USER MOD reduce.3.24.130724 H: found=0, std=0, add=928, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 928 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 109 SER OG : rot -95:sc= -0.315 USER MOD Set 1.2: A 114 GLN : amide:sc= -3.79! C(o=-4.1!,f=-10!) USER MOD Set 2.1: A 68 MET CE :methyl -139:sc= -6.74! (180deg=-8.16!) USER MOD Set 2.2: A 144 MET CE :methyl 160:sc= -0.19 (180deg=-0.706) USER MOD Single : A 12 HIS : no HD1:sc= -11.3! C(o=-11!,f=-11!) USER MOD Single : A 13 GLN : amide:sc= -6.76! C(o=-6.8!,f=-8.1!) USER MOD Single : A 16 SER OG : rot 180:sc= -0.83 USER MOD Single : A 19 THR OG1 : rot 180:sc= 0 USER MOD Single : A 21 ASN : amide:sc= 0 X(o=0,f=-0.44) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 SER OG : rot 180:sc= 0.89 USER MOD Single : A 39 MET CE :methyl -153:sc= -3.89 (180deg=-4.72!) USER MOD Single : A 41 SER OG : rot -34:sc= 0.417 USER MOD Single : A 44 SER OG : rot -170:sc= 0.918 USER MOD Single : A 48 THR OG1 : rot 180:sc= -0.334 USER MOD Single : A 50 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 53 ASN : amide:sc= 0 X(o=0,f=-0.4) USER MOD Single : A 54 THR OG1 : rot 91:sc= 0.00461 USER MOD Single : A 55 MET CE :methyl 140:sc= -13.4! (180deg=-15.1!) USER MOD Single : A 57 ASN : amide:sc= -0.0193 K(o=-0.019,f=-1.3!) USER MOD Single : A 58 THR OG1 : rot -120:sc= -0.886 USER MOD Single : A 62 HIS : no HE2:sc= -14.8! C(o=-15!,f=-14!) USER MOD Single : A 63 GLN : amide:sc= -0.3 K(o=-0.3,f=-2.4!) USER MOD Single : A 66 MET CE :methyl -123:sc= -1.7 (180deg=-4.92!) USER MOD Single : A 67 GLN : amide:sc= -0.748 K(o=-0.75,f=-1.9!) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 THR OG1 : rot -160:sc= 0 USER MOD Single : A 74 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD Single : A 107 THR OG1 : rot 180:sc= 0 USER MOD Single : A 108 THR OG1 : rot 180:sc= 0 USER MOD Single : A 110 THR OG1 : rot 180:sc= 0 USER MOD Single : A 112 GLN : amide:sc=-0.00264 X(o=-0.0026,f=-0.048) USER MOD Single : A 118 MET CE :methyl 164:sc= 0 (180deg=-0.469) USER MOD Single : A 119 THR OG1 : rot 180:sc= 0 USER MOD Single : A 120 HIS : no HD1:sc= -0.714 K(o=-0.71,f=-1.3) USER MOD Single : A 121 ASN : amide:sc= -0.026 X(o=-0.026,f=-0.2) USER MOD Single : A 130 TYR OH : rot 180:sc= 0 USER MOD Single : A 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 139 ASN : amide:sc= -0.0178 X(o=-0.018,f=-0.098) USER MOD Single : A 140 LYS NZ :NH3+ -149:sc= -0.0172 (180deg=-0.541) USER MOD Single : A 145 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N PRO A 1 1.882 0.037 0.048 1.00 0.00 N ATOM 2 CA PRO A 1 1.317 0.381 -1.245 1.00 0.00 C ATOM 3 C PRO A 1 1.305 -0.832 -2.178 1.00 0.00 C ATOM 4 O PRO A 1 1.864 -1.877 -1.850 1.00 0.00 O ATOM 5 CB PRO A 1 2.180 1.520 -1.762 1.00 0.00 C ATOM 6 CG PRO A 1 3.470 1.462 -0.960 1.00 0.00 C ATOM 7 CD PRO A 1 3.236 0.550 0.233 1.00 0.00 C ATOM 0 H2 PRO A 1 1.891 -0.978 0.150 1.00 0.00 H new ATOM 0 H3 PRO A 1 1.281 0.405 0.785 1.00 0.00 H new ATOM 0 HA PRO A 1 0.273 0.689 -1.179 1.00 0.00 H new ATOM 0 HB2 PRO A 1 2.377 1.408 -2.828 1.00 0.00 H new ATOM 0 HB3 PRO A 1 1.681 2.480 -1.630 1.00 0.00 H new ATOM 0 HG2 PRO A 1 4.286 1.083 -1.576 1.00 0.00 H new ATOM 0 HG3 PRO A 1 3.758 2.459 -0.628 1.00 0.00 H new ATOM 0 HD2 PRO A 1 3.966 -0.259 0.262 1.00 0.00 H new ATOM 0 HD3 PRO A 1 3.328 1.095 1.172 1.00 0.00 H new ATOM 15 N ILE A 2 0.662 -0.652 -3.322 1.00 0.00 N ATOM 16 CA ILE A 2 0.570 -1.719 -4.305 1.00 0.00 C ATOM 17 C ILE A 2 1.599 -1.477 -5.411 1.00 0.00 C ATOM 18 O ILE A 2 1.946 -0.334 -5.703 1.00 0.00 O ATOM 19 CB ILE A 2 -0.864 -1.851 -4.819 1.00 0.00 C ATOM 20 CG1 ILE A 2 -1.844 -2.064 -3.664 1.00 0.00 C ATOM 21 CG2 ILE A 2 -0.970 -2.956 -5.871 1.00 0.00 C ATOM 22 CD1 ILE A 2 -2.136 -3.552 -3.459 1.00 0.00 C ATOM 0 H ILE A 2 0.200 0.217 -3.591 1.00 0.00 H new ATOM 0 HA ILE A 2 0.811 -2.679 -3.849 1.00 0.00 H new ATOM 0 HB ILE A 2 -1.139 -0.915 -5.306 1.00 0.00 H new ATOM 0 HG12 ILE A 2 -1.430 -1.642 -2.748 1.00 0.00 H new ATOM 0 HG13 ILE A 2 -2.773 -1.532 -3.868 1.00 0.00 H new ATOM 0 HG21 ILE A 2 -2.000 -3.029 -6.220 1.00 0.00 H new ATOM 0 HG22 ILE A 2 -0.318 -2.721 -6.712 1.00 0.00 H new ATOM 0 HG23 ILE A 2 -0.668 -3.907 -5.432 1.00 0.00 H new ATOM 0 HD11 ILE A 2 -2.835 -3.675 -2.632 1.00 0.00 H new ATOM 0 HD12 ILE A 2 -2.573 -3.966 -4.368 1.00 0.00 H new ATOM 0 HD13 ILE A 2 -1.208 -4.077 -3.231 1.00 0.00 H new ATOM 158 N VAL A 11 0.710 -7.020 -6.919 1.00 0.00 N ATOM 159 CA VAL A 11 1.037 -7.472 -5.578 1.00 0.00 C ATOM 160 C VAL A 11 1.254 -6.257 -4.673 1.00 0.00 C ATOM 161 O VAL A 11 1.612 -5.180 -5.150 1.00 0.00 O ATOM 162 CB VAL A 11 2.246 -8.408 -5.621 1.00 0.00 C ATOM 163 CG1 VAL A 11 1.899 -9.718 -6.331 1.00 0.00 C ATOM 164 CG2 VAL A 11 3.444 -7.727 -6.283 1.00 0.00 C ATOM 0 HA VAL A 11 0.212 -8.047 -5.158 1.00 0.00 H new ATOM 0 HB VAL A 11 2.522 -8.646 -4.594 1.00 0.00 H new ATOM 0 HG11 VAL A 11 2.775 -10.366 -6.348 1.00 0.00 H new ATOM 0 HG12 VAL A 11 1.089 -10.217 -5.799 1.00 0.00 H new ATOM 0 HG13 VAL A 11 1.585 -9.506 -7.353 1.00 0.00 H new ATOM 0 HG21 VAL A 11 4.290 -8.415 -6.300 1.00 0.00 H new ATOM 0 HG22 VAL A 11 3.184 -7.445 -7.303 1.00 0.00 H new ATOM 0 HG23 VAL A 11 3.713 -6.835 -5.718 1.00 0.00 H new ATOM 174 N HIS A 12 1.028 -6.469 -3.385 1.00 0.00 N ATOM 175 CA HIS A 12 1.195 -5.405 -2.411 1.00 0.00 C ATOM 176 C HIS A 12 2.491 -5.624 -1.628 1.00 0.00 C ATOM 177 O HIS A 12 2.983 -6.747 -1.537 1.00 0.00 O ATOM 178 CB HIS A 12 -0.034 -5.299 -1.505 1.00 0.00 C ATOM 179 CG HIS A 12 -0.253 -6.507 -0.625 1.00 0.00 C ATOM 180 ND1 HIS A 12 0.622 -6.868 0.384 1.00 0.00 N ATOM 181 CD2 HIS A 12 -1.257 -7.431 -0.614 1.00 0.00 C ATOM 182 CE1 HIS A 12 0.156 -7.962 0.970 1.00 0.00 C ATOM 183 NE2 HIS A 12 -1.007 -8.309 0.350 1.00 0.00 N ATOM 0 H HIS A 12 0.730 -7.363 -2.993 1.00 0.00 H new ATOM 0 HA HIS A 12 1.279 -4.447 -2.925 1.00 0.00 H new ATOM 0 HB2 HIS A 12 0.067 -4.416 -0.874 1.00 0.00 H new ATOM 0 HB3 HIS A 12 -0.918 -5.148 -2.125 1.00 0.00 H new ATOM 0 HD2 HIS A 12 -2.110 -7.446 -1.277 1.00 0.00 H new ATOM 0 HE1 HIS A 12 0.617 -8.486 1.794 1.00 0.00 H new ATOM 0 HE2 HIS A 12 -1.590 -9.112 0.588 1.00 0.00 H new ATOM 192 N GLN A 13 3.007 -4.532 -1.083 1.00 0.00 N ATOM 193 CA GLN A 13 4.237 -4.591 -0.310 1.00 0.00 C ATOM 194 C GLN A 13 4.043 -3.915 1.049 1.00 0.00 C ATOM 195 O GLN A 13 4.921 -3.194 1.518 1.00 0.00 O ATOM 196 CB GLN A 13 5.397 -3.955 -1.078 1.00 0.00 C ATOM 197 CG GLN A 13 5.955 -4.919 -2.128 1.00 0.00 C ATOM 198 CD GLN A 13 4.858 -5.372 -3.093 1.00 0.00 C ATOM 199 OE1 GLN A 13 4.694 -6.546 -3.381 1.00 0.00 O ATOM 200 NE2 GLN A 13 4.117 -4.379 -3.576 1.00 0.00 N ATOM 0 H GLN A 13 2.596 -3.602 -1.161 1.00 0.00 H new ATOM 0 HA GLN A 13 4.487 -5.638 -0.140 1.00 0.00 H new ATOM 0 HB2 GLN A 13 5.058 -3.040 -1.563 1.00 0.00 H new ATOM 0 HB3 GLN A 13 6.187 -3.673 -0.382 1.00 0.00 H new ATOM 0 HG2 GLN A 13 6.756 -4.432 -2.685 1.00 0.00 H new ATOM 0 HG3 GLN A 13 6.392 -5.787 -1.634 1.00 0.00 H new ATOM 0 HE21 GLN A 13 4.307 -3.417 -3.294 1.00 0.00 H new ATOM 0 HE22 GLN A 13 3.359 -4.579 -4.228 1.00 0.00 H new ATOM 209 N ALA A 14 2.887 -4.173 1.642 1.00 0.00 N ATOM 210 CA ALA A 14 2.566 -3.599 2.937 1.00 0.00 C ATOM 211 C ALA A 14 2.884 -2.103 2.921 1.00 0.00 C ATOM 212 O ALA A 14 3.234 -1.551 1.879 1.00 0.00 O ATOM 213 CB ALA A 14 3.333 -4.346 4.031 1.00 0.00 C ATOM 0 H ALA A 14 2.161 -4.772 1.249 1.00 0.00 H new ATOM 0 HA ALA A 14 1.503 -3.707 3.151 1.00 0.00 H new ATOM 0 HB1 ALA A 14 3.092 -3.915 5.003 1.00 0.00 H new ATOM 0 HB2 ALA A 14 3.050 -5.398 4.020 1.00 0.00 H new ATOM 0 HB3 ALA A 14 4.404 -4.257 3.850 1.00 0.00 H new ATOM 219 N ILE A 15 2.753 -1.489 4.088 1.00 0.00 N ATOM 220 CA ILE A 15 3.022 -0.067 4.220 1.00 0.00 C ATOM 221 C ILE A 15 4.518 0.144 4.462 1.00 0.00 C ATOM 222 O ILE A 15 5.299 -0.805 4.405 1.00 0.00 O ATOM 223 CB ILE A 15 2.131 0.549 5.301 1.00 0.00 C ATOM 224 CG1 ILE A 15 1.858 2.026 5.011 1.00 0.00 C ATOM 225 CG2 ILE A 15 2.734 0.339 6.692 1.00 0.00 C ATOM 226 CD1 ILE A 15 0.385 2.366 5.238 1.00 0.00 C ATOM 0 H ILE A 15 2.464 -1.950 4.951 1.00 0.00 H new ATOM 0 HA ILE A 15 2.771 0.456 3.297 1.00 0.00 H new ATOM 0 HB ILE A 15 1.169 0.036 5.285 1.00 0.00 H new ATOM 0 HG12 ILE A 15 2.482 2.648 5.654 1.00 0.00 H new ATOM 0 HG13 ILE A 15 2.133 2.255 3.981 1.00 0.00 H new ATOM 0 HG21 ILE A 15 2.082 0.786 7.442 1.00 0.00 H new ATOM 0 HG22 ILE A 15 2.834 -0.729 6.888 1.00 0.00 H new ATOM 0 HG23 ILE A 15 3.716 0.810 6.738 1.00 0.00 H new ATOM 0 HD11 ILE A 15 0.218 3.422 5.025 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -0.234 1.760 4.577 1.00 0.00 H new ATOM 0 HD13 ILE A 15 0.119 2.159 6.275 1.00 0.00 H new ATOM 238 N SER A 16 4.872 1.393 4.725 1.00 0.00 N ATOM 239 CA SER A 16 6.260 1.741 4.975 1.00 0.00 C ATOM 240 C SER A 16 6.386 2.453 6.323 1.00 0.00 C ATOM 241 O SER A 16 5.474 3.164 6.742 1.00 0.00 O ATOM 242 CB SER A 16 6.818 2.621 3.855 1.00 0.00 C ATOM 243 OG SER A 16 8.063 3.216 4.213 1.00 0.00 O ATOM 0 H SER A 16 4.221 2.177 4.770 1.00 0.00 H new ATOM 0 HA SER A 16 6.844 0.821 5.001 1.00 0.00 H new ATOM 0 HB2 SER A 16 6.948 2.022 2.954 1.00 0.00 H new ATOM 0 HB3 SER A 16 6.098 3.403 3.616 1.00 0.00 H new ATOM 0 HG SER A 16 8.387 3.768 3.471 1.00 0.00 H new ATOM 249 N PRO A 17 7.555 2.234 6.983 1.00 0.00 N ATOM 250 CA PRO A 17 7.813 2.847 8.275 1.00 0.00 C ATOM 251 C PRO A 17 8.139 4.333 8.120 1.00 0.00 C ATOM 252 O PRO A 17 7.686 5.157 8.914 1.00 0.00 O ATOM 253 CB PRO A 17 8.960 2.045 8.868 1.00 0.00 C ATOM 254 CG PRO A 17 9.607 1.316 7.702 1.00 0.00 C ATOM 255 CD PRO A 17 8.659 1.399 6.517 1.00 0.00 C ATOM 0 HA PRO A 17 6.945 2.823 8.934 1.00 0.00 H new ATOM 0 HB2 PRO A 17 9.677 2.698 9.366 1.00 0.00 H new ATOM 0 HB3 PRO A 17 8.598 1.340 9.616 1.00 0.00 H new ATOM 0 HG2 PRO A 17 10.568 1.768 7.455 1.00 0.00 H new ATOM 0 HG3 PRO A 17 9.802 0.276 7.963 1.00 0.00 H new ATOM 0 HD2 PRO A 17 9.149 1.839 5.648 1.00 0.00 H new ATOM 0 HD3 PRO A 17 8.310 0.410 6.219 1.00 0.00 H new ATOM 263 N ARG A 18 8.923 4.632 7.094 1.00 0.00 N ATOM 264 CA ARG A 18 9.316 6.005 6.827 1.00 0.00 C ATOM 265 C ARG A 18 8.082 6.862 6.534 1.00 0.00 C ATOM 266 O ARG A 18 8.051 8.045 6.867 1.00 0.00 O ATOM 267 CB ARG A 18 10.274 6.082 5.637 1.00 0.00 C ATOM 268 CG ARG A 18 11.714 5.803 6.076 1.00 0.00 C ATOM 269 CD ARG A 18 12.360 4.735 5.190 1.00 0.00 C ATOM 270 NE ARG A 18 13.802 4.624 5.502 1.00 0.00 N ATOM 271 CZ ARG A 18 14.678 3.926 4.766 1.00 0.00 C ATOM 272 NH1 ARG A 18 14.264 3.272 3.672 1.00 0.00 N ATOM 273 NH2 ARG A 18 15.969 3.881 5.125 1.00 0.00 N ATOM 0 H ARG A 18 9.297 3.946 6.438 1.00 0.00 H new ATOM 0 HA ARG A 18 9.824 6.383 7.714 1.00 0.00 H new ATOM 0 HB2 ARG A 18 9.975 5.360 4.877 1.00 0.00 H new ATOM 0 HB3 ARG A 18 10.214 7.070 5.180 1.00 0.00 H new ATOM 0 HG2 ARG A 18 12.297 6.722 6.028 1.00 0.00 H new ATOM 0 HG3 ARG A 18 11.724 5.474 7.115 1.00 0.00 H new ATOM 0 HD2 ARG A 18 11.870 3.774 5.348 1.00 0.00 H new ATOM 0 HD3 ARG A 18 12.225 4.992 4.139 1.00 0.00 H new ATOM 0 HE ARG A 18 14.151 5.109 6.329 1.00 0.00 H new ATOM 0 HH11 ARG A 18 13.282 3.305 3.399 1.00 0.00 H new ATOM 0 HH12 ARG A 18 14.931 2.741 3.112 1.00 0.00 H new ATOM 0 HH21 ARG A 18 16.284 4.378 5.958 1.00 0.00 H new ATOM 0 HH22 ARG A 18 16.636 3.350 4.565 1.00 0.00 H new ATOM 287 N THR A 19 7.096 6.230 5.914 1.00 0.00 N ATOM 288 CA THR A 19 5.863 6.920 5.573 1.00 0.00 C ATOM 289 C THR A 19 5.014 7.146 6.825 1.00 0.00 C ATOM 290 O THR A 19 4.622 8.274 7.118 1.00 0.00 O ATOM 291 CB THR A 19 5.148 6.104 4.493 1.00 0.00 C ATOM 292 OG1 THR A 19 5.165 6.953 3.349 1.00 0.00 O ATOM 293 CG2 THR A 19 3.660 5.914 4.793 1.00 0.00 C ATOM 0 H THR A 19 7.126 5.248 5.639 1.00 0.00 H new ATOM 0 HA THR A 19 6.064 7.913 5.171 1.00 0.00 H new ATOM 0 HB THR A 19 5.627 5.129 4.397 1.00 0.00 H new ATOM 0 HG1 THR A 19 4.723 6.502 2.600 1.00 0.00 H new ATOM 0 HG21 THR A 19 3.200 5.329 3.997 1.00 0.00 H new ATOM 0 HG22 THR A 19 3.544 5.390 5.742 1.00 0.00 H new ATOM 0 HG23 THR A 19 3.174 6.888 4.855 1.00 0.00 H new ATOM 301 N LEU A 20 4.755 6.055 7.530 1.00 0.00 N ATOM 302 CA LEU A 20 3.960 6.120 8.745 1.00 0.00 C ATOM 303 C LEU A 20 4.639 7.058 9.745 1.00 0.00 C ATOM 304 O LEU A 20 3.970 7.822 10.440 1.00 0.00 O ATOM 305 CB LEU A 20 3.706 4.715 9.295 1.00 0.00 C ATOM 306 CG LEU A 20 2.549 3.944 8.657 1.00 0.00 C ATOM 307 CD1 LEU A 20 2.599 2.464 9.040 1.00 0.00 C ATOM 308 CD2 LEU A 20 1.204 4.582 9.010 1.00 0.00 C ATOM 0 H LEU A 20 5.081 5.121 7.283 1.00 0.00 H new ATOM 0 HA LEU A 20 2.976 6.538 8.534 1.00 0.00 H new ATOM 0 HB2 LEU A 20 4.617 4.129 9.174 1.00 0.00 H new ATOM 0 HB3 LEU A 20 3.517 4.794 10.366 1.00 0.00 H new ATOM 0 HG LEU A 20 2.658 4.000 7.574 1.00 0.00 H new ATOM 0 HD11 LEU A 20 1.766 1.939 8.573 1.00 0.00 H new ATOM 0 HD12 LEU A 20 3.539 2.031 8.697 1.00 0.00 H new ATOM 0 HD13 LEU A 20 2.529 2.366 10.123 1.00 0.00 H new ATOM 0 HD21 LEU A 20 0.399 4.014 8.544 1.00 0.00 H new ATOM 0 HD22 LEU A 20 1.072 4.578 10.092 1.00 0.00 H new ATOM 0 HD23 LEU A 20 1.182 5.609 8.646 1.00 0.00 H new ATOM 320 N ASN A 21 5.961 6.971 9.786 1.00 0.00 N ATOM 321 CA ASN A 21 6.737 7.803 10.689 1.00 0.00 C ATOM 322 C ASN A 21 6.495 9.277 10.354 1.00 0.00 C ATOM 323 O ASN A 21 5.986 10.029 11.184 1.00 0.00 O ATOM 324 CB ASN A 21 8.235 7.526 10.542 1.00 0.00 C ATOM 325 CG ASN A 21 9.038 8.271 11.610 1.00 0.00 C ATOM 326 OD1 ASN A 21 8.654 8.356 12.765 1.00 0.00 O ATOM 327 ND2 ASN A 21 10.171 8.804 11.162 1.00 0.00 N ATOM 0 H ASN A 21 6.514 6.337 9.209 1.00 0.00 H new ATOM 0 HA ASN A 21 6.425 7.575 11.708 1.00 0.00 H new ATOM 0 HB2 ASN A 21 8.420 6.455 10.624 1.00 0.00 H new ATOM 0 HB3 ASN A 21 8.570 7.832 9.551 1.00 0.00 H new ATOM 0 HD21 ASN A 21 10.778 9.321 11.798 1.00 0.00 H new ATOM 0 HD22 ASN A 21 10.433 8.695 10.182 1.00 0.00 H new ATOM 334 N ALA A 22 6.871 9.644 9.138 1.00 0.00 N ATOM 335 CA ALA A 22 6.700 11.014 8.684 1.00 0.00 C ATOM 336 C ALA A 22 5.254 11.451 8.927 1.00 0.00 C ATOM 337 O ALA A 22 5.009 12.559 9.401 1.00 0.00 O ATOM 338 CB ALA A 22 7.100 11.117 7.210 1.00 0.00 C ATOM 0 H ALA A 22 7.293 9.017 8.453 1.00 0.00 H new ATOM 0 HA ALA A 22 7.347 11.688 9.246 1.00 0.00 H new ATOM 0 HB1 ALA A 22 6.972 12.144 6.869 1.00 0.00 H new ATOM 0 HB2 ALA A 22 8.144 10.824 7.095 1.00 0.00 H new ATOM 0 HB3 ALA A 22 6.470 10.456 6.615 1.00 0.00 H new ATOM 344 N TRP A 23 4.335 10.557 8.594 1.00 0.00 N ATOM 345 CA TRP A 23 2.920 10.837 8.770 1.00 0.00 C ATOM 346 C TRP A 23 2.703 11.279 10.219 1.00 0.00 C ATOM 347 O TRP A 23 2.248 12.393 10.470 1.00 0.00 O ATOM 348 CB TRP A 23 2.070 9.626 8.380 1.00 0.00 C ATOM 349 CG TRP A 23 0.617 9.708 8.853 1.00 0.00 C ATOM 350 CD1 TRP A 23 -0.006 8.925 9.745 1.00 0.00 C ATOM 351 CD2 TRP A 23 -0.376 10.662 8.420 1.00 0.00 C ATOM 352 NE1 TRP A 23 -1.323 9.304 9.918 1.00 0.00 N ATOM 353 CE2 TRP A 23 -1.554 10.393 9.087 1.00 0.00 C ATOM 354 CE3 TRP A 23 -0.282 11.718 7.496 1.00 0.00 C ATOM 355 CZ2 TRP A 23 -2.728 11.134 8.900 1.00 0.00 C ATOM 356 CZ3 TRP A 23 -1.462 12.448 7.320 1.00 0.00 C ATOM 357 CH2 TRP A 23 -2.657 12.190 7.983 1.00 0.00 C ATOM 0 H TRP A 23 4.543 9.638 8.203 1.00 0.00 H new ATOM 0 HA TRP A 23 2.600 11.642 8.109 1.00 0.00 H new ATOM 0 HB2 TRP A 23 2.083 9.520 7.295 1.00 0.00 H new ATOM 0 HB3 TRP A 23 2.526 8.726 8.794 1.00 0.00 H new ATOM 0 HD1 TRP A 23 0.463 8.101 10.263 1.00 0.00 H new ATOM 0 HE1 TRP A 23 -2.001 8.865 10.541 1.00 0.00 H new ATOM 0 HE3 TRP A 23 0.630 11.947 6.964 1.00 0.00 H new ATOM 0 HZ2 TRP A 23 -3.638 10.903 9.434 1.00 0.00 H new ATOM 0 HZ3 TRP A 23 -1.444 13.270 6.620 1.00 0.00 H new ATOM 0 HH2 TRP A 23 -3.526 12.801 7.791 1.00 0.00 H new ATOM 368 N VAL A 24 3.037 10.381 11.134 1.00 0.00 N ATOM 369 CA VAL A 24 2.884 10.663 12.551 1.00 0.00 C ATOM 370 C VAL A 24 3.416 12.067 12.846 1.00 0.00 C ATOM 371 O VAL A 24 2.775 12.842 13.554 1.00 0.00 O ATOM 372 CB VAL A 24 3.572 9.577 13.378 1.00 0.00 C ATOM 373 CG1 VAL A 24 3.571 9.937 14.866 1.00 0.00 C ATOM 374 CG2 VAL A 24 2.921 8.212 13.144 1.00 0.00 C ATOM 0 H VAL A 24 3.413 9.457 10.921 1.00 0.00 H new ATOM 0 HA VAL A 24 1.831 10.648 12.833 1.00 0.00 H new ATOM 0 HB VAL A 24 4.609 9.514 13.049 1.00 0.00 H new ATOM 0 HG11 VAL A 24 4.066 9.148 15.432 1.00 0.00 H new ATOM 0 HG12 VAL A 24 4.102 10.877 15.013 1.00 0.00 H new ATOM 0 HG13 VAL A 24 2.543 10.043 15.214 1.00 0.00 H new ATOM 0 HG21 VAL A 24 3.430 7.458 13.745 1.00 0.00 H new ATOM 0 HG22 VAL A 24 1.870 8.256 13.431 1.00 0.00 H new ATOM 0 HG23 VAL A 24 2.998 7.948 12.089 1.00 0.00 H new ATOM 384 N LYS A 25 4.585 12.353 12.290 1.00 0.00 N ATOM 385 CA LYS A 25 5.210 13.648 12.485 1.00 0.00 C ATOM 386 C LYS A 25 4.290 14.742 11.936 1.00 0.00 C ATOM 387 O LYS A 25 4.115 15.784 12.566 1.00 0.00 O ATOM 388 CB LYS A 25 6.614 13.664 11.875 1.00 0.00 C ATOM 389 CG LYS A 25 7.672 13.938 12.945 1.00 0.00 C ATOM 390 CD LYS A 25 9.057 13.488 12.474 1.00 0.00 C ATOM 391 CE LYS A 25 10.157 14.087 13.353 1.00 0.00 C ATOM 392 NZ LYS A 25 11.217 14.692 12.518 1.00 0.00 N ATOM 0 H LYS A 25 5.115 11.708 11.704 1.00 0.00 H new ATOM 0 HA LYS A 25 5.346 13.848 13.548 1.00 0.00 H new ATOM 0 HB2 LYS A 25 6.817 12.707 11.394 1.00 0.00 H new ATOM 0 HB3 LYS A 25 6.669 14.428 11.100 1.00 0.00 H new ATOM 0 HG2 LYS A 25 7.691 15.003 13.178 1.00 0.00 H new ATOM 0 HG3 LYS A 25 7.409 13.415 13.864 1.00 0.00 H new ATOM 0 HD2 LYS A 25 9.118 12.400 12.500 1.00 0.00 H new ATOM 0 HD3 LYS A 25 9.209 13.791 11.438 1.00 0.00 H new ATOM 0 HE2 LYS A 25 9.731 14.842 14.014 1.00 0.00 H new ATOM 0 HE3 LYS A 25 10.585 13.312 13.989 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 11.955 15.093 13.131 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 11.635 13.963 11.905 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 10.808 15.446 11.930 1.00 0.00 H new ATOM 406 N VAL A 26 3.728 14.466 10.769 1.00 0.00 N ATOM 407 CA VAL A 26 2.830 15.413 10.129 1.00 0.00 C ATOM 408 C VAL A 26 1.600 15.622 11.014 1.00 0.00 C ATOM 409 O VAL A 26 1.389 16.712 11.544 1.00 0.00 O ATOM 410 CB VAL A 26 2.478 14.931 8.720 1.00 0.00 C ATOM 411 CG1 VAL A 26 1.421 15.832 8.080 1.00 0.00 C ATOM 412 CG2 VAL A 26 3.729 14.843 7.843 1.00 0.00 C ATOM 0 H VAL A 26 3.877 13.601 10.250 1.00 0.00 H new ATOM 0 HA VAL A 26 3.316 16.382 10.015 1.00 0.00 H new ATOM 0 HB VAL A 26 2.056 13.929 8.804 1.00 0.00 H new ATOM 0 HG11 VAL A 26 1.189 15.467 7.079 1.00 0.00 H new ATOM 0 HG12 VAL A 26 0.517 15.821 8.689 1.00 0.00 H new ATOM 0 HG13 VAL A 26 1.802 16.851 8.015 1.00 0.00 H new ATOM 0 HG21 VAL A 26 3.452 14.498 6.847 1.00 0.00 H new ATOM 0 HG22 VAL A 26 4.192 15.827 7.770 1.00 0.00 H new ATOM 0 HG23 VAL A 26 4.435 14.141 8.286 1.00 0.00 H new ATOM 422 N VAL A 27 0.819 14.559 11.147 1.00 0.00 N ATOM 423 CA VAL A 27 -0.385 14.613 11.959 1.00 0.00 C ATOM 424 C VAL A 27 -0.103 15.415 13.231 1.00 0.00 C ATOM 425 O VAL A 27 -0.954 16.174 13.692 1.00 0.00 O ATOM 426 CB VAL A 27 -0.886 13.195 12.245 1.00 0.00 C ATOM 427 CG1 VAL A 27 -2.158 13.224 13.093 1.00 0.00 C ATOM 428 CG2 VAL A 27 -1.111 12.420 10.945 1.00 0.00 C ATOM 0 H VAL A 27 0.997 13.656 10.706 1.00 0.00 H new ATOM 0 HA VAL A 27 -1.184 15.125 11.423 1.00 0.00 H new ATOM 0 HB VAL A 27 -0.115 12.676 12.815 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -2.493 12.204 13.282 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -1.952 13.720 14.042 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -2.938 13.769 12.561 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -1.467 11.416 11.177 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -1.854 12.937 10.337 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -0.173 12.354 10.394 1.00 0.00 H new ATOM 438 N GLU A 28 1.096 15.221 13.760 1.00 0.00 N ATOM 439 CA GLU A 28 1.502 15.917 14.969 1.00 0.00 C ATOM 440 C GLU A 28 1.524 17.428 14.730 1.00 0.00 C ATOM 441 O GLU A 28 0.926 18.189 15.488 1.00 0.00 O ATOM 442 CB GLU A 28 2.863 15.419 15.459 1.00 0.00 C ATOM 443 CG GLU A 28 2.876 15.265 16.980 1.00 0.00 C ATOM 444 CD GLU A 28 2.841 13.789 17.383 1.00 0.00 C ATOM 445 OE1 GLU A 28 1.774 13.171 17.179 1.00 0.00 O ATOM 446 OE2 GLU A 28 3.882 13.312 17.885 1.00 0.00 O ATOM 0 H GLU A 28 1.800 14.592 13.373 1.00 0.00 H new ATOM 0 HA GLU A 28 0.772 15.703 15.750 1.00 0.00 H new ATOM 0 HB2 GLU A 28 3.094 14.462 14.991 1.00 0.00 H new ATOM 0 HB3 GLU A 28 3.641 16.119 15.154 1.00 0.00 H new ATOM 0 HG2 GLU A 28 3.770 15.736 17.389 1.00 0.00 H new ATOM 0 HG3 GLU A 28 2.018 15.783 17.409 1.00 0.00 H new ATOM 453 N GLU A 29 2.220 17.817 13.672 1.00 0.00 N ATOM 454 CA GLU A 29 2.328 19.223 13.322 1.00 0.00 C ATOM 455 C GLU A 29 1.134 19.650 12.466 1.00 0.00 C ATOM 456 O GLU A 29 1.064 20.795 12.020 1.00 0.00 O ATOM 457 CB GLU A 29 3.648 19.509 12.604 1.00 0.00 C ATOM 458 CG GLU A 29 4.484 20.531 13.378 1.00 0.00 C ATOM 459 CD GLU A 29 5.980 20.263 13.200 1.00 0.00 C ATOM 460 OE1 GLU A 29 6.515 20.703 12.160 1.00 0.00 O ATOM 461 OE2 GLU A 29 6.554 19.626 14.109 1.00 0.00 O ATOM 0 H GLU A 29 2.715 17.183 13.045 1.00 0.00 H new ATOM 0 HA GLU A 29 2.318 19.808 14.241 1.00 0.00 H new ATOM 0 HB2 GLU A 29 4.212 18.583 12.491 1.00 0.00 H new ATOM 0 HB3 GLU A 29 3.446 19.884 11.601 1.00 0.00 H new ATOM 0 HG2 GLU A 29 4.247 21.537 13.031 1.00 0.00 H new ATOM 0 HG3 GLU A 29 4.227 20.490 14.436 1.00 0.00 H new ATOM 468 N LYS A 30 0.224 18.709 12.264 1.00 0.00 N ATOM 469 CA LYS A 30 -0.963 18.975 11.470 1.00 0.00 C ATOM 470 C LYS A 30 -2.209 18.705 12.317 1.00 0.00 C ATOM 471 O LYS A 30 -2.774 19.626 12.906 1.00 0.00 O ATOM 472 CB LYS A 30 -0.924 18.177 10.165 1.00 0.00 C ATOM 473 CG LYS A 30 -0.340 19.016 9.027 1.00 0.00 C ATOM 474 CD LYS A 30 1.187 19.072 9.116 1.00 0.00 C ATOM 475 CE LYS A 30 1.757 20.082 8.118 1.00 0.00 C ATOM 476 NZ LYS A 30 3.040 19.595 7.562 1.00 0.00 N ATOM 0 H LYS A 30 0.285 17.761 12.636 1.00 0.00 H new ATOM 0 HA LYS A 30 -0.997 20.024 11.176 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -0.325 17.277 10.303 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -1.931 17.852 9.903 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -0.637 18.592 8.068 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -0.748 20.026 9.068 1.00 0.00 H new ATOM 0 HD2 LYS A 30 1.486 19.346 10.128 1.00 0.00 H new ATOM 0 HD3 LYS A 30 1.603 18.084 8.917 1.00 0.00 H new ATOM 0 HE2 LYS A 30 1.043 20.247 7.311 1.00 0.00 H new ATOM 0 HE3 LYS A 30 1.909 21.043 8.610 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 3.413 20.293 6.887 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 3.724 19.460 8.334 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 2.886 18.689 7.074 1.00 0.00 H new ATOM 490 N ALA A 31 -2.599 17.441 12.353 1.00 0.00 N ATOM 491 CA ALA A 31 -3.768 17.039 13.119 1.00 0.00 C ATOM 492 C ALA A 31 -5.014 17.164 12.241 1.00 0.00 C ATOM 493 O ALA A 31 -5.941 17.901 12.576 1.00 0.00 O ATOM 494 CB ALA A 31 -3.861 17.885 14.390 1.00 0.00 C ATOM 0 H ALA A 31 -2.127 16.680 11.864 1.00 0.00 H new ATOM 0 HA ALA A 31 -3.686 15.997 13.428 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -4.737 17.584 14.964 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -2.964 17.737 14.992 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -3.948 18.938 14.121 1.00 0.00 H new ATOM 500 N PHE A 32 -4.998 16.433 11.137 1.00 0.00 N ATOM 501 CA PHE A 32 -6.116 16.453 10.209 1.00 0.00 C ATOM 502 C PHE A 32 -6.399 17.876 9.723 1.00 0.00 C ATOM 503 O PHE A 32 -7.514 18.375 9.867 1.00 0.00 O ATOM 504 CB PHE A 32 -7.338 15.934 10.970 1.00 0.00 C ATOM 505 CG PHE A 32 -7.522 14.418 10.890 1.00 0.00 C ATOM 506 CD1 PHE A 32 -6.476 13.591 11.158 1.00 0.00 C ATOM 507 CD2 PHE A 32 -8.732 13.897 10.550 1.00 0.00 C ATOM 508 CE1 PHE A 32 -6.648 12.183 11.084 1.00 0.00 C ATOM 509 CE2 PHE A 32 -8.903 12.489 10.476 1.00 0.00 C ATOM 510 CZ PHE A 32 -7.857 11.662 10.745 1.00 0.00 C ATOM 0 H PHE A 32 -4.228 15.822 10.864 1.00 0.00 H new ATOM 0 HA PHE A 32 -5.888 15.839 9.338 1.00 0.00 H new ATOM 0 HB2 PHE A 32 -7.252 16.225 12.017 1.00 0.00 H new ATOM 0 HB3 PHE A 32 -8.231 16.419 10.577 1.00 0.00 H new ATOM 0 HD1 PHE A 32 -5.515 14.005 11.427 1.00 0.00 H new ATOM 0 HD2 PHE A 32 -9.562 14.554 10.336 1.00 0.00 H new ATOM 0 HE1 PHE A 32 -5.818 11.526 11.297 1.00 0.00 H new ATOM 0 HE2 PHE A 32 -9.863 12.075 10.206 1.00 0.00 H new ATOM 0 HZ PHE A 32 -7.987 10.591 10.689 1.00 0.00 H new ATOM 520 N SER A 33 -5.370 18.490 9.156 1.00 0.00 N ATOM 521 CA SER A 33 -5.495 19.845 8.647 1.00 0.00 C ATOM 522 C SER A 33 -6.019 19.819 7.210 1.00 0.00 C ATOM 523 O SER A 33 -6.168 18.751 6.619 1.00 0.00 O ATOM 524 CB SER A 33 -4.156 20.583 8.711 1.00 0.00 C ATOM 525 OG SER A 33 -3.524 20.653 7.436 1.00 0.00 O ATOM 0 H SER A 33 -4.446 18.074 9.038 1.00 0.00 H new ATOM 0 HA SER A 33 -6.205 20.382 9.276 1.00 0.00 H new ATOM 0 HB2 SER A 33 -4.316 21.592 9.092 1.00 0.00 H new ATOM 0 HB3 SER A 33 -3.496 20.077 9.415 1.00 0.00 H new ATOM 0 HG SER A 33 -2.673 21.133 7.518 1.00 0.00 H new ATOM 531 N PRO A 34 -6.290 21.039 6.675 1.00 0.00 N ATOM 532 CA PRO A 34 -6.794 21.167 5.317 1.00 0.00 C ATOM 533 C PRO A 34 -5.681 20.927 4.295 1.00 0.00 C ATOM 534 O PRO A 34 -5.921 20.972 3.090 1.00 0.00 O ATOM 535 CB PRO A 34 -7.377 22.569 5.243 1.00 0.00 C ATOM 536 CG PRO A 34 -6.766 23.335 6.405 1.00 0.00 C ATOM 537 CD PRO A 34 -6.125 22.326 7.344 1.00 0.00 C ATOM 0 HA PRO A 34 -7.553 20.422 5.078 1.00 0.00 H new ATOM 0 HB2 PRO A 34 -7.135 23.043 4.292 1.00 0.00 H new ATOM 0 HB3 PRO A 34 -8.464 22.545 5.319 1.00 0.00 H new ATOM 0 HG2 PRO A 34 -6.023 24.046 6.044 1.00 0.00 H new ATOM 0 HG3 PRO A 34 -7.531 23.910 6.927 1.00 0.00 H new ATOM 0 HD2 PRO A 34 -5.072 22.553 7.510 1.00 0.00 H new ATOM 0 HD3 PRO A 34 -6.610 22.330 8.320 1.00 0.00 H new ATOM 545 N GLU A 35 -4.488 20.678 4.814 1.00 0.00 N ATOM 546 CA GLU A 35 -3.337 20.431 3.962 1.00 0.00 C ATOM 547 C GLU A 35 -2.810 19.011 4.178 1.00 0.00 C ATOM 548 O GLU A 35 -1.673 18.706 3.824 1.00 0.00 O ATOM 549 CB GLU A 35 -2.239 21.467 4.210 1.00 0.00 C ATOM 550 CG GLU A 35 -1.343 21.621 2.979 1.00 0.00 C ATOM 551 CD GLU A 35 0.134 21.662 3.377 1.00 0.00 C ATOM 552 OE1 GLU A 35 0.416 22.228 4.456 1.00 0.00 O ATOM 553 OE2 GLU A 35 0.948 21.126 2.595 1.00 0.00 O ATOM 0 H GLU A 35 -4.293 20.642 5.815 1.00 0.00 H new ATOM 0 HA GLU A 35 -3.652 20.526 2.923 1.00 0.00 H new ATOM 0 HB2 GLU A 35 -2.690 22.428 4.459 1.00 0.00 H new ATOM 0 HB3 GLU A 35 -1.637 21.166 5.067 1.00 0.00 H new ATOM 0 HG2 GLU A 35 -1.516 20.792 2.293 1.00 0.00 H new ATOM 0 HG3 GLU A 35 -1.605 22.535 2.446 1.00 0.00 H new ATOM 560 N VAL A 36 -3.664 18.180 4.759 1.00 0.00 N ATOM 561 CA VAL A 36 -3.299 16.799 5.027 1.00 0.00 C ATOM 562 C VAL A 36 -4.107 15.876 4.113 1.00 0.00 C ATOM 563 O VAL A 36 -3.831 14.681 4.033 1.00 0.00 O ATOM 564 CB VAL A 36 -3.490 16.487 6.513 1.00 0.00 C ATOM 565 CG1 VAL A 36 -3.520 14.976 6.755 1.00 0.00 C ATOM 566 CG2 VAL A 36 -2.404 17.156 7.358 1.00 0.00 C ATOM 0 H VAL A 36 -4.607 18.437 5.051 1.00 0.00 H new ATOM 0 HA VAL A 36 -2.245 16.632 4.806 1.00 0.00 H new ATOM 0 HB VAL A 36 -4.452 16.896 6.821 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -3.657 14.781 7.819 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -4.345 14.534 6.196 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -2.580 14.536 6.423 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -2.563 16.918 8.410 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -1.425 16.791 7.048 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -2.449 18.236 7.219 1.00 0.00 H new ATOM 576 N ILE A 37 -5.088 16.467 3.447 1.00 0.00 N ATOM 577 CA ILE A 37 -5.939 15.713 2.542 1.00 0.00 C ATOM 578 C ILE A 37 -5.123 15.289 1.317 1.00 0.00 C ATOM 579 O ILE A 37 -5.241 14.159 0.849 1.00 0.00 O ATOM 580 CB ILE A 37 -7.197 16.512 2.196 1.00 0.00 C ATOM 581 CG1 ILE A 37 -7.852 17.074 3.460 1.00 0.00 C ATOM 582 CG2 ILE A 37 -8.171 15.670 1.371 1.00 0.00 C ATOM 583 CD1 ILE A 37 -8.523 15.964 4.270 1.00 0.00 C ATOM 0 H ILE A 37 -5.313 17.460 3.516 1.00 0.00 H new ATOM 0 HA ILE A 37 -6.292 14.801 3.023 1.00 0.00 H new ATOM 0 HB ILE A 37 -6.905 17.362 1.579 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -7.100 17.572 4.072 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -8.591 17.827 3.187 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -9.057 16.261 1.139 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -7.689 15.359 0.444 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -8.463 14.788 1.941 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -8.980 16.391 5.163 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -9.291 15.484 3.663 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -7.777 15.225 4.562 1.00 0.00 H new ATOM 595 N PRO A 38 -4.293 16.247 0.821 1.00 0.00 N ATOM 596 CA PRO A 38 -3.460 15.984 -0.340 1.00 0.00 C ATOM 597 C PRO A 38 -2.270 15.094 0.029 1.00 0.00 C ATOM 598 O PRO A 38 -1.832 14.273 -0.775 1.00 0.00 O ATOM 599 CB PRO A 38 -3.041 17.357 -0.842 1.00 0.00 C ATOM 600 CG PRO A 38 -3.270 18.312 0.319 1.00 0.00 C ATOM 601 CD PRO A 38 -4.128 17.597 1.349 1.00 0.00 C ATOM 0 HA PRO A 38 -3.986 15.432 -1.119 1.00 0.00 H new ATOM 0 HB2 PRO A 38 -1.995 17.358 -1.149 1.00 0.00 H new ATOM 0 HB3 PRO A 38 -3.629 17.651 -1.712 1.00 0.00 H new ATOM 0 HG2 PRO A 38 -2.319 18.614 0.758 1.00 0.00 H new ATOM 0 HG3 PRO A 38 -3.765 19.220 -0.026 1.00 0.00 H new ATOM 0 HD2 PRO A 38 -3.645 17.584 2.326 1.00 0.00 H new ATOM 0 HD3 PRO A 38 -5.090 18.093 1.476 1.00 0.00 H new ATOM 609 N MET A 39 -1.782 15.289 1.245 1.00 0.00 N ATOM 610 CA MET A 39 -0.652 14.514 1.730 1.00 0.00 C ATOM 611 C MET A 39 -1.035 13.046 1.918 1.00 0.00 C ATOM 612 O MET A 39 -0.235 12.152 1.643 1.00 0.00 O ATOM 613 CB MET A 39 -0.171 15.092 3.063 1.00 0.00 C ATOM 614 CG MET A 39 1.350 15.251 3.075 1.00 0.00 C ATOM 615 SD MET A 39 1.939 15.369 4.755 1.00 0.00 S ATOM 616 CE MET A 39 1.733 13.673 5.275 1.00 0.00 C ATOM 0 H MET A 39 -2.148 15.972 1.909 1.00 0.00 H new ATOM 0 HA MET A 39 0.147 14.569 0.991 1.00 0.00 H new ATOM 0 HB2 MET A 39 -0.643 16.059 3.235 1.00 0.00 H new ATOM 0 HB3 MET A 39 -0.478 14.438 3.879 1.00 0.00 H new ATOM 0 HG2 MET A 39 1.816 14.401 2.576 1.00 0.00 H new ATOM 0 HG3 MET A 39 1.635 16.143 2.518 1.00 0.00 H new ATOM 0 HE1 MET A 39 1.584 13.639 6.354 1.00 0.00 H new ATOM 0 HE2 MET A 39 0.866 13.242 4.775 1.00 0.00 H new ATOM 0 HE3 MET A 39 2.624 13.102 5.014 1.00 0.00 H new ATOM 626 N PHE A 40 -2.257 12.841 2.386 1.00 0.00 N ATOM 627 CA PHE A 40 -2.755 11.495 2.614 1.00 0.00 C ATOM 628 C PHE A 40 -3.081 10.799 1.291 1.00 0.00 C ATOM 629 O PHE A 40 -2.719 9.641 1.089 1.00 0.00 O ATOM 630 CB PHE A 40 -4.039 11.627 3.437 1.00 0.00 C ATOM 631 CG PHE A 40 -4.332 10.419 4.329 1.00 0.00 C ATOM 632 CD1 PHE A 40 -4.740 9.247 3.774 1.00 0.00 C ATOM 633 CD2 PHE A 40 -4.186 10.519 5.678 1.00 0.00 C ATOM 634 CE1 PHE A 40 -5.013 8.126 4.602 1.00 0.00 C ATOM 635 CE2 PHE A 40 -4.458 9.398 6.506 1.00 0.00 C ATOM 636 CZ PHE A 40 -4.867 8.225 5.951 1.00 0.00 C ATOM 0 H PHE A 40 -2.917 13.584 2.614 1.00 0.00 H new ATOM 0 HA PHE A 40 -2.000 10.901 3.129 1.00 0.00 H new ATOM 0 HB2 PHE A 40 -3.969 12.518 4.061 1.00 0.00 H new ATOM 0 HB3 PHE A 40 -4.879 11.778 2.759 1.00 0.00 H new ATOM 0 HD1 PHE A 40 -4.857 9.168 2.703 1.00 0.00 H new ATOM 0 HD2 PHE A 40 -3.863 11.451 6.119 1.00 0.00 H new ATOM 0 HE1 PHE A 40 -5.337 7.195 4.161 1.00 0.00 H new ATOM 0 HE2 PHE A 40 -4.340 9.476 7.577 1.00 0.00 H new ATOM 0 HZ PHE A 40 -5.076 7.373 6.581 1.00 0.00 H new ATOM 646 N SER A 41 -3.761 11.535 0.424 1.00 0.00 N ATOM 647 CA SER A 41 -4.139 11.003 -0.874 1.00 0.00 C ATOM 648 C SER A 41 -2.890 10.590 -1.655 1.00 0.00 C ATOM 649 O SER A 41 -2.896 9.574 -2.350 1.00 0.00 O ATOM 650 CB SER A 41 -4.951 12.025 -1.673 1.00 0.00 C ATOM 651 OG SER A 41 -4.156 13.136 -2.082 1.00 0.00 O ATOM 0 H SER A 41 -4.060 12.495 0.595 1.00 0.00 H new ATOM 0 HA SER A 41 -4.766 10.126 -0.714 1.00 0.00 H new ATOM 0 HB2 SER A 41 -5.378 11.542 -2.552 1.00 0.00 H new ATOM 0 HB3 SER A 41 -5.785 12.379 -1.067 1.00 0.00 H new ATOM 0 HG SER A 41 -3.488 13.331 -1.392 1.00 0.00 H new ATOM 657 N ALA A 42 -1.849 11.397 -1.514 1.00 0.00 N ATOM 658 CA ALA A 42 -0.595 11.128 -2.197 1.00 0.00 C ATOM 659 C ALA A 42 0.148 10.007 -1.469 1.00 0.00 C ATOM 660 O ALA A 42 0.851 9.215 -2.093 1.00 0.00 O ATOM 661 CB ALA A 42 0.228 12.415 -2.280 1.00 0.00 C ATOM 0 H ALA A 42 -1.848 12.238 -0.937 1.00 0.00 H new ATOM 0 HA ALA A 42 -0.779 10.792 -3.218 1.00 0.00 H new ATOM 0 HB1 ALA A 42 1.169 12.213 -2.792 1.00 0.00 H new ATOM 0 HB2 ALA A 42 -0.332 13.170 -2.833 1.00 0.00 H new ATOM 0 HB3 ALA A 42 0.434 12.781 -1.274 1.00 0.00 H new ATOM 667 N LEU A 43 -0.035 9.974 -0.157 1.00 0.00 N ATOM 668 CA LEU A 43 0.608 8.963 0.664 1.00 0.00 C ATOM 669 C LEU A 43 0.191 7.574 0.175 1.00 0.00 C ATOM 670 O LEU A 43 1.028 6.683 0.038 1.00 0.00 O ATOM 671 CB LEU A 43 0.315 9.208 2.145 1.00 0.00 C ATOM 672 CG LEU A 43 1.441 9.855 2.954 1.00 0.00 C ATOM 673 CD1 LEU A 43 0.887 10.575 4.186 1.00 0.00 C ATOM 674 CD2 LEU A 43 2.511 8.826 3.325 1.00 0.00 C ATOM 0 H LEU A 43 -0.620 10.632 0.358 1.00 0.00 H new ATOM 0 HA LEU A 43 1.692 9.024 0.564 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -0.569 9.841 2.220 1.00 0.00 H new ATOM 0 HB3 LEU A 43 0.064 8.254 2.608 1.00 0.00 H new ATOM 0 HG LEU A 43 1.921 10.608 2.329 1.00 0.00 H new ATOM 0 HD11 LEU A 43 1.708 11.026 4.744 1.00 0.00 H new ATOM 0 HD12 LEU A 43 0.192 11.353 3.871 1.00 0.00 H new ATOM 0 HD13 LEU A 43 0.366 9.859 4.822 1.00 0.00 H new ATOM 0 HD21 LEU A 43 3.300 9.312 3.899 1.00 0.00 H new ATOM 0 HD22 LEU A 43 2.062 8.034 3.924 1.00 0.00 H new ATOM 0 HD23 LEU A 43 2.935 8.398 2.416 1.00 0.00 H new ATOM 686 N SER A 44 -1.103 7.434 -0.074 1.00 0.00 N ATOM 687 CA SER A 44 -1.641 6.169 -0.544 1.00 0.00 C ATOM 688 C SER A 44 -1.447 6.048 -2.057 1.00 0.00 C ATOM 689 O SER A 44 -0.509 5.396 -2.516 1.00 0.00 O ATOM 690 CB SER A 44 -3.122 6.035 -0.187 1.00 0.00 C ATOM 691 OG SER A 44 -3.693 4.842 -0.719 1.00 0.00 O ATOM 0 H SER A 44 -1.794 8.175 0.041 1.00 0.00 H new ATOM 0 HA SER A 44 -1.101 5.362 -0.049 1.00 0.00 H new ATOM 0 HB2 SER A 44 -3.236 6.039 0.897 1.00 0.00 H new ATOM 0 HB3 SER A 44 -3.667 6.899 -0.568 1.00 0.00 H new ATOM 0 HG SER A 44 -4.666 4.867 -0.608 1.00 0.00 H new ATOM 697 N GLU A 45 -2.348 6.686 -2.790 1.00 0.00 N ATOM 698 CA GLU A 45 -2.285 6.657 -4.242 1.00 0.00 C ATOM 699 C GLU A 45 -2.889 5.355 -4.773 1.00 0.00 C ATOM 700 O GLU A 45 -3.220 5.256 -5.954 1.00 0.00 O ATOM 701 CB GLU A 45 -0.848 6.837 -4.734 1.00 0.00 C ATOM 702 CG GLU A 45 -0.763 7.944 -5.786 1.00 0.00 C ATOM 703 CD GLU A 45 0.656 8.058 -6.348 1.00 0.00 C ATOM 704 OE1 GLU A 45 1.478 8.722 -5.681 1.00 0.00 O ATOM 705 OE2 GLU A 45 0.884 7.479 -7.432 1.00 0.00 O ATOM 0 H GLU A 45 -3.124 7.225 -2.407 1.00 0.00 H new ATOM 0 HA GLU A 45 -2.871 7.491 -4.628 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -0.199 7.080 -3.892 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -0.485 5.900 -5.157 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -1.463 7.736 -6.595 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -1.060 8.895 -5.344 1.00 0.00 H new ATOM 712 N GLY A 46 -3.013 4.388 -3.875 1.00 0.00 N ATOM 713 CA GLY A 46 -3.571 3.096 -4.239 1.00 0.00 C ATOM 714 C GLY A 46 -3.136 2.013 -3.250 1.00 0.00 C ATOM 715 O GLY A 46 -2.838 0.888 -3.647 1.00 0.00 O ATOM 0 H GLY A 46 -2.737 4.473 -2.897 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -4.659 3.159 -4.260 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -3.248 2.826 -5.244 1.00 0.00 H new ATOM 719 N ALA A 47 -3.111 2.392 -1.980 1.00 0.00 N ATOM 720 CA ALA A 47 -2.718 1.468 -0.930 1.00 0.00 C ATOM 721 C ALA A 47 -3.810 0.411 -0.751 1.00 0.00 C ATOM 722 O ALA A 47 -4.912 0.558 -1.276 1.00 0.00 O ATOM 723 CB ALA A 47 -2.442 2.245 0.358 1.00 0.00 C ATOM 0 H ALA A 47 -3.357 3.327 -1.655 1.00 0.00 H new ATOM 0 HA ALA A 47 -1.798 0.949 -1.201 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -2.147 1.551 1.145 1.00 0.00 H new ATOM 0 HB2 ALA A 47 -1.639 2.961 0.186 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -3.343 2.777 0.662 1.00 0.00 H new ATOM 729 N THR A 48 -3.464 -0.631 -0.010 1.00 0.00 N ATOM 730 CA THR A 48 -4.401 -1.712 0.245 1.00 0.00 C ATOM 731 C THR A 48 -5.297 -1.371 1.438 1.00 0.00 C ATOM 732 O THR A 48 -5.254 -0.255 1.953 1.00 0.00 O ATOM 733 CB THR A 48 -3.598 -2.999 0.437 1.00 0.00 C ATOM 734 OG1 THR A 48 -3.407 -3.082 1.848 1.00 0.00 O ATOM 735 CG2 THR A 48 -2.179 -2.892 -0.124 1.00 0.00 C ATOM 0 H THR A 48 -2.548 -0.750 0.422 1.00 0.00 H new ATOM 0 HA THR A 48 -5.077 -1.856 -0.598 1.00 0.00 H new ATOM 0 HB THR A 48 -4.118 -3.827 -0.045 1.00 0.00 H new ATOM 0 HG1 THR A 48 -2.895 -3.890 2.062 1.00 0.00 H new ATOM 0 HG21 THR A 48 -1.652 -3.832 0.038 1.00 0.00 H new ATOM 0 HG22 THR A 48 -2.225 -2.681 -1.192 1.00 0.00 H new ATOM 0 HG23 THR A 48 -1.647 -2.086 0.382 1.00 0.00 H new ATOM 743 N PRO A 49 -6.111 -2.378 1.852 1.00 0.00 N ATOM 744 CA PRO A 49 -7.016 -2.197 2.975 1.00 0.00 C ATOM 745 C PRO A 49 -6.255 -2.218 4.301 1.00 0.00 C ATOM 746 O PRO A 49 -6.620 -1.514 5.242 1.00 0.00 O ATOM 747 CB PRO A 49 -8.026 -3.325 2.851 1.00 0.00 C ATOM 748 CG PRO A 49 -7.384 -4.363 1.944 1.00 0.00 C ATOM 749 CD PRO A 49 -6.190 -3.714 1.267 1.00 0.00 C ATOM 0 HA PRO A 49 -7.517 -1.229 2.961 1.00 0.00 H new ATOM 0 HB2 PRO A 49 -8.258 -3.750 3.827 1.00 0.00 H new ATOM 0 HB3 PRO A 49 -8.964 -2.964 2.429 1.00 0.00 H new ATOM 0 HG2 PRO A 49 -7.070 -5.232 2.521 1.00 0.00 H new ATOM 0 HG3 PRO A 49 -8.099 -4.716 1.201 1.00 0.00 H new ATOM 0 HD2 PRO A 49 -5.276 -4.280 1.448 1.00 0.00 H new ATOM 0 HD3 PRO A 49 -6.326 -3.666 0.187 1.00 0.00 H new ATOM 757 N GLN A 50 -5.211 -3.033 4.335 1.00 0.00 N ATOM 758 CA GLN A 50 -4.395 -3.156 5.532 1.00 0.00 C ATOM 759 C GLN A 50 -3.447 -1.961 5.652 1.00 0.00 C ATOM 760 O GLN A 50 -3.166 -1.495 6.755 1.00 0.00 O ATOM 761 CB GLN A 50 -3.620 -4.474 5.535 1.00 0.00 C ATOM 762 CG GLN A 50 -4.157 -5.424 6.607 1.00 0.00 C ATOM 763 CD GLN A 50 -3.074 -6.403 7.065 1.00 0.00 C ATOM 764 OE1 GLN A 50 -2.256 -6.109 7.921 1.00 0.00 O ATOM 765 NE2 GLN A 50 -3.113 -7.581 6.447 1.00 0.00 N ATOM 0 H GLN A 50 -4.911 -3.615 3.553 1.00 0.00 H new ATOM 0 HA GLN A 50 -5.055 -3.160 6.399 1.00 0.00 H new ATOM 0 HB2 GLN A 50 -3.695 -4.946 4.555 1.00 0.00 H new ATOM 0 HB3 GLN A 50 -2.563 -4.278 5.714 1.00 0.00 H new ATOM 0 HG2 GLN A 50 -4.517 -4.849 7.460 1.00 0.00 H new ATOM 0 HG3 GLN A 50 -5.010 -5.977 6.213 1.00 0.00 H new ATOM 0 HE21 GLN A 50 -3.825 -7.762 5.739 1.00 0.00 H new ATOM 0 HE22 GLN A 50 -2.431 -8.303 6.681 1.00 0.00 H new ATOM 774 N ASP A 51 -2.979 -1.499 4.501 1.00 0.00 N ATOM 775 CA ASP A 51 -2.068 -0.369 4.464 1.00 0.00 C ATOM 776 C ASP A 51 -2.809 0.893 4.909 1.00 0.00 C ATOM 777 O ASP A 51 -2.384 1.570 5.844 1.00 0.00 O ATOM 778 CB ASP A 51 -1.542 -0.132 3.046 1.00 0.00 C ATOM 779 CG ASP A 51 -0.052 -0.418 2.854 1.00 0.00 C ATOM 780 OD1 ASP A 51 0.332 -1.591 3.049 1.00 0.00 O ATOM 781 OD2 ASP A 51 0.671 0.544 2.515 1.00 0.00 O ATOM 0 H ASP A 51 -3.214 -1.887 3.588 1.00 0.00 H new ATOM 0 HA ASP A 51 -1.232 -0.588 5.128 1.00 0.00 H new ATOM 0 HB2 ASP A 51 -2.109 -0.756 2.355 1.00 0.00 H new ATOM 0 HB3 ASP A 51 -1.736 0.905 2.771 1.00 0.00 H new ATOM 786 N LEU A 52 -3.906 1.172 4.219 1.00 0.00 N ATOM 787 CA LEU A 52 -4.710 2.340 4.532 1.00 0.00 C ATOM 788 C LEU A 52 -5.228 2.228 5.968 1.00 0.00 C ATOM 789 O LEU A 52 -5.169 3.192 6.730 1.00 0.00 O ATOM 790 CB LEU A 52 -5.817 2.524 3.491 1.00 0.00 C ATOM 791 CG LEU A 52 -5.605 3.650 2.478 1.00 0.00 C ATOM 792 CD1 LEU A 52 -6.626 3.564 1.342 1.00 0.00 C ATOM 793 CD2 LEU A 52 -5.627 5.017 3.165 1.00 0.00 C ATOM 0 H LEU A 52 -4.256 0.608 3.444 1.00 0.00 H new ATOM 0 HA LEU A 52 -4.104 3.244 4.481 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -5.934 1.588 2.945 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -6.755 2.706 4.016 1.00 0.00 H new ATOM 0 HG LEU A 52 -4.617 3.528 2.034 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -6.453 4.376 0.635 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -6.520 2.608 0.829 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -7.633 3.647 1.751 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -5.474 5.800 2.422 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -6.590 5.163 3.653 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -4.832 5.063 3.910 1.00 0.00 H new ATOM 805 N ASN A 53 -5.724 1.043 6.293 1.00 0.00 N ATOM 806 CA ASN A 53 -6.252 0.793 7.623 1.00 0.00 C ATOM 807 C ASN A 53 -5.189 1.148 8.664 1.00 0.00 C ATOM 808 O ASN A 53 -5.500 1.745 9.694 1.00 0.00 O ATOM 809 CB ASN A 53 -6.615 -0.683 7.802 1.00 0.00 C ATOM 810 CG ASN A 53 -6.959 -0.989 9.261 1.00 0.00 C ATOM 811 OD1 ASN A 53 -7.554 -0.192 9.967 1.00 0.00 O ATOM 812 ND2 ASN A 53 -6.552 -2.187 9.673 1.00 0.00 N ATOM 0 H ASN A 53 -5.771 0.246 5.658 1.00 0.00 H new ATOM 0 HA ASN A 53 -7.146 1.403 7.752 1.00 0.00 H new ATOM 0 HB2 ASN A 53 -7.463 -0.933 7.164 1.00 0.00 H new ATOM 0 HB3 ASN A 53 -5.781 -1.308 7.482 1.00 0.00 H new ATOM 0 HD21 ASN A 53 -6.734 -2.486 10.631 1.00 0.00 H new ATOM 0 HD22 ASN A 53 -6.058 -2.807 9.031 1.00 0.00 H new ATOM 819 N THR A 54 -3.957 0.767 8.359 1.00 0.00 N ATOM 820 CA THR A 54 -2.846 1.039 9.257 1.00 0.00 C ATOM 821 C THR A 54 -2.646 2.547 9.416 1.00 0.00 C ATOM 822 O THR A 54 -2.530 3.046 10.535 1.00 0.00 O ATOM 823 CB THR A 54 -1.613 0.315 8.713 1.00 0.00 C ATOM 824 OG1 THR A 54 -1.615 -0.936 9.395 1.00 0.00 O ATOM 825 CG2 THR A 54 -0.305 0.978 9.153 1.00 0.00 C ATOM 0 H THR A 54 -3.703 0.273 7.504 1.00 0.00 H new ATOM 0 HA THR A 54 -3.045 0.663 10.260 1.00 0.00 H new ATOM 0 HB THR A 54 -1.659 0.288 7.624 1.00 0.00 H new ATOM 0 HG1 THR A 54 -2.120 -1.593 8.872 1.00 0.00 H new ATOM 0 HG21 THR A 54 0.539 0.426 8.740 1.00 0.00 H new ATOM 0 HG22 THR A 54 -0.278 2.006 8.791 1.00 0.00 H new ATOM 0 HG23 THR A 54 -0.244 0.975 10.241 1.00 0.00 H new ATOM 833 N MET A 55 -2.612 3.230 8.282 1.00 0.00 N ATOM 834 CA MET A 55 -2.427 4.671 8.281 1.00 0.00 C ATOM 835 C MET A 55 -3.463 5.356 9.176 1.00 0.00 C ATOM 836 O MET A 55 -3.144 6.314 9.879 1.00 0.00 O ATOM 837 CB MET A 55 -2.556 5.203 6.852 1.00 0.00 C ATOM 838 CG MET A 55 -2.008 6.626 6.746 1.00 0.00 C ATOM 839 SD MET A 55 -1.122 6.826 5.208 1.00 0.00 S ATOM 840 CE MET A 55 -1.992 8.228 4.529 1.00 0.00 C ATOM 0 H MET A 55 -2.709 2.812 7.357 1.00 0.00 H new ATOM 0 HA MET A 55 -1.433 4.891 8.671 1.00 0.00 H new ATOM 0 HB2 MET A 55 -2.016 4.550 6.167 1.00 0.00 H new ATOM 0 HB3 MET A 55 -3.603 5.189 6.548 1.00 0.00 H new ATOM 0 HG2 MET A 55 -2.826 7.345 6.800 1.00 0.00 H new ATOM 0 HG3 MET A 55 -1.346 6.833 7.586 1.00 0.00 H new ATOM 0 HE1 MET A 55 -1.280 8.902 4.053 1.00 0.00 H new ATOM 0 HE2 MET A 55 -2.716 7.884 3.790 1.00 0.00 H new ATOM 0 HE3 MET A 55 -2.513 8.755 5.328 1.00 0.00 H new ATOM 850 N LEU A 56 -4.681 4.840 9.119 1.00 0.00 N ATOM 851 CA LEU A 56 -5.765 5.389 9.915 1.00 0.00 C ATOM 852 C LEU A 56 -5.612 4.929 11.365 1.00 0.00 C ATOM 853 O LEU A 56 -5.921 5.675 12.294 1.00 0.00 O ATOM 854 CB LEU A 56 -7.119 5.033 9.297 1.00 0.00 C ATOM 855 CG LEU A 56 -7.937 6.205 8.751 1.00 0.00 C ATOM 856 CD1 LEU A 56 -7.123 7.022 7.747 1.00 0.00 C ATOM 857 CD2 LEU A 56 -9.261 5.720 8.155 1.00 0.00 C ATOM 0 H LEU A 56 -4.942 4.047 8.533 1.00 0.00 H new ATOM 0 HA LEU A 56 -5.719 6.478 9.919 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -6.951 4.324 8.486 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -7.716 4.519 10.050 1.00 0.00 H new ATOM 0 HG LEU A 56 -8.181 6.867 9.582 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -7.728 7.849 7.375 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -6.232 7.416 8.236 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -6.828 6.385 6.914 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -9.823 6.573 7.774 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -9.060 5.025 7.340 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -9.844 5.216 8.926 1.00 0.00 H new ATOM 869 N ASN A 57 -5.135 3.702 11.516 1.00 0.00 N ATOM 870 CA ASN A 57 -4.936 3.133 12.838 1.00 0.00 C ATOM 871 C ASN A 57 -3.828 3.903 13.559 1.00 0.00 C ATOM 872 O ASN A 57 -3.809 3.967 14.787 1.00 0.00 O ATOM 873 CB ASN A 57 -4.511 1.666 12.748 1.00 0.00 C ATOM 874 CG ASN A 57 -4.616 0.980 14.112 1.00 0.00 C ATOM 875 OD1 ASN A 57 -5.305 1.433 15.012 1.00 0.00 O ATOM 876 ND2 ASN A 57 -3.895 -0.133 14.215 1.00 0.00 N ATOM 0 H ASN A 57 -4.880 3.086 10.744 1.00 0.00 H new ATOM 0 HA ASN A 57 -5.879 3.203 13.380 1.00 0.00 H new ATOM 0 HB2 ASN A 57 -5.140 1.145 12.026 1.00 0.00 H new ATOM 0 HB3 ASN A 57 -3.486 1.602 12.383 1.00 0.00 H new ATOM 0 HD21 ASN A 57 -3.897 -0.663 15.086 1.00 0.00 H new ATOM 0 HD22 ASN A 57 -3.340 -0.456 13.423 1.00 0.00 H new ATOM 883 N THR A 58 -2.932 4.468 12.764 1.00 0.00 N ATOM 884 CA THR A 58 -1.822 5.232 13.311 1.00 0.00 C ATOM 885 C THR A 58 -2.341 6.383 14.174 1.00 0.00 C ATOM 886 O THR A 58 -2.025 6.466 15.360 1.00 0.00 O ATOM 887 CB THR A 58 -0.946 5.694 12.145 1.00 0.00 C ATOM 888 OG1 THR A 58 0.129 4.759 12.127 1.00 0.00 O ATOM 889 CG2 THR A 58 -0.267 7.037 12.419 1.00 0.00 C ATOM 0 H THR A 58 -2.951 4.413 11.746 1.00 0.00 H new ATOM 0 HA THR A 58 -1.210 4.621 13.974 1.00 0.00 H new ATOM 0 HB THR A 58 -1.554 5.772 11.243 1.00 0.00 H new ATOM 0 HG1 THR A 58 0.977 5.233 12.257 1.00 0.00 H new ATOM 0 HG21 THR A 58 0.342 7.319 11.560 1.00 0.00 H new ATOM 0 HG22 THR A 58 -1.026 7.800 12.591 1.00 0.00 H new ATOM 0 HG23 THR A 58 0.367 6.951 13.301 1.00 0.00 H new ATOM 897 N VAL A 59 -3.130 7.242 13.547 1.00 0.00 N ATOM 898 CA VAL A 59 -3.697 8.386 14.243 1.00 0.00 C ATOM 899 C VAL A 59 -4.486 7.896 15.459 1.00 0.00 C ATOM 900 O VAL A 59 -4.582 6.694 15.698 1.00 0.00 O ATOM 901 CB VAL A 59 -4.541 9.220 13.278 1.00 0.00 C ATOM 902 CG1 VAL A 59 -6.012 9.219 13.695 1.00 0.00 C ATOM 903 CG2 VAL A 59 -4.001 10.649 13.173 1.00 0.00 C ATOM 0 H VAL A 59 -3.391 7.169 12.564 1.00 0.00 H new ATOM 0 HA VAL A 59 -2.907 9.041 14.610 1.00 0.00 H new ATOM 0 HB VAL A 59 -4.473 8.762 12.291 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -6.590 9.819 12.992 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -6.390 8.196 13.695 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -6.107 9.641 14.696 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -4.619 11.221 12.481 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -4.025 11.120 14.156 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -2.974 10.624 12.808 1.00 0.00 H new ATOM 913 N GLY A 60 -5.031 8.854 16.193 1.00 0.00 N ATOM 914 CA GLY A 60 -5.810 8.536 17.379 1.00 0.00 C ATOM 915 C GLY A 60 -5.798 9.700 18.372 1.00 0.00 C ATOM 916 O GLY A 60 -5.262 9.577 19.472 1.00 0.00 O ATOM 0 H GLY A 60 -4.949 9.850 15.990 1.00 0.00 H new ATOM 0 HA2 GLY A 60 -6.837 8.308 17.093 1.00 0.00 H new ATOM 0 HA3 GLY A 60 -5.406 7.643 17.855 1.00 0.00 H new ATOM 920 N GLY A 61 -6.394 10.805 17.947 1.00 0.00 N ATOM 921 CA GLY A 61 -6.458 11.990 18.785 1.00 0.00 C ATOM 922 C GLY A 61 -7.522 12.964 18.275 1.00 0.00 C ATOM 923 O GLY A 61 -7.270 14.164 18.170 1.00 0.00 O ATOM 0 H GLY A 61 -6.837 10.904 17.033 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -6.685 11.702 19.812 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -5.486 12.483 18.800 1.00 0.00 H new ATOM 927 N HIS A 62 -8.687 12.413 17.972 1.00 0.00 N ATOM 928 CA HIS A 62 -9.790 13.218 17.476 1.00 0.00 C ATOM 929 C HIS A 62 -10.981 12.313 17.151 1.00 0.00 C ATOM 930 O HIS A 62 -11.216 11.984 15.990 1.00 0.00 O ATOM 931 CB HIS A 62 -9.349 14.067 16.283 1.00 0.00 C ATOM 932 CG HIS A 62 -8.475 13.333 15.295 1.00 0.00 C ATOM 933 ND1 HIS A 62 -7.247 13.816 14.875 1.00 0.00 N ATOM 934 CD2 HIS A 62 -8.661 12.145 14.650 1.00 0.00 C ATOM 935 CE1 HIS A 62 -6.729 12.951 14.016 1.00 0.00 C ATOM 936 NE2 HIS A 62 -7.608 11.916 13.877 1.00 0.00 N ATOM 0 H HIS A 62 -8.892 11.418 18.060 1.00 0.00 H new ATOM 0 HA HIS A 62 -10.110 13.918 18.248 1.00 0.00 H new ATOM 0 HB2 HIS A 62 -10.235 14.435 15.765 1.00 0.00 H new ATOM 0 HB3 HIS A 62 -8.809 14.940 16.651 1.00 0.00 H new ATOM 0 HD1 HIS A 62 -6.815 14.690 15.176 1.00 0.00 H new ATOM 0 HD2 HIS A 62 -9.521 11.500 14.752 1.00 0.00 H new ATOM 0 HE1 HIS A 62 -5.778 13.048 13.514 1.00 0.00 H new ATOM 945 N GLN A 63 -11.700 11.938 18.199 1.00 0.00 N ATOM 946 CA GLN A 63 -12.861 11.078 18.040 1.00 0.00 C ATOM 947 C GLN A 63 -13.788 11.632 16.957 1.00 0.00 C ATOM 948 O GLN A 63 -14.511 10.878 16.308 1.00 0.00 O ATOM 949 CB GLN A 63 -13.605 10.911 19.366 1.00 0.00 C ATOM 950 CG GLN A 63 -12.925 9.861 20.249 1.00 0.00 C ATOM 951 CD GLN A 63 -13.960 8.962 20.927 1.00 0.00 C ATOM 952 OE1 GLN A 63 -15.095 8.844 20.497 1.00 0.00 O ATOM 953 NE2 GLN A 63 -13.506 8.336 22.009 1.00 0.00 N ATOM 0 H GLN A 63 -11.501 12.214 19.161 1.00 0.00 H new ATOM 0 HA GLN A 63 -12.518 10.092 17.727 1.00 0.00 H new ATOM 0 HB2 GLN A 63 -13.639 11.866 19.891 1.00 0.00 H new ATOM 0 HB3 GLN A 63 -14.637 10.616 19.174 1.00 0.00 H new ATOM 0 HG2 GLN A 63 -12.251 9.254 19.645 1.00 0.00 H new ATOM 0 HG3 GLN A 63 -12.316 10.356 21.006 1.00 0.00 H new ATOM 0 HE21 GLN A 63 -12.544 8.479 22.315 1.00 0.00 H new ATOM 0 HE22 GLN A 63 -14.120 7.712 22.533 1.00 0.00 H new ATOM 962 N ALA A 64 -13.737 12.946 16.795 1.00 0.00 N ATOM 963 CA ALA A 64 -14.564 13.611 15.802 1.00 0.00 C ATOM 964 C ALA A 64 -14.079 13.227 14.403 1.00 0.00 C ATOM 965 O ALA A 64 -14.880 12.863 13.543 1.00 0.00 O ATOM 966 CB ALA A 64 -14.529 15.123 16.037 1.00 0.00 C ATOM 0 H ALA A 64 -13.136 13.568 17.335 1.00 0.00 H new ATOM 0 HA ALA A 64 -15.602 13.292 15.891 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -15.149 15.621 15.292 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -14.910 15.345 17.034 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -13.503 15.481 15.953 1.00 0.00 H new ATOM 972 N ALA A 65 -12.771 13.322 14.217 1.00 0.00 N ATOM 973 CA ALA A 65 -12.171 12.990 12.937 1.00 0.00 C ATOM 974 C ALA A 65 -12.477 11.530 12.598 1.00 0.00 C ATOM 975 O ALA A 65 -13.069 11.241 11.559 1.00 0.00 O ATOM 976 CB ALA A 65 -10.668 13.272 12.988 1.00 0.00 C ATOM 0 H ALA A 65 -12.110 13.624 14.932 1.00 0.00 H new ATOM 0 HA ALA A 65 -12.593 13.609 12.145 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -10.218 13.023 12.027 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -10.503 14.328 13.203 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -10.211 12.667 13.771 1.00 0.00 H new ATOM 982 N MET A 66 -12.061 10.648 13.495 1.00 0.00 N ATOM 983 CA MET A 66 -12.284 9.224 13.304 1.00 0.00 C ATOM 984 C MET A 66 -13.776 8.917 13.163 1.00 0.00 C ATOM 985 O MET A 66 -14.165 8.059 12.372 1.00 0.00 O ATOM 986 CB MET A 66 -11.715 8.454 14.497 1.00 0.00 C ATOM 987 CG MET A 66 -10.289 7.979 14.214 1.00 0.00 C ATOM 988 SD MET A 66 -10.278 6.886 12.804 1.00 0.00 S ATOM 989 CE MET A 66 -9.047 7.695 11.794 1.00 0.00 C ATOM 0 H MET A 66 -11.571 10.891 14.356 1.00 0.00 H new ATOM 0 HA MET A 66 -11.781 8.916 12.388 1.00 0.00 H new ATOM 0 HB2 MET A 66 -11.721 9.091 15.382 1.00 0.00 H new ATOM 0 HB3 MET A 66 -12.351 7.596 14.717 1.00 0.00 H new ATOM 0 HG2 MET A 66 -9.642 8.836 14.025 1.00 0.00 H new ATOM 0 HG3 MET A 66 -9.889 7.464 15.087 1.00 0.00 H new ATOM 0 HE1 MET A 66 -9.477 7.941 10.823 1.00 0.00 H new ATOM 0 HE2 MET A 66 -8.716 8.610 12.286 1.00 0.00 H new ATOM 0 HE3 MET A 66 -8.195 7.029 11.655 1.00 0.00 H new ATOM 999 N GLN A 67 -14.572 9.636 13.941 1.00 0.00 N ATOM 1000 CA GLN A 67 -16.013 9.451 13.912 1.00 0.00 C ATOM 1001 C GLN A 67 -16.543 9.632 12.488 1.00 0.00 C ATOM 1002 O GLN A 67 -17.203 8.744 11.949 1.00 0.00 O ATOM 1003 CB GLN A 67 -16.708 10.408 14.881 1.00 0.00 C ATOM 1004 CG GLN A 67 -18.218 10.442 14.631 1.00 0.00 C ATOM 1005 CD GLN A 67 -18.663 11.824 14.148 1.00 0.00 C ATOM 1006 OE1 GLN A 67 -17.873 12.634 13.691 1.00 0.00 O ATOM 1007 NE2 GLN A 67 -19.968 12.047 14.275 1.00 0.00 N ATOM 0 H GLN A 67 -14.246 10.348 14.595 1.00 0.00 H new ATOM 0 HA GLN A 67 -16.236 8.434 14.235 1.00 0.00 H new ATOM 0 HB2 GLN A 67 -16.513 10.097 15.907 1.00 0.00 H new ATOM 0 HB3 GLN A 67 -16.294 11.410 14.767 1.00 0.00 H new ATOM 0 HG2 GLN A 67 -18.484 9.690 13.888 1.00 0.00 H new ATOM 0 HG3 GLN A 67 -18.748 10.185 15.548 1.00 0.00 H new ATOM 0 HE21 GLN A 67 -20.573 11.325 14.666 1.00 0.00 H new ATOM 0 HE22 GLN A 67 -20.364 12.940 13.981 1.00 0.00 H new ATOM 1016 N MET A 68 -16.234 10.789 11.918 1.00 0.00 N ATOM 1017 CA MET A 68 -16.671 11.098 10.568 1.00 0.00 C ATOM 1018 C MET A 68 -15.978 10.193 9.547 1.00 0.00 C ATOM 1019 O MET A 68 -16.516 9.940 8.470 1.00 0.00 O ATOM 1020 CB MET A 68 -16.356 12.560 10.251 1.00 0.00 C ATOM 1021 CG MET A 68 -17.562 13.456 10.539 1.00 0.00 C ATOM 1022 SD MET A 68 -17.106 14.745 11.687 1.00 0.00 S ATOM 1023 CE MET A 68 -15.879 15.605 10.717 1.00 0.00 C ATOM 0 H MET A 68 -15.686 11.523 12.367 1.00 0.00 H new ATOM 0 HA MET A 68 -17.746 10.928 10.506 1.00 0.00 H new ATOM 0 HB2 MET A 68 -15.504 12.889 10.846 1.00 0.00 H new ATOM 0 HB3 MET A 68 -16.070 12.655 9.204 1.00 0.00 H new ATOM 0 HG2 MET A 68 -17.928 13.897 9.611 1.00 0.00 H new ATOM 0 HG3 MET A 68 -18.377 12.861 10.952 1.00 0.00 H new ATOM 0 HE1 MET A 68 -15.041 15.885 11.356 1.00 0.00 H new ATOM 0 HE2 MET A 68 -15.524 14.953 9.918 1.00 0.00 H new ATOM 0 HE3 MET A 68 -16.321 16.502 10.284 1.00 0.00 H new ATOM 1033 N LEU A 69 -14.794 9.731 9.921 1.00 0.00 N ATOM 1034 CA LEU A 69 -14.021 8.860 9.051 1.00 0.00 C ATOM 1035 C LEU A 69 -14.801 7.566 8.810 1.00 0.00 C ATOM 1036 O LEU A 69 -14.908 7.104 7.675 1.00 0.00 O ATOM 1037 CB LEU A 69 -12.621 8.636 9.625 1.00 0.00 C ATOM 1038 CG LEU A 69 -11.600 8.007 8.675 1.00 0.00 C ATOM 1039 CD1 LEU A 69 -12.297 7.217 7.565 1.00 0.00 C ATOM 1040 CD2 LEU A 69 -10.648 9.066 8.113 1.00 0.00 C ATOM 0 H LEU A 69 -14.351 9.943 10.815 1.00 0.00 H new ATOM 0 HA LEU A 69 -13.871 9.328 8.078 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -12.230 9.596 9.963 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -12.708 8.000 10.506 1.00 0.00 H new ATOM 0 HG LEU A 69 -10.996 7.300 9.243 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -11.548 6.780 6.904 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -12.899 6.423 8.007 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -12.941 7.885 6.993 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -9.933 8.592 7.441 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -11.220 9.815 7.565 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -10.113 9.546 8.932 1.00 0.00 H new ATOM 1052 N LYS A 70 -15.326 7.017 9.895 1.00 0.00 N ATOM 1053 CA LYS A 70 -16.092 5.785 9.816 1.00 0.00 C ATOM 1054 C LYS A 70 -17.425 6.063 9.117 1.00 0.00 C ATOM 1055 O LYS A 70 -17.820 5.328 8.213 1.00 0.00 O ATOM 1056 CB LYS A 70 -16.245 5.159 11.203 1.00 0.00 C ATOM 1057 CG LYS A 70 -15.054 4.257 11.532 1.00 0.00 C ATOM 1058 CD LYS A 70 -15.216 3.617 12.913 1.00 0.00 C ATOM 1059 CE LYS A 70 -13.951 3.798 13.752 1.00 0.00 C ATOM 1060 NZ LYS A 70 -14.300 4.169 15.143 1.00 0.00 N ATOM 0 H LYS A 70 -15.236 7.403 10.835 1.00 0.00 H new ATOM 0 HA LYS A 70 -15.563 5.046 9.215 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -16.329 5.945 11.953 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -17.167 4.579 11.245 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -14.963 3.478 10.775 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -14.133 4.839 11.503 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -16.066 4.065 13.428 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -15.434 2.555 12.802 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -13.371 2.875 13.750 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -13.322 4.571 13.310 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -13.429 4.288 15.699 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -14.834 5.061 15.141 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -14.882 3.418 15.567 1.00 0.00 H new ATOM 1074 N GLU A 71 -18.079 7.126 9.560 1.00 0.00 N ATOM 1075 CA GLU A 71 -19.358 7.510 8.987 1.00 0.00 C ATOM 1076 C GLU A 71 -19.241 7.644 7.467 1.00 0.00 C ATOM 1077 O GLU A 71 -20.070 7.115 6.728 1.00 0.00 O ATOM 1078 CB GLU A 71 -19.872 8.808 9.614 1.00 0.00 C ATOM 1079 CG GLU A 71 -20.858 8.518 10.746 1.00 0.00 C ATOM 1080 CD GLU A 71 -22.018 9.516 10.734 1.00 0.00 C ATOM 1081 OE1 GLU A 71 -21.729 10.723 10.879 1.00 0.00 O ATOM 1082 OE2 GLU A 71 -23.167 9.048 10.579 1.00 0.00 O ATOM 0 H GLU A 71 -17.747 7.734 10.309 1.00 0.00 H new ATOM 0 HA GLU A 71 -20.083 6.726 9.208 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -19.033 9.388 9.998 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -20.358 9.417 8.851 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -21.245 7.504 10.645 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -20.341 8.568 11.704 1.00 0.00 H new ATOM 1089 N THR A 72 -18.204 8.354 7.046 1.00 0.00 N ATOM 1090 CA THR A 72 -17.968 8.564 5.628 1.00 0.00 C ATOM 1091 C THR A 72 -17.724 7.227 4.925 1.00 0.00 C ATOM 1092 O THR A 72 -18.477 6.847 4.029 1.00 0.00 O ATOM 1093 CB THR A 72 -16.806 9.548 5.483 1.00 0.00 C ATOM 1094 OG1 THR A 72 -17.440 10.806 5.276 1.00 0.00 O ATOM 1095 CG2 THR A 72 -16.002 9.320 4.201 1.00 0.00 C ATOM 0 H THR A 72 -17.518 8.791 7.662 1.00 0.00 H new ATOM 0 HA THR A 72 -18.842 8.997 5.141 1.00 0.00 H new ATOM 0 HB THR A 72 -16.146 9.459 6.346 1.00 0.00 H new ATOM 0 HG1 THR A 72 -16.805 11.429 4.865 1.00 0.00 H new ATOM 0 HG21 THR A 72 -15.190 10.045 4.147 1.00 0.00 H new ATOM 0 HG22 THR A 72 -15.589 8.311 4.205 1.00 0.00 H new ATOM 0 HG23 THR A 72 -16.654 9.441 3.336 1.00 0.00 H new ATOM 1103 N ILE A 73 -16.670 6.551 5.357 1.00 0.00 N ATOM 1104 CA ILE A 73 -16.317 5.265 4.780 1.00 0.00 C ATOM 1105 C ILE A 73 -17.584 4.426 4.603 1.00 0.00 C ATOM 1106 O ILE A 73 -17.826 3.880 3.527 1.00 0.00 O ATOM 1107 CB ILE A 73 -15.238 4.579 5.620 1.00 0.00 C ATOM 1108 CG1 ILE A 73 -13.882 5.263 5.433 1.00 0.00 C ATOM 1109 CG2 ILE A 73 -15.172 3.082 5.310 1.00 0.00 C ATOM 1110 CD1 ILE A 73 -13.008 4.488 4.444 1.00 0.00 C ATOM 0 H ILE A 73 -16.048 6.870 6.100 1.00 0.00 H new ATOM 0 HA ILE A 73 -15.881 5.398 3.790 1.00 0.00 H new ATOM 0 HB ILE A 73 -15.507 4.679 6.671 1.00 0.00 H new ATOM 0 HG12 ILE A 73 -14.031 6.281 5.072 1.00 0.00 H new ATOM 0 HG13 ILE A 73 -13.372 5.337 6.394 1.00 0.00 H new ATOM 0 HG21 ILE A 73 -14.397 2.618 5.920 1.00 0.00 H new ATOM 0 HG22 ILE A 73 -16.134 2.621 5.533 1.00 0.00 H new ATOM 0 HG23 ILE A 73 -14.937 2.939 4.255 1.00 0.00 H new ATOM 0 HD11 ILE A 73 -12.050 4.996 4.329 1.00 0.00 H new ATOM 0 HD12 ILE A 73 -12.841 3.478 4.820 1.00 0.00 H new ATOM 0 HD13 ILE A 73 -13.510 4.437 3.478 1.00 0.00 H new ATOM 1122 N ASN A 74 -18.359 4.349 5.675 1.00 0.00 N ATOM 1123 CA ASN A 74 -19.595 3.585 5.650 1.00 0.00 C ATOM 1124 C ASN A 74 -20.515 4.146 4.565 1.00 0.00 C ATOM 1125 O ASN A 74 -21.202 3.392 3.877 1.00 0.00 O ATOM 1126 CB ASN A 74 -20.329 3.683 6.989 1.00 0.00 C ATOM 1127 CG ASN A 74 -21.191 2.443 7.235 1.00 0.00 C ATOM 1128 OD1 ASN A 74 -20.708 1.383 7.600 1.00 0.00 O ATOM 1129 ND2 ASN A 74 -22.488 2.633 7.016 1.00 0.00 N ATOM 0 H ASN A 74 -18.155 4.803 6.566 1.00 0.00 H new ATOM 0 HA ASN A 74 -19.344 2.543 5.451 1.00 0.00 H new ATOM 0 HB2 ASN A 74 -19.606 3.793 7.797 1.00 0.00 H new ATOM 0 HB3 ASN A 74 -20.957 4.574 6.999 1.00 0.00 H new ATOM 0 HD21 ASN A 74 -23.146 1.866 7.152 1.00 0.00 H new ATOM 0 HD22 ASN A 74 -22.825 3.546 6.712 1.00 0.00 H new ATOM 1136 N GLU A 75 -20.500 5.466 4.444 1.00 0.00 N ATOM 1137 CA GLU A 75 -21.324 6.137 3.453 1.00 0.00 C ATOM 1138 C GLU A 75 -20.891 5.734 2.042 1.00 0.00 C ATOM 1139 O GLU A 75 -21.679 5.170 1.285 1.00 0.00 O ATOM 1140 CB GLU A 75 -21.268 7.655 3.632 1.00 0.00 C ATOM 1141 CG GLU A 75 -22.429 8.148 4.498 1.00 0.00 C ATOM 1142 CD GLU A 75 -22.458 9.677 4.558 1.00 0.00 C ATOM 1143 OE1 GLU A 75 -21.453 10.246 5.036 1.00 0.00 O ATOM 1144 OE2 GLU A 75 -23.485 10.242 4.124 1.00 0.00 O ATOM 0 H GLU A 75 -19.930 6.089 5.016 1.00 0.00 H new ATOM 0 HA GLU A 75 -22.359 5.825 3.597 1.00 0.00 H new ATOM 0 HB2 GLU A 75 -20.321 7.936 4.093 1.00 0.00 H new ATOM 0 HB3 GLU A 75 -21.305 8.141 2.657 1.00 0.00 H new ATOM 0 HG2 GLU A 75 -23.371 7.778 4.094 1.00 0.00 H new ATOM 0 HG3 GLU A 75 -22.334 7.743 5.505 1.00 0.00 H new ATOM 1151 N GLU A 76 -19.640 6.039 1.731 1.00 0.00 N ATOM 1152 CA GLU A 76 -19.093 5.716 0.425 1.00 0.00 C ATOM 1153 C GLU A 76 -19.493 4.296 0.017 1.00 0.00 C ATOM 1154 O GLU A 76 -19.916 4.067 -1.115 1.00 0.00 O ATOM 1155 CB GLU A 76 -17.572 5.883 0.410 1.00 0.00 C ATOM 1156 CG GLU A 76 -17.131 6.791 -0.739 1.00 0.00 C ATOM 1157 CD GLU A 76 -17.530 6.198 -2.092 1.00 0.00 C ATOM 1158 OE1 GLU A 76 -18.715 5.823 -2.219 1.00 0.00 O ATOM 1159 OE2 GLU A 76 -16.641 6.135 -2.967 1.00 0.00 O ATOM 0 H GLU A 76 -18.989 6.507 2.362 1.00 0.00 H new ATOM 0 HA GLU A 76 -19.509 6.413 -0.303 1.00 0.00 H new ATOM 0 HB2 GLU A 76 -17.240 6.304 1.359 1.00 0.00 H new ATOM 0 HB3 GLU A 76 -17.097 4.907 0.310 1.00 0.00 H new ATOM 0 HG2 GLU A 76 -17.583 7.776 -0.622 1.00 0.00 H new ATOM 0 HG3 GLU A 76 -16.050 6.930 -0.703 1.00 0.00 H new ATOM 1166 N ALA A 77 -19.346 3.380 0.964 1.00 0.00 N ATOM 1167 CA ALA A 77 -19.686 1.989 0.718 1.00 0.00 C ATOM 1168 C ALA A 77 -21.182 1.881 0.415 1.00 0.00 C ATOM 1169 O ALA A 77 -21.577 1.244 -0.561 1.00 0.00 O ATOM 1170 CB ALA A 77 -19.273 1.142 1.923 1.00 0.00 C ATOM 0 H ALA A 77 -18.996 3.574 1.902 1.00 0.00 H new ATOM 0 HA ALA A 77 -19.145 1.609 -0.149 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -19.528 0.098 1.739 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -18.198 1.231 2.079 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -19.798 1.492 2.811 1.00 0.00 H new ATOM 1176 N ALA A 78 -21.974 2.513 1.269 1.00 0.00 N ATOM 1177 CA ALA A 78 -23.417 2.496 1.104 1.00 0.00 C ATOM 1178 C ALA A 78 -23.770 2.938 -0.317 1.00 0.00 C ATOM 1179 O ALA A 78 -24.554 2.282 -0.999 1.00 0.00 O ATOM 1180 CB ALA A 78 -24.064 3.384 2.169 1.00 0.00 C ATOM 0 H ALA A 78 -21.643 3.040 2.077 1.00 0.00 H new ATOM 0 HA ALA A 78 -23.806 1.487 1.241 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -25.147 3.371 2.045 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -23.808 3.009 3.160 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -23.699 4.405 2.062 1.00 0.00 H new ATOM 1186 N GLU A 79 -23.173 4.050 -0.722 1.00 0.00 N ATOM 1187 CA GLU A 79 -23.413 4.589 -2.050 1.00 0.00 C ATOM 1188 C GLU A 79 -22.988 3.578 -3.117 1.00 0.00 C ATOM 1189 O GLU A 79 -23.630 3.465 -4.161 1.00 0.00 O ATOM 1190 CB GLU A 79 -22.691 5.923 -2.240 1.00 0.00 C ATOM 1191 CG GLU A 79 -23.361 6.759 -3.332 1.00 0.00 C ATOM 1192 CD GLU A 79 -24.414 7.696 -2.738 1.00 0.00 C ATOM 1193 OE1 GLU A 79 -25.523 7.195 -2.452 1.00 0.00 O ATOM 1194 OE2 GLU A 79 -24.087 8.893 -2.584 1.00 0.00 O ATOM 0 H GLU A 79 -22.523 4.593 -0.153 1.00 0.00 H new ATOM 0 HA GLU A 79 -24.482 4.775 -2.158 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -22.691 6.477 -1.301 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -21.649 5.742 -2.504 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -22.608 7.342 -3.862 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -23.827 6.100 -4.064 1.00 0.00 H new ATOM 1201 N TRP A 80 -21.909 2.869 -2.819 1.00 0.00 N ATOM 1202 CA TRP A 80 -21.391 1.872 -3.740 1.00 0.00 C ATOM 1203 C TRP A 80 -22.492 0.839 -3.987 1.00 0.00 C ATOM 1204 O TRP A 80 -22.771 0.485 -5.131 1.00 0.00 O ATOM 1205 CB TRP A 80 -20.098 1.253 -3.207 1.00 0.00 C ATOM 1206 CG TRP A 80 -18.996 1.110 -4.259 1.00 0.00 C ATOM 1207 CD1 TRP A 80 -18.575 -0.008 -4.866 1.00 0.00 C ATOM 1208 CD2 TRP A 80 -18.187 2.173 -4.806 1.00 0.00 C ATOM 1209 NE1 TRP A 80 -17.558 0.256 -5.762 1.00 0.00 N ATOM 1210 CE2 TRP A 80 -17.315 1.623 -5.724 1.00 0.00 C ATOM 1211 CE3 TRP A 80 -18.193 3.552 -4.535 1.00 0.00 C ATOM 1212 CZ2 TRP A 80 -16.383 2.381 -6.444 1.00 0.00 C ATOM 1213 CZ3 TRP A 80 -17.255 4.295 -5.263 1.00 0.00 C ATOM 1214 CH2 TRP A 80 -16.370 3.757 -6.190 1.00 0.00 C ATOM 0 H TRP A 80 -21.379 2.965 -1.953 1.00 0.00 H new ATOM 0 HA TRP A 80 -21.123 2.329 -4.693 1.00 0.00 H new ATOM 0 HB2 TRP A 80 -19.725 1.866 -2.386 1.00 0.00 H new ATOM 0 HB3 TRP A 80 -20.322 0.269 -2.794 1.00 0.00 H new ATOM 0 HD1 TRP A 80 -18.980 -0.991 -4.678 1.00 0.00 H new ATOM 0 HE1 TRP A 80 -17.074 -0.427 -6.345 1.00 0.00 H new ATOM 0 HE3 TRP A 80 -18.867 4.003 -3.822 1.00 0.00 H new ATOM 0 HZ2 TRP A 80 -15.710 1.928 -7.157 1.00 0.00 H new ATOM 0 HZ3 TRP A 80 -17.217 5.361 -5.092 1.00 0.00 H new ATOM 0 HH2 TRP A 80 -15.675 4.398 -6.712 1.00 0.00 H new ATOM 1225 N ASP A 81 -23.086 0.383 -2.894 1.00 0.00 N ATOM 1226 CA ASP A 81 -24.151 -0.604 -2.977 1.00 0.00 C ATOM 1227 C ASP A 81 -25.292 -0.045 -3.829 1.00 0.00 C ATOM 1228 O ASP A 81 -25.804 -0.731 -4.713 1.00 0.00 O ATOM 1229 CB ASP A 81 -24.710 -0.928 -1.591 1.00 0.00 C ATOM 1230 CG ASP A 81 -25.584 -2.182 -1.524 1.00 0.00 C ATOM 1231 OD1 ASP A 81 -26.773 -2.065 -1.891 1.00 0.00 O ATOM 1232 OD2 ASP A 81 -25.045 -3.228 -1.105 1.00 0.00 O ATOM 0 H ASP A 81 -22.851 0.678 -1.946 1.00 0.00 H new ATOM 0 HA ASP A 81 -23.738 -1.510 -3.420 1.00 0.00 H new ATOM 0 HB2 ASP A 81 -23.877 -1.046 -0.898 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -25.295 -0.077 -1.243 1.00 0.00 H new ATOM 1237 N ARG A 82 -25.657 1.193 -3.533 1.00 0.00 N ATOM 1238 CA ARG A 82 -26.729 1.851 -4.260 1.00 0.00 C ATOM 1239 C ARG A 82 -26.393 1.922 -5.751 1.00 0.00 C ATOM 1240 O ARG A 82 -27.262 1.719 -6.598 1.00 0.00 O ATOM 1241 CB ARG A 82 -26.966 3.266 -3.731 1.00 0.00 C ATOM 1242 CG ARG A 82 -28.303 3.821 -4.229 1.00 0.00 C ATOM 1243 CD ARG A 82 -28.535 5.241 -3.708 1.00 0.00 C ATOM 1244 NE ARG A 82 -29.960 5.421 -3.348 1.00 0.00 N ATOM 1245 CZ ARG A 82 -30.951 5.542 -4.242 1.00 0.00 C ATOM 1246 NH1 ARG A 82 -30.678 5.502 -5.553 1.00 0.00 N ATOM 1247 NH2 ARG A 82 -32.214 5.703 -3.825 1.00 0.00 N ATOM 0 H ARG A 82 -25.229 1.758 -2.799 1.00 0.00 H new ATOM 0 HA ARG A 82 -27.636 1.264 -4.115 1.00 0.00 H new ATOM 0 HB2 ARG A 82 -26.955 3.257 -2.641 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -26.155 3.919 -4.053 1.00 0.00 H new ATOM 0 HG2 ARG A 82 -28.317 3.823 -5.319 1.00 0.00 H new ATOM 0 HG3 ARG A 82 -29.115 3.172 -3.901 1.00 0.00 H new ATOM 0 HD2 ARG A 82 -27.905 5.425 -2.838 1.00 0.00 H new ATOM 0 HD3 ARG A 82 -28.249 5.968 -4.468 1.00 0.00 H new ATOM 0 HE ARG A 82 -30.202 5.455 -2.358 1.00 0.00 H new ATOM 0 HH11 ARG A 82 -29.716 5.379 -5.870 1.00 0.00 H new ATOM 0 HH12 ARG A 82 -31.432 5.594 -6.234 1.00 0.00 H new ATOM 0 HH21 ARG A 82 -32.422 5.734 -2.827 1.00 0.00 H new ATOM 0 HH22 ARG A 82 -32.968 5.795 -4.506 1.00 0.00 H new ATOM 1545 N SER A 102 -18.920 -2.628 0.920 1.00 0.00 N ATOM 1546 CA SER A 102 -18.993 -3.423 2.134 1.00 0.00 C ATOM 1547 C SER A 102 -17.712 -4.243 2.299 1.00 0.00 C ATOM 1548 O SER A 102 -17.028 -4.134 3.316 1.00 0.00 O ATOM 1549 CB SER A 102 -20.214 -4.344 2.117 1.00 0.00 C ATOM 1550 OG SER A 102 -21.347 -3.741 2.736 1.00 0.00 O ATOM 0 HA SER A 102 -19.095 -2.745 2.981 1.00 0.00 H new ATOM 0 HB2 SER A 102 -20.459 -4.602 1.087 1.00 0.00 H new ATOM 0 HB3 SER A 102 -19.973 -5.275 2.631 1.00 0.00 H new ATOM 0 HG SER A 102 -22.106 -4.360 2.703 1.00 0.00 H new ATOM 1556 N ASP A 103 -17.425 -5.045 1.285 1.00 0.00 N ATOM 1557 CA ASP A 103 -16.239 -5.882 1.305 1.00 0.00 C ATOM 1558 C ASP A 103 -15.005 -5.018 1.039 1.00 0.00 C ATOM 1559 O ASP A 103 -13.923 -5.299 1.553 1.00 0.00 O ATOM 1560 CB ASP A 103 -16.305 -6.958 0.219 1.00 0.00 C ATOM 1561 CG ASP A 103 -17.281 -8.103 0.501 1.00 0.00 C ATOM 1562 OD1 ASP A 103 -17.581 -8.310 1.697 1.00 0.00 O ATOM 1563 OD2 ASP A 103 -17.705 -8.744 -0.484 1.00 0.00 O ATOM 0 H ASP A 103 -17.994 -5.133 0.443 1.00 0.00 H new ATOM 0 HA ASP A 103 -16.181 -6.360 2.283 1.00 0.00 H new ATOM 0 HB2 ASP A 103 -16.585 -6.486 -0.723 1.00 0.00 H new ATOM 0 HB3 ASP A 103 -15.308 -7.376 0.082 1.00 0.00 H new ATOM 1568 N ILE A 104 -15.208 -3.984 0.237 1.00 0.00 N ATOM 1569 CA ILE A 104 -14.125 -3.076 -0.104 1.00 0.00 C ATOM 1570 C ILE A 104 -13.500 -2.530 1.181 1.00 0.00 C ATOM 1571 O ILE A 104 -12.370 -2.043 1.168 1.00 0.00 O ATOM 1572 CB ILE A 104 -14.619 -1.987 -1.059 1.00 0.00 C ATOM 1573 CG1 ILE A 104 -15.138 -2.596 -2.362 1.00 0.00 C ATOM 1574 CG2 ILE A 104 -13.531 -0.941 -1.307 1.00 0.00 C ATOM 1575 CD1 ILE A 104 -15.721 -1.517 -3.277 1.00 0.00 C ATOM 0 H ILE A 104 -16.107 -3.754 -0.187 1.00 0.00 H new ATOM 0 HA ILE A 104 -13.339 -3.606 -0.642 1.00 0.00 H new ATOM 0 HB ILE A 104 -15.457 -1.473 -0.588 1.00 0.00 H new ATOM 0 HG12 ILE A 104 -14.327 -3.113 -2.874 1.00 0.00 H new ATOM 0 HG13 ILE A 104 -15.902 -3.342 -2.140 1.00 0.00 H new ATOM 0 HG21 ILE A 104 -13.908 -0.179 -1.989 1.00 0.00 H new ATOM 0 HG22 ILE A 104 -13.251 -0.476 -0.362 1.00 0.00 H new ATOM 0 HG23 ILE A 104 -12.658 -1.422 -1.747 1.00 0.00 H new ATOM 0 HD11 ILE A 104 -16.083 -1.977 -4.197 1.00 0.00 H new ATOM 0 HD12 ILE A 104 -16.548 -1.018 -2.771 1.00 0.00 H new ATOM 0 HD13 ILE A 104 -14.948 -0.786 -3.516 1.00 0.00 H new ATOM 1587 N ALA A 105 -14.262 -2.629 2.261 1.00 0.00 N ATOM 1588 CA ALA A 105 -13.797 -2.151 3.552 1.00 0.00 C ATOM 1589 C ALA A 105 -12.916 -3.221 4.200 1.00 0.00 C ATOM 1590 O ALA A 105 -12.084 -2.913 5.052 1.00 0.00 O ATOM 1591 CB ALA A 105 -14.999 -1.780 4.423 1.00 0.00 C ATOM 0 H ALA A 105 -15.198 -3.033 2.268 1.00 0.00 H new ATOM 0 HA ALA A 105 -13.191 -1.253 3.433 1.00 0.00 H new ATOM 0 HB1 ALA A 105 -14.650 -1.422 5.391 1.00 0.00 H new ATOM 0 HB2 ALA A 105 -15.576 -0.996 3.932 1.00 0.00 H new ATOM 0 HB3 ALA A 105 -15.629 -2.658 4.567 1.00 0.00 H new ATOM 1597 N GLY A 106 -13.128 -4.457 3.771 1.00 0.00 N ATOM 1598 CA GLY A 106 -12.364 -5.574 4.298 1.00 0.00 C ATOM 1599 C GLY A 106 -12.943 -6.055 5.631 1.00 0.00 C ATOM 1600 O GLY A 106 -12.298 -6.810 6.356 1.00 0.00 O ATOM 0 H GLY A 106 -13.819 -4.709 3.064 1.00 0.00 H new ATOM 0 HA2 GLY A 106 -12.368 -6.393 3.579 1.00 0.00 H new ATOM 0 HA3 GLY A 106 -11.325 -5.276 4.435 1.00 0.00 H new ATOM 1604 N THR A 107 -14.154 -5.597 5.913 1.00 0.00 N ATOM 1605 CA THR A 107 -14.828 -5.970 7.144 1.00 0.00 C ATOM 1606 C THR A 107 -15.240 -7.443 7.101 1.00 0.00 C ATOM 1607 O THR A 107 -15.155 -8.145 8.108 1.00 0.00 O ATOM 1608 CB THR A 107 -16.006 -5.016 7.347 1.00 0.00 C ATOM 1609 OG1 THR A 107 -15.392 -3.749 7.571 1.00 0.00 O ATOM 1610 CG2 THR A 107 -16.769 -5.295 8.644 1.00 0.00 C ATOM 0 H THR A 107 -14.686 -4.970 5.309 1.00 0.00 H new ATOM 0 HA THR A 107 -14.163 -5.875 8.003 1.00 0.00 H new ATOM 0 HB THR A 107 -16.688 -5.096 6.500 1.00 0.00 H new ATOM 0 HG1 THR A 107 -16.085 -3.070 7.711 1.00 0.00 H new ATOM 0 HG21 THR A 107 -17.595 -4.590 8.739 1.00 0.00 H new ATOM 0 HG22 THR A 107 -17.161 -6.312 8.624 1.00 0.00 H new ATOM 0 HG23 THR A 107 -16.096 -5.182 9.494 1.00 0.00 H new ATOM 1618 N THR A 108 -15.677 -7.868 5.925 1.00 0.00 N ATOM 1619 CA THR A 108 -16.103 -9.245 5.738 1.00 0.00 C ATOM 1620 C THR A 108 -15.076 -10.011 4.902 1.00 0.00 C ATOM 1621 O THR A 108 -15.057 -11.241 4.910 1.00 0.00 O ATOM 1622 CB THR A 108 -17.501 -9.227 5.116 1.00 0.00 C ATOM 1623 OG1 THR A 108 -18.356 -8.862 6.196 1.00 0.00 O ATOM 1624 CG2 THR A 108 -17.982 -10.623 4.716 1.00 0.00 C ATOM 0 H THR A 108 -15.745 -7.283 5.092 1.00 0.00 H new ATOM 0 HA THR A 108 -16.162 -9.774 6.689 1.00 0.00 H new ATOM 0 HB THR A 108 -17.500 -8.579 4.240 1.00 0.00 H new ATOM 0 HG1 THR A 108 -19.283 -8.825 5.881 1.00 0.00 H new ATOM 0 HG21 THR A 108 -18.979 -10.553 4.280 1.00 0.00 H new ATOM 0 HG22 THR A 108 -17.295 -11.049 3.985 1.00 0.00 H new ATOM 0 HG23 THR A 108 -18.016 -11.263 5.598 1.00 0.00 H new ATOM 1632 N SER A 109 -14.247 -9.252 4.200 1.00 0.00 N ATOM 1633 CA SER A 109 -13.220 -9.845 3.360 1.00 0.00 C ATOM 1634 C SER A 109 -11.834 -9.526 3.925 1.00 0.00 C ATOM 1635 O SER A 109 -11.683 -8.607 4.728 1.00 0.00 O ATOM 1636 CB SER A 109 -13.332 -9.347 1.917 1.00 0.00 C ATOM 1637 OG SER A 109 -13.161 -7.935 1.826 1.00 0.00 O ATOM 0 H SER A 109 -14.266 -8.232 4.196 1.00 0.00 H new ATOM 0 HA SER A 109 -13.364 -10.925 3.355 1.00 0.00 H new ATOM 0 HB2 SER A 109 -12.581 -9.844 1.303 1.00 0.00 H new ATOM 0 HB3 SER A 109 -14.307 -9.621 1.513 1.00 0.00 H new ATOM 0 HG SER A 109 -14.038 -7.498 1.837 1.00 0.00 H new ATOM 1643 N THR A 110 -10.857 -10.304 3.483 1.00 0.00 N ATOM 1644 CA THR A 110 -9.489 -10.116 3.935 1.00 0.00 C ATOM 1645 C THR A 110 -8.655 -9.442 2.844 1.00 0.00 C ATOM 1646 O THR A 110 -9.151 -9.183 1.750 1.00 0.00 O ATOM 1647 CB THR A 110 -8.941 -11.480 4.363 1.00 0.00 C ATOM 1648 OG1 THR A 110 -8.742 -12.175 3.135 1.00 0.00 O ATOM 1649 CG2 THR A 110 -9.980 -12.322 5.105 1.00 0.00 C ATOM 0 H THR A 110 -10.985 -11.066 2.817 1.00 0.00 H new ATOM 0 HA THR A 110 -9.445 -9.447 4.794 1.00 0.00 H new ATOM 0 HB THR A 110 -8.069 -11.337 5.001 1.00 0.00 H new ATOM 0 HG1 THR A 110 -8.386 -13.069 3.319 1.00 0.00 H new ATOM 0 HG21 THR A 110 -9.540 -13.279 5.386 1.00 0.00 H new ATOM 0 HG22 THR A 110 -10.303 -11.794 6.002 1.00 0.00 H new ATOM 0 HG23 THR A 110 -10.839 -12.494 4.457 1.00 0.00 H new ATOM 1657 N LEU A 111 -7.401 -9.177 3.181 1.00 0.00 N ATOM 1658 CA LEU A 111 -6.493 -8.538 2.243 1.00 0.00 C ATOM 1659 C LEU A 111 -6.392 -9.390 0.977 1.00 0.00 C ATOM 1660 O LEU A 111 -6.312 -8.857 -0.129 1.00 0.00 O ATOM 1661 CB LEU A 111 -5.144 -8.262 2.908 1.00 0.00 C ATOM 1662 CG LEU A 111 -3.945 -8.135 1.966 1.00 0.00 C ATOM 1663 CD1 LEU A 111 -3.871 -6.731 1.359 1.00 0.00 C ATOM 1664 CD2 LEU A 111 -2.645 -8.522 2.675 1.00 0.00 C ATOM 0 H LEU A 111 -6.992 -9.393 4.090 1.00 0.00 H new ATOM 0 HA LEU A 111 -6.879 -7.564 1.942 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -5.227 -7.341 3.484 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -4.940 -9.064 3.617 1.00 0.00 H new ATOM 0 HG LEU A 111 -4.083 -8.836 1.143 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -3.010 -6.667 0.693 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -4.782 -6.530 0.795 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -3.768 -5.995 2.156 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -1.809 -8.423 1.982 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -2.488 -7.865 3.530 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -2.711 -9.555 3.018 1.00 0.00 H new ATOM 1676 N GLN A 112 -6.399 -10.699 1.180 1.00 0.00 N ATOM 1677 CA GLN A 112 -6.308 -11.630 0.068 1.00 0.00 C ATOM 1678 C GLN A 112 -7.498 -11.445 -0.877 1.00 0.00 C ATOM 1679 O GLN A 112 -7.325 -11.375 -2.092 1.00 0.00 O ATOM 1680 CB GLN A 112 -6.224 -13.074 0.567 1.00 0.00 C ATOM 1681 CG GLN A 112 -4.858 -13.685 0.249 1.00 0.00 C ATOM 1682 CD GLN A 112 -4.705 -15.058 0.906 1.00 0.00 C ATOM 1683 OE1 GLN A 112 -5.603 -15.884 0.895 1.00 0.00 O ATOM 1684 NE2 GLN A 112 -3.520 -15.255 1.476 1.00 0.00 N ATOM 0 H GLN A 112 -6.466 -11.137 2.099 1.00 0.00 H new ATOM 0 HA GLN A 112 -5.393 -11.418 -0.485 1.00 0.00 H new ATOM 0 HB2 GLN A 112 -6.397 -13.101 1.643 1.00 0.00 H new ATOM 0 HB3 GLN A 112 -7.010 -13.669 0.102 1.00 0.00 H new ATOM 0 HG2 GLN A 112 -4.740 -13.779 -0.831 1.00 0.00 H new ATOM 0 HG3 GLN A 112 -4.068 -13.020 0.599 1.00 0.00 H new ATOM 0 HE21 GLN A 112 -2.813 -14.521 1.449 1.00 0.00 H new ATOM 0 HE22 GLN A 112 -3.318 -16.140 1.941 1.00 0.00 H new ATOM 1693 N GLU A 113 -8.680 -11.371 -0.281 1.00 0.00 N ATOM 1694 CA GLU A 113 -9.897 -11.195 -1.054 1.00 0.00 C ATOM 1695 C GLU A 113 -9.845 -9.881 -1.837 1.00 0.00 C ATOM 1696 O GLU A 113 -10.292 -9.817 -2.980 1.00 0.00 O ATOM 1697 CB GLU A 113 -11.132 -11.248 -0.152 1.00 0.00 C ATOM 1698 CG GLU A 113 -11.798 -12.624 -0.215 1.00 0.00 C ATOM 1699 CD GLU A 113 -12.208 -13.098 1.181 1.00 0.00 C ATOM 1700 OE1 GLU A 113 -13.029 -12.389 1.803 1.00 0.00 O ATOM 1701 OE2 GLU A 113 -11.694 -14.159 1.594 1.00 0.00 O ATOM 0 H GLU A 113 -8.820 -11.430 0.728 1.00 0.00 H new ATOM 0 HA GLU A 113 -9.973 -12.016 -1.767 1.00 0.00 H new ATOM 0 HB2 GLU A 113 -10.846 -11.025 0.876 1.00 0.00 H new ATOM 0 HB3 GLU A 113 -11.844 -10.481 -0.458 1.00 0.00 H new ATOM 0 HG2 GLU A 113 -12.676 -12.578 -0.860 1.00 0.00 H new ATOM 0 HG3 GLU A 113 -11.112 -13.344 -0.661 1.00 0.00 H new ATOM 1708 N GLN A 114 -9.295 -8.865 -1.188 1.00 0.00 N ATOM 1709 CA GLN A 114 -9.178 -7.556 -1.808 1.00 0.00 C ATOM 1710 C GLN A 114 -8.228 -7.619 -3.005 1.00 0.00 C ATOM 1711 O GLN A 114 -8.500 -7.030 -4.049 1.00 0.00 O ATOM 1712 CB GLN A 114 -8.715 -6.508 -0.794 1.00 0.00 C ATOM 1713 CG GLN A 114 -9.540 -6.588 0.493 1.00 0.00 C ATOM 1714 CD GLN A 114 -10.557 -5.447 0.562 1.00 0.00 C ATOM 1715 OE1 GLN A 114 -10.228 -4.302 0.823 1.00 0.00 O ATOM 1716 NE2 GLN A 114 -11.809 -5.822 0.315 1.00 0.00 N ATOM 0 H GLN A 114 -8.925 -8.922 -0.239 1.00 0.00 H new ATOM 0 HA GLN A 114 -10.163 -7.256 -2.166 1.00 0.00 H new ATOM 0 HB2 GLN A 114 -7.660 -6.660 -0.564 1.00 0.00 H new ATOM 0 HB3 GLN A 114 -8.806 -5.512 -1.227 1.00 0.00 H new ATOM 0 HG2 GLN A 114 -10.058 -7.546 0.538 1.00 0.00 H new ATOM 0 HG3 GLN A 114 -8.878 -6.543 1.358 1.00 0.00 H new ATOM 0 HE21 GLN A 114 -12.017 -6.798 0.103 1.00 0.00 H new ATOM 0 HE22 GLN A 114 -12.561 -5.134 0.338 1.00 0.00 H new ATOM 1725 N ILE A 115 -7.132 -8.338 -2.813 1.00 0.00 N ATOM 1726 CA ILE A 115 -6.139 -8.486 -3.863 1.00 0.00 C ATOM 1727 C ILE A 115 -6.792 -9.129 -5.089 1.00 0.00 C ATOM 1728 O ILE A 115 -6.579 -8.684 -6.216 1.00 0.00 O ATOM 1729 CB ILE A 115 -4.919 -9.250 -3.345 1.00 0.00 C ATOM 1730 CG1 ILE A 115 -3.846 -8.286 -2.835 1.00 0.00 C ATOM 1731 CG2 ILE A 115 -4.374 -10.201 -4.412 1.00 0.00 C ATOM 1732 CD1 ILE A 115 -4.440 -7.274 -1.853 1.00 0.00 C ATOM 0 H ILE A 115 -6.910 -8.825 -1.945 1.00 0.00 H new ATOM 0 HA ILE A 115 -5.766 -7.510 -4.174 1.00 0.00 H new ATOM 0 HB ILE A 115 -5.232 -9.861 -2.499 1.00 0.00 H new ATOM 0 HG12 ILE A 115 -3.050 -8.848 -2.347 1.00 0.00 H new ATOM 0 HG13 ILE A 115 -3.395 -7.760 -3.676 1.00 0.00 H new ATOM 0 HG21 ILE A 115 -3.507 -10.732 -4.018 1.00 0.00 H new ATOM 0 HG22 ILE A 115 -5.146 -10.920 -4.687 1.00 0.00 H new ATOM 0 HG23 ILE A 115 -4.080 -9.630 -5.293 1.00 0.00 H new ATOM 0 HD11 ILE A 115 -3.656 -6.601 -1.506 1.00 0.00 H new ATOM 0 HD12 ILE A 115 -5.219 -6.697 -2.352 1.00 0.00 H new ATOM 0 HD13 ILE A 115 -4.868 -7.802 -1.001 1.00 0.00 H new ATOM 1744 N GLY A 116 -7.574 -10.166 -4.828 1.00 0.00 N ATOM 1745 CA GLY A 116 -8.260 -10.874 -5.894 1.00 0.00 C ATOM 1746 C GLY A 116 -9.237 -9.953 -6.627 1.00 0.00 C ATOM 1747 O GLY A 116 -9.251 -9.908 -7.856 1.00 0.00 O ATOM 0 H GLY A 116 -7.748 -10.533 -3.892 1.00 0.00 H new ATOM 0 HA2 GLY A 116 -7.530 -11.271 -6.600 1.00 0.00 H new ATOM 0 HA3 GLY A 116 -8.799 -11.726 -5.480 1.00 0.00 H new ATOM 1751 N TRP A 117 -10.028 -9.238 -5.840 1.00 0.00 N ATOM 1752 CA TRP A 117 -11.007 -8.320 -6.398 1.00 0.00 C ATOM 1753 C TRP A 117 -10.267 -7.339 -7.311 1.00 0.00 C ATOM 1754 O TRP A 117 -10.789 -6.940 -8.351 1.00 0.00 O ATOM 1755 CB TRP A 117 -11.798 -7.623 -5.290 1.00 0.00 C ATOM 1756 CG TRP A 117 -13.115 -8.316 -4.936 1.00 0.00 C ATOM 1757 CD1 TRP A 117 -14.032 -8.820 -5.773 1.00 0.00 C ATOM 1758 CD2 TRP A 117 -13.629 -8.562 -3.610 1.00 0.00 C ATOM 1759 NE1 TRP A 117 -15.095 -9.371 -5.086 1.00 0.00 N ATOM 1760 CE2 TRP A 117 -14.842 -9.210 -3.729 1.00 0.00 C ATOM 1761 CE3 TRP A 117 -13.086 -8.248 -2.352 1.00 0.00 C ATOM 1762 CZ2 TRP A 117 -15.614 -9.598 -2.627 1.00 0.00 C ATOM 1763 CZ3 TRP A 117 -13.870 -8.643 -1.262 1.00 0.00 C ATOM 1764 CH2 TRP A 117 -15.094 -9.295 -1.364 1.00 0.00 C ATOM 0 H TRP A 117 -10.011 -9.276 -4.821 1.00 0.00 H new ATOM 0 HA TRP A 117 -11.747 -8.858 -6.990 1.00 0.00 H new ATOM 0 HB2 TRP A 117 -11.178 -7.566 -4.396 1.00 0.00 H new ATOM 0 HB3 TRP A 117 -12.009 -6.599 -5.598 1.00 0.00 H new ATOM 0 HD1 TRP A 117 -13.950 -8.798 -6.850 1.00 0.00 H new ATOM 0 HE1 TRP A 117 -15.915 -9.815 -5.499 1.00 0.00 H new ATOM 0 HE3 TRP A 117 -12.139 -7.742 -2.236 1.00 0.00 H new ATOM 0 HZ2 TRP A 117 -16.561 -10.104 -2.746 1.00 0.00 H new ATOM 0 HZ3 TRP A 117 -13.498 -8.426 -0.272 1.00 0.00 H new ATOM 0 HH2 TRP A 117 -15.640 -9.566 -0.473 1.00 0.00 H new ATOM 1775 N MET A 118 -9.063 -6.980 -6.890 1.00 0.00 N ATOM 1776 CA MET A 118 -8.247 -6.054 -7.656 1.00 0.00 C ATOM 1777 C MET A 118 -7.843 -6.664 -9.000 1.00 0.00 C ATOM 1778 O MET A 118 -7.844 -5.978 -10.022 1.00 0.00 O ATOM 1779 CB MET A 118 -6.991 -5.699 -6.858 1.00 0.00 C ATOM 1780 CG MET A 118 -7.036 -4.246 -6.382 1.00 0.00 C ATOM 1781 SD MET A 118 -6.561 -4.151 -4.664 1.00 0.00 S ATOM 1782 CE MET A 118 -5.534 -2.692 -4.706 1.00 0.00 C ATOM 0 H MET A 118 -8.633 -7.314 -6.028 1.00 0.00 H new ATOM 0 HA MET A 118 -8.832 -5.155 -7.847 1.00 0.00 H new ATOM 0 HB2 MET A 118 -6.902 -6.364 -5.999 1.00 0.00 H new ATOM 0 HB3 MET A 118 -6.107 -5.856 -7.476 1.00 0.00 H new ATOM 0 HG2 MET A 118 -6.366 -3.636 -6.987 1.00 0.00 H new ATOM 0 HG3 MET A 118 -8.040 -3.843 -6.513 1.00 0.00 H new ATOM 0 HE1 MET A 118 -5.385 -2.323 -3.691 1.00 0.00 H new ATOM 0 HE2 MET A 118 -4.569 -2.939 -5.148 1.00 0.00 H new ATOM 0 HE3 MET A 118 -6.020 -1.922 -5.305 1.00 0.00 H new ATOM 1792 N THR A 119 -7.508 -7.945 -8.956 1.00 0.00 N ATOM 1793 CA THR A 119 -7.102 -8.653 -10.157 1.00 0.00 C ATOM 1794 C THR A 119 -8.265 -9.481 -10.707 1.00 0.00 C ATOM 1795 O THR A 119 -8.055 -10.446 -11.440 1.00 0.00 O ATOM 1796 CB THR A 119 -5.868 -9.492 -9.819 1.00 0.00 C ATOM 1797 OG1 THR A 119 -4.857 -8.526 -9.545 1.00 0.00 O ATOM 1798 CG2 THR A 119 -5.331 -10.259 -11.028 1.00 0.00 C ATOM 0 H THR A 119 -7.510 -8.511 -8.107 1.00 0.00 H new ATOM 0 HA THR A 119 -6.833 -7.958 -10.952 1.00 0.00 H new ATOM 0 HB THR A 119 -6.115 -10.195 -9.024 1.00 0.00 H new ATOM 0 HG1 THR A 119 -4.021 -8.983 -9.315 1.00 0.00 H new ATOM 0 HG21 THR A 119 -4.456 -10.838 -10.732 1.00 0.00 H new ATOM 0 HG22 THR A 119 -6.101 -10.933 -11.403 1.00 0.00 H new ATOM 0 HG23 THR A 119 -5.052 -9.554 -11.812 1.00 0.00 H new ATOM 1806 N HIS A 120 -9.469 -9.072 -10.332 1.00 0.00 N ATOM 1807 CA HIS A 120 -10.667 -9.763 -10.777 1.00 0.00 C ATOM 1808 C HIS A 120 -11.075 -9.244 -12.158 1.00 0.00 C ATOM 1809 O HIS A 120 -10.516 -8.263 -12.646 1.00 0.00 O ATOM 1810 CB HIS A 120 -11.786 -9.635 -9.742 1.00 0.00 C ATOM 1811 CG HIS A 120 -12.896 -10.646 -9.908 1.00 0.00 C ATOM 1812 ND1 HIS A 120 -14.104 -10.340 -10.511 1.00 0.00 N ATOM 1813 CD2 HIS A 120 -12.967 -11.958 -9.546 1.00 0.00 C ATOM 1814 CE1 HIS A 120 -14.861 -11.428 -10.506 1.00 0.00 C ATOM 1815 NE2 HIS A 120 -14.155 -12.429 -9.907 1.00 0.00 N ATOM 0 H HIS A 120 -9.640 -8.270 -9.725 1.00 0.00 H new ATOM 0 HA HIS A 120 -10.461 -10.829 -10.873 1.00 0.00 H new ATOM 0 HB2 HIS A 120 -11.358 -9.741 -8.745 1.00 0.00 H new ATOM 0 HB3 HIS A 120 -12.210 -8.633 -9.802 1.00 0.00 H new ATOM 0 HD2 HIS A 120 -12.189 -12.519 -9.050 1.00 0.00 H new ATOM 0 HE1 HIS A 120 -15.861 -11.508 -10.906 1.00 0.00 H new ATOM 0 HE2 HIS A 120 -14.485 -13.383 -9.760 1.00 0.00 H new ATOM 1824 N ASN A 121 -12.047 -9.926 -12.747 1.00 0.00 N ATOM 1825 CA ASN A 121 -12.537 -9.546 -14.062 1.00 0.00 C ATOM 1826 C ASN A 121 -14.048 -9.319 -13.992 1.00 0.00 C ATOM 1827 O ASN A 121 -14.819 -10.273 -13.919 1.00 0.00 O ATOM 1828 CB ASN A 121 -12.271 -10.650 -15.089 1.00 0.00 C ATOM 1829 CG ASN A 121 -10.845 -10.558 -15.636 1.00 0.00 C ATOM 1830 OD1 ASN A 121 -10.384 -9.514 -16.066 1.00 0.00 O ATOM 1831 ND2 ASN A 121 -10.176 -11.706 -15.594 1.00 0.00 N ATOM 0 H ASN A 121 -12.508 -10.739 -12.338 1.00 0.00 H new ATOM 0 HA ASN A 121 -12.017 -8.638 -14.366 1.00 0.00 H new ATOM 0 HB2 ASN A 121 -12.425 -11.625 -14.628 1.00 0.00 H new ATOM 0 HB3 ASN A 121 -12.985 -10.569 -15.909 1.00 0.00 H new ATOM 0 HD21 ASN A 121 -9.216 -11.749 -15.935 1.00 0.00 H new ATOM 0 HD22 ASN A 121 -10.623 -12.543 -15.221 1.00 0.00 H new ATOM 1838 N PRO A 122 -14.434 -8.015 -14.018 1.00 0.00 N ATOM 1839 CA PRO A 122 -13.454 -6.945 -14.105 1.00 0.00 C ATOM 1840 C PRO A 122 -12.742 -6.743 -12.767 1.00 0.00 C ATOM 1841 O PRO A 122 -13.211 -7.215 -11.732 1.00 0.00 O ATOM 1842 CB PRO A 122 -14.244 -5.724 -14.548 1.00 0.00 C ATOM 1843 CG PRO A 122 -15.700 -6.036 -14.244 1.00 0.00 C ATOM 1844 CD PRO A 122 -15.808 -7.527 -13.964 1.00 0.00 C ATOM 0 HA PRO A 122 -12.654 -7.164 -14.812 1.00 0.00 H new ATOM 0 HB2 PRO A 122 -13.916 -4.832 -14.014 1.00 0.00 H new ATOM 0 HB3 PRO A 122 -14.100 -5.530 -15.611 1.00 0.00 H new ATOM 0 HG2 PRO A 122 -16.042 -5.460 -13.384 1.00 0.00 H new ATOM 0 HG3 PRO A 122 -16.334 -5.759 -15.086 1.00 0.00 H new ATOM 0 HD2 PRO A 122 -16.257 -7.715 -12.989 1.00 0.00 H new ATOM 0 HD3 PRO A 122 -16.434 -8.025 -14.705 1.00 0.00 H new ATOM 1852 N PRO A 123 -11.590 -6.024 -12.832 1.00 0.00 N ATOM 1853 CA PRO A 123 -10.807 -5.755 -11.637 1.00 0.00 C ATOM 1854 C PRO A 123 -11.471 -4.677 -10.779 1.00 0.00 C ATOM 1855 O PRO A 123 -11.626 -3.537 -11.216 1.00 0.00 O ATOM 1856 CB PRO A 123 -9.436 -5.343 -12.150 1.00 0.00 C ATOM 1857 CG PRO A 123 -9.635 -4.950 -13.605 1.00 0.00 C ATOM 1858 CD PRO A 123 -11.003 -5.451 -14.040 1.00 0.00 C ATOM 0 HA PRO A 123 -10.729 -6.622 -10.981 1.00 0.00 H new ATOM 0 HB2 PRO A 123 -9.037 -4.510 -11.572 1.00 0.00 H new ATOM 0 HB3 PRO A 123 -8.723 -6.163 -12.061 1.00 0.00 H new ATOM 0 HG2 PRO A 123 -9.570 -3.868 -13.721 1.00 0.00 H new ATOM 0 HG3 PRO A 123 -8.853 -5.385 -14.228 1.00 0.00 H new ATOM 0 HD2 PRO A 123 -11.616 -4.639 -14.431 1.00 0.00 H new ATOM 0 HD3 PRO A 123 -10.919 -6.196 -14.831 1.00 0.00 H new ATOM 1866 N ILE A 124 -11.847 -5.075 -9.572 1.00 0.00 N ATOM 1867 CA ILE A 124 -12.491 -4.157 -8.648 1.00 0.00 C ATOM 1868 C ILE A 124 -11.436 -3.241 -8.026 1.00 0.00 C ATOM 1869 O ILE A 124 -10.471 -3.716 -7.429 1.00 0.00 O ATOM 1870 CB ILE A 124 -13.321 -4.928 -7.619 1.00 0.00 C ATOM 1871 CG1 ILE A 124 -14.534 -5.589 -8.276 1.00 0.00 C ATOM 1872 CG2 ILE A 124 -13.722 -4.025 -6.451 1.00 0.00 C ATOM 1873 CD1 ILE A 124 -14.278 -7.076 -8.529 1.00 0.00 C ATOM 0 H ILE A 124 -11.718 -6.021 -9.213 1.00 0.00 H new ATOM 0 HA ILE A 124 -13.196 -3.516 -9.177 1.00 0.00 H new ATOM 0 HB ILE A 124 -12.702 -5.727 -7.211 1.00 0.00 H new ATOM 0 HG12 ILE A 124 -15.408 -5.471 -7.636 1.00 0.00 H new ATOM 0 HG13 ILE A 124 -14.759 -5.090 -9.218 1.00 0.00 H new ATOM 0 HG21 ILE A 124 -14.311 -4.597 -5.734 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -12.826 -3.643 -5.962 1.00 0.00 H new ATOM 0 HG23 ILE A 124 -14.315 -3.190 -6.824 1.00 0.00 H new ATOM 0 HD11 ILE A 124 -15.156 -7.522 -8.997 1.00 0.00 H new ATOM 0 HD12 ILE A 124 -13.418 -7.190 -9.189 1.00 0.00 H new ATOM 0 HD13 ILE A 124 -14.078 -7.577 -7.582 1.00 0.00 H new ATOM 1885 N PRO A 125 -11.660 -1.910 -8.191 1.00 0.00 N ATOM 1886 CA PRO A 125 -10.740 -0.923 -7.654 1.00 0.00 C ATOM 1887 C PRO A 125 -10.897 -0.796 -6.137 1.00 0.00 C ATOM 1888 O PRO A 125 -11.023 0.309 -5.613 1.00 0.00 O ATOM 1889 CB PRO A 125 -11.066 0.363 -8.394 1.00 0.00 C ATOM 1890 CG PRO A 125 -12.454 0.168 -8.980 1.00 0.00 C ATOM 1891 CD PRO A 125 -12.792 -1.311 -8.893 1.00 0.00 C ATOM 0 HA PRO A 125 -9.696 -1.198 -7.802 1.00 0.00 H new ATOM 0 HB2 PRO A 125 -11.044 1.218 -7.719 1.00 0.00 H new ATOM 0 HB3 PRO A 125 -10.335 0.558 -9.179 1.00 0.00 H new ATOM 0 HG2 PRO A 125 -13.187 0.760 -8.432 1.00 0.00 H new ATOM 0 HG3 PRO A 125 -12.482 0.506 -10.016 1.00 0.00 H new ATOM 0 HD2 PRO A 125 -13.724 -1.473 -8.352 1.00 0.00 H new ATOM 0 HD3 PRO A 125 -12.919 -1.747 -9.884 1.00 0.00 H new ATOM 1899 N VAL A 126 -10.884 -1.943 -5.475 1.00 0.00 N ATOM 1900 CA VAL A 126 -11.024 -1.974 -4.028 1.00 0.00 C ATOM 1901 C VAL A 126 -10.042 -0.981 -3.404 1.00 0.00 C ATOM 1902 O VAL A 126 -10.343 -0.361 -2.386 1.00 0.00 O ATOM 1903 CB VAL A 126 -10.838 -3.404 -3.515 1.00 0.00 C ATOM 1904 CG1 VAL A 126 -9.530 -4.006 -4.034 1.00 0.00 C ATOM 1905 CG2 VAL A 126 -10.894 -3.449 -1.987 1.00 0.00 C ATOM 0 H VAL A 126 -10.779 -2.858 -5.913 1.00 0.00 H new ATOM 0 HA VAL A 126 -12.027 -1.666 -3.734 1.00 0.00 H new ATOM 0 HB VAL A 126 -11.660 -4.008 -3.898 1.00 0.00 H new ATOM 0 HG11 VAL A 126 -9.422 -5.022 -3.655 1.00 0.00 H new ATOM 0 HG12 VAL A 126 -9.545 -4.025 -5.124 1.00 0.00 H new ATOM 0 HG13 VAL A 126 -8.690 -3.400 -3.693 1.00 0.00 H new ATOM 0 HG21 VAL A 126 -10.759 -4.476 -1.648 1.00 0.00 H new ATOM 0 HG22 VAL A 126 -10.101 -2.824 -1.575 1.00 0.00 H new ATOM 0 HG23 VAL A 126 -11.861 -3.079 -1.647 1.00 0.00 H new ATOM 1915 N GLY A 127 -8.886 -0.862 -4.041 1.00 0.00 N ATOM 1916 CA GLY A 127 -7.857 0.044 -3.560 1.00 0.00 C ATOM 1917 C GLY A 127 -8.258 1.503 -3.796 1.00 0.00 C ATOM 1918 O GLY A 127 -8.607 2.213 -2.854 1.00 0.00 O ATOM 0 H GLY A 127 -8.640 -1.378 -4.886 1.00 0.00 H new ATOM 0 HA2 GLY A 127 -7.688 -0.123 -2.496 1.00 0.00 H new ATOM 0 HA3 GLY A 127 -6.916 -0.165 -4.069 1.00 0.00 H new ATOM 1922 N GLU A 128 -8.194 1.905 -5.056 1.00 0.00 N ATOM 1923 CA GLU A 128 -8.545 3.265 -5.426 1.00 0.00 C ATOM 1924 C GLU A 128 -9.828 3.695 -4.710 1.00 0.00 C ATOM 1925 O GLU A 128 -9.975 4.859 -4.341 1.00 0.00 O ATOM 1926 CB GLU A 128 -8.693 3.399 -6.943 1.00 0.00 C ATOM 1927 CG GLU A 128 -7.365 3.120 -7.651 1.00 0.00 C ATOM 1928 CD GLU A 128 -7.187 4.035 -8.863 1.00 0.00 C ATOM 1929 OE1 GLU A 128 -8.090 4.013 -9.729 1.00 0.00 O ATOM 1930 OE2 GLU A 128 -6.153 4.736 -8.899 1.00 0.00 O ATOM 0 H GLU A 128 -7.904 1.313 -5.834 1.00 0.00 H new ATOM 0 HA GLU A 128 -7.737 3.927 -5.113 1.00 0.00 H new ATOM 0 HB2 GLU A 128 -9.453 2.704 -7.301 1.00 0.00 H new ATOM 0 HB3 GLU A 128 -9.037 4.403 -7.191 1.00 0.00 H new ATOM 0 HG2 GLU A 128 -6.540 3.268 -6.955 1.00 0.00 H new ATOM 0 HG3 GLU A 128 -7.330 2.078 -7.969 1.00 0.00 H new ATOM 1937 N ILE A 129 -10.721 2.733 -4.536 1.00 0.00 N ATOM 1938 CA ILE A 129 -11.985 2.997 -3.871 1.00 0.00 C ATOM 1939 C ILE A 129 -11.719 3.394 -2.417 1.00 0.00 C ATOM 1940 O ILE A 129 -11.987 4.527 -2.020 1.00 0.00 O ATOM 1941 CB ILE A 129 -12.930 1.803 -4.019 1.00 0.00 C ATOM 1942 CG1 ILE A 129 -13.289 1.567 -5.487 1.00 0.00 C ATOM 1943 CG2 ILE A 129 -14.173 1.975 -3.145 1.00 0.00 C ATOM 1944 CD1 ILE A 129 -13.592 0.090 -5.747 1.00 0.00 C ATOM 0 H ILE A 129 -10.594 1.769 -4.844 1.00 0.00 H new ATOM 0 HA ILE A 129 -12.494 3.837 -4.343 1.00 0.00 H new ATOM 0 HB ILE A 129 -12.411 0.911 -3.667 1.00 0.00 H new ATOM 0 HG12 ILE A 129 -14.155 2.172 -5.755 1.00 0.00 H new ATOM 0 HG13 ILE A 129 -12.465 1.890 -6.123 1.00 0.00 H new ATOM 0 HG21 ILE A 129 -14.828 1.112 -3.269 1.00 0.00 H new ATOM 0 HG22 ILE A 129 -13.874 2.056 -2.100 1.00 0.00 H new ATOM 0 HG23 ILE A 129 -14.704 2.879 -3.442 1.00 0.00 H new ATOM 0 HD11 ILE A 129 -13.844 -0.050 -6.798 1.00 0.00 H new ATOM 0 HD12 ILE A 129 -12.716 -0.510 -5.501 1.00 0.00 H new ATOM 0 HD13 ILE A 129 -14.432 -0.224 -5.127 1.00 0.00 H new ATOM 1956 N TYR A 130 -11.196 2.438 -1.663 1.00 0.00 N ATOM 1957 CA TYR A 130 -10.890 2.674 -0.262 1.00 0.00 C ATOM 1958 C TYR A 130 -10.099 3.971 -0.083 1.00 0.00 C ATOM 1959 O TYR A 130 -10.360 4.740 0.840 1.00 0.00 O ATOM 1960 CB TYR A 130 -10.022 1.496 0.184 1.00 0.00 C ATOM 1961 CG TYR A 130 -10.179 1.131 1.662 1.00 0.00 C ATOM 1962 CD1 TYR A 130 -11.438 0.973 2.204 1.00 0.00 C ATOM 1963 CD2 TYR A 130 -9.061 0.960 2.452 1.00 0.00 C ATOM 1964 CE1 TYR A 130 -11.585 0.630 3.594 1.00 0.00 C ATOM 1965 CE2 TYR A 130 -9.208 0.617 3.844 1.00 0.00 C ATOM 1966 CZ TYR A 130 -10.463 0.469 4.346 1.00 0.00 C ATOM 1967 OH TYR A 130 -10.602 0.145 5.659 1.00 0.00 O ATOM 0 H TYR A 130 -10.977 1.499 -1.996 1.00 0.00 H new ATOM 0 HA TYR A 130 -11.807 2.763 0.321 1.00 0.00 H new ATOM 0 HB2 TYR A 130 -10.270 0.625 -0.423 1.00 0.00 H new ATOM 0 HB3 TYR A 130 -8.976 1.734 -0.012 1.00 0.00 H new ATOM 0 HD1 TYR A 130 -12.313 1.107 1.585 1.00 0.00 H new ATOM 0 HD2 TYR A 130 -8.076 1.083 2.027 1.00 0.00 H new ATOM 0 HE1 TYR A 130 -12.565 0.503 4.030 1.00 0.00 H new ATOM 0 HE2 TYR A 130 -8.341 0.481 4.474 1.00 0.00 H new ATOM 0 HH TYR A 130 -9.717 0.061 6.071 1.00 0.00 H new ATOM 1977 N LYS A 131 -9.146 4.174 -0.983 1.00 0.00 N ATOM 1978 CA LYS A 131 -8.315 5.365 -0.936 1.00 0.00 C ATOM 1979 C LYS A 131 -9.206 6.606 -1.019 1.00 0.00 C ATOM 1980 O LYS A 131 -9.021 7.559 -0.262 1.00 0.00 O ATOM 1981 CB LYS A 131 -7.237 5.308 -2.020 1.00 0.00 C ATOM 1982 CG LYS A 131 -6.469 6.629 -2.100 1.00 0.00 C ATOM 1983 CD LYS A 131 -5.856 6.825 -3.488 1.00 0.00 C ATOM 1984 CE LYS A 131 -5.922 8.292 -3.915 1.00 0.00 C ATOM 1985 NZ LYS A 131 -7.124 8.537 -4.744 1.00 0.00 N ATOM 0 H LYS A 131 -8.932 3.534 -1.748 1.00 0.00 H new ATOM 0 HA LYS A 131 -7.779 5.420 0.012 1.00 0.00 H new ATOM 0 HB2 LYS A 131 -6.545 4.493 -1.807 1.00 0.00 H new ATOM 0 HB3 LYS A 131 -7.697 5.092 -2.984 1.00 0.00 H new ATOM 0 HG2 LYS A 131 -7.140 7.458 -1.875 1.00 0.00 H new ATOM 0 HG3 LYS A 131 -5.682 6.642 -1.346 1.00 0.00 H new ATOM 0 HD2 LYS A 131 -4.818 6.491 -3.482 1.00 0.00 H new ATOM 0 HD3 LYS A 131 -6.385 6.207 -4.214 1.00 0.00 H new ATOM 0 HE2 LYS A 131 -5.944 8.933 -3.034 1.00 0.00 H new ATOM 0 HE3 LYS A 131 -5.026 8.554 -4.477 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 -7.154 9.538 -5.025 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 -7.087 7.939 -5.594 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 -7.977 8.306 -4.195 1.00 0.00 H new ATOM 1999 N ARG A 132 -10.152 6.556 -1.944 1.00 0.00 N ATOM 2000 CA ARG A 132 -11.072 7.665 -2.135 1.00 0.00 C ATOM 2001 C ARG A 132 -12.001 7.798 -0.926 1.00 0.00 C ATOM 2002 O ARG A 132 -12.373 8.907 -0.545 1.00 0.00 O ATOM 2003 CB ARG A 132 -11.913 7.471 -3.398 1.00 0.00 C ATOM 2004 CG ARG A 132 -11.806 8.688 -4.320 1.00 0.00 C ATOM 2005 CD ARG A 132 -13.188 9.269 -4.623 1.00 0.00 C ATOM 2006 NE ARG A 132 -13.084 10.296 -5.684 1.00 0.00 N ATOM 2007 CZ ARG A 132 -12.575 11.521 -5.496 1.00 0.00 C ATOM 2008 NH1 ARG A 132 -12.119 11.879 -4.289 1.00 0.00 N ATOM 2009 NH2 ARG A 132 -12.519 12.388 -6.517 1.00 0.00 N ATOM 0 H ARG A 132 -10.302 5.765 -2.570 1.00 0.00 H new ATOM 0 HA ARG A 132 -10.479 8.573 -2.243 1.00 0.00 H new ATOM 0 HB2 ARG A 132 -11.580 6.579 -3.928 1.00 0.00 H new ATOM 0 HB3 ARG A 132 -12.955 7.308 -3.124 1.00 0.00 H new ATOM 0 HG2 ARG A 132 -11.182 9.449 -3.852 1.00 0.00 H new ATOM 0 HG3 ARG A 132 -11.316 8.402 -5.251 1.00 0.00 H new ATOM 0 HD2 ARG A 132 -13.864 8.475 -4.939 1.00 0.00 H new ATOM 0 HD3 ARG A 132 -13.613 9.708 -3.720 1.00 0.00 H new ATOM 0 HE ARG A 132 -13.421 10.056 -6.616 1.00 0.00 H new ATOM 0 HH11 ARG A 132 -12.159 11.219 -3.512 1.00 0.00 H new ATOM 0 HH12 ARG A 132 -11.732 12.812 -4.146 1.00 0.00 H new ATOM 0 HH21 ARG A 132 -12.864 12.115 -7.437 1.00 0.00 H new ATOM 0 HH22 ARG A 132 -12.131 13.321 -6.374 1.00 0.00 H new ATOM 2023 N TRP A 133 -12.348 6.653 -0.359 1.00 0.00 N ATOM 2024 CA TRP A 133 -13.227 6.628 0.798 1.00 0.00 C ATOM 2025 C TRP A 133 -12.522 7.359 1.943 1.00 0.00 C ATOM 2026 O TRP A 133 -12.969 8.421 2.374 1.00 0.00 O ATOM 2027 CB TRP A 133 -13.621 5.194 1.157 1.00 0.00 C ATOM 2028 CG TRP A 133 -14.545 4.528 0.136 1.00 0.00 C ATOM 2029 CD1 TRP A 133 -14.862 4.957 -1.093 1.00 0.00 C ATOM 2030 CD2 TRP A 133 -15.264 3.288 0.308 1.00 0.00 C ATOM 2031 NE1 TRP A 133 -15.730 4.088 -1.724 1.00 0.00 N ATOM 2032 CE2 TRP A 133 -15.982 3.041 -0.845 1.00 0.00 C ATOM 2033 CE3 TRP A 133 -15.306 2.404 1.400 1.00 0.00 C ATOM 2034 CZ2 TRP A 133 -16.794 1.913 -1.016 1.00 0.00 C ATOM 2035 CZ3 TRP A 133 -16.123 1.282 1.214 1.00 0.00 C ATOM 2036 CH2 TRP A 133 -16.851 1.019 0.060 1.00 0.00 C ATOM 0 H TRP A 133 -12.037 5.736 -0.679 1.00 0.00 H new ATOM 0 HA TRP A 133 -14.164 7.141 0.582 1.00 0.00 H new ATOM 0 HB2 TRP A 133 -12.716 4.594 1.258 1.00 0.00 H new ATOM 0 HB3 TRP A 133 -14.113 5.196 2.130 1.00 0.00 H new ATOM 0 HD1 TRP A 133 -14.486 5.868 -1.535 1.00 0.00 H new ATOM 0 HE1 TRP A 133 -16.115 4.195 -2.662 1.00 0.00 H new ATOM 0 HE3 TRP A 133 -14.752 2.577 2.311 1.00 0.00 H new ATOM 0 HZ2 TRP A 133 -17.346 1.742 -1.928 1.00 0.00 H new ATOM 0 HZ3 TRP A 133 -16.192 0.571 2.024 1.00 0.00 H new ATOM 0 HH2 TRP A 133 -17.458 0.128 -0.007 1.00 0.00 H new ATOM 2047 N ILE A 134 -11.433 6.761 2.403 1.00 0.00 N ATOM 2048 CA ILE A 134 -10.663 7.342 3.489 1.00 0.00 C ATOM 2049 C ILE A 134 -10.479 8.840 3.234 1.00 0.00 C ATOM 2050 O ILE A 134 -10.705 9.657 4.125 1.00 0.00 O ATOM 2051 CB ILE A 134 -9.347 6.584 3.678 1.00 0.00 C ATOM 2052 CG1 ILE A 134 -9.576 5.268 4.422 1.00 0.00 C ATOM 2053 CG2 ILE A 134 -8.304 7.462 4.371 1.00 0.00 C ATOM 2054 CD1 ILE A 134 -8.276 4.468 4.533 1.00 0.00 C ATOM 0 H ILE A 134 -11.066 5.880 2.043 1.00 0.00 H new ATOM 0 HA ILE A 134 -11.200 7.243 4.432 1.00 0.00 H new ATOM 0 HB ILE A 134 -8.952 6.332 2.694 1.00 0.00 H new ATOM 0 HG12 ILE A 134 -9.968 5.473 5.418 1.00 0.00 H new ATOM 0 HG13 ILE A 134 -10.328 4.677 3.899 1.00 0.00 H new ATOM 0 HG21 ILE A 134 -7.378 6.900 4.493 1.00 0.00 H new ATOM 0 HG22 ILE A 134 -8.113 8.348 3.765 1.00 0.00 H new ATOM 0 HG23 ILE A 134 -8.676 7.765 5.350 1.00 0.00 H new ATOM 0 HD11 ILE A 134 -8.466 3.537 5.066 1.00 0.00 H new ATOM 0 HD12 ILE A 134 -7.900 4.244 3.535 1.00 0.00 H new ATOM 0 HD13 ILE A 134 -7.534 5.053 5.077 1.00 0.00 H new ATOM 2066 N ILE A 135 -10.070 9.153 2.013 1.00 0.00 N ATOM 2067 CA ILE A 135 -9.853 10.538 1.630 1.00 0.00 C ATOM 2068 C ILE A 135 -11.166 11.312 1.765 1.00 0.00 C ATOM 2069 O ILE A 135 -11.163 12.489 2.121 1.00 0.00 O ATOM 2070 CB ILE A 135 -9.233 10.617 0.233 1.00 0.00 C ATOM 2071 CG1 ILE A 135 -7.707 10.685 0.314 1.00 0.00 C ATOM 2072 CG2 ILE A 135 -9.818 11.785 -0.561 1.00 0.00 C ATOM 2073 CD1 ILE A 135 -7.156 9.580 1.219 1.00 0.00 C ATOM 0 H ILE A 135 -9.883 8.472 1.277 1.00 0.00 H new ATOM 0 HA ILE A 135 -9.134 11.010 2.300 1.00 0.00 H new ATOM 0 HB ILE A 135 -9.486 9.704 -0.306 1.00 0.00 H new ATOM 0 HG12 ILE A 135 -7.282 10.588 -0.685 1.00 0.00 H new ATOM 0 HG13 ILE A 135 -7.403 11.659 0.697 1.00 0.00 H new ATOM 0 HG21 ILE A 135 -9.360 11.818 -1.550 1.00 0.00 H new ATOM 0 HG22 ILE A 135 -10.895 11.652 -0.664 1.00 0.00 H new ATOM 0 HG23 ILE A 135 -9.616 12.719 -0.036 1.00 0.00 H new ATOM 0 HD11 ILE A 135 -6.069 9.651 1.259 1.00 0.00 H new ATOM 0 HD12 ILE A 135 -7.565 9.695 2.223 1.00 0.00 H new ATOM 0 HD13 ILE A 135 -7.442 8.607 0.820 1.00 0.00 H new ATOM 2085 N LEU A 136 -12.257 10.619 1.472 1.00 0.00 N ATOM 2086 CA LEU A 136 -13.574 11.226 1.556 1.00 0.00 C ATOM 2087 C LEU A 136 -13.816 11.715 2.986 1.00 0.00 C ATOM 2088 O LEU A 136 -14.260 12.843 3.194 1.00 0.00 O ATOM 2089 CB LEU A 136 -14.644 10.258 1.048 1.00 0.00 C ATOM 2090 CG LEU A 136 -15.632 10.825 0.027 1.00 0.00 C ATOM 2091 CD1 LEU A 136 -15.986 9.780 -1.033 1.00 0.00 C ATOM 2092 CD2 LEU A 136 -16.878 11.381 0.720 1.00 0.00 C ATOM 0 H LEU A 136 -12.255 9.643 1.176 1.00 0.00 H new ATOM 0 HA LEU A 136 -13.633 12.099 0.906 1.00 0.00 H new ATOM 0 HB2 LEU A 136 -14.145 9.398 0.602 1.00 0.00 H new ATOM 0 HB3 LEU A 136 -15.209 9.890 1.905 1.00 0.00 H new ATOM 0 HG LEU A 136 -15.151 11.656 -0.488 1.00 0.00 H new ATOM 0 HD11 LEU A 136 -16.690 10.209 -1.746 1.00 0.00 H new ATOM 0 HD12 LEU A 136 -15.081 9.472 -1.557 1.00 0.00 H new ATOM 0 HD13 LEU A 136 -16.440 8.913 -0.552 1.00 0.00 H new ATOM 0 HD21 LEU A 136 -17.564 11.778 -0.028 1.00 0.00 H new ATOM 0 HD22 LEU A 136 -17.370 10.584 1.277 1.00 0.00 H new ATOM 0 HD23 LEU A 136 -16.588 12.178 1.405 1.00 0.00 H new ATOM 2104 N GLY A 137 -13.512 10.841 3.934 1.00 0.00 N ATOM 2105 CA GLY A 137 -13.690 11.170 5.339 1.00 0.00 C ATOM 2106 C GLY A 137 -12.762 12.312 5.757 1.00 0.00 C ATOM 2107 O GLY A 137 -13.204 13.283 6.371 1.00 0.00 O ATOM 0 H GLY A 137 -13.144 9.906 3.758 1.00 0.00 H new ATOM 0 HA2 GLY A 137 -14.727 11.454 5.521 1.00 0.00 H new ATOM 0 HA3 GLY A 137 -13.488 10.290 5.950 1.00 0.00 H new ATOM 2111 N LEU A 138 -11.493 12.159 5.408 1.00 0.00 N ATOM 2112 CA LEU A 138 -10.500 13.166 5.740 1.00 0.00 C ATOM 2113 C LEU A 138 -10.985 14.534 5.256 1.00 0.00 C ATOM 2114 O LEU A 138 -10.966 15.505 6.011 1.00 0.00 O ATOM 2115 CB LEU A 138 -9.129 12.769 5.186 1.00 0.00 C ATOM 2116 CG LEU A 138 -8.342 11.749 6.013 1.00 0.00 C ATOM 2117 CD1 LEU A 138 -7.033 11.373 5.317 1.00 0.00 C ATOM 2118 CD2 LEU A 138 -8.111 12.258 7.436 1.00 0.00 C ATOM 0 H LEU A 138 -11.130 11.353 4.899 1.00 0.00 H new ATOM 0 HA LEU A 138 -10.375 13.236 6.821 1.00 0.00 H new ATOM 0 HB2 LEU A 138 -9.267 12.365 4.183 1.00 0.00 H new ATOM 0 HB3 LEU A 138 -8.524 13.670 5.086 1.00 0.00 H new ATOM 0 HG LEU A 138 -8.937 10.839 6.091 1.00 0.00 H new ATOM 0 HD11 LEU A 138 -6.493 10.647 5.925 1.00 0.00 H new ATOM 0 HD12 LEU A 138 -7.251 10.938 4.342 1.00 0.00 H new ATOM 0 HD13 LEU A 138 -6.420 12.265 5.188 1.00 0.00 H new ATOM 0 HD21 LEU A 138 -7.550 11.514 8.002 1.00 0.00 H new ATOM 0 HD22 LEU A 138 -7.547 13.190 7.402 1.00 0.00 H new ATOM 0 HD23 LEU A 138 -9.072 12.433 7.920 1.00 0.00 H new ATOM 2130 N ASN A 139 -11.408 14.566 4.001 1.00 0.00 N ATOM 2131 CA ASN A 139 -11.898 15.800 3.408 1.00 0.00 C ATOM 2132 C ASN A 139 -13.124 16.282 4.185 1.00 0.00 C ATOM 2133 O ASN A 139 -13.226 17.460 4.522 1.00 0.00 O ATOM 2134 CB ASN A 139 -12.315 15.583 1.952 1.00 0.00 C ATOM 2135 CG ASN A 139 -12.022 16.825 1.107 1.00 0.00 C ATOM 2136 OD1 ASN A 139 -12.299 17.948 1.492 1.00 0.00 O ATOM 2137 ND2 ASN A 139 -11.448 16.559 -0.063 1.00 0.00 N ATOM 0 H ASN A 139 -11.422 13.758 3.378 1.00 0.00 H new ATOM 0 HA ASN A 139 -11.095 16.536 3.447 1.00 0.00 H new ATOM 0 HB2 ASN A 139 -11.782 14.725 1.541 1.00 0.00 H new ATOM 0 HB3 ASN A 139 -13.379 15.350 1.905 1.00 0.00 H new ATOM 0 HD21 ASN A 139 -11.212 17.320 -0.700 1.00 0.00 H new ATOM 0 HD22 ASN A 139 -11.243 15.594 -0.323 1.00 0.00 H new ATOM 2144 N LYS A 140 -14.024 15.346 4.446 1.00 0.00 N ATOM 2145 CA LYS A 140 -15.240 15.661 5.177 1.00 0.00 C ATOM 2146 C LYS A 140 -14.873 16.282 6.527 1.00 0.00 C ATOM 2147 O LYS A 140 -15.564 17.177 7.011 1.00 0.00 O ATOM 2148 CB LYS A 140 -16.132 14.424 5.293 1.00 0.00 C ATOM 2149 CG LYS A 140 -17.192 14.407 4.188 1.00 0.00 C ATOM 2150 CD LYS A 140 -18.296 15.427 4.474 1.00 0.00 C ATOM 2151 CE LYS A 140 -19.110 15.721 3.211 1.00 0.00 C ATOM 2152 NZ LYS A 140 -19.219 17.181 2.994 1.00 0.00 N ATOM 0 H LYS A 140 -13.936 14.370 4.165 1.00 0.00 H new ATOM 0 HA LYS A 140 -15.829 16.401 4.634 1.00 0.00 H new ATOM 0 HB2 LYS A 140 -15.521 13.523 5.230 1.00 0.00 H new ATOM 0 HB3 LYS A 140 -16.618 14.412 6.269 1.00 0.00 H new ATOM 0 HG2 LYS A 140 -16.726 14.629 3.228 1.00 0.00 H new ATOM 0 HG3 LYS A 140 -17.625 13.410 4.109 1.00 0.00 H new ATOM 0 HD2 LYS A 140 -18.954 15.047 5.255 1.00 0.00 H new ATOM 0 HD3 LYS A 140 -17.855 16.350 4.850 1.00 0.00 H new ATOM 0 HE2 LYS A 140 -18.636 15.253 2.348 1.00 0.00 H new ATOM 0 HE3 LYS A 140 -20.105 15.286 3.303 1.00 0.00 H new ATOM 0 HZ1 LYS A 140 -20.122 17.396 2.524 1.00 0.00 H new ATOM 0 HZ2 LYS A 140 -19.180 17.672 3.910 1.00 0.00 H new ATOM 0 HZ3 LYS A 140 -18.432 17.503 2.395 1.00 0.00 H new ATOM 2166 N ILE A 141 -13.787 15.781 7.096 1.00 0.00 N ATOM 2167 CA ILE A 141 -13.319 16.276 8.380 1.00 0.00 C ATOM 2168 C ILE A 141 -12.723 17.672 8.198 1.00 0.00 C ATOM 2169 O ILE A 141 -13.044 18.592 8.948 1.00 0.00 O ATOM 2170 CB ILE A 141 -12.356 15.275 9.021 1.00 0.00 C ATOM 2171 CG1 ILE A 141 -13.085 13.991 9.423 1.00 0.00 C ATOM 2172 CG2 ILE A 141 -11.614 15.906 10.201 1.00 0.00 C ATOM 2173 CD1 ILE A 141 -12.133 12.794 9.417 1.00 0.00 C ATOM 0 H ILE A 141 -13.217 15.038 6.692 1.00 0.00 H new ATOM 0 HA ILE A 141 -14.152 16.374 9.077 1.00 0.00 H new ATOM 0 HB ILE A 141 -11.607 15.000 8.279 1.00 0.00 H new ATOM 0 HG12 ILE A 141 -13.518 14.110 10.416 1.00 0.00 H new ATOM 0 HG13 ILE A 141 -13.910 13.807 8.735 1.00 0.00 H new ATOM 0 HG21 ILE A 141 -10.936 15.173 10.638 1.00 0.00 H new ATOM 0 HG22 ILE A 141 -11.043 16.767 9.853 1.00 0.00 H new ATOM 0 HG23 ILE A 141 -12.334 16.228 10.953 1.00 0.00 H new ATOM 0 HD11 ILE A 141 -12.677 11.895 9.706 1.00 0.00 H new ATOM 0 HD12 ILE A 141 -11.720 12.662 8.417 1.00 0.00 H new ATOM 0 HD13 ILE A 141 -11.322 12.971 10.124 1.00 0.00 H new ATOM 2185 N VAL A 142 -11.864 17.789 7.195 1.00 0.00 N ATOM 2186 CA VAL A 142 -11.220 19.058 6.904 1.00 0.00 C ATOM 2187 C VAL A 142 -12.290 20.120 6.644 1.00 0.00 C ATOM 2188 O VAL A 142 -12.111 21.285 6.994 1.00 0.00 O ATOM 2189 CB VAL A 142 -10.244 18.895 5.738 1.00 0.00 C ATOM 2190 CG1 VAL A 142 -10.064 20.214 4.984 1.00 0.00 C ATOM 2191 CG2 VAL A 142 -8.898 18.351 6.220 1.00 0.00 C ATOM 0 H VAL A 142 -11.599 17.025 6.574 1.00 0.00 H new ATOM 0 HA VAL A 142 -10.631 19.392 7.758 1.00 0.00 H new ATOM 0 HB VAL A 142 -10.670 18.169 5.045 1.00 0.00 H new ATOM 0 HG11 VAL A 142 -9.365 20.070 4.160 1.00 0.00 H new ATOM 0 HG12 VAL A 142 -11.026 20.542 4.591 1.00 0.00 H new ATOM 0 HG13 VAL A 142 -9.672 20.971 5.663 1.00 0.00 H new ATOM 0 HG21 VAL A 142 -8.223 18.245 5.371 1.00 0.00 H new ATOM 0 HG22 VAL A 142 -8.465 19.041 6.944 1.00 0.00 H new ATOM 0 HG23 VAL A 142 -9.046 17.379 6.690 1.00 0.00 H new ATOM 2201 N ARG A 143 -13.380 19.680 6.032 1.00 0.00 N ATOM 2202 CA ARG A 143 -14.478 20.578 5.720 1.00 0.00 C ATOM 2203 C ARG A 143 -15.177 21.027 7.005 1.00 0.00 C ATOM 2204 O ARG A 143 -15.408 22.218 7.207 1.00 0.00 O ATOM 2205 CB ARG A 143 -15.499 19.902 4.802 1.00 0.00 C ATOM 2206 CG ARG A 143 -15.087 20.033 3.335 1.00 0.00 C ATOM 2207 CD ARG A 143 -16.114 19.369 2.415 1.00 0.00 C ATOM 2208 NE ARG A 143 -16.696 20.374 1.499 1.00 0.00 N ATOM 2209 CZ ARG A 143 -17.459 20.072 0.439 1.00 0.00 C ATOM 2210 NH1 ARG A 143 -17.739 18.791 0.159 1.00 0.00 N ATOM 2211 NH2 ARG A 143 -17.945 21.049 -0.338 1.00 0.00 N ATOM 0 H ARG A 143 -13.526 18.712 5.744 1.00 0.00 H new ATOM 0 HA ARG A 143 -14.062 21.445 5.206 1.00 0.00 H new ATOM 0 HB2 ARG A 143 -15.589 18.848 5.066 1.00 0.00 H new ATOM 0 HB3 ARG A 143 -16.481 20.352 4.950 1.00 0.00 H new ATOM 0 HG2 ARG A 143 -14.988 21.087 3.074 1.00 0.00 H new ATOM 0 HG3 ARG A 143 -14.110 19.574 3.186 1.00 0.00 H new ATOM 0 HD2 ARG A 143 -15.640 18.573 1.841 1.00 0.00 H new ATOM 0 HD3 ARG A 143 -16.902 18.907 3.009 1.00 0.00 H new ATOM 0 HE ARG A 143 -16.505 21.358 1.686 1.00 0.00 H new ATOM 0 HH11 ARG A 143 -17.372 18.047 0.752 1.00 0.00 H new ATOM 0 HH12 ARG A 143 -18.320 18.560 -0.647 1.00 0.00 H new ATOM 0 HH21 ARG A 143 -17.735 22.024 -0.123 1.00 0.00 H new ATOM 0 HH22 ARG A 143 -18.525 20.818 -1.144 1.00 0.00 H new ATOM 2225 N MET A 144 -15.494 20.049 7.841 1.00 0.00 N ATOM 2226 CA MET A 144 -16.163 20.328 9.101 1.00 0.00 C ATOM 2227 C MET A 144 -15.318 21.259 9.975 1.00 0.00 C ATOM 2228 O MET A 144 -15.833 22.222 10.538 1.00 0.00 O ATOM 2229 CB MET A 144 -16.413 19.016 9.847 1.00 0.00 C ATOM 2230 CG MET A 144 -17.273 19.249 11.092 1.00 0.00 C ATOM 2231 SD MET A 144 -17.004 17.939 12.274 1.00 0.00 S ATOM 2232 CE MET A 144 -15.371 18.371 12.851 1.00 0.00 C ATOM 0 H MET A 144 -15.300 19.062 7.671 1.00 0.00 H new ATOM 0 HA MET A 144 -17.111 20.821 8.887 1.00 0.00 H new ATOM 0 HB2 MET A 144 -16.909 18.306 9.185 1.00 0.00 H new ATOM 0 HB3 MET A 144 -15.461 18.571 10.136 1.00 0.00 H new ATOM 0 HG2 MET A 144 -17.025 20.211 11.540 1.00 0.00 H new ATOM 0 HG3 MET A 144 -18.326 19.289 10.814 1.00 0.00 H new ATOM 0 HE1 MET A 144 -15.189 17.897 13.815 1.00 0.00 H new ATOM 0 HE2 MET A 144 -14.628 18.027 12.131 1.00 0.00 H new ATOM 0 HE3 MET A 144 -15.298 19.453 12.959 1.00 0.00 H new ATOM 2242 N TYR A 145 -14.036 20.937 10.059 1.00 0.00 N ATOM 2243 CA TYR A 145 -13.116 21.732 10.854 1.00 0.00 C ATOM 2244 C TYR A 145 -13.212 23.214 10.485 1.00 0.00 C ATOM 2245 O TYR A 145 -13.313 24.070 11.362 1.00 0.00 O ATOM 2246 CB TYR A 145 -11.714 21.224 10.511 1.00 0.00 C ATOM 2247 CG TYR A 145 -11.126 20.269 11.552 1.00 0.00 C ATOM 2248 CD1 TYR A 145 -11.701 19.030 11.755 1.00 0.00 C ATOM 2249 CD2 TYR A 145 -10.022 20.645 12.289 1.00 0.00 C ATOM 2250 CE1 TYR A 145 -11.148 18.131 12.734 1.00 0.00 C ATOM 2251 CE2 TYR A 145 -9.469 19.747 13.269 1.00 0.00 C ATOM 2252 CZ TYR A 145 -10.060 18.534 13.444 1.00 0.00 C ATOM 2253 OH TYR A 145 -9.538 17.685 14.369 1.00 0.00 O ATOM 0 H TYR A 145 -13.613 20.136 9.590 1.00 0.00 H new ATOM 0 HA TYR A 145 -13.347 21.638 11.915 1.00 0.00 H new ATOM 0 HB2 TYR A 145 -11.748 20.717 9.547 1.00 0.00 H new ATOM 0 HB3 TYR A 145 -11.047 22.078 10.399 1.00 0.00 H new ATOM 0 HD1 TYR A 145 -12.566 18.735 11.179 1.00 0.00 H new ATOM 0 HD2 TYR A 145 -9.572 21.614 12.131 1.00 0.00 H new ATOM 0 HE1 TYR A 145 -11.587 17.159 12.901 1.00 0.00 H new ATOM 0 HE2 TYR A 145 -8.605 20.030 13.852 1.00 0.00 H new ATOM 0 HH TYR A 145 -8.763 18.105 14.798 1.00 0.00 H new