USER MOD reduce.3.24.130724 H: found=0, std=0, add=962, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 963 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 31 MET CE :methyl -149:sc= -0.251 (180deg=-1.03) USER MOD Set 1.2: A 32 MET CE :methyl 161:sc= -0.15 (180deg=-0.578) USER MOD Single : A 9 THR OG1 : rot 180:sc= 0 USER MOD Single : A 11 SER OG : rot 180:sc= -0.0462 USER MOD Single : A 17 GLN : amide:sc= -0.384 X(o=-0.38,f=-0.049) USER MOD Single : A 24 THR OG1 : rot 112:sc= 1.22 USER MOD Single : A 25 TYR OH : rot 180:sc= 0 USER MOD Single : A 39 TYR OH : rot 180:sc= 0 USER MOD Single : A 42 MET CE :methyl -134:sc= -5.94! (180deg=-6.95!) USER MOD Single : A 46 CYS SG : rot 180:sc= 0.135 USER MOD Single : A 49 TYR OH : rot -127:sc= 0.0116 USER MOD Single : A 50 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 53 TYR OH : rot 180:sc= 0 USER MOD Single : A 55 HIS : no HE2:sc= -2.3! C(o=-2.3!,f=-5.3!) USER MOD Single : A 56 TYR OH : rot 180:sc= 0 USER MOD Single : A 57 TYR OH : rot 180:sc= 0 USER MOD Single : A 60 SER OG : rot -25:sc= 0.141 USER MOD Single : A 65 TYR OH : rot -158:sc= 0.322 USER MOD Single : A 66 MET CE :methyl 174:sc= -1.61 (180deg=-1.65) USER MOD Single : A 79 ASN :FLIP amide:sc= -0.118 F(o=-4.7!,f=-0.12) USER MOD Single : A 81 ASN : amide:sc= -6.62! C(o=-6.6!,f=-8.5!) USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 97 THR OG1 : rot 180:sc= 0 USER MOD Single : A 103 GLN : amide:sc= -4.38! C(o=-4.4!,f=-7.1!) USER MOD Single : A 121 TYR OH : rot 180:sc= -0.0491 USER MOD Single : A 122 HIS : no HD1:sc= -0.178 X(o=-0.18,f=0) USER MOD Single : A 131 HIS : no HD1:sc= -2.65 K(o=-2.6,f=-6.1!) USER MOD Single : A 138 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 95 N PRO A 7 0.774 5.169 18.025 1.00 0.00 N ATOM 96 CA PRO A 7 2.211 5.141 17.708 1.00 0.00 C ATOM 97 C PRO A 7 2.499 5.542 16.266 1.00 0.00 C ATOM 98 O PRO A 7 1.857 6.437 15.719 1.00 0.00 O ATOM 99 CB PRO A 7 2.601 3.676 17.941 1.00 0.00 C ATOM 100 CG PRO A 7 1.559 3.143 18.861 1.00 0.00 C ATOM 101 CD PRO A 7 0.292 3.855 18.488 1.00 0.00 C ATOM 0 HA PRO A 7 2.772 5.849 18.317 1.00 0.00 H new ATOM 0 HB2 PRO A 7 2.623 3.119 17.004 1.00 0.00 H new ATOM 0 HB3 PRO A 7 3.595 3.597 18.382 1.00 0.00 H new ATOM 0 HG2 PRO A 7 1.451 2.064 18.748 1.00 0.00 H new ATOM 0 HG3 PRO A 7 1.822 3.330 19.902 1.00 0.00 H new ATOM 0 HD2 PRO A 7 -0.253 3.326 17.706 1.00 0.00 H new ATOM 0 HD3 PRO A 7 -0.383 3.950 19.338 1.00 0.00 H new ATOM 109 N VAL A 8 3.487 4.877 15.676 1.00 0.00 N ATOM 110 CA VAL A 8 3.902 5.123 14.291 1.00 0.00 C ATOM 111 C VAL A 8 2.774 5.721 13.453 1.00 0.00 C ATOM 112 O VAL A 8 1.637 5.249 13.490 1.00 0.00 O ATOM 113 CB VAL A 8 4.380 3.824 13.617 1.00 0.00 C ATOM 114 CG1 VAL A 8 4.714 4.068 12.152 1.00 0.00 C ATOM 115 CG2 VAL A 8 5.578 3.248 14.356 1.00 0.00 C ATOM 0 H VAL A 8 4.027 4.149 16.143 1.00 0.00 H new ATOM 0 HA VAL A 8 4.723 5.839 14.340 1.00 0.00 H new ATOM 0 HB VAL A 8 3.570 3.097 13.662 1.00 0.00 H new ATOM 0 HG11 VAL A 8 5.050 3.137 11.695 1.00 0.00 H new ATOM 0 HG12 VAL A 8 3.827 4.428 11.632 1.00 0.00 H new ATOM 0 HG13 VAL A 8 5.505 4.814 12.079 1.00 0.00 H new ATOM 0 HG21 VAL A 8 5.902 2.330 13.865 1.00 0.00 H new ATOM 0 HG22 VAL A 8 6.393 3.971 14.347 1.00 0.00 H new ATOM 0 HG23 VAL A 8 5.299 3.029 15.387 1.00 0.00 H new ATOM 125 N THR A 9 3.105 6.756 12.686 1.00 0.00 N ATOM 126 CA THR A 9 2.131 7.427 11.839 1.00 0.00 C ATOM 127 C THR A 9 2.758 7.842 10.517 1.00 0.00 C ATOM 128 O THR A 9 3.942 8.176 10.458 1.00 0.00 O ATOM 129 CB THR A 9 1.545 8.677 12.525 1.00 0.00 C ATOM 130 OG1 THR A 9 2.601 9.510 13.014 1.00 0.00 O ATOM 131 CG2 THR A 9 0.626 8.286 13.672 1.00 0.00 C ATOM 0 H THR A 9 4.045 7.148 12.636 1.00 0.00 H new ATOM 0 HA THR A 9 1.327 6.714 11.658 1.00 0.00 H new ATOM 0 HB THR A 9 0.962 9.228 11.787 1.00 0.00 H new ATOM 0 HG1 THR A 9 2.219 10.302 13.447 1.00 0.00 H new ATOM 0 HG21 THR A 9 0.225 9.185 14.140 1.00 0.00 H new ATOM 0 HG22 THR A 9 -0.195 7.679 13.290 1.00 0.00 H new ATOM 0 HG23 THR A 9 1.188 7.713 14.409 1.00 0.00 H new ATOM 139 N ALA A 10 1.960 7.819 9.457 1.00 0.00 N ATOM 140 CA ALA A 10 2.443 8.192 8.136 1.00 0.00 C ATOM 141 C ALA A 10 2.390 9.703 7.940 1.00 0.00 C ATOM 142 O ALA A 10 1.945 10.438 8.822 1.00 0.00 O ATOM 143 CB ALA A 10 1.633 7.489 7.058 1.00 0.00 C ATOM 0 H ALA A 10 0.978 7.546 9.487 1.00 0.00 H new ATOM 0 HA ALA A 10 3.483 7.877 8.055 1.00 0.00 H new ATOM 0 HB1 ALA A 10 2.006 7.778 6.076 1.00 0.00 H new ATOM 0 HB2 ALA A 10 1.726 6.410 7.178 1.00 0.00 H new ATOM 0 HB3 ALA A 10 0.585 7.774 7.146 1.00 0.00 H new ATOM 149 N SER A 11 2.847 10.159 6.780 1.00 0.00 N ATOM 150 CA SER A 11 2.854 11.584 6.466 1.00 0.00 C ATOM 151 C SER A 11 2.983 11.806 4.964 1.00 0.00 C ATOM 152 O SER A 11 3.396 10.912 4.231 1.00 0.00 O ATOM 153 CB SER A 11 4.001 12.282 7.198 1.00 0.00 C ATOM 154 OG SER A 11 4.010 13.673 6.925 1.00 0.00 O ATOM 0 H SER A 11 3.218 9.563 6.040 1.00 0.00 H new ATOM 0 HA SER A 11 1.908 12.011 6.799 1.00 0.00 H new ATOM 0 HB2 SER A 11 3.904 12.120 8.271 1.00 0.00 H new ATOM 0 HB3 SER A 11 4.951 11.843 6.894 1.00 0.00 H new ATOM 0 HG SER A 11 4.752 14.096 7.406 1.00 0.00 H new ATOM 160 N LEU A 12 2.626 13.002 4.509 1.00 0.00 N ATOM 161 CA LEU A 12 2.711 13.328 3.092 1.00 0.00 C ATOM 162 C LEU A 12 4.079 13.905 2.747 1.00 0.00 C ATOM 163 O LEU A 12 4.484 14.937 3.281 1.00 0.00 O ATOM 164 CB LEU A 12 1.609 14.314 2.703 1.00 0.00 C ATOM 165 CG LEU A 12 1.418 14.506 1.197 1.00 0.00 C ATOM 166 CD1 LEU A 12 1.185 13.165 0.515 1.00 0.00 C ATOM 167 CD2 LEU A 12 0.259 15.452 0.927 1.00 0.00 C ATOM 0 H LEU A 12 2.277 13.758 5.098 1.00 0.00 H new ATOM 0 HA LEU A 12 2.575 12.407 2.525 1.00 0.00 H new ATOM 0 HB2 LEU A 12 0.668 13.972 3.133 1.00 0.00 H new ATOM 0 HB3 LEU A 12 1.832 15.282 3.152 1.00 0.00 H new ATOM 0 HG LEU A 12 2.326 14.947 0.785 1.00 0.00 H new ATOM 0 HD11 LEU A 12 1.051 13.320 -0.556 1.00 0.00 H new ATOM 0 HD12 LEU A 12 2.045 12.517 0.683 1.00 0.00 H new ATOM 0 HD13 LEU A 12 0.292 12.697 0.928 1.00 0.00 H new ATOM 0 HD21 LEU A 12 0.136 15.579 -0.149 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -0.656 15.037 1.351 1.00 0.00 H new ATOM 0 HD23 LEU A 12 0.465 16.420 1.385 1.00 0.00 H new ATOM 179 N VAL A 13 4.788 13.226 1.849 1.00 0.00 N ATOM 180 CA VAL A 13 6.115 13.660 1.429 1.00 0.00 C ATOM 181 C VAL A 13 6.029 14.819 0.440 1.00 0.00 C ATOM 182 O VAL A 13 5.017 14.992 -0.238 1.00 0.00 O ATOM 183 CB VAL A 13 6.900 12.503 0.781 1.00 0.00 C ATOM 184 CG1 VAL A 13 8.371 12.863 0.643 1.00 0.00 C ATOM 185 CG2 VAL A 13 6.731 11.227 1.591 1.00 0.00 C ATOM 0 H VAL A 13 4.463 12.371 1.398 1.00 0.00 H new ATOM 0 HA VAL A 13 6.640 13.992 2.325 1.00 0.00 H new ATOM 0 HB VAL A 13 6.498 12.331 -0.218 1.00 0.00 H new ATOM 0 HG11 VAL A 13 8.907 12.033 0.183 1.00 0.00 H new ATOM 0 HG12 VAL A 13 8.471 13.750 0.018 1.00 0.00 H new ATOM 0 HG13 VAL A 13 8.790 13.064 1.629 1.00 0.00 H new ATOM 0 HG21 VAL A 13 7.292 10.420 1.120 1.00 0.00 H new ATOM 0 HG22 VAL A 13 7.105 11.386 2.603 1.00 0.00 H new ATOM 0 HG23 VAL A 13 5.675 10.959 1.632 1.00 0.00 H new ATOM 195 N ALA A 14 7.096 15.611 0.367 1.00 0.00 N ATOM 196 CA ALA A 14 7.145 16.749 -0.545 1.00 0.00 C ATOM 197 C ALA A 14 6.857 16.310 -1.976 1.00 0.00 C ATOM 198 O ALA A 14 6.897 15.121 -2.287 1.00 0.00 O ATOM 199 CB ALA A 14 8.499 17.437 -0.463 1.00 0.00 C ATOM 0 H ALA A 14 7.938 15.485 0.929 1.00 0.00 H new ATOM 0 HA ALA A 14 6.375 17.459 -0.245 1.00 0.00 H new ATOM 0 HB1 ALA A 14 8.519 18.284 -1.149 1.00 0.00 H new ATOM 0 HB2 ALA A 14 8.666 17.791 0.554 1.00 0.00 H new ATOM 0 HB3 ALA A 14 9.283 16.731 -0.735 1.00 0.00 H new ATOM 205 N GLU A 15 6.573 17.273 -2.844 1.00 0.00 N ATOM 206 CA GLU A 15 6.273 16.977 -4.240 1.00 0.00 C ATOM 207 C GLU A 15 7.549 16.814 -5.060 1.00 0.00 C ATOM 208 O GLU A 15 7.559 16.111 -6.072 1.00 0.00 O ATOM 209 CB GLU A 15 5.403 18.084 -4.838 1.00 0.00 C ATOM 210 CG GLU A 15 6.035 19.464 -4.761 1.00 0.00 C ATOM 211 CD GLU A 15 5.085 20.565 -5.190 1.00 0.00 C ATOM 212 OE1 GLU A 15 4.345 21.078 -4.326 1.00 0.00 O ATOM 213 OE2 GLU A 15 5.082 20.912 -6.389 1.00 0.00 O ATOM 0 H GLU A 15 6.544 18.265 -2.607 1.00 0.00 H new ATOM 0 HA GLU A 15 5.728 16.034 -4.273 1.00 0.00 H new ATOM 0 HB2 GLU A 15 5.194 17.847 -5.881 1.00 0.00 H new ATOM 0 HB3 GLU A 15 4.445 18.103 -4.318 1.00 0.00 H new ATOM 0 HG2 GLU A 15 6.365 19.652 -3.739 1.00 0.00 H new ATOM 0 HG3 GLU A 15 6.923 19.489 -5.393 1.00 0.00 H new ATOM 220 N ALA A 16 8.622 17.466 -4.624 1.00 0.00 N ATOM 221 CA ALA A 16 9.899 17.388 -5.325 1.00 0.00 C ATOM 222 C ALA A 16 10.817 16.341 -4.702 1.00 0.00 C ATOM 223 O ALA A 16 11.908 16.082 -5.209 1.00 0.00 O ATOM 224 CB ALA A 16 10.578 18.749 -5.331 1.00 0.00 C ATOM 0 H ALA A 16 8.633 18.053 -3.790 1.00 0.00 H new ATOM 0 HA ALA A 16 9.698 17.084 -6.352 1.00 0.00 H new ATOM 0 HB1 ALA A 16 11.530 18.678 -5.857 1.00 0.00 H new ATOM 0 HB2 ALA A 16 9.938 19.473 -5.835 1.00 0.00 H new ATOM 0 HB3 ALA A 16 10.753 19.073 -4.305 1.00 0.00 H new ATOM 230 N GLN A 17 10.368 15.735 -3.606 1.00 0.00 N ATOM 231 CA GLN A 17 11.160 14.721 -2.917 1.00 0.00 C ATOM 232 C GLN A 17 10.470 13.360 -2.948 1.00 0.00 C ATOM 233 O GLN A 17 11.106 12.329 -2.731 1.00 0.00 O ATOM 234 CB GLN A 17 11.406 15.140 -1.466 1.00 0.00 C ATOM 235 CG GLN A 17 12.145 16.459 -1.333 1.00 0.00 C ATOM 236 CD GLN A 17 13.562 16.388 -1.869 1.00 0.00 C ATOM 237 OE1 GLN A 17 14.506 16.119 -1.127 1.00 0.00 O ATOM 238 NE2 GLN A 17 13.714 16.618 -3.167 1.00 0.00 N ATOM 0 H GLN A 17 9.463 15.928 -3.177 1.00 0.00 H new ATOM 0 HA GLN A 17 12.113 14.633 -3.438 1.00 0.00 H new ATOM 0 HB2 GLN A 17 10.448 15.216 -0.951 1.00 0.00 H new ATOM 0 HB3 GLN A 17 11.978 14.360 -0.963 1.00 0.00 H new ATOM 0 HG2 GLN A 17 11.596 17.235 -1.867 1.00 0.00 H new ATOM 0 HG3 GLN A 17 12.171 16.753 -0.284 1.00 0.00 H new ATOM 0 HE21 GLN A 17 12.902 16.838 -3.744 1.00 0.00 H new ATOM 0 HE22 GLN A 17 14.642 16.575 -3.587 1.00 0.00 H new ATOM 247 N ARG A 18 9.169 13.365 -3.216 1.00 0.00 N ATOM 248 CA ARG A 18 8.397 12.129 -3.264 1.00 0.00 C ATOM 249 C ARG A 18 8.854 11.229 -4.409 1.00 0.00 C ATOM 250 O ARG A 18 8.697 10.009 -4.349 1.00 0.00 O ATOM 251 CB ARG A 18 6.904 12.439 -3.401 1.00 0.00 C ATOM 252 CG ARG A 18 6.549 13.194 -4.671 1.00 0.00 C ATOM 253 CD ARG A 18 5.070 13.548 -4.711 1.00 0.00 C ATOM 254 NE ARG A 18 4.220 12.361 -4.710 1.00 0.00 N ATOM 255 CZ ARG A 18 3.004 12.325 -5.244 1.00 0.00 C ATOM 256 NH1 ARG A 18 2.495 13.407 -5.820 1.00 0.00 N ATOM 257 NH2 ARG A 18 2.293 11.206 -5.203 1.00 0.00 N ATOM 0 H ARG A 18 8.628 14.209 -3.403 1.00 0.00 H new ATOM 0 HA ARG A 18 8.567 11.595 -2.329 1.00 0.00 H new ATOM 0 HB2 ARG A 18 6.344 11.504 -3.377 1.00 0.00 H new ATOM 0 HB3 ARG A 18 6.583 13.025 -2.539 1.00 0.00 H new ATOM 0 HG2 ARG A 18 7.145 14.105 -4.733 1.00 0.00 H new ATOM 0 HG3 ARG A 18 6.803 12.587 -5.540 1.00 0.00 H new ATOM 0 HD2 ARG A 18 4.823 14.170 -3.851 1.00 0.00 H new ATOM 0 HD3 ARG A 18 4.864 14.140 -5.603 1.00 0.00 H new ATOM 0 HE ARG A 18 4.580 11.512 -4.275 1.00 0.00 H new ATOM 0 HH11 ARG A 18 3.038 14.270 -5.854 1.00 0.00 H new ATOM 0 HH12 ARG A 18 1.561 13.376 -6.229 1.00 0.00 H new ATOM 0 HH21 ARG A 18 2.680 10.372 -4.761 1.00 0.00 H new ATOM 0 HH22 ARG A 18 1.360 11.180 -5.613 1.00 0.00 H new ATOM 271 N LEU A 19 9.425 11.831 -5.449 1.00 0.00 N ATOM 272 CA LEU A 19 9.895 11.067 -6.598 1.00 0.00 C ATOM 273 C LEU A 19 11.227 10.379 -6.304 1.00 0.00 C ATOM 274 O LEU A 19 11.636 9.469 -7.025 1.00 0.00 O ATOM 275 CB LEU A 19 10.001 11.948 -7.857 1.00 0.00 C ATOM 276 CG LEU A 19 10.738 13.297 -7.734 1.00 0.00 C ATOM 277 CD1 LEU A 19 9.869 14.330 -7.037 1.00 0.00 C ATOM 278 CD2 LEU A 19 12.073 13.148 -7.020 1.00 0.00 C ATOM 0 H LEU A 19 9.572 12.838 -5.519 1.00 0.00 H new ATOM 0 HA LEU A 19 9.153 10.292 -6.794 1.00 0.00 H new ATOM 0 HB2 LEU A 19 10.498 11.365 -8.632 1.00 0.00 H new ATOM 0 HB3 LEU A 19 8.990 12.150 -8.210 1.00 0.00 H new ATOM 0 HG LEU A 19 10.944 13.646 -8.746 1.00 0.00 H new ATOM 0 HD11 LEU A 19 10.412 15.272 -6.963 1.00 0.00 H new ATOM 0 HD12 LEU A 19 8.954 14.482 -7.610 1.00 0.00 H new ATOM 0 HD13 LEU A 19 9.616 13.978 -6.037 1.00 0.00 H new ATOM 0 HD21 LEU A 19 12.561 14.121 -6.954 1.00 0.00 H new ATOM 0 HD22 LEU A 19 11.907 12.756 -6.016 1.00 0.00 H new ATOM 0 HD23 LEU A 19 12.709 12.460 -7.577 1.00 0.00 H new ATOM 290 N ASP A 20 11.898 10.817 -5.244 1.00 0.00 N ATOM 291 CA ASP A 20 13.179 10.236 -4.859 1.00 0.00 C ATOM 292 C ASP A 20 13.047 9.464 -3.551 1.00 0.00 C ATOM 293 O ASP A 20 13.927 8.685 -3.187 1.00 0.00 O ATOM 294 CB ASP A 20 14.235 11.331 -4.708 1.00 0.00 C ATOM 295 CG ASP A 20 15.642 10.815 -4.937 1.00 0.00 C ATOM 296 OD1 ASP A 20 16.089 10.808 -6.103 1.00 0.00 O ATOM 297 OD2 ASP A 20 16.297 10.418 -3.950 1.00 0.00 O ATOM 0 H ASP A 20 11.577 11.571 -4.637 1.00 0.00 H new ATOM 0 HA ASP A 20 13.490 9.547 -5.644 1.00 0.00 H new ATOM 0 HB2 ASP A 20 14.026 12.133 -5.416 1.00 0.00 H new ATOM 0 HB3 ASP A 20 14.167 11.762 -3.709 1.00 0.00 H new ATOM 302 N PHE A 21 11.938 9.683 -2.856 1.00 0.00 N ATOM 303 CA PHE A 21 11.681 9.015 -1.586 1.00 0.00 C ATOM 304 C PHE A 21 11.395 7.534 -1.808 1.00 0.00 C ATOM 305 O PHE A 21 11.890 6.679 -1.072 1.00 0.00 O ATOM 306 CB PHE A 21 10.497 9.670 -0.875 1.00 0.00 C ATOM 307 CG PHE A 21 10.483 9.443 0.610 1.00 0.00 C ATOM 308 CD1 PHE A 21 11.266 10.219 1.450 1.00 0.00 C ATOM 309 CD2 PHE A 21 9.685 8.457 1.166 1.00 0.00 C ATOM 310 CE1 PHE A 21 11.253 10.016 2.816 1.00 0.00 C ATOM 311 CE2 PHE A 21 9.667 8.248 2.532 1.00 0.00 C ATOM 312 CZ PHE A 21 10.452 9.029 3.358 1.00 0.00 C ATOM 0 H PHE A 21 11.199 10.321 -3.152 1.00 0.00 H new ATOM 0 HA PHE A 21 12.570 9.111 -0.962 1.00 0.00 H new ATOM 0 HB2 PHE A 21 10.516 10.742 -1.069 1.00 0.00 H new ATOM 0 HB3 PHE A 21 9.571 9.285 -1.301 1.00 0.00 H new ATOM 0 HD1 PHE A 21 11.894 10.992 1.031 1.00 0.00 H new ATOM 0 HD2 PHE A 21 9.069 7.844 0.524 1.00 0.00 H new ATOM 0 HE1 PHE A 21 11.868 10.628 3.460 1.00 0.00 H new ATOM 0 HE2 PHE A 21 9.040 7.476 2.953 1.00 0.00 H new ATOM 0 HZ PHE A 21 10.440 8.868 4.426 1.00 0.00 H new ATOM 322 N LEU A 22 10.592 7.240 -2.826 1.00 0.00 N ATOM 323 CA LEU A 22 10.239 5.862 -3.149 1.00 0.00 C ATOM 324 C LEU A 22 11.497 5.022 -3.381 1.00 0.00 C ATOM 325 O LEU A 22 11.660 3.969 -2.767 1.00 0.00 O ATOM 326 CB LEU A 22 9.335 5.814 -4.386 1.00 0.00 C ATOM 327 CG LEU A 22 8.184 4.805 -4.317 1.00 0.00 C ATOM 328 CD1 LEU A 22 8.712 3.398 -4.079 1.00 0.00 C ATOM 329 CD2 LEU A 22 7.200 5.198 -3.228 1.00 0.00 C ATOM 0 H LEU A 22 10.174 7.938 -3.441 1.00 0.00 H new ATOM 0 HA LEU A 22 9.694 5.444 -2.303 1.00 0.00 H new ATOM 0 HB2 LEU A 22 8.916 6.807 -4.549 1.00 0.00 H new ATOM 0 HB3 LEU A 22 9.949 5.581 -5.256 1.00 0.00 H new ATOM 0 HG LEU A 22 7.663 4.814 -5.274 1.00 0.00 H new ATOM 0 HD11 LEU A 22 7.877 2.699 -4.034 1.00 0.00 H new ATOM 0 HD12 LEU A 22 9.377 3.116 -4.895 1.00 0.00 H new ATOM 0 HD13 LEU A 22 9.260 3.370 -3.137 1.00 0.00 H new ATOM 0 HD21 LEU A 22 6.388 4.471 -3.192 1.00 0.00 H new ATOM 0 HD22 LEU A 22 7.712 5.219 -2.266 1.00 0.00 H new ATOM 0 HD23 LEU A 22 6.793 6.186 -3.444 1.00 0.00 H new ATOM 341 N PRO A 23 12.405 5.470 -4.273 1.00 0.00 N ATOM 342 CA PRO A 23 13.648 4.745 -4.560 1.00 0.00 C ATOM 343 C PRO A 23 14.627 4.796 -3.391 1.00 0.00 C ATOM 344 O PRO A 23 15.588 4.030 -3.332 1.00 0.00 O ATOM 345 CB PRO A 23 14.224 5.488 -5.768 1.00 0.00 C ATOM 346 CG PRO A 23 13.662 6.863 -5.669 1.00 0.00 C ATOM 347 CD PRO A 23 12.291 6.705 -5.078 1.00 0.00 C ATOM 0 HA PRO A 23 13.469 3.685 -4.741 1.00 0.00 H new ATOM 0 HB2 PRO A 23 15.314 5.503 -5.741 1.00 0.00 H new ATOM 0 HB3 PRO A 23 13.935 5.008 -6.703 1.00 0.00 H new ATOM 0 HG2 PRO A 23 14.288 7.496 -5.040 1.00 0.00 H new ATOM 0 HG3 PRO A 23 13.613 7.336 -6.650 1.00 0.00 H new ATOM 0 HD2 PRO A 23 12.018 7.562 -4.462 1.00 0.00 H new ATOM 0 HD3 PRO A 23 11.528 6.612 -5.851 1.00 0.00 H new ATOM 355 N THR A 24 14.375 5.714 -2.469 1.00 0.00 N ATOM 356 CA THR A 24 15.226 5.886 -1.298 1.00 0.00 C ATOM 357 C THR A 24 14.889 4.880 -0.196 1.00 0.00 C ATOM 358 O THR A 24 15.769 4.447 0.547 1.00 0.00 O ATOM 359 CB THR A 24 15.106 7.322 -0.743 1.00 0.00 C ATOM 360 OG1 THR A 24 15.826 8.230 -1.584 1.00 0.00 O ATOM 361 CG2 THR A 24 15.636 7.418 0.677 1.00 0.00 C ATOM 0 H THR A 24 13.583 6.356 -2.509 1.00 0.00 H new ATOM 0 HA THR A 24 16.252 5.706 -1.620 1.00 0.00 H new ATOM 0 HB THR A 24 14.049 7.587 -0.730 1.00 0.00 H new ATOM 0 HG1 THR A 24 15.194 8.818 -2.047 1.00 0.00 H new ATOM 0 HG21 THR A 24 15.535 8.443 1.034 1.00 0.00 H new ATOM 0 HG22 THR A 24 15.067 6.751 1.324 1.00 0.00 H new ATOM 0 HG23 THR A 24 16.687 7.130 0.693 1.00 0.00 H new ATOM 369 N TYR A 25 13.617 4.504 -0.099 1.00 0.00 N ATOM 370 CA TYR A 25 13.184 3.556 0.924 1.00 0.00 C ATOM 371 C TYR A 25 12.871 2.183 0.334 1.00 0.00 C ATOM 372 O TYR A 25 12.853 1.182 1.049 1.00 0.00 O ATOM 373 CB TYR A 25 11.965 4.101 1.665 1.00 0.00 C ATOM 374 CG TYR A 25 12.320 5.080 2.762 1.00 0.00 C ATOM 375 CD1 TYR A 25 12.924 6.296 2.466 1.00 0.00 C ATOM 376 CD2 TYR A 25 12.060 4.785 4.093 1.00 0.00 C ATOM 377 CE1 TYR A 25 13.258 7.189 3.466 1.00 0.00 C ATOM 378 CE2 TYR A 25 12.389 5.674 5.099 1.00 0.00 C ATOM 379 CZ TYR A 25 12.987 6.873 4.780 1.00 0.00 C ATOM 380 OH TYR A 25 13.319 7.760 5.779 1.00 0.00 O ATOM 0 H TYR A 25 12.873 4.838 -0.711 1.00 0.00 H new ATOM 0 HA TYR A 25 14.009 3.431 1.626 1.00 0.00 H new ATOM 0 HB2 TYR A 25 11.303 4.591 0.951 1.00 0.00 H new ATOM 0 HB3 TYR A 25 11.409 3.269 2.096 1.00 0.00 H new ATOM 0 HD1 TYR A 25 13.136 6.547 1.437 1.00 0.00 H new ATOM 0 HD2 TYR A 25 11.593 3.845 4.347 1.00 0.00 H new ATOM 0 HE1 TYR A 25 13.729 8.129 3.220 1.00 0.00 H new ATOM 0 HE2 TYR A 25 12.178 5.430 6.130 1.00 0.00 H new ATOM 0 HH TYR A 25 13.060 7.387 6.647 1.00 0.00 H new ATOM 390 N PHE A 26 12.626 2.141 -0.970 1.00 0.00 N ATOM 391 CA PHE A 26 12.319 0.887 -1.647 1.00 0.00 C ATOM 392 C PHE A 26 13.474 0.473 -2.548 1.00 0.00 C ATOM 393 O PHE A 26 13.773 -0.713 -2.692 1.00 0.00 O ATOM 394 CB PHE A 26 11.036 1.031 -2.469 1.00 0.00 C ATOM 395 CG PHE A 26 10.170 -0.201 -2.470 1.00 0.00 C ATOM 396 CD1 PHE A 26 10.004 -0.952 -1.315 1.00 0.00 C ATOM 397 CD2 PHE A 26 9.519 -0.603 -3.625 1.00 0.00 C ATOM 398 CE1 PHE A 26 9.207 -2.081 -1.314 1.00 0.00 C ATOM 399 CE2 PHE A 26 8.720 -1.732 -3.629 1.00 0.00 C ATOM 400 CZ PHE A 26 8.564 -2.471 -2.473 1.00 0.00 C ATOM 0 H PHE A 26 12.634 2.959 -1.579 1.00 0.00 H new ATOM 0 HA PHE A 26 12.170 0.113 -0.894 1.00 0.00 H new ATOM 0 HB2 PHE A 26 10.458 1.869 -2.079 1.00 0.00 H new ATOM 0 HB3 PHE A 26 11.301 1.278 -3.497 1.00 0.00 H new ATOM 0 HD1 PHE A 26 10.504 -0.651 -0.406 1.00 0.00 H new ATOM 0 HD2 PHE A 26 9.637 -0.029 -4.532 1.00 0.00 H new ATOM 0 HE1 PHE A 26 9.087 -2.658 -0.409 1.00 0.00 H new ATOM 0 HE2 PHE A 26 8.218 -2.035 -4.536 1.00 0.00 H new ATOM 0 HZ PHE A 26 7.940 -3.353 -2.475 1.00 0.00 H new ATOM 410 N GLY A 27 14.118 1.464 -3.150 1.00 0.00 N ATOM 411 CA GLY A 27 15.242 1.199 -4.026 1.00 0.00 C ATOM 412 C GLY A 27 15.147 1.957 -5.337 1.00 0.00 C ATOM 413 O GLY A 27 14.069 2.042 -5.926 1.00 0.00 O ATOM 0 H GLY A 27 13.881 2.451 -3.047 1.00 0.00 H new ATOM 0 HA2 GLY A 27 16.167 1.472 -3.518 1.00 0.00 H new ATOM 0 HA3 GLY A 27 15.295 0.130 -4.231 1.00 0.00 H new ATOM 417 N PRO A 28 16.269 2.520 -5.823 1.00 0.00 N ATOM 418 CA PRO A 28 16.295 3.279 -7.079 1.00 0.00 C ATOM 419 C PRO A 28 15.805 2.455 -8.260 1.00 0.00 C ATOM 420 O PRO A 28 15.492 2.997 -9.321 1.00 0.00 O ATOM 421 CB PRO A 28 17.773 3.649 -7.257 1.00 0.00 C ATOM 422 CG PRO A 28 18.519 2.731 -6.349 1.00 0.00 C ATOM 423 CD PRO A 28 17.598 2.458 -5.197 1.00 0.00 C ATOM 0 HA PRO A 28 15.634 4.145 -7.040 1.00 0.00 H new ATOM 0 HB2 PRO A 28 18.089 3.521 -8.292 1.00 0.00 H new ATOM 0 HB3 PRO A 28 17.952 4.692 -6.996 1.00 0.00 H new ATOM 0 HG2 PRO A 28 18.788 1.808 -6.862 1.00 0.00 H new ATOM 0 HG3 PRO A 28 19.448 3.188 -6.007 1.00 0.00 H new ATOM 0 HD2 PRO A 28 17.789 1.483 -4.748 1.00 0.00 H new ATOM 0 HD3 PRO A 28 17.708 3.200 -4.406 1.00 0.00 H new ATOM 431 N ARG A 29 15.749 1.142 -8.076 1.00 0.00 N ATOM 432 CA ARG A 29 15.293 0.249 -9.128 1.00 0.00 C ATOM 433 C ARG A 29 13.856 -0.205 -8.891 1.00 0.00 C ATOM 434 O ARG A 29 13.096 -0.394 -9.841 1.00 0.00 O ATOM 435 CB ARG A 29 16.214 -0.970 -9.227 1.00 0.00 C ATOM 436 CG ARG A 29 15.657 -2.088 -10.097 1.00 0.00 C ATOM 437 CD ARG A 29 15.401 -1.616 -11.520 1.00 0.00 C ATOM 438 NE ARG A 29 14.503 -2.514 -12.241 1.00 0.00 N ATOM 439 CZ ARG A 29 14.799 -3.070 -13.412 1.00 0.00 C ATOM 440 NH1 ARG A 29 15.970 -2.831 -13.987 1.00 0.00 N ATOM 441 NH2 ARG A 29 13.924 -3.869 -14.007 1.00 0.00 N ATOM 0 H ARG A 29 16.014 0.675 -7.209 1.00 0.00 H new ATOM 0 HA ARG A 29 15.324 0.802 -10.067 1.00 0.00 H new ATOM 0 HB2 ARG A 29 17.177 -0.655 -9.628 1.00 0.00 H new ATOM 0 HB3 ARG A 29 16.397 -1.358 -8.225 1.00 0.00 H new ATOM 0 HG2 ARG A 29 16.358 -2.923 -10.111 1.00 0.00 H new ATOM 0 HG3 ARG A 29 14.728 -2.459 -9.663 1.00 0.00 H new ATOM 0 HD2 ARG A 29 14.971 -0.614 -11.498 1.00 0.00 H new ATOM 0 HD3 ARG A 29 16.348 -1.545 -12.054 1.00 0.00 H new ATOM 0 HE ARG A 29 13.597 -2.727 -11.823 1.00 0.00 H new ATOM 0 HH11 ARG A 29 16.647 -2.219 -13.531 1.00 0.00 H new ATOM 0 HH12 ARG A 29 16.194 -3.259 -14.885 1.00 0.00 H new ATOM 0 HH21 ARG A 29 13.024 -4.057 -13.566 1.00 0.00 H new ATOM 0 HH22 ARG A 29 14.151 -4.295 -14.905 1.00 0.00 H new ATOM 455 N LEU A 30 13.476 -0.379 -7.626 1.00 0.00 N ATOM 456 CA LEU A 30 12.134 -0.832 -7.280 1.00 0.00 C ATOM 457 C LEU A 30 11.100 0.279 -7.418 1.00 0.00 C ATOM 458 O LEU A 30 9.921 0.005 -7.613 1.00 0.00 O ATOM 459 CB LEU A 30 12.126 -1.363 -5.844 1.00 0.00 C ATOM 460 CG LEU A 30 12.785 -2.732 -5.645 1.00 0.00 C ATOM 461 CD1 LEU A 30 14.280 -2.652 -5.912 1.00 0.00 C ATOM 462 CD2 LEU A 30 12.521 -3.248 -4.239 1.00 0.00 C ATOM 0 H LEU A 30 14.082 -0.212 -6.823 1.00 0.00 H new ATOM 0 HA LEU A 30 11.863 -1.624 -7.978 1.00 0.00 H new ATOM 0 HB2 LEU A 30 12.631 -0.639 -5.204 1.00 0.00 H new ATOM 0 HB3 LEU A 30 11.093 -1.423 -5.503 1.00 0.00 H new ATOM 0 HG LEU A 30 12.348 -3.431 -6.358 1.00 0.00 H new ATOM 0 HD11 LEU A 30 14.729 -3.634 -5.765 1.00 0.00 H new ATOM 0 HD12 LEU A 30 14.449 -2.325 -6.938 1.00 0.00 H new ATOM 0 HD13 LEU A 30 14.735 -1.939 -5.224 1.00 0.00 H new ATOM 0 HD21 LEU A 30 12.996 -4.221 -4.114 1.00 0.00 H new ATOM 0 HD22 LEU A 30 12.931 -2.548 -3.511 1.00 0.00 H new ATOM 0 HD23 LEU A 30 11.447 -3.345 -4.083 1.00 0.00 H new ATOM 474 N MET A 31 11.544 1.525 -7.284 1.00 0.00 N ATOM 475 CA MET A 31 10.657 2.687 -7.387 1.00 0.00 C ATOM 476 C MET A 31 9.525 2.485 -8.395 1.00 0.00 C ATOM 477 O MET A 31 8.410 2.959 -8.179 1.00 0.00 O ATOM 478 CB MET A 31 11.466 3.928 -7.764 1.00 0.00 C ATOM 479 CG MET A 31 12.662 3.623 -8.650 1.00 0.00 C ATOM 480 SD MET A 31 13.133 5.017 -9.693 1.00 0.00 S ATOM 481 CE MET A 31 11.681 5.169 -10.730 1.00 0.00 C ATOM 0 H MET A 31 12.520 1.760 -7.102 1.00 0.00 H new ATOM 0 HA MET A 31 10.195 2.820 -6.409 1.00 0.00 H new ATOM 0 HB2 MET A 31 10.814 4.635 -8.277 1.00 0.00 H new ATOM 0 HB3 MET A 31 11.813 4.417 -6.854 1.00 0.00 H new ATOM 0 HG2 MET A 31 13.509 3.341 -8.025 1.00 0.00 H new ATOM 0 HG3 MET A 31 12.431 2.765 -9.281 1.00 0.00 H new ATOM 0 HE1 MET A 31 11.972 5.544 -11.711 1.00 0.00 H new ATOM 0 HE2 MET A 31 11.209 4.193 -10.841 1.00 0.00 H new ATOM 0 HE3 MET A 31 10.977 5.863 -10.271 1.00 0.00 H new ATOM 491 N MET A 32 9.806 1.783 -9.485 1.00 0.00 N ATOM 492 CA MET A 32 8.801 1.532 -10.510 1.00 0.00 C ATOM 493 C MET A 32 8.236 0.123 -10.368 1.00 0.00 C ATOM 494 O MET A 32 7.055 -0.114 -10.626 1.00 0.00 O ATOM 495 CB MET A 32 9.396 1.722 -11.907 1.00 0.00 C ATOM 496 CG MET A 32 10.496 0.728 -12.240 1.00 0.00 C ATOM 497 SD MET A 32 11.133 0.930 -13.914 1.00 0.00 S ATOM 498 CE MET A 32 11.756 2.608 -13.844 1.00 0.00 C ATOM 0 H MET A 32 10.721 1.377 -9.682 1.00 0.00 H new ATOM 0 HA MET A 32 7.992 2.250 -10.377 1.00 0.00 H new ATOM 0 HB2 MET A 32 8.601 1.632 -12.647 1.00 0.00 H new ATOM 0 HB3 MET A 32 9.795 2.733 -11.989 1.00 0.00 H new ATOM 0 HG2 MET A 32 11.313 0.845 -11.528 1.00 0.00 H new ATOM 0 HG3 MET A 32 10.112 -0.285 -12.121 1.00 0.00 H new ATOM 0 HE1 MET A 32 12.464 2.767 -14.657 1.00 0.00 H new ATOM 0 HE2 MET A 32 10.927 3.308 -13.943 1.00 0.00 H new ATOM 0 HE3 MET A 32 12.257 2.771 -12.889 1.00 0.00 H new ATOM 508 N ARG A 33 9.092 -0.807 -9.959 1.00 0.00 N ATOM 509 CA ARG A 33 8.686 -2.195 -9.775 1.00 0.00 C ATOM 510 C ARG A 33 7.712 -2.329 -8.608 1.00 0.00 C ATOM 511 O ARG A 33 7.014 -3.336 -8.486 1.00 0.00 O ATOM 512 CB ARG A 33 9.911 -3.079 -9.530 1.00 0.00 C ATOM 513 CG ARG A 33 10.960 -2.996 -10.628 1.00 0.00 C ATOM 514 CD ARG A 33 10.413 -3.470 -11.966 1.00 0.00 C ATOM 515 NE ARG A 33 9.899 -4.835 -11.895 1.00 0.00 N ATOM 516 CZ ARG A 33 9.307 -5.452 -12.914 1.00 0.00 C ATOM 517 NH1 ARG A 33 9.160 -4.829 -14.076 1.00 0.00 N ATOM 518 NH2 ARG A 33 8.861 -6.693 -12.772 1.00 0.00 N ATOM 0 H ARG A 33 10.073 -0.624 -9.748 1.00 0.00 H new ATOM 0 HA ARG A 33 8.184 -2.522 -10.685 1.00 0.00 H new ATOM 0 HB2 ARG A 33 10.368 -2.795 -8.582 1.00 0.00 H new ATOM 0 HB3 ARG A 33 9.586 -4.114 -9.429 1.00 0.00 H new ATOM 0 HG2 ARG A 33 11.309 -1.967 -10.721 1.00 0.00 H new ATOM 0 HG3 ARG A 33 11.824 -3.602 -10.353 1.00 0.00 H new ATOM 0 HD2 ARG A 33 9.617 -2.799 -12.290 1.00 0.00 H new ATOM 0 HD3 ARG A 33 11.200 -3.418 -12.718 1.00 0.00 H new ATOM 0 HE ARG A 33 9.999 -5.343 -11.016 1.00 0.00 H new ATOM 0 HH11 ARG A 33 9.501 -3.875 -14.190 1.00 0.00 H new ATOM 0 HH12 ARG A 33 8.706 -5.304 -14.856 1.00 0.00 H new ATOM 0 HH21 ARG A 33 8.972 -7.176 -11.880 1.00 0.00 H new ATOM 0 HH22 ARG A 33 8.407 -7.165 -13.554 1.00 0.00 H new ATOM 532 N GLY A 34 7.666 -1.311 -7.750 1.00 0.00 N ATOM 533 CA GLY A 34 6.780 -1.348 -6.603 1.00 0.00 C ATOM 534 C GLY A 34 5.577 -0.441 -6.760 1.00 0.00 C ATOM 535 O GLY A 34 4.456 -0.827 -6.427 1.00 0.00 O ATOM 0 H GLY A 34 8.227 -0.463 -7.831 1.00 0.00 H new ATOM 0 HA2 GLY A 34 6.439 -2.371 -6.446 1.00 0.00 H new ATOM 0 HA3 GLY A 34 7.335 -1.056 -5.711 1.00 0.00 H new ATOM 539 N GLU A 35 5.805 0.768 -7.268 1.00 0.00 N ATOM 540 CA GLU A 35 4.722 1.724 -7.464 1.00 0.00 C ATOM 541 C GLU A 35 3.648 1.127 -8.363 1.00 0.00 C ATOM 542 O GLU A 35 2.455 1.343 -8.152 1.00 0.00 O ATOM 543 CB GLU A 35 5.250 3.026 -8.075 1.00 0.00 C ATOM 544 CG GLU A 35 5.756 2.872 -9.501 1.00 0.00 C ATOM 545 CD GLU A 35 6.159 4.194 -10.124 1.00 0.00 C ATOM 546 OE1 GLU A 35 7.218 4.735 -9.739 1.00 0.00 O ATOM 547 OE2 GLU A 35 5.416 4.691 -10.995 1.00 0.00 O ATOM 0 H GLU A 35 6.725 1.106 -7.550 1.00 0.00 H new ATOM 0 HA GLU A 35 4.287 1.950 -6.490 1.00 0.00 H new ATOM 0 HB2 GLU A 35 4.456 3.772 -8.060 1.00 0.00 H new ATOM 0 HB3 GLU A 35 6.058 3.408 -7.451 1.00 0.00 H new ATOM 0 HG2 GLU A 35 6.611 2.196 -9.508 1.00 0.00 H new ATOM 0 HG3 GLU A 35 4.979 2.410 -10.110 1.00 0.00 H new ATOM 554 N ALA A 36 4.084 0.374 -9.367 1.00 0.00 N ATOM 555 CA ALA A 36 3.161 -0.262 -10.299 1.00 0.00 C ATOM 556 C ALA A 36 2.499 -1.492 -9.680 1.00 0.00 C ATOM 557 O ALA A 36 1.415 -1.900 -10.094 1.00 0.00 O ATOM 558 CB ALA A 36 3.887 -0.642 -11.582 1.00 0.00 C ATOM 0 H ALA A 36 5.069 0.189 -9.556 1.00 0.00 H new ATOM 0 HA ALA A 36 2.375 0.456 -10.533 1.00 0.00 H new ATOM 0 HB1 ALA A 36 3.187 -1.116 -12.270 1.00 0.00 H new ATOM 0 HB2 ALA A 36 4.300 0.254 -12.045 1.00 0.00 H new ATOM 0 HB3 ALA A 36 4.695 -1.336 -11.351 1.00 0.00 H new ATOM 564 N LEU A 37 3.160 -2.085 -8.690 1.00 0.00 N ATOM 565 CA LEU A 37 2.638 -3.272 -8.022 1.00 0.00 C ATOM 566 C LEU A 37 1.513 -2.932 -7.047 1.00 0.00 C ATOM 567 O LEU A 37 0.555 -3.689 -6.910 1.00 0.00 O ATOM 568 CB LEU A 37 3.764 -3.984 -7.276 1.00 0.00 C ATOM 569 CG LEU A 37 3.866 -5.487 -7.529 1.00 0.00 C ATOM 570 CD1 LEU A 37 2.630 -6.200 -7.004 1.00 0.00 C ATOM 571 CD2 LEU A 37 4.061 -5.771 -9.011 1.00 0.00 C ATOM 0 H LEU A 37 4.059 -1.762 -8.333 1.00 0.00 H new ATOM 0 HA LEU A 37 2.226 -3.927 -8.790 1.00 0.00 H new ATOM 0 HB2 LEU A 37 4.711 -3.521 -7.553 1.00 0.00 H new ATOM 0 HB3 LEU A 37 3.630 -3.820 -6.207 1.00 0.00 H new ATOM 0 HG LEU A 37 4.736 -5.867 -6.993 1.00 0.00 H new ATOM 0 HD11 LEU A 37 2.719 -7.270 -7.193 1.00 0.00 H new ATOM 0 HD12 LEU A 37 2.538 -6.027 -5.932 1.00 0.00 H new ATOM 0 HD13 LEU A 37 1.745 -5.815 -7.511 1.00 0.00 H new ATOM 0 HD21 LEU A 37 4.131 -6.847 -9.169 1.00 0.00 H new ATOM 0 HD22 LEU A 37 3.214 -5.376 -9.572 1.00 0.00 H new ATOM 0 HD23 LEU A 37 4.978 -5.293 -9.355 1.00 0.00 H new ATOM 583 N VAL A 38 1.631 -1.791 -6.373 1.00 0.00 N ATOM 584 CA VAL A 38 0.620 -1.380 -5.403 1.00 0.00 C ATOM 585 C VAL A 38 -0.678 -0.985 -6.095 1.00 0.00 C ATOM 586 O VAL A 38 -1.770 -1.274 -5.602 1.00 0.00 O ATOM 587 CB VAL A 38 1.112 -0.214 -4.523 1.00 0.00 C ATOM 588 CG1 VAL A 38 2.495 -0.520 -3.973 1.00 0.00 C ATOM 589 CG2 VAL A 38 1.117 1.095 -5.297 1.00 0.00 C ATOM 0 H VAL A 38 2.409 -1.140 -6.479 1.00 0.00 H new ATOM 0 HA VAL A 38 0.433 -2.241 -4.761 1.00 0.00 H new ATOM 0 HB VAL A 38 0.421 -0.101 -3.688 1.00 0.00 H new ATOM 0 HG11 VAL A 38 2.832 0.311 -3.353 1.00 0.00 H new ATOM 0 HG12 VAL A 38 2.455 -1.428 -3.372 1.00 0.00 H new ATOM 0 HG13 VAL A 38 3.192 -0.662 -4.799 1.00 0.00 H new ATOM 0 HG21 VAL A 38 1.469 1.899 -4.650 1.00 0.00 H new ATOM 0 HG22 VAL A 38 1.779 1.006 -6.158 1.00 0.00 H new ATOM 0 HG23 VAL A 38 0.107 1.320 -5.638 1.00 0.00 H new ATOM 599 N TYR A 39 -0.554 -0.325 -7.240 1.00 0.00 N ATOM 600 CA TYR A 39 -1.719 0.103 -8.002 1.00 0.00 C ATOM 601 C TYR A 39 -2.313 -1.074 -8.770 1.00 0.00 C ATOM 602 O TYR A 39 -3.498 -1.076 -9.106 1.00 0.00 O ATOM 603 CB TYR A 39 -1.334 1.240 -8.956 1.00 0.00 C ATOM 604 CG TYR A 39 -1.346 0.865 -10.423 1.00 0.00 C ATOM 605 CD1 TYR A 39 -0.227 0.305 -11.022 1.00 0.00 C ATOM 606 CD2 TYR A 39 -2.473 1.078 -11.206 1.00 0.00 C ATOM 607 CE1 TYR A 39 -0.229 -0.034 -12.362 1.00 0.00 C ATOM 608 CE2 TYR A 39 -2.485 0.741 -12.546 1.00 0.00 C ATOM 609 CZ TYR A 39 -1.360 0.186 -13.119 1.00 0.00 C ATOM 610 OH TYR A 39 -1.366 -0.149 -14.454 1.00 0.00 O ATOM 0 H TYR A 39 0.341 -0.075 -7.660 1.00 0.00 H new ATOM 0 HA TYR A 39 -2.477 0.474 -7.312 1.00 0.00 H new ATOM 0 HB2 TYR A 39 -2.020 2.073 -8.802 1.00 0.00 H new ATOM 0 HB3 TYR A 39 -0.337 1.595 -8.694 1.00 0.00 H new ATOM 0 HD1 TYR A 39 0.660 0.131 -10.432 1.00 0.00 H new ATOM 0 HD2 TYR A 39 -3.355 1.514 -10.760 1.00 0.00 H new ATOM 0 HE1 TYR A 39 0.651 -0.469 -12.813 1.00 0.00 H new ATOM 0 HE2 TYR A 39 -3.370 0.911 -13.141 1.00 0.00 H new ATOM 0 HH TYR A 39 -2.239 0.069 -14.842 1.00 0.00 H new ATOM 620 N ALA A 40 -1.480 -2.074 -9.043 1.00 0.00 N ATOM 621 CA ALA A 40 -1.919 -3.262 -9.765 1.00 0.00 C ATOM 622 C ALA A 40 -3.030 -3.977 -9.005 1.00 0.00 C ATOM 623 O ALA A 40 -3.995 -4.453 -9.601 1.00 0.00 O ATOM 624 CB ALA A 40 -0.746 -4.201 -9.997 1.00 0.00 C ATOM 0 H ALA A 40 -0.496 -2.084 -8.774 1.00 0.00 H new ATOM 0 HA ALA A 40 -2.314 -2.950 -10.732 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -1.088 -5.084 -10.537 1.00 0.00 H new ATOM 0 HB2 ALA A 40 0.018 -3.691 -10.583 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -0.326 -4.503 -9.037 1.00 0.00 H new ATOM 630 N TRP A 41 -2.883 -4.046 -7.686 1.00 0.00 N ATOM 631 CA TRP A 41 -3.876 -4.700 -6.841 1.00 0.00 C ATOM 632 C TRP A 41 -5.082 -3.795 -6.610 1.00 0.00 C ATOM 633 O TRP A 41 -6.213 -4.266 -6.507 1.00 0.00 O ATOM 634 CB TRP A 41 -3.260 -5.081 -5.493 1.00 0.00 C ATOM 635 CG TRP A 41 -2.269 -6.203 -5.574 1.00 0.00 C ATOM 636 CD1 TRP A 41 -0.925 -6.101 -5.796 1.00 0.00 C ATOM 637 CD2 TRP A 41 -2.546 -7.601 -5.423 1.00 0.00 C ATOM 638 NE1 TRP A 41 -0.351 -7.348 -5.794 1.00 0.00 N ATOM 639 CE2 TRP A 41 -1.326 -8.286 -5.568 1.00 0.00 C ATOM 640 CE3 TRP A 41 -3.709 -8.338 -5.180 1.00 0.00 C ATOM 641 CZ2 TRP A 41 -1.236 -9.673 -5.478 1.00 0.00 C ATOM 642 CZ3 TRP A 41 -3.618 -9.714 -5.091 1.00 0.00 C ATOM 643 CH2 TRP A 41 -2.389 -10.369 -5.239 1.00 0.00 C ATOM 0 H TRP A 41 -2.087 -3.658 -7.180 1.00 0.00 H new ATOM 0 HA TRP A 41 -4.209 -5.601 -7.356 1.00 0.00 H new ATOM 0 HB2 TRP A 41 -2.769 -4.205 -5.068 1.00 0.00 H new ATOM 0 HB3 TRP A 41 -4.058 -5.363 -4.806 1.00 0.00 H new ATOM 0 HD1 TRP A 41 -0.392 -5.175 -5.951 1.00 0.00 H new ATOM 0 HE1 TRP A 41 0.639 -7.545 -5.937 1.00 0.00 H new ATOM 0 HE3 TRP A 41 -4.661 -7.841 -5.064 1.00 0.00 H new ATOM 0 HZ2 TRP A 41 -0.290 -10.181 -5.593 1.00 0.00 H new ATOM 0 HZ3 TRP A 41 -4.510 -10.294 -4.904 1.00 0.00 H new ATOM 0 HH2 TRP A 41 -2.351 -11.446 -5.163 1.00 0.00 H new ATOM 654 N MET A 42 -4.829 -2.492 -6.534 1.00 0.00 N ATOM 655 CA MET A 42 -5.887 -1.514 -6.295 1.00 0.00 C ATOM 656 C MET A 42 -6.932 -1.522 -7.411 1.00 0.00 C ATOM 657 O MET A 42 -8.132 -1.440 -7.147 1.00 0.00 O ATOM 658 CB MET A 42 -5.282 -0.115 -6.162 1.00 0.00 C ATOM 659 CG MET A 42 -6.278 0.951 -5.732 1.00 0.00 C ATOM 660 SD MET A 42 -6.453 1.076 -3.941 1.00 0.00 S ATOM 661 CE MET A 42 -7.443 -0.372 -3.579 1.00 0.00 C ATOM 0 H MET A 42 -3.898 -2.087 -6.635 1.00 0.00 H new ATOM 0 HA MET A 42 -6.389 -1.789 -5.367 1.00 0.00 H new ATOM 0 HB2 MET A 42 -4.468 -0.150 -5.438 1.00 0.00 H new ATOM 0 HB3 MET A 42 -4.846 0.174 -7.119 1.00 0.00 H new ATOM 0 HG2 MET A 42 -5.962 1.916 -6.128 1.00 0.00 H new ATOM 0 HG3 MET A 42 -7.251 0.729 -6.171 1.00 0.00 H new ATOM 0 HE1 MET A 42 -8.251 -0.100 -2.900 1.00 0.00 H new ATOM 0 HE2 MET A 42 -7.864 -0.766 -4.504 1.00 0.00 H new ATOM 0 HE3 MET A 42 -6.818 -1.133 -3.112 1.00 0.00 H new ATOM 671 N ARG A 43 -6.471 -1.620 -8.654 1.00 0.00 N ATOM 672 CA ARG A 43 -7.372 -1.618 -9.805 1.00 0.00 C ATOM 673 C ARG A 43 -8.079 -2.963 -9.974 1.00 0.00 C ATOM 674 O ARG A 43 -8.999 -3.089 -10.782 1.00 0.00 O ATOM 675 CB ARG A 43 -6.601 -1.261 -11.080 1.00 0.00 C ATOM 676 CG ARG A 43 -5.455 -2.211 -11.396 1.00 0.00 C ATOM 677 CD ARG A 43 -5.929 -3.414 -12.197 1.00 0.00 C ATOM 678 NE ARG A 43 -6.529 -3.021 -13.470 1.00 0.00 N ATOM 679 CZ ARG A 43 -7.172 -3.862 -14.274 1.00 0.00 C ATOM 680 NH1 ARG A 43 -7.298 -5.140 -13.940 1.00 0.00 N ATOM 681 NH2 ARG A 43 -7.691 -3.425 -15.414 1.00 0.00 N ATOM 0 H ARG A 43 -5.482 -1.702 -8.891 1.00 0.00 H new ATOM 0 HA ARG A 43 -8.137 -0.863 -9.624 1.00 0.00 H new ATOM 0 HB2 ARG A 43 -7.294 -1.252 -11.921 1.00 0.00 H new ATOM 0 HB3 ARG A 43 -6.205 -0.250 -10.982 1.00 0.00 H new ATOM 0 HG2 ARG A 43 -4.686 -1.680 -11.957 1.00 0.00 H new ATOM 0 HG3 ARG A 43 -4.996 -2.550 -10.467 1.00 0.00 H new ATOM 0 HD2 ARG A 43 -5.087 -4.080 -12.383 1.00 0.00 H new ATOM 0 HD3 ARG A 43 -6.656 -3.976 -11.611 1.00 0.00 H new ATOM 0 HE ARG A 43 -6.450 -2.046 -13.758 1.00 0.00 H new ATOM 0 HH11 ARG A 43 -6.901 -5.480 -13.064 1.00 0.00 H new ATOM 0 HH12 ARG A 43 -7.792 -5.783 -14.559 1.00 0.00 H new ATOM 0 HH21 ARG A 43 -7.597 -2.443 -15.674 1.00 0.00 H new ATOM 0 HH22 ARG A 43 -8.184 -4.071 -16.030 1.00 0.00 H new ATOM 695 N ARG A 44 -7.649 -3.963 -9.212 1.00 0.00 N ATOM 696 CA ARG A 44 -8.252 -5.292 -9.288 1.00 0.00 C ATOM 697 C ARG A 44 -9.361 -5.455 -8.253 1.00 0.00 C ATOM 698 O ARG A 44 -10.429 -5.989 -8.553 1.00 0.00 O ATOM 699 CB ARG A 44 -7.187 -6.372 -9.086 1.00 0.00 C ATOM 700 CG ARG A 44 -6.222 -6.504 -10.253 1.00 0.00 C ATOM 701 CD ARG A 44 -5.130 -7.520 -9.959 1.00 0.00 C ATOM 702 NE ARG A 44 -5.679 -8.831 -9.624 1.00 0.00 N ATOM 703 CZ ARG A 44 -4.932 -9.877 -9.281 1.00 0.00 C ATOM 704 NH1 ARG A 44 -3.611 -9.766 -9.234 1.00 0.00 N ATOM 705 NH2 ARG A 44 -5.507 -11.035 -8.986 1.00 0.00 N ATOM 0 H ARG A 44 -6.889 -3.881 -8.537 1.00 0.00 H new ATOM 0 HA ARG A 44 -8.691 -5.403 -10.280 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -6.621 -6.147 -8.182 1.00 0.00 H new ATOM 0 HB3 ARG A 44 -7.680 -7.330 -8.924 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -6.769 -6.804 -11.147 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -5.771 -5.535 -10.466 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -4.477 -7.611 -10.827 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -4.515 -7.163 -9.133 1.00 0.00 H new ATOM 0 HE ARG A 44 -6.691 -8.951 -9.655 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -3.166 -8.877 -9.461 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -3.041 -10.570 -8.971 1.00 0.00 H new ATOM 0 HH21 ARG A 44 -6.522 -11.124 -9.022 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -4.934 -11.837 -8.723 1.00 0.00 H new ATOM 719 N LEU A 45 -9.095 -4.996 -7.035 1.00 0.00 N ATOM 720 CA LEU A 45 -10.071 -5.090 -5.954 1.00 0.00 C ATOM 721 C LEU A 45 -11.413 -4.501 -6.382 1.00 0.00 C ATOM 722 O LEU A 45 -12.460 -4.864 -5.849 1.00 0.00 O ATOM 723 CB LEU A 45 -9.571 -4.385 -4.696 1.00 0.00 C ATOM 724 CG LEU A 45 -8.171 -4.790 -4.230 1.00 0.00 C ATOM 725 CD1 LEU A 45 -7.753 -3.966 -3.021 1.00 0.00 C ATOM 726 CD2 LEU A 45 -8.124 -6.276 -3.903 1.00 0.00 C ATOM 0 H LEU A 45 -8.214 -4.556 -6.771 1.00 0.00 H new ATOM 0 HA LEU A 45 -10.207 -6.147 -5.726 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -9.579 -3.310 -4.875 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -10.275 -4.579 -3.887 1.00 0.00 H new ATOM 0 HG LEU A 45 -7.470 -4.594 -5.041 1.00 0.00 H new ATOM 0 HD11 LEU A 45 -6.755 -4.267 -2.703 1.00 0.00 H new ATOM 0 HD12 LEU A 45 -7.746 -2.909 -3.286 1.00 0.00 H new ATOM 0 HD13 LEU A 45 -8.459 -4.131 -2.207 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -7.120 -6.544 -3.574 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -8.838 -6.497 -3.109 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -8.380 -6.852 -4.792 1.00 0.00 H new ATOM 738 N CYS A 46 -11.375 -3.591 -7.350 1.00 0.00 N ATOM 739 CA CYS A 46 -12.590 -2.968 -7.864 1.00 0.00 C ATOM 740 C CYS A 46 -12.748 -3.268 -9.352 1.00 0.00 C ATOM 741 O CYS A 46 -11.773 -3.255 -10.103 1.00 0.00 O ATOM 742 CB CYS A 46 -12.560 -1.456 -7.634 1.00 0.00 C ATOM 743 SG CYS A 46 -13.953 -0.571 -8.370 1.00 0.00 S ATOM 0 H CYS A 46 -10.516 -3.268 -7.795 1.00 0.00 H new ATOM 0 HA CYS A 46 -13.442 -3.383 -7.326 1.00 0.00 H new ATOM 0 HB2 CYS A 46 -12.546 -1.263 -6.561 1.00 0.00 H new ATOM 0 HB3 CYS A 46 -11.632 -1.055 -8.042 1.00 0.00 H new ATOM 0 HG CYS A 46 -13.840 0.700 -8.120 1.00 0.00 H new ATOM 749 N GLU A 47 -13.980 -3.538 -9.771 1.00 0.00 N ATOM 750 CA GLU A 47 -14.260 -3.851 -11.168 1.00 0.00 C ATOM 751 C GLU A 47 -14.274 -2.584 -12.012 1.00 0.00 C ATOM 752 O GLU A 47 -13.965 -2.614 -13.204 1.00 0.00 O ATOM 753 CB GLU A 47 -15.606 -4.569 -11.292 1.00 0.00 C ATOM 754 CG GLU A 47 -16.784 -3.730 -10.829 1.00 0.00 C ATOM 755 CD GLU A 47 -18.120 -4.370 -11.154 1.00 0.00 C ATOM 756 OE1 GLU A 47 -18.617 -5.161 -10.326 1.00 0.00 O ATOM 757 OE2 GLU A 47 -18.667 -4.081 -12.239 1.00 0.00 O ATOM 0 H GLU A 47 -14.800 -3.546 -9.164 1.00 0.00 H new ATOM 0 HA GLU A 47 -13.470 -4.506 -11.534 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -15.761 -4.857 -12.332 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -15.573 -5.489 -10.708 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -16.713 -3.573 -9.753 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -16.732 -2.748 -11.298 1.00 0.00 H new ATOM 764 N ARG A 48 -14.632 -1.472 -11.383 1.00 0.00 N ATOM 765 CA ARG A 48 -14.687 -0.188 -12.067 1.00 0.00 C ATOM 766 C ARG A 48 -13.660 0.768 -11.474 1.00 0.00 C ATOM 767 O ARG A 48 -13.993 1.875 -11.052 1.00 0.00 O ATOM 768 CB ARG A 48 -16.090 0.411 -11.963 1.00 0.00 C ATOM 769 CG ARG A 48 -17.179 -0.498 -12.510 1.00 0.00 C ATOM 770 CD ARG A 48 -18.558 0.117 -12.333 1.00 0.00 C ATOM 771 NE ARG A 48 -18.656 1.430 -12.963 1.00 0.00 N ATOM 772 CZ ARG A 48 -19.735 2.204 -12.890 1.00 0.00 C ATOM 773 NH1 ARG A 48 -20.805 1.796 -12.221 1.00 0.00 N ATOM 774 NH2 ARG A 48 -19.744 3.388 -13.489 1.00 0.00 N ATOM 0 H ARG A 48 -14.889 -1.434 -10.397 1.00 0.00 H new ATOM 0 HA ARG A 48 -14.453 -0.344 -13.120 1.00 0.00 H new ATOM 0 HB2 ARG A 48 -16.305 0.634 -10.918 1.00 0.00 H new ATOM 0 HB3 ARG A 48 -16.113 1.358 -12.502 1.00 0.00 H new ATOM 0 HG2 ARG A 48 -16.998 -0.689 -13.568 1.00 0.00 H new ATOM 0 HG3 ARG A 48 -17.141 -1.461 -12.001 1.00 0.00 H new ATOM 0 HD2 ARG A 48 -19.309 -0.547 -12.761 1.00 0.00 H new ATOM 0 HD3 ARG A 48 -18.781 0.207 -11.270 1.00 0.00 H new ATOM 0 HE ARG A 48 -17.852 1.773 -13.489 1.00 0.00 H new ATOM 0 HH11 ARG A 48 -20.802 0.886 -11.760 1.00 0.00 H new ATOM 0 HH12 ARG A 48 -21.631 2.392 -12.167 1.00 0.00 H new ATOM 0 HH21 ARG A 48 -18.923 3.705 -14.005 1.00 0.00 H new ATOM 0 HH22 ARG A 48 -20.572 3.982 -13.433 1.00 0.00 H new ATOM 788 N TYR A 49 -12.408 0.327 -11.450 1.00 0.00 N ATOM 789 CA TYR A 49 -11.324 1.126 -10.902 1.00 0.00 C ATOM 790 C TYR A 49 -10.326 1.511 -11.989 1.00 0.00 C ATOM 791 O TYR A 49 -9.448 0.724 -12.345 1.00 0.00 O ATOM 792 CB TYR A 49 -10.608 0.348 -9.800 1.00 0.00 C ATOM 793 CG TYR A 49 -9.936 1.229 -8.778 1.00 0.00 C ATOM 794 CD1 TYR A 49 -8.897 2.077 -9.136 1.00 0.00 C ATOM 795 CD2 TYR A 49 -10.342 1.212 -7.454 1.00 0.00 C ATOM 796 CE1 TYR A 49 -8.282 2.884 -8.200 1.00 0.00 C ATOM 797 CE2 TYR A 49 -9.736 2.015 -6.510 1.00 0.00 C ATOM 798 CZ TYR A 49 -8.705 2.851 -6.888 1.00 0.00 C ATOM 799 OH TYR A 49 -8.096 3.654 -5.951 1.00 0.00 O ATOM 0 H TYR A 49 -12.120 -0.584 -11.806 1.00 0.00 H new ATOM 0 HA TYR A 49 -11.751 2.038 -10.486 1.00 0.00 H new ATOM 0 HB2 TYR A 49 -11.328 -0.296 -9.295 1.00 0.00 H new ATOM 0 HB3 TYR A 49 -9.861 -0.303 -10.253 1.00 0.00 H new ATOM 0 HD1 TYR A 49 -8.564 2.106 -10.163 1.00 0.00 H new ATOM 0 HD2 TYR A 49 -11.148 0.558 -7.155 1.00 0.00 H new ATOM 0 HE1 TYR A 49 -7.474 3.538 -8.494 1.00 0.00 H new ATOM 0 HE2 TYR A 49 -10.066 1.990 -5.482 1.00 0.00 H new ATOM 0 HH TYR A 49 -7.804 3.107 -5.192 1.00 0.00 H new ATOM 809 N ASN A 50 -10.470 2.720 -12.517 1.00 0.00 N ATOM 810 CA ASN A 50 -9.576 3.209 -13.559 1.00 0.00 C ATOM 811 C ASN A 50 -8.204 3.556 -12.987 1.00 0.00 C ATOM 812 O ASN A 50 -7.176 3.161 -13.537 1.00 0.00 O ATOM 813 CB ASN A 50 -10.185 4.432 -14.245 1.00 0.00 C ATOM 814 CG ASN A 50 -11.420 4.084 -15.054 1.00 0.00 C ATOM 815 OD1 ASN A 50 -11.336 3.816 -16.251 1.00 0.00 O ATOM 816 ND2 ASN A 50 -12.575 4.081 -14.397 1.00 0.00 N ATOM 0 H ASN A 50 -11.197 3.380 -12.241 1.00 0.00 H new ATOM 0 HA ASN A 50 -9.446 2.415 -14.295 1.00 0.00 H new ATOM 0 HB2 ASN A 50 -10.445 5.176 -13.492 1.00 0.00 H new ATOM 0 HB3 ASN A 50 -9.441 4.887 -14.899 1.00 0.00 H new ATOM 0 HD21 ASN A 50 -13.440 3.850 -14.886 1.00 0.00 H new ATOM 0 HD22 ASN A 50 -12.597 4.310 -13.403 1.00 0.00 H new ATOM 823 N GLY A 51 -8.193 4.296 -11.881 1.00 0.00 N ATOM 824 CA GLY A 51 -6.937 4.676 -11.258 1.00 0.00 C ATOM 825 C GLY A 51 -7.055 5.938 -10.422 1.00 0.00 C ATOM 826 O GLY A 51 -8.158 6.426 -10.177 1.00 0.00 O ATOM 0 H GLY A 51 -9.029 4.638 -11.407 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -6.587 3.859 -10.627 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -6.184 4.827 -12.031 1.00 0.00 H new ATOM 830 N ALA A 52 -5.910 6.466 -9.992 1.00 0.00 N ATOM 831 CA ALA A 52 -5.874 7.676 -9.174 1.00 0.00 C ATOM 832 C ALA A 52 -4.438 8.059 -8.830 1.00 0.00 C ATOM 833 O ALA A 52 -3.490 7.411 -9.276 1.00 0.00 O ATOM 834 CB ALA A 52 -6.688 7.485 -7.903 1.00 0.00 C ATOM 0 H ALA A 52 -4.992 6.072 -10.198 1.00 0.00 H new ATOM 0 HA ALA A 52 -6.315 8.488 -9.753 1.00 0.00 H new ATOM 0 HB1 ALA A 52 -6.650 8.396 -7.306 1.00 0.00 H new ATOM 0 HB2 ALA A 52 -7.723 7.265 -8.164 1.00 0.00 H new ATOM 0 HB3 ALA A 52 -6.275 6.657 -7.327 1.00 0.00 H new ATOM 840 N TYR A 53 -4.283 9.115 -8.036 1.00 0.00 N ATOM 841 CA TYR A 53 -2.963 9.581 -7.631 1.00 0.00 C ATOM 842 C TYR A 53 -2.527 8.935 -6.321 1.00 0.00 C ATOM 843 O TYR A 53 -2.942 9.353 -5.241 1.00 0.00 O ATOM 844 CB TYR A 53 -2.958 11.102 -7.490 1.00 0.00 C ATOM 845 CG TYR A 53 -2.871 11.830 -8.810 1.00 0.00 C ATOM 846 CD1 TYR A 53 -1.794 11.626 -9.662 1.00 0.00 C ATOM 847 CD2 TYR A 53 -3.862 12.718 -9.204 1.00 0.00 C ATOM 848 CE1 TYR A 53 -1.706 12.288 -10.871 1.00 0.00 C ATOM 849 CE2 TYR A 53 -3.783 13.385 -10.412 1.00 0.00 C ATOM 850 CZ TYR A 53 -2.704 13.167 -11.242 1.00 0.00 C ATOM 851 OH TYR A 53 -2.622 13.827 -12.446 1.00 0.00 O ATOM 0 H TYR A 53 -5.057 9.664 -7.661 1.00 0.00 H new ATOM 0 HA TYR A 53 -2.254 9.291 -8.406 1.00 0.00 H new ATOM 0 HB2 TYR A 53 -3.865 11.414 -6.972 1.00 0.00 H new ATOM 0 HB3 TYR A 53 -2.116 11.398 -6.865 1.00 0.00 H new ATOM 0 HD1 TYR A 53 -1.012 10.938 -9.375 1.00 0.00 H new ATOM 0 HD2 TYR A 53 -4.709 12.891 -8.556 1.00 0.00 H new ATOM 0 HE1 TYR A 53 -0.861 12.119 -11.522 1.00 0.00 H new ATOM 0 HE2 TYR A 53 -4.562 14.073 -10.704 1.00 0.00 H new ATOM 0 HH TYR A 53 -3.404 14.407 -12.555 1.00 0.00 H new ATOM 861 N TRP A 54 -1.694 7.906 -6.429 1.00 0.00 N ATOM 862 CA TRP A 54 -1.195 7.193 -5.258 1.00 0.00 C ATOM 863 C TRP A 54 -0.102 7.993 -4.554 1.00 0.00 C ATOM 864 O TRP A 54 1.087 7.705 -4.699 1.00 0.00 O ATOM 865 CB TRP A 54 -0.665 5.818 -5.673 1.00 0.00 C ATOM 866 CG TRP A 54 -1.328 5.285 -6.906 1.00 0.00 C ATOM 867 CD1 TRP A 54 -2.616 4.846 -7.022 1.00 0.00 C ATOM 868 CD2 TRP A 54 -0.737 5.143 -8.203 1.00 0.00 C ATOM 869 NE1 TRP A 54 -2.863 4.441 -8.311 1.00 0.00 N ATOM 870 CE2 TRP A 54 -1.724 4.612 -9.055 1.00 0.00 C ATOM 871 CE3 TRP A 54 0.529 5.412 -8.727 1.00 0.00 C ATOM 872 CZ2 TRP A 54 -1.482 4.347 -10.400 1.00 0.00 C ATOM 873 CZ3 TRP A 54 0.769 5.149 -10.062 1.00 0.00 C ATOM 874 CH2 TRP A 54 -0.232 4.621 -10.886 1.00 0.00 C ATOM 0 H TRP A 54 -1.349 7.546 -7.319 1.00 0.00 H new ATOM 0 HA TRP A 54 -2.019 7.062 -4.557 1.00 0.00 H new ATOM 0 HB2 TRP A 54 0.409 5.885 -5.845 1.00 0.00 H new ATOM 0 HB3 TRP A 54 -0.814 5.115 -4.854 1.00 0.00 H new ATOM 0 HD1 TRP A 54 -3.336 4.821 -6.217 1.00 0.00 H new ATOM 0 HE1 TRP A 54 -3.749 4.073 -8.658 1.00 0.00 H new ATOM 0 HE3 TRP A 54 1.308 5.819 -8.099 1.00 0.00 H new ATOM 0 HZ2 TRP A 54 -2.253 3.940 -11.037 1.00 0.00 H new ATOM 0 HZ3 TRP A 54 1.745 5.354 -10.477 1.00 0.00 H new ATOM 0 HH2 TRP A 54 -0.014 4.426 -11.926 1.00 0.00 H new ATOM 885 N HIS A 55 -0.519 9.009 -3.805 1.00 0.00 N ATOM 886 CA HIS A 55 0.404 9.866 -3.074 1.00 0.00 C ATOM 887 C HIS A 55 1.397 9.049 -2.266 1.00 0.00 C ATOM 888 O HIS A 55 1.055 8.009 -1.702 1.00 0.00 O ATOM 889 CB HIS A 55 -0.363 10.807 -2.144 1.00 0.00 C ATOM 890 CG HIS A 55 -1.309 11.720 -2.856 1.00 0.00 C ATOM 891 ND1 HIS A 55 -0.969 12.995 -3.258 1.00 0.00 N ATOM 892 CD2 HIS A 55 -2.596 11.539 -3.237 1.00 0.00 C ATOM 893 CE1 HIS A 55 -2.006 13.558 -3.854 1.00 0.00 C ATOM 894 NE2 HIS A 55 -3.004 12.695 -3.855 1.00 0.00 N ATOM 0 H HIS A 55 -1.501 9.259 -3.689 1.00 0.00 H new ATOM 0 HA HIS A 55 0.957 10.453 -3.807 1.00 0.00 H new ATOM 0 HB2 HIS A 55 -0.921 10.213 -1.421 1.00 0.00 H new ATOM 0 HB3 HIS A 55 0.351 11.407 -1.580 1.00 0.00 H new ATOM 0 HD1 HIS A 55 -0.059 13.435 -3.117 1.00 0.00 H new ATOM 0 HD2 HIS A 55 -3.191 10.651 -3.083 1.00 0.00 H new ATOM 0 HE1 HIS A 55 -2.032 14.555 -4.269 1.00 0.00 H new ATOM 903 N TYR A 56 2.632 9.528 -2.218 1.00 0.00 N ATOM 904 CA TYR A 56 3.684 8.854 -1.472 1.00 0.00 C ATOM 905 C TYR A 56 3.657 9.295 -0.013 1.00 0.00 C ATOM 906 O TYR A 56 3.672 10.489 0.286 1.00 0.00 O ATOM 907 CB TYR A 56 5.049 9.146 -2.098 1.00 0.00 C ATOM 908 CG TYR A 56 5.175 8.652 -3.526 1.00 0.00 C ATOM 909 CD1 TYR A 56 4.746 7.380 -3.881 1.00 0.00 C ATOM 910 CD2 TYR A 56 5.719 9.458 -4.517 1.00 0.00 C ATOM 911 CE1 TYR A 56 4.856 6.924 -5.181 1.00 0.00 C ATOM 912 CE2 TYR A 56 5.832 9.011 -5.820 1.00 0.00 C ATOM 913 CZ TYR A 56 5.399 7.744 -6.146 1.00 0.00 C ATOM 914 OH TYR A 56 5.512 7.294 -7.442 1.00 0.00 O ATOM 0 H TYR A 56 2.930 10.383 -2.688 1.00 0.00 H new ATOM 0 HA TYR A 56 3.511 7.779 -1.512 1.00 0.00 H new ATOM 0 HB2 TYR A 56 5.228 10.221 -2.076 1.00 0.00 H new ATOM 0 HB3 TYR A 56 5.826 8.681 -1.491 1.00 0.00 H new ATOM 0 HD1 TYR A 56 4.319 6.735 -3.127 1.00 0.00 H new ATOM 0 HD2 TYR A 56 6.060 10.451 -4.265 1.00 0.00 H new ATOM 0 HE1 TYR A 56 4.518 5.931 -5.439 1.00 0.00 H new ATOM 0 HE2 TYR A 56 6.257 9.651 -6.579 1.00 0.00 H new ATOM 0 HH TYR A 56 5.914 7.994 -7.998 1.00 0.00 H new ATOM 924 N TYR A 57 3.617 8.322 0.891 1.00 0.00 N ATOM 925 CA TYR A 57 3.568 8.613 2.319 1.00 0.00 C ATOM 926 C TYR A 57 4.806 8.098 3.041 1.00 0.00 C ATOM 927 O TYR A 57 5.331 7.033 2.720 1.00 0.00 O ATOM 928 CB TYR A 57 2.314 8.004 2.944 1.00 0.00 C ATOM 929 CG TYR A 57 1.064 8.819 2.703 1.00 0.00 C ATOM 930 CD1 TYR A 57 0.310 8.648 1.549 1.00 0.00 C ATOM 931 CD2 TYR A 57 0.644 9.763 3.629 1.00 0.00 C ATOM 932 CE1 TYR A 57 -0.830 9.396 1.327 1.00 0.00 C ATOM 933 CE2 TYR A 57 -0.495 10.514 3.415 1.00 0.00 C ATOM 934 CZ TYR A 57 -1.228 10.327 2.262 1.00 0.00 C ATOM 935 OH TYR A 57 -2.363 11.074 2.045 1.00 0.00 O ATOM 0 H TYR A 57 3.618 7.328 0.661 1.00 0.00 H new ATOM 0 HA TYR A 57 3.538 9.697 2.430 1.00 0.00 H new ATOM 0 HB2 TYR A 57 2.168 7.001 2.542 1.00 0.00 H new ATOM 0 HB3 TYR A 57 2.468 7.898 4.018 1.00 0.00 H new ATOM 0 HD1 TYR A 57 0.620 7.919 0.814 1.00 0.00 H new ATOM 0 HD2 TYR A 57 1.217 9.913 4.532 1.00 0.00 H new ATOM 0 HE1 TYR A 57 -1.407 9.252 0.425 1.00 0.00 H new ATOM 0 HE2 TYR A 57 -0.810 11.244 4.146 1.00 0.00 H new ATOM 0 HH TYR A 57 -2.504 11.682 2.800 1.00 0.00 H new ATOM 945 N ALA A 58 5.264 8.871 4.019 1.00 0.00 N ATOM 946 CA ALA A 58 6.434 8.507 4.807 1.00 0.00 C ATOM 947 C ALA A 58 6.026 8.100 6.217 1.00 0.00 C ATOM 948 O ALA A 58 5.465 8.900 6.967 1.00 0.00 O ATOM 949 CB ALA A 58 7.421 9.662 4.855 1.00 0.00 C ATOM 0 H ALA A 58 4.839 9.759 4.286 1.00 0.00 H new ATOM 0 HA ALA A 58 6.918 7.655 4.329 1.00 0.00 H new ATOM 0 HB1 ALA A 58 8.289 9.374 5.447 1.00 0.00 H new ATOM 0 HB2 ALA A 58 7.739 9.911 3.843 1.00 0.00 H new ATOM 0 HB3 ALA A 58 6.943 10.530 5.309 1.00 0.00 H new ATOM 955 N LEU A 59 6.310 6.854 6.572 1.00 0.00 N ATOM 956 CA LEU A 59 5.967 6.338 7.889 1.00 0.00 C ATOM 957 C LEU A 59 7.117 6.543 8.872 1.00 0.00 C ATOM 958 O LEU A 59 8.287 6.519 8.491 1.00 0.00 O ATOM 959 CB LEU A 59 5.589 4.861 7.789 1.00 0.00 C ATOM 960 CG LEU A 59 4.112 4.601 7.489 1.00 0.00 C ATOM 961 CD1 LEU A 59 3.911 3.187 6.970 1.00 0.00 C ATOM 962 CD2 LEU A 59 3.265 4.845 8.729 1.00 0.00 C ATOM 0 H LEU A 59 6.778 6.181 5.965 1.00 0.00 H new ATOM 0 HA LEU A 59 5.108 6.892 8.267 1.00 0.00 H new ATOM 0 HB2 LEU A 59 6.192 4.397 7.008 1.00 0.00 H new ATOM 0 HB3 LEU A 59 5.848 4.369 8.726 1.00 0.00 H new ATOM 0 HG LEU A 59 3.791 5.296 6.713 1.00 0.00 H new ATOM 0 HD11 LEU A 59 2.854 3.022 6.763 1.00 0.00 H new ATOM 0 HD12 LEU A 59 4.486 3.050 6.054 1.00 0.00 H new ATOM 0 HD13 LEU A 59 4.249 2.472 7.720 1.00 0.00 H new ATOM 0 HD21 LEU A 59 2.217 4.655 8.497 1.00 0.00 H new ATOM 0 HD22 LEU A 59 3.587 4.176 9.527 1.00 0.00 H new ATOM 0 HD23 LEU A 59 3.383 5.879 9.053 1.00 0.00 H new ATOM 974 N SER A 60 6.770 6.743 10.140 1.00 0.00 N ATOM 975 CA SER A 60 7.764 6.976 11.184 1.00 0.00 C ATOM 976 C SER A 60 8.477 5.690 11.588 1.00 0.00 C ATOM 977 O SER A 60 9.528 5.733 12.229 1.00 0.00 O ATOM 978 CB SER A 60 7.101 7.608 12.410 1.00 0.00 C ATOM 979 OG SER A 60 8.047 7.843 13.439 1.00 0.00 O ATOM 0 H SER A 60 5.805 6.748 10.471 1.00 0.00 H new ATOM 0 HA SER A 60 8.511 7.658 10.778 1.00 0.00 H new ATOM 0 HB2 SER A 60 6.627 8.548 12.127 1.00 0.00 H new ATOM 0 HB3 SER A 60 6.313 6.952 12.780 1.00 0.00 H new ATOM 0 HG SER A 60 8.799 7.222 13.340 1.00 0.00 H new ATOM 985 N ASP A 61 7.910 4.548 11.215 1.00 0.00 N ATOM 986 CA ASP A 61 8.511 3.262 11.553 1.00 0.00 C ATOM 987 C ASP A 61 9.746 3.009 10.700 1.00 0.00 C ATOM 988 O ASP A 61 10.617 2.220 11.064 1.00 0.00 O ATOM 989 CB ASP A 61 7.502 2.130 11.358 1.00 0.00 C ATOM 990 CG ASP A 61 7.930 0.848 12.045 1.00 0.00 C ATOM 991 OD1 ASP A 61 8.992 0.304 11.679 1.00 0.00 O ATOM 992 OD2 ASP A 61 7.204 0.392 12.953 1.00 0.00 O ATOM 0 H ASP A 61 7.042 4.485 10.683 1.00 0.00 H new ATOM 0 HA ASP A 61 8.808 3.291 12.601 1.00 0.00 H new ATOM 0 HB2 ASP A 61 6.532 2.441 11.747 1.00 0.00 H new ATOM 0 HB3 ASP A 61 7.373 1.942 10.292 1.00 0.00 H new ATOM 997 N GLY A 62 9.816 3.692 9.563 1.00 0.00 N ATOM 998 CA GLY A 62 10.943 3.527 8.666 1.00 0.00 C ATOM 999 C GLY A 62 10.510 3.027 7.304 1.00 0.00 C ATOM 1000 O GLY A 62 11.328 2.891 6.394 1.00 0.00 O ATOM 0 H GLY A 62 9.111 4.358 9.247 1.00 0.00 H new ATOM 0 HA2 GLY A 62 11.462 4.479 8.555 1.00 0.00 H new ATOM 0 HA3 GLY A 62 11.654 2.825 9.101 1.00 0.00 H new ATOM 1004 N GLY A 63 9.217 2.752 7.168 1.00 0.00 N ATOM 1005 CA GLY A 63 8.687 2.271 5.909 1.00 0.00 C ATOM 1006 C GLY A 63 7.978 3.362 5.135 1.00 0.00 C ATOM 1007 O GLY A 63 8.354 4.532 5.219 1.00 0.00 O ATOM 0 H GLY A 63 8.526 2.855 7.911 1.00 0.00 H new ATOM 0 HA2 GLY A 63 9.500 1.868 5.305 1.00 0.00 H new ATOM 0 HA3 GLY A 63 7.993 1.452 6.098 1.00 0.00 H new ATOM 1011 N PHE A 64 6.946 2.982 4.388 1.00 0.00 N ATOM 1012 CA PHE A 64 6.183 3.938 3.593 1.00 0.00 C ATOM 1013 C PHE A 64 5.053 3.239 2.844 1.00 0.00 C ATOM 1014 O PHE A 64 5.174 2.073 2.468 1.00 0.00 O ATOM 1015 CB PHE A 64 7.099 4.645 2.591 1.00 0.00 C ATOM 1016 CG PHE A 64 7.579 3.748 1.488 1.00 0.00 C ATOM 1017 CD1 PHE A 64 8.653 2.897 1.687 1.00 0.00 C ATOM 1018 CD2 PHE A 64 6.949 3.749 0.253 1.00 0.00 C ATOM 1019 CE1 PHE A 64 9.092 2.065 0.675 1.00 0.00 C ATOM 1020 CE2 PHE A 64 7.383 2.921 -0.761 1.00 0.00 C ATOM 1021 CZ PHE A 64 8.456 2.077 -0.551 1.00 0.00 C ATOM 0 H PHE A 64 6.619 2.019 4.317 1.00 0.00 H new ATOM 0 HA PHE A 64 5.753 4.674 4.272 1.00 0.00 H new ATOM 0 HB2 PHE A 64 6.566 5.490 2.156 1.00 0.00 H new ATOM 0 HB3 PHE A 64 7.961 5.050 3.121 1.00 0.00 H new ATOM 0 HD1 PHE A 64 9.153 2.883 2.644 1.00 0.00 H new ATOM 0 HD2 PHE A 64 6.109 4.406 0.083 1.00 0.00 H new ATOM 0 HE1 PHE A 64 9.931 1.406 0.842 1.00 0.00 H new ATOM 0 HE2 PHE A 64 6.884 2.933 -1.719 1.00 0.00 H new ATOM 0 HZ PHE A 64 8.797 1.428 -1.344 1.00 0.00 H new ATOM 1031 N TYR A 65 3.957 3.956 2.632 1.00 0.00 N ATOM 1032 CA TYR A 65 2.816 3.399 1.912 1.00 0.00 C ATOM 1033 C TYR A 65 2.248 4.411 0.913 1.00 0.00 C ATOM 1034 O TYR A 65 2.482 5.613 1.028 1.00 0.00 O ATOM 1035 CB TYR A 65 1.733 2.940 2.895 1.00 0.00 C ATOM 1036 CG TYR A 65 0.696 3.992 3.216 1.00 0.00 C ATOM 1037 CD1 TYR A 65 0.918 4.938 4.208 1.00 0.00 C ATOM 1038 CD2 TYR A 65 -0.509 4.033 2.527 1.00 0.00 C ATOM 1039 CE1 TYR A 65 -0.031 5.897 4.504 1.00 0.00 C ATOM 1040 CE2 TYR A 65 -1.463 4.990 2.816 1.00 0.00 C ATOM 1041 CZ TYR A 65 -1.220 5.919 3.804 1.00 0.00 C ATOM 1042 OH TYR A 65 -2.168 6.872 4.097 1.00 0.00 O ATOM 0 H TYR A 65 3.833 4.919 2.946 1.00 0.00 H new ATOM 0 HA TYR A 65 3.161 2.532 1.349 1.00 0.00 H new ATOM 0 HB2 TYR A 65 1.230 2.066 2.481 1.00 0.00 H new ATOM 0 HB3 TYR A 65 2.211 2.624 3.822 1.00 0.00 H new ATOM 0 HD1 TYR A 65 1.848 4.924 4.757 1.00 0.00 H new ATOM 0 HD2 TYR A 65 -0.704 3.305 1.753 1.00 0.00 H new ATOM 0 HE1 TYR A 65 0.156 6.626 5.279 1.00 0.00 H new ATOM 0 HE2 TYR A 65 -2.395 5.010 2.270 1.00 0.00 H new ATOM 0 HH TYR A 65 -3.046 6.566 3.788 1.00 0.00 H new ATOM 1052 N MET A 66 1.500 3.907 -0.065 1.00 0.00 N ATOM 1053 CA MET A 66 0.895 4.751 -1.097 1.00 0.00 C ATOM 1054 C MET A 66 -0.627 4.696 -1.026 1.00 0.00 C ATOM 1055 O MET A 66 -1.213 3.626 -0.862 1.00 0.00 O ATOM 1056 CB MET A 66 1.363 4.303 -2.483 1.00 0.00 C ATOM 1057 CG MET A 66 2.843 4.535 -2.731 1.00 0.00 C ATOM 1058 SD MET A 66 3.473 3.599 -4.140 1.00 0.00 S ATOM 1059 CE MET A 66 2.410 4.192 -5.455 1.00 0.00 C ATOM 0 H MET A 66 1.296 2.913 -0.166 1.00 0.00 H new ATOM 0 HA MET A 66 1.212 5.779 -0.922 1.00 0.00 H new ATOM 0 HB2 MET A 66 1.145 3.242 -2.605 1.00 0.00 H new ATOM 0 HB3 MET A 66 0.789 4.836 -3.241 1.00 0.00 H new ATOM 0 HG2 MET A 66 3.016 5.598 -2.900 1.00 0.00 H new ATOM 0 HG3 MET A 66 3.404 4.259 -1.838 1.00 0.00 H new ATOM 0 HE1 MET A 66 2.748 3.784 -6.408 1.00 0.00 H new ATOM 0 HE2 MET A 66 1.385 3.873 -5.266 1.00 0.00 H new ATOM 0 HE3 MET A 66 2.450 5.281 -5.492 1.00 0.00 H new ATOM 1069 N ALA A 67 -1.259 5.859 -1.152 1.00 0.00 N ATOM 1070 CA ALA A 67 -2.713 5.946 -1.108 1.00 0.00 C ATOM 1071 C ALA A 67 -3.249 6.759 -2.284 1.00 0.00 C ATOM 1072 O ALA A 67 -2.927 7.938 -2.428 1.00 0.00 O ATOM 1073 CB ALA A 67 -3.165 6.565 0.205 1.00 0.00 C ATOM 0 H ALA A 67 -0.787 6.753 -1.285 1.00 0.00 H new ATOM 0 HA ALA A 67 -3.114 4.935 -1.181 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -4.253 6.624 0.224 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -2.820 5.949 1.035 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -2.746 7.567 0.298 1.00 0.00 H new ATOM 1079 N PRO A 68 -4.079 6.138 -3.143 1.00 0.00 N ATOM 1080 CA PRO A 68 -4.663 6.821 -4.301 1.00 0.00 C ATOM 1081 C PRO A 68 -5.418 8.080 -3.890 1.00 0.00 C ATOM 1082 O PRO A 68 -5.793 8.236 -2.729 1.00 0.00 O ATOM 1083 CB PRO A 68 -5.625 5.783 -4.889 1.00 0.00 C ATOM 1084 CG PRO A 68 -5.122 4.469 -4.400 1.00 0.00 C ATOM 1085 CD PRO A 68 -4.509 4.732 -3.054 1.00 0.00 C ATOM 0 HA PRO A 68 -3.904 7.154 -5.009 1.00 0.00 H new ATOM 0 HB2 PRO A 68 -6.648 5.962 -4.558 1.00 0.00 H new ATOM 0 HB3 PRO A 68 -5.631 5.823 -5.978 1.00 0.00 H new ATOM 0 HG2 PRO A 68 -5.933 3.745 -4.324 1.00 0.00 H new ATOM 0 HG3 PRO A 68 -4.387 4.053 -5.088 1.00 0.00 H new ATOM 0 HD2 PRO A 68 -5.228 4.582 -2.249 1.00 0.00 H new ATOM 0 HD3 PRO A 68 -3.668 4.066 -2.858 1.00 0.00 H new ATOM 1093 N ASP A 69 -5.634 8.981 -4.843 1.00 0.00 N ATOM 1094 CA ASP A 69 -6.341 10.225 -4.563 1.00 0.00 C ATOM 1095 C ASP A 69 -7.787 10.161 -5.046 1.00 0.00 C ATOM 1096 O ASP A 69 -8.090 10.529 -6.181 1.00 0.00 O ATOM 1097 CB ASP A 69 -5.624 11.402 -5.223 1.00 0.00 C ATOM 1098 CG ASP A 69 -6.269 12.733 -4.889 1.00 0.00 C ATOM 1099 OD1 ASP A 69 -5.884 13.339 -3.866 1.00 0.00 O ATOM 1100 OD2 ASP A 69 -7.160 13.169 -5.648 1.00 0.00 O ATOM 0 H ASP A 69 -5.331 8.874 -5.811 1.00 0.00 H new ATOM 0 HA ASP A 69 -6.348 10.369 -3.483 1.00 0.00 H new ATOM 0 HB2 ASP A 69 -4.582 11.415 -4.902 1.00 0.00 H new ATOM 0 HB3 ASP A 69 -5.623 11.263 -6.304 1.00 0.00 H new ATOM 1105 N LEU A 70 -8.673 9.682 -4.179 1.00 0.00 N ATOM 1106 CA LEU A 70 -10.090 9.579 -4.512 1.00 0.00 C ATOM 1107 C LEU A 70 -10.961 9.913 -3.305 1.00 0.00 C ATOM 1108 O LEU A 70 -11.004 9.165 -2.329 1.00 0.00 O ATOM 1109 CB LEU A 70 -10.419 8.176 -5.029 1.00 0.00 C ATOM 1110 CG LEU A 70 -9.811 7.827 -6.390 1.00 0.00 C ATOM 1111 CD1 LEU A 70 -10.106 6.379 -6.752 1.00 0.00 C ATOM 1112 CD2 LEU A 70 -10.336 8.764 -7.467 1.00 0.00 C ATOM 0 H LEU A 70 -8.436 9.359 -3.241 1.00 0.00 H new ATOM 0 HA LEU A 70 -10.304 10.302 -5.299 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -10.075 7.446 -4.297 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -11.502 8.075 -5.095 1.00 0.00 H new ATOM 0 HG LEU A 70 -8.730 7.951 -6.324 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -9.666 6.150 -7.722 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -9.679 5.721 -5.995 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -11.185 6.228 -6.798 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -9.892 8.500 -8.427 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -11.420 8.673 -7.531 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -10.072 9.791 -7.216 1.00 0.00 H new ATOM 1124 N ALA A 71 -11.654 11.044 -3.385 1.00 0.00 N ATOM 1125 CA ALA A 71 -12.523 11.488 -2.300 1.00 0.00 C ATOM 1126 C ALA A 71 -13.950 10.985 -2.493 1.00 0.00 C ATOM 1127 O ALA A 71 -14.642 11.393 -3.425 1.00 0.00 O ATOM 1128 CB ALA A 71 -12.505 13.006 -2.198 1.00 0.00 C ATOM 0 H ALA A 71 -11.631 11.670 -4.190 1.00 0.00 H new ATOM 0 HA ALA A 71 -12.143 11.067 -1.369 1.00 0.00 H new ATOM 0 HB1 ALA A 71 -13.157 13.324 -1.385 1.00 0.00 H new ATOM 0 HB2 ALA A 71 -11.488 13.345 -2.001 1.00 0.00 H new ATOM 0 HB3 ALA A 71 -12.857 13.438 -3.135 1.00 0.00 H new ATOM 1134 N GLY A 72 -14.382 10.096 -1.604 1.00 0.00 N ATOM 1135 CA GLY A 72 -15.724 9.550 -1.689 1.00 0.00 C ATOM 1136 C GLY A 72 -15.797 8.105 -1.234 1.00 0.00 C ATOM 1137 O GLY A 72 -14.900 7.617 -0.547 1.00 0.00 O ATOM 0 H GLY A 72 -13.826 9.744 -0.825 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -16.397 10.153 -1.079 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -16.076 9.621 -2.718 1.00 0.00 H new ATOM 1141 N ARG A 73 -16.870 7.422 -1.618 1.00 0.00 N ATOM 1142 CA ARG A 73 -17.067 6.027 -1.252 1.00 0.00 C ATOM 1143 C ARG A 73 -16.706 5.116 -2.418 1.00 0.00 C ATOM 1144 O ARG A 73 -17.418 5.056 -3.420 1.00 0.00 O ATOM 1145 CB ARG A 73 -18.517 5.792 -0.827 1.00 0.00 C ATOM 1146 CG ARG A 73 -18.957 6.667 0.337 1.00 0.00 C ATOM 1147 CD ARG A 73 -20.420 6.443 0.682 1.00 0.00 C ATOM 1148 NE ARG A 73 -20.843 7.240 1.830 1.00 0.00 N ATOM 1149 CZ ARG A 73 -21.697 6.806 2.752 1.00 0.00 C ATOM 1150 NH1 ARG A 73 -22.205 5.584 2.668 1.00 0.00 N ATOM 1151 NH2 ARG A 73 -22.042 7.594 3.761 1.00 0.00 N ATOM 0 H ARG A 73 -17.620 7.816 -2.186 1.00 0.00 H new ATOM 0 HA ARG A 73 -16.413 5.792 -0.412 1.00 0.00 H new ATOM 0 HB2 ARG A 73 -19.172 5.978 -1.679 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -18.641 4.745 -0.551 1.00 0.00 H new ATOM 0 HG2 ARG A 73 -18.340 6.451 1.209 1.00 0.00 H new ATOM 0 HG3 ARG A 73 -18.798 7.716 0.085 1.00 0.00 H new ATOM 0 HD2 ARG A 73 -21.038 6.694 -0.180 1.00 0.00 H new ATOM 0 HD3 ARG A 73 -20.584 5.387 0.895 1.00 0.00 H new ATOM 0 HE ARG A 73 -20.463 8.181 1.930 1.00 0.00 H new ATOM 0 HH11 ARG A 73 -21.941 4.974 1.894 1.00 0.00 H new ATOM 0 HH12 ARG A 73 -22.860 5.254 3.377 1.00 0.00 H new ATOM 0 HH21 ARG A 73 -21.652 8.534 3.830 1.00 0.00 H new ATOM 0 HH22 ARG A 73 -22.697 7.260 4.468 1.00 0.00 H new ATOM 1165 N LEU A 74 -15.592 4.410 -2.277 1.00 0.00 N ATOM 1166 CA LEU A 74 -15.119 3.506 -3.319 1.00 0.00 C ATOM 1167 C LEU A 74 -15.439 2.053 -2.985 1.00 0.00 C ATOM 1168 O LEU A 74 -14.913 1.498 -2.021 1.00 0.00 O ATOM 1169 CB LEU A 74 -13.610 3.667 -3.510 1.00 0.00 C ATOM 1170 CG LEU A 74 -13.143 5.087 -3.839 1.00 0.00 C ATOM 1171 CD1 LEU A 74 -11.624 5.160 -3.831 1.00 0.00 C ATOM 1172 CD2 LEU A 74 -13.695 5.533 -5.184 1.00 0.00 C ATOM 0 H LEU A 74 -14.997 4.446 -1.449 1.00 0.00 H new ATOM 0 HA LEU A 74 -15.636 3.766 -4.243 1.00 0.00 H new ATOM 0 HB2 LEU A 74 -13.108 3.338 -2.600 1.00 0.00 H new ATOM 0 HB3 LEU A 74 -13.288 3.001 -4.311 1.00 0.00 H new ATOM 0 HG LEU A 74 -13.524 5.763 -3.073 1.00 0.00 H new ATOM 0 HD11 LEU A 74 -11.307 6.176 -4.067 1.00 0.00 H new ATOM 0 HD12 LEU A 74 -11.252 4.883 -2.845 1.00 0.00 H new ATOM 0 HD13 LEU A 74 -11.223 4.473 -4.576 1.00 0.00 H new ATOM 0 HD21 LEU A 74 -13.352 6.545 -5.401 1.00 0.00 H new ATOM 0 HD22 LEU A 74 -13.345 4.857 -5.964 1.00 0.00 H new ATOM 0 HD23 LEU A 74 -14.784 5.518 -5.153 1.00 0.00 H new ATOM 1184 N GLU A 75 -16.300 1.440 -3.791 1.00 0.00 N ATOM 1185 CA GLU A 75 -16.678 0.046 -3.585 1.00 0.00 C ATOM 1186 C GLU A 75 -15.530 -0.883 -3.969 1.00 0.00 C ATOM 1187 O GLU A 75 -15.455 -1.355 -5.104 1.00 0.00 O ATOM 1188 CB GLU A 75 -17.922 -0.296 -4.409 1.00 0.00 C ATOM 1189 CG GLU A 75 -19.210 0.282 -3.842 1.00 0.00 C ATOM 1190 CD GLU A 75 -19.822 -0.600 -2.772 1.00 0.00 C ATOM 1191 OE1 GLU A 75 -19.196 -0.762 -1.705 1.00 0.00 O ATOM 1192 OE2 GLU A 75 -20.931 -1.128 -3.002 1.00 0.00 O ATOM 0 H GLU A 75 -16.749 1.885 -4.592 1.00 0.00 H new ATOM 0 HA GLU A 75 -16.904 -0.094 -2.528 1.00 0.00 H new ATOM 0 HB2 GLU A 75 -17.786 0.072 -5.426 1.00 0.00 H new ATOM 0 HB3 GLU A 75 -18.018 -1.380 -4.473 1.00 0.00 H new ATOM 0 HG2 GLU A 75 -19.008 1.268 -3.424 1.00 0.00 H new ATOM 0 HG3 GLU A 75 -19.929 0.419 -4.650 1.00 0.00 H new ATOM 1199 N ILE A 76 -14.631 -1.131 -3.021 1.00 0.00 N ATOM 1200 CA ILE A 76 -13.485 -2.000 -3.263 1.00 0.00 C ATOM 1201 C ILE A 76 -13.745 -3.413 -2.748 1.00 0.00 C ATOM 1202 O ILE A 76 -13.771 -3.656 -1.540 1.00 0.00 O ATOM 1203 CB ILE A 76 -12.202 -1.430 -2.615 1.00 0.00 C ATOM 1204 CG1 ILE A 76 -11.567 -0.382 -3.536 1.00 0.00 C ATOM 1205 CG2 ILE A 76 -11.208 -2.541 -2.300 1.00 0.00 C ATOM 1206 CD1 ILE A 76 -10.854 -0.970 -4.736 1.00 0.00 C ATOM 0 H ILE A 76 -14.674 -0.743 -2.079 1.00 0.00 H new ATOM 0 HA ILE A 76 -13.337 -2.045 -4.342 1.00 0.00 H new ATOM 0 HB ILE A 76 -12.476 -0.951 -1.675 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -12.343 0.299 -3.885 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -10.858 0.212 -2.959 1.00 0.00 H new ATOM 0 HG21 ILE A 76 -10.315 -2.112 -1.845 1.00 0.00 H new ATOM 0 HG22 ILE A 76 -11.662 -3.251 -1.608 1.00 0.00 H new ATOM 0 HG23 ILE A 76 -10.934 -3.056 -3.221 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -10.432 -0.166 -5.338 1.00 0.00 H new ATOM 0 HD12 ILE A 76 -10.054 -1.628 -4.397 1.00 0.00 H new ATOM 0 HD13 ILE A 76 -11.563 -1.540 -5.337 1.00 0.00 H new ATOM 1218 N GLU A 77 -13.951 -4.338 -3.680 1.00 0.00 N ATOM 1219 CA GLU A 77 -14.205 -5.732 -3.338 1.00 0.00 C ATOM 1220 C GLU A 77 -12.902 -6.522 -3.310 1.00 0.00 C ATOM 1221 O GLU A 77 -12.362 -6.890 -4.353 1.00 0.00 O ATOM 1222 CB GLU A 77 -15.173 -6.357 -4.343 1.00 0.00 C ATOM 1223 CG GLU A 77 -16.513 -5.644 -4.421 1.00 0.00 C ATOM 1224 CD GLU A 77 -17.451 -6.275 -5.431 1.00 0.00 C ATOM 1225 OE1 GLU A 77 -18.134 -7.258 -5.075 1.00 0.00 O ATOM 1226 OE2 GLU A 77 -17.502 -5.788 -6.581 1.00 0.00 O ATOM 0 H GLU A 77 -13.947 -4.146 -4.682 1.00 0.00 H new ATOM 0 HA GLU A 77 -14.655 -5.765 -2.346 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -14.711 -6.354 -5.330 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -15.341 -7.400 -4.073 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -16.984 -5.654 -3.438 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -16.350 -4.599 -4.686 1.00 0.00 H new ATOM 1233 N VAL A 78 -12.407 -6.786 -2.108 1.00 0.00 N ATOM 1234 CA VAL A 78 -11.160 -7.523 -1.945 1.00 0.00 C ATOM 1235 C VAL A 78 -11.333 -8.995 -2.276 1.00 0.00 C ATOM 1236 O VAL A 78 -11.909 -9.752 -1.493 1.00 0.00 O ATOM 1237 CB VAL A 78 -10.604 -7.408 -0.511 1.00 0.00 C ATOM 1238 CG1 VAL A 78 -9.757 -6.155 -0.360 1.00 0.00 C ATOM 1239 CG2 VAL A 78 -11.725 -7.429 0.508 1.00 0.00 C ATOM 0 H VAL A 78 -12.848 -6.502 -1.233 1.00 0.00 H new ATOM 0 HA VAL A 78 -10.453 -7.071 -2.641 1.00 0.00 H new ATOM 0 HB VAL A 78 -9.966 -8.272 -0.326 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -9.375 -6.094 0.659 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -8.921 -6.194 -1.059 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -10.366 -5.276 -0.572 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -11.306 -7.347 1.511 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -12.398 -6.591 0.326 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -12.278 -8.364 0.421 1.00 0.00 H new ATOM 1249 N ASN A 79 -10.837 -9.404 -3.438 1.00 0.00 N ATOM 1250 CA ASN A 79 -10.918 -10.795 -3.855 1.00 0.00 C ATOM 1251 C ASN A 79 -9.855 -11.630 -3.147 1.00 0.00 C ATOM 1252 O ASN A 79 -9.462 -12.693 -3.628 1.00 0.00 O ATOM 1253 CB ASN A 79 -10.749 -10.909 -5.374 1.00 0.00 C ATOM 1254 CG ASN A 79 -9.727 -9.933 -5.938 1.00 0.00 C ATOM 1255 OD1 ASN A 79 -8.837 -9.428 -5.087 1.00 0.00 O flip ATOM 1256 ND2 ASN A 79 -9.746 -9.625 -7.130 1.00 0.00 N flip ATOM 0 H ASN A 79 -10.374 -8.789 -4.108 1.00 0.00 H new ATOM 0 HA ASN A 79 -11.901 -11.177 -3.581 1.00 0.00 H new ATOM 0 HB2 ASN A 79 -10.447 -11.926 -5.624 1.00 0.00 H new ATOM 0 HB3 ASN A 79 -11.712 -10.735 -5.854 1.00 0.00 H new ATOM 0 HD21 ASN A 79 -10.444 -10.034 -7.751 1.00 0.00 H new ATOM 0 HD22 ASN A 79 -9.064 -8.961 -7.496 1.00 0.00 H new ATOM 1263 N GLY A 80 -9.401 -11.143 -1.994 1.00 0.00 N ATOM 1264 CA GLY A 80 -8.393 -11.852 -1.230 1.00 0.00 C ATOM 1265 C GLY A 80 -8.994 -12.549 -0.029 1.00 0.00 C ATOM 1266 O GLY A 80 -8.512 -13.597 0.401 1.00 0.00 O ATOM 0 H GLY A 80 -9.716 -10.267 -1.576 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -7.900 -12.585 -1.868 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -7.626 -11.151 -0.899 1.00 0.00 H new ATOM 1270 N ASN A 81 -10.056 -11.960 0.510 1.00 0.00 N ATOM 1271 CA ASN A 81 -10.748 -12.526 1.657 1.00 0.00 C ATOM 1272 C ASN A 81 -12.256 -12.420 1.463 1.00 0.00 C ATOM 1273 O ASN A 81 -13.035 -12.725 2.365 1.00 0.00 O ATOM 1274 CB ASN A 81 -10.327 -11.826 2.948 1.00 0.00 C ATOM 1275 CG ASN A 81 -11.079 -10.534 3.184 1.00 0.00 C ATOM 1276 OD1 ASN A 81 -12.156 -10.529 3.779 1.00 0.00 O ATOM 1277 ND2 ASN A 81 -10.511 -9.427 2.725 1.00 0.00 N ATOM 0 H ASN A 81 -10.456 -11.087 0.167 1.00 0.00 H new ATOM 0 HA ASN A 81 -10.475 -13.578 1.738 1.00 0.00 H new ATOM 0 HB2 ASN A 81 -10.492 -12.497 3.791 1.00 0.00 H new ATOM 0 HB3 ASN A 81 -9.258 -11.618 2.911 1.00 0.00 H new ATOM 0 HD21 ASN A 81 -10.968 -8.525 2.860 1.00 0.00 H new ATOM 0 HD22 ASN A 81 -9.617 -9.477 2.237 1.00 0.00 H new ATOM 1284 N GLY A 82 -12.656 -11.985 0.269 1.00 0.00 N ATOM 1285 CA GLY A 82 -14.064 -11.853 -0.052 1.00 0.00 C ATOM 1286 C GLY A 82 -14.784 -10.777 0.737 1.00 0.00 C ATOM 1287 O GLY A 82 -16.003 -10.848 0.899 1.00 0.00 O ATOM 0 H GLY A 82 -12.022 -11.720 -0.485 1.00 0.00 H new ATOM 0 HA2 GLY A 82 -14.164 -11.636 -1.115 1.00 0.00 H new ATOM 0 HA3 GLY A 82 -14.557 -12.809 0.126 1.00 0.00 H new ATOM 1291 N PHE A 83 -14.058 -9.777 1.235 1.00 0.00 N ATOM 1292 CA PHE A 83 -14.704 -8.709 1.997 1.00 0.00 C ATOM 1293 C PHE A 83 -15.230 -7.614 1.077 1.00 0.00 C ATOM 1294 O PHE A 83 -14.514 -6.676 0.731 1.00 0.00 O ATOM 1295 CB PHE A 83 -13.752 -8.111 3.034 1.00 0.00 C ATOM 1296 CG PHE A 83 -14.337 -6.940 3.773 1.00 0.00 C ATOM 1297 CD1 PHE A 83 -15.479 -7.091 4.544 1.00 0.00 C ATOM 1298 CD2 PHE A 83 -13.748 -5.688 3.693 1.00 0.00 C ATOM 1299 CE1 PHE A 83 -16.022 -6.017 5.222 1.00 0.00 C ATOM 1300 CE2 PHE A 83 -14.287 -4.610 4.370 1.00 0.00 C ATOM 1301 CZ PHE A 83 -15.425 -4.774 5.136 1.00 0.00 C ATOM 0 H PHE A 83 -13.048 -9.683 1.129 1.00 0.00 H new ATOM 0 HA PHE A 83 -15.549 -9.155 2.522 1.00 0.00 H new ATOM 0 HB2 PHE A 83 -13.476 -8.884 3.752 1.00 0.00 H new ATOM 0 HB3 PHE A 83 -12.835 -7.796 2.536 1.00 0.00 H new ATOM 0 HD1 PHE A 83 -15.950 -8.060 4.615 1.00 0.00 H new ATOM 0 HD2 PHE A 83 -12.859 -5.553 3.095 1.00 0.00 H new ATOM 0 HE1 PHE A 83 -16.912 -6.149 5.819 1.00 0.00 H new ATOM 0 HE2 PHE A 83 -13.818 -3.639 4.300 1.00 0.00 H new ATOM 0 HZ PHE A 83 -15.847 -3.933 5.666 1.00 0.00 H new ATOM 1311 N ARG A 84 -16.492 -7.745 0.685 1.00 0.00 N ATOM 1312 CA ARG A 84 -17.124 -6.764 -0.182 1.00 0.00 C ATOM 1313 C ARG A 84 -17.558 -5.553 0.632 1.00 0.00 C ATOM 1314 O ARG A 84 -18.452 -5.645 1.473 1.00 0.00 O ATOM 1315 CB ARG A 84 -18.326 -7.384 -0.896 1.00 0.00 C ATOM 1316 CG ARG A 84 -18.985 -6.455 -1.904 1.00 0.00 C ATOM 1317 CD ARG A 84 -20.172 -7.123 -2.580 1.00 0.00 C ATOM 1318 NE ARG A 84 -20.772 -6.269 -3.601 1.00 0.00 N ATOM 1319 CZ ARG A 84 -21.966 -6.494 -4.143 1.00 0.00 C ATOM 1320 NH1 ARG A 84 -22.687 -7.538 -3.758 1.00 0.00 N ATOM 1321 NH2 ARG A 84 -22.440 -5.673 -5.071 1.00 0.00 N ATOM 0 H ARG A 84 -17.096 -8.522 0.955 1.00 0.00 H new ATOM 0 HA ARG A 84 -16.404 -6.442 -0.934 1.00 0.00 H new ATOM 0 HB2 ARG A 84 -18.005 -8.291 -1.407 1.00 0.00 H new ATOM 0 HB3 ARG A 84 -19.065 -7.682 -0.152 1.00 0.00 H new ATOM 0 HG2 ARG A 84 -19.315 -5.546 -1.402 1.00 0.00 H new ATOM 0 HG3 ARG A 84 -18.256 -6.157 -2.657 1.00 0.00 H new ATOM 0 HD2 ARG A 84 -19.850 -8.060 -3.034 1.00 0.00 H new ATOM 0 HD3 ARG A 84 -20.922 -7.374 -1.830 1.00 0.00 H new ATOM 0 HE ARG A 84 -20.246 -5.454 -3.917 1.00 0.00 H new ATOM 0 HH11 ARG A 84 -22.327 -8.171 -3.044 1.00 0.00 H new ATOM 0 HH12 ARG A 84 -23.602 -7.708 -4.175 1.00 0.00 H new ATOM 0 HH21 ARG A 84 -21.889 -4.868 -5.370 1.00 0.00 H new ATOM 0 HH22 ARG A 84 -23.356 -5.846 -5.486 1.00 0.00 H new ATOM 1335 N GLY A 85 -16.919 -4.419 0.375 1.00 0.00 N ATOM 1336 CA GLY A 85 -17.243 -3.205 1.102 1.00 0.00 C ATOM 1337 C GLY A 85 -16.704 -1.961 0.428 1.00 0.00 C ATOM 1338 O GLY A 85 -15.892 -2.046 -0.494 1.00 0.00 O ATOM 0 H GLY A 85 -16.182 -4.317 -0.323 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -18.326 -3.122 1.198 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -16.838 -3.271 2.112 1.00 0.00 H new ATOM 1342 N GLU A 86 -17.157 -0.801 0.891 1.00 0.00 N ATOM 1343 CA GLU A 86 -16.716 0.469 0.330 1.00 0.00 C ATOM 1344 C GLU A 86 -15.770 1.188 1.285 1.00 0.00 C ATOM 1345 O GLU A 86 -16.094 1.403 2.453 1.00 0.00 O ATOM 1346 CB GLU A 86 -17.923 1.355 0.016 1.00 0.00 C ATOM 1347 CG GLU A 86 -18.868 1.532 1.192 1.00 0.00 C ATOM 1348 CD GLU A 86 -20.155 2.233 0.805 1.00 0.00 C ATOM 1349 OE1 GLU A 86 -20.157 3.479 0.750 1.00 0.00 O ATOM 1350 OE2 GLU A 86 -21.160 1.536 0.557 1.00 0.00 O ATOM 0 H GLU A 86 -17.829 -0.715 1.653 1.00 0.00 H new ATOM 0 HA GLU A 86 -16.176 0.264 -0.594 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -17.570 2.335 -0.307 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -18.473 0.923 -0.820 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -19.103 0.555 1.614 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -18.367 2.105 1.973 1.00 0.00 H new ATOM 1357 N LEU A 87 -14.598 1.553 0.778 1.00 0.00 N ATOM 1358 CA LEU A 87 -13.595 2.245 1.579 1.00 0.00 C ATOM 1359 C LEU A 87 -13.144 3.527 0.893 1.00 0.00 C ATOM 1360 O LEU A 87 -13.493 3.783 -0.260 1.00 0.00 O ATOM 1361 CB LEU A 87 -12.376 1.346 1.813 1.00 0.00 C ATOM 1362 CG LEU A 87 -12.481 0.375 2.993 1.00 0.00 C ATOM 1363 CD1 LEU A 87 -12.803 1.124 4.279 1.00 0.00 C ATOM 1364 CD2 LEU A 87 -13.523 -0.698 2.718 1.00 0.00 C ATOM 0 H LEU A 87 -14.318 1.380 -0.188 1.00 0.00 H new ATOM 0 HA LEU A 87 -14.052 2.493 2.537 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -12.195 0.768 0.907 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -11.504 1.981 1.966 1.00 0.00 H new ATOM 0 HG LEU A 87 -11.515 -0.115 3.117 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -12.873 0.416 5.105 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -12.014 1.846 4.487 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -13.753 1.647 4.168 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -13.580 -1.376 3.569 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -14.495 -0.230 2.561 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -13.242 -1.258 1.826 1.00 0.00 H new ATOM 1376 N SER A 88 -12.368 4.328 1.610 1.00 0.00 N ATOM 1377 CA SER A 88 -11.852 5.575 1.066 1.00 0.00 C ATOM 1378 C SER A 88 -10.547 5.315 0.325 1.00 0.00 C ATOM 1379 O SER A 88 -9.950 4.249 0.470 1.00 0.00 O ATOM 1380 CB SER A 88 -11.628 6.595 2.184 1.00 0.00 C ATOM 1381 OG SER A 88 -12.836 6.876 2.869 1.00 0.00 O ATOM 0 H SER A 88 -12.082 4.136 2.570 1.00 0.00 H new ATOM 0 HA SER A 88 -12.584 5.982 0.369 1.00 0.00 H new ATOM 0 HB2 SER A 88 -10.889 6.212 2.887 1.00 0.00 H new ATOM 0 HB3 SER A 88 -11.222 7.515 1.764 1.00 0.00 H new ATOM 0 HG SER A 88 -12.665 7.529 3.579 1.00 0.00 H new ATOM 1387 N ALA A 89 -10.110 6.283 -0.471 1.00 0.00 N ATOM 1388 CA ALA A 89 -8.872 6.138 -1.226 1.00 0.00 C ATOM 1389 C ALA A 89 -7.712 5.801 -0.302 1.00 0.00 C ATOM 1390 O ALA A 89 -6.748 5.150 -0.708 1.00 0.00 O ATOM 1391 CB ALA A 89 -8.577 7.405 -2.011 1.00 0.00 C ATOM 0 H ALA A 89 -10.591 7.172 -0.610 1.00 0.00 H new ATOM 0 HA ALA A 89 -8.996 5.315 -1.930 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -7.649 7.280 -2.569 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -9.394 7.602 -2.705 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -8.476 8.244 -1.323 1.00 0.00 H new ATOM 1397 N ASP A 90 -7.812 6.247 0.943 1.00 0.00 N ATOM 1398 CA ASP A 90 -6.780 5.987 1.934 1.00 0.00 C ATOM 1399 C ASP A 90 -6.924 4.578 2.500 1.00 0.00 C ATOM 1400 O ASP A 90 -5.994 3.777 2.435 1.00 0.00 O ATOM 1401 CB ASP A 90 -6.854 7.014 3.065 1.00 0.00 C ATOM 1402 CG ASP A 90 -5.688 6.903 4.026 1.00 0.00 C ATOM 1403 OD1 ASP A 90 -5.694 5.976 4.864 1.00 0.00 O ATOM 1404 OD2 ASP A 90 -4.767 7.742 3.941 1.00 0.00 O ATOM 0 H ASP A 90 -8.601 6.792 1.290 1.00 0.00 H new ATOM 0 HA ASP A 90 -5.809 6.071 1.445 1.00 0.00 H new ATOM 0 HB2 ASP A 90 -6.876 8.017 2.640 1.00 0.00 H new ATOM 0 HB3 ASP A 90 -7.787 6.880 3.613 1.00 0.00 H new ATOM 1409 N ALA A 91 -8.103 4.278 3.045 1.00 0.00 N ATOM 1410 CA ALA A 91 -8.368 2.965 3.628 1.00 0.00 C ATOM 1411 C ALA A 91 -8.225 1.855 2.592 1.00 0.00 C ATOM 1412 O ALA A 91 -8.083 0.684 2.942 1.00 0.00 O ATOM 1413 CB ALA A 91 -9.756 2.930 4.251 1.00 0.00 C ATOM 0 H ALA A 91 -8.889 4.927 3.094 1.00 0.00 H new ATOM 0 HA ALA A 91 -7.626 2.793 4.408 1.00 0.00 H new ATOM 0 HB1 ALA A 91 -9.937 1.945 4.681 1.00 0.00 H new ATOM 0 HB2 ALA A 91 -9.822 3.685 5.034 1.00 0.00 H new ATOM 0 HB3 ALA A 91 -10.504 3.135 3.485 1.00 0.00 H new ATOM 1419 N ALA A 92 -8.264 2.227 1.316 1.00 0.00 N ATOM 1420 CA ALA A 92 -8.131 1.263 0.235 1.00 0.00 C ATOM 1421 C ALA A 92 -6.688 1.202 -0.237 1.00 0.00 C ATOM 1422 O ALA A 92 -6.198 0.150 -0.648 1.00 0.00 O ATOM 1423 CB ALA A 92 -9.055 1.626 -0.919 1.00 0.00 C ATOM 0 H ALA A 92 -8.387 3.191 1.008 1.00 0.00 H new ATOM 0 HA ALA A 92 -8.418 0.279 0.607 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -8.943 0.894 -1.719 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -10.088 1.628 -0.571 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -8.797 2.616 -1.294 1.00 0.00 H new ATOM 1429 N GLY A 93 -6.011 2.346 -0.176 1.00 0.00 N ATOM 1430 CA GLY A 93 -4.625 2.408 -0.583 1.00 0.00 C ATOM 1431 C GLY A 93 -3.748 1.538 0.290 1.00 0.00 C ATOM 1432 O GLY A 93 -2.668 1.118 -0.125 1.00 0.00 O ATOM 0 H GLY A 93 -6.402 3.230 0.149 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -4.536 2.089 -1.622 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -4.277 3.440 -0.535 1.00 0.00 H new ATOM 1436 N ILE A 94 -4.219 1.267 1.504 1.00 0.00 N ATOM 1437 CA ILE A 94 -3.475 0.431 2.439 1.00 0.00 C ATOM 1438 C ILE A 94 -3.413 -1.000 1.927 1.00 0.00 C ATOM 1439 O ILE A 94 -2.350 -1.620 1.896 1.00 0.00 O ATOM 1440 CB ILE A 94 -4.124 0.419 3.841 1.00 0.00 C ATOM 1441 CG1 ILE A 94 -4.712 1.791 4.187 1.00 0.00 C ATOM 1442 CG2 ILE A 94 -3.107 -0.006 4.890 1.00 0.00 C ATOM 1443 CD1 ILE A 94 -3.706 2.921 4.150 1.00 0.00 C ATOM 0 H ILE A 94 -5.109 1.613 1.862 1.00 0.00 H new ATOM 0 HA ILE A 94 -2.473 0.854 2.518 1.00 0.00 H new ATOM 0 HB ILE A 94 -4.940 -0.303 3.832 1.00 0.00 H new ATOM 0 HG12 ILE A 94 -5.519 2.015 3.490 1.00 0.00 H new ATOM 0 HG13 ILE A 94 -5.154 1.745 5.182 1.00 0.00 H new ATOM 0 HG21 ILE A 94 -3.578 -0.010 5.873 1.00 0.00 H new ATOM 0 HG22 ILE A 94 -2.742 -1.007 4.659 1.00 0.00 H new ATOM 0 HG23 ILE A 94 -2.271 0.694 4.891 1.00 0.00 H new ATOM 0 HD11 ILE A 94 -4.201 3.858 4.406 1.00 0.00 H new ATOM 0 HD12 ILE A 94 -2.910 2.723 4.868 1.00 0.00 H new ATOM 0 HD13 ILE A 94 -3.281 2.997 3.149 1.00 0.00 H new ATOM 1455 N VAL A 95 -4.569 -1.511 1.522 1.00 0.00 N ATOM 1456 CA VAL A 95 -4.683 -2.867 1.007 1.00 0.00 C ATOM 1457 C VAL A 95 -4.014 -3.001 -0.358 1.00 0.00 C ATOM 1458 O VAL A 95 -3.635 -4.097 -0.768 1.00 0.00 O ATOM 1459 CB VAL A 95 -6.162 -3.281 0.885 1.00 0.00 C ATOM 1460 CG1 VAL A 95 -6.284 -4.749 0.514 1.00 0.00 C ATOM 1461 CG2 VAL A 95 -6.904 -2.988 2.179 1.00 0.00 C ATOM 0 H VAL A 95 -5.450 -0.998 1.542 1.00 0.00 H new ATOM 0 HA VAL A 95 -4.177 -3.524 1.714 1.00 0.00 H new ATOM 0 HB VAL A 95 -6.617 -2.694 0.087 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -7.337 -5.018 0.434 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -5.791 -4.925 -0.442 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -5.812 -5.359 1.284 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -7.947 -3.286 2.076 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -6.446 -3.546 2.995 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -6.851 -1.921 2.395 1.00 0.00 H new ATOM 1471 N ALA A 96 -3.868 -1.879 -1.057 1.00 0.00 N ATOM 1472 CA ALA A 96 -3.253 -1.879 -2.378 1.00 0.00 C ATOM 1473 C ALA A 96 -1.739 -2.034 -2.291 1.00 0.00 C ATOM 1474 O ALA A 96 -1.148 -2.851 -2.997 1.00 0.00 O ATOM 1475 CB ALA A 96 -3.609 -0.601 -3.121 1.00 0.00 C ATOM 0 H ALA A 96 -4.167 -0.960 -0.730 1.00 0.00 H new ATOM 0 HA ALA A 96 -3.643 -2.735 -2.928 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -3.144 -0.612 -4.107 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -4.691 -0.534 -3.231 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -3.247 0.260 -2.559 1.00 0.00 H new ATOM 1481 N THR A 97 -1.115 -1.247 -1.420 1.00 0.00 N ATOM 1482 CA THR A 97 0.332 -1.296 -1.248 1.00 0.00 C ATOM 1483 C THR A 97 0.759 -2.535 -0.467 1.00 0.00 C ATOM 1484 O THR A 97 1.746 -3.185 -0.817 1.00 0.00 O ATOM 1485 CB THR A 97 0.858 -0.036 -0.535 1.00 0.00 C ATOM 1486 OG1 THR A 97 2.255 -0.179 -0.255 1.00 0.00 O ATOM 1487 CG2 THR A 97 0.100 0.218 0.757 1.00 0.00 C ATOM 0 H THR A 97 -1.588 -0.569 -0.823 1.00 0.00 H new ATOM 0 HA THR A 97 0.765 -1.342 -2.247 1.00 0.00 H new ATOM 0 HB THR A 97 0.704 0.816 -1.197 1.00 0.00 H new ATOM 0 HG1 THR A 97 2.582 0.627 0.197 1.00 0.00 H new ATOM 0 HG21 THR A 97 0.492 1.113 1.239 1.00 0.00 H new ATOM 0 HG22 THR A 97 -0.958 0.359 0.536 1.00 0.00 H new ATOM 0 HG23 THR A 97 0.221 -0.636 1.424 1.00 0.00 H new ATOM 1495 N LEU A 98 0.019 -2.858 0.591 1.00 0.00 N ATOM 1496 CA LEU A 98 0.331 -4.026 1.412 1.00 0.00 C ATOM 1497 C LEU A 98 0.428 -5.290 0.563 1.00 0.00 C ATOM 1498 O LEU A 98 1.423 -6.012 0.623 1.00 0.00 O ATOM 1499 CB LEU A 98 -0.729 -4.214 2.501 1.00 0.00 C ATOM 1500 CG LEU A 98 -0.613 -3.262 3.692 1.00 0.00 C ATOM 1501 CD1 LEU A 98 -1.823 -3.401 4.605 1.00 0.00 C ATOM 1502 CD2 LEU A 98 0.672 -3.526 4.464 1.00 0.00 C ATOM 0 H LEU A 98 -0.798 -2.330 0.899 1.00 0.00 H new ATOM 0 HA LEU A 98 1.300 -3.851 1.880 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -1.714 -4.090 2.052 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -0.672 -5.239 2.868 1.00 0.00 H new ATOM 0 HG LEU A 98 -0.582 -2.240 3.314 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -1.724 -2.716 5.447 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -2.729 -3.162 4.048 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -1.884 -4.425 4.975 1.00 0.00 H new ATOM 0 HD21 LEU A 98 0.737 -2.839 5.308 1.00 0.00 H new ATOM 0 HD22 LEU A 98 0.672 -4.552 4.831 1.00 0.00 H new ATOM 0 HD23 LEU A 98 1.529 -3.376 3.807 1.00 0.00 H new ATOM 1514 N PHE A 99 -0.612 -5.555 -0.225 1.00 0.00 N ATOM 1515 CA PHE A 99 -0.639 -6.733 -1.087 1.00 0.00 C ATOM 1516 C PHE A 99 0.568 -6.755 -2.019 1.00 0.00 C ATOM 1517 O PHE A 99 1.110 -7.817 -2.326 1.00 0.00 O ATOM 1518 CB PHE A 99 -1.932 -6.770 -1.903 1.00 0.00 C ATOM 1519 CG PHE A 99 -3.020 -7.587 -1.265 1.00 0.00 C ATOM 1520 CD1 PHE A 99 -3.814 -7.051 -0.265 1.00 0.00 C ATOM 1521 CD2 PHE A 99 -3.246 -8.894 -1.668 1.00 0.00 C ATOM 1522 CE1 PHE A 99 -4.815 -7.804 0.322 1.00 0.00 C ATOM 1523 CE2 PHE A 99 -4.245 -9.650 -1.085 1.00 0.00 C ATOM 1524 CZ PHE A 99 -5.030 -9.105 -0.089 1.00 0.00 C ATOM 0 H PHE A 99 -1.446 -4.970 -0.284 1.00 0.00 H new ATOM 0 HA PHE A 99 -0.598 -7.616 -0.450 1.00 0.00 H new ATOM 0 HB2 PHE A 99 -2.291 -5.751 -2.047 1.00 0.00 H new ATOM 0 HB3 PHE A 99 -1.717 -7.175 -2.892 1.00 0.00 H new ATOM 0 HD1 PHE A 99 -3.650 -6.034 0.060 1.00 0.00 H new ATOM 0 HD2 PHE A 99 -2.634 -9.326 -2.446 1.00 0.00 H new ATOM 0 HE1 PHE A 99 -5.428 -7.375 1.101 1.00 0.00 H new ATOM 0 HE2 PHE A 99 -4.412 -10.667 -1.409 1.00 0.00 H new ATOM 0 HZ PHE A 99 -5.811 -9.695 0.368 1.00 0.00 H new ATOM 1534 N ALA A 100 0.983 -5.575 -2.467 1.00 0.00 N ATOM 1535 CA ALA A 100 2.129 -5.456 -3.358 1.00 0.00 C ATOM 1536 C ALA A 100 3.401 -5.920 -2.659 1.00 0.00 C ATOM 1537 O ALA A 100 4.261 -6.559 -3.268 1.00 0.00 O ATOM 1538 CB ALA A 100 2.280 -4.019 -3.836 1.00 0.00 C ATOM 0 H ALA A 100 0.542 -4.687 -2.227 1.00 0.00 H new ATOM 0 HA ALA A 100 1.960 -6.095 -4.225 1.00 0.00 H new ATOM 0 HB1 ALA A 100 3.140 -3.945 -4.501 1.00 0.00 H new ATOM 0 HB2 ALA A 100 1.380 -3.717 -4.372 1.00 0.00 H new ATOM 0 HB3 ALA A 100 2.428 -3.364 -2.978 1.00 0.00 H new ATOM 1544 N LEU A 101 3.511 -5.592 -1.377 1.00 0.00 N ATOM 1545 CA LEU A 101 4.672 -5.974 -0.580 1.00 0.00 C ATOM 1546 C LEU A 101 4.828 -7.491 -0.532 1.00 0.00 C ATOM 1547 O LEU A 101 5.935 -8.016 -0.648 1.00 0.00 O ATOM 1548 CB LEU A 101 4.539 -5.421 0.841 1.00 0.00 C ATOM 1549 CG LEU A 101 4.501 -3.895 0.947 1.00 0.00 C ATOM 1550 CD1 LEU A 101 4.130 -3.465 2.359 1.00 0.00 C ATOM 1551 CD2 LEU A 101 5.842 -3.300 0.541 1.00 0.00 C ATOM 0 H LEU A 101 2.807 -5.060 -0.865 1.00 0.00 H new ATOM 0 HA LEU A 101 5.560 -5.552 -1.051 1.00 0.00 H new ATOM 0 HB2 LEU A 101 3.629 -5.823 1.286 1.00 0.00 H new ATOM 0 HB3 LEU A 101 5.374 -5.790 1.436 1.00 0.00 H new ATOM 0 HG LEU A 101 3.738 -3.521 0.265 1.00 0.00 H new ATOM 0 HD11 LEU A 101 4.108 -2.377 2.414 1.00 0.00 H new ATOM 0 HD12 LEU A 101 3.147 -3.861 2.613 1.00 0.00 H new ATOM 0 HD13 LEU A 101 4.869 -3.849 3.062 1.00 0.00 H new ATOM 0 HD21 LEU A 101 5.798 -2.214 0.622 1.00 0.00 H new ATOM 0 HD22 LEU A 101 6.623 -3.681 1.198 1.00 0.00 H new ATOM 0 HD23 LEU A 101 6.067 -3.578 -0.489 1.00 0.00 H new ATOM 1563 N GLY A 102 3.709 -8.189 -0.360 1.00 0.00 N ATOM 1564 CA GLY A 102 3.737 -9.640 -0.290 1.00 0.00 C ATOM 1565 C GLY A 102 4.056 -10.298 -1.620 1.00 0.00 C ATOM 1566 O GLY A 102 4.678 -11.360 -1.656 1.00 0.00 O ATOM 0 H GLY A 102 2.781 -7.775 -0.268 1.00 0.00 H new ATOM 0 HA2 GLY A 102 4.479 -9.947 0.447 1.00 0.00 H new ATOM 0 HA3 GLY A 102 2.770 -9.999 0.063 1.00 0.00 H new ATOM 1570 N GLN A 103 3.635 -9.673 -2.715 1.00 0.00 N ATOM 1571 CA GLN A 103 3.879 -10.224 -4.046 1.00 0.00 C ATOM 1572 C GLN A 103 5.339 -10.059 -4.457 1.00 0.00 C ATOM 1573 O GLN A 103 5.973 -11.009 -4.916 1.00 0.00 O ATOM 1574 CB GLN A 103 2.970 -9.560 -5.082 1.00 0.00 C ATOM 1575 CG GLN A 103 3.239 -10.024 -6.507 1.00 0.00 C ATOM 1576 CD GLN A 103 2.311 -9.382 -7.519 1.00 0.00 C ATOM 1577 OE1 GLN A 103 1.149 -9.103 -7.226 1.00 0.00 O ATOM 1578 NE2 GLN A 103 2.825 -9.132 -8.717 1.00 0.00 N ATOM 0 H GLN A 103 3.126 -8.789 -2.709 1.00 0.00 H new ATOM 0 HA GLN A 103 3.652 -11.289 -4.005 1.00 0.00 H new ATOM 0 HB2 GLN A 103 1.930 -9.769 -4.830 1.00 0.00 H new ATOM 0 HB3 GLN A 103 3.100 -8.479 -5.029 1.00 0.00 H new ATOM 0 HG2 GLN A 103 4.271 -9.794 -6.770 1.00 0.00 H new ATOM 0 HG3 GLN A 103 3.131 -11.107 -6.558 1.00 0.00 H new ATOM 0 HE21 GLN A 103 3.794 -9.380 -8.918 1.00 0.00 H new ATOM 0 HE22 GLN A 103 2.251 -8.692 -9.436 1.00 0.00 H new ATOM 1587 N LEU A 104 5.865 -8.850 -4.292 1.00 0.00 N ATOM 1588 CA LEU A 104 7.244 -8.563 -4.648 1.00 0.00 C ATOM 1589 C LEU A 104 8.202 -9.449 -3.861 1.00 0.00 C ATOM 1590 O LEU A 104 9.193 -9.943 -4.399 1.00 0.00 O ATOM 1591 CB LEU A 104 7.550 -7.091 -4.389 1.00 0.00 C ATOM 1592 CG LEU A 104 8.865 -6.599 -4.981 1.00 0.00 C ATOM 1593 CD1 LEU A 104 8.853 -6.750 -6.495 1.00 0.00 C ATOM 1594 CD2 LEU A 104 9.118 -5.153 -4.588 1.00 0.00 C ATOM 0 H LEU A 104 5.353 -8.053 -3.913 1.00 0.00 H new ATOM 0 HA LEU A 104 7.381 -8.775 -5.708 1.00 0.00 H new ATOM 0 HB2 LEU A 104 6.737 -6.488 -4.794 1.00 0.00 H new ATOM 0 HB3 LEU A 104 7.566 -6.922 -3.312 1.00 0.00 H new ATOM 0 HG LEU A 104 9.675 -7.208 -4.581 1.00 0.00 H new ATOM 0 HD11 LEU A 104 9.799 -6.394 -6.904 1.00 0.00 H new ATOM 0 HD12 LEU A 104 8.717 -7.800 -6.755 1.00 0.00 H new ATOM 0 HD13 LEU A 104 8.034 -6.164 -6.913 1.00 0.00 H new ATOM 0 HD21 LEU A 104 10.061 -4.818 -5.020 1.00 0.00 H new ATOM 0 HD22 LEU A 104 8.307 -4.528 -4.960 1.00 0.00 H new ATOM 0 HD23 LEU A 104 9.168 -5.074 -3.502 1.00 0.00 H new ATOM 1606 N ALA A 105 7.898 -9.645 -2.582 1.00 0.00 N ATOM 1607 CA ALA A 105 8.726 -10.478 -1.719 1.00 0.00 C ATOM 1608 C ALA A 105 8.689 -11.931 -2.177 1.00 0.00 C ATOM 1609 O ALA A 105 9.673 -12.660 -2.051 1.00 0.00 O ATOM 1610 CB ALA A 105 8.266 -10.364 -0.273 1.00 0.00 C ATOM 0 H ALA A 105 7.084 -9.238 -2.121 1.00 0.00 H new ATOM 0 HA ALA A 105 9.755 -10.125 -1.785 1.00 0.00 H new ATOM 0 HB1 ALA A 105 8.894 -10.992 0.359 1.00 0.00 H new ATOM 0 HB2 ALA A 105 8.345 -9.327 0.053 1.00 0.00 H new ATOM 0 HB3 ALA A 105 7.229 -10.692 -0.194 1.00 0.00 H new ATOM 1616 N ALA A 106 7.542 -12.346 -2.710 1.00 0.00 N ATOM 1617 CA ALA A 106 7.370 -13.711 -3.194 1.00 0.00 C ATOM 1618 C ALA A 106 7.925 -13.866 -4.605 1.00 0.00 C ATOM 1619 O ALA A 106 8.177 -14.980 -5.065 1.00 0.00 O ATOM 1620 CB ALA A 106 5.901 -14.102 -3.157 1.00 0.00 C ATOM 0 H ALA A 106 6.718 -11.755 -2.817 1.00 0.00 H new ATOM 0 HA ALA A 106 7.929 -14.377 -2.537 1.00 0.00 H new ATOM 0 HB1 ALA A 106 5.787 -15.123 -3.521 1.00 0.00 H new ATOM 0 HB2 ALA A 106 5.533 -14.039 -2.133 1.00 0.00 H new ATOM 0 HB3 ALA A 106 5.328 -13.425 -3.791 1.00 0.00 H new ATOM 1626 N GLU A 107 8.111 -12.740 -5.289 1.00 0.00 N ATOM 1627 CA GLU A 107 8.638 -12.748 -6.649 1.00 0.00 C ATOM 1628 C GLU A 107 10.037 -13.355 -6.672 1.00 0.00 C ATOM 1629 O GLU A 107 10.297 -14.316 -7.397 1.00 0.00 O ATOM 1630 CB GLU A 107 8.669 -11.325 -7.214 1.00 0.00 C ATOM 1631 CG GLU A 107 8.882 -11.262 -8.718 1.00 0.00 C ATOM 1632 CD GLU A 107 10.295 -11.628 -9.131 1.00 0.00 C ATOM 1633 OE1 GLU A 107 11.194 -10.772 -8.995 1.00 0.00 O ATOM 1634 OE2 GLU A 107 10.502 -12.771 -9.589 1.00 0.00 O ATOM 0 H GLU A 107 7.904 -11.811 -4.923 1.00 0.00 H new ATOM 0 HA GLU A 107 7.984 -13.358 -7.272 1.00 0.00 H new ATOM 0 HB2 GLU A 107 7.731 -10.827 -6.969 1.00 0.00 H new ATOM 0 HB3 GLU A 107 9.465 -10.766 -6.721 1.00 0.00 H new ATOM 0 HG2 GLU A 107 8.180 -11.937 -9.208 1.00 0.00 H new ATOM 0 HG3 GLU A 107 8.655 -10.256 -9.070 1.00 0.00 H new ATOM 1750 N LEU A 117 12.442 -6.693 2.847 1.00 0.00 N ATOM 1751 CA LEU A 117 11.408 -5.774 2.402 1.00 0.00 C ATOM 1752 C LEU A 117 10.130 -6.017 3.193 1.00 0.00 C ATOM 1753 O LEU A 117 9.357 -5.095 3.451 1.00 0.00 O ATOM 1754 CB LEU A 117 11.140 -5.970 0.909 1.00 0.00 C ATOM 1755 CG LEU A 117 10.254 -7.169 0.570 1.00 0.00 C ATOM 1756 CD1 LEU A 117 8.793 -6.748 0.498 1.00 0.00 C ATOM 1757 CD2 LEU A 117 10.701 -7.812 -0.732 1.00 0.00 C ATOM 0 HA LEU A 117 11.745 -4.751 2.569 1.00 0.00 H new ATOM 0 HB2 LEU A 117 10.672 -5.067 0.516 1.00 0.00 H new ATOM 0 HB3 LEU A 117 12.094 -6.084 0.395 1.00 0.00 H new ATOM 0 HG LEU A 117 10.354 -7.910 1.363 1.00 0.00 H new ATOM 0 HD11 LEU A 117 8.176 -7.614 0.256 1.00 0.00 H new ATOM 0 HD12 LEU A 117 8.484 -6.340 1.460 1.00 0.00 H new ATOM 0 HD13 LEU A 117 8.671 -5.988 -0.274 1.00 0.00 H new ATOM 0 HD21 LEU A 117 10.059 -8.663 -0.957 1.00 0.00 H new ATOM 0 HD22 LEU A 117 10.633 -7.083 -1.540 1.00 0.00 H new ATOM 0 HD23 LEU A 117 11.732 -8.151 -0.635 1.00 0.00 H new ATOM 1769 N ILE A 118 9.920 -7.278 3.567 1.00 0.00 N ATOM 1770 CA ILE A 118 8.746 -7.674 4.332 1.00 0.00 C ATOM 1771 C ILE A 118 8.544 -6.748 5.525 1.00 0.00 C ATOM 1772 O ILE A 118 7.419 -6.536 5.981 1.00 0.00 O ATOM 1773 CB ILE A 118 8.871 -9.136 4.820 1.00 0.00 C ATOM 1774 CG1 ILE A 118 8.601 -10.108 3.666 1.00 0.00 C ATOM 1775 CG2 ILE A 118 7.924 -9.406 5.982 1.00 0.00 C ATOM 1776 CD1 ILE A 118 7.214 -9.978 3.070 1.00 0.00 C ATOM 0 H ILE A 118 10.555 -8.046 3.349 1.00 0.00 H new ATOM 0 HA ILE A 118 7.880 -7.599 3.674 1.00 0.00 H new ATOM 0 HB ILE A 118 9.890 -9.291 5.174 1.00 0.00 H new ATOM 0 HG12 ILE A 118 9.340 -9.942 2.882 1.00 0.00 H new ATOM 0 HG13 ILE A 118 8.739 -11.129 4.023 1.00 0.00 H new ATOM 0 HG21 ILE A 118 8.032 -10.441 6.306 1.00 0.00 H new ATOM 0 HG22 ILE A 118 8.165 -8.739 6.810 1.00 0.00 H new ATOM 0 HG23 ILE A 118 6.897 -9.231 5.662 1.00 0.00 H new ATOM 0 HD11 ILE A 118 7.097 -10.698 2.260 1.00 0.00 H new ATOM 0 HD12 ILE A 118 6.467 -10.174 3.840 1.00 0.00 H new ATOM 0 HD13 ILE A 118 7.078 -8.969 2.681 1.00 0.00 H new ATOM 1788 N ASP A 119 9.646 -6.197 6.020 1.00 0.00 N ATOM 1789 CA ASP A 119 9.608 -5.285 7.153 1.00 0.00 C ATOM 1790 C ASP A 119 8.573 -4.188 6.943 1.00 0.00 C ATOM 1791 O ASP A 119 7.769 -3.904 7.830 1.00 0.00 O ATOM 1792 CB ASP A 119 10.984 -4.657 7.358 1.00 0.00 C ATOM 1793 CG ASP A 119 11.823 -5.413 8.370 1.00 0.00 C ATOM 1794 OD1 ASP A 119 11.640 -5.182 9.583 1.00 0.00 O ATOM 1795 OD2 ASP A 119 12.663 -6.236 7.949 1.00 0.00 O ATOM 0 H ASP A 119 10.581 -6.368 5.651 1.00 0.00 H new ATOM 0 HA ASP A 119 9.328 -5.856 8.038 1.00 0.00 H new ATOM 0 HB2 ASP A 119 11.511 -4.626 6.405 1.00 0.00 H new ATOM 0 HB3 ASP A 119 10.863 -3.626 7.689 1.00 0.00 H new ATOM 1800 N ARG A 120 8.597 -3.581 5.761 1.00 0.00 N ATOM 1801 CA ARG A 120 7.669 -2.504 5.429 1.00 0.00 C ATOM 1802 C ARG A 120 6.223 -2.938 5.645 1.00 0.00 C ATOM 1803 O ARG A 120 5.391 -2.148 6.095 1.00 0.00 O ATOM 1804 CB ARG A 120 7.870 -2.057 3.978 1.00 0.00 C ATOM 1805 CG ARG A 120 9.099 -1.181 3.767 1.00 0.00 C ATOM 1806 CD ARG A 120 10.387 -1.926 4.078 1.00 0.00 C ATOM 1807 NE ARG A 120 11.569 -1.112 3.807 1.00 0.00 N ATOM 1808 CZ ARG A 120 12.625 -1.051 4.613 1.00 0.00 C ATOM 1809 NH1 ARG A 120 12.645 -1.749 5.741 1.00 0.00 N ATOM 1810 NH2 ARG A 120 13.664 -0.291 4.292 1.00 0.00 N ATOM 0 H ARG A 120 9.251 -3.817 5.014 1.00 0.00 H new ATOM 0 HA ARG A 120 7.877 -1.665 6.093 1.00 0.00 H new ATOM 0 HB2 ARG A 120 7.952 -2.940 3.344 1.00 0.00 H new ATOM 0 HB3 ARG A 120 6.986 -1.510 3.651 1.00 0.00 H new ATOM 0 HG2 ARG A 120 9.122 -0.831 2.735 1.00 0.00 H new ATOM 0 HG3 ARG A 120 9.028 -0.298 4.402 1.00 0.00 H new ATOM 0 HD2 ARG A 120 10.387 -2.228 5.125 1.00 0.00 H new ATOM 0 HD3 ARG A 120 10.431 -2.838 3.483 1.00 0.00 H new ATOM 0 HE ARG A 120 11.585 -0.559 2.950 1.00 0.00 H new ATOM 0 HH11 ARG A 120 11.849 -2.335 5.992 1.00 0.00 H new ATOM 0 HH12 ARG A 120 13.457 -1.700 6.357 1.00 0.00 H new ATOM 0 HH21 ARG A 120 13.654 0.248 3.426 1.00 0.00 H new ATOM 0 HH22 ARG A 120 14.473 -0.245 4.911 1.00 0.00 H new ATOM 1824 N TYR A 121 5.929 -4.191 5.319 1.00 0.00 N ATOM 1825 CA TYR A 121 4.581 -4.724 5.481 1.00 0.00 C ATOM 1826 C TYR A 121 4.118 -4.611 6.931 1.00 0.00 C ATOM 1827 O TYR A 121 3.118 -3.957 7.222 1.00 0.00 O ATOM 1828 CB TYR A 121 4.526 -6.186 5.026 1.00 0.00 C ATOM 1829 CG TYR A 121 3.144 -6.800 5.102 1.00 0.00 C ATOM 1830 CD1 TYR A 121 2.591 -7.170 6.323 1.00 0.00 C ATOM 1831 CD2 TYR A 121 2.394 -7.016 3.952 1.00 0.00 C ATOM 1832 CE1 TYR A 121 1.333 -7.735 6.395 1.00 0.00 C ATOM 1833 CE2 TYR A 121 1.135 -7.581 4.017 1.00 0.00 C ATOM 1834 CZ TYR A 121 0.609 -7.937 5.241 1.00 0.00 C ATOM 1835 OH TYR A 121 -0.645 -8.500 5.310 1.00 0.00 O ATOM 0 H TYR A 121 6.604 -4.856 4.942 1.00 0.00 H new ATOM 0 HA TYR A 121 3.909 -4.133 4.859 1.00 0.00 H new ATOM 0 HB2 TYR A 121 4.886 -6.251 3.999 1.00 0.00 H new ATOM 0 HB3 TYR A 121 5.208 -6.774 5.640 1.00 0.00 H new ATOM 0 HD1 TYR A 121 3.155 -7.013 7.231 1.00 0.00 H new ATOM 0 HD2 TYR A 121 2.802 -6.738 2.992 1.00 0.00 H new ATOM 0 HE1 TYR A 121 0.919 -8.017 7.352 1.00 0.00 H new ATOM 0 HE2 TYR A 121 0.566 -7.743 3.114 1.00 0.00 H new ATOM 0 HH TYR A 121 -1.021 -8.573 4.408 1.00 0.00 H new ATOM 1845 N HIS A 122 4.850 -5.257 7.833 1.00 0.00 N ATOM 1846 CA HIS A 122 4.512 -5.237 9.252 1.00 0.00 C ATOM 1847 C HIS A 122 4.433 -3.809 9.782 1.00 0.00 C ATOM 1848 O HIS A 122 3.590 -3.496 10.624 1.00 0.00 O ATOM 1849 CB HIS A 122 5.542 -6.033 10.055 1.00 0.00 C ATOM 1850 CG HIS A 122 5.565 -7.492 9.718 1.00 0.00 C ATOM 1851 ND1 HIS A 122 4.883 -8.444 10.446 1.00 0.00 N ATOM 1852 CD2 HIS A 122 6.195 -8.161 8.724 1.00 0.00 C ATOM 1853 CE1 HIS A 122 5.092 -9.635 9.915 1.00 0.00 C ATOM 1854 NE2 HIS A 122 5.885 -9.491 8.869 1.00 0.00 N ATOM 0 H HIS A 122 5.682 -5.802 7.606 1.00 0.00 H new ATOM 0 HA HIS A 122 3.532 -5.699 9.367 1.00 0.00 H new ATOM 0 HB2 HIS A 122 6.532 -5.612 9.879 1.00 0.00 H new ATOM 0 HB3 HIS A 122 5.331 -5.917 11.118 1.00 0.00 H new ATOM 0 HD2 HIS A 122 6.824 -7.729 7.960 1.00 0.00 H new ATOM 0 HE1 HIS A 122 4.684 -10.568 10.275 1.00 0.00 H new ATOM 0 HE2 HIS A 122 6.214 -10.245 8.266 1.00 0.00 H new ATOM 1863 N PHE A 123 5.315 -2.949 9.287 1.00 0.00 N ATOM 1864 CA PHE A 123 5.345 -1.554 9.716 1.00 0.00 C ATOM 1865 C PHE A 123 4.016 -0.860 9.430 1.00 0.00 C ATOM 1866 O PHE A 123 3.373 -0.333 10.339 1.00 0.00 O ATOM 1867 CB PHE A 123 6.481 -0.802 9.014 1.00 0.00 C ATOM 1868 CG PHE A 123 7.862 -1.312 9.342 1.00 0.00 C ATOM 1869 CD1 PHE A 123 8.064 -2.228 10.365 1.00 0.00 C ATOM 1870 CD2 PHE A 123 8.960 -0.869 8.620 1.00 0.00 C ATOM 1871 CE1 PHE A 123 9.333 -2.689 10.660 1.00 0.00 C ATOM 1872 CE2 PHE A 123 10.229 -1.327 8.912 1.00 0.00 C ATOM 1873 CZ PHE A 123 10.417 -2.238 9.932 1.00 0.00 C ATOM 0 H PHE A 123 6.018 -3.191 8.589 1.00 0.00 H new ATOM 0 HA PHE A 123 5.517 -1.542 10.792 1.00 0.00 H new ATOM 0 HB2 PHE A 123 6.330 -0.865 7.936 1.00 0.00 H new ATOM 0 HB3 PHE A 123 6.423 0.253 9.283 1.00 0.00 H new ATOM 0 HD1 PHE A 123 7.220 -2.584 10.937 1.00 0.00 H new ATOM 0 HD2 PHE A 123 8.821 -0.157 7.820 1.00 0.00 H new ATOM 0 HE1 PHE A 123 9.477 -3.401 11.459 1.00 0.00 H new ATOM 0 HE2 PHE A 123 11.075 -0.972 8.342 1.00 0.00 H new ATOM 0 HZ PHE A 123 11.410 -2.597 10.160 1.00 0.00 H new ATOM 1883 N LEU A 124 3.614 -0.863 8.164 1.00 0.00 N ATOM 1884 CA LEU A 124 2.367 -0.226 7.753 1.00 0.00 C ATOM 1885 C LEU A 124 1.165 -0.897 8.406 1.00 0.00 C ATOM 1886 O LEU A 124 0.267 -0.225 8.913 1.00 0.00 O ATOM 1887 CB LEU A 124 2.225 -0.276 6.231 1.00 0.00 C ATOM 1888 CG LEU A 124 0.872 0.195 5.690 1.00 0.00 C ATOM 1889 CD1 LEU A 124 0.651 1.666 6.008 1.00 0.00 C ATOM 1890 CD2 LEU A 124 0.783 -0.049 4.191 1.00 0.00 C ATOM 0 H LEU A 124 4.134 -1.300 7.403 1.00 0.00 H new ATOM 0 HA LEU A 124 2.398 0.814 8.079 1.00 0.00 H new ATOM 0 HB2 LEU A 124 3.010 0.337 5.788 1.00 0.00 H new ATOM 0 HB3 LEU A 124 2.395 -1.300 5.899 1.00 0.00 H new ATOM 0 HG LEU A 124 0.087 -0.382 6.179 1.00 0.00 H new ATOM 0 HD11 LEU A 124 -0.316 1.982 5.615 1.00 0.00 H new ATOM 0 HD12 LEU A 124 0.669 1.811 7.088 1.00 0.00 H new ATOM 0 HD13 LEU A 124 1.441 2.260 5.549 1.00 0.00 H new ATOM 0 HD21 LEU A 124 -0.185 0.292 3.824 1.00 0.00 H new ATOM 0 HD22 LEU A 124 1.577 0.501 3.685 1.00 0.00 H new ATOM 0 HD23 LEU A 124 0.893 -1.114 3.989 1.00 0.00 H new ATOM 1902 N ARG A 125 1.151 -2.225 8.376 1.00 0.00 N ATOM 1903 CA ARG A 125 0.061 -2.998 8.963 1.00 0.00 C ATOM 1904 C ARG A 125 -0.313 -2.477 10.351 1.00 0.00 C ATOM 1905 O ARG A 125 -1.489 -2.454 10.715 1.00 0.00 O ATOM 1906 CB ARG A 125 0.447 -4.475 9.053 1.00 0.00 C ATOM 1907 CG ARG A 125 -0.673 -5.363 9.572 1.00 0.00 C ATOM 1908 CD ARG A 125 -0.238 -6.817 9.659 1.00 0.00 C ATOM 1909 NE ARG A 125 -1.343 -7.699 10.020 1.00 0.00 N ATOM 1910 CZ ARG A 125 -1.265 -9.026 9.994 1.00 0.00 C ATOM 1911 NH1 ARG A 125 -0.138 -9.621 9.628 1.00 0.00 N ATOM 1912 NH2 ARG A 125 -2.315 -9.761 10.334 1.00 0.00 N ATOM 0 H ARG A 125 1.885 -2.791 7.950 1.00 0.00 H new ATOM 0 HA ARG A 125 -0.807 -2.888 8.313 1.00 0.00 H new ATOM 0 HB2 ARG A 125 0.749 -4.824 8.066 1.00 0.00 H new ATOM 0 HB3 ARG A 125 1.313 -4.577 9.706 1.00 0.00 H new ATOM 0 HG2 ARG A 125 -0.986 -5.017 10.557 1.00 0.00 H new ATOM 0 HG3 ARG A 125 -1.539 -5.280 8.915 1.00 0.00 H new ATOM 0 HD2 ARG A 125 0.176 -7.129 8.700 1.00 0.00 H new ATOM 0 HD3 ARG A 125 0.558 -6.913 10.397 1.00 0.00 H new ATOM 0 HE ARG A 125 -2.224 -7.274 10.308 1.00 0.00 H new ATOM 0 HH11 ARG A 125 0.673 -9.060 9.365 1.00 0.00 H new ATOM 0 HH12 ARG A 125 -0.082 -10.639 9.609 1.00 0.00 H new ATOM 0 HH21 ARG A 125 -3.184 -9.308 10.616 1.00 0.00 H new ATOM 0 HH22 ARG A 125 -2.253 -10.779 10.313 1.00 0.00 H new ATOM 1926 N GLY A 126 0.688 -2.060 11.121 1.00 0.00 N ATOM 1927 CA GLY A 126 0.433 -1.559 12.462 1.00 0.00 C ATOM 1928 C GLY A 126 -0.254 -0.205 12.482 1.00 0.00 C ATOM 1929 O GLY A 126 -1.034 0.084 13.389 1.00 0.00 O ATOM 0 H GLY A 126 1.669 -2.060 10.842 1.00 0.00 H new ATOM 0 HA2 GLY A 126 -0.185 -2.279 12.999 1.00 0.00 H new ATOM 0 HA3 GLY A 126 1.378 -1.486 13.000 1.00 0.00 H new ATOM 1933 N PHE A 127 0.032 0.628 11.486 1.00 0.00 N ATOM 1934 CA PHE A 127 -0.560 1.960 11.407 1.00 0.00 C ATOM 1935 C PHE A 127 -2.048 1.888 11.076 1.00 0.00 C ATOM 1936 O PHE A 127 -2.865 2.568 11.697 1.00 0.00 O ATOM 1937 CB PHE A 127 0.173 2.797 10.354 1.00 0.00 C ATOM 1938 CG PHE A 127 -0.433 4.152 10.120 1.00 0.00 C ATOM 1939 CD1 PHE A 127 -0.449 5.103 11.127 1.00 0.00 C ATOM 1940 CD2 PHE A 127 -0.983 4.475 8.890 1.00 0.00 C ATOM 1941 CE1 PHE A 127 -1.002 6.352 10.913 1.00 0.00 C ATOM 1942 CE2 PHE A 127 -1.538 5.721 8.670 1.00 0.00 C ATOM 1943 CZ PHE A 127 -1.547 6.661 9.683 1.00 0.00 C ATOM 0 H PHE A 127 0.670 0.405 10.722 1.00 0.00 H new ATOM 0 HA PHE A 127 -0.456 2.434 12.383 1.00 0.00 H new ATOM 0 HB2 PHE A 127 1.211 2.923 10.663 1.00 0.00 H new ATOM 0 HB3 PHE A 127 0.185 2.248 9.412 1.00 0.00 H new ATOM 0 HD1 PHE A 127 -0.024 4.866 12.091 1.00 0.00 H new ATOM 0 HD2 PHE A 127 -0.978 3.745 8.094 1.00 0.00 H new ATOM 0 HE1 PHE A 127 -1.008 7.084 11.707 1.00 0.00 H new ATOM 0 HE2 PHE A 127 -1.965 5.960 7.707 1.00 0.00 H new ATOM 0 HZ PHE A 127 -1.980 7.636 9.513 1.00 0.00 H new ATOM 1953 N ALA A 128 -2.393 1.060 10.096 1.00 0.00 N ATOM 1954 CA ALA A 128 -3.782 0.905 9.679 1.00 0.00 C ATOM 1955 C ALA A 128 -4.614 0.212 10.752 1.00 0.00 C ATOM 1956 O ALA A 128 -5.841 0.155 10.658 1.00 0.00 O ATOM 1957 CB ALA A 128 -3.854 0.133 8.372 1.00 0.00 C ATOM 0 H ALA A 128 -1.730 0.486 9.575 1.00 0.00 H new ATOM 0 HA ALA A 128 -4.200 1.900 9.528 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -4.896 0.024 8.071 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -3.308 0.674 7.599 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -3.410 -0.853 8.507 1.00 0.00 H new ATOM 1963 N ALA A 129 -3.943 -0.317 11.769 1.00 0.00 N ATOM 1964 CA ALA A 129 -4.624 -1.009 12.857 1.00 0.00 C ATOM 1965 C ALA A 129 -5.375 -0.033 13.758 1.00 0.00 C ATOM 1966 O ALA A 129 -6.282 -0.428 14.492 1.00 0.00 O ATOM 1967 CB ALA A 129 -3.627 -1.820 13.670 1.00 0.00 C ATOM 0 H ALA A 129 -2.928 -0.280 11.863 1.00 0.00 H new ATOM 0 HA ALA A 129 -5.357 -1.685 12.416 1.00 0.00 H new ATOM 0 HB1 ALA A 129 -4.148 -2.332 14.479 1.00 0.00 H new ATOM 0 HB2 ALA A 129 -3.145 -2.556 13.026 1.00 0.00 H new ATOM 0 HB3 ALA A 129 -2.872 -1.155 14.088 1.00 0.00 H new ATOM 1973 N GLY A 130 -4.995 1.240 13.702 1.00 0.00 N ATOM 1974 CA GLY A 130 -5.645 2.244 14.527 1.00 0.00 C ATOM 1975 C GLY A 130 -6.468 3.233 13.724 1.00 0.00 C ATOM 1976 O GLY A 130 -6.868 4.277 14.240 1.00 0.00 O ATOM 0 H GLY A 130 -4.250 1.594 13.102 1.00 0.00 H new ATOM 0 HA2 GLY A 130 -6.290 1.748 15.252 1.00 0.00 H new ATOM 0 HA3 GLY A 130 -4.888 2.786 15.093 1.00 0.00 H new ATOM 1980 N HIS A 131 -6.724 2.908 12.461 1.00 0.00 N ATOM 1981 CA HIS A 131 -7.511 3.780 11.593 1.00 0.00 C ATOM 1982 C HIS A 131 -9.004 3.614 11.872 1.00 0.00 C ATOM 1983 O HIS A 131 -9.425 2.606 12.437 1.00 0.00 O ATOM 1984 CB HIS A 131 -7.217 3.478 10.121 1.00 0.00 C ATOM 1985 CG HIS A 131 -6.231 4.418 9.500 1.00 0.00 C ATOM 1986 ND1 HIS A 131 -6.333 5.790 9.599 1.00 0.00 N ATOM 1987 CD2 HIS A 131 -5.120 4.178 8.763 1.00 0.00 C ATOM 1988 CE1 HIS A 131 -5.329 6.352 8.951 1.00 0.00 C ATOM 1989 NE2 HIS A 131 -4.579 5.396 8.435 1.00 0.00 N ATOM 0 H HIS A 131 -6.399 2.050 12.016 1.00 0.00 H new ATOM 0 HA HIS A 131 -7.230 4.812 11.804 1.00 0.00 H new ATOM 0 HB2 HIS A 131 -6.838 2.460 10.037 1.00 0.00 H new ATOM 0 HB3 HIS A 131 -8.149 3.519 9.558 1.00 0.00 H new ATOM 0 HD2 HIS A 131 -4.732 3.209 8.485 1.00 0.00 H new ATOM 0 HE1 HIS A 131 -5.152 7.413 8.859 1.00 0.00 H new ATOM 0 HE2 HIS A 131 -3.734 5.539 7.882 1.00 0.00 H new ATOM 1998 N PRO A 132 -9.826 4.607 11.482 1.00 0.00 N ATOM 1999 CA PRO A 132 -11.279 4.558 11.689 1.00 0.00 C ATOM 2000 C PRO A 132 -11.912 3.357 10.997 1.00 0.00 C ATOM 2001 O PRO A 132 -12.958 2.862 11.418 1.00 0.00 O ATOM 2002 CB PRO A 132 -11.783 5.865 11.064 1.00 0.00 C ATOM 2003 CG PRO A 132 -10.686 6.309 10.159 1.00 0.00 C ATOM 2004 CD PRO A 132 -9.414 5.851 10.810 1.00 0.00 C ATOM 0 HA PRO A 132 -11.537 4.456 12.743 1.00 0.00 H new ATOM 0 HB2 PRO A 132 -12.710 5.707 10.512 1.00 0.00 H new ATOM 0 HB3 PRO A 132 -11.991 6.613 11.829 1.00 0.00 H new ATOM 0 HG2 PRO A 132 -10.797 5.873 9.166 1.00 0.00 H new ATOM 0 HG3 PRO A 132 -10.695 7.392 10.035 1.00 0.00 H new ATOM 0 HD2 PRO A 132 -8.625 5.674 10.079 1.00 0.00 H new ATOM 0 HD3 PRO A 132 -9.033 6.587 11.518 1.00 0.00 H new ATOM 2012 N GLU A 133 -11.267 2.893 9.933 1.00 0.00 N ATOM 2013 CA GLU A 133 -11.754 1.746 9.177 1.00 0.00 C ATOM 2014 C GLU A 133 -10.805 0.564 9.321 1.00 0.00 C ATOM 2015 O GLU A 133 -10.818 -0.360 8.508 1.00 0.00 O ATOM 2016 CB GLU A 133 -11.917 2.106 7.703 1.00 0.00 C ATOM 2017 CG GLU A 133 -13.162 2.924 7.420 1.00 0.00 C ATOM 2018 CD GLU A 133 -13.024 4.371 7.848 1.00 0.00 C ATOM 2019 OE1 GLU A 133 -12.337 5.137 7.140 1.00 0.00 O ATOM 2020 OE2 GLU A 133 -13.605 4.739 8.890 1.00 0.00 O ATOM 0 H GLU A 133 -10.402 3.296 9.573 1.00 0.00 H new ATOM 0 HA GLU A 133 -12.727 1.464 9.580 1.00 0.00 H new ATOM 0 HB2 GLU A 133 -11.041 2.665 7.373 1.00 0.00 H new ATOM 0 HB3 GLU A 133 -11.951 1.190 7.114 1.00 0.00 H new ATOM 0 HG2 GLU A 133 -13.382 2.885 6.353 1.00 0.00 H new ATOM 0 HG3 GLU A 133 -14.011 2.476 7.937 1.00 0.00 H new ATOM 2027 N ALA A 134 -9.981 0.615 10.360 1.00 0.00 N ATOM 2028 CA ALA A 134 -9.015 -0.442 10.639 1.00 0.00 C ATOM 2029 C ALA A 134 -9.632 -1.820 10.441 1.00 0.00 C ATOM 2030 O ALA A 134 -9.040 -2.688 9.801 1.00 0.00 O ATOM 2031 CB ALA A 134 -8.479 -0.304 12.055 1.00 0.00 C ATOM 0 H ALA A 134 -9.962 1.384 11.029 1.00 0.00 H new ATOM 0 HA ALA A 134 -8.190 -0.339 9.935 1.00 0.00 H new ATOM 0 HB1 ALA A 134 -7.759 -1.099 12.251 1.00 0.00 H new ATOM 0 HB2 ALA A 134 -7.990 0.664 12.166 1.00 0.00 H new ATOM 0 HB3 ALA A 134 -9.303 -0.378 12.765 1.00 0.00 H new ATOM 2037 N ALA A 135 -10.822 -2.015 10.999 1.00 0.00 N ATOM 2038 CA ALA A 135 -11.521 -3.288 10.886 1.00 0.00 C ATOM 2039 C ALA A 135 -11.604 -3.762 9.436 1.00 0.00 C ATOM 2040 O ALA A 135 -11.403 -4.941 9.149 1.00 0.00 O ATOM 2041 CB ALA A 135 -12.917 -3.176 11.483 1.00 0.00 C ATOM 0 H ALA A 135 -11.323 -1.306 11.535 1.00 0.00 H new ATOM 0 HA ALA A 135 -10.949 -4.030 11.444 1.00 0.00 H new ATOM 0 HB1 ALA A 135 -13.429 -4.134 11.392 1.00 0.00 H new ATOM 0 HB2 ALA A 135 -12.842 -2.903 12.536 1.00 0.00 H new ATOM 0 HB3 ALA A 135 -13.481 -2.411 10.949 1.00 0.00 H new ATOM 2047 N ALA A 136 -11.907 -2.842 8.528 1.00 0.00 N ATOM 2048 CA ALA A 136 -12.023 -3.179 7.114 1.00 0.00 C ATOM 2049 C ALA A 136 -10.659 -3.366 6.454 1.00 0.00 C ATOM 2050 O ALA A 136 -10.488 -4.241 5.607 1.00 0.00 O ATOM 2051 CB ALA A 136 -12.816 -2.106 6.385 1.00 0.00 C ATOM 0 H ALA A 136 -12.076 -1.860 8.744 1.00 0.00 H new ATOM 0 HA ALA A 136 -12.550 -4.131 7.046 1.00 0.00 H new ATOM 0 HB1 ALA A 136 -12.897 -2.367 5.330 1.00 0.00 H new ATOM 0 HB2 ALA A 136 -13.814 -2.033 6.818 1.00 0.00 H new ATOM 0 HB3 ALA A 136 -12.307 -1.147 6.484 1.00 0.00 H new ATOM 2057 N ILE A 137 -9.692 -2.542 6.843 1.00 0.00 N ATOM 2058 CA ILE A 137 -8.350 -2.604 6.267 1.00 0.00 C ATOM 2059 C ILE A 137 -7.616 -3.907 6.593 1.00 0.00 C ATOM 2060 O ILE A 137 -7.110 -4.575 5.691 1.00 0.00 O ATOM 2061 CB ILE A 137 -7.489 -1.419 6.742 1.00 0.00 C ATOM 2062 CG1 ILE A 137 -8.126 -0.096 6.315 1.00 0.00 C ATOM 2063 CG2 ILE A 137 -6.076 -1.539 6.189 1.00 0.00 C ATOM 2064 CD1 ILE A 137 -7.463 1.120 6.921 1.00 0.00 C ATOM 0 H ILE A 137 -9.811 -1.822 7.556 1.00 0.00 H new ATOM 0 HA ILE A 137 -8.492 -2.558 5.187 1.00 0.00 H new ATOM 0 HB ILE A 137 -7.435 -1.438 7.830 1.00 0.00 H new ATOM 0 HG12 ILE A 137 -8.086 -0.017 5.229 1.00 0.00 H new ATOM 0 HG13 ILE A 137 -9.179 -0.103 6.596 1.00 0.00 H new ATOM 0 HG21 ILE A 137 -5.478 -0.695 6.532 1.00 0.00 H new ATOM 0 HG22 ILE A 137 -5.626 -2.468 6.538 1.00 0.00 H new ATOM 0 HG23 ILE A 137 -6.111 -1.540 5.100 1.00 0.00 H new ATOM 0 HD11 ILE A 137 -7.968 2.021 6.573 1.00 0.00 H new ATOM 0 HD12 ILE A 137 -7.526 1.065 8.008 1.00 0.00 H new ATOM 0 HD13 ILE A 137 -6.416 1.152 6.620 1.00 0.00 H new ATOM 2076 N TYR A 138 -7.555 -4.269 7.872 1.00 0.00 N ATOM 2077 CA TYR A 138 -6.845 -5.478 8.284 1.00 0.00 C ATOM 2078 C TYR A 138 -7.533 -6.734 7.764 1.00 0.00 C ATOM 2079 O TYR A 138 -6.870 -7.716 7.428 1.00 0.00 O ATOM 2080 CB TYR A 138 -6.701 -5.527 9.810 1.00 0.00 C ATOM 2081 CG TYR A 138 -7.806 -6.273 10.526 1.00 0.00 C ATOM 2082 CD1 TYR A 138 -9.028 -5.667 10.778 1.00 0.00 C ATOM 2083 CD2 TYR A 138 -7.622 -7.582 10.952 1.00 0.00 C ATOM 2084 CE1 TYR A 138 -10.038 -6.344 11.435 1.00 0.00 C ATOM 2085 CE2 TYR A 138 -8.627 -8.266 11.610 1.00 0.00 C ATOM 2086 CZ TYR A 138 -9.833 -7.642 11.849 1.00 0.00 C ATOM 2087 OH TYR A 138 -10.836 -8.319 12.504 1.00 0.00 O ATOM 0 H TYR A 138 -7.985 -3.748 8.636 1.00 0.00 H new ATOM 0 HA TYR A 138 -5.848 -5.444 7.845 1.00 0.00 H new ATOM 0 HB2 TYR A 138 -5.747 -5.994 10.056 1.00 0.00 H new ATOM 0 HB3 TYR A 138 -6.664 -4.506 10.191 1.00 0.00 H new ATOM 0 HD1 TYR A 138 -9.193 -4.650 10.456 1.00 0.00 H new ATOM 0 HD2 TYR A 138 -6.678 -8.073 10.766 1.00 0.00 H new ATOM 0 HE1 TYR A 138 -10.984 -5.858 11.623 1.00 0.00 H new ATOM 0 HE2 TYR A 138 -8.468 -9.284 11.935 1.00 0.00 H new ATOM 0 HH TYR A 138 -10.530 -9.223 12.726 1.00 0.00 H new ATOM 2097 N ARG A 139 -8.858 -6.708 7.700 1.00 0.00 N ATOM 2098 CA ARG A 139 -9.607 -7.854 7.202 1.00 0.00 C ATOM 2099 C ARG A 139 -9.469 -7.938 5.689 1.00 0.00 C ATOM 2100 O ARG A 139 -9.490 -9.024 5.109 1.00 0.00 O ATOM 2101 CB ARG A 139 -11.082 -7.760 7.602 1.00 0.00 C ATOM 2102 CG ARG A 139 -11.868 -6.717 6.823 1.00 0.00 C ATOM 2103 CD ARG A 139 -13.316 -6.658 7.282 1.00 0.00 C ATOM 2104 NE ARG A 139 -13.967 -7.962 7.199 1.00 0.00 N ATOM 2105 CZ ARG A 139 -15.093 -8.267 7.839 1.00 0.00 C ATOM 2106 NH1 ARG A 139 -15.689 -7.363 8.605 1.00 0.00 N ATOM 2107 NH2 ARG A 139 -15.622 -9.476 7.714 1.00 0.00 N ATOM 0 H ARG A 139 -9.432 -5.914 7.984 1.00 0.00 H new ATOM 0 HA ARG A 139 -9.197 -8.760 7.649 1.00 0.00 H new ATOM 0 HB2 ARG A 139 -11.550 -8.734 7.459 1.00 0.00 H new ATOM 0 HB3 ARG A 139 -11.146 -7.529 8.665 1.00 0.00 H new ATOM 0 HG2 ARG A 139 -11.404 -5.739 6.951 1.00 0.00 H new ATOM 0 HG3 ARG A 139 -11.831 -6.951 5.759 1.00 0.00 H new ATOM 0 HD2 ARG A 139 -13.357 -6.297 8.310 1.00 0.00 H new ATOM 0 HD3 ARG A 139 -13.862 -5.940 6.670 1.00 0.00 H new ATOM 0 HE ARG A 139 -13.534 -8.680 6.618 1.00 0.00 H new ATOM 0 HH11 ARG A 139 -15.284 -6.432 8.704 1.00 0.00 H new ATOM 0 HH12 ARG A 139 -16.552 -7.599 9.095 1.00 0.00 H new ATOM 0 HH21 ARG A 139 -15.166 -10.174 7.127 1.00 0.00 H new ATOM 0 HH22 ARG A 139 -16.485 -9.708 8.205 1.00 0.00 H new ATOM 2121 N ALA A 140 -9.323 -6.775 5.059 1.00 0.00 N ATOM 2122 CA ALA A 140 -9.168 -6.696 3.613 1.00 0.00 C ATOM 2123 C ALA A 140 -7.877 -7.374 3.172 1.00 0.00 C ATOM 2124 O ALA A 140 -7.806 -7.950 2.086 1.00 0.00 O ATOM 2125 CB ALA A 140 -9.187 -5.246 3.156 1.00 0.00 C ATOM 0 H ALA A 140 -9.309 -5.871 5.532 1.00 0.00 H new ATOM 0 HA ALA A 140 -10.005 -7.218 3.150 1.00 0.00 H new ATOM 0 HB1 ALA A 140 -9.070 -5.204 2.073 1.00 0.00 H new ATOM 0 HB2 ALA A 140 -10.136 -4.789 3.436 1.00 0.00 H new ATOM 0 HB3 ALA A 140 -8.369 -4.704 3.630 1.00 0.00 H new ATOM 2131 N ILE A 141 -6.858 -7.300 4.023 1.00 0.00 N ATOM 2132 CA ILE A 141 -5.570 -7.911 3.723 1.00 0.00 C ATOM 2133 C ILE A 141 -5.468 -9.298 4.345 1.00 0.00 C ATOM 2134 O ILE A 141 -4.585 -10.082 3.999 1.00 0.00 O ATOM 2135 CB ILE A 141 -4.399 -7.046 4.230 1.00 0.00 C ATOM 2136 CG1 ILE A 141 -4.450 -6.922 5.755 1.00 0.00 C ATOM 2137 CG2 ILE A 141 -4.436 -5.672 3.579 1.00 0.00 C ATOM 2138 CD1 ILE A 141 -3.225 -6.263 6.353 1.00 0.00 C ATOM 0 H ILE A 141 -6.900 -6.824 4.924 1.00 0.00 H new ATOM 0 HA ILE A 141 -5.504 -7.992 2.638 1.00 0.00 H new ATOM 0 HB ILE A 141 -3.462 -7.531 3.956 1.00 0.00 H new ATOM 0 HG12 ILE A 141 -5.334 -6.348 6.035 1.00 0.00 H new ATOM 0 HG13 ILE A 141 -4.565 -7.916 6.188 1.00 0.00 H new ATOM 0 HG21 ILE A 141 -3.603 -5.073 3.947 1.00 0.00 H new ATOM 0 HG22 ILE A 141 -4.356 -5.780 2.497 1.00 0.00 H new ATOM 0 HG23 ILE A 141 -5.376 -5.178 3.826 1.00 0.00 H new ATOM 0 HD11 ILE A 141 -3.333 -6.210 7.436 1.00 0.00 H new ATOM 0 HD12 ILE A 141 -2.339 -6.848 6.105 1.00 0.00 H new ATOM 0 HD13 ILE A 141 -3.120 -5.256 5.949 1.00 0.00 H new ATOM 2150 N ASP A 142 -6.379 -9.590 5.269 1.00 0.00 N ATOM 2151 CA ASP A 142 -6.399 -10.882 5.947 1.00 0.00 C ATOM 2152 C ASP A 142 -6.507 -12.026 4.943 1.00 0.00 C ATOM 2153 O ASP A 142 -5.455 -12.592 4.577 1.00 0.00 O ATOM 2154 CB ASP A 142 -7.565 -10.943 6.935 1.00 0.00 C ATOM 2155 CG ASP A 142 -7.626 -12.262 7.679 1.00 0.00 C ATOM 2156 OD1 ASP A 142 -6.959 -12.385 8.727 1.00 0.00 O ATOM 2157 OD2 ASP A 142 -8.341 -13.174 7.211 1.00 0.00 O ATOM 2158 OXT ASP A 142 -7.641 -12.346 4.532 1.00 0.00 O ATOM 0 H ASP A 142 -7.114 -8.948 5.566 1.00 0.00 H new ATOM 0 HA ASP A 142 -5.462 -10.992 6.492 1.00 0.00 H new ATOM 0 HB2 ASP A 142 -7.472 -10.128 7.653 1.00 0.00 H new ATOM 0 HB3 ASP A 142 -8.501 -10.789 6.398 1.00 0.00 H new