 VAL A 52 3.309 -9.274 -5.261 1.00 0.00 C ATOM 0 H VAL A 52 4.403 -5.884 -7.762 1.00 0.00 H new ATOM 0 HA VAL A 52 3.274 -8.591 -7.900 1.00 0.00 H new ATOM 0 HB VAL A 52 5.068 -8.749 -6.359 1.00 0.00 H new ATOM 0 HG11 VAL A 52 5.014 -7.582 -4.138 1.00 0.00 H new ATOM 0 HG12 VAL A 52 5.303 -6.483 -5.508 1.00 0.00 H new ATOM 0 HG13 VAL A 52 3.694 -6.558 -4.752 1.00 0.00 H new ATOM 0 HG21 VAL A 52 3.827 -9.595 -4.358 1.00 0.00 H new ATOM 0 HG22 VAL A 52 2.354 -8.823 -4.991 1.00 0.00 H new ATOM 0 HG23 VAL A 52 3.134 -10.136 -5.905 1.00 0.00 H new ATOM 730 N ILE A 53 1.146 -7.699 -7.110 1.00 0.00 N ATOM 731 CA ILE A 53 -0.196 -7.196 -6.992 1.00 0.00 C ATOM 732 C ILE A 53 -0.729 -7.812 -5.710 1.00 0.00 C ATOM 733 O ILE A 53 -0.886 -9.032 -5.586 1.00 0.00 O ATOM 734 CB ILE A 53 -0.996 -7.564 -8.258 1.00 0.00 C ATOM 735 CG1 ILE A 53 -0.337 -7.076 -9.571 1.00 0.00 C ATOM 736 CG2 ILE A 53 -2.428 -7.024 -8.185 1.00 0.00 C ATOM 737 CD1 ILE A 53 0.089 -5.602 -9.604 1.00 0.00 C ATOM 0 H ILE A 53 1.179 -8.713 -7.218 1.00 0.00 H new ATOM 0 HA ILE A 53 -0.265 -6.110 -6.928 1.00 0.00 H new ATOM 0 HB ILE A 53 -1.008 -8.654 -8.283 1.00 0.00 H new ATOM 0 HG12 ILE A 53 0.542 -7.692 -9.764 1.00 0.00 H new ATOM 0 HG13 ILE A 53 -1.034 -7.250 -10.391 1.00 0.00 H new ATOM 0 HG21 ILE A 53 -2.967 -7.299 -9.091 1.00 0.00 H new ATOM 0 HG22 ILE A 53 -2.934 -7.450 -7.318 1.00 0.00 H new ATOM 0 HG23 ILE A 53 -2.403 -5.938 -8.093 1.00 0.00 H new ATOM 0 HD11 ILE A 53 0.537 -5.374 -10.571 1.00 0.00 H new ATOM 0 HD12 ILE A 53 -0.784 -4.967 -9.450 1.00 0.00 H new ATOM 0 HD13 ILE A 53 0.816 -5.416 -8.814 1.00 0.00 H new ATOM 749 N LEU A 54 -0.946 -6.953 -4.721 1.00 0.00 N ATOM 750 CA LEU A 54 -1.776 -7.285 -3.590 1.00 0.00 C ATOM 751 C LEU A 54 -3.198 -7.179 -4.125 1.00 0.00 C ATOM 752 O LEU A 54 -3.727 -6.079 -4.308 1.00 0.00 O ATOM 753 CB LEU A 54 -1.544 -6.360 -2.390 1.00 0.00 C ATOM 754 CG LEU A 54 -0.168 -6.360 -1.705 1.00 0.00 C ATOM 755 CD1 LEU A 54 0.158 -7.746 -1.157 1.00 0.00 C ATOM 756 CD2 LEU A 54 0.979 -5.849 -2.585 1.00 0.00 C ATOM 0 H LEU A 54 -0.550 -6.014 -4.689 1.00 0.00 H new ATOM 0 HA LEU A 54 -1.549 -8.278 -3.202 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -1.750 -5.340 -2.716 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -2.288 -6.609 -1.634 1.00 0.00 H new ATOM 0 HG LEU A 54 -0.251 -5.646 -0.885 1.00 0.00 H new ATOM 0 HD11 LEU A 54 1.136 -7.726 -0.676 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -0.599 -8.037 -0.429 1.00 0.00 H new ATOM 0 HD13 LEU A 54 0.171 -8.467 -1.975 1.00 0.00 H new ATOM 0 HD21 LEU A 54 1.912 -5.883 -2.023 1.00 0.00 H new ATOM 0 HD22 LEU A 54 1.066 -6.478 -3.471 1.00 0.00 H new ATOM 0 HD23 LEU A 54 0.776 -4.822 -2.888 1.00 0.00 H new ATOM 768 N SER A 55 -3.777 -8.323 -4.453 1.00 0.00 N ATOM 769 CA SER A 55 -5.167 -8.429 -4.847 1.00 0.00 C ATOM 770 C SER A 55 -5.995 -8.713 -3.593 1.00 0.00 C ATOM 771 O SER A 55 -5.486 -8.716 -2.471 1.00 0.00 O ATOM 772 CB SER A 55 -5.316 -9.500 -5.932 1.00 0.00 C ATOM 773 OG SER A 55 -4.640 -9.085 -7.097 1.00 0.00 O ATOM 0 H SER A 55 -3.284 -9.216 -4.452 1.00 0.00 H new ATOM 0 HA SER A 55 -5.534 -7.501 -5.286 1.00 0.00 H new ATOM 0 HB2 SER A 55 -4.909 -10.448 -5.581 1.00 0.00 H new ATOM 0 HB3 SER A 55 -6.371 -9.667 -6.151 1.00 0.00 H new ATOM 0 HG SER A 55 -4.733 -9.770 -7.791 1.00 0.00 H new ATOM 779 N ASP A 56 -7.294 -8.932 -3.777 1.00 0.00 N ATOM 780 CA ASP A 56 -8.261 -8.924 -2.683 1.00 0.00 C ATOM 781 C ASP A 56 -8.027 -10.015 -1.635 1.00 0.00 C ATOM 782 O ASP A 56 -8.414 -9.846 -0.481 1.00 0.00 O ATOM 783 CB ASP A 56 -9.668 -9.071 -3.253 1.00 0.00 C ATOM 784 CG ASP A 56 -10.664 -8.513 -2.254 1.00 0.00 C ATOM 785 OD1 ASP A 56 -10.679 -7.275 -2.127 1.00 0.00 O ATOM 786 OD2 ASP A 56 -11.425 -9.261 -1.610 1.00 0.00 O ATOM 0 H ASP A 56 -7.707 -9.120 -4.691 1.00 0.00 H new ATOM 0 HA ASP A 56 -8.135 -7.971 -2.170 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -9.748 -8.540 -4.201 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -9.885 -10.120 -3.456 1.00 0.00 H new ATOM 791 N GLU A 57 -7.372 -11.108 -2.040 1.00 0.00 N ATOM 792 CA GLU A 57 -6.932 -12.194 -1.172 1.00 0.00 C ATOM 793 C GLU A 57 -5.875 -11.681 -0.192 1.00 0.00 C ATOM 794 O GLU A 57 -5.960 -11.915 1.012 1.00 0.00 O ATOM 795 CB GLU A 57 -6.334 -13.329 -2.026 1.00 0.00 C ATOM 796 CG GLU A 57 -7.373 -14.061 -2.890 1.00 0.00 C ATOM 797 CD GLU A 57 -6.818 -15.386 -3.419 1.00 0.00 C ATOM 798 OE1 GLU A 57 -6.623 -16.325 -2.621 1.00 0.00 O ATOM 799 OE2 GLU A 57 -6.611 -15.534 -4.650 1.00 0.00 O ATOM 0 H GLU A 57 -7.127 -11.262 -3.018 1.00 0.00 H new ATOM 0 HA GLU A 57 -7.787 -12.572 -0.612 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -5.561 -12.916 -2.674 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -5.848 -14.050 -1.369 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -8.271 -14.249 -2.302 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -7.666 -13.427 -3.726 1.00 0.00 H new ATOM 806 N GLU A 58 -4.884 -10.950 -0.703 1.00 0.00 N ATOM 807 CA GLU A 58 -3.739 -10.470 0.065 1.00 0.00 C ATOM 808 C GLU A 58 -4.141 -9.309 0.986 1.00 0.00 C ATOM 809 O GLU A 58 -3.388 -8.901 1.867 1.00 0.00 O ATOM 810 CB GLU A 58 -2.625 -9.991 -0.882 1.00 0.00 C ATOM 811 CG GLU A 58 -2.470 -10.695 -2.239 1.00 0.00 C ATOM 812 CD GLU A 58 -2.238 -12.201 -2.229 1.00 0.00 C ATOM 813 OE1 GLU A 58 -2.092 -12.834 -1.157 1.00 0.00 O ATOM 814 OE2 GLU A 58 -2.138 -12.738 -3.359 1.00 0.00 O ATOM 0 H GLU A 58 -4.856 -10.670 -1.683 1.00 0.00 H new ATOM 0 HA GLU A 58 -3.377 -11.299 0.673 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -2.785 -8.930 -1.074 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -1.677 -10.079 -0.351 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -3.368 -10.497 -2.825 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -1.637 -10.230 -2.766 1.00 0.00 H new ATOM 821 N LEU A 59 -5.326 -8.743 0.754 1.00 0.00 N ATOM 822 CA LEU A 59 -5.869 -7.576 1.443 1.00 0.00 C ATOM 823 C LEU A 59 -7.143 -7.936 2.215 1.00 0.00 C ATOM 824 O LEU A 59 -7.917 -7.058 2.592 1.00 0.00 O ATOM 825 CB LEU A 59 -6.060 -6.447 0.417 1.00 0.00 C ATOM 826 CG LEU A 59 -4.716 -5.806 0.014 1.00 0.00 C ATOM 827 CD1 LEU A 59 -4.772 -5.205 -1.390 1.00 0.00 C ATOM 828 CD2 LEU A 59 -4.318 -4.692 0.988 1.00 0.00 C ATOM 0 H LEU A 59 -5.963 -9.106 0.045 1.00 0.00 H new ATOM 0 HA LEU A 59 -5.173 -7.218 2.201 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -6.555 -6.842 -0.470 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -6.716 -5.683 0.835 1.00 0.00 H new ATOM 0 HG LEU A 59 -3.978 -6.608 0.039 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -3.806 -4.764 -1.636 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -5.008 -5.987 -2.112 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -5.542 -4.435 -1.426 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -3.367 -4.260 0.677 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -5.085 -3.918 0.989 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -4.218 -5.105 1.992 1.00 0.00 H new ATOM 840 N ALA A 60 -7.356 -9.221 2.500 1.00 0.00 N ATOM 841 CA ALA A 60 -8.449 -9.751 3.312 1.00 0.00 C ATOM 842 C ALA A 60 -8.288 -9.465 4.817 1.00 0.00 C ATOM 843 O ALA A 60 -8.963 -10.072 5.651 1.00 0.00 O ATOM 844 CB ALA A 60 -8.589 -11.252 3.045 1.00 0.00 C ATOM 0 H ALA A 60 -6.740 -9.956 2.153 1.00 0.00 H new ATOM 0 HA ALA A 60 -9.361 -9.233 3.016 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -9.403 -11.654 3.648 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -8.804 -11.415 1.989 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -7.659 -11.757 3.308 1.00 0.00 H new ATOM 850 N VAL A 61 -7.379 -8.571 5.189 1.00 0.00 N ATOM 851 CA VAL A 61 -6.815 -8.386 6.518 1.00 0.00 C ATOM 852 C VAL A 61 -6.871 -6.902 6.888 1.00 0.00 C ATOM 853 O VAL A 61 -6.961 -6.027 6.027 1.00 0.00 O ATOM 854 CB VAL A 61 -5.359 -8.911 6.533 1.00 0.00 C ATOM 855 CG1 VAL A 61 -5.260 -10.414 6.767 1.00 0.00 C ATOM 856 CG2 VAL A 61 -4.621 -8.623 5.222 1.00 0.00 C ATOM 0 H VAL A 61 -6.989 -7.908 4.519 1.00 0.00 H new ATOM 0 HA VAL A 61 -7.390 -8.947 7.255 1.00 0.00 H new ATOM 0 HB VAL A 61 -4.899 -8.376 7.364 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -4.212 -10.714 6.765 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -5.707 -10.663 7.729 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -5.790 -10.941 5.974 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -3.604 -9.011 5.284 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -5.144 -9.106 4.396 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -4.589 -7.547 5.051 1.00 0.00 H new ATOM 866 N GLU A 62 -6.784 -6.614 8.184 1.00 0.00 N ATOM 867 CA GLU A 62 -6.900 -5.261 8.731 1.00 0.00 C ATOM 868 C GLU A 62 -5.778 -4.325 8.261 1.00 0.00 C ATOM 869 O GLU A 62 -5.979 -3.111 8.162 1.00 0.00 O ATOM 870 CB GLU A 62 -6.963 -5.346 10.274 1.00 0.00 C ATOM 871 CG GLU A 62 -5.797 -6.138 10.897 1.00 0.00 C ATOM 872 CD GLU A 62 -5.713 -6.077 12.430 1.00 0.00 C ATOM 873 OE1 GLU A 62 -6.753 -6.205 13.118 1.00 0.00 O ATOM 874 OE2 GLU A 62 -4.582 -5.944 12.962 1.00 0.00 O ATOM 0 H GLU A 62 -6.628 -7.326 8.898 1.00 0.00 H new ATOM 0 HA GLU A 62 -7.821 -4.819 8.351 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -6.966 -4.337 10.685 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -7.904 -5.812 10.566 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -5.885 -7.182 10.595 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -4.861 -5.763 10.482 1.00 0.00 H new ATOM 881 N LYS A 63 -4.576 -4.859 8.027 1.00 0.00 N ATOM 882 CA LYS A 63 -3.359 -4.051 8.024 1.00 0.00 C ATOM 883 C LYS A 63 -2.279 -4.867 7.347 1.00 0.00 C ATOM 884 O LYS A 63 -2.014 -5.974 7.820 1.00 0.00 O ATOM 885 CB LYS A 63 -2.992 -3.739 9.483 1.00 0.00 C ATOM 886 CG LYS A 63 -2.108 -2.517 9.698 1.00 0.00 C ATOM 887 CD LYS A 63 -0.656 -2.610 9.209 1.00 0.00 C ATOM 888 CE LYS A 63 0.134 -1.325 9.495 1.00 0.00 C ATOM 889 NZ LYS A 63 0.060 -0.901 10.908 1.00 0.00 N ATOM 0 H LYS A 63 -4.422 -5.849 7.837 1.00 0.00 H new ATOM 0 HA LYS A 63 -3.485 -3.109 7.490 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -3.914 -3.601 10.048 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -2.487 -4.608 9.905 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -2.578 -1.668 9.202 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -2.092 -2.294 10.765 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -0.164 -3.453 9.694 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -0.647 -2.809 8.137 1.00 0.00 H new ATOM 0 HE2 LYS A 63 1.178 -1.479 9.223 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -0.246 -0.524 8.861 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 0.754 -0.146 11.081 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -0.896 -0.547 11.115 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 0.270 -1.711 11.525 1.00 0.00 H new ATOM 903 N VAL A 64 -1.702 -4.353 6.261 1.00 0.00 N ATOM 904 CA VAL A 64 -0.796 -5.123 5.417 1.00 0.00 C ATOM 905 C VAL A 64 0.440 -4.262 5.169 1.00 0.00 C ATOM 906 O VAL A 64 0.446 -3.384 4.299 1.00 0.00 O ATOM 907 CB VAL A 64 -1.483 -5.603 4.111 1.00 0.00 C ATOM 908 CG1 VAL A 64 -0.811 -6.865 3.561 1.00 0.00 C ATOM 909 CG2 VAL A 64 -2.965 -5.918 4.318 1.00 0.00 C ATOM 0 H VAL A 64 -1.850 -3.395 5.945 1.00 0.00 H new ATOM 0 HA VAL A 64 -0.497 -6.044 5.917 1.00 0.00 H new ATOM 0 HB VAL A 64 -1.383 -4.779 3.404 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -1.315 -7.176 2.646 1.00 0.00 H new ATOM 0 HG12 VAL A 64 0.236 -6.655 3.345 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -0.876 -7.663 4.300 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -3.402 -6.250 3.376 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -3.069 -6.706 5.064 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -3.483 -5.023 4.662 1.00 0.00 H new ATOM 919 N THR A 65 1.460 -4.429 6.000 1.00 0.00 N ATOM 920 CA THR A 65 2.736 -3.752 5.825 1.00 0.00 C ATOM 921 C THR A 65 3.560 -4.542 4.807 1.00 0.00 C ATOM 922 O THR A 65 3.687 -5.758 4.947 1.00 0.00 O ATOM 923 CB THR A 65 3.447 -3.669 7.179 1.00 0.00 C ATOM 924 OG1 THR A 65 2.546 -3.195 8.163 1.00 0.00 O ATOM 925 CG2 THR A 65 4.659 -2.736 7.094 1.00 0.00 C ATOM 0 H THR A 65 1.425 -5.040 6.816 1.00 0.00 H new ATOM 0 HA THR A 65 2.598 -2.736 5.454 1.00 0.00 H new ATOM 0 HB THR A 65 3.794 -4.665 7.453 1.00 0.00 H new ATOM 0 HG1 THR A 65 3.003 -3.145 9.028 1.00 0.00 H new ATOM 0 HG21 THR A 65 5.151 -2.690 8.065 1.00 0.00 H new ATOM 0 HG22 THR A 65 5.359 -3.116 6.350 1.00 0.00 H new ATOM 0 HG23 THR A 65 4.330 -1.738 6.806 1.00 0.00 H new ATOM 933 N LEU A 66 4.120 -3.889 3.787 1.00 0.00 N ATOM 934 CA LEU A 66 4.990 -4.523 2.794 1.00 0.00 C ATOM 935 C LEU A 66 6.242 -3.670 2.655 1.00 0.00 C ATOM 936 O LEU A 66 6.175 -2.446 2.771 1.00 0.00 O ATOM 937 CB LEU A 66 4.309 -4.660 1.419 1.00 0.00 C ATOM 938 CG LEU A 66 3.214 -5.720 1.228 1.00 0.00 C ATOM 939 CD1 LEU A 66 3.646 -7.115 1.682 1.00 0.00 C ATOM 940 CD2 LEU A 66 1.911 -5.332 1.910 1.00 0.00 C ATOM 0 H LEU A 66 3.980 -2.892 3.625 1.00 0.00 H new ATOM 0 HA LEU A 66 5.227 -5.531 3.135 1.00 0.00 H new ATOM 0 HB2 LEU A 66 3.875 -3.692 1.170 1.00 0.00 H new ATOM 0 HB3 LEU A 66 5.090 -4.858 0.684 1.00 0.00 H new ATOM 0 HG LEU A 66 3.042 -5.761 0.152 1.00 0.00 H new ATOM 0 HD11 LEU A 66 2.829 -7.819 1.522 1.00 0.00 H new ATOM 0 HD12 LEU A 66 4.516 -7.432 1.107 1.00 0.00 H new ATOM 0 HD13 LEU A 66 3.901 -7.090 2.742 1.00 0.00 H new ATOM 0 HD21 LEU A 66 1.168 -6.113 1.746 1.00 0.00 H new ATOM 0 HD22 LEU A 66 2.082 -5.212 2.980 1.00 0.00 H new ATOM 0 HD23 LEU A 66 1.548 -4.393 1.493 1.00 0.00 H new ATOM 952 N SER A 67 7.385 -4.300 2.399 1.00 0.00 N ATOM 953 CA SER A 67 8.668 -3.616 2.278 1.00 0.00 C ATOM 954 C SER A 67 9.536 -4.311 1.237 1.00 0.00 C ATOM 955 O SER A 67 9.222 -5.403 0.766 1.00 0.00 O ATOM 956 CB SER A 67 9.340 -3.609 3.657 1.00 0.00 C ATOM 957 OG SER A 67 10.492 -2.777 3.717 1.00 0.00 O ATOM 0 H SER A 67 7.447 -5.310 2.268 1.00 0.00 H new ATOM 0 HA SER A 67 8.524 -2.588 1.945 1.00 0.00 H new ATOM 0 HB2 SER A 67 8.619 -3.274 4.403 1.00 0.00 H new ATOM 0 HB3 SER A 67 9.622 -4.628 3.921 1.00 0.00 H new ATOM 0 HG SER A 67 10.381 -2.019 3.105 1.00 0.00 H new ATOM 963 N THR A 68 10.661 -3.693 0.898 1.00 0.00 N ATOM 964 CA THR A 68 11.700 -4.318 0.111 1.00 0.00 C ATOM 965 C THR A 68 12.548 -5.244 0.994 1.00 0.00 C ATOM 966 O THR A 68 12.535 -5.151 2.227 1.00 0.00 O ATOM 967 CB THR A 68 12.522 -3.209 -0.565 1.00 0.00 C ATOM 968 OG1 THR A 68 13.016 -2.250 0.355 1.00 0.00 O ATOM 969 CG2 THR A 68 11.640 -2.474 -1.579 1.00 0.00 C ATOM 0 H THR A 68 10.873 -2.733 1.168 1.00 0.00 H new ATOM 0 HA THR A 68 11.277 -4.950 -0.670 1.00 0.00 H new ATOM 0 HB THR A 68 13.373 -3.695 -1.042 1.00 0.00 H new ATOM 0 HG1 THR A 68 13.983 -2.149 0.235 1.00 0.00 H new ATOM 0 HG21 THR A 68 12.219 -1.686 -2.061 1.00 0.00 H new ATOM 0 HG22 THR A 68 11.288 -3.178 -2.333 1.00 0.00 H new ATOM 0 HG23 THR A 68 10.785 -2.034 -1.066 1.00 0.00 H new ATOM 977 N THR A 69 13.345 -6.110 0.369 1.00 0.00 N ATOM 978 CA THR A 69 14.403 -6.856 1.046 1.00 0.00 C ATOM 979 C THR A 69 15.731 -6.088 1.027 1.00 0.00 C ATOM 980 O THR A 69 16.746 -6.583 1.527 1.00 0.00 O ATOM 981 CB THR A 69 14.549 -8.248 0.419 1.00 0.00 C ATOM 982 OG1 THR A 69 14.802 -8.170 -0.970 1.00 0.00 O ATOM 983 CG2 THR A 69 13.283 -9.082 0.604 1.00 0.00 C ATOM 0 H THR A 69 13.274 -6.314 -0.628 1.00 0.00 H new ATOM 0 HA THR A 69 14.123 -6.979 2.092 1.00 0.00 H new ATOM 0 HB THR A 69 15.390 -8.718 0.929 1.00 0.00 H new ATOM 0 HG1 THR A 69 15.341 -8.940 -1.248 1.00 0.00 H new ATOM 0 HG21 THR A 69 13.423 -10.062 0.147 1.00 0.00 H new ATOM 0 HG22 THR A 69 13.079 -9.203 1.668 1.00 0.00 H new ATOM 0 HG23 THR A 69 12.442 -8.577 0.129 1.00 0.00 H new ATOM 991 N GLY A 70 15.767 -4.884 0.451 1.00 0.00 N ATOM 992 CA GLY A 70 16.983 -4.106 0.413 1.00 0.00 C ATOM 993 C GLY A 70 16.793 -2.700 -0.118 1.00 0.00 C ATOM 994 O GLY A 70 15.682 -2.171 -0.200 1.00 0.00 O ATOM 0 H GLY A 70 14.964 -4.437 0.009 1.00 0.00 H new ATOM 0 HA2 GLY A 70 17.400 -4.051 1.419 1.00 0.00 H new ATOM 0 HA3 GLY A 70 17.715 -4.623 -0.208 1.00 0.00 H new ATOM 998 N LYS A 71 17.930 -2.118 -0.475 1.00 0.00 N ATOM 999 CA LYS A 71 18.120 -0.858 -1.168 1.00 0.00 C ATOM 1000 C LYS A 71 17.264 -0.832 -2.429 1.00 0.00 C ATOM 1001 O LYS A 71 17.500 -1.638 -3.332 1.00 0.00 O ATOM 1002 CB LYS A 71 19.617 -0.794 -1.521 1.00 0.00 C ATOM 1003 CG LYS A 71 20.240 0.561 -1.804 1.00 0.00 C ATOM 1004 CD LYS A 71 19.396 1.497 -2.670 1.00 0.00 C ATOM 1005 CE LYS A 71 20.294 2.549 -3.308 1.00 0.00 C ATOM 1006 NZ LYS A 71 21.001 2.032 -4.503 1.00 0.00 N ATOM 0 H LYS A 71 18.825 -2.561 -0.265 1.00 0.00 H new ATOM 0 HA LYS A 71 17.825 -0.004 -0.558 1.00 0.00 H new ATOM 0 HB2 LYS A 71 20.171 -1.247 -0.699 1.00 0.00 H new ATOM 0 HB3 LYS A 71 19.777 -1.422 -2.398 1.00 0.00 H new ATOM 0 HG2 LYS A 71 20.443 1.055 -0.854 1.00 0.00 H new ATOM 0 HG3 LYS A 71 21.201 0.406 -2.294 1.00 0.00 H new ATOM 0 HD2 LYS A 71 18.880 0.927 -3.443 1.00 0.00 H new ATOM 0 HD3 LYS A 71 18.629 1.978 -2.063 1.00 0.00 H new ATOM 0 HE2 LYS A 71 19.694 3.414 -3.589 1.00 0.00 H new ATOM 0 HE3 LYS A 71 21.025 2.893 -2.576 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 22.028 2.062 -4.339 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 20.708 1.051 -4.682 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 20.765 2.620 -5.328 1.00 0.00 H new ATOM 1020 N ALA A 72 16.338 0.113 -2.534 1.00 0.00 N ATOM 1021 CA ALA A 72 15.522 0.306 -3.719 1.00 0.00 C ATOM 1022 C ALA A 72 15.635 1.745 -4.216 1.00 0.00 C ATOM 1023 O ALA A 72 16.180 2.605 -3.522 1.00 0.00 O ATOM 1024 CB ALA A 72 14.077 -0.075 -3.403 1.00 0.00 C ATOM 0 H ALA A 72 16.132 0.775 -1.786 1.00 0.00 H new ATOM 0 HA ALA A 72 15.879 -0.339 -4.522 1.00 0.00 H new ATOM 0 HB1 ALA A 72 13.461 0.068 -4.290 1.00 0.00 H new ATOM 0 HB2 ALA A 72 14.035 -1.120 -3.097 1.00 0.00 H new ATOM 0 HB3 ALA A 72 13.703 0.555 -2.596 1.00 0.00 H new ATOM 1030 N ILE A 73 15.153 1.990 -5.437 1.00 0.00 N ATOM 1031 CA ILE A 73 15.176 3.295 -6.083 1.00 0.00 C ATOM 1032 C ILE A 73 13.773 3.703 -6.537 1.00 0.00 C ATOM 1033 O ILE A 73 13.640 4.784 -7.094 1.00 0.00 O ATOM 1034 CB ILE A 73 16.119 3.302 -7.312 1.00 0.00 C ATOM 1035 CG1 ILE A 73 17.246 2.252 -7.317 1.00 0.00 C ATOM 1036 CG2 ILE A 73 16.723 4.710 -7.492 1.00 0.00 C ATOM 1037 CD1 ILE A 73 18.211 2.241 -6.132 1.00 0.00 C ATOM 0 H ILE A 73 14.726 1.265 -6.014 1.00 0.00 H new ATOM 0 HA ILE A 73 15.546 4.008 -5.346 1.00 0.00 H new ATOM 0 HB ILE A 73 15.480 3.020 -8.149 1.00 0.00 H new ATOM 0 HG12 ILE A 73 16.786 1.266 -7.384 1.00 0.00 H new ATOM 0 HG13 ILE A 73 17.832 2.393 -8.225 1.00 0.00 H new ATOM 0 HG21 ILE A 73 17.386 4.714 -8.357 1.00 0.00 H new ATOM 0 HG22 ILE A 73 15.922 5.433 -7.646 1.00 0.00 H new ATOM 0 HG23 ILE A 73 17.288 4.980 -6.600 1.00 0.00 H new ATOM 0 HD11 ILE A 73 18.949 1.451 -6.271 1.00 0.00 H new ATOM 0 HD12 ILE A 73 18.717 3.204 -6.066 1.00 0.00 H new ATOM 0 HD13 ILE A 73 17.655 2.060 -5.212 1.00 0.00 H new ATOM 1049 N GLU A 74 12.748 2.857 -6.369 1.00 0.00 N ATOM 1050 CA GLU A 74 11.354 3.214 -6.608 1.00 0.00 C ATOM 1051 C GLU A 74 10.450 2.382 -5.718 1.00 0.00 C ATOM 1052 O GLU A 74 10.885 1.327 -5.242 1.00 0.00 O ATOM 1053 CB GLU A 74 10.907 2.962 -8.054 1.00 0.00 C ATOM 1054 CG GLU A 74 11.645 3.807 -9.083 1.00 0.00 C ATOM 1055 CD GLU A 74 10.925 3.912 -10.434 1.00 0.00 C ATOM 1056 OE1 GLU A 74 9.814 3.361 -10.626 1.00 0.00 O ATOM 1057 OE2 GLU A 74 11.502 4.542 -11.346 1.00 0.00 O ATOM 0 H GLU A 74 12.872 1.893 -6.059 1.00 0.00 H new ATOM 0 HA GLU A 74 11.278 4.280 -6.394 1.00 0.00 H new ATOM 0 HB2 GLU A 74 11.054 1.908 -8.291 1.00 0.00 H new ATOM 0 HB3 GLU A 74 9.838 3.161 -8.134 1.00 0.00 H new ATOM 0 HG2 GLU A 74 11.788 4.810 -8.680 1.00 0.00 H new ATOM 0 HG3 GLU A 74 12.636 3.383 -9.243 1.00 0.00 H new ATOM 1064 N PHE A 75 9.202 2.834 -5.561 1.00 0.00 N ATOM 1065 CA PHE A 75 8.154 2.165 -4.809 1.00 0.00 C ATOM 1066 C PHE A 75 6.793 2.727 -5.236 1.00 0.00 C ATOM 1067 O PHE A 75 6.168 3.518 -4.521 1.00 0.00 O ATOM 1068 CB PHE A 75 8.442 2.359 -3.314 1.00 0.00 C ATOM 1069 CG PHE A 75 7.936 1.285 -2.396 1.00 0.00 C ATOM 1070 CD1 PHE A 75 8.331 -0.049 -2.607 1.00 0.00 C ATOM 1071 CD2 PHE A 75 7.240 1.642 -1.232 1.00 0.00 C ATOM 1072 CE1 PHE A 75 8.038 -1.029 -1.646 1.00 0.00 C ATOM 1073 CE2 PHE A 75 6.975 0.664 -0.271 1.00 0.00 C ATOM 1074 CZ PHE A 75 7.364 -0.670 -0.467 1.00 0.00 C ATOM 0 H PHE A 75 8.889 3.712 -5.974 1.00 0.00 H new ATOM 0 HA PHE A 75 8.130 1.094 -5.009 1.00 0.00 H new ATOM 0 HB2 PHE A 75 9.521 2.443 -3.181 1.00 0.00 H new ATOM 0 HB3 PHE A 75 8.008 3.309 -3.002 1.00 0.00 H new ATOM 0 HD1 PHE A 75 8.860 -0.319 -3.509 1.00 0.00 H new ATOM 0 HD2 PHE A 75 6.913 2.660 -1.081 1.00 0.00 H new ATOM 0 HE1 PHE A 75 8.330 -2.055 -1.812 1.00 0.00 H new ATOM 0 HE2 PHE A 75 6.462 0.939 0.639 1.00 0.00 H new ATOM 0 HZ PHE A 75 7.147 -1.416 0.284 1.00 0.00 H new ATOM 1084 N ALA A 76 6.353 2.376 -6.444 1.00 0.00 N ATOM 1085 CA ALA A 76 5.057 2.802 -6.960 1.00 0.00 C ATOM 1086 C ALA A 76 3.932 2.134 -6.175 1.00 0.00 C ATOM 1087 O ALA A 76 4.044 0.951 -5.857 1.00 0.00 O ATOM 1088 CB ALA A 76 4.947 2.447 -8.443 1.00 0.00 C ATOM 0 H ALA A 76 6.884 1.791 -7.089 1.00 0.00 H new ATOM 0 HA ALA A 76 4.968 3.882 -6.846 1.00 0.00 H new ATOM 0 HB1 ALA A 76 3.977 2.768 -8.823 1.00 0.00 H new ATOM 0 HB2 ALA A 76 5.738 2.951 -8.997 1.00 0.00 H new ATOM 0 HB3 ALA A 76 5.047 1.369 -8.567 1.00 0.00 H new ATOM 1094 N VAL A 77 2.825 2.843 -5.951 1.00 0.00 N ATOM 1095 CA VAL A 77 1.635 2.395 -5.243 1.00 0.00 C ATOM 1096 C VAL A 77 0.433 2.995 -5.986 1.00 0.00 C ATOM 1097 O VAL A 77 0.247 4.214 -6.009 1.00 0.00 O ATOM 1098 CB VAL A 77 1.711 2.813 -3.754 1.00 0.00 C ATOM 1099 CG1 VAL A 77 0.394 2.554 -3.010 1.00 0.00 C ATOM 1100 CG2 VAL A 77 2.816 2.053 -3.001 1.00 0.00 C ATOM 0 H VAL A 77 2.734 3.804 -6.281 1.00 0.00 H new ATOM 0 HA VAL A 77 1.541 1.309 -5.233 1.00 0.00 H new ATOM 0 HB VAL A 77 1.927 3.881 -3.769 1.00 0.00 H new ATOM 0 HG11 VAL A 77 0.497 2.863 -1.970 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -0.408 3.124 -3.480 1.00 0.00 H new ATOM 0 HG13 VAL A 77 0.156 1.491 -3.051 1.00 0.00 H new ATOM 0 HG21 VAL A 77 2.835 2.376 -1.960 1.00 0.00 H new ATOM 0 HG22 VAL A 77 2.616 0.982 -3.045 1.00 0.00 H new ATOM 0 HG23 VAL A 77 3.781 2.261 -3.463 1.00 0.00 H new ATOM 1110 N SER A 78 -0.391 2.147 -6.600 1.00 0.00 N ATOM 1111 CA SER A 78 -1.671 2.535 -7.194 1.00 0.00 C ATOM 1112 C SER A 78 -2.756 1.594 -6.674 1.00 0.00 C ATOM 1113 O SER A 78 -2.432 0.495 -6.211 1.00 0.00 O ATOM 1114 CB SER A 78 -1.580 2.453 -8.721 1.00 0.00 C ATOM 1115 OG SER A 78 -0.514 3.226 -9.234 1.00 0.00 O ATOM 0 H SER A 78 -0.185 1.153 -6.701 1.00 0.00 H new ATOM 0 HA SER A 78 -1.916 3.561 -6.919 1.00 0.00 H new ATOM 0 HB2 SER A 78 -1.449 1.413 -9.020 1.00 0.00 H new ATOM 0 HB3 SER A 78 -2.518 2.795 -9.158 1.00 0.00 H new ATOM 0 HG SER A 78 -0.491 3.144 -10.210 1.00 0.00 H new ATOM 1121 N GLY A 79 -4.029 1.996 -6.726 1.00 0.00 N ATOM 1122 CA GLY A 79 -5.139 1.192 -6.226 1.00 0.00 C ATOM 1123 C GLY A 79 -6.325 2.057 -5.819 1.00 0.00 C ATOM 1124 O GLY A 79 -6.315 3.267 -6.060 1.00 0.00 O ATOM 0 H GLY A 79 -4.316 2.893 -7.118 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -5.451 0.485 -6.995 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -4.806 0.605 -5.370 1.00 0.00 H new ATOM 1128 N GLY A 80 -7.330 1.430 -5.204 1.00 0.00 N ATOM 1129 CA GLY A 80 -8.531 2.069 -4.688 1.00 0.00 C ATOM 1130 C GLY A 80 -9.515 1.042 -4.140 1.00 0.00 C ATOM 1131 O GLY A 80 -9.303 -0.160 -4.325 1.00 0.00 O ATOM 0 H GLY A 80 -7.324 0.422 -5.048 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -8.261 2.773 -3.901 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -9.008 2.645 -5.481 1.00 0.00 H new ATOM 1135 N VAL A 81 -10.597 1.513 -3.515 1.00 0.00 N ATOM 1136 CA VAL A 81 -11.733 0.707 -3.065 1.00 0.00 C ATOM 1137 C VAL A 81 -13.036 1.518 -3.139 1.00 0.00 C ATOM 1138 O VAL A 81 -13.094 2.647 -2.649 1.00 0.00 O ATOM 1139 CB VAL A 81 -11.539 0.182 -1.625 1.00 0.00 C ATOM 1140 CG1 VAL A 81 -10.755 -1.129 -1.588 1.00 0.00 C ATOM 1141 CG2 VAL A 81 -10.861 1.176 -0.669 1.00 0.00 C ATOM 0 H VAL A 81 -10.709 2.504 -3.301 1.00 0.00 H new ATOM 0 HA VAL A 81 -11.795 -0.151 -3.735 1.00 0.00 H new ATOM 0 HB VAL A 81 -12.559 0.024 -1.273 1.00 0.00 H new ATOM 0 HG11 VAL A 81 -10.645 -1.458 -0.555 1.00 0.00 H new ATOM 0 HG12 VAL A 81 -11.291 -1.890 -2.156 1.00 0.00 H new ATOM 0 HG13 VAL A 81 -9.769 -0.976 -2.027 1.00 0.00 H new ATOM 0 HG21 VAL A 81 -10.766 0.724 0.318 1.00 0.00 H new ATOM 0 HG22 VAL A 81 -9.871 1.429 -1.049 1.00 0.00 H new ATOM 0 HG23 VAL A 81 -11.464 2.081 -0.597 1.00 0.00 H new ATOM 1266 N GLU A 91 -21.641 0.502 6.702 1.00 0.00 N ATOM 1267 CA GLU A 91 -20.981 1.760 7.032 1.00 0.00 C ATOM 1268 C GLU A 91 -19.741 1.924 6.166 1.00 0.00 C ATOM 1269 O GLU A 91 -19.126 0.923 5.822 1.00 0.00 O ATOM 1270 CB GLU A 91 -20.525 1.804 8.494 1.00 0.00 C ATOM 1271 CG GLU A 91 -21.552 2.520 9.380 1.00 0.00 C ATOM 1272 CD GLU A 91 -20.866 3.155 10.591 1.00 0.00 C ATOM 1273 OE1 GLU A 91 -20.570 2.425 11.572 1.00 0.00 O ATOM 1274 OE2 GLU A 91 -20.618 4.383 10.567 1.00 0.00 O ATOM 0 HA GLU A 91 -21.705 2.556 6.858 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -20.372 0.789 8.860 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -19.565 2.315 8.562 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -22.067 3.288 8.802 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -22.310 1.811 9.714 1.00 0.00 H new ATOM 1281 N PRO A 92 -19.323 3.162 5.880 1.00 0.00 N ATOM 1282 CA PRO A 92 -18.255 3.421 4.934 1.00 0.00 C ATOM 1283 C PRO A 92 -16.845 3.256 5.523 1.00 0.00 C ATOM 1284 O PRO A 92 -16.677 2.987 6.719 1.00 0.00 O ATOM 1285 CB PRO A 92 -18.525 4.848 4.485 1.00 0.00 C ATOM 1286 CG PRO A 92 -19.090 5.514 5.733 1.00 0.00 C ATOM 1287 CD PRO A 92 -19.956 4.402 6.302 1.00 0.00 C ATOM 0 HA PRO A 92 -18.259 2.700 4.116 1.00 0.00 H new ATOM 0 HB2 PRO A 92 -17.614 5.341 4.145 1.00 0.00 H new ATOM 0 HB3 PRO A 92 -19.233 4.881 3.657 1.00 0.00 H new ATOM 0 HG2 PRO A 92 -18.306 5.819 6.426 1.00 0.00 H new ATOM 0 HG3 PRO A 92 -19.670 6.406 5.496 1.00 0.00 H new ATOM 0 HD2 PRO A 92 -20.011 4.464 7.389 1.00 0.00 H new ATOM 0 HD3 PRO A 92 -20.977 4.469 5.927 1.00 0.00 H new ATOM 1295 N MET A 93 -15.803 3.492 4.711 1.00 0.00 N ATOM 1296 CA MET A 93 -14.432 3.121 5.017 1.00 0.00 C ATOM 1297 C MET A 93 -13.465 4.254 4.731 1.00 0.00 C ATOM 1298 O MET A 93 -13.782 5.235 4.047 1.00 0.00 O ATOM 1299 CB MET A 93 -14.011 1.868 4.234 1.00 0.00 C ATOM 1300 CG MET A 93 -13.795 2.102 2.732 1.00 0.00 C ATOM 1301 SD MET A 93 -13.264 0.655 1.777 1.00 0.00 S ATOM 1302 CE MET A 93 -12.184 -0.226 2.939 1.00 0.00 C ATOM 0 H MET A 93 -15.902 3.956 3.808 1.00 0.00 H new ATOM 0 HA MET A 93 -14.394 2.902 6.084 1.00 0.00 H new ATOM 0 HB2 MET A 93 -13.089 1.478 4.665 1.00 0.00 H new ATOM 0 HB3 MET A 93 -14.773 1.100 4.364 1.00 0.00 H new ATOM 0 HG2 MET A 93 -14.726 2.475 2.304 1.00 0.00 H new ATOM 0 HG3 MET A 93 -13.050 2.888 2.609 1.00 0.00 H new ATOM 0 HE1 MET A 93 -11.771 -1.110 2.453 1.00 0.00 H new ATOM 0 HE2 MET A 93 -11.371 0.430 3.249 1.00 0.00 H new ATOM 0 HE3 MET A 93 -12.760 -0.528 3.814 1.00 0.00 H new ATOM 1312 N GLN A 94 -12.247 4.059 5.210 1.00 0.00 N ATOM 1313 CA GLN A 94 -11.078 4.849 4.933 1.00 0.00 C ATOM 1314 C GLN A 94 -9.906 3.894 4.793 1.00 0.00 C ATOM 1315 O GLN A 94 -9.852 2.810 5.384 1.00 0.00 O ATOM 1316 CB GLN A 94 -10.842 5.823 6.096 1.00 0.00 C ATOM 1317 CG GLN A 94 -11.898 6.932 6.092 1.00 0.00 C ATOM 1318 CD GLN A 94 -11.646 7.911 7.232 1.00 0.00 C ATOM 1319 OE1 GLN A 94 -11.918 7.615 8.392 1.00 0.00 O ATOM 1320 NE2 GLN A 94 -11.092 9.078 6.938 1.00 0.00 N ATOM 0 H GLN A 94 -12.045 3.288 5.846 1.00 0.00 H new ATOM 0 HA GLN A 94 -11.198 5.429 4.018 1.00 0.00 H new ATOM 0 HB2 GLN A 94 -10.877 5.283 7.042 1.00 0.00 H new ATOM 0 HB3 GLN A 94 -9.847 6.260 6.015 1.00 0.00 H new ATOM 0 HG2 GLN A 94 -11.876 7.460 5.139 1.00 0.00 H new ATOM 0 HG3 GLN A 94 -12.892 6.496 6.192 1.00 0.00 H new ATOM 0 HE21 GLN A 94 -10.872 9.309 5.969 1.00 0.00 H new ATOM 0 HE22 GLN A 94 -10.885 9.746 7.681 1.00 0.00 H new ATOM 1329 N TRP A 95 -8.936 4.360 4.027 1.00 0.00 N ATOM 1330 CA TRP A 95 -7.640 3.757 3.836 1.00 0.00 C ATOM 1331 C TRP A 95 -6.672 4.781 4.406 1.00 0.00 C ATOM 1332 O TRP A 95 -6.619 5.909 3.911 1.00 0.00 O ATOM 1333 CB TRP A 95 -7.433 3.492 2.334 1.00 0.00 C ATOM 1334 CG TRP A 95 -7.797 2.127 1.820 1.00 0.00 C ATOM 1335 CD1 TRP A 95 -8.628 1.225 2.400 1.00 0.00 C ATOM 1336 CD2 TRP A 95 -7.227 1.449 0.658 1.00 0.00 C ATOM 1337 NE1 TRP A 95 -8.583 0.032 1.699 1.00 0.00 N ATOM 1338 CE2 TRP A 95 -7.742 0.120 0.611 1.00 0.00 C ATOM 1339 CE3 TRP A 95 -6.279 1.803 -0.328 1.00 0.00 C ATOM 1340 CZ2 TRP A 95 -7.357 -0.796 -0.377 1.00 0.00 C ATOM 1341 CZ3 TRP A 95 -5.904 0.894 -1.334 1.00 0.00 C ATOM 1342 CH2 TRP A 95 -6.442 -0.402 -1.364 1.00 0.00 C ATOM 0 H TRP A 95 -9.044 5.222 3.492 1.00 0.00 H new ATOM 0 HA TRP A 95 -7.506 2.793 4.327 1.00 0.00 H new ATOM 0 HB2 TRP A 95 -8.014 4.228 1.778 1.00 0.00 H new ATOM 0 HB3 TRP A 95 -6.384 3.672 2.101 1.00 0.00 H new ATOM 0 HD1 TRP A 95 -9.233 1.410 3.276 1.00 0.00 H new ATOM 0 HE1 TRP A 95 -9.106 -0.805 1.955 1.00 0.00 H new ATOM 0 HE3 TRP A 95 -5.835 2.787 -0.309 1.00 0.00 H new ATOM 0 HZ2 TRP A 95 -7.762 -1.797 -0.378 1.00 0.00 H new ATOM 0 HZ3 TRP A 95 -5.195 1.196 -2.091 1.00 0.00 H new ATOM 0 HH2 TRP A 95 -6.153 -1.092 -2.143 1.00 0.00 H new ATOM 1353 N VAL A 96 -5.963 4.466 5.487 1.00 0.00 N ATOM 1354 CA VAL A 96 -4.790 5.238 5.891 1.00 0.00 C ATOM 1355 C VAL A 96 -3.603 4.505 5.268 1.00 0.00 C ATOM 1356 O VAL A 96 -3.497 3.281 5.391 1.00 0.00 O ATOM 1357 CB VAL A 96 -4.702 5.388 7.422 1.00 0.00 C ATOM 1358 CG1 VAL A 96 -3.470 6.207 7.814 1.00 0.00 C ATOM 1359 CG2 VAL A 96 -5.934 6.075 8.026 1.00 0.00 C ATOM 0 H VAL A 96 -6.180 3.680 6.100 1.00 0.00 H new ATOM 0 HA VAL A 96 -4.825 6.270 5.541 1.00 0.00 H new ATOM 0 HB VAL A 96 -4.639 4.374 7.816 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -3.426 6.301 8.899 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -2.571 5.705 7.457 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -3.535 7.199 7.366 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -5.814 6.152 9.107 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -6.039 7.073 7.600 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -6.825 5.488 7.801 1.00 0.00 H new ATOM 1369 N VAL A 97 -2.771 5.232 4.524 1.00 0.00 N ATOM 1370 CA VAL A 97 -1.809 4.684 3.592 1.00 0.00 C ATOM 1371 C VAL A 97 -0.524 5.498 3.734 1.00 0.00 C ATOM 1372 O VAL A 97 -0.370 6.594 3.187 1.00 0.00 O ATOM 1373 CB VAL A 97 -2.423 4.668 2.178 1.00 0.00 C ATOM 1374 CG1 VAL A 97 -3.373 3.482 2.023 1.00 0.00 C ATOM 1375 CG2 VAL A 97 -3.201 5.937 1.802 1.00 0.00 C ATOM 0 H VAL A 97 -2.754 6.251 4.561 1.00 0.00 H new ATOM 0 HA VAL A 97 -1.553 3.645 3.800 1.00 0.00 H new ATOM 0 HB VAL A 97 -1.566 4.597 1.508 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -3.798 3.485 1.019 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -2.825 2.553 2.182 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -4.175 3.560 2.757 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -3.596 5.835 0.791 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -4.025 6.079 2.501 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -2.535 6.799 1.846 1.00 0.00 H new ATOM 1385 N THR A 98 0.371 4.991 4.572 1.00 0.00 N ATOM 1386 CA THR A 98 1.620 5.643 4.930 1.00 0.00 C ATOM 1387 C THR A 98 2.715 5.078 4.017 1.00 0.00 C ATOM 1388 O THR A 98 2.530 4.045 3.359 1.00 0.00 O ATOM 1389 CB THR A 98 1.875 5.394 6.435 1.00 0.00 C ATOM 1390 OG1 THR A 98 0.647 5.483 7.141 1.00 0.00 O ATOM 1391 CG2 THR A 98 2.833 6.386 7.089 1.00 0.00 C ATOM 0 H THR A 98 0.243 4.090 5.033 1.00 0.00 H new ATOM 0 HA THR A 98 1.598 6.723 4.785 1.00 0.00 H new ATOM 0 HB THR A 98 2.330 4.405 6.488 1.00 0.00 H new ATOM 0 HG1 THR A 98 0.806 5.324 8.095 1.00 0.00 H new ATOM 0 HG21 THR A 98 2.953 6.135 8.143 1.00 0.00 H new ATOM 0 HG22 THR A 98 3.802 6.338 6.592 1.00 0.00 H new ATOM 0 HG23 THR A 98 2.429 7.395 7.000 1.00 0.00 H new ATOM 1399 N VAL A 99 3.866 5.745 3.958 1.00 0.00 N ATOM 1400 CA VAL A 99 5.096 5.183 3.413 1.00 0.00 C ATOM 1401 C VAL A 99 6.194 5.571 4.394 1.00 0.00 C ATOM 1402 O VAL A 99 6.374 6.749 4.724 1.00 0.00 O ATOM 1403 CB VAL A 99 5.408 5.589 1.953 1.00 0.00 C ATOM 1404 CG1 VAL A 99 6.544 4.725 1.392 1.00 0.00 C ATOM 1405 CG2 VAL A 99 4.199 5.422 1.019 1.00 0.00 C ATOM 0 H VAL A 99 3.970 6.703 4.292 1.00 0.00 H new ATOM 0 HA VAL A 99 5.001 4.101 3.324 1.00 0.00 H new ATOM 0 HB VAL A 99 5.687 6.642 1.987 1.00 0.00 H new ATOM 0 HG11 VAL A 99 6.753 5.021 0.364 1.00 0.00 H new ATOM 0 HG12 VAL A 99 7.439 4.862 1.999 1.00 0.00 H new ATOM 0 HG13 VAL A 99 6.248 3.676 1.414 1.00 0.00 H new ATOM 0 HG21 VAL A 99 4.476 5.722 0.008 1.00 0.00 H new ATOM 0 HG22 VAL A 99 3.884 4.379 1.015 1.00 0.00 H new ATOM 0 HG23 VAL A 99 3.378 6.047 1.371 1.00 0.00 H new ATOM 1415 N TYR A 100 6.880 4.562 4.904 1.00 0.00 N ATOM 1416 CA TYR A 100 8.099 4.667 5.662 1.00 0.00 C ATOM 1417 C TYR A 100 9.265 4.453 4.700 1.00 0.00 C ATOM 1418 O TYR A 100 9.140 3.839 3.638 1.00 0.00 O ATOM 1419 CB TYR A 100 8.086 3.632 6.798 1.00 0.00 C ATOM 1420 CG TYR A 100 6.927 3.798 7.766 1.00 0.00 C ATOM 1421 CD1 TYR A 100 7.046 4.652 8.880 1.00 0.00 C ATOM 1422 CD2 TYR A 100 5.714 3.121 7.528 1.00 0.00 C ATOM 1423 CE1 TYR A 100 5.956 4.838 9.750 1.00 0.00 C ATOM 1424 CE2 TYR A 100 4.620 3.306 8.391 1.00 0.00 C ATOM 1425 CZ TYR A 100 4.739 4.161 9.509 1.00 0.00 C ATOM 1426 OH TYR A 100 3.689 4.295 10.360 1.00 0.00 O ATOM 0 H TYR A 100 6.577 3.595 4.789 1.00 0.00 H new ATOM 0 HA TYR A 100 8.201 5.649 6.124 1.00 0.00 H new ATOM 0 HB2 TYR A 100 8.046 2.632 6.366 1.00 0.00 H new ATOM 0 HB3 TYR A 100 9.022 3.702 7.352 1.00 0.00 H new ATOM 0 HD1 TYR A 100 7.977 5.166 9.067 1.00 0.00 H new ATOM 0 HD2 TYR A 100 5.625 2.458 6.680 1.00 0.00 H new ATOM 0 HE1 TYR A 100 6.049 5.497 10.601 1.00 0.00 H new ATOM 0 HE2 TYR A 100 3.688 2.794 8.199 1.00 0.00 H new ATOM 0 HH TYR A 100 2.935 3.759 10.036 1.00 0.00 H new ATOM 1436 N LYS A 101 10.421 4.970 5.086 1.00 0.00 N ATOM 1437 CA LYS A 101 11.704 4.776 4.451 1.00 0.00 C ATOM 1438 C LYS A 101 12.530 3.883 5.378 1.00 0.00 C ATOM 1439 O LYS A 101 11.983 3.236 6.277 1.00 0.00 O ATOM 1440 CB LYS A 101 12.287 6.175 4.172 1.00 0.00 C ATOM 1441 CG LYS A 101 13.199 6.213 2.946 1.00 0.00 C ATOM 1442 CD LYS A 101 13.358 7.647 2.428 1.00 0.00 C ATOM 1443 CE LYS A 101 14.442 7.786 1.363 1.00 0.00 C ATOM 1444 NZ LYS A 101 14.868 9.186 1.174 1.00 0.00 N ATOM 0 H LYS A 101 10.486 5.575 5.905 1.00 0.00 H new ATOM 0 HA LYS A 101 11.670 4.266 3.488 1.00 0.00 H new ATOM 0 HB2 LYS A 101 11.469 6.881 4.030 1.00 0.00 H new ATOM 0 HB3 LYS A 101 12.848 6.509 5.045 1.00 0.00 H new ATOM 0 HG2 LYS A 101 14.176 5.804 3.202 1.00 0.00 H new ATOM 0 HG3 LYS A 101 12.785 5.582 2.160 1.00 0.00 H new ATOM 0 HD2 LYS A 101 12.407 7.985 2.015 1.00 0.00 H new ATOM 0 HD3 LYS A 101 13.594 8.304 3.265 1.00 0.00 H new ATOM 0 HE2 LYS A 101 15.304 7.182 1.645 1.00 0.00 H new ATOM 0 HE3 LYS A 101 14.071 7.391 0.417 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 15.605 9.229 0.441 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 14.053 9.760 0.879 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 15.247 9.557 2.068 1.00 0.00 H new ATOM 1458 N ASN A 102 13.845 3.870 5.173 1.00 0.00 N ATOM 1459 CA ASN A 102 14.847 3.260 6.039 1.00 0.00 C ATOM 1460 C ASN A 102 14.836 3.962 7.405 1.00 0.00 C ATOM 1461 O ASN A 102 15.605 4.891 7.659 1.00 0.00 O ATOM 1462 CB ASN A 102 16.239 3.217 5.378 1.00 0.00 C ATOM 1463 CG ASN A 102 16.964 4.541 5.162 1.00 0.00 C ATOM 1464 OD1 ASN A 102 18.012 4.817 5.737 1.00 0.00 O ATOM 1465 ND2 ASN A 102 16.483 5.352 4.235 1.00 0.00 N ATOM 0 H ASN A 102 14.261 4.310 4.352 1.00 0.00 H new ATOM 0 HA ASN A 102 14.589 2.214 6.204 1.00 0.00 H new ATOM 0 HB2 ASN A 102 16.880 2.580 5.987 1.00 0.00 H new ATOM 0 HB3 ASN A 102 16.135 2.730 4.408 1.00 0.00 H new ATOM 0 HD21 ASN A 102 16.983 6.208 3.997 1.00 0.00 H new ATOM 0 HD22 ASN A 102 15.612 5.121 3.758 1.00 0.00 H new ATOM 1472 N GLY A 103 13.911 3.539 8.261 1.00 0.00 N ATOM 1473 CA GLY A 103 13.863 3.862 9.685 1.00 0.00 C ATOM 1474 C GLY A 103 13.105 5.146 10.036 1.00 0.00 C ATOM 1475 O GLY A 103 13.310 5.674 11.123 1.00 0.00 O ATOM 0 H GLY A 103 13.141 2.936 7.970 1.00 0.00 H new ATOM 0 HA2 GLY A 103 13.400 3.029 10.215 1.00 0.00 H new ATOM 0 HA3 GLY A 103 14.884 3.948 10.056 1.00 0.00 H new ATOM 1479 N LYS A 104 12.282 5.696 9.135 1.00 0.00 N ATOM 1480 CA LYS A 104 11.539 6.946 9.335 1.00 0.00 C ATOM 1481 C LYS A 104 10.261 6.976 8.493 1.00 0.00 C ATOM 1482 O LYS A 104 10.129 6.147 7.596 1.00 0.00 O ATOM 1483 CB LYS A 104 12.449 8.114 9.041 1.00 0.00 C ATOM 1484 CG LYS A 104 12.828 8.223 7.567 1.00 0.00 C ATOM 1485 CD LYS A 104 14.155 8.951 7.571 1.00 0.00 C ATOM 1486 CE LYS A 104 14.570 9.267 6.131 1.00 0.00 C ATOM 1487 NZ LYS A 104 15.758 10.136 6.066 1.00 0.00 N ATOM 0 H LYS A 104 12.110 5.273 8.223 1.00 0.00 H new ATOM 0 HA LYS A 104 11.216 7.015 10.374 1.00 0.00 H new ATOM 0 HB2 LYS A 104 11.959 9.036 9.353 1.00 0.00 H new ATOM 0 HB3 LYS A 104 13.357 8.018 9.637 1.00 0.00 H new ATOM 0 HG2 LYS A 104 12.916 7.239 7.106 1.00 0.00 H new ATOM 0 HG3 LYS A 104 12.075 8.773 7.003 1.00 0.00 H new ATOM 0 HD2 LYS A 104 14.074 9.872 8.148 1.00 0.00 H new ATOM 0 HD3 LYS A 104 14.916 8.338 8.054 1.00 0.00 H new ATOM 0 HE2 LYS A 104 14.775 8.336 5.602 1.00 0.00 H new ATOM 0 HE3 LYS A 104 13.741 9.751 5.615 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 15.999 10.321 5.071 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 15.556 11.036 6.546 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 16.558 9.665 6.534 1.00 0.00 H new ATOM 1501 N GLU A 105 9.355 7.928 8.713 1.00 0.00 N ATOM 1502 CA GLU A 105 8.124 8.126 7.939 1.00 0.00 C ATOM 1503 C GLU A 105 8.367 9.232 6.892 1.00 0.00 C ATOM 1504 O GLU A 105 8.956 10.260 7.242 1.00 0.00 O ATOM 1505 CB GLU A 105 6.994 8.505 8.918 1.00 0.00 C ATOM 1506 CG GLU A 105 5.607 8.270 8.305 1.00 0.00 C ATOM 1507 CD GLU A 105 4.496 9.012 9.059 1.00 0.00 C ATOM 1508 OE1 GLU A 105 4.457 10.261 8.926 1.00 0.00 O ATOM 1509 OE2 GLU A 105 3.665 8.345 9.720 1.00 0.00 O ATOM 0 H GLU A 105 9.460 8.610 9.464 1.00 0.00 H new ATOM 0 HA GLU A 105 7.835 7.218 7.409 1.00 0.00 H new ATOM 0 HB2 GLU A 105 7.092 7.918 9.831 1.00 0.00 H new ATOM 0 HB3 GLU A 105 7.094 9.553 9.200 1.00 0.00 H new ATOM 0 HG2 GLU A 105 5.614 8.594 7.264 1.00 0.00 H new ATOM 0 HG3 GLU A 105 5.390 7.202 8.305 1.00 0.00 H new ATOM 1516 N ILE A 106 7.942 9.059 5.630 1.00 0.00 N ATOM 1517 CA ILE A 106 8.125 10.060 4.559 1.00 0.00 C ATOM 1518 C ILE A 106 6.837 10.411 3.814 1.00 0.00 C ATOM 1519 O ILE A 106 6.773 11.455 3.165 1.00 0.00 O ATOM 1520 CB ILE A 106 9.231 9.652 3.558 1.00 0.00 C ATOM 1521 CG1 ILE A 106 8.960 8.329 2.799 1.00 0.00 C ATOM 1522 CG2 ILE A 106 10.588 9.600 4.263 1.00 0.00 C ATOM 1523 CD1 ILE A 106 8.238 8.531 1.464 1.00 0.00 C ATOM 0 H ILE A 106 7.458 8.216 5.319 1.00 0.00 H new ATOM 0 HA ILE A 106 8.444 10.963 5.079 1.00 0.00 H new ATOM 0 HB ILE A 106 9.235 10.427 2.791 1.00 0.00 H new ATOM 0 HG12 ILE A 106 9.908 7.822 2.618 1.00 0.00 H new ATOM 0 HG13 ILE A 106 8.363 7.672 3.431 1.00 0.00 H new ATOM 0 HG21 ILE A 106 11.359 9.312 3.548 1.00 0.00 H new ATOM 0 HG22 ILE A 106 10.823 10.582 4.673 1.00 0.00 H new ATOM 0 HG23 ILE A 106 10.551 8.869 5.071 1.00 0.00 H new ATOM 0 HD11 ILE A 106 8.080 7.564 0.986 1.00 0.00 H new ATOM 0 HD12 ILE A 106 7.275 9.010 1.640 1.00 0.00 H new ATOM 0 HD13 ILE A 106 8.844 9.162 0.814 1.00 0.00 H new ATOM 1535 N GLU A 107 5.774 9.626 3.958 1.00 0.00 N ATOM 1536 CA GLU A 107 4.444 9.902 3.412 1.00 0.00 C ATOM 1537 C GLU A 107 3.454 9.729 4.554 1.00 0.00 C ATOM 1538 O GLU A 107 3.757 8.981 5.485 1.00 0.00 O ATOM 1539 CB GLU A 107 4.171 8.883 2.307 1.00 0.00 C ATOM 1540 CG GLU A 107 2.781 8.948 1.665 1.00 0.00 C ATOM 1541 CD GLU A 107 2.455 10.343 1.157 1.00 0.00 C ATOM 1542 OE1 GLU A 107 3.008 10.726 0.101 1.00 0.00 O ATOM 1543 OE2 GLU A 107 1.709 11.061 1.855 1.00 0.00 O ATOM 0 H GLU A 107 5.813 8.748 4.476 1.00 0.00 H new ATOM 0 HA GLU A 107 4.362 10.907 2.997 1.00 0.00 H new ATOM 0 HB2 GLU A 107 4.918 9.016 1.524 1.00 0.00 H new ATOM 0 HB3 GLU A 107 4.314 7.884 2.718 1.00 0.00 H new ATOM 0 HG2 GLU A 107 2.730 8.240 0.838 1.00 0.00 H new ATOM 0 HG3 GLU A 107 2.030 8.642 2.394 1.00 0.00 H new ATOM 1550 N LYS A 108 2.303 10.401 4.519 1.00 0.00 N ATOM 1551 CA LYS A 108 1.258 10.228 5.519 1.00 0.00 C ATOM 1552 C LYS A 108 -0.052 10.742 4.927 1.00 0.00 C ATOM 1553 O LYS A 108 -0.477 11.859 5.236 1.00 0.00 O ATOM 1554 CB LYS A 108 1.653 10.953 6.824 1.00 0.00 C ATOM 1555 CG LYS A 108 0.952 10.327 8.027 1.00 0.00 C ATOM 1556 CD LYS A 108 1.085 11.186 9.287 1.00 0.00 C ATOM 1557 CE LYS A 108 0.896 10.399 10.584 1.00 0.00 C ATOM 1558 NZ LYS A 108 -0.365 9.635 10.649 1.00 0.00 N ATOM 0 H LYS A 108 2.072 11.081 3.794 1.00 0.00 H new ATOM 0 HA LYS A 108 1.127 9.178 5.779 1.00 0.00 H new ATOM 0 HB2 LYS A 108 2.733 10.903 6.960 1.00 0.00 H new ATOM 0 HB3 LYS A 108 1.390 12.008 6.753 1.00 0.00 H new ATOM 0 HG2 LYS A 108 -0.104 10.185 7.796 1.00 0.00 H new ATOM 0 HG3 LYS A 108 1.373 9.339 8.217 1.00 0.00 H new ATOM 0 HD2 LYS A 108 2.069 11.654 9.296 1.00 0.00 H new ATOM 0 HD3 LYS A 108 0.350 11.990 9.249 1.00 0.00 H new ATOM 0 HE2 LYS A 108 1.732 9.710 10.703 1.00 0.00 H new ATOM 0 HE3 LYS A 108 0.932 11.092 11.425 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 -0.434 9.157 11.570 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 -1.170 10.283 10.534 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 -0.381 8.925 9.889 1.00 0.00 H new ATOM 1572 N LYS A 109 -0.701 9.949 4.073 1.00 0.00 N ATOM 1573 CA LYS A 109 -1.988 10.320 3.484 1.00 0.00 C ATOM 1574 C LYS A 109 -3.033 9.262 3.785 1.00 0.00 C ATOM 1575 O LYS A 109 -2.737 8.203 4.338 1.00 0.00 O ATOM 1576 CB LYS A 109 -1.827 10.733 2.002 1.00 0.00 C ATOM 1577 CG LYS A 109 -1.277 9.673 1.030 1.00 0.00 C ATOM 1578 CD LYS A 109 -2.350 8.899 0.250 1.00 0.00 C ATOM 1579 CE LYS A 109 -2.694 9.466 -1.136 1.00 0.00 C ATOM 1580 NZ LYS A 109 -3.373 10.774 -1.118 1.00 0.00 N ATOM 0 H LYS A 109 -0.353 9.039 3.772 1.00 0.00 H new ATOM 0 HA LYS A 109 -2.377 11.223 3.955 1.00 0.00 H new ATOM 0 HB2 LYS A 109 -2.801 11.055 1.634 1.00 0.00 H new ATOM 0 HB3 LYS A 109 -1.168 11.601 1.963 1.00 0.00 H new ATOM 0 HG2 LYS A 109 -0.612 10.163 0.318 1.00 0.00 H new ATOM 0 HG3 LYS A 109 -0.673 8.962 1.593 1.00 0.00 H new ATOM 0 HD2 LYS A 109 -2.015 7.869 0.130 1.00 0.00 H new ATOM 0 HD3 LYS A 109 -3.261 8.870 0.849 1.00 0.00 H new ATOM 0 HE2 LYS A 109 -1.774 9.558 -1.714 1.00 0.00 H new ATOM 0 HE3 LYS A 109 -3.329 8.750 -1.658 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 -3.566 11.078 -2.094 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 -4.269 10.693 -0.597 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 -2.763 11.475 -0.651 1.00 0.00 H new ATOM 1594 N SER A 110 -4.286 9.581 3.496 1.00 0.00 N ATOM 1595 CA SER A 110 -5.422 8.722 3.747 1.00 0.00 C ATOM 1596 C SER A 110 -6.530 9.147 2.800 1.00 0.00 C ATOM 1597 O SER A 110 -6.534 10.285 2.328 1.00 0.00 O ATOM 1598 CB SER A 110 -5.823 8.891 5.219 1.00 0.00 C ATOM 1599 OG SER A 110 -6.995 8.193 5.601 1.00 0.00 O ATOM 0 H SER A 110 -4.542 10.471 3.068 1.00 0.00 H new ATOM 0 HA SER A 110 -5.202 7.669 3.574 1.00 0.00 H new ATOM 0 HB2 SER A 110 -4.997 8.556 5.846 1.00 0.00 H new ATOM 0 HB3 SER A 110 -5.967 9.952 5.422 1.00 0.00 H new ATOM 0 HG SER A 110 -7.048 7.348 5.107 1.00 0.00 H new ATOM 1605 N LEU A 111 -7.436 8.222 2.498 1.00 0.00 N ATOM 1606 CA LEU A 111 -8.571 8.404 1.636 1.00 0.00 C ATOM 1607 C LEU A 111 -9.785 7.864 2.376 1.00 0.00 C ATOM 1608 O LEU A 111 -9.732 7.481 3.547 1.00 0.00 O ATOM 1609 CB LEU A 111 -8.449 7.718 0.271 1.00 0.00 C ATOM 1610 CG LEU A 111 -7.084 7.803 -0.419 1.00 0.00 C ATOM 1611 CD1 LEU A 111 -6.096 6.904 0.309 1.00 0.00 C ATOM 1612 CD2 LEU A 111 -7.229 7.241 -1.811 1.00 0.00 C ATOM 0 H LEU A 111 -7.384 7.276 2.876 1.00 0.00 H new ATOM 0 HA LEU A 111 -8.653 9.468 1.412 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -8.703 6.665 0.395 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -9.195 8.150 -0.396 1.00 0.00 H new ATOM 0 HG LEU A 111 -6.741 8.838 -0.425 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -5.123 6.962 -0.179 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -6.002 7.230 1.345 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -6.454 5.875 0.284 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -6.269 7.290 -2.325 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -7.557 6.203 -1.752 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -7.966 7.823 -2.363 1.00 0.00 H new ATOM 1624 N VAL A 112 -10.893 7.860 1.659 1.00 0.00 N ATOM 1625 CA VAL A 112 -12.242 7.841 2.171 1.00 0.00 C ATOM 1626 C VAL A 112 -13.200 7.537 1.010 1.00 0.00 C ATOM 1627 O VAL A 112 -13.228 8.283 0.025 1.00 0.00 O ATOM 1628 CB VAL A 112 -12.435 9.212 2.858 1.00 0.00 C ATOM 1629 CG1 VAL A 112 -12.246 10.458 1.974 1.00 0.00 C ATOM 1630 CG2 VAL A 112 -13.736 9.307 3.643 1.00 0.00 C ATOM 0 H VAL A 112 -10.868 7.871 0.639 1.00 0.00 H new ATOM 0 HA VAL A 112 -12.448 7.065 2.908 1.00 0.00 H new ATOM 0 HB VAL A 112 -11.596 9.233 3.554 1.00 0.00 H new ATOM 0 HG11 VAL A 112 -12.408 11.356 2.571 1.00 0.00 H new ATOM 0 HG12 VAL A 112 -11.233 10.468 1.571 1.00 0.00 H new ATOM 0 HG13 VAL A 112 -12.963 10.434 1.153 1.00 0.00 H new ATOM 0 HG21 VAL A 112 -13.813 10.293 4.102 1.00 0.00 H new ATOM 0 HG22 VAL A 112 -14.579 9.153 2.970 1.00 0.00 H new ATOM 0 HG23 VAL A 112 -13.748 8.543 4.420 1.00 0.00 H new ATOM 1640 N PHE A 113 -13.965 6.443 1.081 1.00 0.00 N ATOM 1641 CA PHE A 113 -15.033 6.145 0.120 1.00 0.00 C ATOM 1642 C PHE A 113 -16.215 5.488 0.827 1.00 0.00 C ATOM 1643 O PHE A 113 -16.117 5.141 2.007 1.00 0.00 O ATOM 1644 CB PHE A 113 -14.525 5.287 -1.057 1.00 0.00 C ATOM 1645 CG PHE A 113 -14.455 6.043 -2.374 1.00 0.00 C ATOM 1646 CD1 PHE A 113 -15.591 6.708 -2.884 1.00 0.00 C ATOM 1647 CD2 PHE A 113 -13.265 6.050 -3.122 1.00 0.00 C ATOM 1648 CE1 PHE A 113 -15.529 7.388 -4.113 1.00 0.00 C ATOM 1649 CE2 PHE A 113 -13.183 6.776 -4.320 1.00 0.00 C ATOM 1650 CZ PHE A 113 -14.317 7.430 -4.826 1.00 0.00 C ATOM 0 H PHE A 113 -13.861 5.736 1.809 1.00 0.00 H new ATOM 0 HA PHE A 113 -15.373 7.088 -0.308 1.00 0.00 H new ATOM 0 HB2 PHE A 113 -13.534 4.903 -0.815 1.00 0.00 H new ATOM 0 HB3 PHE A 113 -15.181 4.425 -1.177 1.00 0.00 H new ATOM 0 HD1 PHE A 113 -16.515 6.694 -2.326 1.00 0.00 H new ATOM 0 HD2 PHE A 113 -12.408 5.493 -2.772 1.00 0.00 H new ATOM 0 HE1 PHE A 113 -16.408 7.876 -4.508 1.00 0.00 H new ATOM 0 HE2 PHE A 113 -12.246 6.832 -4.854 1.00 0.00 H new ATOM 0 HZ PHE A 113 -14.259 7.965 -5.762 1.00 0.00 H new ATOM 1796 N ASP A 123 -8.289 7.120 -6.764 1.00 0.00 N ATOM 1797 CA ASP A 123 -8.022 6.803 -5.363 1.00 0.00 C ATOM 1798 C ASP A 123 -6.530 7.056 -5.122 1.00 0.00 C ATOM 1799 O ASP A 123 -6.179 8.165 -4.709 1.00 0.00 O ATOM 1800 CB ASP A 123 -8.448 5.363 -5.011 1.00 0.00 C ATOM 1801 CG ASP A 123 -9.713 5.220 -4.154 1.00 0.00 C ATOM 1802 OD1 ASP A 123 -9.751 5.729 -3.011 1.00 0.00 O ATOM 1803 OD2 ASP A 123 -10.615 4.452 -4.560 1.00 0.00 O ATOM 0 HA ASP A 123 -8.614 7.437 -4.703 1.00 0.00 H new ATOM 0 HB2 ASP A 123 -8.600 4.814 -5.940 1.00 0.00 H new ATOM 0 HB3 ASP A 123 -7.623 4.880 -4.487 1.00 0.00 H new ATOM 1808 N LEU A 124 -5.641 6.102 -5.441 1.00 0.00 N ATOM 1809 CA LEU A 124 -4.203 6.187 -5.166 1.00 0.00 C ATOM 1810 C LEU A 124 -3.388 6.282 -6.456 1.00 0.00 C ATOM 1811 O LEU A 124 -3.513 5.429 -7.338 1.00 0.00 O ATOM 1812 CB LEU A 124 -3.722 4.981 -4.323 1.00 0.00 C ATOM 1813 CG LEU A 124 -3.454 5.334 -2.849 1.00 0.00 C ATOM 1814 CD1 LEU A 124 -3.177 4.081 -2.016 1.00 0.00 C ATOM 1815 CD2 LEU A 124 -2.231 6.241 -2.691 1.00 0.00 C ATOM 0 H LEU A 124 -5.909 5.235 -5.906 1.00 0.00 H new ATOM 0 HA LEU A 124 -4.042 7.100 -4.593 1.00 0.00 H new ATOM 0 HB2 LEU A 124 -4.473 4.192 -4.369 1.00 0.00 H new ATOM 0 HB3 LEU A 124 -2.810 4.579 -4.764 1.00 0.00 H new ATOM 0 HG LEU A 124 -4.354 5.843 -2.503 1.00 0.00 H new ATOM 0 HD11 LEU A 124 -2.992 4.366 -0.980 1.00 0.00 H new ATOM 0 HD12 LEU A 124 -4.040 3.416 -2.061 1.00 0.00 H new ATOM 0 HD13 LEU A 124 -2.302 3.567 -2.413 1.00 0.00 H new ATOM 0 HD21 LEU A 124 -2.078 6.465 -1.635 1.00 0.00 H new ATOM 0 HD22 LEU A 124 -1.350 5.735 -3.086 1.00 0.00 H new ATOM 0 HD23 LEU A 124 -2.393 7.169 -3.239 1.00 0.00 H new ATOM 1827 N ASN A 125 -2.517 7.292 -6.514 1.00 0.00 N ATOM 1828 CA ASN A 125 -1.534 7.584 -7.551 1.00 0.00 C ATOM 1829 C ASN A 125 -0.263 8.050 -6.831 1.00 0.00 C ATOM 1830 O ASN A 125 -0.054 9.250 -6.644 1.00 0.00 O ATOM 1831 CB ASN A 125 -2.102 8.646 -8.522 1.00 0.00 C ATOM 1832 CG ASN A 125 -1.063 9.410 -9.346 1.00 0.00 C ATOM 1833 OD1 ASN A 125 -1.007 10.638 -9.289 1.00 0.00 O ATOM 1834 ND2 ASN A 125 -0.264 8.746 -10.159 1.00 0.00 N ATOM 0 H ASN A 125 -2.482 7.986 -5.768 1.00 0.00 H new ATOM 0 HA ASN A 125 -1.300 6.712 -8.161 1.00 0.00 H new ATOM 0 HB2 ASN A 125 -2.793 8.154 -9.207 1.00 0.00 H new ATOM 0 HB3 ASN A 125 -2.683 9.366 -7.946 1.00 0.00 H new ATOM 0 HD21 ASN A 125 0.403 9.250 -10.743 1.00 0.00 H new ATOM 0 HD22 ASN A 125 -0.313 7.728 -10.204 1.00 0.00 H new ATOM 1841 N LEU A 126 0.562 7.106 -6.363 1.00 0.00 N ATOM 1842 CA LEU A 126 1.838 7.367 -5.691 1.00 0.00 C ATOM 1843 C LEU A 126 2.938 6.705 -6.505 1.00 0.00 C ATOM 1844 O LEU A 126 2.847 5.521 -6.840 1.00 0.00 O ATOM 1845 CB LEU A 126 1.835 6.842 -4.242 1.00 0.00 C ATOM 1846 CG LEU A 126 1.797 7.939 -3.165 1.00 0.00 C ATOM 1847 CD1 LEU A 126 0.606 8.893 -3.297 1.00 0.00 C ATOM 1848 CD2 LEU A 126 1.729 7.265 -1.790 1.00 0.00 C ATOM 0 H LEU A 126 0.353 6.111 -6.444 1.00 0.00 H new ATOM 0 HA LEU A 126 2.006 8.442 -5.630 1.00 0.00 H new ATOM 0 HB2 LEU A 126 0.973 6.189 -4.108 1.00 0.00 H new ATOM 0 HB3 LEU A 126 2.725 6.231 -4.089 1.00 0.00 H new ATOM 0 HG LEU A 126 2.699 8.539 -3.290 1.00 0.00 H new ATOM 0 HD11 LEU A 126 0.647 9.639 -2.503 1.00 0.00 H new ATOM 0 HD12 LEU A 126 0.645 9.392 -4.265 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -0.323 8.329 -3.217 1.00 0.00 H new ATOM 0 HD21 LEU A 126 1.701 8.028 -1.012 1.00 0.00 H new ATOM 0 HD22 LEU A 126 0.830 6.652 -1.729 1.00 0.00 H new ATOM 0 HD23 LEU A 126 2.608 6.635 -1.650 1.00 0.00 H new ATOM 1860 N TYR A 127 3.981 7.451 -6.843 1.00 0.00 N ATOM 1861 CA TYR A 127 5.082 7.002 -7.678 1.00 0.00 C ATOM 1862 C TYR A 127 6.373 7.597 -7.107 1.00 0.00 C ATOM 1863 O TYR A 127 6.946 8.548 -7.646 1.00 0.00 O ATOM 1864 CB TYR A 127 4.786 7.347 -9.154 1.00 0.00 C ATOM 1865 CG TYR A 127 5.090 6.234 -10.132 1.00 0.00 C ATOM 1866 CD1 TYR A 127 6.327 5.575 -10.065 1.00 0.00 C ATOM 1867 CD2 TYR A 127 4.136 5.832 -11.089 1.00 0.00 C ATOM 1868 CE1 TYR A 127 6.584 4.489 -10.909 1.00 0.00 C ATOM 1869 CE2 TYR A 127 4.387 4.733 -11.933 1.00 0.00 C ATOM 1870 CZ TYR A 127 5.610 4.038 -11.826 1.00 0.00 C ATOM 1871 OH TYR A 127 5.850 2.928 -12.573 1.00 0.00 O ATOM 0 H TYR A 127 4.085 8.417 -6.532 1.00 0.00 H new ATOM 0 HA TYR A 127 5.207 5.919 -7.668 1.00 0.00 H new ATOM 0 HB2 TYR A 127 3.734 7.618 -9.247 1.00 0.00 H new ATOM 0 HB3 TYR A 127 5.367 8.226 -9.432 1.00 0.00 H new ATOM 0 HD1 TYR A 127 7.079 5.905 -9.364 1.00 0.00 H new ATOM 0 HD2 TYR A 127 3.204 6.372 -11.176 1.00 0.00 H new ATOM 0 HE1 TYR A 127 7.540 3.989 -10.858 1.00 0.00 H new ATOM 0 HE2 TYR A 127 3.648 4.424 -12.658 1.00 0.00 H new ATOM 0 HH TYR A 127 5.080 2.751 -13.153 1.00 0.00 H new ATOM 1881 N TYR A 128 6.798 7.063 -5.961 1.00 0.00 N ATOM 1882 CA TYR A 128 8.060 7.453 -5.355 1.00 0.00 C ATOM 1883 C TYR A 128 9.232 6.839 -6.127 1.00 0.00 C ATOM 1884 O TYR A 128 9.096 5.766 -6.731 1.00 0.00 O ATOM 1885 CB TYR A 128 8.106 7.043 -3.885 1.00 0.00 C ATOM 1886 CG TYR A 128 7.382 7.960 -2.929 1.00 0.00 C ATOM 1887 CD1 TYR A 128 7.862 9.273 -2.776 1.00 0.00 C ATOM 1888 CD2 TYR A 128 6.317 7.495 -2.130 1.00 0.00 C ATOM 1889 CE1 TYR A 128 7.252 10.143 -1.866 1.00 0.00 C ATOM 1890 CE2 TYR A 128 5.668 8.380 -1.245 1.00 0.00 C ATOM 1891 CZ TYR A 128 6.129 9.719 -1.129 1.00 0.00 C ATOM 1892 OH TYR A 128 5.530 10.646 -0.334 1.00 0.00 O ATOM 0 H TYR A 128 6.281 6.357 -5.437 1.00 0.00 H new ATOM 0 HA TYR A 128 8.145 8.539 -5.403 1.00 0.00 H new ATOM 0 HB2 TYR A 128 7.683 6.043 -3.792 1.00 0.00 H new ATOM 0 HB3 TYR A 128 9.150 6.977 -3.577 1.00 0.00 H new ATOM 0 HD1 TYR A 128 8.704 9.611 -3.363 1.00 0.00 H new ATOM 0 HD2 TYR A 128 6.000 6.465 -2.196 1.00 0.00 H new ATOM 0 HE1 TYR A 128 7.642 11.141 -1.728 1.00 0.00 H new ATOM 0 HE2 TYR A 128 4.826 8.042 -0.659 1.00 0.00 H new ATOM 0 HH TYR A 128 4.571 10.676 -0.532 1.00 0.00 H new ATOM 1902 N ASN A 129 10.366 7.547 -6.113 1.00 0.00 N ATOM 1903 CA ASN A 129 11.622 7.194 -6.762 1.00 0.00 C ATOM 1904 C ASN A 129 12.794 7.842 -6.021 1.00 0.00 C ATOM 1905 O ASN A 129 12.750 7.856 -4.765 1.00 0.00 O ATOM 1906 CB ASN A 129 11.579 7.514 -8.268 1.00 0.00 C ATOM 1907 CG ASN A 129 11.612 8.994 -8.608 1.00 0.00 C ATOM 1908 OD1 ASN A 129 11.210 9.858 -7.835 1.00 0.00 O ATOM 1909 ND2 ASN A 129 12.043 9.319 -9.810 1.00 0.00 N ATOM 0 H ASN A 129 10.430 8.436 -5.616 1.00 0.00 H new ATOM 0 HA ASN A 129 11.775 6.116 -6.702 1.00 0.00 H new ATOM 0 HB2 ASN A 129 12.424 7.026 -8.753 1.00 0.00 H new ATOM 0 HB3 ASN A 129 10.674 7.079 -8.691 1.00 0.00 H new ATOM 0 HD21 ASN A 129 12.044 10.296 -10.105 1.00 0.00 H new ATOM 0 HD22 ASN A 129 12.375 8.594 -10.446 1.00 0.00 H new