USER MOD reduce.3.24.130724 H: found=0, std=0, add=842, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 838 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 47 ASN : amide:sc= 0.462 K(o=0.96,f=-0.027) USER MOD Set 1.2: A 51 ASN : amide:sc= 0.499 K(o=0.96,f=-0.027) USER MOD Single : A 1 SER N :NH3+ -174:sc= 0.697 (180deg=0.567) USER MOD Single : A 1 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot -69:sc= 0.638 USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 13 GLN : amide:sc= 0 X(o=0,f=-0.4) USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 THR OG1 : rot 5:sc= 1.27 USER MOD Single : A 19 THR OG1 : rot 180:sc= 0 USER MOD Single : A 23 SER OG : rot 117:sc= 1.23 USER MOD Single : A 29 THR OG1 : rot 78:sc= 0.158 USER MOD Single : A 32 LYS NZ :NH3+ -157:sc= 0.997 (180deg=0.478) USER MOD Single : A 33 LYS NZ :NH3+ 168:sc= -0.0526 (180deg=-0.242) USER MOD Single : A 37 SER OG : rot 180:sc= 0 USER MOD Single : A 40 THR OG1 : rot 180:sc= 0 USER MOD Single : A 42 SER OG : rot 180:sc= -0.0276 USER MOD Single : A 44 TYR OH : rot 177:sc= 0.0508 USER MOD Single : B 1 SER N :NH3+ -174:sc= 0.791 (180deg=0.74) USER MOD Single : B 1 SER OG : rot 180:sc= 0 USER MOD Single : B 3 SER OG : rot -73:sc= 0.639 USER MOD Single : B 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 9 SER OG : rot 180:sc= 0 USER MOD Single : B 13 GLN : amide:sc= 0 X(o=0,f=-0.29) USER MOD Single : B 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 15 THR OG1 : rot 17:sc= 2 USER MOD Single : B 19 THR OG1 : rot 180:sc= 0 USER MOD Single : B 23 SER OG : rot 71:sc= 0.606 USER MOD Single : B 29 THR OG1 : rot 74:sc= 0.0485 USER MOD Single : B 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 33 LYS NZ :NH3+ -169:sc=-0.000892 (180deg=-0.123) USER MOD Single : B 37 SER OG : rot -37:sc= 0.101 USER MOD Single : B 40 THR OG1 : rot 180:sc= 0 USER MOD Single : B 42 SER OG : rot 180:sc= 0 USER MOD Single : B 44 TYR OH : rot -170:sc= 1.25 USER MOD Single : B 47 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 51 ASN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 27.681 -17.492 5.622 1.00 0.00 N ATOM 2 CA SER A 1 27.963 -16.906 4.296 1.00 0.00 C ATOM 3 C SER A 1 27.130 -17.579 3.199 1.00 0.00 C ATOM 4 O SER A 1 26.568 -16.921 2.323 1.00 0.00 O ATOM 5 CB SER A 1 29.461 -17.022 3.993 1.00 0.00 C ATOM 6 OG SER A 1 30.217 -16.424 5.031 1.00 0.00 O ATOM 0 H1 SER A 1 28.182 -16.950 6.355 1.00 0.00 H new ATOM 0 H2 SER A 1 26.658 -17.459 5.806 1.00 0.00 H new ATOM 0 H3 SER A 1 28.005 -18.480 5.641 1.00 0.00 H new ATOM 0 HA SER A 1 27.682 -15.853 4.314 1.00 0.00 H new ATOM 0 HB2 SER A 1 29.738 -18.071 3.889 1.00 0.00 H new ATOM 0 HB3 SER A 1 29.686 -16.537 3.043 1.00 0.00 H new ATOM 0 HG SER A 1 31.172 -16.505 4.828 1.00 0.00 H new ATOM 12 N ASP A 2 27.077 -18.902 3.297 1.00 0.00 N ATOM 13 CA ASP A 2 26.521 -20.092 2.648 1.00 0.00 C ATOM 14 C ASP A 2 25.045 -19.999 2.226 1.00 0.00 C ATOM 15 O ASP A 2 24.351 -21.002 2.082 1.00 0.00 O ATOM 16 CB ASP A 2 26.753 -21.266 3.639 1.00 0.00 C ATOM 17 CG ASP A 2 28.106 -21.179 4.370 1.00 0.00 C ATOM 18 OD1 ASP A 2 28.195 -20.310 5.285 1.00 0.00 O ATOM 19 OD2 ASP A 2 29.075 -21.791 3.892 1.00 0.00 O ATOM 0 H ASP A 2 27.595 -19.266 4.096 1.00 0.00 H new ATOM 0 HA ASP A 2 27.031 -20.231 1.694 1.00 0.00 H new ATOM 0 HB2 ASP A 2 25.949 -21.277 4.375 1.00 0.00 H new ATOM 0 HB3 ASP A 2 26.700 -22.209 3.095 1.00 0.00 H new ATOM 24 N SER A 3 24.543 -18.783 2.042 1.00 0.00 N ATOM 25 CA SER A 3 23.201 -18.380 1.653 1.00 0.00 C ATOM 26 C SER A 3 22.839 -18.809 0.216 1.00 0.00 C ATOM 27 O SER A 3 22.503 -17.979 -0.632 1.00 0.00 O ATOM 28 CB SER A 3 23.105 -16.862 1.901 1.00 0.00 C ATOM 29 OG SER A 3 24.169 -16.110 1.323 1.00 0.00 O ATOM 0 H SER A 3 25.137 -17.965 2.178 1.00 0.00 H new ATOM 0 HA SER A 3 22.452 -18.894 2.255 1.00 0.00 H new ATOM 0 HB2 SER A 3 22.158 -16.498 1.501 1.00 0.00 H new ATOM 0 HB3 SER A 3 23.088 -16.681 2.976 1.00 0.00 H new ATOM 0 HG SER A 3 25.005 -16.310 1.794 1.00 0.00 H new ATOM 35 N ALA A 4 22.828 -20.116 -0.054 1.00 0.00 N ATOM 36 CA ALA A 4 22.530 -20.720 -1.351 1.00 0.00 C ATOM 37 C ALA A 4 21.173 -20.332 -1.962 1.00 0.00 C ATOM 38 O ALA A 4 21.010 -20.473 -3.173 1.00 0.00 O ATOM 39 CB ALA A 4 22.624 -22.246 -1.212 1.00 0.00 C ATOM 0 H ALA A 4 23.037 -20.813 0.660 1.00 0.00 H new ATOM 0 HA ALA A 4 23.270 -20.326 -2.047 1.00 0.00 H new ATOM 0 HB1 ALA A 4 22.404 -22.713 -2.172 1.00 0.00 H new ATOM 0 HB2 ALA A 4 23.630 -22.521 -0.897 1.00 0.00 H new ATOM 0 HB3 ALA A 4 21.904 -22.589 -0.469 1.00 0.00 H new ATOM 45 N VAL A 5 20.225 -19.819 -1.168 1.00 0.00 N ATOM 46 CA VAL A 5 18.884 -19.418 -1.598 1.00 0.00 C ATOM 47 C VAL A 5 18.857 -18.484 -2.818 1.00 0.00 C ATOM 48 O VAL A 5 17.919 -18.561 -3.614 1.00 0.00 O ATOM 49 CB VAL A 5 18.123 -18.839 -0.382 1.00 0.00 C ATOM 50 CG1 VAL A 5 18.758 -17.548 0.162 1.00 0.00 C ATOM 51 CG2 VAL A 5 16.637 -18.576 -0.653 1.00 0.00 C ATOM 0 H VAL A 5 20.379 -19.667 -0.171 1.00 0.00 H new ATOM 0 HA VAL A 5 18.372 -20.310 -1.958 1.00 0.00 H new ATOM 0 HB VAL A 5 18.202 -19.624 0.370 1.00 0.00 H new ATOM 0 HG11 VAL A 5 18.180 -17.189 1.014 1.00 0.00 H new ATOM 0 HG12 VAL A 5 19.782 -17.751 0.477 1.00 0.00 H new ATOM 0 HG13 VAL A 5 18.763 -16.788 -0.619 1.00 0.00 H new ATOM 0 HG21 VAL A 5 16.170 -18.171 0.245 1.00 0.00 H new ATOM 0 HG22 VAL A 5 16.537 -17.860 -1.469 1.00 0.00 H new ATOM 0 HG23 VAL A 5 16.146 -19.510 -0.928 1.00 0.00 H new ATOM 61 N ARG A 6 19.853 -17.605 -2.999 1.00 0.00 N ATOM 62 CA ARG A 6 19.894 -16.674 -4.127 1.00 0.00 C ATOM 63 C ARG A 6 21.312 -16.567 -4.664 1.00 0.00 C ATOM 64 O ARG A 6 22.219 -16.281 -3.886 1.00 0.00 O ATOM 65 CB ARG A 6 19.355 -15.300 -3.690 1.00 0.00 C ATOM 66 CG ARG A 6 19.254 -14.327 -4.878 1.00 0.00 C ATOM 67 CD ARG A 6 18.783 -12.936 -4.442 1.00 0.00 C ATOM 68 NE ARG A 6 19.808 -12.236 -3.648 1.00 0.00 N ATOM 69 CZ ARG A 6 19.595 -11.498 -2.554 1.00 0.00 C ATOM 70 NH1 ARG A 6 18.368 -11.145 -2.189 1.00 0.00 N ATOM 71 NH2 ARG A 6 20.619 -11.091 -1.817 1.00 0.00 N ATOM 0 H ARG A 6 20.649 -17.522 -2.367 1.00 0.00 H new ATOM 0 HA ARG A 6 19.259 -17.048 -4.930 1.00 0.00 H new ATOM 0 HB2 ARG A 6 18.372 -15.422 -3.234 1.00 0.00 H new ATOM 0 HB3 ARG A 6 20.009 -14.878 -2.928 1.00 0.00 H new ATOM 0 HG2 ARG A 6 20.227 -14.245 -5.363 1.00 0.00 H new ATOM 0 HG3 ARG A 6 18.562 -14.729 -5.618 1.00 0.00 H new ATOM 0 HD2 ARG A 6 18.537 -12.343 -5.323 1.00 0.00 H new ATOM 0 HD3 ARG A 6 17.869 -13.029 -3.855 1.00 0.00 H new ATOM 0 HE ARG A 6 20.774 -12.323 -3.964 1.00 0.00 H new ATOM 0 HH11 ARG A 6 17.566 -11.437 -2.747 1.00 0.00 H new ATOM 0 HH12 ARG A 6 18.228 -10.581 -1.350 1.00 0.00 H new ATOM 0 HH21 ARG A 6 21.571 -11.341 -2.084 1.00 0.00 H new ATOM 0 HH22 ARG A 6 20.455 -10.528 -0.983 1.00 0.00 H new ATOM 85 N LYS A 7 21.496 -16.769 -5.970 1.00 0.00 N ATOM 86 CA LYS A 7 22.803 -16.682 -6.622 1.00 0.00 C ATOM 87 C LYS A 7 23.283 -15.227 -6.630 1.00 0.00 C ATOM 88 O LYS A 7 24.273 -14.914 -5.976 1.00 0.00 O ATOM 89 CB LYS A 7 22.728 -17.299 -8.030 1.00 0.00 C ATOM 90 CG LYS A 7 22.651 -18.833 -7.957 1.00 0.00 C ATOM 91 CD LYS A 7 22.219 -19.459 -9.289 1.00 0.00 C ATOM 92 CE LYS A 7 22.195 -20.991 -9.166 1.00 0.00 C ATOM 93 NZ LYS A 7 21.279 -21.617 -10.150 1.00 0.00 N ATOM 0 H LYS A 7 20.736 -16.999 -6.610 1.00 0.00 H new ATOM 0 HA LYS A 7 23.542 -17.257 -6.064 1.00 0.00 H new ATOM 0 HB2 LYS A 7 21.854 -16.912 -8.554 1.00 0.00 H new ATOM 0 HB3 LYS A 7 23.603 -17.002 -8.608 1.00 0.00 H new ATOM 0 HG2 LYS A 7 23.625 -19.230 -7.671 1.00 0.00 H new ATOM 0 HG3 LYS A 7 21.947 -19.122 -7.177 1.00 0.00 H new ATOM 0 HD2 LYS A 7 21.231 -19.093 -9.569 1.00 0.00 H new ATOM 0 HD3 LYS A 7 22.906 -19.160 -10.081 1.00 0.00 H new ATOM 0 HE2 LYS A 7 23.202 -21.381 -9.310 1.00 0.00 H new ATOM 0 HE3 LYS A 7 21.887 -21.268 -8.158 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 21.295 -22.650 -10.031 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 20.312 -21.265 -9.997 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 21.587 -21.375 -11.114 1.00 0.00 H new ATOM 107 N LYS A 8 22.615 -14.336 -7.370 1.00 0.00 N ATOM 108 CA LYS A 8 22.944 -12.908 -7.470 1.00 0.00 C ATOM 109 C LYS A 8 21.642 -12.108 -7.502 1.00 0.00 C ATOM 110 O LYS A 8 20.552 -12.690 -7.487 1.00 0.00 O ATOM 111 CB LYS A 8 23.783 -12.598 -8.728 1.00 0.00 C ATOM 112 CG LYS A 8 25.110 -13.369 -8.848 1.00 0.00 C ATOM 113 CD LYS A 8 25.783 -13.099 -10.202 1.00 0.00 C ATOM 114 CE LYS A 8 26.385 -11.689 -10.315 1.00 0.00 C ATOM 115 NZ LYS A 8 26.608 -11.307 -11.726 1.00 0.00 N ATOM 0 H LYS A 8 21.805 -14.595 -7.934 1.00 0.00 H new ATOM 0 HA LYS A 8 23.544 -12.628 -6.604 1.00 0.00 H new ATOM 0 HB2 LYS A 8 23.178 -12.813 -9.609 1.00 0.00 H new ATOM 0 HB3 LYS A 8 24.001 -11.530 -8.744 1.00 0.00 H new ATOM 0 HG2 LYS A 8 25.780 -13.075 -8.040 1.00 0.00 H new ATOM 0 HG3 LYS A 8 24.925 -14.437 -8.736 1.00 0.00 H new ATOM 0 HD2 LYS A 8 26.570 -13.836 -10.361 1.00 0.00 H new ATOM 0 HD3 LYS A 8 25.051 -13.238 -10.997 1.00 0.00 H new ATOM 0 HE2 LYS A 8 25.717 -10.968 -9.843 1.00 0.00 H new ATOM 0 HE3 LYS A 8 27.330 -11.651 -9.773 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 27.015 -10.351 -11.767 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 27.264 -11.981 -12.169 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 25.702 -11.320 -12.236 1.00 0.00 H new ATOM 129 N SER A 9 21.730 -10.780 -7.588 1.00 0.00 N ATOM 130 CA SER A 9 20.602 -9.866 -7.641 1.00 0.00 C ATOM 131 C SER A 9 20.990 -8.766 -8.630 1.00 0.00 C ATOM 132 O SER A 9 21.952 -8.051 -8.371 1.00 0.00 O ATOM 133 CB SER A 9 20.341 -9.352 -6.216 1.00 0.00 C ATOM 134 OG SER A 9 19.039 -8.821 -6.051 1.00 0.00 O ATOM 0 H SER A 9 22.628 -10.298 -7.624 1.00 0.00 H new ATOM 0 HA SER A 9 19.674 -10.324 -7.983 1.00 0.00 H new ATOM 0 HB2 SER A 9 20.487 -10.168 -5.508 1.00 0.00 H new ATOM 0 HB3 SER A 9 21.075 -8.584 -5.972 1.00 0.00 H new ATOM 0 HG SER A 9 18.927 -8.511 -5.128 1.00 0.00 H new ATOM 140 N GLU A 10 20.256 -8.622 -9.743 1.00 0.00 N ATOM 141 CA GLU A 10 20.534 -7.610 -10.777 1.00 0.00 C ATOM 142 C GLU A 10 19.398 -6.594 -10.961 1.00 0.00 C ATOM 143 O GLU A 10 19.462 -5.719 -11.826 1.00 0.00 O ATOM 144 CB GLU A 10 20.939 -8.301 -12.096 1.00 0.00 C ATOM 145 CG GLU A 10 19.743 -8.922 -12.839 1.00 0.00 C ATOM 146 CD GLU A 10 20.157 -9.856 -13.984 1.00 0.00 C ATOM 147 OE1 GLU A 10 21.046 -9.519 -14.802 1.00 0.00 O ATOM 148 OE2 GLU A 10 19.573 -10.958 -14.080 1.00 0.00 O ATOM 0 H GLU A 10 19.448 -9.207 -9.954 1.00 0.00 H new ATOM 0 HA GLU A 10 21.377 -7.012 -10.432 1.00 0.00 H new ATOM 0 HB2 GLU A 10 21.426 -7.574 -12.746 1.00 0.00 H new ATOM 0 HB3 GLU A 10 21.671 -9.079 -11.882 1.00 0.00 H new ATOM 0 HG2 GLU A 10 19.132 -9.479 -12.128 1.00 0.00 H new ATOM 0 HG3 GLU A 10 19.118 -8.123 -13.239 1.00 0.00 H new ATOM 155 N VAL A 11 18.340 -6.716 -10.165 1.00 0.00 N ATOM 156 CA VAL A 11 17.179 -5.831 -10.204 1.00 0.00 C ATOM 157 C VAL A 11 17.598 -4.405 -9.826 1.00 0.00 C ATOM 158 O VAL A 11 18.341 -4.210 -8.860 1.00 0.00 O ATOM 159 CB VAL A 11 16.046 -6.360 -9.302 1.00 0.00 C ATOM 160 CG1 VAL A 11 15.395 -7.602 -9.916 1.00 0.00 C ATOM 161 CG2 VAL A 11 16.532 -6.697 -7.887 1.00 0.00 C ATOM 0 H VAL A 11 18.264 -7.449 -9.459 1.00 0.00 H new ATOM 0 HA VAL A 11 16.784 -5.808 -11.220 1.00 0.00 H new ATOM 0 HB VAL A 11 15.314 -5.556 -9.228 1.00 0.00 H new ATOM 0 HG11 VAL A 11 14.599 -7.957 -9.261 1.00 0.00 H new ATOM 0 HG12 VAL A 11 14.978 -7.350 -10.891 1.00 0.00 H new ATOM 0 HG13 VAL A 11 16.144 -8.385 -10.033 1.00 0.00 H new ATOM 0 HG21 VAL A 11 15.695 -7.065 -7.293 1.00 0.00 H new ATOM 0 HG22 VAL A 11 17.304 -7.464 -7.941 1.00 0.00 H new ATOM 0 HG23 VAL A 11 16.942 -5.801 -7.420 1.00 0.00 H new ATOM 171 N ARG A 12 17.115 -3.402 -10.564 1.00 0.00 N ATOM 172 CA ARG A 12 17.470 -2.009 -10.301 1.00 0.00 C ATOM 173 C ARG A 12 16.542 -1.333 -9.309 1.00 0.00 C ATOM 174 O ARG A 12 16.985 -0.450 -8.573 1.00 0.00 O ATOM 175 CB ARG A 12 17.496 -1.206 -11.615 1.00 0.00 C ATOM 176 CG ARG A 12 18.665 -1.552 -12.552 1.00 0.00 C ATOM 177 CD ARG A 12 19.936 -0.731 -12.303 1.00 0.00 C ATOM 178 NE ARG A 12 20.508 -1.038 -10.990 1.00 0.00 N ATOM 179 CZ ARG A 12 20.464 -0.291 -9.889 1.00 0.00 C ATOM 180 NH1 ARG A 12 20.346 1.030 -9.968 1.00 0.00 N ATOM 181 NH2 ARG A 12 20.507 -0.902 -8.713 1.00 0.00 N ATOM 0 H ARG A 12 16.476 -3.531 -11.349 1.00 0.00 H new ATOM 0 HA ARG A 12 18.463 -2.025 -9.851 1.00 0.00 H new ATOM 0 HB2 ARG A 12 16.559 -1.373 -12.147 1.00 0.00 H new ATOM 0 HB3 ARG A 12 17.541 -0.144 -11.376 1.00 0.00 H new ATOM 0 HG2 ARG A 12 18.902 -2.610 -12.442 1.00 0.00 H new ATOM 0 HG3 ARG A 12 18.346 -1.402 -13.583 1.00 0.00 H new ATOM 0 HD2 ARG A 12 20.669 -0.943 -13.082 1.00 0.00 H new ATOM 0 HD3 ARG A 12 19.704 0.332 -12.364 1.00 0.00 H new ATOM 0 HE ARG A 12 20.998 -1.929 -10.910 1.00 0.00 H new ATOM 0 HH11 ARG A 12 20.288 1.483 -10.880 1.00 0.00 H new ATOM 0 HH12 ARG A 12 20.313 1.591 -9.117 1.00 0.00 H new ATOM 0 HH21 ARG A 12 20.572 -1.919 -8.669 1.00 0.00 H new ATOM 0 HH22 ARG A 12 20.475 -0.355 -7.853 1.00 0.00 H new ATOM 195 N GLN A 13 15.260 -1.693 -9.285 1.00 0.00 N ATOM 196 CA GLN A 13 14.287 -1.089 -8.389 1.00 0.00 C ATOM 197 C GLN A 13 14.463 -1.635 -6.973 1.00 0.00 C ATOM 198 O GLN A 13 13.961 -2.703 -6.626 1.00 0.00 O ATOM 199 CB GLN A 13 12.860 -1.293 -8.920 1.00 0.00 C ATOM 200 CG GLN A 13 12.644 -0.659 -10.305 1.00 0.00 C ATOM 201 CD GLN A 13 11.266 -0.952 -10.905 1.00 0.00 C ATOM 202 OE1 GLN A 13 10.365 -1.495 -10.274 1.00 0.00 O ATOM 203 NE2 GLN A 13 11.078 -0.606 -12.166 1.00 0.00 N ATOM 0 H GLN A 13 14.870 -2.415 -9.891 1.00 0.00 H new ATOM 0 HA GLN A 13 14.459 -0.013 -8.347 1.00 0.00 H new ATOM 0 HB2 GLN A 13 12.647 -2.361 -8.977 1.00 0.00 H new ATOM 0 HB3 GLN A 13 12.149 -0.864 -8.214 1.00 0.00 H new ATOM 0 HG2 GLN A 13 12.774 0.420 -10.226 1.00 0.00 H new ATOM 0 HG3 GLN A 13 13.413 -1.024 -10.986 1.00 0.00 H new ATOM 0 HE21 GLN A 13 11.829 -0.155 -12.688 1.00 0.00 H new ATOM 0 HE22 GLN A 13 10.182 -0.790 -12.617 1.00 0.00 H new ATOM 212 N LYS A 14 15.191 -0.891 -6.135 1.00 0.00 N ATOM 213 CA LYS A 14 15.416 -1.285 -4.745 1.00 0.00 C ATOM 214 C LYS A 14 14.093 -1.244 -3.980 1.00 0.00 C ATOM 215 O LYS A 14 13.884 -2.015 -3.048 1.00 0.00 O ATOM 216 CB LYS A 14 16.478 -0.386 -4.099 1.00 0.00 C ATOM 217 CG LYS A 14 16.032 1.075 -3.912 1.00 0.00 C ATOM 218 CD LYS A 14 17.200 1.982 -3.530 1.00 0.00 C ATOM 219 CE LYS A 14 17.766 1.612 -2.151 1.00 0.00 C ATOM 220 NZ LYS A 14 18.870 2.491 -1.726 1.00 0.00 N ATOM 0 H LYS A 14 15.635 -0.011 -6.398 1.00 0.00 H new ATOM 0 HA LYS A 14 15.795 -2.307 -4.711 1.00 0.00 H new ATOM 0 HB2 LYS A 14 16.747 -0.800 -3.127 1.00 0.00 H new ATOM 0 HB3 LYS A 14 17.378 -0.405 -4.714 1.00 0.00 H new ATOM 0 HG2 LYS A 14 15.578 1.437 -4.834 1.00 0.00 H new ATOM 0 HG3 LYS A 14 15.266 1.125 -3.138 1.00 0.00 H new ATOM 0 HD2 LYS A 14 17.986 1.902 -4.281 1.00 0.00 H new ATOM 0 HD3 LYS A 14 16.870 3.021 -3.523 1.00 0.00 H new ATOM 0 HE2 LYS A 14 16.966 1.659 -1.412 1.00 0.00 H new ATOM 0 HE3 LYS A 14 18.118 0.581 -2.174 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 19.210 2.193 -0.790 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 19.648 2.428 -2.413 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 18.532 3.473 -1.675 1.00 0.00 H new ATOM 234 N THR A 15 13.218 -0.315 -4.350 1.00 0.00 N ATOM 235 CA THR A 15 11.917 -0.129 -3.761 1.00 0.00 C ATOM 236 C THR A 15 10.958 -1.183 -4.336 1.00 0.00 C ATOM 237 O THR A 15 11.255 -1.883 -5.308 1.00 0.00 O ATOM 238 CB THR A 15 11.519 1.340 -4.021 1.00 0.00 C ATOM 239 OG1 THR A 15 10.494 1.829 -3.175 1.00 0.00 O ATOM 240 CG2 THR A 15 11.129 1.642 -5.472 1.00 0.00 C ATOM 0 H THR A 15 13.413 0.350 -5.099 1.00 0.00 H new ATOM 0 HA THR A 15 11.893 -0.284 -2.682 1.00 0.00 H new ATOM 0 HB THR A 15 12.445 1.866 -3.788 1.00 0.00 H new ATOM 0 HG1 THR A 15 10.270 1.149 -2.506 1.00 0.00 H new ATOM 0 HG21 THR A 15 10.864 2.695 -5.566 1.00 0.00 H new ATOM 0 HG22 THR A 15 11.970 1.419 -6.129 1.00 0.00 H new ATOM 0 HG23 THR A 15 10.275 1.026 -5.755 1.00 0.00 H new ATOM 248 N VAL A 16 9.799 -1.292 -3.709 1.00 0.00 N ATOM 249 CA VAL A 16 8.712 -2.189 -4.046 1.00 0.00 C ATOM 250 C VAL A 16 7.737 -1.372 -4.851 1.00 0.00 C ATOM 251 O VAL A 16 7.557 -0.195 -4.542 1.00 0.00 O ATOM 252 CB VAL A 16 7.988 -2.588 -2.749 1.00 0.00 C ATOM 253 CG1 VAL A 16 6.790 -3.515 -2.972 1.00 0.00 C ATOM 254 CG2 VAL A 16 8.935 -3.295 -1.799 1.00 0.00 C ATOM 0 H VAL A 16 9.580 -0.716 -2.896 1.00 0.00 H new ATOM 0 HA VAL A 16 9.072 -3.071 -4.575 1.00 0.00 H new ATOM 0 HB VAL A 16 7.626 -1.649 -2.330 1.00 0.00 H new ATOM 0 HG11 VAL A 16 6.331 -3.753 -2.013 1.00 0.00 H new ATOM 0 HG12 VAL A 16 6.060 -3.018 -3.611 1.00 0.00 H new ATOM 0 HG13 VAL A 16 7.126 -4.435 -3.451 1.00 0.00 H new ATOM 0 HG21 VAL A 16 8.401 -3.568 -0.889 1.00 0.00 H new ATOM 0 HG22 VAL A 16 9.323 -4.195 -2.275 1.00 0.00 H new ATOM 0 HG23 VAL A 16 9.762 -2.631 -1.549 1.00 0.00 H new ATOM 264 N VAL A 17 7.074 -1.966 -5.829 1.00 0.00 N ATOM 265 CA VAL A 17 6.100 -1.236 -6.600 1.00 0.00 C ATOM 266 C VAL A 17 4.976 -2.184 -6.977 1.00 0.00 C ATOM 267 O VAL A 17 5.105 -3.059 -7.836 1.00 0.00 O ATOM 268 CB VAL A 17 6.777 -0.457 -7.729 1.00 0.00 C ATOM 269 CG1 VAL A 17 7.337 -1.326 -8.849 1.00 0.00 C ATOM 270 CG2 VAL A 17 5.786 0.575 -8.257 1.00 0.00 C ATOM 0 H VAL A 17 7.195 -2.942 -6.101 1.00 0.00 H new ATOM 0 HA VAL A 17 5.619 -0.444 -6.026 1.00 0.00 H new ATOM 0 HB VAL A 17 7.658 0.032 -7.312 1.00 0.00 H new ATOM 0 HG11 VAL A 17 7.798 -0.692 -9.606 1.00 0.00 H new ATOM 0 HG12 VAL A 17 8.084 -2.007 -8.442 1.00 0.00 H new ATOM 0 HG13 VAL A 17 6.529 -1.902 -9.301 1.00 0.00 H new ATOM 0 HG21 VAL A 17 6.248 1.143 -9.064 1.00 0.00 H new ATOM 0 HG22 VAL A 17 4.898 0.067 -8.633 1.00 0.00 H new ATOM 0 HG23 VAL A 17 5.503 1.253 -7.452 1.00 0.00 H new ATOM 280 N ARG A 18 3.888 -2.096 -6.221 1.00 0.00 N ATOM 281 CA ARG A 18 2.705 -2.925 -6.471 1.00 0.00 C ATOM 282 C ARG A 18 1.446 -2.135 -6.198 1.00 0.00 C ATOM 283 O ARG A 18 1.471 -1.160 -5.447 1.00 0.00 O ATOM 284 CB ARG A 18 2.719 -4.240 -5.660 1.00 0.00 C ATOM 285 CG ARG A 18 3.214 -5.410 -6.523 1.00 0.00 C ATOM 286 CD ARG A 18 2.952 -6.766 -5.858 1.00 0.00 C ATOM 287 NE ARG A 18 3.577 -7.866 -6.615 1.00 0.00 N ATOM 288 CZ ARG A 18 3.174 -8.353 -7.795 1.00 0.00 C ATOM 289 NH1 ARG A 18 2.048 -7.929 -8.363 1.00 0.00 N ATOM 290 NH2 ARG A 18 3.934 -9.228 -8.442 1.00 0.00 N ATOM 0 H ARG A 18 3.796 -1.460 -5.429 1.00 0.00 H new ATOM 0 HA ARG A 18 2.726 -3.210 -7.523 1.00 0.00 H new ATOM 0 HB2 ARG A 18 3.364 -4.128 -4.788 1.00 0.00 H new ATOM 0 HB3 ARG A 18 1.717 -4.454 -5.290 1.00 0.00 H new ATOM 0 HG2 ARG A 18 2.718 -5.380 -7.493 1.00 0.00 H new ATOM 0 HG3 ARG A 18 4.282 -5.297 -6.708 1.00 0.00 H new ATOM 0 HD2 ARG A 18 3.342 -6.755 -4.840 1.00 0.00 H new ATOM 0 HD3 ARG A 18 1.878 -6.936 -5.786 1.00 0.00 H new ATOM 0 HE ARG A 18 4.400 -8.300 -6.197 1.00 0.00 H new ATOM 0 HH11 ARG A 18 1.477 -7.222 -7.899 1.00 0.00 H new ATOM 0 HH12 ARG A 18 1.755 -8.311 -9.263 1.00 0.00 H new ATOM 0 HH21 ARG A 18 4.822 -9.527 -8.040 1.00 0.00 H new ATOM 0 HH22 ARG A 18 3.630 -9.601 -9.341 1.00 0.00 H new ATOM 304 N THR A 19 0.349 -2.566 -6.802 1.00 0.00 N ATOM 305 CA THR A 19 -0.939 -1.930 -6.640 1.00 0.00 C ATOM 306 C THR A 19 -1.576 -2.543 -5.399 1.00 0.00 C ATOM 307 O THR A 19 -2.066 -3.676 -5.388 1.00 0.00 O ATOM 308 CB THR A 19 -1.733 -2.100 -7.924 1.00 0.00 C ATOM 309 OG1 THR A 19 -1.012 -1.479 -8.970 1.00 0.00 O ATOM 310 CG2 THR A 19 -3.080 -1.406 -7.846 1.00 0.00 C ATOM 0 H THR A 19 0.333 -3.375 -7.423 1.00 0.00 H new ATOM 0 HA THR A 19 -0.883 -0.853 -6.479 1.00 0.00 H new ATOM 0 HB THR A 19 -1.886 -3.166 -8.090 1.00 0.00 H new ATOM 0 HG1 THR A 19 -1.505 -1.578 -9.811 1.00 0.00 H new ATOM 0 HG21 THR A 19 -3.618 -1.550 -8.783 1.00 0.00 H new ATOM 0 HG22 THR A 19 -3.660 -1.828 -7.026 1.00 0.00 H new ATOM 0 HG23 THR A 19 -2.931 -0.340 -7.674 1.00 0.00 H new ATOM 318 N LEU A 20 -1.478 -1.790 -4.316 1.00 0.00 N ATOM 319 CA LEU A 20 -1.971 -2.108 -2.988 1.00 0.00 C ATOM 320 C LEU A 20 -3.344 -1.462 -2.847 1.00 0.00 C ATOM 321 O LEU A 20 -3.466 -0.297 -2.464 1.00 0.00 O ATOM 322 CB LEU A 20 -0.960 -1.644 -1.916 1.00 0.00 C ATOM 323 CG LEU A 20 -0.907 -2.515 -0.646 1.00 0.00 C ATOM 324 CD1 LEU A 20 -2.280 -2.908 -0.086 1.00 0.00 C ATOM 325 CD2 LEU A 20 -0.077 -3.785 -0.882 1.00 0.00 C ATOM 0 H LEU A 20 -1.021 -0.879 -4.344 1.00 0.00 H new ATOM 0 HA LEU A 20 -2.077 -3.183 -2.842 1.00 0.00 H new ATOM 0 HB2 LEU A 20 0.034 -1.620 -2.363 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -1.204 -0.622 -1.627 1.00 0.00 H new ATOM 0 HG LEU A 20 -0.432 -1.882 0.103 1.00 0.00 H new ATOM 0 HD11 LEU A 20 -2.147 -3.520 0.807 1.00 0.00 H new ATOM 0 HD12 LEU A 20 -2.839 -2.008 0.170 1.00 0.00 H new ATOM 0 HD13 LEU A 20 -2.830 -3.476 -0.836 1.00 0.00 H new ATOM 0 HD21 LEU A 20 -0.056 -4.381 0.030 1.00 0.00 H new ATOM 0 HD22 LEU A 20 -0.525 -4.368 -1.686 1.00 0.00 H new ATOM 0 HD23 LEU A 20 0.941 -3.509 -1.158 1.00 0.00 H new ATOM 337 N ARG A 21 -4.370 -2.184 -3.285 1.00 0.00 N ATOM 338 CA ARG A 21 -5.747 -1.727 -3.212 1.00 0.00 C ATOM 339 C ARG A 21 -6.288 -1.875 -1.794 1.00 0.00 C ATOM 340 O ARG A 21 -5.742 -2.616 -0.972 1.00 0.00 O ATOM 341 CB ARG A 21 -6.614 -2.467 -4.248 1.00 0.00 C ATOM 342 CG ARG A 21 -6.788 -1.549 -5.463 1.00 0.00 C ATOM 343 CD ARG A 21 -7.468 -2.173 -6.671 1.00 0.00 C ATOM 344 NE ARG A 21 -8.763 -2.759 -6.303 1.00 0.00 N ATOM 345 CZ ARG A 21 -9.299 -3.906 -6.727 1.00 0.00 C ATOM 346 NH1 ARG A 21 -8.699 -4.652 -7.647 1.00 0.00 N ATOM 347 NH2 ARG A 21 -10.458 -4.298 -6.210 1.00 0.00 N ATOM 0 H ARG A 21 -4.265 -3.109 -3.703 1.00 0.00 H new ATOM 0 HA ARG A 21 -5.783 -0.666 -3.458 1.00 0.00 H new ATOM 0 HB2 ARG A 21 -6.140 -3.403 -4.543 1.00 0.00 H new ATOM 0 HB3 ARG A 21 -7.584 -2.722 -3.821 1.00 0.00 H new ATOM 0 HG2 ARG A 21 -7.364 -0.676 -5.156 1.00 0.00 H new ATOM 0 HG3 ARG A 21 -5.805 -1.191 -5.768 1.00 0.00 H new ATOM 0 HD2 ARG A 21 -7.613 -1.416 -7.442 1.00 0.00 H new ATOM 0 HD3 ARG A 21 -6.825 -2.943 -7.097 1.00 0.00 H new ATOM 0 HE ARG A 21 -9.323 -2.223 -5.641 1.00 0.00 H new ATOM 0 HH11 ARG A 21 -7.809 -4.352 -8.046 1.00 0.00 H new ATOM 0 HH12 ARG A 21 -9.128 -5.525 -7.955 1.00 0.00 H new ATOM 0 HH21 ARG A 21 -10.921 -3.726 -5.503 1.00 0.00 H new ATOM 0 HH22 ARG A 21 -10.885 -5.171 -6.520 1.00 0.00 H new ATOM 361 N PHE A 22 -7.383 -1.165 -1.538 1.00 0.00 N ATOM 362 CA PHE A 22 -8.111 -1.141 -0.278 1.00 0.00 C ATOM 363 C PHE A 22 -9.594 -1.129 -0.592 1.00 0.00 C ATOM 364 O PHE A 22 -9.982 -1.025 -1.760 1.00 0.00 O ATOM 365 CB PHE A 22 -7.717 0.070 0.576 1.00 0.00 C ATOM 366 CG PHE A 22 -6.288 0.017 1.071 1.00 0.00 C ATOM 367 CD1 PHE A 22 -5.248 0.505 0.259 1.00 0.00 C ATOM 368 CD2 PHE A 22 -5.994 -0.556 2.323 1.00 0.00 C ATOM 369 CE1 PHE A 22 -3.914 0.393 0.678 1.00 0.00 C ATOM 370 CE2 PHE A 22 -4.662 -0.642 2.756 1.00 0.00 C ATOM 371 CZ PHE A 22 -3.619 -0.184 1.931 1.00 0.00 C ATOM 0 H PHE A 22 -7.806 -0.560 -2.242 1.00 0.00 H new ATOM 0 HA PHE A 22 -7.860 -2.026 0.307 1.00 0.00 H new ATOM 0 HB2 PHE A 22 -7.858 0.979 -0.009 1.00 0.00 H new ATOM 0 HB3 PHE A 22 -8.388 0.135 1.432 1.00 0.00 H new ATOM 0 HD1 PHE A 22 -5.477 0.967 -0.690 1.00 0.00 H new ATOM 0 HD2 PHE A 22 -6.792 -0.928 2.949 1.00 0.00 H new ATOM 0 HE1 PHE A 22 -3.115 0.747 0.043 1.00 0.00 H new ATOM 0 HE2 PHE A 22 -4.437 -1.061 3.726 1.00 0.00 H new ATOM 0 HZ PHE A 22 -2.593 -0.274 2.257 1.00 0.00 H new ATOM 381 N SER A 23 -10.430 -1.289 0.419 1.00 0.00 N ATOM 382 CA SER A 23 -11.883 -1.288 0.293 1.00 0.00 C ATOM 383 C SER A 23 -12.413 0.049 0.863 1.00 0.00 C ATOM 384 O SER A 23 -11.609 0.802 1.416 1.00 0.00 O ATOM 385 CB SER A 23 -12.400 -2.589 0.909 1.00 0.00 C ATOM 386 OG SER A 23 -11.649 -3.694 0.429 1.00 0.00 O ATOM 0 H SER A 23 -10.111 -1.427 1.378 1.00 0.00 H new ATOM 0 HA SER A 23 -12.259 -1.303 -0.730 1.00 0.00 H new ATOM 0 HB2 SER A 23 -12.330 -2.538 1.996 1.00 0.00 H new ATOM 0 HB3 SER A 23 -13.454 -2.722 0.663 1.00 0.00 H new ATOM 0 HG SER A 23 -11.186 -4.125 1.178 1.00 0.00 H new ATOM 392 N PRO A 24 -13.704 0.412 0.755 1.00 0.00 N ATOM 393 CA PRO A 24 -14.167 1.703 1.255 1.00 0.00 C ATOM 394 C PRO A 24 -14.180 1.792 2.778 1.00 0.00 C ATOM 395 O PRO A 24 -13.969 2.882 3.315 1.00 0.00 O ATOM 396 CB PRO A 24 -15.551 1.906 0.642 1.00 0.00 C ATOM 397 CG PRO A 24 -16.065 0.478 0.499 1.00 0.00 C ATOM 398 CD PRO A 24 -14.808 -0.327 0.167 1.00 0.00 C ATOM 0 HA PRO A 24 -13.481 2.498 0.963 1.00 0.00 H new ATOM 0 HB2 PRO A 24 -16.195 2.506 1.285 1.00 0.00 H new ATOM 0 HB3 PRO A 24 -15.497 2.416 -0.320 1.00 0.00 H new ATOM 0 HG2 PRO A 24 -16.534 0.127 1.418 1.00 0.00 H new ATOM 0 HG3 PRO A 24 -16.812 0.398 -0.291 1.00 0.00 H new ATOM 0 HD2 PRO A 24 -14.868 -1.335 0.578 1.00 0.00 H new ATOM 0 HD3 PRO A 24 -14.681 -0.429 -0.911 1.00 0.00 H new ATOM 406 N VAL A 25 -14.468 0.699 3.488 1.00 0.00 N ATOM 407 CA VAL A 25 -14.480 0.713 4.946 1.00 0.00 C ATOM 408 C VAL A 25 -13.020 0.674 5.412 1.00 0.00 C ATOM 409 O VAL A 25 -12.683 1.330 6.393 1.00 0.00 O ATOM 410 CB VAL A 25 -15.345 -0.442 5.490 1.00 0.00 C ATOM 411 CG1 VAL A 25 -15.490 -0.367 7.019 1.00 0.00 C ATOM 412 CG2 VAL A 25 -16.766 -0.428 4.900 1.00 0.00 C ATOM 0 H VAL A 25 -14.695 -0.205 3.074 1.00 0.00 H new ATOM 0 HA VAL A 25 -14.941 1.618 5.342 1.00 0.00 H new ATOM 0 HB VAL A 25 -14.828 -1.356 5.198 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -16.106 -1.196 7.367 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -14.505 -0.427 7.481 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -15.963 0.576 7.294 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -17.339 -1.259 5.311 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -17.256 0.512 5.154 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -16.711 -0.527 3.816 1.00 0.00 H new ATOM 422 N GLU A 26 -12.146 -0.059 4.704 1.00 0.00 N ATOM 423 CA GLU A 26 -10.727 -0.144 5.043 1.00 0.00 C ATOM 424 C GLU A 26 -10.144 1.269 4.945 1.00 0.00 C ATOM 425 O GLU A 26 -9.567 1.781 5.901 1.00 0.00 O ATOM 426 CB GLU A 26 -9.955 -1.075 4.086 1.00 0.00 C ATOM 427 CG GLU A 26 -10.329 -2.566 4.121 1.00 0.00 C ATOM 428 CD GLU A 26 -9.672 -3.363 2.978 1.00 0.00 C ATOM 429 OE1 GLU A 26 -8.643 -2.929 2.418 1.00 0.00 O ATOM 430 OE2 GLU A 26 -10.236 -4.393 2.528 1.00 0.00 O ATOM 0 H GLU A 26 -12.408 -0.606 3.884 1.00 0.00 H new ATOM 0 HA GLU A 26 -10.629 -0.557 6.047 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -10.099 -0.712 3.068 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -8.892 -0.986 4.309 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -10.026 -2.991 5.078 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -11.412 -2.668 4.055 1.00 0.00 H new ATOM 437 N ASP A 27 -10.344 1.896 3.782 1.00 0.00 N ATOM 438 CA ASP A 27 -9.879 3.236 3.465 1.00 0.00 C ATOM 439 C ASP A 27 -10.410 4.248 4.457 1.00 0.00 C ATOM 440 O ASP A 27 -9.645 5.076 4.916 1.00 0.00 O ATOM 441 CB ASP A 27 -10.348 3.632 2.071 1.00 0.00 C ATOM 442 CG ASP A 27 -9.910 5.056 1.715 1.00 0.00 C ATOM 443 OD1 ASP A 27 -8.687 5.336 1.751 1.00 0.00 O ATOM 444 OD2 ASP A 27 -10.790 5.859 1.323 1.00 0.00 O ATOM 0 H ASP A 27 -10.854 1.463 3.012 1.00 0.00 H new ATOM 0 HA ASP A 27 -8.790 3.229 3.511 1.00 0.00 H new ATOM 0 HB2 ASP A 27 -9.946 2.933 1.338 1.00 0.00 H new ATOM 0 HB3 ASP A 27 -11.434 3.560 2.017 1.00 0.00 H new ATOM 449 N GLU A 28 -11.706 4.207 4.778 1.00 0.00 N ATOM 450 CA GLU A 28 -12.302 5.134 5.724 1.00 0.00 C ATOM 451 C GLU A 28 -11.615 5.050 7.089 1.00 0.00 C ATOM 452 O GLU A 28 -11.213 6.087 7.613 1.00 0.00 O ATOM 453 CB GLU A 28 -13.819 4.914 5.810 1.00 0.00 C ATOM 454 CG GLU A 28 -14.417 5.896 6.818 1.00 0.00 C ATOM 455 CD GLU A 28 -15.857 6.267 6.501 1.00 0.00 C ATOM 456 OE1 GLU A 28 -16.774 5.445 6.729 1.00 0.00 O ATOM 457 OE2 GLU A 28 -16.064 7.430 6.095 1.00 0.00 O ATOM 0 H GLU A 28 -12.363 3.531 4.388 1.00 0.00 H new ATOM 0 HA GLU A 28 -12.145 6.151 5.364 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -14.275 5.058 4.830 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -14.033 3.889 6.113 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -14.371 5.458 7.815 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -13.810 6.801 6.839 1.00 0.00 H new ATOM 464 N THR A 29 -11.471 3.852 7.664 1.00 0.00 N ATOM 465 CA THR A 29 -10.818 3.684 8.957 1.00 0.00 C ATOM 466 C THR A 29 -9.394 4.256 8.891 1.00 0.00 C ATOM 467 O THR A 29 -9.015 5.093 9.716 1.00 0.00 O ATOM 468 CB THR A 29 -10.812 2.186 9.315 1.00 0.00 C ATOM 469 OG1 THR A 29 -12.121 1.656 9.456 1.00 0.00 O ATOM 470 CG2 THR A 29 -10.060 1.877 10.606 1.00 0.00 C ATOM 0 H THR A 29 -11.802 2.982 7.248 1.00 0.00 H new ATOM 0 HA THR A 29 -11.357 4.225 9.735 1.00 0.00 H new ATOM 0 HB THR A 29 -10.301 1.718 8.474 1.00 0.00 H new ATOM 0 HG1 THR A 29 -12.504 1.491 8.569 1.00 0.00 H new ATOM 0 HG21 THR A 29 -10.094 0.805 10.799 1.00 0.00 H new ATOM 0 HG22 THR A 29 -9.022 2.195 10.507 1.00 0.00 H new ATOM 0 HG23 THR A 29 -10.526 2.410 11.435 1.00 0.00 H new ATOM 478 N ILE A 30 -8.614 3.820 7.895 1.00 0.00 N ATOM 479 CA ILE A 30 -7.238 4.255 7.706 1.00 0.00 C ATOM 480 C ILE A 30 -7.175 5.769 7.575 1.00 0.00 C ATOM 481 O ILE A 30 -6.344 6.409 8.211 1.00 0.00 O ATOM 482 CB ILE A 30 -6.605 3.530 6.500 1.00 0.00 C ATOM 483 CG1 ILE A 30 -6.459 2.037 6.866 1.00 0.00 C ATOM 484 CG2 ILE A 30 -5.232 4.134 6.127 1.00 0.00 C ATOM 485 CD1 ILE A 30 -6.102 1.175 5.660 1.00 0.00 C ATOM 0 H ILE A 30 -8.930 3.149 7.195 1.00 0.00 H new ATOM 0 HA ILE A 30 -6.651 3.985 8.584 1.00 0.00 H new ATOM 0 HB ILE A 30 -7.248 3.649 5.628 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -5.688 1.926 7.629 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -7.392 1.679 7.301 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -4.818 3.597 5.274 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -5.355 5.186 5.869 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -4.553 4.046 6.975 1.00 0.00 H new ATOM 0 HD11 ILE A 30 -6.011 0.134 5.971 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -6.885 1.261 4.906 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -5.155 1.512 5.239 1.00 0.00 H new ATOM 497 N ARG A 31 -8.034 6.352 6.747 1.00 0.00 N ATOM 498 CA ARG A 31 -8.080 7.779 6.505 1.00 0.00 C ATOM 499 C ARG A 31 -8.402 8.554 7.769 1.00 0.00 C ATOM 500 O ARG A 31 -7.736 9.552 8.028 1.00 0.00 O ATOM 501 CB ARG A 31 -9.057 8.053 5.362 1.00 0.00 C ATOM 502 CG ARG A 31 -8.883 9.476 4.858 1.00 0.00 C ATOM 503 CD ARG A 31 -9.722 9.677 3.595 1.00 0.00 C ATOM 504 NE ARG A 31 -9.472 11.015 3.042 1.00 0.00 N ATOM 505 CZ ARG A 31 -8.299 11.477 2.593 1.00 0.00 C ATOM 506 NH1 ARG A 31 -7.324 10.642 2.232 1.00 0.00 N ATOM 507 NH2 ARG A 31 -8.101 12.789 2.527 1.00 0.00 N ATOM 0 H ARG A 31 -8.731 5.829 6.216 1.00 0.00 H new ATOM 0 HA ARG A 31 -7.095 8.134 6.202 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -8.885 7.347 4.549 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -10.081 7.902 5.704 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -9.189 10.185 5.627 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -7.832 9.671 4.644 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -9.473 8.915 2.856 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -10.781 9.561 3.828 1.00 0.00 H new ATOM 0 HE ARG A 31 -10.267 11.652 2.996 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -7.466 9.634 2.296 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -6.436 11.011 1.892 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -8.839 13.431 2.817 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -7.211 13.154 2.187 1.00 0.00 H new ATOM 521 N LYS A 32 -9.386 8.112 8.555 1.00 0.00 N ATOM 522 CA LYS A 32 -9.746 8.796 9.791 1.00 0.00 C ATOM 523 C LYS A 32 -8.546 8.841 10.717 1.00 0.00 C ATOM 524 O LYS A 32 -8.216 9.910 11.228 1.00 0.00 O ATOM 525 CB LYS A 32 -10.920 8.097 10.503 1.00 0.00 C ATOM 526 CG LYS A 32 -12.251 8.806 10.249 1.00 0.00 C ATOM 527 CD LYS A 32 -12.795 8.593 8.839 1.00 0.00 C ATOM 528 CE LYS A 32 -14.040 9.463 8.696 1.00 0.00 C ATOM 529 NZ LYS A 32 -14.598 9.451 7.332 1.00 0.00 N ATOM 0 H LYS A 32 -9.946 7.283 8.354 1.00 0.00 H new ATOM 0 HA LYS A 32 -10.059 9.808 9.536 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -10.988 7.065 10.160 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -10.726 8.065 11.575 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -12.986 8.451 10.971 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -12.123 9.874 10.423 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -12.048 8.866 8.094 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -13.039 7.543 8.676 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -14.800 9.117 9.397 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -13.794 10.488 8.973 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -15.164 10.310 7.181 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -13.822 9.422 6.640 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -15.202 8.613 7.211 1.00 0.00 H new ATOM 543 N LYS A 33 -7.920 7.687 10.950 1.00 0.00 N ATOM 544 CA LYS A 33 -6.768 7.562 11.830 1.00 0.00 C ATOM 545 C LYS A 33 -5.601 8.370 11.300 1.00 0.00 C ATOM 546 O LYS A 33 -4.997 9.096 12.083 1.00 0.00 O ATOM 547 CB LYS A 33 -6.420 6.077 12.040 1.00 0.00 C ATOM 548 CG LYS A 33 -6.955 5.543 13.376 1.00 0.00 C ATOM 549 CD LYS A 33 -8.473 5.713 13.586 1.00 0.00 C ATOM 550 CE LYS A 33 -8.950 5.216 14.959 1.00 0.00 C ATOM 551 NZ LYS A 33 -8.158 5.777 16.078 1.00 0.00 N ATOM 0 H LYS A 33 -8.206 6.805 10.526 1.00 0.00 H new ATOM 0 HA LYS A 33 -7.013 7.975 12.809 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -6.836 5.488 11.222 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -5.338 5.950 12.006 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -6.710 4.484 13.451 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -6.432 6.049 14.188 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -8.733 6.766 13.477 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -9.005 5.170 12.805 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -9.999 5.482 15.093 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -8.891 4.128 14.987 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -8.639 5.577 16.978 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -7.213 5.343 16.087 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -8.065 6.806 15.956 1.00 0.00 H new ATOM 565 N ALA A 34 -5.287 8.260 10.014 1.00 0.00 N ATOM 566 CA ALA A 34 -4.203 8.982 9.374 1.00 0.00 C ATOM 567 C ALA A 34 -4.387 10.482 9.584 1.00 0.00 C ATOM 568 O ALA A 34 -3.496 11.129 10.140 1.00 0.00 O ATOM 569 CB ALA A 34 -4.155 8.620 7.891 1.00 0.00 C ATOM 0 H ALA A 34 -5.795 7.649 9.374 1.00 0.00 H new ATOM 0 HA ALA A 34 -3.250 8.699 9.821 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -3.341 9.162 7.410 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -3.990 7.548 7.783 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -5.100 8.891 7.420 1.00 0.00 H new ATOM 575 N GLU A 35 -5.549 11.013 9.189 1.00 0.00 N ATOM 576 CA GLU A 35 -5.831 12.439 9.298 1.00 0.00 C ATOM 577 C GLU A 35 -5.766 12.915 10.750 1.00 0.00 C ATOM 578 O GLU A 35 -5.228 13.992 11.019 1.00 0.00 O ATOM 579 CB GLU A 35 -7.153 12.787 8.587 1.00 0.00 C ATOM 580 CG GLU A 35 -7.332 14.308 8.383 1.00 0.00 C ATOM 581 CD GLU A 35 -8.068 14.659 7.083 1.00 0.00 C ATOM 582 OE1 GLU A 35 -7.593 14.242 5.994 1.00 0.00 O ATOM 583 OE2 GLU A 35 -9.108 15.364 7.117 1.00 0.00 O ATOM 0 H GLU A 35 -6.312 10.467 8.788 1.00 0.00 H new ATOM 0 HA GLU A 35 -5.049 12.993 8.779 1.00 0.00 H new ATOM 0 HB2 GLU A 35 -7.183 12.288 7.619 1.00 0.00 H new ATOM 0 HB3 GLU A 35 -7.989 12.401 9.171 1.00 0.00 H new ATOM 0 HG2 GLU A 35 -7.884 14.719 9.228 1.00 0.00 H new ATOM 0 HG3 GLU A 35 -6.352 14.786 8.379 1.00 0.00 H new ATOM 590 N ASP A 36 -6.252 12.099 11.689 1.00 0.00 N ATOM 591 CA ASP A 36 -6.250 12.408 13.116 1.00 0.00 C ATOM 592 C ASP A 36 -4.831 12.327 13.700 1.00 0.00 C ATOM 593 O ASP A 36 -4.536 12.954 14.722 1.00 0.00 O ATOM 594 CB ASP A 36 -7.201 11.446 13.829 1.00 0.00 C ATOM 595 CG ASP A 36 -7.376 11.818 15.293 1.00 0.00 C ATOM 596 OD1 ASP A 36 -8.000 12.872 15.563 1.00 0.00 O ATOM 597 OD2 ASP A 36 -6.937 11.025 16.161 1.00 0.00 O ATOM 0 H ASP A 36 -6.664 11.191 11.473 1.00 0.00 H new ATOM 0 HA ASP A 36 -6.594 13.431 13.266 1.00 0.00 H new ATOM 0 HB2 ASP A 36 -8.171 11.456 13.332 1.00 0.00 H new ATOM 0 HB3 ASP A 36 -6.815 10.429 13.754 1.00 0.00 H new ATOM 602 N SER A 37 -3.953 11.541 13.063 1.00 0.00 N ATOM 603 CA SER A 37 -2.549 11.344 13.415 1.00 0.00 C ATOM 604 C SER A 37 -1.717 12.482 12.809 1.00 0.00 C ATOM 605 O SER A 37 -0.524 12.589 13.099 1.00 0.00 O ATOM 606 CB SER A 37 -2.037 10.001 12.844 1.00 0.00 C ATOM 607 OG SER A 37 -0.940 9.460 13.556 1.00 0.00 O ATOM 0 H SER A 37 -4.223 10.997 12.243 1.00 0.00 H new ATOM 0 HA SER A 37 -2.454 11.335 14.501 1.00 0.00 H new ATOM 0 HB2 SER A 37 -2.854 9.279 12.850 1.00 0.00 H new ATOM 0 HB3 SER A 37 -1.747 10.146 11.803 1.00 0.00 H new ATOM 0 HG SER A 37 -0.668 8.613 13.144 1.00 0.00 H new ATOM 613 N GLY A 38 -2.322 13.325 11.964 1.00 0.00 N ATOM 614 CA GLY A 38 -1.654 14.427 11.306 1.00 0.00 C ATOM 615 C GLY A 38 -0.812 13.952 10.121 1.00 0.00 C ATOM 616 O GLY A 38 -0.055 14.753 9.572 1.00 0.00 O ATOM 0 H GLY A 38 -3.310 13.249 11.721 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -2.395 15.148 10.960 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -1.016 14.945 12.022 1.00 0.00 H new ATOM 620 N LEU A 39 -0.903 12.682 9.708 1.00 0.00 N ATOM 621 CA LEU A 39 -0.139 12.096 8.621 1.00 0.00 C ATOM 622 C LEU A 39 -1.041 11.649 7.487 1.00 0.00 C ATOM 623 O LEU A 39 -2.219 11.349 7.649 1.00 0.00 O ATOM 624 CB LEU A 39 0.590 10.826 9.116 1.00 0.00 C ATOM 625 CG LEU A 39 1.581 11.013 10.270 1.00 0.00 C ATOM 626 CD1 LEU A 39 2.339 9.699 10.448 1.00 0.00 C ATOM 627 CD2 LEU A 39 2.589 12.145 10.031 1.00 0.00 C ATOM 0 H LEU A 39 -1.539 12.015 10.145 1.00 0.00 H new ATOM 0 HA LEU A 39 0.557 12.861 8.277 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -0.162 10.100 9.426 1.00 0.00 H new ATOM 0 HB3 LEU A 39 1.126 10.390 8.273 1.00 0.00 H new ATOM 0 HG LEU A 39 1.013 11.287 11.159 1.00 0.00 H new ATOM 0 HD11 LEU A 39 3.054 9.799 11.264 1.00 0.00 H new ATOM 0 HD12 LEU A 39 1.634 8.901 10.680 1.00 0.00 H new ATOM 0 HD13 LEU A 39 2.870 9.458 9.527 1.00 0.00 H new ATOM 0 HD21 LEU A 39 3.260 12.222 10.887 1.00 0.00 H new ATOM 0 HD22 LEU A 39 3.169 11.932 9.133 1.00 0.00 H new ATOM 0 HD23 LEU A 39 2.055 13.087 9.903 1.00 0.00 H new ATOM 639 N THR A 40 -0.462 11.596 6.301 1.00 0.00 N ATOM 640 CA THR A 40 -1.153 11.113 5.126 1.00 0.00 C ATOM 641 C THR A 40 -1.193 9.606 5.313 1.00 0.00 C ATOM 642 O THR A 40 -0.289 8.998 5.901 1.00 0.00 O ATOM 643 CB THR A 40 -0.395 11.525 3.847 1.00 0.00 C ATOM 644 OG1 THR A 40 -0.859 10.781 2.736 1.00 0.00 O ATOM 645 CG2 THR A 40 1.123 11.329 3.973 1.00 0.00 C ATOM 0 H THR A 40 0.500 11.887 6.129 1.00 0.00 H new ATOM 0 HA THR A 40 -2.154 11.528 5.013 1.00 0.00 H new ATOM 0 HB THR A 40 -0.590 12.587 3.701 1.00 0.00 H new ATOM 0 HG1 THR A 40 -0.370 11.055 1.932 1.00 0.00 H new ATOM 0 HG21 THR A 40 1.607 11.634 3.045 1.00 0.00 H new ATOM 0 HG22 THR A 40 1.501 11.935 4.796 1.00 0.00 H new ATOM 0 HG23 THR A 40 1.339 10.278 4.167 1.00 0.00 H new ATOM 653 N VAL A 41 -2.221 9.000 4.737 1.00 0.00 N ATOM 654 CA VAL A 41 -2.442 7.577 4.769 1.00 0.00 C ATOM 655 C VAL A 41 -1.185 6.817 4.327 1.00 0.00 C ATOM 656 O VAL A 41 -0.941 5.728 4.820 1.00 0.00 O ATOM 657 CB VAL A 41 -3.687 7.235 3.948 1.00 0.00 C ATOM 658 CG1 VAL A 41 -4.929 7.998 4.427 1.00 0.00 C ATOM 659 CG2 VAL A 41 -3.518 7.414 2.439 1.00 0.00 C ATOM 0 H VAL A 41 -2.940 9.507 4.222 1.00 0.00 H new ATOM 0 HA VAL A 41 -2.634 7.252 5.792 1.00 0.00 H new ATOM 0 HB VAL A 41 -3.833 6.169 4.124 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -5.786 7.721 3.813 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -5.132 7.746 5.468 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -4.753 9.070 4.341 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -4.448 7.150 1.935 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -3.270 8.453 2.221 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -2.716 6.767 2.083 1.00 0.00 H new ATOM 669 N SER A 42 -0.362 7.373 3.430 1.00 0.00 N ATOM 670 CA SER A 42 0.872 6.736 2.975 1.00 0.00 C ATOM 671 C SER A 42 1.804 6.537 4.180 1.00 0.00 C ATOM 672 O SER A 42 2.179 5.409 4.507 1.00 0.00 O ATOM 673 CB SER A 42 1.501 7.596 1.871 1.00 0.00 C ATOM 674 OG SER A 42 2.780 7.131 1.503 1.00 0.00 O ATOM 0 H SER A 42 -0.537 8.281 3.000 1.00 0.00 H new ATOM 0 HA SER A 42 0.677 5.752 2.548 1.00 0.00 H new ATOM 0 HB2 SER A 42 0.850 7.596 0.997 1.00 0.00 H new ATOM 0 HB3 SER A 42 1.575 8.628 2.214 1.00 0.00 H new ATOM 0 HG SER A 42 3.146 7.704 0.797 1.00 0.00 H new ATOM 680 N ALA A 43 2.164 7.634 4.857 1.00 0.00 N ATOM 681 CA ALA A 43 3.018 7.611 6.033 1.00 0.00 C ATOM 682 C ALA A 43 2.370 6.745 7.114 1.00 0.00 C ATOM 683 O ALA A 43 3.070 6.001 7.787 1.00 0.00 O ATOM 684 CB ALA A 43 3.276 9.029 6.549 1.00 0.00 C ATOM 0 H ALA A 43 1.862 8.572 4.593 1.00 0.00 H new ATOM 0 HA ALA A 43 3.983 7.181 5.764 1.00 0.00 H new ATOM 0 HB1 ALA A 43 3.917 8.985 7.429 1.00 0.00 H new ATOM 0 HB2 ALA A 43 3.766 9.615 5.772 1.00 0.00 H new ATOM 0 HB3 ALA A 43 2.328 9.498 6.814 1.00 0.00 H new ATOM 690 N TYR A 44 1.045 6.823 7.278 1.00 0.00 N ATOM 691 CA TYR A 44 0.329 6.028 8.263 1.00 0.00 C ATOM 692 C TYR A 44 0.522 4.533 7.963 1.00 0.00 C ATOM 693 O TYR A 44 0.910 3.791 8.858 1.00 0.00 O ATOM 694 CB TYR A 44 -1.150 6.414 8.294 1.00 0.00 C ATOM 695 CG TYR A 44 -1.954 5.587 9.274 1.00 0.00 C ATOM 696 CD1 TYR A 44 -2.037 5.965 10.626 1.00 0.00 C ATOM 697 CD2 TYR A 44 -2.583 4.407 8.833 1.00 0.00 C ATOM 698 CE1 TYR A 44 -2.743 5.158 11.534 1.00 0.00 C ATOM 699 CE2 TYR A 44 -3.305 3.604 9.730 1.00 0.00 C ATOM 700 CZ TYR A 44 -3.370 3.969 11.096 1.00 0.00 C ATOM 701 OH TYR A 44 -4.054 3.214 11.999 1.00 0.00 O ATOM 0 H TYR A 44 0.446 7.440 6.729 1.00 0.00 H new ATOM 0 HA TYR A 44 0.735 6.230 9.254 1.00 0.00 H new ATOM 0 HB2 TYR A 44 -1.240 7.468 8.556 1.00 0.00 H new ATOM 0 HB3 TYR A 44 -1.572 6.297 7.296 1.00 0.00 H new ATOM 0 HD1 TYR A 44 -1.560 6.872 10.965 1.00 0.00 H new ATOM 0 HD2 TYR A 44 -2.509 4.117 7.795 1.00 0.00 H new ATOM 0 HE1 TYR A 44 -2.807 5.448 12.572 1.00 0.00 H new ATOM 0 HE2 TYR A 44 -3.807 2.714 9.380 1.00 0.00 H new ATOM 0 HH TYR A 44 -4.471 2.454 11.541 1.00 0.00 H new ATOM 711 N ILE A 45 0.296 4.092 6.718 1.00 0.00 N ATOM 712 CA ILE A 45 0.435 2.705 6.275 1.00 0.00 C ATOM 713 C ILE A 45 1.838 2.198 6.589 1.00 0.00 C ATOM 714 O ILE A 45 1.986 1.251 7.360 1.00 0.00 O ATOM 715 CB ILE A 45 0.117 2.567 4.759 1.00 0.00 C ATOM 716 CG1 ILE A 45 -1.389 2.634 4.434 1.00 0.00 C ATOM 717 CG2 ILE A 45 0.715 1.293 4.122 1.00 0.00 C ATOM 718 CD1 ILE A 45 -2.183 1.400 4.847 1.00 0.00 C ATOM 0 H ILE A 45 0.001 4.717 5.968 1.00 0.00 H new ATOM 0 HA ILE A 45 -0.286 2.093 6.816 1.00 0.00 H new ATOM 0 HB ILE A 45 0.601 3.438 4.317 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -1.816 3.507 4.929 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -1.509 2.785 3.361 1.00 0.00 H new ATOM 0 HG21 ILE A 45 0.455 1.259 3.064 1.00 0.00 H new ATOM 0 HG22 ILE A 45 1.800 1.307 4.229 1.00 0.00 H new ATOM 0 HG23 ILE A 45 0.312 0.412 4.623 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -3.231 1.536 4.580 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -1.788 0.524 4.333 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -2.099 1.257 5.924 1.00 0.00 H new ATOM 730 N ARG A 46 2.863 2.808 5.984 1.00 0.00 N ATOM 731 CA ARG A 46 4.249 2.410 6.167 1.00 0.00 C ATOM 732 C ARG A 46 4.604 2.361 7.646 1.00 0.00 C ATOM 733 O ARG A 46 5.215 1.390 8.075 1.00 0.00 O ATOM 734 CB ARG A 46 5.196 3.280 5.310 1.00 0.00 C ATOM 735 CG ARG A 46 5.570 4.633 5.919 1.00 0.00 C ATOM 736 CD ARG A 46 6.331 5.520 4.935 1.00 0.00 C ATOM 737 NE ARG A 46 6.687 6.794 5.568 1.00 0.00 N ATOM 738 CZ ARG A 46 7.501 7.731 5.080 1.00 0.00 C ATOM 739 NH1 ARG A 46 8.094 7.613 3.894 1.00 0.00 N ATOM 740 NH2 ARG A 46 7.705 8.816 5.811 1.00 0.00 N ATOM 0 H ARG A 46 2.745 3.598 5.350 1.00 0.00 H new ATOM 0 HA ARG A 46 4.385 1.393 5.799 1.00 0.00 H new ATOM 0 HB2 ARG A 46 6.111 2.718 5.125 1.00 0.00 H new ATOM 0 HB3 ARG A 46 4.727 3.453 4.341 1.00 0.00 H new ATOM 0 HG2 ARG A 46 4.664 5.146 6.242 1.00 0.00 H new ATOM 0 HG3 ARG A 46 6.180 4.473 6.808 1.00 0.00 H new ATOM 0 HD2 ARG A 46 7.233 5.009 4.597 1.00 0.00 H new ATOM 0 HD3 ARG A 46 5.719 5.703 4.052 1.00 0.00 H new ATOM 0 HE ARG A 46 6.268 6.984 6.478 1.00 0.00 H new ATOM 0 HH11 ARG A 46 7.932 6.783 3.323 1.00 0.00 H new ATOM 0 HH12 ARG A 46 8.710 8.352 3.556 1.00 0.00 H new ATOM 0 HH21 ARG A 46 7.246 8.915 6.716 1.00 0.00 H new ATOM 0 HH22 ARG A 46 8.322 9.553 5.469 1.00 0.00 H new ATOM 754 N ASN A 47 4.191 3.365 8.420 1.00 0.00 N ATOM 755 CA ASN A 47 4.464 3.444 9.842 1.00 0.00 C ATOM 756 C ASN A 47 3.812 2.290 10.605 1.00 0.00 C ATOM 757 O ASN A 47 4.507 1.557 11.305 1.00 0.00 O ATOM 758 CB ASN A 47 3.982 4.790 10.403 1.00 0.00 C ATOM 759 CG ASN A 47 4.213 4.804 11.901 1.00 0.00 C ATOM 760 OD1 ASN A 47 5.341 4.651 12.366 1.00 0.00 O ATOM 761 ND2 ASN A 47 3.149 4.952 12.663 1.00 0.00 N ATOM 0 H ASN A 47 3.650 4.154 8.065 1.00 0.00 H new ATOM 0 HA ASN A 47 5.543 3.366 9.977 1.00 0.00 H new ATOM 0 HB2 ASN A 47 4.521 5.611 9.930 1.00 0.00 H new ATOM 0 HB3 ASN A 47 2.924 4.934 10.183 1.00 0.00 H new ATOM 0 HD21 ASN A 47 3.244 4.942 13.679 1.00 0.00 H new ATOM 0 HD22 ASN A 47 2.230 5.076 12.238 1.00 0.00 H new ATOM 768 N ALA A 48 2.491 2.128 10.470 1.00 0.00 N ATOM 769 CA ALA A 48 1.721 1.087 11.152 1.00 0.00 C ATOM 770 C ALA A 48 2.178 -0.316 10.759 1.00 0.00 C ATOM 771 O ALA A 48 2.027 -1.256 11.531 1.00 0.00 O ATOM 772 CB ALA A 48 0.221 1.243 10.839 1.00 0.00 C ATOM 0 H ALA A 48 1.920 2.727 9.874 1.00 0.00 H new ATOM 0 HA ALA A 48 1.892 1.210 12.221 1.00 0.00 H new ATOM 0 HB1 ALA A 48 -0.341 0.463 11.352 1.00 0.00 H new ATOM 0 HB2 ALA A 48 -0.122 2.220 11.179 1.00 0.00 H new ATOM 0 HB3 ALA A 48 0.063 1.157 9.764 1.00 0.00 H new ATOM 778 N ALA A 49 2.708 -0.475 9.550 1.00 0.00 N ATOM 779 CA ALA A 49 3.166 -1.767 9.067 1.00 0.00 C ATOM 780 C ALA A 49 4.488 -2.204 9.693 1.00 0.00 C ATOM 781 O ALA A 49 4.759 -3.402 9.749 1.00 0.00 O ATOM 782 CB ALA A 49 3.332 -1.694 7.555 1.00 0.00 C ATOM 0 H ALA A 49 2.830 0.286 8.882 1.00 0.00 H new ATOM 0 HA ALA A 49 2.417 -2.506 9.351 1.00 0.00 H new ATOM 0 HB1 ALA A 49 3.676 -2.658 7.180 1.00 0.00 H new ATOM 0 HB2 ALA A 49 2.375 -1.446 7.095 1.00 0.00 H new ATOM 0 HB3 ALA A 49 4.064 -0.926 7.306 1.00 0.00 H new ATOM 788 N LEU A 50 5.325 -1.253 10.103 1.00 0.00 N ATOM 789 CA LEU A 50 6.620 -1.545 10.703 1.00 0.00 C ATOM 790 C LEU A 50 6.514 -1.585 12.225 1.00 0.00 C ATOM 791 O LEU A 50 7.108 -2.464 12.846 1.00 0.00 O ATOM 792 CB LEU A 50 7.646 -0.466 10.305 1.00 0.00 C ATOM 793 CG LEU A 50 7.837 -0.282 8.788 1.00 0.00 C ATOM 794 CD1 LEU A 50 8.394 1.115 8.500 1.00 0.00 C ATOM 795 CD2 LEU A 50 8.705 -1.352 8.123 1.00 0.00 C ATOM 0 H LEU A 50 5.121 -0.256 10.027 1.00 0.00 H new ATOM 0 HA LEU A 50 6.946 -2.519 10.339 1.00 0.00 H new ATOM 0 HB2 LEU A 50 7.336 0.486 10.736 1.00 0.00 H new ATOM 0 HB3 LEU A 50 8.608 -0.719 10.750 1.00 0.00 H new ATOM 0 HG LEU A 50 6.848 -0.396 8.344 1.00 0.00 H new ATOM 0 HD11 LEU A 50 8.527 1.239 7.425 1.00 0.00 H new ATOM 0 HD12 LEU A 50 7.697 1.868 8.869 1.00 0.00 H new ATOM 0 HD13 LEU A 50 9.355 1.234 9.001 1.00 0.00 H new ATOM 0 HD21 LEU A 50 8.786 -1.144 7.056 1.00 0.00 H new ATOM 0 HD22 LEU A 50 9.699 -1.344 8.570 1.00 0.00 H new ATOM 0 HD23 LEU A 50 8.250 -2.332 8.268 1.00 0.00 H new ATOM 807 N ASN A 51 5.814 -0.611 12.817 1.00 0.00 N ATOM 808 CA ASN A 51 5.641 -0.473 14.262 1.00 0.00 C ATOM 809 C ASN A 51 4.376 -1.159 14.731 1.00 0.00 C ATOM 810 O ASN A 51 4.383 -2.398 14.842 1.00 0.00 O ATOM 811 CB ASN A 51 5.683 1.013 14.664 1.00 0.00 C ATOM 812 CG ASN A 51 7.047 1.624 14.399 1.00 0.00 C ATOM 813 OD1 ASN A 51 8.064 1.119 14.875 1.00 0.00 O ATOM 814 ND2 ASN A 51 7.131 2.670 13.595 1.00 0.00 N ATOM 0 H ASN A 51 5.341 0.121 12.288 1.00 0.00 H new ATOM 0 HA ASN A 51 6.469 -0.974 14.763 1.00 0.00 H new ATOM 0 HB2 ASN A 51 4.923 1.563 14.108 1.00 0.00 H new ATOM 0 HB3 ASN A 51 5.438 1.112 15.722 1.00 0.00 H new ATOM 0 HD21 ASN A 51 8.043 3.064 13.365 1.00 0.00 H new ATOM 0 HD22 ASN A 51 6.284 3.083 13.205 1.00 0.00 H new TER 821 ASN A 51 ATOM 822 N SER B 1 -27.477 15.115 10.311 1.00 0.00 N ATOM 823 CA SER B 1 -27.868 14.979 8.892 1.00 0.00 C ATOM 824 C SER B 1 -27.117 15.981 8.004 1.00 0.00 C ATOM 825 O SER B 1 -26.582 15.638 6.948 1.00 0.00 O ATOM 826 CB SER B 1 -29.385 15.154 8.771 1.00 0.00 C ATOM 827 OG SER B 1 -30.043 14.247 9.638 1.00 0.00 O ATOM 0 H1 SER B 1 -27.924 14.359 10.868 1.00 0.00 H new ATOM 0 H2 SER B 1 -26.443 15.041 10.395 1.00 0.00 H new ATOM 0 H3 SER B 1 -27.788 16.040 10.670 1.00 0.00 H new ATOM 0 HA SER B 1 -27.594 13.984 8.542 1.00 0.00 H new ATOM 0 HB2 SER B 1 -29.663 16.178 9.021 1.00 0.00 H new ATOM 0 HB3 SER B 1 -29.699 14.981 7.742 1.00 0.00 H new ATOM 0 HG SER B 1 -31.013 14.364 9.559 1.00 0.00 H new ATOM 833 N ASP B 2 -27.104 17.216 8.490 1.00 0.00 N ATOM 834 CA ASP B 2 -26.622 18.568 8.201 1.00 0.00 C ATOM 835 C ASP B 2 -25.157 18.641 7.746 1.00 0.00 C ATOM 836 O ASP B 2 -24.436 19.592 8.048 1.00 0.00 O ATOM 837 CB ASP B 2 -26.832 19.387 9.510 1.00 0.00 C ATOM 838 CG ASP B 2 -28.077 18.966 10.311 1.00 0.00 C ATOM 839 OD1 ASP B 2 -27.995 17.865 10.932 1.00 0.00 O ATOM 840 OD2 ASP B 2 -29.139 19.572 10.113 1.00 0.00 O ATOM 0 H ASP B 2 -27.592 17.303 9.382 1.00 0.00 H new ATOM 0 HA ASP B 2 -27.181 18.968 7.355 1.00 0.00 H new ATOM 0 HB2 ASP B 2 -25.950 19.278 10.142 1.00 0.00 H new ATOM 0 HB3 ASP B 2 -26.914 20.444 9.257 1.00 0.00 H new ATOM 845 N SER B 3 -24.674 17.614 7.056 1.00 0.00 N ATOM 846 CA SER B 3 -23.334 17.417 6.530 1.00 0.00 C ATOM 847 C SER B 3 -22.952 18.391 5.400 1.00 0.00 C ATOM 848 O SER B 3 -22.655 17.973 4.277 1.00 0.00 O ATOM 849 CB SER B 3 -23.208 15.928 6.149 1.00 0.00 C ATOM 850 OG SER B 3 -24.294 15.462 5.353 1.00 0.00 O ATOM 0 H SER B 3 -25.274 16.821 6.830 1.00 0.00 H new ATOM 0 HA SER B 3 -22.599 17.662 7.297 1.00 0.00 H new ATOM 0 HB2 SER B 3 -22.275 15.776 5.606 1.00 0.00 H new ATOM 0 HB3 SER B 3 -23.149 15.330 7.058 1.00 0.00 H new ATOM 0 HG SER B 3 -25.093 15.368 5.913 1.00 0.00 H new ATOM 856 N ALA B 4 -22.889 19.694 5.696 1.00 0.00 N ATOM 857 CA ALA B 4 -22.528 20.745 4.740 1.00 0.00 C ATOM 858 C ALA B 4 -21.134 20.525 4.121 1.00 0.00 C ATOM 859 O ALA B 4 -20.826 21.090 3.071 1.00 0.00 O ATOM 860 CB ALA B 4 -22.593 22.111 5.435 1.00 0.00 C ATOM 0 H ALA B 4 -23.092 20.055 6.628 1.00 0.00 H new ATOM 0 HA ALA B 4 -23.246 20.709 3.920 1.00 0.00 H new ATOM 0 HB1 ALA B 4 -22.325 22.894 4.725 1.00 0.00 H new ATOM 0 HB2 ALA B 4 -23.605 22.285 5.802 1.00 0.00 H new ATOM 0 HB3 ALA B 4 -21.896 22.127 6.273 1.00 0.00 H new ATOM 866 N VAL B 5 -20.304 19.695 4.760 1.00 0.00 N ATOM 867 CA VAL B 5 -18.952 19.332 4.361 1.00 0.00 C ATOM 868 C VAL B 5 -18.848 18.759 2.940 1.00 0.00 C ATOM 869 O VAL B 5 -17.783 18.923 2.342 1.00 0.00 O ATOM 870 CB VAL B 5 -18.361 18.339 5.393 1.00 0.00 C ATOM 871 CG1 VAL B 5 -17.955 19.070 6.678 1.00 0.00 C ATOM 872 CG2 VAL B 5 -19.332 17.202 5.768 1.00 0.00 C ATOM 0 H VAL B 5 -20.582 19.232 5.625 1.00 0.00 H new ATOM 0 HA VAL B 5 -18.373 20.255 4.343 1.00 0.00 H new ATOM 0 HB VAL B 5 -17.491 17.896 4.909 1.00 0.00 H new ATOM 0 HG11 VAL B 5 -17.543 18.354 7.389 1.00 0.00 H new ATOM 0 HG12 VAL B 5 -17.204 19.825 6.445 1.00 0.00 H new ATOM 0 HG13 VAL B 5 -18.830 19.552 7.114 1.00 0.00 H new ATOM 0 HG21 VAL B 5 -18.857 16.542 6.494 1.00 0.00 H new ATOM 0 HG22 VAL B 5 -20.238 17.625 6.201 1.00 0.00 H new ATOM 0 HG23 VAL B 5 -19.589 16.633 4.874 1.00 0.00 H new ATOM 882 N ARG B 6 -19.883 18.110 2.379 1.00 0.00 N ATOM 883 CA ARG B 6 -19.826 17.535 1.028 1.00 0.00 C ATOM 884 C ARG B 6 -21.213 17.552 0.391 1.00 0.00 C ATOM 885 O ARG B 6 -22.173 17.092 1.007 1.00 0.00 O ATOM 886 CB ARG B 6 -19.287 16.096 1.121 1.00 0.00 C ATOM 887 CG ARG B 6 -19.077 15.424 -0.250 1.00 0.00 C ATOM 888 CD ARG B 6 -18.774 13.927 -0.102 1.00 0.00 C ATOM 889 NE ARG B 6 -19.941 13.196 0.419 1.00 0.00 N ATOM 890 CZ ARG B 6 -19.951 12.002 1.017 1.00 0.00 C ATOM 891 NH1 ARG B 6 -18.863 11.239 1.050 1.00 0.00 N ATOM 892 NH2 ARG B 6 -21.072 11.593 1.594 1.00 0.00 N ATOM 0 H ARG B 6 -20.778 17.971 2.849 1.00 0.00 H new ATOM 0 HA ARG B 6 -19.160 18.128 0.401 1.00 0.00 H new ATOM 0 HB2 ARG B 6 -18.339 16.106 1.660 1.00 0.00 H new ATOM 0 HB3 ARG B 6 -19.981 15.495 1.708 1.00 0.00 H new ATOM 0 HG2 ARG B 6 -19.969 15.557 -0.862 1.00 0.00 H new ATOM 0 HG3 ARG B 6 -18.255 15.913 -0.774 1.00 0.00 H new ATOM 0 HD2 ARG B 6 -18.485 13.515 -1.069 1.00 0.00 H new ATOM 0 HD3 ARG B 6 -17.926 13.790 0.569 1.00 0.00 H new ATOM 0 HE ARG B 6 -20.846 13.654 0.311 1.00 0.00 H new ATOM 0 HH11 ARG B 6 -18.000 11.563 0.613 1.00 0.00 H new ATOM 0 HH12 ARG B 6 -18.891 10.330 1.512 1.00 0.00 H new ATOM 0 HH21 ARG B 6 -21.901 12.186 1.575 1.00 0.00 H new ATOM 0 HH22 ARG B 6 -21.105 10.685 2.057 1.00 0.00 H new ATOM 906 N LYS B 7 -21.323 18.045 -0.847 1.00 0.00 N ATOM 907 CA LYS B 7 -22.597 18.116 -1.567 1.00 0.00 C ATOM 908 C LYS B 7 -23.039 16.733 -2.053 1.00 0.00 C ATOM 909 O LYS B 7 -24.092 16.273 -1.618 1.00 0.00 O ATOM 910 CB LYS B 7 -22.525 19.159 -2.695 1.00 0.00 C ATOM 911 CG LYS B 7 -22.510 20.583 -2.110 1.00 0.00 C ATOM 912 CD LYS B 7 -22.044 21.630 -3.129 1.00 0.00 C ATOM 913 CE LYS B 7 -21.833 22.972 -2.412 1.00 0.00 C ATOM 914 NZ LYS B 7 -20.814 23.809 -3.080 1.00 0.00 N ATOM 0 H LYS B 7 -20.530 18.406 -1.378 1.00 0.00 H new ATOM 0 HA LYS B 7 -23.371 18.453 -0.877 1.00 0.00 H new ATOM 0 HB2 LYS B 7 -21.629 18.995 -3.293 1.00 0.00 H new ATOM 0 HB3 LYS B 7 -23.379 19.042 -3.362 1.00 0.00 H new ATOM 0 HG2 LYS B 7 -23.510 20.840 -1.761 1.00 0.00 H new ATOM 0 HG3 LYS B 7 -21.853 20.609 -1.241 1.00 0.00 H new ATOM 0 HD2 LYS B 7 -21.117 21.307 -3.602 1.00 0.00 H new ATOM 0 HD3 LYS B 7 -22.785 21.739 -3.921 1.00 0.00 H new ATOM 0 HE2 LYS B 7 -22.778 23.514 -2.374 1.00 0.00 H new ATOM 0 HE3 LYS B 7 -21.530 22.787 -1.381 1.00 0.00 H new ATOM 0 HZ1 LYS B 7 -20.706 24.704 -2.561 1.00 0.00 H new ATOM 0 HZ2 LYS B 7 -19.905 23.304 -3.094 1.00 0.00 H new ATOM 0 HZ3 LYS B 7 -21.114 24.008 -4.056 1.00 0.00 H new ATOM 928 N LYS B 8 -22.301 16.063 -2.942 1.00 0.00 N ATOM 929 CA LYS B 8 -22.644 14.730 -3.461 1.00 0.00 C ATOM 930 C LYS B 8 -21.363 13.918 -3.676 1.00 0.00 C ATOM 931 O LYS B 8 -20.266 14.401 -3.391 1.00 0.00 O ATOM 932 CB LYS B 8 -23.424 14.845 -4.792 1.00 0.00 C ATOM 933 CG LYS B 8 -24.797 15.536 -4.702 1.00 0.00 C ATOM 934 CD LYS B 8 -25.610 15.327 -5.994 1.00 0.00 C ATOM 935 CE LYS B 8 -26.242 13.924 -6.047 1.00 0.00 C ATOM 936 NZ LYS B 8 -26.513 13.464 -7.428 1.00 0.00 N ATOM 0 H LYS B 8 -21.434 16.435 -3.330 1.00 0.00 H new ATOM 0 HA LYS B 8 -23.279 14.224 -2.733 1.00 0.00 H new ATOM 0 HB2 LYS B 8 -22.809 15.391 -5.507 1.00 0.00 H new ATOM 0 HB3 LYS B 8 -23.568 13.843 -5.196 1.00 0.00 H new ATOM 0 HG2 LYS B 8 -25.352 15.140 -3.852 1.00 0.00 H new ATOM 0 HG3 LYS B 8 -24.660 16.603 -4.524 1.00 0.00 H new ATOM 0 HD2 LYS B 8 -26.394 16.082 -6.057 1.00 0.00 H new ATOM 0 HD3 LYS B 8 -24.962 15.467 -6.859 1.00 0.00 H new ATOM 0 HE2 LYS B 8 -25.577 13.213 -5.557 1.00 0.00 H new ATOM 0 HE3 LYS B 8 -27.174 13.930 -5.482 1.00 0.00 H new ATOM 0 HZ1 LYS B 8 -26.938 12.515 -7.401 1.00 0.00 H new ATOM 0 HZ2 LYS B 8 -27.170 14.124 -7.891 1.00 0.00 H new ATOM 0 HZ3 LYS B 8 -25.622 13.429 -7.964 1.00 0.00 H new ATOM 950 N SER B 9 -21.488 12.690 -4.179 1.00 0.00 N ATOM 951 CA SER B 9 -20.390 11.787 -4.484 1.00 0.00 C ATOM 952 C SER B 9 -20.902 10.903 -5.617 1.00 0.00 C ATOM 953 O SER B 9 -21.857 10.150 -5.435 1.00 0.00 O ATOM 954 CB SER B 9 -19.946 11.000 -3.240 1.00 0.00 C ATOM 955 OG SER B 9 -18.548 11.147 -3.063 1.00 0.00 O ATOM 0 H SER B 9 -22.399 12.284 -4.393 1.00 0.00 H new ATOM 0 HA SER B 9 -19.489 12.316 -4.794 1.00 0.00 H new ATOM 0 HB2 SER B 9 -20.475 11.363 -2.359 1.00 0.00 H new ATOM 0 HB3 SER B 9 -20.200 9.946 -3.353 1.00 0.00 H new ATOM 0 HG SER B 9 -18.264 10.647 -2.269 1.00 0.00 H new ATOM 961 N GLU B 10 -20.303 11.034 -6.801 1.00 0.00 N ATOM 962 CA GLU B 10 -20.678 10.290 -8.005 1.00 0.00 C ATOM 963 C GLU B 10 -19.608 9.278 -8.435 1.00 0.00 C ATOM 964 O GLU B 10 -19.576 8.834 -9.588 1.00 0.00 O ATOM 965 CB GLU B 10 -21.076 11.288 -9.099 1.00 0.00 C ATOM 966 CG GLU B 10 -19.920 12.148 -9.628 1.00 0.00 C ATOM 967 CD GLU B 10 -20.471 13.337 -10.412 1.00 0.00 C ATOM 968 OE1 GLU B 10 -21.261 13.124 -11.355 1.00 0.00 O ATOM 969 OE2 GLU B 10 -20.171 14.504 -10.053 1.00 0.00 O ATOM 0 H GLU B 10 -19.525 11.676 -6.954 1.00 0.00 H new ATOM 0 HA GLU B 10 -21.545 9.666 -7.791 1.00 0.00 H new ATOM 0 HB2 GLU B 10 -21.514 10.739 -9.932 1.00 0.00 H new ATOM 0 HB3 GLU B 10 -21.852 11.946 -8.708 1.00 0.00 H new ATOM 0 HG2 GLU B 10 -19.309 12.501 -8.797 1.00 0.00 H new ATOM 0 HG3 GLU B 10 -19.273 11.548 -10.268 1.00 0.00 H new ATOM 976 N VAL B 11 -18.712 8.939 -7.511 1.00 0.00 N ATOM 977 CA VAL B 11 -17.632 7.987 -7.709 1.00 0.00 C ATOM 978 C VAL B 11 -18.202 6.606 -8.052 1.00 0.00 C ATOM 979 O VAL B 11 -19.335 6.290 -7.677 1.00 0.00 O ATOM 980 CB VAL B 11 -16.752 7.961 -6.442 1.00 0.00 C ATOM 981 CG1 VAL B 11 -15.928 9.251 -6.369 1.00 0.00 C ATOM 982 CG2 VAL B 11 -17.495 7.774 -5.110 1.00 0.00 C ATOM 0 H VAL B 11 -18.722 9.336 -6.572 1.00 0.00 H new ATOM 0 HA VAL B 11 -17.008 8.288 -8.550 1.00 0.00 H new ATOM 0 HB VAL B 11 -16.130 7.073 -6.554 1.00 0.00 H new ATOM 0 HG11 VAL B 11 -15.305 9.235 -5.474 1.00 0.00 H new ATOM 0 HG12 VAL B 11 -15.293 9.328 -7.252 1.00 0.00 H new ATOM 0 HG13 VAL B 11 -16.599 10.109 -6.329 1.00 0.00 H new ATOM 0 HG21 VAL B 11 -16.777 7.771 -4.290 1.00 0.00 H new ATOM 0 HG22 VAL B 11 -18.202 8.591 -4.970 1.00 0.00 H new ATOM 0 HG23 VAL B 11 -18.033 6.826 -5.124 1.00 0.00 H new ATOM 992 N ARG B 12 -17.423 5.776 -8.752 1.00 0.00 N ATOM 993 CA ARG B 12 -17.833 4.425 -9.148 1.00 0.00 C ATOM 994 C ARG B 12 -16.785 3.374 -8.804 1.00 0.00 C ATOM 995 O ARG B 12 -16.948 2.208 -9.166 1.00 0.00 O ATOM 996 CB ARG B 12 -18.266 4.384 -10.621 1.00 0.00 C ATOM 997 CG ARG B 12 -17.138 4.607 -11.637 1.00 0.00 C ATOM 998 CD ARG B 12 -17.691 4.534 -13.063 1.00 0.00 C ATOM 999 NE ARG B 12 -18.137 3.175 -13.433 1.00 0.00 N ATOM 1000 CZ ARG B 12 -17.510 2.341 -14.270 1.00 0.00 C ATOM 1001 NH1 ARG B 12 -16.275 2.588 -14.689 1.00 0.00 N ATOM 1002 NH2 ARG B 12 -18.130 1.252 -14.699 1.00 0.00 N ATOM 0 H ARG B 12 -16.484 6.024 -9.062 1.00 0.00 H new ATOM 0 HA ARG B 12 -18.710 4.163 -8.556 1.00 0.00 H new ATOM 0 HB2 ARG B 12 -18.728 3.417 -10.821 1.00 0.00 H new ATOM 0 HB3 ARG B 12 -19.032 5.143 -10.780 1.00 0.00 H new ATOM 0 HG2 ARG B 12 -16.673 5.578 -11.468 1.00 0.00 H new ATOM 0 HG3 ARG B 12 -16.362 3.854 -11.501 1.00 0.00 H new ATOM 0 HD2 ARG B 12 -18.528 5.225 -13.159 1.00 0.00 H new ATOM 0 HD3 ARG B 12 -16.923 4.863 -13.763 1.00 0.00 H new ATOM 0 HE ARG B 12 -19.004 2.842 -13.011 1.00 0.00 H new ATOM 0 HH11 ARG B 12 -15.787 3.426 -14.373 1.00 0.00 H new ATOM 0 HH12 ARG B 12 -15.814 1.940 -15.327 1.00 0.00 H new ATOM 0 HH21 ARG B 12 -19.082 1.052 -14.391 1.00 0.00 H new ATOM 0 HH22 ARG B 12 -17.656 0.613 -15.337 1.00 0.00 H new ATOM 1016 N GLN B 13 -15.723 3.748 -8.095 1.00 0.00 N ATOM 1017 CA GLN B 13 -14.659 2.852 -7.687 1.00 0.00 C ATOM 1018 C GLN B 13 -14.584 2.929 -6.170 1.00 0.00 C ATOM 1019 O GLN B 13 -13.908 3.795 -5.621 1.00 0.00 O ATOM 1020 CB GLN B 13 -13.327 3.239 -8.355 1.00 0.00 C ATOM 1021 CG GLN B 13 -13.370 3.265 -9.893 1.00 0.00 C ATOM 1022 CD GLN B 13 -12.038 3.716 -10.497 1.00 0.00 C ATOM 1023 OE1 GLN B 13 -10.963 3.362 -10.011 1.00 0.00 O ATOM 1024 NE2 GLN B 13 -12.072 4.485 -11.568 1.00 0.00 N ATOM 0 H GLN B 13 -15.581 4.709 -7.783 1.00 0.00 H new ATOM 0 HA GLN B 13 -14.860 1.828 -8.001 1.00 0.00 H new ATOM 0 HB2 GLN B 13 -13.027 4.223 -7.996 1.00 0.00 H new ATOM 0 HB3 GLN B 13 -12.557 2.535 -8.037 1.00 0.00 H new ATOM 0 HG2 GLN B 13 -13.619 2.271 -10.265 1.00 0.00 H new ATOM 0 HG3 GLN B 13 -14.163 3.937 -10.222 1.00 0.00 H new ATOM 0 HE21 GLN B 13 -12.968 4.772 -11.962 1.00 0.00 H new ATOM 0 HE22 GLN B 13 -11.202 4.793 -12.003 1.00 0.00 H new ATOM 1033 N LYS B 14 -15.313 2.048 -5.476 1.00 0.00 N ATOM 1034 CA LYS B 14 -15.303 2.026 -4.013 1.00 0.00 C ATOM 1035 C LYS B 14 -13.909 1.687 -3.477 1.00 0.00 C ATOM 1036 O LYS B 14 -13.593 2.026 -2.337 1.00 0.00 O ATOM 1037 CB LYS B 14 -16.398 1.086 -3.484 1.00 0.00 C ATOM 1038 CG LYS B 14 -16.186 -0.400 -3.826 1.00 0.00 C ATOM 1039 CD LYS B 14 -17.448 -1.245 -3.596 1.00 0.00 C ATOM 1040 CE LYS B 14 -17.902 -1.200 -2.127 1.00 0.00 C ATOM 1041 NZ LYS B 14 -18.973 -2.165 -1.804 1.00 0.00 N ATOM 0 H LYS B 14 -15.915 1.344 -5.904 1.00 0.00 H new ATOM 0 HA LYS B 14 -15.536 3.023 -3.640 1.00 0.00 H new ATOM 0 HB2 LYS B 14 -16.457 1.191 -2.401 1.00 0.00 H new ATOM 0 HB3 LYS B 14 -17.359 1.405 -3.888 1.00 0.00 H new ATOM 0 HG2 LYS B 14 -15.879 -0.489 -4.868 1.00 0.00 H new ATOM 0 HG3 LYS B 14 -15.372 -0.796 -3.219 1.00 0.00 H new ATOM 0 HD2 LYS B 14 -18.251 -0.881 -4.237 1.00 0.00 H new ATOM 0 HD3 LYS B 14 -17.252 -2.278 -3.885 1.00 0.00 H new ATOM 0 HE2 LYS B 14 -17.043 -1.396 -1.485 1.00 0.00 H new ATOM 0 HE3 LYS B 14 -18.250 -0.194 -1.895 1.00 0.00 H new ATOM 0 HZ1 LYS B 14 -19.227 -2.078 -0.799 1.00 0.00 H new ATOM 0 HZ2 LYS B 14 -19.808 -1.966 -2.391 1.00 0.00 H new ATOM 0 HZ3 LYS B 14 -18.639 -3.131 -1.994 1.00 0.00 H new ATOM 1055 N THR B 15 -13.099 0.976 -4.264 1.00 0.00 N ATOM 1056 CA THR B 15 -11.743 0.611 -3.897 1.00 0.00 C ATOM 1057 C THR B 15 -10.863 1.866 -3.968 1.00 0.00 C ATOM 1058 O THR B 15 -11.308 2.940 -4.374 1.00 0.00 O ATOM 1059 CB THR B 15 -11.279 -0.516 -4.843 1.00 0.00 C ATOM 1060 OG1 THR B 15 -10.193 -1.261 -4.336 1.00 0.00 O ATOM 1061 CG2 THR B 15 -10.858 -0.038 -6.233 1.00 0.00 C ATOM 0 H THR B 15 -13.377 0.636 -5.185 1.00 0.00 H new ATOM 0 HA THR B 15 -11.676 0.232 -2.877 1.00 0.00 H new ATOM 0 HB THR B 15 -12.173 -1.135 -4.919 1.00 0.00 H new ATOM 0 HG1 THR B 15 -10.104 -1.097 -3.374 1.00 0.00 H new ATOM 0 HG21 THR B 15 -10.547 -0.893 -6.833 1.00 0.00 H new ATOM 0 HG22 THR B 15 -11.699 0.458 -6.717 1.00 0.00 H new ATOM 0 HG23 THR B 15 -10.028 0.662 -6.141 1.00 0.00 H new ATOM 1069 N VAL B 16 -9.597 1.733 -3.592 1.00 0.00 N ATOM 1070 CA VAL B 16 -8.623 2.810 -3.617 1.00 0.00 C ATOM 1071 C VAL B 16 -7.456 2.227 -4.373 1.00 0.00 C ATOM 1072 O VAL B 16 -6.896 1.242 -3.898 1.00 0.00 O ATOM 1073 CB VAL B 16 -8.215 3.240 -2.204 1.00 0.00 C ATOM 1074 CG1 VAL B 16 -7.425 4.549 -2.294 1.00 0.00 C ATOM 1075 CG2 VAL B 16 -9.437 3.396 -1.303 1.00 0.00 C ATOM 0 H VAL B 16 -9.213 0.851 -3.254 1.00 0.00 H new ATOM 0 HA VAL B 16 -9.017 3.713 -4.084 1.00 0.00 H new ATOM 0 HB VAL B 16 -7.587 2.469 -1.759 1.00 0.00 H new ATOM 0 HG11 VAL B 16 -7.129 4.865 -1.294 1.00 0.00 H new ATOM 0 HG12 VAL B 16 -6.535 4.396 -2.904 1.00 0.00 H new ATOM 0 HG13 VAL B 16 -8.048 5.319 -2.748 1.00 0.00 H new ATOM 0 HG21 VAL B 16 -9.118 3.702 -0.307 1.00 0.00 H new ATOM 0 HG22 VAL B 16 -10.102 4.153 -1.719 1.00 0.00 H new ATOM 0 HG23 VAL B 16 -9.965 2.445 -1.239 1.00 0.00 H new ATOM 1085 N VAL B 17 -7.116 2.765 -5.541 1.00 0.00 N ATOM 1086 CA VAL B 17 -6.019 2.240 -6.333 1.00 0.00 C ATOM 1087 C VAL B 17 -4.914 3.274 -6.478 1.00 0.00 C ATOM 1088 O VAL B 17 -5.052 4.286 -7.175 1.00 0.00 O ATOM 1089 CB VAL B 17 -6.544 1.634 -7.649 1.00 0.00 C ATOM 1090 CG1 VAL B 17 -7.007 2.661 -8.686 1.00 0.00 C ATOM 1091 CG2 VAL B 17 -5.458 0.740 -8.248 1.00 0.00 C ATOM 0 H VAL B 17 -7.589 3.567 -5.957 1.00 0.00 H new ATOM 0 HA VAL B 17 -5.544 1.407 -5.815 1.00 0.00 H new ATOM 0 HB VAL B 17 -7.436 1.063 -7.393 1.00 0.00 H new ATOM 0 HG11 VAL B 17 -7.359 2.144 -9.578 1.00 0.00 H new ATOM 0 HG12 VAL B 17 -7.818 3.259 -8.269 1.00 0.00 H new ATOM 0 HG13 VAL B 17 -6.174 3.313 -8.950 1.00 0.00 H new ATOM 0 HG21 VAL B 17 -5.818 0.305 -9.180 1.00 0.00 H new ATOM 0 HG22 VAL B 17 -4.566 1.334 -8.445 1.00 0.00 H new ATOM 0 HG23 VAL B 17 -5.215 -0.057 -7.546 1.00 0.00 H new ATOM 1101 N ARG B 18 -3.807 3.048 -5.778 1.00 0.00 N ATOM 1102 CA ARG B 18 -2.651 3.939 -5.853 1.00 0.00 C ATOM 1103 C ARG B 18 -1.399 3.096 -6.018 1.00 0.00 C ATOM 1104 O ARG B 18 -1.487 1.875 -6.209 1.00 0.00 O ATOM 1105 CB ARG B 18 -2.628 4.945 -4.673 1.00 0.00 C ATOM 1106 CG ARG B 18 -3.304 6.254 -5.111 1.00 0.00 C ATOM 1107 CD ARG B 18 -3.099 7.431 -4.152 1.00 0.00 C ATOM 1108 NE ARG B 18 -3.580 8.667 -4.805 1.00 0.00 N ATOM 1109 CZ ARG B 18 -4.034 9.782 -4.219 1.00 0.00 C ATOM 1110 NH1 ARG B 18 -4.009 9.937 -2.905 1.00 0.00 N ATOM 1111 NH2 ARG B 18 -4.539 10.754 -4.965 1.00 0.00 N ATOM 0 H ARG B 18 -3.684 2.253 -5.150 1.00 0.00 H new ATOM 0 HA ARG B 18 -2.711 4.583 -6.730 1.00 0.00 H new ATOM 0 HB2 ARG B 18 -3.146 4.525 -3.811 1.00 0.00 H new ATOM 0 HB3 ARG B 18 -1.601 5.138 -4.364 1.00 0.00 H new ATOM 0 HG2 ARG B 18 -2.923 6.533 -6.094 1.00 0.00 H new ATOM 0 HG3 ARG B 18 -4.373 6.075 -5.222 1.00 0.00 H new ATOM 0 HD2 ARG B 18 -3.642 7.259 -3.223 1.00 0.00 H new ATOM 0 HD3 ARG B 18 -2.045 7.527 -3.892 1.00 0.00 H new ATOM 0 HE ARG B 18 -3.564 8.671 -5.825 1.00 0.00 H new ATOM 0 HH11 ARG B 18 -3.637 9.196 -2.311 1.00 0.00 H new ATOM 0 HH12 ARG B 18 -4.362 10.798 -2.486 1.00 0.00 H new ATOM 0 HH21 ARG B 18 -4.580 10.650 -5.979 1.00 0.00 H new ATOM 0 HH22 ARG B 18 -4.887 11.606 -4.525 1.00 0.00 H new ATOM 1125 N THR B 19 -0.239 3.736 -6.016 1.00 0.00 N ATOM 1126 CA THR B 19 1.050 3.087 -6.133 1.00 0.00 C ATOM 1127 C THR B 19 1.753 3.541 -4.865 1.00 0.00 C ATOM 1128 O THR B 19 2.085 4.718 -4.703 1.00 0.00 O ATOM 1129 CB THR B 19 1.769 3.439 -7.441 1.00 0.00 C ATOM 1130 OG1 THR B 19 0.853 3.549 -8.513 1.00 0.00 O ATOM 1131 CG2 THR B 19 2.760 2.320 -7.744 1.00 0.00 C ATOM 0 H THR B 19 -0.171 4.750 -5.930 1.00 0.00 H new ATOM 0 HA THR B 19 1.004 2.000 -6.203 1.00 0.00 H new ATOM 0 HB THR B 19 2.275 4.398 -7.329 1.00 0.00 H new ATOM 0 HG1 THR B 19 1.337 3.776 -9.335 1.00 0.00 H new ATOM 0 HG21 THR B 19 3.288 2.543 -8.671 1.00 0.00 H new ATOM 0 HG22 THR B 19 3.478 2.239 -6.928 1.00 0.00 H new ATOM 0 HG23 THR B 19 2.223 1.377 -7.850 1.00 0.00 H new ATOM 1139 N LEU B 20 1.873 2.625 -3.916 1.00 0.00 N ATOM 1140 CA LEU B 20 2.465 2.843 -2.619 1.00 0.00 C ATOM 1141 C LEU B 20 3.764 2.066 -2.491 1.00 0.00 C ATOM 1142 O LEU B 20 3.764 0.884 -2.151 1.00 0.00 O ATOM 1143 CB LEU B 20 1.419 2.452 -1.566 1.00 0.00 C ATOM 1144 CG LEU B 20 1.752 3.004 -0.177 1.00 0.00 C ATOM 1145 CD1 LEU B 20 1.574 4.525 -0.142 1.00 0.00 C ATOM 1146 CD2 LEU B 20 0.784 2.395 0.834 1.00 0.00 C ATOM 0 H LEU B 20 1.543 1.668 -4.042 1.00 0.00 H new ATOM 0 HA LEU B 20 2.735 3.889 -2.472 1.00 0.00 H new ATOM 0 HB2 LEU B 20 0.441 2.821 -1.875 1.00 0.00 H new ATOM 0 HB3 LEU B 20 1.348 1.366 -1.515 1.00 0.00 H new ATOM 0 HG LEU B 20 2.786 2.754 0.060 1.00 0.00 H new ATOM 0 HD11 LEU B 20 1.816 4.897 0.854 1.00 0.00 H new ATOM 0 HD12 LEU B 20 2.239 4.986 -0.873 1.00 0.00 H new ATOM 0 HD13 LEU B 20 0.541 4.776 -0.382 1.00 0.00 H new ATOM 0 HD21 LEU B 20 1.008 2.779 1.829 1.00 0.00 H new ATOM 0 HD22 LEU B 20 -0.238 2.661 0.565 1.00 0.00 H new ATOM 0 HD23 LEU B 20 0.890 1.310 0.831 1.00 0.00 H new ATOM 1158 N ARG B 21 4.862 2.705 -2.880 1.00 0.00 N ATOM 1159 CA ARG B 21 6.205 2.158 -2.805 1.00 0.00 C ATOM 1160 C ARG B 21 6.589 1.906 -1.349 1.00 0.00 C ATOM 1161 O ARG B 21 6.047 2.546 -0.451 1.00 0.00 O ATOM 1162 CB ARG B 21 7.203 3.196 -3.367 1.00 0.00 C ATOM 1163 CG ARG B 21 7.529 3.054 -4.854 1.00 0.00 C ATOM 1164 CD ARG B 21 6.354 3.233 -5.806 1.00 0.00 C ATOM 1165 NE ARG B 21 5.976 4.651 -5.934 1.00 0.00 N ATOM 1166 CZ ARG B 21 5.410 5.219 -7.007 1.00 0.00 C ATOM 1167 NH1 ARG B 21 5.023 4.497 -8.051 1.00 0.00 N ATOM 1168 NH2 ARG B 21 5.245 6.532 -7.041 1.00 0.00 N ATOM 0 H ARG B 21 4.837 3.648 -3.268 1.00 0.00 H new ATOM 0 HA ARG B 21 6.234 1.228 -3.372 1.00 0.00 H new ATOM 0 HB2 ARG B 21 6.799 4.194 -3.195 1.00 0.00 H new ATOM 0 HB3 ARG B 21 8.132 3.126 -2.801 1.00 0.00 H new ATOM 0 HG2 ARG B 21 8.296 3.785 -5.111 1.00 0.00 H new ATOM 0 HG3 ARG B 21 7.961 2.067 -5.020 1.00 0.00 H new ATOM 0 HD2 ARG B 21 6.615 2.835 -6.787 1.00 0.00 H new ATOM 0 HD3 ARG B 21 5.501 2.659 -5.445 1.00 0.00 H new ATOM 0 HE ARG B 21 6.162 5.255 -5.133 1.00 0.00 H new ATOM 0 HH11 ARG B 21 5.154 3.485 -8.048 1.00 0.00 H new ATOM 0 HH12 ARG B 21 4.594 4.954 -8.856 1.00 0.00 H new ATOM 0 HH21 ARG B 21 5.548 7.105 -6.253 1.00 0.00 H new ATOM 0 HH22 ARG B 21 4.815 6.971 -7.855 1.00 0.00 H new ATOM 1182 N PHE B 22 7.548 1.011 -1.140 1.00 0.00 N ATOM 1183 CA PHE B 22 8.127 0.640 0.149 1.00 0.00 C ATOM 1184 C PHE B 22 9.618 0.524 -0.139 1.00 0.00 C ATOM 1185 O PHE B 22 10.010 0.146 -1.249 1.00 0.00 O ATOM 1186 CB PHE B 22 7.554 -0.657 0.733 1.00 0.00 C ATOM 1187 CG PHE B 22 6.106 -0.556 1.162 1.00 0.00 C ATOM 1188 CD1 PHE B 22 5.084 -0.750 0.216 1.00 0.00 C ATOM 1189 CD2 PHE B 22 5.774 -0.241 2.494 1.00 0.00 C ATOM 1190 CE1 PHE B 22 3.738 -0.612 0.586 1.00 0.00 C ATOM 1191 CE2 PHE B 22 4.430 -0.141 2.880 1.00 0.00 C ATOM 1192 CZ PHE B 22 3.408 -0.308 1.925 1.00 0.00 C ATOM 0 H PHE B 22 7.968 0.493 -1.912 1.00 0.00 H new ATOM 0 HA PHE B 22 7.895 1.381 0.915 1.00 0.00 H new ATOM 0 HB2 PHE B 22 7.647 -1.449 -0.010 1.00 0.00 H new ATOM 0 HB3 PHE B 22 8.156 -0.953 1.592 1.00 0.00 H new ATOM 0 HD1 PHE B 22 5.337 -1.007 -0.802 1.00 0.00 H new ATOM 0 HD2 PHE B 22 6.557 -0.076 3.220 1.00 0.00 H new ATOM 0 HE1 PHE B 22 2.958 -0.738 -0.150 1.00 0.00 H new ATOM 0 HE2 PHE B 22 4.178 0.064 3.910 1.00 0.00 H new ATOM 0 HZ PHE B 22 2.373 -0.204 2.217 1.00 0.00 H new ATOM 1202 N SER B 23 10.451 0.921 0.805 1.00 0.00 N ATOM 1203 CA SER B 23 11.906 0.893 0.681 1.00 0.00 C ATOM 1204 C SER B 23 12.404 -0.559 0.791 1.00 0.00 C ATOM 1205 O SER B 23 11.617 -1.423 1.173 1.00 0.00 O ATOM 1206 CB SER B 23 12.456 1.798 1.790 1.00 0.00 C ATOM 1207 OG SER B 23 11.697 2.991 1.899 1.00 0.00 O ATOM 0 H SER B 23 10.132 1.282 1.704 1.00 0.00 H new ATOM 0 HA SER B 23 12.251 1.260 -0.286 1.00 0.00 H new ATOM 0 HB2 SER B 23 12.439 1.265 2.740 1.00 0.00 H new ATOM 0 HB3 SER B 23 13.497 2.044 1.580 1.00 0.00 H new ATOM 0 HG SER B 23 10.819 2.786 2.283 1.00 0.00 H new ATOM 1213 N PRO B 24 13.680 -0.872 0.498 1.00 0.00 N ATOM 1214 CA PRO B 24 14.165 -2.246 0.584 1.00 0.00 C ATOM 1215 C PRO B 24 14.093 -2.771 2.018 1.00 0.00 C ATOM 1216 O PRO B 24 13.636 -3.891 2.237 1.00 0.00 O ATOM 1217 CB PRO B 24 15.594 -2.222 0.039 1.00 0.00 C ATOM 1218 CG PRO B 24 16.038 -0.772 0.189 1.00 0.00 C ATOM 1219 CD PRO B 24 14.740 0.019 0.048 1.00 0.00 C ATOM 0 HA PRO B 24 13.547 -2.929 0.002 1.00 0.00 H new ATOM 0 HB2 PRO B 24 16.243 -2.895 0.599 1.00 0.00 H new ATOM 0 HB3 PRO B 24 15.626 -2.541 -1.003 1.00 0.00 H new ATOM 0 HG2 PRO B 24 16.512 -0.596 1.155 1.00 0.00 H new ATOM 0 HG3 PRO B 24 16.762 -0.493 -0.577 1.00 0.00 H new ATOM 0 HD2 PRO B 24 14.769 0.927 0.650 1.00 0.00 H new ATOM 0 HD3 PRO B 24 14.580 0.326 -0.985 1.00 0.00 H new ATOM 1227 N VAL B 25 14.501 -1.947 2.983 1.00 0.00 N ATOM 1228 CA VAL B 25 14.506 -2.274 4.400 1.00 0.00 C ATOM 1229 C VAL B 25 13.071 -2.435 4.914 1.00 0.00 C ATOM 1230 O VAL B 25 12.806 -3.321 5.724 1.00 0.00 O ATOM 1231 CB VAL B 25 15.257 -1.161 5.160 1.00 0.00 C ATOM 1232 CG1 VAL B 25 15.443 -1.536 6.635 1.00 0.00 C ATOM 1233 CG2 VAL B 25 16.645 -0.882 4.566 1.00 0.00 C ATOM 0 H VAL B 25 14.846 -1.007 2.790 1.00 0.00 H new ATOM 0 HA VAL B 25 15.017 -3.223 4.565 1.00 0.00 H new ATOM 0 HB VAL B 25 14.642 -0.266 5.066 1.00 0.00 H new ATOM 0 HG11 VAL B 25 15.975 -0.736 7.150 1.00 0.00 H new ATOM 0 HG12 VAL B 25 14.468 -1.681 7.099 1.00 0.00 H new ATOM 0 HG13 VAL B 25 16.019 -2.459 6.706 1.00 0.00 H new ATOM 0 HG21 VAL B 25 17.132 -0.091 5.136 1.00 0.00 H new ATOM 0 HG22 VAL B 25 17.249 -1.788 4.612 1.00 0.00 H new ATOM 0 HG23 VAL B 25 16.540 -0.569 3.527 1.00 0.00 H new ATOM 1243 N GLU B 26 12.153 -1.574 4.458 1.00 0.00 N ATOM 1244 CA GLU B 26 10.753 -1.610 4.865 1.00 0.00 C ATOM 1245 C GLU B 26 10.104 -2.882 4.331 1.00 0.00 C ATOM 1246 O GLU B 26 9.373 -3.544 5.062 1.00 0.00 O ATOM 1247 CB GLU B 26 9.999 -0.382 4.336 1.00 0.00 C ATOM 1248 CG GLU B 26 10.453 0.932 4.991 1.00 0.00 C ATOM 1249 CD GLU B 26 9.788 2.166 4.369 1.00 0.00 C ATOM 1250 OE1 GLU B 26 9.558 2.179 3.133 1.00 0.00 O ATOM 1251 OE2 GLU B 26 9.680 3.217 5.034 1.00 0.00 O ATOM 0 H GLU B 26 12.367 -0.831 3.793 1.00 0.00 H new ATOM 0 HA GLU B 26 10.705 -1.599 5.954 1.00 0.00 H new ATOM 0 HB2 GLU B 26 10.142 -0.312 3.258 1.00 0.00 H new ATOM 0 HB3 GLU B 26 8.931 -0.517 4.508 1.00 0.00 H new ATOM 0 HG2 GLU B 26 10.224 0.900 6.056 1.00 0.00 H new ATOM 0 HG3 GLU B 26 11.535 1.023 4.900 1.00 0.00 H new ATOM 1258 N ASP B 27 10.373 -3.217 3.063 1.00 0.00 N ATOM 1259 CA ASP B 27 9.843 -4.409 2.410 1.00 0.00 C ATOM 1260 C ASP B 27 10.327 -5.633 3.147 1.00 0.00 C ATOM 1261 O ASP B 27 9.541 -6.519 3.414 1.00 0.00 O ATOM 1262 CB ASP B 27 10.311 -4.501 0.965 1.00 0.00 C ATOM 1263 CG ASP B 27 9.619 -5.634 0.194 1.00 0.00 C ATOM 1264 OD1 ASP B 27 8.373 -5.765 0.271 1.00 0.00 O ATOM 1265 OD2 ASP B 27 10.296 -6.277 -0.641 1.00 0.00 O ATOM 0 H ASP B 27 10.974 -2.657 2.458 1.00 0.00 H new ATOM 0 HA ASP B 27 8.755 -4.349 2.425 1.00 0.00 H new ATOM 0 HB2 ASP B 27 10.118 -3.553 0.463 1.00 0.00 H new ATOM 0 HB3 ASP B 27 11.389 -4.658 0.945 1.00 0.00 H new ATOM 1270 N GLU B 28 11.611 -5.668 3.492 1.00 0.00 N ATOM 1271 CA GLU B 28 12.243 -6.739 4.228 1.00 0.00 C ATOM 1272 C GLU B 28 11.516 -6.919 5.564 1.00 0.00 C ATOM 1273 O GLU B 28 11.063 -8.029 5.817 1.00 0.00 O ATOM 1274 CB GLU B 28 13.742 -6.434 4.330 1.00 0.00 C ATOM 1275 CG GLU B 28 14.565 -7.530 5.012 1.00 0.00 C ATOM 1276 CD GLU B 28 16.076 -7.270 4.946 1.00 0.00 C ATOM 1277 OE1 GLU B 28 16.560 -6.489 4.090 1.00 0.00 O ATOM 1278 OE2 GLU B 28 16.819 -7.977 5.661 1.00 0.00 O ATOM 0 H GLU B 28 12.259 -4.917 3.253 1.00 0.00 H new ATOM 0 HA GLU B 28 12.166 -7.703 3.725 1.00 0.00 H new ATOM 0 HB2 GLU B 28 14.136 -6.271 3.327 1.00 0.00 H new ATOM 0 HB3 GLU B 28 13.874 -5.502 4.880 1.00 0.00 H new ATOM 0 HG2 GLU B 28 14.260 -7.610 6.056 1.00 0.00 H new ATOM 0 HG3 GLU B 28 14.345 -8.488 4.541 1.00 0.00 H new ATOM 1285 N THR B 29 11.331 -5.873 6.380 1.00 0.00 N ATOM 1286 CA THR B 29 10.628 -6.003 7.658 1.00 0.00 C ATOM 1287 C THR B 29 9.187 -6.489 7.429 1.00 0.00 C ATOM 1288 O THR B 29 8.780 -7.490 8.020 1.00 0.00 O ATOM 1289 CB THR B 29 10.667 -4.667 8.432 1.00 0.00 C ATOM 1290 OG1 THR B 29 11.999 -4.272 8.710 1.00 0.00 O ATOM 1291 CG2 THR B 29 9.932 -4.733 9.774 1.00 0.00 C ATOM 0 H THR B 29 11.659 -4.929 6.176 1.00 0.00 H new ATOM 0 HA THR B 29 11.134 -6.751 8.268 1.00 0.00 H new ATOM 0 HB THR B 29 10.170 -3.949 7.780 1.00 0.00 H new ATOM 0 HG1 THR B 29 12.421 -3.944 7.889 1.00 0.00 H new ATOM 0 HG21 THR B 29 9.994 -3.765 10.271 1.00 0.00 H new ATOM 0 HG22 THR B 29 8.886 -4.987 9.604 1.00 0.00 H new ATOM 0 HG23 THR B 29 10.392 -5.494 10.404 1.00 0.00 H new ATOM 1299 N ILE B 30 8.419 -5.805 6.571 1.00 0.00 N ATOM 1300 CA ILE B 30 7.033 -6.164 6.280 1.00 0.00 C ATOM 1301 C ILE B 30 6.963 -7.612 5.816 1.00 0.00 C ATOM 1302 O ILE B 30 6.139 -8.374 6.304 1.00 0.00 O ATOM 1303 CB ILE B 30 6.425 -5.191 5.240 1.00 0.00 C ATOM 1304 CG1 ILE B 30 6.143 -3.840 5.925 1.00 0.00 C ATOM 1305 CG2 ILE B 30 5.115 -5.746 4.623 1.00 0.00 C ATOM 1306 CD1 ILE B 30 5.950 -2.680 4.941 1.00 0.00 C ATOM 0 H ILE B 30 8.746 -4.985 6.060 1.00 0.00 H new ATOM 0 HA ILE B 30 6.437 -6.074 7.188 1.00 0.00 H new ATOM 0 HB ILE B 30 7.142 -5.067 4.429 1.00 0.00 H new ATOM 0 HG12 ILE B 30 5.249 -3.935 6.542 1.00 0.00 H new ATOM 0 HG13 ILE B 30 6.969 -3.603 6.595 1.00 0.00 H new ATOM 0 HG21 ILE B 30 4.723 -5.032 3.899 1.00 0.00 H new ATOM 0 HG22 ILE B 30 5.321 -6.693 4.124 1.00 0.00 H new ATOM 0 HG23 ILE B 30 4.380 -5.904 5.412 1.00 0.00 H new ATOM 0 HD11 ILE B 30 5.756 -1.762 5.495 1.00 0.00 H new ATOM 0 HD12 ILE B 30 6.852 -2.558 4.341 1.00 0.00 H new ATOM 0 HD13 ILE B 30 5.105 -2.895 4.287 1.00 0.00 H new ATOM 1318 N ARG B 31 7.795 -7.993 4.851 1.00 0.00 N ATOM 1319 CA ARG B 31 7.837 -9.329 4.292 1.00 0.00 C ATOM 1320 C ARG B 31 8.208 -10.343 5.347 1.00 0.00 C ATOM 1321 O ARG B 31 7.599 -11.398 5.350 1.00 0.00 O ATOM 1322 CB ARG B 31 8.792 -9.384 3.097 1.00 0.00 C ATOM 1323 CG ARG B 31 8.833 -10.785 2.481 1.00 0.00 C ATOM 1324 CD ARG B 31 9.418 -10.698 1.071 1.00 0.00 C ATOM 1325 NE ARG B 31 9.615 -12.026 0.454 1.00 0.00 N ATOM 1326 CZ ARG B 31 8.696 -12.945 0.108 1.00 0.00 C ATOM 1327 NH1 ARG B 31 7.415 -12.852 0.454 1.00 0.00 N ATOM 1328 NH2 ARG B 31 9.059 -13.986 -0.627 1.00 0.00 N ATOM 0 H ARG B 31 8.474 -7.360 4.429 1.00 0.00 H new ATOM 0 HA ARG B 31 6.840 -9.583 3.932 1.00 0.00 H new ATOM 0 HB2 ARG B 31 8.477 -8.662 2.343 1.00 0.00 H new ATOM 0 HB3 ARG B 31 9.794 -9.095 3.416 1.00 0.00 H new ATOM 0 HG2 ARG B 31 9.438 -11.449 3.098 1.00 0.00 H new ATOM 0 HG3 ARG B 31 7.830 -11.209 2.446 1.00 0.00 H new ATOM 0 HD2 ARG B 31 8.754 -10.104 0.442 1.00 0.00 H new ATOM 0 HD3 ARG B 31 10.373 -10.174 1.110 1.00 0.00 H new ATOM 0 HE ARG B 31 10.584 -12.282 0.264 1.00 0.00 H new ATOM 0 HH11 ARG B 31 7.092 -12.057 1.006 1.00 0.00 H new ATOM 0 HH12 ARG B 31 6.755 -13.575 0.167 1.00 0.00 H new ATOM 0 HH21 ARG B 31 10.029 -14.086 -0.926 1.00 0.00 H new ATOM 0 HH22 ARG B 31 8.368 -14.688 -0.894 1.00 0.00 H new ATOM 1342 N LYS B 32 9.189 -10.078 6.203 1.00 0.00 N ATOM 1343 CA LYS B 32 9.579 -11.031 7.232 1.00 0.00 C ATOM 1344 C LYS B 32 8.397 -11.283 8.152 1.00 0.00 C ATOM 1345 O LYS B 32 8.065 -12.436 8.394 1.00 0.00 O ATOM 1346 CB LYS B 32 10.803 -10.525 8.016 1.00 0.00 C ATOM 1347 CG LYS B 32 12.127 -11.089 7.483 1.00 0.00 C ATOM 1348 CD LYS B 32 12.447 -10.749 6.022 1.00 0.00 C ATOM 1349 CE LYS B 32 13.516 -11.714 5.524 1.00 0.00 C ATOM 1350 NZ LYS B 32 13.709 -11.646 4.062 1.00 0.00 N ATOM 0 H LYS B 32 9.727 -9.212 6.204 1.00 0.00 H new ATOM 0 HA LYS B 32 9.868 -11.971 6.762 1.00 0.00 H new ATOM 0 HB2 LYS B 32 10.833 -9.436 7.971 1.00 0.00 H new ATOM 0 HB3 LYS B 32 10.694 -10.797 9.066 1.00 0.00 H new ATOM 0 HG2 LYS B 32 12.938 -10.720 8.110 1.00 0.00 H new ATOM 0 HG3 LYS B 32 12.110 -12.174 7.590 1.00 0.00 H new ATOM 0 HD2 LYS B 32 11.549 -10.829 5.409 1.00 0.00 H new ATOM 0 HD3 LYS B 32 12.798 -9.720 5.941 1.00 0.00 H new ATOM 0 HE2 LYS B 32 14.460 -11.492 6.022 1.00 0.00 H new ATOM 0 HE3 LYS B 32 13.240 -12.731 5.803 1.00 0.00 H new ATOM 0 HZ1 LYS B 32 14.446 -12.322 3.777 1.00 0.00 H new ATOM 0 HZ2 LYS B 32 12.817 -11.884 3.583 1.00 0.00 H new ATOM 0 HZ3 LYS B 32 14.000 -10.684 3.795 1.00 0.00 H new ATOM 1364 N LYS B 33 7.743 -10.227 8.633 1.00 0.00 N ATOM 1365 CA LYS B 33 6.610 -10.364 9.536 1.00 0.00 C ATOM 1366 C LYS B 33 5.461 -11.083 8.834 1.00 0.00 C ATOM 1367 O LYS B 33 4.907 -12.039 9.370 1.00 0.00 O ATOM 1368 CB LYS B 33 6.192 -8.975 10.050 1.00 0.00 C ATOM 1369 CG LYS B 33 5.873 -8.943 11.550 1.00 0.00 C ATOM 1370 CD LYS B 33 4.938 -10.055 12.060 1.00 0.00 C ATOM 1371 CE LYS B 33 4.415 -9.759 13.471 1.00 0.00 C ATOM 1372 NZ LYS B 33 5.492 -9.385 14.407 1.00 0.00 N ATOM 0 H LYS B 33 7.984 -9.262 8.408 1.00 0.00 H new ATOM 0 HA LYS B 33 6.893 -10.970 10.397 1.00 0.00 H new ATOM 0 HB2 LYS B 33 6.992 -8.265 9.843 1.00 0.00 H new ATOM 0 HB3 LYS B 33 5.316 -8.640 9.494 1.00 0.00 H new ATOM 0 HG2 LYS B 33 6.811 -9.001 12.103 1.00 0.00 H new ATOM 0 HG3 LYS B 33 5.423 -7.979 11.786 1.00 0.00 H new ATOM 0 HD2 LYS B 33 4.096 -10.164 11.376 1.00 0.00 H new ATOM 0 HD3 LYS B 33 5.472 -11.005 12.062 1.00 0.00 H new ATOM 0 HE2 LYS B 33 3.684 -8.952 13.422 1.00 0.00 H new ATOM 0 HE3 LYS B 33 3.895 -10.637 13.853 1.00 0.00 H new ATOM 0 HZ1 LYS B 33 5.121 -9.377 15.378 1.00 0.00 H new ATOM 0 HZ2 LYS B 33 6.267 -10.075 14.338 1.00 0.00 H new ATOM 0 HZ3 LYS B 33 5.849 -8.439 14.165 1.00 0.00 H new ATOM 1386 N ALA B 34 5.117 -10.628 7.632 1.00 0.00 N ATOM 1387 CA ALA B 34 4.063 -11.152 6.781 1.00 0.00 C ATOM 1388 C ALA B 34 4.271 -12.641 6.502 1.00 0.00 C ATOM 1389 O ALA B 34 3.397 -13.456 6.795 1.00 0.00 O ATOM 1390 CB ALA B 34 4.060 -10.335 5.482 1.00 0.00 C ATOM 0 H ALA B 34 5.598 -9.836 7.205 1.00 0.00 H new ATOM 0 HA ALA B 34 3.097 -11.061 7.279 1.00 0.00 H new ATOM 0 HB1 ALA B 34 3.277 -10.706 4.821 1.00 0.00 H new ATOM 0 HB2 ALA B 34 3.874 -9.286 5.712 1.00 0.00 H new ATOM 0 HB3 ALA B 34 5.027 -10.432 4.989 1.00 0.00 H new ATOM 1396 N GLU B 35 5.430 -12.991 5.945 1.00 0.00 N ATOM 1397 CA GLU B 35 5.806 -14.347 5.573 1.00 0.00 C ATOM 1398 C GLU B 35 5.830 -15.267 6.787 1.00 0.00 C ATOM 1399 O GLU B 35 5.337 -16.394 6.705 1.00 0.00 O ATOM 1400 CB GLU B 35 7.151 -14.318 4.830 1.00 0.00 C ATOM 1401 CG GLU B 35 7.499 -15.646 4.149 1.00 0.00 C ATOM 1402 CD GLU B 35 8.885 -15.623 3.498 1.00 0.00 C ATOM 1403 OE1 GLU B 35 9.419 -14.550 3.129 1.00 0.00 O ATOM 1404 OE2 GLU B 35 9.490 -16.709 3.355 1.00 0.00 O ATOM 0 H GLU B 35 6.158 -12.309 5.734 1.00 0.00 H new ATOM 0 HA GLU B 35 5.055 -14.758 4.898 1.00 0.00 H new ATOM 0 HB2 GLU B 35 7.126 -13.529 4.079 1.00 0.00 H new ATOM 0 HB3 GLU B 35 7.942 -14.062 5.535 1.00 0.00 H new ATOM 0 HG2 GLU B 35 7.459 -16.450 4.884 1.00 0.00 H new ATOM 0 HG3 GLU B 35 6.748 -15.870 3.391 1.00 0.00 H new ATOM 1411 N ASP B 36 6.373 -14.802 7.912 1.00 0.00 N ATOM 1412 CA ASP B 36 6.454 -15.572 9.147 1.00 0.00 C ATOM 1413 C ASP B 36 5.041 -15.824 9.668 1.00 0.00 C ATOM 1414 O ASP B 36 4.710 -16.936 10.081 1.00 0.00 O ATOM 1415 CB ASP B 36 7.326 -14.811 10.144 1.00 0.00 C ATOM 1416 CG ASP B 36 7.615 -15.588 11.417 1.00 0.00 C ATOM 1417 OD1 ASP B 36 6.688 -15.862 12.209 1.00 0.00 O ATOM 1418 OD2 ASP B 36 8.813 -15.767 11.737 1.00 0.00 O ATOM 0 H ASP B 36 6.774 -13.867 7.989 1.00 0.00 H new ATOM 0 HA ASP B 36 6.917 -16.545 8.981 1.00 0.00 H new ATOM 0 HB2 ASP B 36 8.270 -14.552 9.664 1.00 0.00 H new ATOM 0 HB3 ASP B 36 6.833 -13.874 10.404 1.00 0.00 H new ATOM 1423 N SER B 37 4.178 -14.809 9.582 1.00 0.00 N ATOM 1424 CA SER B 37 2.790 -14.882 10.000 1.00 0.00 C ATOM 1425 C SER B 37 1.956 -15.623 8.940 1.00 0.00 C ATOM 1426 O SER B 37 0.769 -15.862 9.163 1.00 0.00 O ATOM 1427 CB SER B 37 2.257 -13.461 10.250 1.00 0.00 C ATOM 1428 OG SER B 37 1.008 -13.476 10.924 1.00 0.00 O ATOM 0 H SER B 37 4.438 -13.896 9.210 1.00 0.00 H new ATOM 0 HA SER B 37 2.712 -15.445 10.930 1.00 0.00 H new ATOM 0 HB2 SER B 37 2.982 -12.900 10.840 1.00 0.00 H new ATOM 0 HB3 SER B 37 2.150 -12.941 9.298 1.00 0.00 H new ATOM 0 HG SER B 37 0.470 -14.228 10.599 1.00 0.00 H new ATOM 1434 N GLY B 38 2.531 -15.999 7.793 1.00 0.00 N ATOM 1435 CA GLY B 38 1.851 -16.698 6.720 1.00 0.00 C ATOM 1436 C GLY B 38 0.725 -15.875 6.093 1.00 0.00 C ATOM 1437 O GLY B 38 -0.237 -16.467 5.602 1.00 0.00 O ATOM 0 H GLY B 38 3.513 -15.815 7.588 1.00 0.00 H new ATOM 0 HA2 GLY B 38 2.575 -16.961 5.949 1.00 0.00 H new ATOM 0 HA3 GLY B 38 1.441 -17.632 7.104 1.00 0.00 H new ATOM 1441 N LEU B 39 0.786 -14.542 6.153 1.00 0.00 N ATOM 1442 CA LEU B 39 -0.200 -13.636 5.601 1.00 0.00 C ATOM 1443 C LEU B 39 0.540 -12.812 4.579 1.00 0.00 C ATOM 1444 O LEU B 39 1.504 -12.148 4.939 1.00 0.00 O ATOM 1445 CB LEU B 39 -0.780 -12.654 6.639 1.00 0.00 C ATOM 1446 CG LEU B 39 -1.392 -13.248 7.909 1.00 0.00 C ATOM 1447 CD1 LEU B 39 -2.046 -12.126 8.704 1.00 0.00 C ATOM 1448 CD2 LEU B 39 -2.449 -14.321 7.635 1.00 0.00 C ATOM 0 H LEU B 39 1.558 -14.054 6.608 1.00 0.00 H new ATOM 0 HA LEU B 39 -1.032 -14.220 5.208 1.00 0.00 H new ATOM 0 HB2 LEU B 39 0.015 -11.971 6.937 1.00 0.00 H new ATOM 0 HB3 LEU B 39 -1.546 -12.056 6.145 1.00 0.00 H new ATOM 0 HG LEU B 39 -0.581 -13.726 8.458 1.00 0.00 H new ATOM 0 HD11 LEU B 39 -2.487 -12.534 9.613 1.00 0.00 H new ATOM 0 HD12 LEU B 39 -1.295 -11.381 8.968 1.00 0.00 H new ATOM 0 HD13 LEU B 39 -2.824 -11.659 8.101 1.00 0.00 H new ATOM 0 HD21 LEU B 39 -2.839 -14.697 8.581 1.00 0.00 H new ATOM 0 HD22 LEU B 39 -3.263 -13.890 7.052 1.00 0.00 H new ATOM 0 HD23 LEU B 39 -1.998 -15.141 7.076 1.00 0.00 H new ATOM 1460 N THR B 40 0.117 -12.845 3.322 1.00 0.00 N ATOM 1461 CA THR B 40 0.757 -12.052 2.284 1.00 0.00 C ATOM 1462 C THR B 40 0.793 -10.603 2.740 1.00 0.00 C ATOM 1463 O THR B 40 -0.124 -10.112 3.409 1.00 0.00 O ATOM 1464 CB THR B 40 -0.004 -12.252 0.969 1.00 0.00 C ATOM 1465 OG1 THR B 40 0.639 -11.617 -0.117 1.00 0.00 O ATOM 1466 CG2 THR B 40 -1.446 -11.735 1.060 1.00 0.00 C ATOM 0 H THR B 40 -0.666 -13.412 2.998 1.00 0.00 H new ATOM 0 HA THR B 40 1.786 -12.365 2.109 1.00 0.00 H new ATOM 0 HB THR B 40 -0.018 -13.328 0.794 1.00 0.00 H new ATOM 0 HG1 THR B 40 0.124 -11.769 -0.937 1.00 0.00 H new ATOM 0 HG21 THR B 40 -1.951 -11.895 0.107 1.00 0.00 H new ATOM 0 HG22 THR B 40 -1.976 -12.272 1.847 1.00 0.00 H new ATOM 0 HG23 THR B 40 -1.437 -10.670 1.291 1.00 0.00 H new ATOM 1474 N VAL B 41 1.831 -9.905 2.295 1.00 0.00 N ATOM 1475 CA VAL B 41 2.072 -8.518 2.619 1.00 0.00 C ATOM 1476 C VAL B 41 0.819 -7.653 2.427 1.00 0.00 C ATOM 1477 O VAL B 41 0.594 -6.743 3.212 1.00 0.00 O ATOM 1478 CB VAL B 41 3.319 -8.011 1.885 1.00 0.00 C ATOM 1479 CG1 VAL B 41 4.573 -8.842 2.201 1.00 0.00 C ATOM 1480 CG2 VAL B 41 3.148 -7.904 0.370 1.00 0.00 C ATOM 0 H VAL B 41 2.543 -10.305 1.683 1.00 0.00 H new ATOM 0 HA VAL B 41 2.291 -8.433 3.684 1.00 0.00 H new ATOM 0 HB VAL B 41 3.457 -7.001 2.272 1.00 0.00 H new ATOM 0 HG11 VAL B 41 5.425 -8.438 1.654 1.00 0.00 H new ATOM 0 HG12 VAL B 41 4.776 -8.801 3.271 1.00 0.00 H new ATOM 0 HG13 VAL B 41 4.408 -9.877 1.902 1.00 0.00 H new ATOM 0 HG21 VAL B 41 4.073 -7.539 -0.076 1.00 0.00 H new ATOM 0 HG22 VAL B 41 2.911 -8.886 -0.040 1.00 0.00 H new ATOM 0 HG23 VAL B 41 2.338 -7.211 0.143 1.00 0.00 H new ATOM 1490 N SER B 42 -0.038 -7.941 1.442 1.00 0.00 N ATOM 1491 CA SER B 42 -1.261 -7.176 1.217 1.00 0.00 C ATOM 1492 C SER B 42 -2.181 -7.268 2.454 1.00 0.00 C ATOM 1493 O SER B 42 -2.677 -6.247 2.934 1.00 0.00 O ATOM 1494 CB SER B 42 -1.913 -7.682 -0.078 1.00 0.00 C ATOM 1495 OG SER B 42 -3.031 -6.914 -0.473 1.00 0.00 O ATOM 0 H SER B 42 0.099 -8.708 0.783 1.00 0.00 H new ATOM 0 HA SER B 42 -1.049 -6.115 1.087 1.00 0.00 H new ATOM 0 HB2 SER B 42 -1.173 -7.673 -0.878 1.00 0.00 H new ATOM 0 HB3 SER B 42 -2.222 -8.718 0.059 1.00 0.00 H new ATOM 0 HG SER B 42 -3.403 -7.281 -1.302 1.00 0.00 H new ATOM 1501 N ALA B 43 -2.438 -8.484 2.956 1.00 0.00 N ATOM 1502 CA ALA B 43 -3.267 -8.712 4.135 1.00 0.00 C ATOM 1503 C ALA B 43 -2.553 -8.154 5.362 1.00 0.00 C ATOM 1504 O ALA B 43 -3.184 -7.497 6.181 1.00 0.00 O ATOM 1505 CB ALA B 43 -3.538 -10.204 4.348 1.00 0.00 C ATOM 0 H ALA B 43 -2.069 -9.342 2.546 1.00 0.00 H new ATOM 0 HA ALA B 43 -4.222 -8.209 3.984 1.00 0.00 H new ATOM 0 HB1 ALA B 43 -4.158 -10.338 5.234 1.00 0.00 H new ATOM 0 HB2 ALA B 43 -4.056 -10.607 3.478 1.00 0.00 H new ATOM 0 HB3 ALA B 43 -2.593 -10.730 4.483 1.00 0.00 H new ATOM 1511 N TYR B 44 -1.244 -8.394 5.483 1.00 0.00 N ATOM 1512 CA TYR B 44 -0.446 -7.910 6.599 1.00 0.00 C ATOM 1513 C TYR B 44 -0.606 -6.383 6.729 1.00 0.00 C ATOM 1514 O TYR B 44 -0.916 -5.890 7.813 1.00 0.00 O ATOM 1515 CB TYR B 44 1.018 -8.304 6.402 1.00 0.00 C ATOM 1516 CG TYR B 44 1.915 -7.718 7.466 1.00 0.00 C ATOM 1517 CD1 TYR B 44 2.086 -8.385 8.691 1.00 0.00 C ATOM 1518 CD2 TYR B 44 2.509 -6.458 7.258 1.00 0.00 C ATOM 1519 CE1 TYR B 44 2.836 -7.782 9.713 1.00 0.00 C ATOM 1520 CE2 TYR B 44 3.280 -5.866 8.269 1.00 0.00 C ATOM 1521 CZ TYR B 44 3.443 -6.524 9.506 1.00 0.00 C ATOM 1522 OH TYR B 44 4.179 -5.967 10.500 1.00 0.00 O ATOM 0 H TYR B 44 -0.710 -8.934 4.802 1.00 0.00 H new ATOM 0 HA TYR B 44 -0.794 -8.367 7.525 1.00 0.00 H new ATOM 0 HB2 TYR B 44 1.105 -9.390 6.414 1.00 0.00 H new ATOM 0 HB3 TYR B 44 1.354 -7.968 5.421 1.00 0.00 H new ATOM 0 HD1 TYR B 44 1.642 -9.357 8.846 1.00 0.00 H new ATOM 0 HD2 TYR B 44 2.370 -5.946 6.317 1.00 0.00 H new ATOM 0 HE1 TYR B 44 2.949 -8.283 10.663 1.00 0.00 H new ATOM 0 HE2 TYR B 44 3.748 -4.908 8.101 1.00 0.00 H new ATOM 0 HH TYR B 44 4.392 -5.039 10.269 1.00 0.00 H new ATOM 1532 N ILE B 45 -0.425 -5.650 5.621 1.00 0.00 N ATOM 1533 CA ILE B 45 -0.534 -4.196 5.532 1.00 0.00 C ATOM 1534 C ILE B 45 -1.913 -3.739 5.993 1.00 0.00 C ATOM 1535 O ILE B 45 -2.015 -3.033 6.994 1.00 0.00 O ATOM 1536 CB ILE B 45 -0.225 -3.710 4.084 1.00 0.00 C ATOM 1537 CG1 ILE B 45 1.280 -3.772 3.738 1.00 0.00 C ATOM 1538 CG2 ILE B 45 -0.761 -2.295 3.778 1.00 0.00 C ATOM 1539 CD1 ILE B 45 2.135 -2.714 4.429 1.00 0.00 C ATOM 0 H ILE B 45 -0.188 -6.078 4.726 1.00 0.00 H new ATOM 0 HA ILE B 45 0.206 -3.747 6.195 1.00 0.00 H new ATOM 0 HB ILE B 45 -0.761 -4.416 3.450 1.00 0.00 H new ATOM 0 HG12 ILE B 45 1.660 -4.758 4.004 1.00 0.00 H new ATOM 0 HG13 ILE B 45 1.396 -3.666 2.659 1.00 0.00 H new ATOM 0 HG21 ILE B 45 -0.509 -2.024 2.753 1.00 0.00 H new ATOM 0 HG22 ILE B 45 -1.844 -2.282 3.901 1.00 0.00 H new ATOM 0 HG23 ILE B 45 -0.309 -1.579 4.464 1.00 0.00 H new ATOM 0 HD11 ILE B 45 3.176 -2.833 4.128 1.00 0.00 H new ATOM 0 HD12 ILE B 45 1.786 -1.721 4.144 1.00 0.00 H new ATOM 0 HD13 ILE B 45 2.055 -2.830 5.510 1.00 0.00 H new ATOM 1551 N ARG B 46 -2.973 -4.131 5.272 1.00 0.00 N ATOM 1552 CA ARG B 46 -4.329 -3.712 5.615 1.00 0.00 C ATOM 1553 C ARG B 46 -4.648 -4.027 7.075 1.00 0.00 C ATOM 1554 O ARG B 46 -5.119 -3.150 7.784 1.00 0.00 O ATOM 1555 CB ARG B 46 -5.361 -4.259 4.607 1.00 0.00 C ATOM 1556 CG ARG B 46 -5.804 -5.704 4.876 1.00 0.00 C ATOM 1557 CD ARG B 46 -6.545 -6.340 3.704 1.00 0.00 C ATOM 1558 NE ARG B 46 -7.063 -7.674 4.066 1.00 0.00 N ATOM 1559 CZ ARG B 46 -7.991 -8.360 3.392 1.00 0.00 C ATOM 1560 NH1 ARG B 46 -8.494 -7.870 2.271 1.00 0.00 N ATOM 1561 NH2 ARG B 46 -8.419 -9.547 3.803 1.00 0.00 N ATOM 0 H ARG B 46 -2.913 -4.735 4.452 1.00 0.00 H new ATOM 0 HA ARG B 46 -4.394 -2.627 5.528 1.00 0.00 H new ATOM 0 HB2 ARG B 46 -6.240 -3.614 4.619 1.00 0.00 H new ATOM 0 HB3 ARG B 46 -4.937 -4.202 3.604 1.00 0.00 H new ATOM 0 HG2 ARG B 46 -4.927 -6.307 5.112 1.00 0.00 H new ATOM 0 HG3 ARG B 46 -6.448 -5.721 5.755 1.00 0.00 H new ATOM 0 HD2 ARG B 46 -7.370 -5.696 3.399 1.00 0.00 H new ATOM 0 HD3 ARG B 46 -5.874 -6.426 2.849 1.00 0.00 H new ATOM 0 HE ARG B 46 -6.679 -8.111 4.904 1.00 0.00 H new ATOM 0 HH11 ARG B 46 -8.174 -6.967 1.920 1.00 0.00 H new ATOM 0 HH12 ARG B 46 -9.202 -8.395 1.758 1.00 0.00 H new ATOM 0 HH21 ARG B 46 -8.038 -9.959 4.655 1.00 0.00 H new ATOM 0 HH22 ARG B 46 -9.129 -10.047 3.267 1.00 0.00 H new ATOM 1575 N ASN B 47 -4.342 -5.237 7.543 1.00 0.00 N ATOM 1576 CA ASN B 47 -4.609 -5.649 8.911 1.00 0.00 C ATOM 1577 C ASN B 47 -3.926 -4.722 9.912 1.00 0.00 C ATOM 1578 O ASN B 47 -4.603 -4.207 10.801 1.00 0.00 O ATOM 1579 CB ASN B 47 -4.175 -7.100 9.104 1.00 0.00 C ATOM 1580 CG ASN B 47 -4.385 -7.533 10.542 1.00 0.00 C ATOM 1581 OD1 ASN B 47 -5.513 -7.654 11.002 1.00 0.00 O ATOM 1582 ND2 ASN B 47 -3.313 -7.773 11.265 1.00 0.00 N ATOM 0 H ASN B 47 -3.899 -5.960 6.976 1.00 0.00 H new ATOM 0 HA ASN B 47 -5.681 -5.580 9.097 1.00 0.00 H new ATOM 0 HB2 ASN B 47 -4.744 -7.747 8.437 1.00 0.00 H new ATOM 0 HB3 ASN B 47 -3.124 -7.210 8.835 1.00 0.00 H new ATOM 0 HD21 ASN B 47 -3.409 -8.069 12.237 1.00 0.00 H new ATOM 0 HD22 ASN B 47 -2.386 -7.664 10.854 1.00 0.00 H new ATOM 1589 N ALA B 48 -2.618 -4.483 9.752 1.00 0.00 N ATOM 1590 CA ALA B 48 -1.845 -3.617 10.641 1.00 0.00 C ATOM 1591 C ALA B 48 -2.382 -2.184 10.629 1.00 0.00 C ATOM 1592 O ALA B 48 -2.308 -1.484 11.638 1.00 0.00 O ATOM 1593 CB ALA B 48 -0.365 -3.601 10.223 1.00 0.00 C ATOM 0 H ALA B 48 -2.066 -4.889 8.996 1.00 0.00 H new ATOM 0 HA ALA B 48 -1.939 -4.020 11.649 1.00 0.00 H new ATOM 0 HB1 ALA B 48 0.196 -2.952 10.895 1.00 0.00 H new ATOM 0 HB2 ALA B 48 0.039 -4.612 10.275 1.00 0.00 H new ATOM 0 HB3 ALA B 48 -0.279 -3.228 9.202 1.00 0.00 H new ATOM 1599 N ALA B 49 -2.903 -1.741 9.483 1.00 0.00 N ATOM 1600 CA ALA B 49 -3.447 -0.406 9.289 1.00 0.00 C ATOM 1601 C ALA B 49 -4.849 -0.218 9.884 1.00 0.00 C ATOM 1602 O ALA B 49 -5.280 0.921 10.068 1.00 0.00 O ATOM 1603 CB ALA B 49 -3.494 -0.114 7.794 1.00 0.00 C ATOM 0 H ALA B 49 -2.957 -2.320 8.645 1.00 0.00 H new ATOM 0 HA ALA B 49 -2.792 0.287 9.817 1.00 0.00 H new ATOM 0 HB1 ALA B 49 -3.900 0.884 7.631 1.00 0.00 H new ATOM 0 HB2 ALA B 49 -2.487 -0.168 7.381 1.00 0.00 H new ATOM 0 HB3 ALA B 49 -4.129 -0.849 7.299 1.00 0.00 H new ATOM 1609 N LEU B 50 -5.573 -1.297 10.177 1.00 0.00 N ATOM 1610 CA LEU B 50 -6.923 -1.234 10.738 1.00 0.00 C ATOM 1611 C LEU B 50 -6.908 -1.534 12.225 1.00 0.00 C ATOM 1612 O LEU B 50 -7.695 -0.943 12.969 1.00 0.00 O ATOM 1613 CB LEU B 50 -7.816 -2.262 10.039 1.00 0.00 C ATOM 1614 CG LEU B 50 -7.958 -1.990 8.534 1.00 0.00 C ATOM 1615 CD1 LEU B 50 -8.389 -3.284 7.854 1.00 0.00 C ATOM 1616 CD2 LEU B 50 -8.909 -0.838 8.243 1.00 0.00 C ATOM 0 H LEU B 50 -5.237 -2.249 10.031 1.00 0.00 H new ATOM 0 HA LEU B 50 -7.309 -0.226 10.583 1.00 0.00 H new ATOM 0 HB2 LEU B 50 -7.402 -3.259 10.187 1.00 0.00 H new ATOM 0 HB3 LEU B 50 -8.803 -2.255 10.501 1.00 0.00 H new ATOM 0 HG LEU B 50 -6.997 -1.673 8.130 1.00 0.00 H new ATOM 0 HD11 LEU B 50 -8.496 -3.114 6.783 1.00 0.00 H new ATOM 0 HD12 LEU B 50 -7.636 -4.053 8.026 1.00 0.00 H new ATOM 0 HD13 LEU B 50 -9.343 -3.611 8.267 1.00 0.00 H new ATOM 0 HD21 LEU B 50 -8.976 -0.685 7.166 1.00 0.00 H new ATOM 0 HD22 LEU B 50 -9.897 -1.073 8.638 1.00 0.00 H new ATOM 0 HD23 LEU B 50 -8.536 0.070 8.716 1.00 0.00 H new ATOM 1628 N ASN B 51 -6.047 -2.472 12.624 1.00 0.00 N ATOM 1629 CA ASN B 51 -5.860 -2.915 14.005 1.00 0.00 C ATOM 1630 C ASN B 51 -4.712 -2.120 14.600 1.00 0.00 C ATOM 1631 O ASN B 51 -3.797 -2.719 15.202 1.00 0.00 O ATOM 1632 CB ASN B 51 -5.591 -4.434 14.089 1.00 0.00 C ATOM 1633 CG ASN B 51 -6.821 -5.285 13.843 1.00 0.00 C ATOM 1634 OD1 ASN B 51 -7.388 -5.843 14.782 1.00 0.00 O ATOM 1635 ND2 ASN B 51 -7.221 -5.436 12.595 1.00 0.00 N ATOM 0 H ASN B 51 -5.438 -2.962 11.968 1.00 0.00 H new ATOM 0 HA ASN B 51 -6.774 -2.737 14.572 1.00 0.00 H new ATOM 0 HB2 ASN B 51 -4.825 -4.699 13.360 1.00 0.00 H new ATOM 0 HB3 ASN B 51 -5.189 -4.669 15.074 1.00 0.00 H new ATOM 0 HD21 ASN B 51 -8.023 -6.030 12.385 1.00 0.00 H new ATOM 0 HD22 ASN B 51 -6.728 -4.959 11.840 1.00 0.00 H new TER 1642 ASN B 51