USER MOD reduce.3.24.130724 H: found=0, std=0, add=888, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 889 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 106 GLN : amide:sc= -0.766 K(o=-0.77,f=-0.015) USER MOD Set 1.2: B 110 TYR OH : rot 180:sc= 0 USER MOD Single : A 1 MET CE :methyl 166:sc= 0 (180deg=-0.541) USER MOD Single : A 1 MET N :NH3+ -155:sc= 1.25 (180deg=0.976) USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 7 LYS NZ :NH3+ -170:sc= 1.12 (180deg=0.933) USER MOD Single : A 13 TYR OH : rot 150:sc= -0.18 USER MOD Single : A 14 GLN : amide:sc= -0.0881 K(o=-0.088,f=-0.7) USER MOD Single : A 15 LYS NZ :NH3+ -165:sc=-0.00341 (180deg=-0.198) USER MOD Single : A 18 THR OG1 : rot 78:sc= 0.475 USER MOD Single : A 20 ASN : amide:sc= 0.194! K(o=0.19!,f=-4.2) USER MOD Single : A 22 GLN : amide:sc= 0 X(o=0,f=-0.36) USER MOD Single : A 24 GLN : amide:sc= -1.11 X(o=-1.1,f=-1.4!) USER MOD Single : A 28 THR OG1 : rot 180:sc= 0 USER MOD Single : A 29 GLN : amide:sc= -0.587 K(o=-0.59,f=-4.6!) USER MOD Single : A 30 LYS NZ :NH3+ 149:sc= -0.0533 (180deg=-0.404) USER MOD Single : A 33 LYS NZ :NH3+ -166:sc= -0.0618 (180deg=-0.292) USER MOD Single : A 39 GLN : amide:sc= -1.04 K(o=-1,f=-0.012) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 THR OG1 : rot 180:sc= -0.0987 USER MOD Single : A 53 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 88 SER OG : rot 180:sc= 0 USER MOD Single : B 100 GLN : amide:sc= 0.594 K(o=0.59,f=-1.6!) USER MOD Single : B 101 TYR OH : rot 180:sc= 0 USER MOD Single : B 107 ASN : amide:sc= -3.2! C(o=-3.2!,f=-1.5!) USER MOD Single : B 111 LYS NZ :NH3+ 150:sc= -1.76! (180deg=-3.36!) USER MOD Single : B 112 LYS NZ :NH3+ -136:sc= -0.591 (180deg=-2.62!) USER MOD Single : B 115 GLN : amide:sc= -0.848 K(o=-0.85,f=0) USER MOD Single : B 123 LYS NZ :NH3+ -126:sc= -0.706 (180deg=-4.27!) USER MOD Single : B 130 SER OG : rot 85:sc= 1.25 USER MOD Single : B 133 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 26.139 -2.371 6.684 1.00 0.00 N ATOM 2 CA MET A 1 25.376 -2.662 5.452 1.00 0.00 C ATOM 3 C MET A 1 26.226 -3.478 4.484 1.00 0.00 C ATOM 4 O MET A 1 25.851 -4.590 4.114 1.00 0.00 O ATOM 5 CB MET A 1 24.909 -1.360 4.792 1.00 0.00 C ATOM 6 CG MET A 1 23.860 -1.568 3.713 1.00 0.00 C ATOM 7 SD MET A 1 23.210 -0.018 3.058 1.00 0.00 S ATOM 8 CE MET A 1 21.918 -0.627 1.975 1.00 0.00 C ATOM 0 H1 MET A 1 25.479 -2.210 7.471 1.00 0.00 H new ATOM 0 H2 MET A 1 26.756 -3.177 6.909 1.00 0.00 H new ATOM 0 H3 MET A 1 26.719 -1.520 6.540 1.00 0.00 H new ATOM 0 HA MET A 1 24.496 -3.247 5.717 1.00 0.00 H new ATOM 0 HB2 MET A 1 24.504 -0.699 5.558 1.00 0.00 H new ATOM 0 HB3 MET A 1 25.771 -0.854 4.357 1.00 0.00 H new ATOM 0 HG2 MET A 1 24.294 -2.147 2.898 1.00 0.00 H new ATOM 0 HG3 MET A 1 23.039 -2.157 4.121 1.00 0.00 H new ATOM 0 HE1 MET A 1 21.264 0.197 1.689 1.00 0.00 H new ATOM 0 HE2 MET A 1 22.367 -1.061 1.081 1.00 0.00 H new ATOM 0 HE3 MET A 1 21.336 -1.388 2.495 1.00 0.00 H new ATOM 20 N ASP A 2 27.374 -2.935 4.086 1.00 0.00 N ATOM 21 CA ASP A 2 28.293 -3.645 3.198 1.00 0.00 C ATOM 22 C ASP A 2 29.737 -3.351 3.580 1.00 0.00 C ATOM 23 O ASP A 2 29.989 -2.639 4.550 1.00 0.00 O ATOM 24 CB ASP A 2 28.059 -3.264 1.733 1.00 0.00 C ATOM 25 CG ASP A 2 26.785 -3.852 1.167 1.00 0.00 C ATOM 26 OD1 ASP A 2 25.945 -3.081 0.663 1.00 0.00 O ATOM 27 OD2 ASP A 2 26.621 -5.091 1.219 1.00 0.00 O ATOM 0 H ASP A 2 27.691 -2.006 4.364 1.00 0.00 H new ATOM 0 HA ASP A 2 28.101 -4.712 3.311 1.00 0.00 H new ATOM 0 HB2 ASP A 2 28.021 -2.178 1.647 1.00 0.00 H new ATOM 0 HB3 ASP A 2 28.906 -3.602 1.135 1.00 0.00 H new ATOM 32 N SER A 3 30.682 -3.893 2.821 1.00 0.00 N ATOM 33 CA SER A 3 32.098 -3.670 3.091 1.00 0.00 C ATOM 34 C SER A 3 32.441 -2.186 2.972 1.00 0.00 C ATOM 35 O SER A 3 33.069 -1.608 3.863 1.00 0.00 O ATOM 36 CB SER A 3 32.956 -4.489 2.122 1.00 0.00 C ATOM 37 OG SER A 3 32.604 -5.864 2.169 1.00 0.00 O ATOM 0 H SER A 3 30.494 -4.489 2.015 1.00 0.00 H new ATOM 0 HA SER A 3 32.310 -3.993 4.110 1.00 0.00 H new ATOM 0 HB2 SER A 3 32.827 -4.111 1.108 1.00 0.00 H new ATOM 0 HB3 SER A 3 34.010 -4.371 2.374 1.00 0.00 H new ATOM 0 HG SER A 3 33.164 -6.367 1.541 1.00 0.00 H new ATOM 43 N ALA A 4 32.009 -1.572 1.878 1.00 0.00 N ATOM 44 CA ALA A 4 32.245 -0.155 1.658 1.00 0.00 C ATOM 45 C ALA A 4 31.140 0.683 2.290 1.00 0.00 C ATOM 46 O ALA A 4 31.411 1.616 3.046 1.00 0.00 O ATOM 47 CB ALA A 4 32.351 0.138 0.170 1.00 0.00 C ATOM 0 H ALA A 4 31.493 -2.035 1.130 1.00 0.00 H new ATOM 0 HA ALA A 4 33.188 0.113 2.134 1.00 0.00 H new ATOM 0 HB1 ALA A 4 32.528 1.203 0.021 1.00 0.00 H new ATOM 0 HB2 ALA A 4 33.179 -0.430 -0.255 1.00 0.00 H new ATOM 0 HB3 ALA A 4 31.423 -0.149 -0.324 1.00 0.00 H new ATOM 53 N ILE A 5 29.893 0.337 1.983 1.00 0.00 N ATOM 54 CA ILE A 5 28.745 1.065 2.511 1.00 0.00 C ATOM 55 C ILE A 5 28.620 0.839 4.015 1.00 0.00 C ATOM 56 O ILE A 5 28.209 -0.234 4.464 1.00 0.00 O ATOM 57 CB ILE A 5 27.433 0.641 1.819 1.00 0.00 C ATOM 58 CG1 ILE A 5 27.586 0.718 0.296 1.00 0.00 C ATOM 59 CG2 ILE A 5 26.286 1.527 2.283 1.00 0.00 C ATOM 60 CD1 ILE A 5 26.374 0.226 -0.465 1.00 0.00 C ATOM 0 H ILE A 5 29.652 -0.443 1.371 1.00 0.00 H new ATOM 0 HA ILE A 5 28.912 2.123 2.310 1.00 0.00 H new ATOM 0 HB ILE A 5 27.210 -0.390 2.092 1.00 0.00 H new ATOM 0 HG12 ILE A 5 27.787 1.751 0.012 1.00 0.00 H new ATOM 0 HG13 ILE A 5 28.454 0.131 -0.003 1.00 0.00 H new ATOM 0 HG21 ILE A 5 25.365 1.219 1.788 1.00 0.00 H new ATOM 0 HG22 ILE A 5 26.167 1.433 3.362 1.00 0.00 H new ATOM 0 HG23 ILE A 5 26.503 2.565 2.031 1.00 0.00 H new ATOM 0 HD11 ILE A 5 26.558 0.311 -1.536 1.00 0.00 H new ATOM 0 HD12 ILE A 5 26.184 -0.817 -0.211 1.00 0.00 H new ATOM 0 HD13 ILE A 5 25.506 0.829 -0.196 1.00 0.00 H new ATOM 72 N SER A 6 28.973 1.856 4.783 1.00 0.00 N ATOM 73 CA SER A 6 29.002 1.752 6.228 1.00 0.00 C ATOM 74 C SER A 6 27.654 2.147 6.815 1.00 0.00 C ATOM 75 O SER A 6 26.679 2.310 6.074 1.00 0.00 O ATOM 76 CB SER A 6 30.115 2.640 6.781 1.00 0.00 C ATOM 77 OG SER A 6 31.342 2.376 6.121 1.00 0.00 O ATOM 0 H SER A 6 29.246 2.771 4.423 1.00 0.00 H new ATOM 0 HA SER A 6 29.202 0.719 6.511 1.00 0.00 H new ATOM 0 HB2 SER A 6 29.847 3.689 6.655 1.00 0.00 H new ATOM 0 HB3 SER A 6 30.227 2.467 7.851 1.00 0.00 H new ATOM 0 HG SER A 6 32.042 2.956 6.488 1.00 0.00 H new ATOM 83 N LYS A 7 27.585 2.307 8.131 1.00 0.00 N ATOM 84 CA LYS A 7 26.336 2.677 8.774 1.00 0.00 C ATOM 85 C LYS A 7 25.890 4.073 8.325 1.00 0.00 C ATOM 86 O LYS A 7 24.715 4.426 8.427 1.00 0.00 O ATOM 87 CB LYS A 7 26.462 2.613 10.295 1.00 0.00 C ATOM 88 CG LYS A 7 25.126 2.769 10.997 1.00 0.00 C ATOM 89 CD LYS A 7 25.222 2.521 12.490 1.00 0.00 C ATOM 90 CE LYS A 7 25.550 1.067 12.799 1.00 0.00 C ATOM 91 NZ LYS A 7 24.474 0.140 12.351 1.00 0.00 N ATOM 0 H LYS A 7 28.373 2.187 8.767 1.00 0.00 H new ATOM 0 HA LYS A 7 25.575 1.959 8.470 1.00 0.00 H new ATOM 0 HB2 LYS A 7 26.909 1.660 10.579 1.00 0.00 H new ATOM 0 HB3 LYS A 7 27.140 3.397 10.633 1.00 0.00 H new ATOM 0 HG2 LYS A 7 24.743 3.775 10.823 1.00 0.00 H new ATOM 0 HG3 LYS A 7 24.407 2.074 10.562 1.00 0.00 H new ATOM 0 HD2 LYS A 7 25.990 3.166 12.917 1.00 0.00 H new ATOM 0 HD3 LYS A 7 24.279 2.790 12.965 1.00 0.00 H new ATOM 0 HE2 LYS A 7 26.487 0.796 12.312 1.00 0.00 H new ATOM 0 HE3 LYS A 7 25.704 0.951 13.872 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 24.656 -0.812 12.728 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 23.555 0.480 12.699 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 24.458 0.103 11.312 1.00 0.00 H new ATOM 105 N GLU A 8 26.845 4.840 7.801 1.00 0.00 N ATOM 106 CA GLU A 8 26.596 6.186 7.291 1.00 0.00 C ATOM 107 C GLU A 8 25.407 6.207 6.329 1.00 0.00 C ATOM 108 O GLU A 8 24.376 6.824 6.606 1.00 0.00 O ATOM 109 CB GLU A 8 27.839 6.689 6.557 1.00 0.00 C ATOM 110 CG GLU A 8 29.108 6.641 7.373 1.00 0.00 C ATOM 111 CD GLU A 8 30.333 6.992 6.554 1.00 0.00 C ATOM 112 OE1 GLU A 8 31.031 7.965 6.900 1.00 0.00 O ATOM 113 OE2 GLU A 8 30.600 6.296 5.554 1.00 0.00 O ATOM 0 H GLU A 8 27.817 4.543 7.718 1.00 0.00 H new ATOM 0 HA GLU A 8 26.366 6.831 8.139 1.00 0.00 H new ATOM 0 HB2 GLU A 8 27.979 6.093 5.655 1.00 0.00 H new ATOM 0 HB3 GLU A 8 27.666 7.717 6.237 1.00 0.00 H new ATOM 0 HG2 GLU A 8 29.024 7.332 8.212 1.00 0.00 H new ATOM 0 HG3 GLU A 8 29.229 5.643 7.794 1.00 0.00 H new ATOM 120 N ASP A 9 25.557 5.521 5.202 1.00 0.00 N ATOM 121 CA ASP A 9 24.522 5.503 4.175 1.00 0.00 C ATOM 122 C ASP A 9 23.442 4.489 4.538 1.00 0.00 C ATOM 123 O ASP A 9 22.305 4.570 4.074 1.00 0.00 O ATOM 124 CB ASP A 9 25.136 5.167 2.814 1.00 0.00 C ATOM 125 CG ASP A 9 24.247 5.576 1.656 1.00 0.00 C ATOM 126 OD1 ASP A 9 24.307 6.758 1.251 1.00 0.00 O ATOM 127 OD2 ASP A 9 23.498 4.725 1.136 1.00 0.00 O ATOM 0 H ASP A 9 26.385 4.970 4.976 1.00 0.00 H new ATOM 0 HA ASP A 9 24.066 6.491 4.115 1.00 0.00 H new ATOM 0 HB2 ASP A 9 26.100 5.667 2.721 1.00 0.00 H new ATOM 0 HB3 ASP A 9 25.326 4.095 2.760 1.00 0.00 H new ATOM 132 N GLU A 10 23.818 3.543 5.390 1.00 0.00 N ATOM 133 CA GLU A 10 22.904 2.528 5.901 1.00 0.00 C ATOM 134 C GLU A 10 21.718 3.169 6.606 1.00 0.00 C ATOM 135 O GLU A 10 20.570 2.992 6.200 1.00 0.00 O ATOM 136 CB GLU A 10 23.653 1.637 6.882 1.00 0.00 C ATOM 137 CG GLU A 10 22.806 0.580 7.561 1.00 0.00 C ATOM 138 CD GLU A 10 23.602 -0.207 8.584 1.00 0.00 C ATOM 139 OE1 GLU A 10 23.498 0.090 9.791 1.00 0.00 O ATOM 140 OE2 GLU A 10 24.348 -1.126 8.187 1.00 0.00 O ATOM 0 H GLU A 10 24.769 3.458 5.748 1.00 0.00 H new ATOM 0 HA GLU A 10 22.529 1.940 5.064 1.00 0.00 H new ATOM 0 HB2 GLU A 10 24.468 1.143 6.352 1.00 0.00 H new ATOM 0 HB3 GLU A 10 24.106 2.266 7.648 1.00 0.00 H new ATOM 0 HG2 GLU A 10 21.955 1.055 8.049 1.00 0.00 H new ATOM 0 HG3 GLU A 10 22.404 -0.101 6.811 1.00 0.00 H new ATOM 147 N GLU A 11 22.012 3.909 7.668 1.00 0.00 N ATOM 148 CA GLU A 11 20.994 4.595 8.443 1.00 0.00 C ATOM 149 C GLU A 11 20.217 5.579 7.579 1.00 0.00 C ATOM 150 O GLU A 11 19.042 5.846 7.834 1.00 0.00 O ATOM 151 CB GLU A 11 21.635 5.308 9.629 1.00 0.00 C ATOM 152 CG GLU A 11 22.181 4.351 10.674 1.00 0.00 C ATOM 153 CD GLU A 11 21.085 3.689 11.484 1.00 0.00 C ATOM 154 OE1 GLU A 11 20.751 2.518 11.209 1.00 0.00 O ATOM 155 OE2 GLU A 11 20.555 4.336 12.414 1.00 0.00 O ATOM 0 H GLU A 11 22.962 4.048 8.013 1.00 0.00 H new ATOM 0 HA GLU A 11 20.288 3.854 8.817 1.00 0.00 H new ATOM 0 HB2 GLU A 11 22.444 5.944 9.269 1.00 0.00 H new ATOM 0 HB3 GLU A 11 20.898 5.962 10.094 1.00 0.00 H new ATOM 0 HG2 GLU A 11 22.779 3.584 10.182 1.00 0.00 H new ATOM 0 HG3 GLU A 11 22.848 4.893 11.345 1.00 0.00 H new ATOM 162 N ARG A 12 20.870 6.105 6.548 1.00 0.00 N ATOM 163 CA ARG A 12 20.209 6.990 5.600 1.00 0.00 C ATOM 164 C ARG A 12 19.125 6.221 4.843 1.00 0.00 C ATOM 165 O ARG A 12 18.000 6.697 4.691 1.00 0.00 O ATOM 166 CB ARG A 12 21.228 7.580 4.620 1.00 0.00 C ATOM 167 CG ARG A 12 20.639 8.599 3.659 1.00 0.00 C ATOM 168 CD ARG A 12 20.066 9.802 4.393 1.00 0.00 C ATOM 169 NE ARG A 12 21.077 10.491 5.194 1.00 0.00 N ATOM 170 CZ ARG A 12 20.859 11.626 5.856 1.00 0.00 C ATOM 171 NH1 ARG A 12 19.665 12.201 5.822 1.00 0.00 N ATOM 172 NH2 ARG A 12 21.837 12.179 6.559 1.00 0.00 N ATOM 0 H ARG A 12 21.856 5.933 6.349 1.00 0.00 H new ATOM 0 HA ARG A 12 19.745 7.811 6.147 1.00 0.00 H new ATOM 0 HB2 ARG A 12 22.031 8.051 5.186 1.00 0.00 H new ATOM 0 HB3 ARG A 12 21.676 6.770 4.045 1.00 0.00 H new ATOM 0 HG2 ARG A 12 21.410 8.931 2.964 1.00 0.00 H new ATOM 0 HG3 ARG A 12 19.855 8.128 3.065 1.00 0.00 H new ATOM 0 HD2 ARG A 12 19.641 10.498 3.670 1.00 0.00 H new ATOM 0 HD3 ARG A 12 19.251 9.477 5.040 1.00 0.00 H new ATOM 0 HE ARG A 12 22.007 10.076 5.249 1.00 0.00 H new ATOM 0 HH11 ARG A 12 18.908 11.774 5.287 1.00 0.00 H new ATOM 0 HH12 ARG A 12 19.503 13.070 6.331 1.00 0.00 H new ATOM 0 HH21 ARG A 12 22.755 11.735 6.592 1.00 0.00 H new ATOM 0 HH22 ARG A 12 21.672 13.048 7.067 1.00 0.00 H new ATOM 186 N TYR A 13 19.478 5.022 4.387 1.00 0.00 N ATOM 187 CA TYR A 13 18.520 4.125 3.753 1.00 0.00 C ATOM 188 C TYR A 13 17.420 3.746 4.740 1.00 0.00 C ATOM 189 O TYR A 13 16.240 3.741 4.400 1.00 0.00 O ATOM 190 CB TYR A 13 19.236 2.868 3.242 1.00 0.00 C ATOM 191 CG TYR A 13 18.317 1.697 2.991 1.00 0.00 C ATOM 192 CD1 TYR A 13 18.406 0.550 3.768 1.00 0.00 C ATOM 193 CD2 TYR A 13 17.353 1.745 1.994 1.00 0.00 C ATOM 194 CE1 TYR A 13 17.560 -0.519 3.558 1.00 0.00 C ATOM 195 CE2 TYR A 13 16.504 0.679 1.776 1.00 0.00 C ATOM 196 CZ TYR A 13 16.609 -0.450 2.564 1.00 0.00 C ATOM 197 OH TYR A 13 15.763 -1.518 2.356 1.00 0.00 O ATOM 0 H TYR A 13 20.426 4.649 4.446 1.00 0.00 H new ATOM 0 HA TYR A 13 18.064 4.637 2.906 1.00 0.00 H new ATOM 0 HB2 TYR A 13 19.759 3.111 2.317 1.00 0.00 H new ATOM 0 HB3 TYR A 13 19.993 2.573 3.968 1.00 0.00 H new ATOM 0 HD1 TYR A 13 19.149 0.494 4.549 1.00 0.00 H new ATOM 0 HD2 TYR A 13 17.266 2.629 1.380 1.00 0.00 H new ATOM 0 HE1 TYR A 13 17.643 -1.405 4.170 1.00 0.00 H new ATOM 0 HE2 TYR A 13 15.761 0.728 0.993 1.00 0.00 H new ATOM 0 HH TYR A 13 14.906 -1.194 2.009 1.00 0.00 H new ATOM 207 N GLN A 14 17.827 3.437 5.959 1.00 0.00 N ATOM 208 CA GLN A 14 16.898 3.083 7.031 1.00 0.00 C ATOM 209 C GLN A 14 15.835 4.155 7.217 1.00 0.00 C ATOM 210 O GLN A 14 14.638 3.871 7.220 1.00 0.00 O ATOM 211 CB GLN A 14 17.664 2.899 8.333 1.00 0.00 C ATOM 212 CG GLN A 14 18.650 1.750 8.285 1.00 0.00 C ATOM 213 CD GLN A 14 17.972 0.412 8.071 1.00 0.00 C ATOM 214 OE1 GLN A 14 16.837 0.200 8.499 1.00 0.00 O ATOM 215 NE2 GLN A 14 18.658 -0.493 7.396 1.00 0.00 N ATOM 0 H GLN A 14 18.808 3.423 6.238 1.00 0.00 H new ATOM 0 HA GLN A 14 16.402 2.152 6.755 1.00 0.00 H new ATOM 0 HB2 GLN A 14 18.199 3.820 8.566 1.00 0.00 H new ATOM 0 HB3 GLN A 14 16.955 2.728 9.143 1.00 0.00 H new ATOM 0 HG2 GLN A 14 19.366 1.923 7.482 1.00 0.00 H new ATOM 0 HG3 GLN A 14 19.216 1.722 9.216 1.00 0.00 H new ATOM 0 HE21 GLN A 14 19.596 -0.275 7.059 1.00 0.00 H new ATOM 0 HE22 GLN A 14 18.250 -1.409 7.211 1.00 0.00 H new ATOM 224 N LYS A 15 16.282 5.383 7.395 1.00 0.00 N ATOM 225 CA LYS A 15 15.373 6.517 7.495 1.00 0.00 C ATOM 226 C LYS A 15 14.500 6.646 6.249 1.00 0.00 C ATOM 227 O LYS A 15 13.344 7.050 6.336 1.00 0.00 O ATOM 228 CB LYS A 15 16.141 7.818 7.722 1.00 0.00 C ATOM 229 CG LYS A 15 16.914 7.856 9.032 1.00 0.00 C ATOM 230 CD LYS A 15 15.995 7.842 10.237 1.00 0.00 C ATOM 231 CE LYS A 15 15.190 9.121 10.326 1.00 0.00 C ATOM 232 NZ LYS A 15 16.046 10.301 10.619 1.00 0.00 N ATOM 0 H LYS A 15 17.270 5.625 7.474 1.00 0.00 H new ATOM 0 HA LYS A 15 14.726 6.333 8.353 1.00 0.00 H new ATOM 0 HB2 LYS A 15 16.837 7.967 6.896 1.00 0.00 H new ATOM 0 HB3 LYS A 15 15.439 8.651 7.701 1.00 0.00 H new ATOM 0 HG2 LYS A 15 17.587 7.000 9.080 1.00 0.00 H new ATOM 0 HG3 LYS A 15 17.535 8.752 9.060 1.00 0.00 H new ATOM 0 HD2 LYS A 15 15.320 6.988 10.173 1.00 0.00 H new ATOM 0 HD3 LYS A 15 16.584 7.716 11.145 1.00 0.00 H new ATOM 0 HE2 LYS A 15 14.661 9.282 9.387 1.00 0.00 H new ATOM 0 HE3 LYS A 15 14.434 9.020 11.105 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 15.448 11.097 10.921 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 16.716 10.064 11.378 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 16.573 10.569 9.763 1.00 0.00 H new ATOM 246 N LEU A 16 15.051 6.287 5.098 1.00 0.00 N ATOM 247 CA LEU A 16 14.319 6.365 3.838 1.00 0.00 C ATOM 248 C LEU A 16 13.155 5.379 3.827 1.00 0.00 C ATOM 249 O LEU A 16 12.031 5.737 3.470 1.00 0.00 O ATOM 250 CB LEU A 16 15.257 6.095 2.660 1.00 0.00 C ATOM 251 CG LEU A 16 14.711 6.462 1.279 1.00 0.00 C ATOM 252 CD1 LEU A 16 14.145 7.874 1.285 1.00 0.00 C ATOM 253 CD2 LEU A 16 15.810 6.335 0.245 1.00 0.00 C ATOM 0 H LEU A 16 16.005 5.938 5.009 1.00 0.00 H new ATOM 0 HA LEU A 16 13.915 7.372 3.739 1.00 0.00 H new ATOM 0 HB2 LEU A 16 16.183 6.647 2.823 1.00 0.00 H new ATOM 0 HB3 LEU A 16 15.513 5.036 2.659 1.00 0.00 H new ATOM 0 HG LEU A 16 13.904 5.775 1.025 1.00 0.00 H new ATOM 0 HD11 LEU A 16 13.762 8.117 0.294 1.00 0.00 H new ATOM 0 HD12 LEU A 16 13.336 7.939 2.013 1.00 0.00 H new ATOM 0 HD13 LEU A 16 14.931 8.580 1.553 1.00 0.00 H new ATOM 0 HD21 LEU A 16 15.417 6.597 -0.737 1.00 0.00 H new ATOM 0 HD22 LEU A 16 16.629 7.008 0.500 1.00 0.00 H new ATOM 0 HD23 LEU A 16 16.176 5.308 0.227 1.00 0.00 H new ATOM 265 N VAL A 17 13.424 4.141 4.228 1.00 0.00 N ATOM 266 CA VAL A 17 12.368 3.136 4.331 1.00 0.00 C ATOM 267 C VAL A 17 11.380 3.560 5.400 1.00 0.00 C ATOM 268 O VAL A 17 10.184 3.319 5.287 1.00 0.00 O ATOM 269 CB VAL A 17 12.916 1.725 4.655 1.00 0.00 C ATOM 270 CG1 VAL A 17 14.226 1.514 3.941 1.00 0.00 C ATOM 271 CG2 VAL A 17 13.075 1.496 6.155 1.00 0.00 C ATOM 0 H VAL A 17 14.354 3.810 4.485 1.00 0.00 H new ATOM 0 HA VAL A 17 11.879 3.072 3.359 1.00 0.00 H new ATOM 0 HB VAL A 17 12.188 0.995 4.302 1.00 0.00 H new ATOM 0 HG11 VAL A 17 14.610 0.520 4.171 1.00 0.00 H new ATOM 0 HG12 VAL A 17 14.073 1.604 2.866 1.00 0.00 H new ATOM 0 HG13 VAL A 17 14.944 2.265 4.269 1.00 0.00 H new ATOM 0 HG21 VAL A 17 13.462 0.492 6.331 1.00 0.00 H new ATOM 0 HG22 VAL A 17 13.770 2.230 6.563 1.00 0.00 H new ATOM 0 HG23 VAL A 17 12.107 1.602 6.644 1.00 0.00 H new ATOM 281 N THR A 18 11.901 4.227 6.419 1.00 0.00 N ATOM 282 CA THR A 18 11.100 4.763 7.476 1.00 0.00 C ATOM 283 C THR A 18 10.086 5.745 6.906 1.00 0.00 C ATOM 284 O THR A 18 8.886 5.592 7.107 1.00 0.00 O ATOM 285 CB THR A 18 12.011 5.452 8.498 1.00 0.00 C ATOM 286 OG1 THR A 18 12.677 4.478 9.316 1.00 0.00 O ATOM 287 CG2 THR A 18 11.232 6.420 9.343 1.00 0.00 C ATOM 0 H THR A 18 12.900 4.405 6.524 1.00 0.00 H new ATOM 0 HA THR A 18 10.556 3.960 7.974 1.00 0.00 H new ATOM 0 HB THR A 18 12.769 6.017 7.955 1.00 0.00 H new ATOM 0 HG1 THR A 18 13.427 4.091 8.818 1.00 0.00 H new ATOM 0 HG21 THR A 18 11.900 6.896 10.060 1.00 0.00 H new ATOM 0 HG22 THR A 18 10.783 7.181 8.705 1.00 0.00 H new ATOM 0 HG23 THR A 18 10.447 5.886 9.878 1.00 0.00 H new ATOM 295 N GLU A 19 10.587 6.721 6.149 1.00 0.00 N ATOM 296 CA GLU A 19 9.745 7.712 5.490 1.00 0.00 C ATOM 297 C GLU A 19 8.650 7.039 4.681 1.00 0.00 C ATOM 298 O GLU A 19 7.525 7.533 4.597 1.00 0.00 O ATOM 299 CB GLU A 19 10.596 8.598 4.575 1.00 0.00 C ATOM 300 CG GLU A 19 11.607 9.434 5.341 1.00 0.00 C ATOM 301 CD GLU A 19 12.373 10.400 4.461 1.00 0.00 C ATOM 302 OE1 GLU A 19 11.814 11.465 4.110 1.00 0.00 O ATOM 303 OE2 GLU A 19 13.550 10.121 4.145 1.00 0.00 O ATOM 0 H GLU A 19 11.585 6.844 5.977 1.00 0.00 H new ATOM 0 HA GLU A 19 9.278 8.329 6.258 1.00 0.00 H new ATOM 0 HB2 GLU A 19 11.121 7.971 3.855 1.00 0.00 H new ATOM 0 HB3 GLU A 19 9.942 9.258 4.005 1.00 0.00 H new ATOM 0 HG2 GLU A 19 11.090 9.994 6.120 1.00 0.00 H new ATOM 0 HG3 GLU A 19 12.313 8.771 5.841 1.00 0.00 H new ATOM 310 N ASN A 20 8.994 5.894 4.116 1.00 0.00 N ATOM 311 CA ASN A 20 8.091 5.145 3.262 1.00 0.00 C ATOM 312 C ASN A 20 7.051 4.370 4.057 1.00 0.00 C ATOM 313 O ASN A 20 5.860 4.532 3.832 1.00 0.00 O ATOM 314 CB ASN A 20 8.887 4.205 2.367 1.00 0.00 C ATOM 315 CG ASN A 20 9.352 4.896 1.109 1.00 0.00 C ATOM 316 OD1 ASN A 20 8.696 4.823 0.079 1.00 0.00 O ATOM 317 ND2 ASN A 20 10.470 5.597 1.192 1.00 0.00 N ATOM 0 H ASN A 20 9.908 5.458 4.237 1.00 0.00 H new ATOM 0 HA ASN A 20 7.549 5.863 2.647 1.00 0.00 H new ATOM 0 HB2 ASN A 20 9.750 3.825 2.914 1.00 0.00 H new ATOM 0 HB3 ASN A 20 8.272 3.344 2.104 1.00 0.00 H new ATOM 0 HD21 ASN A 20 10.816 6.104 0.377 1.00 0.00 H new ATOM 0 HD22 ASN A 20 10.987 5.631 2.071 1.00 0.00 H new ATOM 324 N GLU A 21 7.484 3.539 4.992 1.00 0.00 N ATOM 325 CA GLU A 21 6.558 2.708 5.751 1.00 0.00 C ATOM 326 C GLU A 21 5.487 3.549 6.444 1.00 0.00 C ATOM 327 O GLU A 21 4.362 3.087 6.650 1.00 0.00 O ATOM 328 CB GLU A 21 7.329 1.901 6.784 1.00 0.00 C ATOM 329 CG GLU A 21 8.417 1.052 6.168 1.00 0.00 C ATOM 330 CD GLU A 21 7.904 -0.256 5.603 1.00 0.00 C ATOM 331 OE1 GLU A 21 8.106 -0.507 4.399 1.00 0.00 O ATOM 332 OE2 GLU A 21 7.308 -1.049 6.365 1.00 0.00 O ATOM 0 H GLU A 21 8.465 3.421 5.244 1.00 0.00 H new ATOM 0 HA GLU A 21 6.056 2.037 5.055 1.00 0.00 H new ATOM 0 HB2 GLU A 21 7.772 2.580 7.512 1.00 0.00 H new ATOM 0 HB3 GLU A 21 6.636 1.258 7.328 1.00 0.00 H new ATOM 0 HG2 GLU A 21 8.904 1.617 5.374 1.00 0.00 H new ATOM 0 HG3 GLU A 21 9.176 0.842 6.922 1.00 0.00 H new ATOM 339 N GLN A 22 5.840 4.781 6.805 1.00 0.00 N ATOM 340 CA GLN A 22 4.885 5.698 7.426 1.00 0.00 C ATOM 341 C GLN A 22 3.717 5.965 6.493 1.00 0.00 C ATOM 342 O GLN A 22 2.579 5.587 6.773 1.00 0.00 O ATOM 343 CB GLN A 22 5.529 7.041 7.766 1.00 0.00 C ATOM 344 CG GLN A 22 6.831 6.939 8.545 1.00 0.00 C ATOM 345 CD GLN A 22 7.332 8.285 9.024 1.00 0.00 C ATOM 346 OE1 GLN A 22 7.100 9.314 8.384 1.00 0.00 O ATOM 347 NE2 GLN A 22 8.020 8.289 10.154 1.00 0.00 N ATOM 0 H GLN A 22 6.776 5.167 6.679 1.00 0.00 H new ATOM 0 HA GLN A 22 4.542 5.218 8.342 1.00 0.00 H new ATOM 0 HB2 GLN A 22 5.717 7.584 6.840 1.00 0.00 H new ATOM 0 HB3 GLN A 22 4.820 7.633 8.345 1.00 0.00 H new ATOM 0 HG2 GLN A 22 6.686 6.283 9.404 1.00 0.00 H new ATOM 0 HG3 GLN A 22 7.591 6.476 7.916 1.00 0.00 H new ATOM 0 HE21 GLN A 22 8.189 7.415 10.651 1.00 0.00 H new ATOM 0 HE22 GLN A 22 8.382 9.166 10.528 1.00 0.00 H new ATOM 356 N LEU A 23 4.007 6.606 5.368 1.00 0.00 N ATOM 357 CA LEU A 23 2.959 7.065 4.482 1.00 0.00 C ATOM 358 C LEU A 23 2.378 5.908 3.673 1.00 0.00 C ATOM 359 O LEU A 23 1.273 6.011 3.154 1.00 0.00 O ATOM 360 CB LEU A 23 3.454 8.236 3.611 1.00 0.00 C ATOM 361 CG LEU A 23 4.195 7.917 2.308 1.00 0.00 C ATOM 362 CD1 LEU A 23 4.648 9.204 1.649 1.00 0.00 C ATOM 363 CD2 LEU A 23 5.388 7.021 2.535 1.00 0.00 C ATOM 0 H LEU A 23 4.954 6.816 5.054 1.00 0.00 H new ATOM 0 HA LEU A 23 2.136 7.455 5.080 1.00 0.00 H new ATOM 0 HB2 LEU A 23 2.589 8.850 3.359 1.00 0.00 H new ATOM 0 HB3 LEU A 23 4.113 8.850 4.225 1.00 0.00 H new ATOM 0 HG LEU A 23 3.500 7.385 1.659 1.00 0.00 H new ATOM 0 HD11 LEU A 23 5.174 8.973 0.723 1.00 0.00 H new ATOM 0 HD12 LEU A 23 3.780 9.825 1.428 1.00 0.00 H new ATOM 0 HD13 LEU A 23 5.316 9.742 2.322 1.00 0.00 H new ATOM 0 HD21 LEU A 23 5.881 6.823 1.583 1.00 0.00 H new ATOM 0 HD22 LEU A 23 6.088 7.512 3.211 1.00 0.00 H new ATOM 0 HD23 LEU A 23 5.058 6.080 2.975 1.00 0.00 H new ATOM 375 N GLN A 24 3.118 4.801 3.594 1.00 0.00 N ATOM 376 CA GLN A 24 2.579 3.540 3.082 1.00 0.00 C ATOM 377 C GLN A 24 1.285 3.187 3.806 1.00 0.00 C ATOM 378 O GLN A 24 0.273 2.844 3.188 1.00 0.00 O ATOM 379 CB GLN A 24 3.579 2.405 3.297 1.00 0.00 C ATOM 380 CG GLN A 24 4.697 2.334 2.291 1.00 0.00 C ATOM 381 CD GLN A 24 5.499 1.061 2.439 1.00 0.00 C ATOM 382 OE1 GLN A 24 4.984 0.027 2.867 1.00 0.00 O ATOM 383 NE2 GLN A 24 6.758 1.129 2.078 1.00 0.00 N ATOM 0 H GLN A 24 4.096 4.752 3.879 1.00 0.00 H new ATOM 0 HA GLN A 24 2.387 3.665 2.016 1.00 0.00 H new ATOM 0 HB2 GLN A 24 4.013 2.509 4.291 1.00 0.00 H new ATOM 0 HB3 GLN A 24 3.038 1.459 3.282 1.00 0.00 H new ATOM 0 HG2 GLN A 24 4.285 2.390 1.284 1.00 0.00 H new ATOM 0 HG3 GLN A 24 5.354 3.195 2.415 1.00 0.00 H new ATOM 0 HE21 GLN A 24 7.142 2.007 1.729 1.00 0.00 H new ATOM 0 HE22 GLN A 24 7.353 0.304 2.146 1.00 0.00 H new ATOM 392 N ARG A 25 1.342 3.293 5.127 1.00 0.00 N ATOM 393 CA ARG A 25 0.219 3.007 5.993 1.00 0.00 C ATOM 394 C ARG A 25 -0.878 4.046 5.792 1.00 0.00 C ATOM 395 O ARG A 25 -2.051 3.709 5.647 1.00 0.00 O ATOM 396 CB ARG A 25 0.719 3.013 7.440 1.00 0.00 C ATOM 397 CG ARG A 25 -0.266 3.598 8.428 1.00 0.00 C ATOM 398 CD ARG A 25 0.429 4.069 9.695 1.00 0.00 C ATOM 399 NE ARG A 25 1.266 3.022 10.284 1.00 0.00 N ATOM 400 CZ ARG A 25 1.907 3.143 11.446 1.00 0.00 C ATOM 401 NH1 ARG A 25 1.824 4.269 12.144 1.00 0.00 N ATOM 402 NH2 ARG A 25 2.636 2.135 11.908 1.00 0.00 N ATOM 0 H ARG A 25 2.182 3.584 5.628 1.00 0.00 H new ATOM 0 HA ARG A 25 -0.204 2.031 5.756 1.00 0.00 H new ATOM 0 HB2 ARG A 25 0.953 1.991 7.737 1.00 0.00 H new ATOM 0 HB3 ARG A 25 1.649 3.580 7.490 1.00 0.00 H new ATOM 0 HG2 ARG A 25 -0.791 4.435 7.967 1.00 0.00 H new ATOM 0 HG3 ARG A 25 -1.017 2.850 8.681 1.00 0.00 H new ATOM 0 HD2 ARG A 25 1.044 4.940 9.469 1.00 0.00 H new ATOM 0 HD3 ARG A 25 -0.319 4.387 10.422 1.00 0.00 H new ATOM 0 HE ARG A 25 1.365 2.145 9.773 1.00 0.00 H new ATOM 0 HH11 ARG A 25 1.267 5.048 11.792 1.00 0.00 H new ATOM 0 HH12 ARG A 25 2.317 4.356 13.033 1.00 0.00 H new ATOM 0 HH21 ARG A 25 2.705 1.269 11.374 1.00 0.00 H new ATOM 0 HH22 ARG A 25 3.127 2.226 12.797 1.00 0.00 H new ATOM 416 N LEU A 26 -0.470 5.309 5.760 1.00 0.00 N ATOM 417 CA LEU A 26 -1.393 6.425 5.602 1.00 0.00 C ATOM 418 C LEU A 26 -2.171 6.303 4.297 1.00 0.00 C ATOM 419 O LEU A 26 -3.328 6.716 4.206 1.00 0.00 O ATOM 420 CB LEU A 26 -0.606 7.734 5.662 1.00 0.00 C ATOM 421 CG LEU A 26 0.179 7.923 6.968 1.00 0.00 C ATOM 422 CD1 LEU A 26 1.112 9.119 6.891 1.00 0.00 C ATOM 423 CD2 LEU A 26 -0.775 8.072 8.145 1.00 0.00 C ATOM 0 H LEU A 26 0.508 5.587 5.843 1.00 0.00 H new ATOM 0 HA LEU A 26 -2.122 6.413 6.412 1.00 0.00 H new ATOM 0 HB2 LEU A 26 0.089 7.769 4.823 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -1.296 8.569 5.539 1.00 0.00 H new ATOM 0 HG LEU A 26 0.790 7.033 7.118 1.00 0.00 H new ATOM 0 HD11 LEU A 26 1.651 9.221 7.833 1.00 0.00 H new ATOM 0 HD12 LEU A 26 1.825 8.973 6.079 1.00 0.00 H new ATOM 0 HD13 LEU A 26 0.531 10.022 6.705 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -0.202 8.205 9.063 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -1.415 8.940 7.987 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -1.392 7.177 8.229 1.00 0.00 H new ATOM 435 N ILE A 27 -1.527 5.724 3.295 1.00 0.00 N ATOM 436 CA ILE A 27 -2.182 5.417 2.034 1.00 0.00 C ATOM 437 C ILE A 27 -3.199 4.304 2.216 1.00 0.00 C ATOM 438 O ILE A 27 -4.375 4.482 1.911 1.00 0.00 O ATOM 439 CB ILE A 27 -1.164 4.979 0.968 1.00 0.00 C ATOM 440 CG1 ILE A 27 -0.244 6.134 0.611 1.00 0.00 C ATOM 441 CG2 ILE A 27 -1.862 4.451 -0.277 1.00 0.00 C ATOM 442 CD1 ILE A 27 0.823 5.734 -0.368 1.00 0.00 C ATOM 0 H ILE A 27 -0.544 5.456 3.333 1.00 0.00 H new ATOM 0 HA ILE A 27 -2.682 6.327 1.702 1.00 0.00 H new ATOM 0 HB ILE A 27 -0.566 4.169 1.386 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -0.834 6.948 0.189 1.00 0.00 H new ATOM 0 HG13 ILE A 27 0.224 6.516 1.518 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -1.116 4.149 -1.012 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -2.478 3.592 -0.012 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -2.493 5.233 -0.700 1.00 0.00 H new ATOM 0 HD11 ILE A 27 1.454 6.595 -0.590 1.00 0.00 H new ATOM 0 HD12 ILE A 27 1.432 4.939 0.062 1.00 0.00 H new ATOM 0 HD13 ILE A 27 0.358 5.378 -1.287 1.00 0.00 H new ATOM 454 N THR A 28 -2.730 3.165 2.724 1.00 0.00 N ATOM 455 CA THR A 28 -3.563 1.971 2.865 1.00 0.00 C ATOM 456 C THR A 28 -4.867 2.280 3.611 1.00 0.00 C ATOM 457 O THR A 28 -5.918 1.742 3.270 1.00 0.00 O ATOM 458 CB THR A 28 -2.794 0.813 3.567 1.00 0.00 C ATOM 459 OG1 THR A 28 -3.208 -0.449 3.029 1.00 0.00 O ATOM 460 CG2 THR A 28 -3.025 0.801 5.074 1.00 0.00 C ATOM 0 H THR A 28 -1.770 3.044 3.047 1.00 0.00 H new ATOM 0 HA THR A 28 -3.818 1.642 1.858 1.00 0.00 H new ATOM 0 HB THR A 28 -1.732 0.978 3.383 1.00 0.00 H new ATOM 0 HG1 THR A 28 -2.718 -1.171 3.475 1.00 0.00 H new ATOM 0 HG21 THR A 28 -2.469 -0.023 5.521 1.00 0.00 H new ATOM 0 HG22 THR A 28 -2.683 1.743 5.502 1.00 0.00 H new ATOM 0 HG23 THR A 28 -4.088 0.674 5.278 1.00 0.00 H new ATOM 468 N GLN A 29 -4.793 3.173 4.602 1.00 0.00 N ATOM 469 CA GLN A 29 -5.964 3.575 5.377 1.00 0.00 C ATOM 470 C GLN A 29 -7.030 4.157 4.471 1.00 0.00 C ATOM 471 O GLN A 29 -8.183 3.731 4.476 1.00 0.00 O ATOM 472 CB GLN A 29 -5.577 4.632 6.408 1.00 0.00 C ATOM 473 CG GLN A 29 -4.528 4.171 7.397 1.00 0.00 C ATOM 474 CD GLN A 29 -5.072 3.200 8.427 1.00 0.00 C ATOM 475 OE1 GLN A 29 -6.019 2.457 8.164 1.00 0.00 O ATOM 476 NE2 GLN A 29 -4.479 3.200 9.608 1.00 0.00 N ATOM 0 H GLN A 29 -3.927 3.632 4.886 1.00 0.00 H new ATOM 0 HA GLN A 29 -6.353 2.689 5.878 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -5.207 5.515 5.887 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -6.470 4.935 6.955 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -3.709 3.697 6.856 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -4.112 5.039 7.908 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -3.698 3.831 9.786 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -4.803 2.569 10.341 1.00 0.00 H new ATOM 485 N LYS A 30 -6.626 5.149 3.706 1.00 0.00 N ATOM 486 CA LYS A 30 -7.538 5.832 2.807 1.00 0.00 C ATOM 487 C LYS A 30 -7.913 4.929 1.634 1.00 0.00 C ATOM 488 O LYS A 30 -9.061 4.923 1.192 1.00 0.00 O ATOM 489 CB LYS A 30 -6.909 7.131 2.305 1.00 0.00 C ATOM 490 CG LYS A 30 -6.260 7.963 3.404 1.00 0.00 C ATOM 491 CD LYS A 30 -7.190 8.162 4.598 1.00 0.00 C ATOM 492 CE LYS A 30 -6.550 9.037 5.664 1.00 0.00 C ATOM 493 NZ LYS A 30 -6.192 10.385 5.143 1.00 0.00 N ATOM 0 H LYS A 30 -5.669 5.503 3.687 1.00 0.00 H new ATOM 0 HA LYS A 30 -8.449 6.075 3.354 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -6.159 6.893 1.551 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -7.676 7.729 1.814 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -5.344 7.474 3.736 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -5.974 8.935 3.002 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -8.122 8.618 4.263 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -7.446 7.193 5.027 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -7.236 9.144 6.504 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -5.654 8.547 6.045 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -6.265 11.084 5.910 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -5.218 10.369 4.780 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -6.843 10.645 4.375 1.00 0.00 H new ATOM 507 N GLU A 31 -6.941 4.158 1.154 1.00 0.00 N ATOM 508 CA GLU A 31 -7.153 3.223 0.050 1.00 0.00 C ATOM 509 C GLU A 31 -8.351 2.320 0.306 1.00 0.00 C ATOM 510 O GLU A 31 -9.335 2.370 -0.432 1.00 0.00 O ATOM 511 CB GLU A 31 -5.905 2.367 -0.169 1.00 0.00 C ATOM 512 CG GLU A 31 -4.881 2.995 -1.100 1.00 0.00 C ATOM 513 CD GLU A 31 -5.298 2.923 -2.553 1.00 0.00 C ATOM 514 OE1 GLU A 31 -5.310 1.807 -3.120 1.00 0.00 O ATOM 515 OE2 GLU A 31 -5.613 3.975 -3.140 1.00 0.00 O ATOM 0 H GLU A 31 -5.988 4.163 1.517 1.00 0.00 H new ATOM 0 HA GLU A 31 -7.353 3.812 -0.845 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -5.435 2.175 0.795 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -6.206 1.401 -0.575 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -4.731 4.038 -0.820 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -3.923 2.490 -0.975 1.00 0.00 H new ATOM 522 N GLU A 32 -8.270 1.520 1.366 1.00 0.00 N ATOM 523 CA GLU A 32 -9.305 0.535 1.670 1.00 0.00 C ATOM 524 C GLU A 32 -10.689 1.181 1.769 1.00 0.00 C ATOM 525 O GLU A 32 -11.676 0.620 1.289 1.00 0.00 O ATOM 526 CB GLU A 32 -8.967 -0.228 2.961 1.00 0.00 C ATOM 527 CG GLU A 32 -8.578 0.664 4.132 1.00 0.00 C ATOM 528 CD GLU A 32 -8.428 -0.098 5.431 1.00 0.00 C ATOM 529 OE1 GLU A 32 -7.308 -0.545 5.748 1.00 0.00 O ATOM 530 OE2 GLU A 32 -9.436 -0.247 6.153 1.00 0.00 O ATOM 0 H GLU A 32 -7.496 1.535 2.031 1.00 0.00 H new ATOM 0 HA GLU A 32 -9.334 -0.176 0.845 1.00 0.00 H new ATOM 0 HB2 GLU A 32 -9.828 -0.831 3.249 1.00 0.00 H new ATOM 0 HB3 GLU A 32 -8.148 -0.918 2.758 1.00 0.00 H new ATOM 0 HG2 GLU A 32 -7.639 1.167 3.902 1.00 0.00 H new ATOM 0 HG3 GLU A 32 -9.333 1.440 4.257 1.00 0.00 H new ATOM 537 N LYS A 33 -10.750 2.373 2.353 1.00 0.00 N ATOM 538 CA LYS A 33 -12.021 3.059 2.557 1.00 0.00 C ATOM 539 C LYS A 33 -12.573 3.625 1.251 1.00 0.00 C ATOM 540 O LYS A 33 -13.766 3.500 0.967 1.00 0.00 O ATOM 541 CB LYS A 33 -11.864 4.176 3.588 1.00 0.00 C ATOM 542 CG LYS A 33 -11.406 3.679 4.947 1.00 0.00 C ATOM 543 CD LYS A 33 -11.367 4.801 5.968 1.00 0.00 C ATOM 544 CE LYS A 33 -10.891 4.306 7.323 1.00 0.00 C ATOM 545 NZ LYS A 33 -11.757 3.223 7.856 1.00 0.00 N ATOM 0 H LYS A 33 -9.935 2.884 2.693 1.00 0.00 H new ATOM 0 HA LYS A 33 -12.734 2.324 2.930 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -11.146 4.907 3.215 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -12.817 4.694 3.700 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -12.078 2.894 5.294 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -10.415 3.233 4.857 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -10.705 5.592 5.616 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -12.361 5.238 6.068 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -9.867 3.942 7.237 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -10.875 5.137 8.028 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -11.550 3.078 8.865 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -12.756 3.489 7.742 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -11.572 2.342 7.335 1.00 0.00 H new ATOM 559 N ILE A 34 -11.706 4.235 0.452 1.00 0.00 N ATOM 560 CA ILE A 34 -12.122 4.822 -0.820 1.00 0.00 C ATOM 561 C ILE A 34 -12.597 3.742 -1.789 1.00 0.00 C ATOM 562 O ILE A 34 -13.461 3.985 -2.625 1.00 0.00 O ATOM 563 CB ILE A 34 -10.987 5.651 -1.467 1.00 0.00 C ATOM 564 CG1 ILE A 34 -10.709 6.891 -0.624 1.00 0.00 C ATOM 565 CG2 ILE A 34 -11.352 6.055 -2.889 1.00 0.00 C ATOM 566 CD1 ILE A 34 -9.322 7.465 -0.830 1.00 0.00 C ATOM 0 H ILE A 34 -10.713 4.337 0.660 1.00 0.00 H new ATOM 0 HA ILE A 34 -12.952 5.495 -0.606 1.00 0.00 H new ATOM 0 HB ILE A 34 -10.089 5.035 -1.509 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -11.449 7.655 -0.862 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -10.837 6.641 0.429 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -10.538 6.637 -3.322 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -11.519 5.161 -3.490 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -12.261 6.657 -2.874 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -9.195 8.345 -0.199 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -8.575 6.717 -0.564 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -9.197 7.747 -1.875 1.00 0.00 H new ATOM 578 N ARG A 35 -12.047 2.542 -1.655 1.00 0.00 N ATOM 579 CA ARG A 35 -12.456 1.414 -2.488 1.00 0.00 C ATOM 580 C ARG A 35 -13.921 1.083 -2.250 1.00 0.00 C ATOM 581 O ARG A 35 -14.650 0.714 -3.170 1.00 0.00 O ATOM 582 CB ARG A 35 -11.584 0.201 -2.194 1.00 0.00 C ATOM 583 CG ARG A 35 -10.122 0.438 -2.526 1.00 0.00 C ATOM 584 CD ARG A 35 -9.250 -0.753 -2.173 1.00 0.00 C ATOM 585 NE ARG A 35 -7.834 -0.454 -2.381 1.00 0.00 N ATOM 586 CZ ARG A 35 -6.836 -1.144 -1.834 1.00 0.00 C ATOM 587 NH1 ARG A 35 -7.090 -2.215 -1.090 1.00 0.00 N ATOM 588 NH2 ARG A 35 -5.582 -0.762 -2.039 1.00 0.00 N ATOM 0 H ARG A 35 -11.316 2.323 -0.978 1.00 0.00 H new ATOM 0 HA ARG A 35 -12.330 1.690 -3.535 1.00 0.00 H new ATOM 0 HB2 ARG A 35 -11.675 -0.060 -1.140 1.00 0.00 H new ATOM 0 HB3 ARG A 35 -11.949 -0.652 -2.767 1.00 0.00 H new ATOM 0 HG2 ARG A 35 -10.024 0.654 -3.590 1.00 0.00 H new ATOM 0 HG3 ARG A 35 -9.768 1.317 -1.988 1.00 0.00 H new ATOM 0 HD2 ARG A 35 -9.416 -1.032 -1.133 1.00 0.00 H new ATOM 0 HD3 ARG A 35 -9.537 -1.610 -2.783 1.00 0.00 H new ATOM 0 HE ARG A 35 -7.596 0.334 -2.984 1.00 0.00 H new ATOM 0 HH11 ARG A 35 -8.054 -2.512 -0.936 1.00 0.00 H new ATOM 0 HH12 ARG A 35 -6.321 -2.740 -0.673 1.00 0.00 H new ATOM 0 HH21 ARG A 35 -5.386 0.057 -2.614 1.00 0.00 H new ATOM 0 HH22 ARG A 35 -4.814 -1.288 -1.622 1.00 0.00 H new ATOM 602 N VAL A 36 -14.346 1.244 -1.010 1.00 0.00 N ATOM 603 CA VAL A 36 -15.736 1.045 -0.640 1.00 0.00 C ATOM 604 C VAL A 36 -16.589 2.170 -1.215 1.00 0.00 C ATOM 605 O VAL A 36 -17.735 1.970 -1.614 1.00 0.00 O ATOM 606 CB VAL A 36 -15.884 1.013 0.889 1.00 0.00 C ATOM 607 CG1 VAL A 36 -17.282 0.570 1.293 1.00 0.00 C ATOM 608 CG2 VAL A 36 -14.823 0.107 1.492 1.00 0.00 C ATOM 0 H VAL A 36 -13.741 1.515 -0.235 1.00 0.00 H new ATOM 0 HA VAL A 36 -16.073 0.091 -1.046 1.00 0.00 H new ATOM 0 HB VAL A 36 -15.739 2.021 1.276 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -17.359 0.556 2.380 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -18.016 1.265 0.886 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -17.474 -0.430 0.903 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -14.934 0.089 2.576 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -14.940 -0.903 1.098 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -13.833 0.484 1.234 1.00 0.00 H new ATOM 618 N LEU A 37 -16.002 3.356 -1.268 1.00 0.00 N ATOM 619 CA LEU A 37 -16.655 4.514 -1.861 1.00 0.00 C ATOM 620 C LEU A 37 -16.726 4.378 -3.367 1.00 0.00 C ATOM 621 O LEU A 37 -17.616 4.929 -4.005 1.00 0.00 O ATOM 622 CB LEU A 37 -15.916 5.792 -1.484 1.00 0.00 C ATOM 623 CG LEU A 37 -16.602 6.624 -0.408 1.00 0.00 C ATOM 624 CD1 LEU A 37 -17.803 7.353 -0.995 1.00 0.00 C ATOM 625 CD2 LEU A 37 -17.029 5.724 0.742 1.00 0.00 C ATOM 0 H LEU A 37 -15.067 3.543 -0.905 1.00 0.00 H new ATOM 0 HA LEU A 37 -17.672 4.567 -1.471 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -14.915 5.530 -1.140 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -15.796 6.404 -2.378 1.00 0.00 H new ATOM 0 HG LEU A 37 -15.902 7.369 -0.028 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -18.286 7.944 -0.217 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -17.472 8.011 -1.798 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -18.512 6.626 -1.390 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -17.519 6.323 1.510 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -17.722 4.968 0.374 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -16.152 5.236 1.167 1.00 0.00 H new ATOM 637 N ARG A 38 -15.781 3.645 -3.925 1.00 0.00 N ATOM 638 CA ARG A 38 -15.795 3.341 -5.350 1.00 0.00 C ATOM 639 C ARG A 38 -17.037 2.533 -5.685 1.00 0.00 C ATOM 640 O ARG A 38 -17.635 2.710 -6.738 1.00 0.00 O ATOM 641 CB ARG A 38 -14.539 2.582 -5.776 1.00 0.00 C ATOM 642 CG ARG A 38 -13.272 3.417 -5.704 1.00 0.00 C ATOM 643 CD ARG A 38 -12.065 2.640 -6.197 1.00 0.00 C ATOM 644 NE ARG A 38 -12.180 2.285 -7.612 1.00 0.00 N ATOM 645 CZ ARG A 38 -11.349 1.451 -8.240 1.00 0.00 C ATOM 646 NH1 ARG A 38 -10.345 0.889 -7.578 1.00 0.00 N ATOM 647 NH2 ARG A 38 -11.525 1.173 -9.527 1.00 0.00 N ATOM 0 H ARG A 38 -14.992 3.247 -3.416 1.00 0.00 H new ATOM 0 HA ARG A 38 -15.811 4.282 -5.899 1.00 0.00 H new ATOM 0 HB2 ARG A 38 -14.422 1.704 -5.141 1.00 0.00 H new ATOM 0 HB3 ARG A 38 -14.670 2.223 -6.797 1.00 0.00 H new ATOM 0 HG2 ARG A 38 -13.395 4.319 -6.303 1.00 0.00 H new ATOM 0 HG3 ARG A 38 -13.104 3.738 -4.676 1.00 0.00 H new ATOM 0 HD2 ARG A 38 -11.164 3.235 -6.045 1.00 0.00 H new ATOM 0 HD3 ARG A 38 -11.951 1.733 -5.604 1.00 0.00 H new ATOM 0 HE ARG A 38 -12.941 2.700 -8.150 1.00 0.00 H new ATOM 0 HH11 ARG A 38 -10.208 1.095 -6.588 1.00 0.00 H new ATOM 0 HH12 ARG A 38 -9.710 0.252 -8.059 1.00 0.00 H new ATOM 0 HH21 ARG A 38 -12.298 1.598 -10.039 1.00 0.00 H new ATOM 0 HH22 ARG A 38 -10.887 0.535 -10.003 1.00 0.00 H new ATOM 661 N GLN A 39 -17.429 1.661 -4.764 1.00 0.00 N ATOM 662 CA GLN A 39 -18.663 0.903 -4.902 1.00 0.00 C ATOM 663 C GLN A 39 -19.866 1.841 -4.920 1.00 0.00 C ATOM 664 O GLN A 39 -20.840 1.603 -5.632 1.00 0.00 O ATOM 665 CB GLN A 39 -18.795 -0.091 -3.753 1.00 0.00 C ATOM 666 CG GLN A 39 -17.570 -0.968 -3.565 1.00 0.00 C ATOM 667 CD GLN A 39 -17.347 -1.944 -4.705 1.00 0.00 C ATOM 668 OE1 GLN A 39 -16.212 -2.312 -5.004 1.00 0.00 O ATOM 669 NE2 GLN A 39 -18.423 -2.378 -5.344 1.00 0.00 N ATOM 0 H GLN A 39 -16.907 1.462 -3.911 1.00 0.00 H new ATOM 0 HA GLN A 39 -18.633 0.357 -5.845 1.00 0.00 H new ATOM 0 HB2 GLN A 39 -18.985 0.457 -2.830 1.00 0.00 H new ATOM 0 HB3 GLN A 39 -19.663 -0.726 -3.931 1.00 0.00 H new ATOM 0 HG2 GLN A 39 -16.690 -0.333 -3.463 1.00 0.00 H new ATOM 0 HG3 GLN A 39 -17.671 -1.525 -2.634 1.00 0.00 H new ATOM 0 HE21 GLN A 39 -19.348 -2.050 -5.067 1.00 0.00 H new ATOM 0 HE22 GLN A 39 -18.327 -3.041 -6.113 1.00 0.00 H new ATOM 678 N ARG A 40 -19.790 2.906 -4.125 1.00 0.00 N ATOM 679 CA ARG A 40 -20.798 3.957 -4.152 1.00 0.00 C ATOM 680 C ARG A 40 -20.786 4.659 -5.499 1.00 0.00 C ATOM 681 O ARG A 40 -21.835 4.988 -6.048 1.00 0.00 O ATOM 682 CB ARG A 40 -20.548 4.983 -3.044 1.00 0.00 C ATOM 683 CG ARG A 40 -21.259 4.697 -1.729 1.00 0.00 C ATOM 684 CD ARG A 40 -20.784 3.408 -1.083 1.00 0.00 C ATOM 685 NE ARG A 40 -21.440 2.228 -1.649 1.00 0.00 N ATOM 686 CZ ARG A 40 -21.181 0.982 -1.261 1.00 0.00 C ATOM 687 NH1 ARG A 40 -20.314 0.758 -0.284 1.00 0.00 N ATOM 688 NH2 ARG A 40 -21.806 -0.037 -1.837 1.00 0.00 N ATOM 0 H ARG A 40 -19.038 3.062 -3.454 1.00 0.00 H new ATOM 0 HA ARG A 40 -21.771 3.494 -3.989 1.00 0.00 H new ATOM 0 HB2 ARG A 40 -19.476 5.038 -2.855 1.00 0.00 H new ATOM 0 HB3 ARG A 40 -20.859 5.965 -3.402 1.00 0.00 H new ATOM 0 HG2 ARG A 40 -21.094 5.527 -1.042 1.00 0.00 H new ATOM 0 HG3 ARG A 40 -22.333 4.638 -1.905 1.00 0.00 H new ATOM 0 HD2 ARG A 40 -19.705 3.317 -1.210 1.00 0.00 H new ATOM 0 HD3 ARG A 40 -20.977 3.449 -0.011 1.00 0.00 H new ATOM 0 HE ARG A 40 -22.135 2.369 -2.382 1.00 0.00 H new ATOM 0 HH11 ARG A 40 -19.845 1.541 0.171 1.00 0.00 H new ATOM 0 HH12 ARG A 40 -20.116 -0.198 0.013 1.00 0.00 H new ATOM 0 HH21 ARG A 40 -22.486 0.135 -2.578 1.00 0.00 H new ATOM 0 HH22 ARG A 40 -21.607 -0.992 -1.539 1.00 0.00 H new ATOM 702 N LEU A 41 -19.591 4.882 -6.032 1.00 0.00 N ATOM 703 CA LEU A 41 -19.449 5.524 -7.329 1.00 0.00 C ATOM 704 C LEU A 41 -20.004 4.620 -8.417 1.00 0.00 C ATOM 705 O LEU A 41 -20.546 5.099 -9.404 1.00 0.00 O ATOM 706 CB LEU A 41 -17.994 5.853 -7.639 1.00 0.00 C ATOM 707 CG LEU A 41 -17.182 6.465 -6.497 1.00 0.00 C ATOM 708 CD1 LEU A 41 -15.745 6.687 -6.935 1.00 0.00 C ATOM 709 CD2 LEU A 41 -17.799 7.772 -6.024 1.00 0.00 C ATOM 0 H LEU A 41 -18.710 4.628 -5.586 1.00 0.00 H new ATOM 0 HA LEU A 41 -20.009 6.458 -7.298 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -17.497 4.938 -7.961 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -17.971 6.542 -8.483 1.00 0.00 H new ATOM 0 HG LEU A 41 -17.193 5.766 -5.661 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -15.177 7.123 -6.113 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -15.299 5.733 -7.218 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -15.725 7.364 -7.789 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -17.200 8.184 -5.212 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -17.826 8.482 -6.851 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -18.813 7.588 -5.670 1.00 0.00 H new ATOM 721 N VAL A 42 -19.851 3.311 -8.230 1.00 0.00 N ATOM 722 CA VAL A 42 -20.483 2.321 -9.098 1.00 0.00 C ATOM 723 C VAL A 42 -21.984 2.577 -9.162 1.00 0.00 C ATOM 724 O VAL A 42 -22.591 2.575 -10.234 1.00 0.00 O ATOM 725 CB VAL A 42 -20.245 0.886 -8.574 1.00 0.00 C ATOM 726 CG1 VAL A 42 -21.053 -0.125 -9.368 1.00 0.00 C ATOM 727 CG2 VAL A 42 -18.766 0.535 -8.604 1.00 0.00 C ATOM 0 H VAL A 42 -19.290 2.909 -7.479 1.00 0.00 H new ATOM 0 HA VAL A 42 -20.040 2.413 -10.090 1.00 0.00 H new ATOM 0 HB VAL A 42 -20.582 0.849 -7.538 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -20.867 -1.126 -8.979 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -22.114 0.107 -9.280 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -20.759 -0.083 -10.417 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -18.625 -0.479 -8.231 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -18.398 0.599 -9.628 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -18.214 1.233 -7.975 1.00 0.00 H new ATOM 737 N GLU A 43 -22.556 2.826 -7.992 1.00 0.00 N ATOM 738 CA GLU A 43 -23.979 3.092 -7.854 1.00 0.00 C ATOM 739 C GLU A 43 -24.353 4.455 -8.438 1.00 0.00 C ATOM 740 O GLU A 43 -25.533 4.765 -8.611 1.00 0.00 O ATOM 741 CB GLU A 43 -24.365 3.036 -6.376 1.00 0.00 C ATOM 742 CG GLU A 43 -23.968 1.736 -5.697 1.00 0.00 C ATOM 743 CD GLU A 43 -24.324 1.711 -4.226 1.00 0.00 C ATOM 744 OE1 GLU A 43 -25.391 1.166 -3.885 1.00 0.00 O ATOM 745 OE2 GLU A 43 -23.539 2.227 -3.401 1.00 0.00 O ATOM 0 H GLU A 43 -22.044 2.849 -7.110 1.00 0.00 H new ATOM 0 HA GLU A 43 -24.525 2.330 -8.410 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -23.894 3.869 -5.853 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -25.443 3.171 -6.284 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -24.460 0.904 -6.200 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -22.894 1.586 -5.809 1.00 0.00 H new ATOM 752 N ARG A 44 -23.348 5.271 -8.729 1.00 0.00 N ATOM 753 CA ARG A 44 -23.581 6.592 -9.299 1.00 0.00 C ATOM 754 C ARG A 44 -23.258 6.609 -10.784 1.00 0.00 C ATOM 755 O ARG A 44 -23.813 7.398 -11.546 1.00 0.00 O ATOM 756 CB ARG A 44 -22.731 7.653 -8.594 1.00 0.00 C ATOM 757 CG ARG A 44 -22.950 7.718 -7.097 1.00 0.00 C ATOM 758 CD ARG A 44 -22.501 9.051 -6.516 1.00 0.00 C ATOM 759 NE ARG A 44 -21.245 9.532 -7.096 1.00 0.00 N ATOM 760 CZ ARG A 44 -20.327 10.230 -6.424 1.00 0.00 C ATOM 761 NH1 ARG A 44 -20.469 10.446 -5.120 1.00 0.00 N ATOM 762 NH2 ARG A 44 -19.258 10.706 -7.052 1.00 0.00 N ATOM 0 H ARG A 44 -22.365 5.042 -8.580 1.00 0.00 H new ATOM 0 HA ARG A 44 -24.637 6.822 -9.156 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -21.678 7.450 -8.789 1.00 0.00 H new ATOM 0 HB3 ARG A 44 -22.953 8.629 -9.027 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -24.006 7.564 -6.877 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -22.402 6.909 -6.614 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -23.280 9.795 -6.682 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -22.382 8.950 -5.437 1.00 0.00 H new ATOM 0 HE ARG A 44 -21.060 9.320 -8.076 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -21.283 10.078 -4.628 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -19.764 10.980 -4.612 1.00 0.00 H new ATOM 0 HH21 ARG A 44 -19.137 10.539 -8.051 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -18.558 11.239 -6.536 1.00 0.00 H new ATOM 776 N GLY A 45 -22.358 5.726 -11.176 1.00 0.00 N ATOM 777 CA GLY A 45 -21.841 5.729 -12.526 1.00 0.00 C ATOM 778 C GLY A 45 -20.840 6.842 -12.703 1.00 0.00 C ATOM 779 O GLY A 45 -20.737 7.429 -13.772 1.00 0.00 O ATOM 0 H GLY A 45 -21.971 4.998 -10.575 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -21.371 4.770 -12.744 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -22.660 5.851 -13.235 1.00 0.00 H new ATOM 783 N ASP A 46 -20.082 7.100 -11.642 1.00 0.00 N ATOM 784 CA ASP A 46 -19.216 8.274 -11.553 1.00 0.00 C ATOM 785 C ASP A 46 -18.131 8.267 -12.624 1.00 0.00 C ATOM 786 O ASP A 46 -17.677 9.323 -13.066 1.00 0.00 O ATOM 787 CB ASP A 46 -18.574 8.333 -10.168 1.00 0.00 C ATOM 788 CG ASP A 46 -17.866 9.645 -9.900 1.00 0.00 C ATOM 789 OD1 ASP A 46 -16.619 9.673 -9.917 1.00 0.00 O ATOM 790 OD2 ASP A 46 -18.559 10.653 -9.653 1.00 0.00 O ATOM 0 H ASP A 46 -20.050 6.501 -10.817 1.00 0.00 H new ATOM 0 HA ASP A 46 -19.835 9.156 -11.717 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -19.343 8.180 -9.410 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -17.861 7.515 -10.069 1.00 0.00 H new ATOM 795 N ALA A 47 -17.727 7.079 -13.044 1.00 0.00 N ATOM 796 CA ALA A 47 -16.669 6.939 -14.034 1.00 0.00 C ATOM 797 C ALA A 47 -17.167 7.256 -15.441 1.00 0.00 C ATOM 798 O ALA A 47 -16.382 7.614 -16.319 1.00 0.00 O ATOM 799 CB ALA A 47 -16.085 5.536 -13.983 1.00 0.00 C ATOM 0 H ALA A 47 -18.116 6.196 -12.715 1.00 0.00 H new ATOM 0 HA ALA A 47 -15.889 7.660 -13.791 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -15.295 5.444 -14.728 1.00 0.00 H new ATOM 0 HB2 ALA A 47 -15.673 5.349 -12.991 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -16.869 4.808 -14.193 1.00 0.00 H new ATOM 805 N LYS A 48 -18.471 7.137 -15.651 1.00 0.00 N ATOM 806 CA LYS A 48 -19.051 7.359 -16.969 1.00 0.00 C ATOM 807 C LYS A 48 -19.857 8.656 -16.979 1.00 0.00 C ATOM 808 O LYS A 48 -19.661 9.520 -17.835 1.00 0.00 O ATOM 809 CB LYS A 48 -19.948 6.174 -17.346 1.00 0.00 C ATOM 810 CG LYS A 48 -19.889 5.797 -18.820 1.00 0.00 C ATOM 811 CD LYS A 48 -20.446 6.892 -19.714 1.00 0.00 C ATOM 812 CE LYS A 48 -20.226 6.568 -21.176 1.00 0.00 C ATOM 813 NZ LYS A 48 -20.740 7.637 -22.071 1.00 0.00 N ATOM 0 H LYS A 48 -19.146 6.889 -14.928 1.00 0.00 H new ATOM 0 HA LYS A 48 -18.248 7.444 -17.701 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -19.660 5.309 -16.749 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -20.978 6.414 -17.084 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -18.856 5.592 -19.100 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -20.451 4.877 -18.981 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -21.512 7.015 -19.522 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -19.967 7.841 -19.473 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -19.161 6.425 -21.358 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -20.720 5.627 -21.416 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -20.568 7.373 -23.062 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -21.761 7.757 -21.917 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -20.251 8.530 -21.861 1.00 0.00 H new ATOM 827 N GLY A 49 -20.736 8.794 -16.003 1.00 0.00 N ATOM 828 CA GLY A 49 -21.612 9.943 -15.930 1.00 0.00 C ATOM 829 C GLY A 49 -22.991 9.551 -15.444 1.00 0.00 C ATOM 830 O GLY A 49 -23.480 10.074 -14.441 1.00 0.00 O ATOM 0 H GLY A 49 -20.860 8.120 -15.248 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -21.185 10.687 -15.258 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -21.689 10.408 -16.913 1.00 0.00 H new ATOM 834 N THR A 50 -23.616 8.623 -16.153 1.00 0.00 N ATOM 835 CA THR A 50 -24.929 8.121 -15.791 1.00 0.00 C ATOM 836 C THR A 50 -25.106 6.701 -16.325 1.00 0.00 C ATOM 837 O THR A 50 -24.997 6.463 -17.530 1.00 0.00 O ATOM 838 CB THR A 50 -26.047 9.028 -16.349 1.00 0.00 C ATOM 839 OG1 THR A 50 -25.831 10.383 -15.929 1.00 0.00 O ATOM 840 CG2 THR A 50 -27.417 8.565 -15.873 1.00 0.00 C ATOM 0 H THR A 50 -23.226 8.198 -16.994 1.00 0.00 H new ATOM 0 HA THR A 50 -25.002 8.117 -14.703 1.00 0.00 H new ATOM 0 HB THR A 50 -26.019 8.969 -17.437 1.00 0.00 H new ATOM 0 HG1 THR A 50 -26.542 10.954 -16.287 1.00 0.00 H new ATOM 0 HG21 THR A 50 -28.185 9.222 -16.281 1.00 0.00 H new ATOM 0 HG22 THR A 50 -27.594 7.544 -16.212 1.00 0.00 H new ATOM 0 HG23 THR A 50 -27.454 8.597 -14.784 1.00 0.00 H new ATOM 848 N GLU A 51 -25.338 5.759 -15.424 1.00 0.00 N ATOM 849 CA GLU A 51 -25.538 4.365 -15.804 1.00 0.00 C ATOM 850 C GLU A 51 -26.902 4.171 -16.445 1.00 0.00 C ATOM 851 O GLU A 51 -27.934 4.298 -15.787 1.00 0.00 O ATOM 852 CB GLU A 51 -25.394 3.449 -14.589 1.00 0.00 C ATOM 853 CG GLU A 51 -23.991 3.420 -14.016 1.00 0.00 C ATOM 854 CD GLU A 51 -22.961 2.915 -15.009 1.00 0.00 C ATOM 855 OE1 GLU A 51 -22.424 3.726 -15.794 1.00 0.00 O ATOM 856 OE2 GLU A 51 -22.681 1.697 -15.007 1.00 0.00 O ATOM 0 H GLU A 51 -25.393 5.933 -14.421 1.00 0.00 H new ATOM 0 HA GLU A 51 -24.771 4.102 -16.533 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -26.088 3.775 -13.814 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -25.684 2.437 -14.871 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -23.715 4.423 -13.692 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -23.978 2.784 -13.131 1.00 0.00 H new ATOM 863 N LEU A 52 -26.899 3.875 -17.734 1.00 0.00 N ATOM 864 CA LEU A 52 -28.135 3.676 -18.471 1.00 0.00 C ATOM 865 C LEU A 52 -28.451 2.195 -18.594 1.00 0.00 C ATOM 866 O LEU A 52 -29.605 1.802 -18.764 1.00 0.00 O ATOM 867 CB LEU A 52 -28.038 4.312 -19.861 1.00 0.00 C ATOM 868 CG LEU A 52 -27.713 5.807 -19.875 1.00 0.00 C ATOM 869 CD1 LEU A 52 -27.665 6.332 -21.301 1.00 0.00 C ATOM 870 CD2 LEU A 52 -28.732 6.583 -19.055 1.00 0.00 C ATOM 0 H LEU A 52 -26.052 3.767 -18.292 1.00 0.00 H new ATOM 0 HA LEU A 52 -28.942 4.159 -17.921 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -27.272 3.785 -20.431 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -28.984 4.158 -20.380 1.00 0.00 H new ATOM 0 HG LEU A 52 -26.730 5.947 -19.425 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -27.433 7.397 -21.289 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -26.896 5.799 -21.859 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -28.633 6.177 -21.778 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -28.484 7.644 -19.077 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -29.727 6.434 -19.475 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -28.716 6.228 -18.025 1.00 0.00 H new ATOM 882 N ASN A 53 -27.420 1.379 -18.501 1.00 0.00 N ATOM 883 CA ASN A 53 -27.574 -0.067 -18.606 1.00 0.00 C ATOM 884 C ASN A 53 -27.688 -0.694 -17.226 1.00 0.00 C ATOM 885 O ASN A 53 -28.548 -1.542 -16.985 1.00 0.00 O ATOM 886 CB ASN A 53 -26.405 -0.689 -19.373 1.00 0.00 C ATOM 887 CG ASN A 53 -26.409 -0.320 -20.843 1.00 0.00 C ATOM 888 OD1 ASN A 53 -27.042 -0.993 -21.660 1.00 0.00 O ATOM 889 ND2 ASN A 53 -25.700 0.742 -21.193 1.00 0.00 N ATOM 0 H ASN A 53 -26.460 1.690 -18.352 1.00 0.00 H new ATOM 0 HA ASN A 53 -28.492 -0.267 -19.159 1.00 0.00 H new ATOM 0 HB2 ASN A 53 -25.467 -0.364 -18.923 1.00 0.00 H new ATOM 0 HB3 ASN A 53 -26.447 -1.774 -19.275 1.00 0.00 H new ATOM 0 HD21 ASN A 53 -25.663 1.031 -22.170 1.00 0.00 H new ATOM 0 HD22 ASN A 53 -25.191 1.271 -20.485 1.00 0.00 H new TER 896 ASN A 53 ATOM 897 N GLY B 84 11.307 -15.706 -17.574 1.00 0.00 N ATOM 898 CA GLY B 84 11.865 -16.339 -16.402 1.00 0.00 C ATOM 899 C GLY B 84 11.212 -15.828 -15.139 1.00 0.00 C ATOM 900 O GLY B 84 10.028 -15.485 -15.155 1.00 0.00 O ATOM 0 HA2 GLY B 84 11.733 -17.419 -16.471 1.00 0.00 H new ATOM 0 HA3 GLY B 84 12.938 -16.152 -16.361 1.00 0.00 H new ATOM 904 N PRO B 85 11.954 -15.755 -14.027 1.00 0.00 N ATOM 905 CA PRO B 85 11.437 -15.250 -12.769 1.00 0.00 C ATOM 906 C PRO B 85 11.626 -13.743 -12.643 1.00 0.00 C ATOM 907 O PRO B 85 12.026 -13.079 -13.605 1.00 0.00 O ATOM 908 CB PRO B 85 12.287 -15.994 -11.748 1.00 0.00 C ATOM 909 CG PRO B 85 13.622 -16.104 -12.402 1.00 0.00 C ATOM 910 CD PRO B 85 13.367 -16.161 -13.896 1.00 0.00 C ATOM 0 HA PRO B 85 10.365 -15.407 -12.651 1.00 0.00 H new ATOM 0 HB2 PRO B 85 12.348 -15.449 -10.806 1.00 0.00 H new ATOM 0 HB3 PRO B 85 11.871 -16.976 -11.522 1.00 0.00 H new ATOM 0 HG2 PRO B 85 14.250 -15.250 -12.148 1.00 0.00 H new ATOM 0 HG3 PRO B 85 14.147 -16.997 -12.064 1.00 0.00 H new ATOM 0 HD2 PRO B 85 14.029 -15.488 -14.441 1.00 0.00 H new ATOM 0 HD3 PRO B 85 13.534 -17.162 -14.293 1.00 0.00 H new ATOM 918 N LEU B 86 11.326 -13.211 -11.466 1.00 0.00 N ATOM 919 CA LEU B 86 11.493 -11.789 -11.183 1.00 0.00 C ATOM 920 C LEU B 86 12.902 -11.304 -11.552 1.00 0.00 C ATOM 921 O LEU B 86 13.873 -12.070 -11.517 1.00 0.00 O ATOM 922 CB LEU B 86 11.211 -11.504 -9.698 1.00 0.00 C ATOM 923 CG LEU B 86 12.301 -11.925 -8.697 1.00 0.00 C ATOM 924 CD1 LEU B 86 11.895 -11.529 -7.288 1.00 0.00 C ATOM 925 CD2 LEU B 86 12.576 -13.422 -8.758 1.00 0.00 C ATOM 0 H LEU B 86 10.961 -13.750 -10.681 1.00 0.00 H new ATOM 0 HA LEU B 86 10.777 -11.243 -11.797 1.00 0.00 H new ATOM 0 HB2 LEU B 86 11.038 -10.434 -9.583 1.00 0.00 H new ATOM 0 HB3 LEU B 86 10.284 -12.008 -9.424 1.00 0.00 H new ATOM 0 HG LEU B 86 13.220 -11.407 -8.971 1.00 0.00 H new ATOM 0 HD11 LEU B 86 12.673 -11.831 -6.587 1.00 0.00 H new ATOM 0 HD12 LEU B 86 11.761 -10.448 -7.238 1.00 0.00 H new ATOM 0 HD13 LEU B 86 10.959 -12.023 -7.027 1.00 0.00 H new ATOM 0 HD21 LEU B 86 13.351 -13.679 -8.036 1.00 0.00 H new ATOM 0 HD22 LEU B 86 11.664 -13.969 -8.521 1.00 0.00 H new ATOM 0 HD23 LEU B 86 12.910 -13.690 -9.760 1.00 0.00 H new ATOM 937 N GLY B 87 13.005 -10.029 -11.901 1.00 0.00 N ATOM 938 CA GLY B 87 14.279 -9.460 -12.309 1.00 0.00 C ATOM 939 C GLY B 87 15.112 -8.997 -11.129 1.00 0.00 C ATOM 940 O GLY B 87 16.135 -8.334 -11.301 1.00 0.00 O ATOM 0 H GLY B 87 12.224 -9.373 -11.909 1.00 0.00 H new ATOM 0 HA2 GLY B 87 14.840 -10.202 -12.877 1.00 0.00 H new ATOM 0 HA3 GLY B 87 14.100 -8.617 -12.976 1.00 0.00 H new ATOM 944 N SER B 88 14.679 -9.362 -9.931 1.00 0.00 N ATOM 945 CA SER B 88 15.374 -8.982 -8.709 1.00 0.00 C ATOM 946 C SER B 88 16.501 -9.968 -8.390 1.00 0.00 C ATOM 947 O SER B 88 17.078 -9.938 -7.303 1.00 0.00 O ATOM 948 CB SER B 88 14.382 -8.926 -7.547 1.00 0.00 C ATOM 949 OG SER B 88 13.232 -8.168 -7.896 1.00 0.00 O ATOM 0 H SER B 88 13.843 -9.926 -9.779 1.00 0.00 H new ATOM 0 HA SER B 88 15.817 -7.997 -8.856 1.00 0.00 H new ATOM 0 HB2 SER B 88 14.085 -9.937 -7.269 1.00 0.00 H new ATOM 0 HB3 SER B 88 14.863 -8.483 -6.675 1.00 0.00 H new ATOM 0 HG SER B 88 12.611 -8.148 -7.138 1.00 0.00 H new ATOM 955 N ARG B 89 16.821 -10.825 -9.357 1.00 0.00 N ATOM 956 CA ARG B 89 17.830 -11.866 -9.170 1.00 0.00 C ATOM 957 C ARG B 89 19.238 -11.284 -9.065 1.00 0.00 C ATOM 958 O ARG B 89 20.148 -11.935 -8.554 1.00 0.00 O ATOM 959 CB ARG B 89 17.764 -12.880 -10.316 1.00 0.00 C ATOM 960 CG ARG B 89 16.511 -13.739 -10.294 1.00 0.00 C ATOM 961 CD ARG B 89 16.498 -14.672 -9.094 1.00 0.00 C ATOM 962 NE ARG B 89 15.278 -15.472 -9.029 1.00 0.00 N ATOM 963 CZ ARG B 89 15.208 -16.677 -8.461 1.00 0.00 C ATOM 964 NH1 ARG B 89 16.297 -17.233 -7.940 1.00 0.00 N ATOM 965 NH2 ARG B 89 14.052 -17.327 -8.415 1.00 0.00 N ATOM 0 H ARG B 89 16.394 -10.819 -10.283 1.00 0.00 H new ATOM 0 HA ARG B 89 17.610 -12.369 -8.228 1.00 0.00 H new ATOM 0 HB2 ARG B 89 17.813 -12.347 -11.265 1.00 0.00 H new ATOM 0 HB3 ARG B 89 18.640 -13.527 -10.269 1.00 0.00 H new ATOM 0 HG2 ARG B 89 15.630 -13.098 -10.268 1.00 0.00 H new ATOM 0 HG3 ARG B 89 16.453 -14.324 -11.212 1.00 0.00 H new ATOM 0 HD2 ARG B 89 17.362 -15.334 -9.142 1.00 0.00 H new ATOM 0 HD3 ARG B 89 16.595 -14.086 -8.180 1.00 0.00 H new ATOM 0 HE ARG B 89 14.429 -15.087 -9.442 1.00 0.00 H new ATOM 0 HH11 ARG B 89 17.188 -16.738 -7.974 1.00 0.00 H new ATOM 0 HH12 ARG B 89 16.241 -18.154 -7.506 1.00 0.00 H new ATOM 0 HH21 ARG B 89 13.214 -16.905 -8.815 1.00 0.00 H new ATOM 0 HH22 ARG B 89 14.002 -18.248 -7.980 1.00 0.00 H new ATOM 979 N ARG B 90 19.414 -10.058 -9.543 1.00 0.00 N ATOM 980 CA ARG B 90 20.704 -9.387 -9.452 1.00 0.00 C ATOM 981 C ARG B 90 20.820 -8.716 -8.084 1.00 0.00 C ATOM 982 O ARG B 90 20.738 -7.490 -7.966 1.00 0.00 O ATOM 983 CB ARG B 90 20.858 -8.357 -10.574 1.00 0.00 C ATOM 984 CG ARG B 90 20.543 -8.906 -11.957 1.00 0.00 C ATOM 985 CD ARG B 90 20.629 -7.823 -13.019 1.00 0.00 C ATOM 986 NE ARG B 90 20.192 -8.304 -14.331 1.00 0.00 N ATOM 987 CZ ARG B 90 19.995 -7.516 -15.387 1.00 0.00 C ATOM 988 NH1 ARG B 90 20.210 -6.211 -15.296 1.00 0.00 N ATOM 989 NH2 ARG B 90 19.583 -8.037 -16.534 1.00 0.00 N ATOM 0 H ARG B 90 18.682 -9.510 -9.996 1.00 0.00 H new ATOM 0 HA ARG B 90 21.502 -10.121 -9.564 1.00 0.00 H new ATOM 0 HB2 ARG B 90 20.202 -7.511 -10.371 1.00 0.00 H new ATOM 0 HB3 ARG B 90 21.879 -7.977 -10.568 1.00 0.00 H new ATOM 0 HG2 ARG B 90 21.239 -9.709 -12.198 1.00 0.00 H new ATOM 0 HG3 ARG B 90 19.543 -9.340 -11.958 1.00 0.00 H new ATOM 0 HD2 ARG B 90 20.014 -6.974 -12.721 1.00 0.00 H new ATOM 0 HD3 ARG B 90 21.656 -7.464 -13.088 1.00 0.00 H new ATOM 0 HE ARG B 90 20.028 -9.304 -14.443 1.00 0.00 H new ATOM 0 HH11 ARG B 90 20.528 -5.807 -14.415 1.00 0.00 H new ATOM 0 HH12 ARG B 90 20.058 -5.611 -16.107 1.00 0.00 H new ATOM 0 HH21 ARG B 90 19.417 -9.041 -16.608 1.00 0.00 H new ATOM 0 HH22 ARG B 90 19.432 -7.434 -17.343 1.00 0.00 H new ATOM 1003 N PHE B 91 21.014 -9.549 -7.065 1.00 0.00 N ATOM 1004 CA PHE B 91 20.942 -9.133 -5.666 1.00 0.00 C ATOM 1005 C PHE B 91 21.844 -7.946 -5.345 1.00 0.00 C ATOM 1006 O PHE B 91 21.388 -6.962 -4.777 1.00 0.00 O ATOM 1007 CB PHE B 91 21.286 -10.301 -4.743 1.00 0.00 C ATOM 1008 CG PHE B 91 20.319 -11.448 -4.838 1.00 0.00 C ATOM 1009 CD1 PHE B 91 20.701 -12.649 -5.415 1.00 0.00 C ATOM 1010 CD2 PHE B 91 19.027 -11.321 -4.356 1.00 0.00 C ATOM 1011 CE1 PHE B 91 19.812 -13.702 -5.506 1.00 0.00 C ATOM 1012 CE2 PHE B 91 18.135 -12.370 -4.445 1.00 0.00 C ATOM 1013 CZ PHE B 91 18.527 -13.562 -5.022 1.00 0.00 C ATOM 0 H PHE B 91 21.227 -10.539 -7.187 1.00 0.00 H new ATOM 0 HA PHE B 91 19.914 -8.812 -5.497 1.00 0.00 H new ATOM 0 HB2 PHE B 91 22.287 -10.660 -4.982 1.00 0.00 H new ATOM 0 HB3 PHE B 91 21.313 -9.944 -3.714 1.00 0.00 H new ATOM 0 HD1 PHE B 91 21.705 -12.763 -5.798 1.00 0.00 H new ATOM 0 HD2 PHE B 91 18.714 -10.391 -3.905 1.00 0.00 H new ATOM 0 HE1 PHE B 91 20.122 -14.634 -5.955 1.00 0.00 H new ATOM 0 HE2 PHE B 91 17.131 -12.259 -4.064 1.00 0.00 H new ATOM 0 HZ PHE B 91 17.829 -14.383 -5.094 1.00 0.00 H new ATOM 1023 N VAL B 92 23.117 -8.021 -5.691 1.00 0.00 N ATOM 1024 CA VAL B 92 24.027 -6.946 -5.331 1.00 0.00 C ATOM 1025 C VAL B 92 23.899 -5.779 -6.307 1.00 0.00 C ATOM 1026 O VAL B 92 24.007 -4.614 -5.920 1.00 0.00 O ATOM 1027 CB VAL B 92 25.498 -7.423 -5.245 1.00 0.00 C ATOM 1028 CG1 VAL B 92 26.035 -7.852 -6.603 1.00 0.00 C ATOM 1029 CG2 VAL B 92 26.374 -6.344 -4.629 1.00 0.00 C ATOM 0 H VAL B 92 23.537 -8.794 -6.208 1.00 0.00 H new ATOM 0 HA VAL B 92 23.740 -6.607 -4.336 1.00 0.00 H new ATOM 0 HB VAL B 92 25.523 -8.300 -4.598 1.00 0.00 H new ATOM 0 HG11 VAL B 92 27.069 -8.179 -6.498 1.00 0.00 H new ATOM 0 HG12 VAL B 92 25.432 -8.673 -6.990 1.00 0.00 H new ATOM 0 HG13 VAL B 92 25.989 -7.011 -7.295 1.00 0.00 H new ATOM 0 HG21 VAL B 92 27.404 -6.697 -4.577 1.00 0.00 H new ATOM 0 HG22 VAL B 92 26.330 -5.445 -5.243 1.00 0.00 H new ATOM 0 HG23 VAL B 92 26.018 -6.115 -3.625 1.00 0.00 H new ATOM 1039 N VAL B 93 23.617 -6.093 -7.563 1.00 0.00 N ATOM 1040 CA VAL B 93 23.550 -5.081 -8.602 1.00 0.00 C ATOM 1041 C VAL B 93 22.449 -4.062 -8.320 1.00 0.00 C ATOM 1042 O VAL B 93 22.726 -2.885 -8.064 1.00 0.00 O ATOM 1043 CB VAL B 93 23.321 -5.709 -9.988 1.00 0.00 C ATOM 1044 CG1 VAL B 93 23.320 -4.641 -11.073 1.00 0.00 C ATOM 1045 CG2 VAL B 93 24.375 -6.767 -10.280 1.00 0.00 C ATOM 0 H VAL B 93 23.431 -7.043 -7.886 1.00 0.00 H new ATOM 0 HA VAL B 93 24.513 -4.570 -8.602 1.00 0.00 H new ATOM 0 HB VAL B 93 22.343 -6.191 -9.984 1.00 0.00 H new ATOM 0 HG11 VAL B 93 23.156 -5.109 -12.044 1.00 0.00 H new ATOM 0 HG12 VAL B 93 22.523 -3.924 -10.877 1.00 0.00 H new ATOM 0 HG13 VAL B 93 24.280 -4.125 -11.076 1.00 0.00 H new ATOM 0 HG21 VAL B 93 24.195 -7.198 -11.265 1.00 0.00 H new ATOM 0 HG22 VAL B 93 25.364 -6.310 -10.260 1.00 0.00 H new ATOM 0 HG23 VAL B 93 24.322 -7.551 -9.525 1.00 0.00 H new ATOM 1055 N ASP B 94 21.202 -4.510 -8.332 1.00 0.00 N ATOM 1056 CA ASP B 94 20.094 -3.578 -8.236 1.00 0.00 C ATOM 1057 C ASP B 94 19.682 -3.323 -6.793 1.00 0.00 C ATOM 1058 O ASP B 94 19.436 -2.189 -6.430 1.00 0.00 O ATOM 1059 CB ASP B 94 18.887 -4.037 -9.055 1.00 0.00 C ATOM 1060 CG ASP B 94 19.207 -4.242 -10.523 1.00 0.00 C ATOM 1061 OD1 ASP B 94 19.366 -5.405 -10.942 1.00 0.00 O ATOM 1062 OD2 ASP B 94 19.285 -3.243 -11.270 1.00 0.00 O ATOM 0 H ASP B 94 20.937 -5.492 -8.406 1.00 0.00 H new ATOM 0 HA ASP B 94 20.453 -2.638 -8.656 1.00 0.00 H new ATOM 0 HB2 ASP B 94 18.506 -4.970 -8.639 1.00 0.00 H new ATOM 0 HB3 ASP B 94 18.091 -3.298 -8.963 1.00 0.00 H new ATOM 1067 N ASP B 95 19.625 -4.344 -5.950 1.00 0.00 N ATOM 1068 CA ASP B 95 19.173 -4.129 -4.568 1.00 0.00 C ATOM 1069 C ASP B 95 20.024 -3.071 -3.864 1.00 0.00 C ATOM 1070 O ASP B 95 19.555 -2.383 -2.966 1.00 0.00 O ATOM 1071 CB ASP B 95 19.163 -5.434 -3.768 1.00 0.00 C ATOM 1072 CG ASP B 95 18.861 -5.236 -2.292 1.00 0.00 C ATOM 1073 OD1 ASP B 95 17.672 -5.315 -1.906 1.00 0.00 O ATOM 1074 OD2 ASP B 95 19.811 -5.028 -1.513 1.00 0.00 O ATOM 0 H ASP B 95 19.876 -5.305 -6.181 1.00 0.00 H new ATOM 0 HA ASP B 95 18.148 -3.762 -4.619 1.00 0.00 H new ATOM 0 HB2 ASP B 95 18.421 -6.108 -4.196 1.00 0.00 H new ATOM 0 HB3 ASP B 95 20.132 -5.922 -3.870 1.00 0.00 H new ATOM 1079 N ARG B 96 21.251 -2.880 -4.317 1.00 0.00 N ATOM 1080 CA ARG B 96 22.109 -1.889 -3.689 1.00 0.00 C ATOM 1081 C ARG B 96 21.791 -0.506 -4.239 1.00 0.00 C ATOM 1082 O ARG B 96 21.191 0.320 -3.553 1.00 0.00 O ATOM 1083 CB ARG B 96 23.586 -2.213 -3.904 1.00 0.00 C ATOM 1084 CG ARG B 96 24.074 -3.460 -3.179 1.00 0.00 C ATOM 1085 CD ARG B 96 23.987 -3.320 -1.668 1.00 0.00 C ATOM 1086 NE ARG B 96 22.662 -3.648 -1.147 1.00 0.00 N ATOM 1087 CZ ARG B 96 22.391 -3.786 0.149 1.00 0.00 C ATOM 1088 NH1 ARG B 96 23.341 -3.589 1.057 1.00 0.00 N ATOM 1089 NH2 ARG B 96 21.173 -4.134 0.535 1.00 0.00 N ATOM 0 H ARG B 96 21.669 -3.384 -5.099 1.00 0.00 H new ATOM 0 HA ARG B 96 21.916 -1.906 -2.616 1.00 0.00 H new ATOM 0 HB2 ARG B 96 23.766 -2.336 -4.972 1.00 0.00 H new ATOM 0 HB3 ARG B 96 24.183 -1.362 -3.577 1.00 0.00 H new ATOM 0 HG2 ARG B 96 23.481 -4.318 -3.497 1.00 0.00 H new ATOM 0 HG3 ARG B 96 25.106 -3.663 -3.464 1.00 0.00 H new ATOM 0 HD2 ARG B 96 24.727 -3.972 -1.204 1.00 0.00 H new ATOM 0 HD3 ARG B 96 24.241 -2.298 -1.387 1.00 0.00 H new ATOM 0 HE ARG B 96 21.902 -3.779 -1.814 1.00 0.00 H new ATOM 0 HH11 ARG B 96 24.283 -3.331 0.762 1.00 0.00 H new ATOM 0 HH12 ARG B 96 23.129 -3.696 2.049 1.00 0.00 H new ATOM 0 HH21 ARG B 96 20.444 -4.296 -0.160 1.00 0.00 H new ATOM 0 HH22 ARG B 96 20.963 -4.240 1.528 1.00 0.00 H new ATOM 1103 N ARG B 97 22.153 -0.283 -5.498 1.00 0.00 N ATOM 1104 CA ARG B 97 21.970 0.994 -6.146 1.00 0.00 C ATOM 1105 C ARG B 97 20.493 1.321 -6.295 1.00 0.00 C ATOM 1106 O ARG B 97 20.023 2.389 -5.915 1.00 0.00 O ATOM 1107 CB ARG B 97 22.575 0.916 -7.537 1.00 0.00 C ATOM 1108 CG ARG B 97 23.948 0.276 -7.605 1.00 0.00 C ATOM 1109 CD ARG B 97 24.266 -0.140 -9.032 1.00 0.00 C ATOM 1110 NE ARG B 97 24.222 0.996 -9.952 1.00 0.00 N ATOM 1111 CZ ARG B 97 23.404 1.081 -11.003 1.00 0.00 C ATOM 1112 NH1 ARG B 97 22.574 0.084 -11.292 1.00 0.00 N ATOM 1113 NH2 ARG B 97 23.423 2.162 -11.769 1.00 0.00 N ATOM 0 H ARG B 97 22.583 -0.991 -6.093 1.00 0.00 H new ATOM 0 HA ARG B 97 22.448 1.765 -5.542 1.00 0.00 H new ATOM 0 HB2 ARG B 97 21.897 0.355 -8.180 1.00 0.00 H new ATOM 0 HB3 ARG B 97 22.640 1.925 -7.945 1.00 0.00 H new ATOM 0 HG2 ARG B 97 24.702 0.977 -7.247 1.00 0.00 H new ATOM 0 HG3 ARG B 97 23.984 -0.594 -6.949 1.00 0.00 H new ATOM 0 HD2 ARG B 97 25.255 -0.597 -9.066 1.00 0.00 H new ATOM 0 HD3 ARG B 97 23.554 -0.898 -9.357 1.00 0.00 H new ATOM 0 HE ARG B 97 24.858 1.774 -9.779 1.00 0.00 H new ATOM 0 HH11 ARG B 97 22.560 -0.753 -10.709 1.00 0.00 H new ATOM 0 HH12 ARG B 97 21.951 0.156 -12.097 1.00 0.00 H new ATOM 0 HH21 ARG B 97 24.062 2.928 -11.555 1.00 0.00 H new ATOM 0 HH22 ARG B 97 22.798 2.229 -12.573 1.00 0.00 H new ATOM 1127 N GLU B 98 19.779 0.354 -6.834 1.00 0.00 N ATOM 1128 CA GLU B 98 18.425 0.536 -7.317 1.00 0.00 C ATOM 1129 C GLU B 98 17.387 0.503 -6.207 1.00 0.00 C ATOM 1130 O GLU B 98 16.422 1.261 -6.239 1.00 0.00 O ATOM 1131 CB GLU B 98 18.115 -0.562 -8.304 1.00 0.00 C ATOM 1132 CG GLU B 98 19.005 -0.531 -9.522 1.00 0.00 C ATOM 1133 CD GLU B 98 18.651 0.588 -10.478 1.00 0.00 C ATOM 1134 OE1 GLU B 98 18.083 0.295 -11.551 1.00 0.00 O ATOM 1135 OE2 GLU B 98 18.934 1.757 -10.166 1.00 0.00 O ATOM 0 H GLU B 98 20.129 -0.597 -6.951 1.00 0.00 H new ATOM 0 HA GLU B 98 18.373 1.522 -7.778 1.00 0.00 H new ATOM 0 HB2 GLU B 98 18.220 -1.528 -7.809 1.00 0.00 H new ATOM 0 HB3 GLU B 98 17.075 -0.476 -8.619 1.00 0.00 H new ATOM 0 HG2 GLU B 98 20.042 -0.418 -9.206 1.00 0.00 H new ATOM 0 HG3 GLU B 98 18.933 -1.485 -10.044 1.00 0.00 H new ATOM 1142 N LEU B 99 17.558 -0.389 -5.238 1.00 0.00 N ATOM 1143 CA LEU B 99 16.557 -0.540 -4.202 1.00 0.00 C ATOM 1144 C LEU B 99 16.494 0.730 -3.363 1.00 0.00 C ATOM 1145 O LEU B 99 15.420 1.283 -3.178 1.00 0.00 O ATOM 1146 CB LEU B 99 16.835 -1.804 -3.376 1.00 0.00 C ATOM 1147 CG LEU B 99 15.959 -2.075 -2.148 1.00 0.00 C ATOM 1148 CD1 LEU B 99 16.501 -1.340 -0.939 1.00 0.00 C ATOM 1149 CD2 LEU B 99 14.504 -1.707 -2.409 1.00 0.00 C ATOM 0 H LEU B 99 18.366 -1.006 -5.152 1.00 0.00 H new ATOM 0 HA LEU B 99 15.571 -0.676 -4.645 1.00 0.00 H new ATOM 0 HB2 LEU B 99 16.749 -2.662 -4.042 1.00 0.00 H new ATOM 0 HB3 LEU B 99 17.872 -1.762 -3.042 1.00 0.00 H new ATOM 0 HG LEU B 99 15.990 -3.145 -1.941 1.00 0.00 H new ATOM 0 HD11 LEU B 99 15.867 -1.543 -0.076 1.00 0.00 H new ATOM 0 HD12 LEU B 99 17.516 -1.679 -0.732 1.00 0.00 H new ATOM 0 HD13 LEU B 99 16.510 -0.268 -1.138 1.00 0.00 H new ATOM 0 HD21 LEU B 99 13.911 -1.912 -1.517 1.00 0.00 H new ATOM 0 HD22 LEU B 99 14.435 -0.647 -2.655 1.00 0.00 H new ATOM 0 HD23 LEU B 99 14.123 -2.298 -3.242 1.00 0.00 H new ATOM 1161 N GLN B 100 17.640 1.237 -2.918 1.00 0.00 N ATOM 1162 CA GLN B 100 17.655 2.494 -2.172 1.00 0.00 C ATOM 1163 C GLN B 100 17.135 3.632 -3.057 1.00 0.00 C ATOM 1164 O GLN B 100 16.513 4.581 -2.581 1.00 0.00 O ATOM 1165 CB GLN B 100 19.068 2.803 -1.653 1.00 0.00 C ATOM 1166 CG GLN B 100 20.116 2.989 -2.740 1.00 0.00 C ATOM 1167 CD GLN B 100 20.313 4.441 -3.130 1.00 0.00 C ATOM 1168 OE1 GLN B 100 20.171 5.342 -2.305 1.00 0.00 O ATOM 1169 NE2 GLN B 100 20.631 4.677 -4.392 1.00 0.00 N ATOM 0 H GLN B 100 18.555 0.808 -3.056 1.00 0.00 H new ATOM 0 HA GLN B 100 16.998 2.398 -1.308 1.00 0.00 H new ATOM 0 HB2 GLN B 100 19.028 3.708 -1.047 1.00 0.00 H new ATOM 0 HB3 GLN B 100 19.385 1.993 -0.996 1.00 0.00 H new ATOM 0 HG2 GLN B 100 21.065 2.579 -2.396 1.00 0.00 H new ATOM 0 HG3 GLN B 100 19.823 2.418 -3.621 1.00 0.00 H new ATOM 0 HE21 GLN B 100 20.739 3.900 -5.044 1.00 0.00 H new ATOM 0 HE22 GLN B 100 20.768 5.636 -4.713 1.00 0.00 H new ATOM 1178 N TYR B 101 17.377 3.491 -4.355 1.00 0.00 N ATOM 1179 CA TYR B 101 16.944 4.456 -5.359 1.00 0.00 C ATOM 1180 C TYR B 101 15.422 4.504 -5.478 1.00 0.00 C ATOM 1181 O TYR B 101 14.843 5.576 -5.654 1.00 0.00 O ATOM 1182 CB TYR B 101 17.569 4.095 -6.715 1.00 0.00 C ATOM 1183 CG TYR B 101 17.180 5.015 -7.851 1.00 0.00 C ATOM 1184 CD1 TYR B 101 17.880 6.191 -8.087 1.00 0.00 C ATOM 1185 CD2 TYR B 101 16.118 4.703 -8.691 1.00 0.00 C ATOM 1186 CE1 TYR B 101 17.533 7.030 -9.129 1.00 0.00 C ATOM 1187 CE2 TYR B 101 15.764 5.536 -9.732 1.00 0.00 C ATOM 1188 CZ TYR B 101 16.474 6.697 -9.947 1.00 0.00 C ATOM 1189 OH TYR B 101 16.122 7.529 -10.985 1.00 0.00 O ATOM 0 H TYR B 101 17.884 2.696 -4.744 1.00 0.00 H new ATOM 0 HA TYR B 101 17.279 5.446 -5.048 1.00 0.00 H new ATOM 0 HB2 TYR B 101 18.654 4.102 -6.614 1.00 0.00 H new ATOM 0 HB3 TYR B 101 17.280 3.076 -6.974 1.00 0.00 H new ATOM 0 HD1 TYR B 101 18.709 6.454 -7.446 1.00 0.00 H new ATOM 0 HD2 TYR B 101 15.560 3.793 -8.526 1.00 0.00 H new ATOM 0 HE1 TYR B 101 18.088 7.941 -9.301 1.00 0.00 H new ATOM 0 HE2 TYR B 101 14.935 5.280 -10.375 1.00 0.00 H new ATOM 0 HH TYR B 101 15.357 7.148 -11.464 1.00 0.00 H new ATOM 1199 N ARG B 102 14.774 3.353 -5.387 1.00 0.00 N ATOM 1200 CA ARG B 102 13.329 3.301 -5.543 1.00 0.00 C ATOM 1201 C ARG B 102 12.617 3.706 -4.255 1.00 0.00 C ATOM 1202 O ARG B 102 11.469 4.137 -4.293 1.00 0.00 O ATOM 1203 CB ARG B 102 12.864 1.918 -6.010 1.00 0.00 C ATOM 1204 CG ARG B 102 13.094 0.805 -5.007 1.00 0.00 C ATOM 1205 CD ARG B 102 12.745 -0.549 -5.596 1.00 0.00 C ATOM 1206 NE ARG B 102 13.533 -0.842 -6.794 1.00 0.00 N ATOM 1207 CZ ARG B 102 13.789 -2.072 -7.234 1.00 0.00 C ATOM 1208 NH1 ARG B 102 13.338 -3.126 -6.566 1.00 0.00 N ATOM 1209 NH2 ARG B 102 14.497 -2.243 -8.342 1.00 0.00 N ATOM 0 H ARG B 102 15.219 2.453 -5.208 1.00 0.00 H new ATOM 0 HA ARG B 102 13.061 4.021 -6.316 1.00 0.00 H new ATOM 0 HB2 ARG B 102 11.800 1.966 -6.243 1.00 0.00 H new ATOM 0 HB3 ARG B 102 13.382 1.668 -6.936 1.00 0.00 H new ATOM 0 HG2 ARG B 102 14.137 0.808 -4.690 1.00 0.00 H new ATOM 0 HG3 ARG B 102 12.490 0.984 -4.117 1.00 0.00 H new ATOM 0 HD2 ARG B 102 12.917 -1.325 -4.850 1.00 0.00 H new ATOM 0 HD3 ARG B 102 11.684 -0.575 -5.844 1.00 0.00 H new ATOM 0 HE ARG B 102 13.909 -0.056 -7.324 1.00 0.00 H new ATOM 0 HH11 ARG B 102 12.794 -2.995 -5.713 1.00 0.00 H new ATOM 0 HH12 ARG B 102 13.535 -4.067 -6.905 1.00 0.00 H new ATOM 0 HH21 ARG B 102 14.844 -1.433 -8.855 1.00 0.00 H new ATOM 0 HH22 ARG B 102 14.694 -3.185 -8.681 1.00 0.00 H new ATOM 1223 N VAL B 103 13.298 3.599 -3.122 1.00 0.00 N ATOM 1224 CA VAL B 103 12.690 3.963 -1.848 1.00 0.00 C ATOM 1225 C VAL B 103 12.484 5.481 -1.768 1.00 0.00 C ATOM 1226 O VAL B 103 11.430 5.950 -1.342 1.00 0.00 O ATOM 1227 CB VAL B 103 13.535 3.468 -0.650 1.00 0.00 C ATOM 1228 CG1 VAL B 103 12.767 3.575 0.648 1.00 0.00 C ATOM 1229 CG2 VAL B 103 13.971 2.032 -0.847 1.00 0.00 C ATOM 0 H VAL B 103 14.260 3.267 -3.058 1.00 0.00 H new ATOM 0 HA VAL B 103 11.719 3.471 -1.792 1.00 0.00 H new ATOM 0 HB VAL B 103 14.415 4.109 -0.597 1.00 0.00 H new ATOM 0 HG11 VAL B 103 13.389 3.219 1.469 1.00 0.00 H new ATOM 0 HG12 VAL B 103 12.493 4.615 0.824 1.00 0.00 H new ATOM 0 HG13 VAL B 103 11.864 2.968 0.588 1.00 0.00 H new ATOM 0 HG21 VAL B 103 14.563 1.711 0.010 1.00 0.00 H new ATOM 0 HG22 VAL B 103 13.092 1.394 -0.940 1.00 0.00 H new ATOM 0 HG23 VAL B 103 14.573 1.955 -1.753 1.00 0.00 H new ATOM 1239 N GLU B 104 13.483 6.249 -2.193 1.00 0.00 N ATOM 1240 CA GLU B 104 13.356 7.711 -2.243 1.00 0.00 C ATOM 1241 C GLU B 104 12.259 8.166 -3.205 1.00 0.00 C ATOM 1242 O GLU B 104 11.477 9.052 -2.867 1.00 0.00 O ATOM 1243 CB GLU B 104 14.683 8.386 -2.596 1.00 0.00 C ATOM 1244 CG GLU B 104 15.547 7.577 -3.533 1.00 0.00 C ATOM 1245 CD GLU B 104 16.653 8.397 -4.164 1.00 0.00 C ATOM 1246 OE1 GLU B 104 16.417 8.992 -5.236 1.00 0.00 O ATOM 1247 OE2 GLU B 104 17.759 8.458 -3.592 1.00 0.00 O ATOM 0 H GLU B 104 14.385 5.891 -2.507 1.00 0.00 H new ATOM 0 HA GLU B 104 13.069 8.023 -1.239 1.00 0.00 H new ATOM 0 HB2 GLU B 104 14.477 9.355 -3.051 1.00 0.00 H new ATOM 0 HB3 GLU B 104 15.239 8.577 -1.678 1.00 0.00 H new ATOM 0 HG2 GLU B 104 15.986 6.742 -2.986 1.00 0.00 H new ATOM 0 HG3 GLU B 104 14.923 7.151 -4.319 1.00 0.00 H new ATOM 1254 N VAL B 105 12.187 7.579 -4.398 1.00 0.00 N ATOM 1255 CA VAL B 105 11.096 7.921 -5.309 1.00 0.00 C ATOM 1256 C VAL B 105 9.756 7.536 -4.695 1.00 0.00 C ATOM 1257 O VAL B 105 8.812 8.318 -4.744 1.00 0.00 O ATOM 1258 CB VAL B 105 11.252 7.313 -6.733 1.00 0.00 C ATOM 1259 CG1 VAL B 105 11.994 5.998 -6.705 1.00 0.00 C ATOM 1260 CG2 VAL B 105 9.909 7.119 -7.411 1.00 0.00 C ATOM 0 H VAL B 105 12.848 6.886 -4.749 1.00 0.00 H new ATOM 0 HA VAL B 105 11.137 9.002 -5.446 1.00 0.00 H new ATOM 0 HB VAL B 105 11.836 8.031 -7.308 1.00 0.00 H new ATOM 0 HG11 VAL B 105 12.081 5.608 -7.719 1.00 0.00 H new ATOM 0 HG12 VAL B 105 12.990 6.151 -6.288 1.00 0.00 H new ATOM 0 HG13 VAL B 105 11.448 5.285 -6.088 1.00 0.00 H new ATOM 0 HG21 VAL B 105 10.060 6.693 -8.403 1.00 0.00 H new ATOM 0 HG22 VAL B 105 9.295 6.443 -6.815 1.00 0.00 H new ATOM 0 HG23 VAL B 105 9.405 8.081 -7.503 1.00 0.00 H new ATOM 1270 N GLN B 106 9.685 6.361 -4.077 1.00 0.00 N ATOM 1271 CA GLN B 106 8.455 5.924 -3.423 1.00 0.00 C ATOM 1272 C GLN B 106 8.060 6.885 -2.299 1.00 0.00 C ATOM 1273 O GLN B 106 6.881 7.164 -2.112 1.00 0.00 O ATOM 1274 CB GLN B 106 8.595 4.496 -2.891 1.00 0.00 C ATOM 1275 CG GLN B 106 8.609 3.435 -3.980 1.00 0.00 C ATOM 1276 CD GLN B 106 7.429 3.542 -4.930 1.00 0.00 C ATOM 1277 OE1 GLN B 106 6.368 2.966 -4.692 1.00 0.00 O ATOM 1278 NE2 GLN B 106 7.614 4.255 -6.030 1.00 0.00 N ATOM 0 H GLN B 106 10.458 5.698 -4.015 1.00 0.00 H new ATOM 0 HA GLN B 106 7.660 5.931 -4.169 1.00 0.00 H new ATOM 0 HB2 GLN B 106 9.516 4.422 -2.313 1.00 0.00 H new ATOM 0 HB3 GLN B 106 7.772 4.291 -2.207 1.00 0.00 H new ATOM 0 HG2 GLN B 106 9.535 3.519 -4.549 1.00 0.00 H new ATOM 0 HG3 GLN B 106 8.607 2.448 -3.518 1.00 0.00 H new ATOM 0 HE21 GLN B 106 8.508 4.719 -6.193 1.00 0.00 H new ATOM 0 HE22 GLN B 106 6.863 4.341 -6.715 1.00 0.00 H new ATOM 1287 N ASN B 107 9.054 7.401 -1.575 1.00 0.00 N ATOM 1288 CA ASN B 107 8.825 8.424 -0.546 1.00 0.00 C ATOM 1289 C ASN B 107 8.012 9.589 -1.113 1.00 0.00 C ATOM 1290 O ASN B 107 7.060 10.071 -0.489 1.00 0.00 O ATOM 1291 CB ASN B 107 10.163 8.938 -0.003 1.00 0.00 C ATOM 1292 CG ASN B 107 10.018 10.224 0.788 1.00 0.00 C ATOM 1293 OD1 ASN B 107 10.230 11.319 0.268 1.00 0.00 O ATOM 1294 ND2 ASN B 107 9.633 10.104 2.044 1.00 0.00 N ATOM 0 H ASN B 107 10.031 7.128 -1.681 1.00 0.00 H new ATOM 0 HA ASN B 107 8.260 7.969 0.268 1.00 0.00 H new ATOM 0 HB2 ASN B 107 10.610 8.174 0.633 1.00 0.00 H new ATOM 0 HB3 ASN B 107 10.849 9.103 -0.834 1.00 0.00 H new ATOM 0 HD21 ASN B 107 9.501 10.936 2.619 1.00 0.00 H new ATOM 0 HD22 ASN B 107 9.467 9.179 2.440 1.00 0.00 H new ATOM 1301 N ARG B 108 8.389 10.021 -2.306 1.00 0.00 N ATOM 1302 CA ARG B 108 7.718 11.120 -2.978 1.00 0.00 C ATOM 1303 C ARG B 108 6.400 10.664 -3.598 1.00 0.00 C ATOM 1304 O ARG B 108 5.363 11.301 -3.420 1.00 0.00 O ATOM 1305 CB ARG B 108 8.631 11.698 -4.059 1.00 0.00 C ATOM 1306 CG ARG B 108 9.879 12.371 -3.509 1.00 0.00 C ATOM 1307 CD ARG B 108 10.723 12.994 -4.610 1.00 0.00 C ATOM 1308 NE ARG B 108 11.924 13.637 -4.074 1.00 0.00 N ATOM 1309 CZ ARG B 108 12.730 14.436 -4.776 1.00 0.00 C ATOM 1310 NH1 ARG B 108 12.482 14.688 -6.056 1.00 0.00 N ATOM 1311 NH2 ARG B 108 13.789 14.984 -4.191 1.00 0.00 N ATOM 0 H ARG B 108 9.165 9.621 -2.833 1.00 0.00 H new ATOM 0 HA ARG B 108 7.496 11.889 -2.239 1.00 0.00 H new ATOM 0 HB2 ARG B 108 8.929 10.898 -4.737 1.00 0.00 H new ATOM 0 HB3 ARG B 108 8.068 12.422 -4.649 1.00 0.00 H new ATOM 0 HG2 ARG B 108 9.590 13.141 -2.794 1.00 0.00 H new ATOM 0 HG3 ARG B 108 10.476 11.639 -2.965 1.00 0.00 H new ATOM 0 HD2 ARG B 108 11.011 12.225 -5.327 1.00 0.00 H new ATOM 0 HD3 ARG B 108 10.128 13.729 -5.153 1.00 0.00 H new ATOM 0 HE ARG B 108 12.161 13.462 -3.097 1.00 0.00 H new ATOM 0 HH11 ARG B 108 11.670 14.270 -6.510 1.00 0.00 H new ATOM 0 HH12 ARG B 108 13.103 15.300 -6.585 1.00 0.00 H new ATOM 0 HH21 ARG B 108 13.984 14.794 -3.208 1.00 0.00 H new ATOM 0 HH22 ARG B 108 14.407 15.595 -4.725 1.00 0.00 H new ATOM 1325 N VAL B 109 6.456 9.553 -4.318 1.00 0.00 N ATOM 1326 CA VAL B 109 5.293 9.018 -5.024 1.00 0.00 C ATOM 1327 C VAL B 109 4.149 8.688 -4.074 1.00 0.00 C ATOM 1328 O VAL B 109 3.005 9.067 -4.323 1.00 0.00 O ATOM 1329 CB VAL B 109 5.655 7.764 -5.845 1.00 0.00 C ATOM 1330 CG1 VAL B 109 4.428 7.194 -6.542 1.00 0.00 C ATOM 1331 CG2 VAL B 109 6.733 8.102 -6.859 1.00 0.00 C ATOM 0 H VAL B 109 7.303 8.997 -4.431 1.00 0.00 H new ATOM 0 HA VAL B 109 4.963 9.804 -5.703 1.00 0.00 H new ATOM 0 HB VAL B 109 6.035 7.004 -5.163 1.00 0.00 H new ATOM 0 HG11 VAL B 109 4.712 6.310 -7.114 1.00 0.00 H new ATOM 0 HG12 VAL B 109 3.681 6.920 -5.797 1.00 0.00 H new ATOM 0 HG13 VAL B 109 4.011 7.943 -7.215 1.00 0.00 H new ATOM 0 HG21 VAL B 109 6.983 7.211 -7.435 1.00 0.00 H new ATOM 0 HG22 VAL B 109 6.369 8.879 -7.532 1.00 0.00 H new ATOM 0 HG23 VAL B 109 7.622 8.460 -6.339 1.00 0.00 H new ATOM 1341 N TYR B 110 4.455 8.000 -2.982 1.00 0.00 N ATOM 1342 CA TYR B 110 3.438 7.650 -2.004 1.00 0.00 C ATOM 1343 C TYR B 110 2.809 8.913 -1.416 1.00 0.00 C ATOM 1344 O TYR B 110 1.625 8.933 -1.079 1.00 0.00 O ATOM 1345 CB TYR B 110 4.027 6.787 -0.883 1.00 0.00 C ATOM 1346 CG TYR B 110 4.315 5.342 -1.252 1.00 0.00 C ATOM 1347 CD1 TYR B 110 3.468 4.627 -2.089 1.00 0.00 C ATOM 1348 CD2 TYR B 110 5.419 4.682 -0.724 1.00 0.00 C ATOM 1349 CE1 TYR B 110 3.710 3.301 -2.390 1.00 0.00 C ATOM 1350 CE2 TYR B 110 5.672 3.357 -1.027 1.00 0.00 C ATOM 1351 CZ TYR B 110 4.814 2.672 -1.859 1.00 0.00 C ATOM 1352 OH TYR B 110 5.050 1.347 -2.150 1.00 0.00 O ATOM 0 H TYR B 110 5.395 7.675 -2.753 1.00 0.00 H new ATOM 0 HA TYR B 110 2.667 7.072 -2.513 1.00 0.00 H new ATOM 0 HB2 TYR B 110 4.954 7.248 -0.542 1.00 0.00 H new ATOM 0 HB3 TYR B 110 3.337 6.798 -0.039 1.00 0.00 H new ATOM 0 HD1 TYR B 110 2.604 5.117 -2.512 1.00 0.00 H new ATOM 0 HD2 TYR B 110 6.090 5.213 -0.066 1.00 0.00 H new ATOM 0 HE1 TYR B 110 3.037 2.760 -3.039 1.00 0.00 H new ATOM 0 HE2 TYR B 110 6.538 2.861 -0.613 1.00 0.00 H new ATOM 0 HH TYR B 110 5.869 1.054 -1.699 1.00 0.00 H new ATOM 1362 N LYS B 111 3.606 9.971 -1.311 1.00 0.00 N ATOM 1363 CA LYS B 111 3.119 11.248 -0.804 1.00 0.00 C ATOM 1364 C LYS B 111 2.150 11.875 -1.801 1.00 0.00 C ATOM 1365 O LYS B 111 1.151 12.484 -1.413 1.00 0.00 O ATOM 1366 CB LYS B 111 4.294 12.192 -0.530 1.00 0.00 C ATOM 1367 CG LYS B 111 3.900 13.480 0.180 1.00 0.00 C ATOM 1368 CD LYS B 111 5.102 14.380 0.450 1.00 0.00 C ATOM 1369 CE LYS B 111 5.915 13.937 1.667 1.00 0.00 C ATOM 1370 NZ LYS B 111 6.565 12.608 1.486 1.00 0.00 N ATOM 0 H LYS B 111 4.592 9.969 -1.570 1.00 0.00 H new ATOM 0 HA LYS B 111 2.589 11.076 0.133 1.00 0.00 H new ATOM 0 HB2 LYS B 111 5.035 11.668 0.074 1.00 0.00 H new ATOM 0 HB3 LYS B 111 4.774 12.443 -1.476 1.00 0.00 H new ATOM 0 HG2 LYS B 111 3.173 14.020 -0.427 1.00 0.00 H new ATOM 0 HG3 LYS B 111 3.410 13.238 1.123 1.00 0.00 H new ATOM 0 HD2 LYS B 111 5.747 14.389 -0.428 1.00 0.00 H new ATOM 0 HD3 LYS B 111 4.757 15.403 0.602 1.00 0.00 H new ATOM 0 HE2 LYS B 111 6.681 14.684 1.876 1.00 0.00 H new ATOM 0 HE3 LYS B 111 5.261 13.899 2.538 1.00 0.00 H new ATOM 0 HZ1 LYS B 111 7.446 12.574 2.038 1.00 0.00 H new ATOM 0 HZ2 LYS B 111 5.922 11.859 1.815 1.00 0.00 H new ATOM 0 HZ3 LYS B 111 6.781 12.461 0.479 1.00 0.00 H new ATOM 1384 N LYS B 112 2.451 11.710 -3.085 1.00 0.00 N ATOM 1385 CA LYS B 112 1.581 12.189 -4.153 1.00 0.00 C ATOM 1386 C LYS B 112 0.231 11.487 -4.095 1.00 0.00 C ATOM 1387 O LYS B 112 -0.815 12.112 -4.284 1.00 0.00 O ATOM 1388 CB LYS B 112 2.230 11.944 -5.517 1.00 0.00 C ATOM 1389 CG LYS B 112 3.534 12.695 -5.724 1.00 0.00 C ATOM 1390 CD LYS B 112 4.331 12.155 -6.908 1.00 0.00 C ATOM 1391 CE LYS B 112 3.685 12.456 -8.257 1.00 0.00 C ATOM 1392 NZ LYS B 112 2.515 11.582 -8.550 1.00 0.00 N ATOM 0 H LYS B 112 3.297 11.245 -3.413 1.00 0.00 H new ATOM 0 HA LYS B 112 1.430 13.260 -4.017 1.00 0.00 H new ATOM 0 HB2 LYS B 112 2.415 10.876 -5.633 1.00 0.00 H new ATOM 0 HB3 LYS B 112 1.528 12.233 -6.299 1.00 0.00 H new ATOM 0 HG2 LYS B 112 3.321 13.752 -5.884 1.00 0.00 H new ATOM 0 HG3 LYS B 112 4.139 12.625 -4.820 1.00 0.00 H new ATOM 0 HD2 LYS B 112 5.333 12.584 -6.889 1.00 0.00 H new ATOM 0 HD3 LYS B 112 4.444 11.076 -6.800 1.00 0.00 H new ATOM 0 HE2 LYS B 112 3.367 13.498 -8.277 1.00 0.00 H new ATOM 0 HE3 LYS B 112 4.428 12.335 -9.045 1.00 0.00 H new ATOM 0 HZ1 LYS B 112 2.566 11.253 -9.535 1.00 0.00 H new ATOM 0 HZ2 LYS B 112 2.525 10.762 -7.910 1.00 0.00 H new ATOM 0 HZ3 LYS B 112 1.636 12.120 -8.410 1.00 0.00 H new ATOM 1406 N GLU B 113 0.263 10.185 -3.820 1.00 0.00 N ATOM 1407 CA GLU B 113 -0.955 9.392 -3.725 1.00 0.00 C ATOM 1408 C GLU B 113 -1.869 9.943 -2.647 1.00 0.00 C ATOM 1409 O GLU B 113 -3.058 10.121 -2.870 1.00 0.00 O ATOM 1410 CB GLU B 113 -0.644 7.925 -3.426 1.00 0.00 C ATOM 1411 CG GLU B 113 0.315 7.295 -4.421 1.00 0.00 C ATOM 1412 CD GLU B 113 0.324 5.782 -4.360 1.00 0.00 C ATOM 1413 OE1 GLU B 113 1.409 5.181 -4.495 1.00 0.00 O ATOM 1414 OE2 GLU B 113 -0.759 5.180 -4.191 1.00 0.00 O ATOM 0 H GLU B 113 1.122 9.658 -3.659 1.00 0.00 H new ATOM 0 HA GLU B 113 -1.457 9.451 -4.691 1.00 0.00 H new ATOM 0 HB2 GLU B 113 -0.219 7.848 -2.425 1.00 0.00 H new ATOM 0 HB3 GLU B 113 -1.575 7.358 -3.421 1.00 0.00 H new ATOM 0 HG2 GLU B 113 0.043 7.611 -5.428 1.00 0.00 H new ATOM 0 HG3 GLU B 113 1.322 7.666 -4.231 1.00 0.00 H new ATOM 1421 N ILE B 114 -1.298 10.227 -1.485 1.00 0.00 N ATOM 1422 CA ILE B 114 -2.054 10.748 -0.355 1.00 0.00 C ATOM 1423 C ILE B 114 -2.765 12.054 -0.696 1.00 0.00 C ATOM 1424 O ILE B 114 -3.863 12.309 -0.208 1.00 0.00 O ATOM 1425 CB ILE B 114 -1.124 10.951 0.852 1.00 0.00 C ATOM 1426 CG1 ILE B 114 -0.537 9.604 1.253 1.00 0.00 C ATOM 1427 CG2 ILE B 114 -1.861 11.601 2.015 1.00 0.00 C ATOM 1428 CD1 ILE B 114 0.449 9.684 2.391 1.00 0.00 C ATOM 0 H ILE B 114 -0.303 10.104 -1.299 1.00 0.00 H new ATOM 0 HA ILE B 114 -2.820 10.014 -0.105 1.00 0.00 H new ATOM 0 HB ILE B 114 -0.316 11.628 0.574 1.00 0.00 H new ATOM 0 HG12 ILE B 114 -1.349 8.934 1.535 1.00 0.00 H new ATOM 0 HG13 ILE B 114 -0.044 9.161 0.388 1.00 0.00 H new ATOM 0 HG21 ILE B 114 -1.176 11.731 2.853 1.00 0.00 H new ATOM 0 HG22 ILE B 114 -2.244 12.573 1.705 1.00 0.00 H new ATOM 0 HG23 ILE B 114 -2.691 10.965 2.321 1.00 0.00 H new ATOM 0 HD11 ILE B 114 0.823 8.686 2.619 1.00 0.00 H new ATOM 0 HD12 ILE B 114 1.282 10.327 2.107 1.00 0.00 H new ATOM 0 HD13 ILE B 114 -0.044 10.097 3.271 1.00 0.00 H new ATOM 1440 N GLN B 115 -2.149 12.871 -1.540 1.00 0.00 N ATOM 1441 CA GLN B 115 -2.763 14.118 -1.972 1.00 0.00 C ATOM 1442 C GLN B 115 -3.987 13.827 -2.825 1.00 0.00 C ATOM 1443 O GLN B 115 -5.036 14.454 -2.671 1.00 0.00 O ATOM 1444 CB GLN B 115 -1.777 14.950 -2.770 1.00 0.00 C ATOM 1445 CG GLN B 115 -0.450 15.144 -2.071 1.00 0.00 C ATOM 1446 CD GLN B 115 0.383 16.217 -2.731 1.00 0.00 C ATOM 1447 OE1 GLN B 115 1.186 16.889 -2.085 1.00 0.00 O ATOM 1448 NE2 GLN B 115 0.194 16.395 -4.026 1.00 0.00 N ATOM 0 H GLN B 115 -1.227 12.693 -1.938 1.00 0.00 H new ATOM 0 HA GLN B 115 -3.062 14.678 -1.086 1.00 0.00 H new ATOM 0 HB2 GLN B 115 -1.605 14.470 -3.734 1.00 0.00 H new ATOM 0 HB3 GLN B 115 -2.218 15.926 -2.974 1.00 0.00 H new ATOM 0 HG2 GLN B 115 -0.624 15.410 -1.028 1.00 0.00 H new ATOM 0 HG3 GLN B 115 0.102 14.204 -2.072 1.00 0.00 H new ATOM 0 HE21 GLN B 115 -0.481 15.817 -4.527 1.00 0.00 H new ATOM 0 HE22 GLN B 115 0.723 17.110 -4.525 1.00 0.00 H new ATOM 1457 N ALA B 116 -3.829 12.867 -3.722 1.00 0.00 N ATOM 1458 CA ALA B 116 -4.924 12.404 -4.559 1.00 0.00 C ATOM 1459 C ALA B 116 -6.021 11.792 -3.702 1.00 0.00 C ATOM 1460 O ALA B 116 -7.198 12.128 -3.835 1.00 0.00 O ATOM 1461 CB ALA B 116 -4.411 11.381 -5.561 1.00 0.00 C ATOM 0 H ALA B 116 -2.944 12.389 -3.890 1.00 0.00 H new ATOM 0 HA ALA B 116 -5.339 13.255 -5.099 1.00 0.00 H new ATOM 0 HB1 ALA B 116 -5.236 11.038 -6.185 1.00 0.00 H new ATOM 0 HB2 ALA B 116 -3.647 11.839 -6.189 1.00 0.00 H new ATOM 0 HB3 ALA B 116 -3.982 10.533 -5.028 1.00 0.00 H new ATOM 1467 N LEU B 117 -5.605 10.915 -2.803 1.00 0.00 N ATOM 1468 CA LEU B 117 -6.511 10.232 -1.895 1.00 0.00 C ATOM 1469 C LEU B 117 -7.236 11.235 -1.010 1.00 0.00 C ATOM 1470 O LEU B 117 -8.378 11.021 -0.627 1.00 0.00 O ATOM 1471 CB LEU B 117 -5.725 9.231 -1.040 1.00 0.00 C ATOM 1472 CG LEU B 117 -4.990 8.147 -1.833 1.00 0.00 C ATOM 1473 CD1 LEU B 117 -4.178 7.257 -0.911 1.00 0.00 C ATOM 1474 CD2 LEU B 117 -5.963 7.312 -2.646 1.00 0.00 C ATOM 0 H LEU B 117 -4.626 10.656 -2.682 1.00 0.00 H new ATOM 0 HA LEU B 117 -7.258 9.693 -2.478 1.00 0.00 H new ATOM 0 HB2 LEU B 117 -4.998 9.779 -0.441 1.00 0.00 H new ATOM 0 HB3 LEU B 117 -6.413 8.749 -0.345 1.00 0.00 H new ATOM 0 HG LEU B 117 -4.308 8.646 -2.521 1.00 0.00 H new ATOM 0 HD11 LEU B 117 -3.666 6.495 -1.499 1.00 0.00 H new ATOM 0 HD12 LEU B 117 -3.443 7.860 -0.378 1.00 0.00 H new ATOM 0 HD13 LEU B 117 -4.842 6.776 -0.193 1.00 0.00 H new ATOM 0 HD21 LEU B 117 -5.414 6.550 -3.199 1.00 0.00 H new ATOM 0 HD22 LEU B 117 -6.677 6.831 -1.977 1.00 0.00 H new ATOM 0 HD23 LEU B 117 -6.497 7.954 -3.346 1.00 0.00 H new ATOM 1486 N ASP B 118 -6.567 12.340 -0.715 1.00 0.00 N ATOM 1487 CA ASP B 118 -7.128 13.398 0.120 1.00 0.00 C ATOM 1488 C ASP B 118 -8.389 13.997 -0.502 1.00 0.00 C ATOM 1489 O ASP B 118 -9.319 14.381 0.207 1.00 0.00 O ATOM 1490 CB ASP B 118 -6.077 14.483 0.353 1.00 0.00 C ATOM 1491 CG ASP B 118 -6.631 15.699 1.058 1.00 0.00 C ATOM 1492 OD1 ASP B 118 -6.913 16.703 0.374 1.00 0.00 O ATOM 1493 OD2 ASP B 118 -6.779 15.660 2.296 1.00 0.00 O ATOM 0 H ASP B 118 -5.621 12.531 -1.046 1.00 0.00 H new ATOM 0 HA ASP B 118 -7.414 12.961 1.077 1.00 0.00 H new ATOM 0 HB2 ASP B 118 -5.260 14.069 0.943 1.00 0.00 H new ATOM 0 HB3 ASP B 118 -5.656 14.786 -0.606 1.00 0.00 H new ATOM 1498 N ALA B 119 -8.426 14.065 -1.826 1.00 0.00 N ATOM 1499 CA ALA B 119 -9.621 14.520 -2.522 1.00 0.00 C ATOM 1500 C ALA B 119 -10.739 13.505 -2.323 1.00 0.00 C ATOM 1501 O ALA B 119 -11.897 13.852 -2.070 1.00 0.00 O ATOM 1502 CB ALA B 119 -9.332 14.722 -4.000 1.00 0.00 C ATOM 0 H ALA B 119 -7.648 13.813 -2.436 1.00 0.00 H new ATOM 0 HA ALA B 119 -9.935 15.479 -2.109 1.00 0.00 H new ATOM 0 HB1 ALA B 119 -10.236 15.062 -4.504 1.00 0.00 H new ATOM 0 HB2 ALA B 119 -8.548 15.469 -4.119 1.00 0.00 H new ATOM 0 HB3 ALA B 119 -9.004 13.780 -4.439 1.00 0.00 H new ATOM 1508 N GLU B 120 -10.375 12.240 -2.411 1.00 0.00 N ATOM 1509 CA GLU B 120 -11.296 11.160 -2.145 1.00 0.00 C ATOM 1510 C GLU B 120 -11.739 11.168 -0.682 1.00 0.00 C ATOM 1511 O GLU B 120 -12.820 10.704 -0.355 1.00 0.00 O ATOM 1512 CB GLU B 120 -10.664 9.824 -2.494 1.00 0.00 C ATOM 1513 CG GLU B 120 -10.730 9.442 -3.962 1.00 0.00 C ATOM 1514 CD GLU B 120 -9.906 10.333 -4.868 1.00 0.00 C ATOM 1515 OE1 GLU B 120 -8.795 9.914 -5.264 1.00 0.00 O ATOM 1516 OE2 GLU B 120 -10.377 11.435 -5.210 1.00 0.00 O ATOM 0 H GLU B 120 -9.436 11.936 -2.668 1.00 0.00 H new ATOM 0 HA GLU B 120 -12.176 11.306 -2.771 1.00 0.00 H new ATOM 0 HB2 GLU B 120 -9.618 9.843 -2.187 1.00 0.00 H new ATOM 0 HB3 GLU B 120 -11.154 9.045 -1.910 1.00 0.00 H new ATOM 0 HG2 GLU B 120 -10.390 8.413 -4.075 1.00 0.00 H new ATOM 0 HG3 GLU B 120 -11.770 9.472 -4.288 1.00 0.00 H new ATOM 1523 N ILE B 121 -10.896 11.677 0.203 1.00 0.00 N ATOM 1524 CA ILE B 121 -11.282 11.837 1.601 1.00 0.00 C ATOM 1525 C ILE B 121 -12.547 12.685 1.704 1.00 0.00 C ATOM 1526 O ILE B 121 -13.382 12.461 2.577 1.00 0.00 O ATOM 1527 CB ILE B 121 -10.133 12.442 2.454 1.00 0.00 C ATOM 1528 CG1 ILE B 121 -9.358 11.334 3.164 1.00 0.00 C ATOM 1529 CG2 ILE B 121 -10.649 13.448 3.468 1.00 0.00 C ATOM 1530 CD1 ILE B 121 -8.701 10.355 2.222 1.00 0.00 C ATOM 0 H ILE B 121 -9.948 11.984 -0.016 1.00 0.00 H new ATOM 0 HA ILE B 121 -11.490 10.847 2.006 1.00 0.00 H new ATOM 0 HB ILE B 121 -9.466 12.970 1.773 1.00 0.00 H new ATOM 0 HG12 ILE B 121 -8.593 11.785 3.797 1.00 0.00 H new ATOM 0 HG13 ILE B 121 -10.037 10.792 3.822 1.00 0.00 H new ATOM 0 HG21 ILE B 121 -9.813 13.846 4.043 1.00 0.00 H new ATOM 0 HG22 ILE B 121 -11.153 14.263 2.948 1.00 0.00 H new ATOM 0 HG23 ILE B 121 -11.352 12.958 4.142 1.00 0.00 H new ATOM 0 HD11 ILE B 121 -8.169 9.597 2.797 1.00 0.00 H new ATOM 0 HD12 ILE B 121 -9.462 9.876 1.607 1.00 0.00 H new ATOM 0 HD13 ILE B 121 -7.996 10.884 1.581 1.00 0.00 H new ATOM 1542 N ARG B 122 -12.704 13.630 0.781 1.00 0.00 N ATOM 1543 CA ARG B 122 -13.911 14.442 0.719 1.00 0.00 C ATOM 1544 C ARG B 122 -15.140 13.560 0.491 1.00 0.00 C ATOM 1545 O ARG B 122 -16.179 13.762 1.125 1.00 0.00 O ATOM 1546 CB ARG B 122 -13.795 15.498 -0.383 1.00 0.00 C ATOM 1547 CG ARG B 122 -15.045 16.345 -0.559 1.00 0.00 C ATOM 1548 CD ARG B 122 -14.826 17.448 -1.582 1.00 0.00 C ATOM 1549 NE ARG B 122 -13.838 18.426 -1.126 1.00 0.00 N ATOM 1550 CZ ARG B 122 -12.950 19.019 -1.926 1.00 0.00 C ATOM 1551 NH1 ARG B 122 -12.902 18.717 -3.217 1.00 0.00 N ATOM 1552 NH2 ARG B 122 -12.108 19.917 -1.432 1.00 0.00 N ATOM 0 H ARG B 122 -12.010 13.851 0.067 1.00 0.00 H new ATOM 0 HA ARG B 122 -14.028 14.955 1.673 1.00 0.00 H new ATOM 0 HB2 ARG B 122 -12.953 16.153 -0.158 1.00 0.00 H new ATOM 0 HB3 ARG B 122 -13.569 15.001 -1.326 1.00 0.00 H new ATOM 0 HG2 ARG B 122 -15.874 15.712 -0.876 1.00 0.00 H new ATOM 0 HG3 ARG B 122 -15.327 16.784 0.398 1.00 0.00 H new ATOM 0 HD2 ARG B 122 -14.495 17.010 -2.524 1.00 0.00 H new ATOM 0 HD3 ARG B 122 -15.772 17.952 -1.780 1.00 0.00 H new ATOM 0 HE ARG B 122 -13.827 18.669 -0.136 1.00 0.00 H new ATOM 0 HH11 ARG B 122 -13.547 18.028 -3.604 1.00 0.00 H new ATOM 0 HH12 ARG B 122 -12.221 19.174 -3.823 1.00 0.00 H new ATOM 0 HH21 ARG B 122 -12.139 20.154 -0.440 1.00 0.00 H new ATOM 0 HH22 ARG B 122 -11.429 20.370 -2.044 1.00 0.00 H new ATOM 1566 N LYS B 123 -15.023 12.571 -0.398 1.00 0.00 N ATOM 1567 CA LYS B 123 -16.135 11.650 -0.642 1.00 0.00 C ATOM 1568 C LYS B 123 -16.373 10.785 0.595 1.00 0.00 C ATOM 1569 O LYS B 123 -17.515 10.487 0.948 1.00 0.00 O ATOM 1570 CB LYS B 123 -15.873 10.771 -1.874 1.00 0.00 C ATOM 1571 CG LYS B 123 -15.006 9.545 -1.605 1.00 0.00 C ATOM 1572 CD LYS B 123 -14.465 8.903 -2.862 1.00 0.00 C ATOM 1573 CE LYS B 123 -14.496 9.865 -4.019 1.00 0.00 C ATOM 1574 NZ LYS B 123 -14.100 9.240 -5.305 1.00 0.00 N ATOM 0 H LYS B 123 -14.186 12.389 -0.952 1.00 0.00 H new ATOM 0 HA LYS B 123 -17.030 12.239 -0.843 1.00 0.00 H new ATOM 0 HB2 LYS B 123 -16.830 10.442 -2.279 1.00 0.00 H new ATOM 0 HB3 LYS B 123 -15.393 11.378 -2.642 1.00 0.00 H new ATOM 0 HG2 LYS B 123 -14.172 9.833 -0.965 1.00 0.00 H new ATOM 0 HG3 LYS B 123 -15.592 8.809 -1.054 1.00 0.00 H new ATOM 0 HD2 LYS B 123 -13.442 8.568 -2.691 1.00 0.00 H new ATOM 0 HD3 LYS B 123 -15.054 8.019 -3.105 1.00 0.00 H new ATOM 0 HE2 LYS B 123 -15.501 10.276 -4.116 1.00 0.00 H new ATOM 0 HE3 LYS B 123 -13.829 10.701 -3.807 1.00 0.00 H new ATOM 0 HZ1 LYS B 123 -13.329 9.790 -5.735 1.00 0.00 H new ATOM 0 HZ2 LYS B 123 -13.777 8.266 -5.133 1.00 0.00 H new ATOM 0 HZ3 LYS B 123 -14.916 9.225 -5.950 1.00 0.00 H new ATOM 1588 N LEU B 124 -15.285 10.399 1.253 1.00 0.00 N ATOM 1589 CA LEU B 124 -15.368 9.645 2.494 1.00 0.00 C ATOM 1590 C LEU B 124 -16.114 10.443 3.549 1.00 0.00 C ATOM 1591 O LEU B 124 -17.084 9.956 4.129 1.00 0.00 O ATOM 1592 CB LEU B 124 -13.972 9.288 3.011 1.00 0.00 C ATOM 1593 CG LEU B 124 -13.202 8.256 2.185 1.00 0.00 C ATOM 1594 CD1 LEU B 124 -11.815 8.041 2.770 1.00 0.00 C ATOM 1595 CD2 LEU B 124 -13.963 6.944 2.138 1.00 0.00 C ATOM 0 H LEU B 124 -14.333 10.598 0.944 1.00 0.00 H new ATOM 0 HA LEU B 124 -15.912 8.723 2.290 1.00 0.00 H new ATOM 0 HB2 LEU B 124 -13.379 10.201 3.062 1.00 0.00 H new ATOM 0 HB3 LEU B 124 -14.067 8.913 4.030 1.00 0.00 H new ATOM 0 HG LEU B 124 -13.096 8.633 1.168 1.00 0.00 H new ATOM 0 HD11 LEU B 124 -11.278 7.304 2.172 1.00 0.00 H new ATOM 0 HD12 LEU B 124 -11.267 8.983 2.763 1.00 0.00 H new ATOM 0 HD13 LEU B 124 -11.904 7.681 3.795 1.00 0.00 H new ATOM 0 HD21 LEU B 124 -13.403 6.219 1.547 1.00 0.00 H new ATOM 0 HD22 LEU B 124 -14.094 6.563 3.151 1.00 0.00 H new ATOM 0 HD23 LEU B 124 -14.940 7.106 1.683 1.00 0.00 H new ATOM 1607 N GLU B 125 -15.673 11.681 3.767 1.00 0.00 N ATOM 1608 CA GLU B 125 -16.256 12.549 4.787 1.00 0.00 C ATOM 1609 C GLU B 125 -17.762 12.695 4.612 1.00 0.00 C ATOM 1610 O GLU B 125 -18.479 12.940 5.577 1.00 0.00 O ATOM 1611 CB GLU B 125 -15.594 13.926 4.775 1.00 0.00 C ATOM 1612 CG GLU B 125 -14.135 13.902 5.197 1.00 0.00 C ATOM 1613 CD GLU B 125 -13.568 15.290 5.395 1.00 0.00 C ATOM 1614 OE1 GLU B 125 -12.902 15.808 4.474 1.00 0.00 O ATOM 1615 OE2 GLU B 125 -13.792 15.878 6.475 1.00 0.00 O ATOM 0 H GLU B 125 -14.907 12.108 3.245 1.00 0.00 H new ATOM 0 HA GLU B 125 -16.072 12.076 5.752 1.00 0.00 H new ATOM 0 HB2 GLU B 125 -15.667 14.346 3.772 1.00 0.00 H new ATOM 0 HB3 GLU B 125 -16.145 14.591 5.440 1.00 0.00 H new ATOM 0 HG2 GLU B 125 -14.037 13.337 6.124 1.00 0.00 H new ATOM 0 HG3 GLU B 125 -13.550 13.378 4.441 1.00 0.00 H new ATOM 1622 N ARG B 126 -18.237 12.535 3.381 1.00 0.00 N ATOM 1623 CA ARG B 126 -19.669 12.541 3.111 1.00 0.00 C ATOM 1624 C ARG B 126 -20.363 11.460 3.935 1.00 0.00 C ATOM 1625 O ARG B 126 -21.304 11.742 4.674 1.00 0.00 O ATOM 1626 CB ARG B 126 -19.944 12.319 1.622 1.00 0.00 C ATOM 1627 CG ARG B 126 -19.484 13.463 0.735 1.00 0.00 C ATOM 1628 CD ARG B 126 -19.680 13.147 -0.740 1.00 0.00 C ATOM 1629 NE ARG B 126 -21.072 12.832 -1.060 1.00 0.00 N ATOM 1630 CZ ARG B 126 -21.583 12.867 -2.291 1.00 0.00 C ATOM 1631 NH1 ARG B 126 -20.837 13.255 -3.321 1.00 0.00 N ATOM 1632 NH2 ARG B 126 -22.852 12.529 -2.487 1.00 0.00 N ATOM 0 H ARG B 126 -17.652 12.400 2.556 1.00 0.00 H new ATOM 0 HA ARG B 126 -20.065 13.517 3.393 1.00 0.00 H new ATOM 0 HB2 ARG B 126 -19.447 11.403 1.303 1.00 0.00 H new ATOM 0 HB3 ARG B 126 -21.014 12.168 1.478 1.00 0.00 H new ATOM 0 HG2 ARG B 126 -20.038 14.366 0.990 1.00 0.00 H new ATOM 0 HG3 ARG B 126 -18.431 13.670 0.926 1.00 0.00 H new ATOM 0 HD2 ARG B 126 -19.356 13.999 -1.338 1.00 0.00 H new ATOM 0 HD3 ARG B 126 -19.046 12.304 -1.016 1.00 0.00 H new ATOM 0 HE ARG B 126 -21.691 12.569 -0.293 1.00 0.00 H new ATOM 0 HH11 ARG B 126 -19.866 13.529 -3.173 1.00 0.00 H new ATOM 0 HH12 ARG B 126 -21.236 13.279 -4.259 1.00 0.00 H new ATOM 0 HH21 ARG B 126 -23.432 12.244 -1.698 1.00 0.00 H new ATOM 0 HH22 ARG B 126 -23.247 12.554 -3.427 1.00 0.00 H new ATOM 1646 N LEU B 127 -19.873 10.228 3.819 1.00 0.00 N ATOM 1647 CA LEU B 127 -20.425 9.103 4.574 1.00 0.00 C ATOM 1648 C LEU B 127 -20.252 9.319 6.075 1.00 0.00 C ATOM 1649 O LEU B 127 -21.197 9.139 6.845 1.00 0.00 O ATOM 1650 CB LEU B 127 -19.765 7.780 4.161 1.00 0.00 C ATOM 1651 CG LEU B 127 -20.230 7.177 2.826 1.00 0.00 C ATOM 1652 CD1 LEU B 127 -21.716 6.858 2.866 1.00 0.00 C ATOM 1653 CD2 LEU B 127 -19.918 8.105 1.664 1.00 0.00 C ATOM 0 H LEU B 127 -19.094 9.982 3.209 1.00 0.00 H new ATOM 0 HA LEU B 127 -21.489 9.047 4.345 1.00 0.00 H new ATOM 0 HB2 LEU B 127 -18.687 7.936 4.109 1.00 0.00 H new ATOM 0 HB3 LEU B 127 -19.944 7.048 4.948 1.00 0.00 H new ATOM 0 HG LEU B 127 -19.680 6.248 2.674 1.00 0.00 H new ATOM 0 HD11 LEU B 127 -22.023 6.432 1.911 1.00 0.00 H new ATOM 0 HD12 LEU B 127 -21.913 6.141 3.663 1.00 0.00 H new ATOM 0 HD13 LEU B 127 -22.279 7.772 3.053 1.00 0.00 H new ATOM 0 HD21 LEU B 127 -20.259 7.651 0.734 1.00 0.00 H new ATOM 0 HD22 LEU B 127 -20.428 9.057 1.811 1.00 0.00 H new ATOM 0 HD23 LEU B 127 -18.842 8.274 1.612 1.00 0.00 H new ATOM 1665 N LEU B 128 -19.035 9.673 6.484 1.00 0.00 N ATOM 1666 CA LEU B 128 -18.733 10.028 7.862 1.00 0.00 C ATOM 1667 C LEU B 128 -19.758 11.000 8.443 1.00 0.00 C ATOM 1668 O LEU B 128 -20.483 10.658 9.379 1.00 0.00 O ATOM 1669 CB LEU B 128 -17.339 10.652 7.925 1.00 0.00 C ATOM 1670 CG LEU B 128 -16.164 9.666 7.888 1.00 0.00 C ATOM 1671 CD1 LEU B 128 -16.147 8.828 6.622 1.00 0.00 C ATOM 1672 CD2 LEU B 128 -14.849 10.413 8.043 1.00 0.00 C ATOM 0 H LEU B 128 -18.228 9.721 5.862 1.00 0.00 H new ATOM 0 HA LEU B 128 -18.771 9.117 8.460 1.00 0.00 H new ATOM 0 HB2 LEU B 128 -17.234 11.345 7.090 1.00 0.00 H new ATOM 0 HB3 LEU B 128 -17.266 11.241 8.839 1.00 0.00 H new ATOM 0 HG LEU B 128 -16.294 8.979 8.724 1.00 0.00 H new ATOM 0 HD11 LEU B 128 -15.296 8.148 6.647 1.00 0.00 H new ATOM 0 HD12 LEU B 128 -17.070 8.252 6.554 1.00 0.00 H new ATOM 0 HD13 LEU B 128 -16.063 9.482 5.754 1.00 0.00 H new ATOM 0 HD21 LEU B 128 -14.022 9.703 8.015 1.00 0.00 H new ATOM 0 HD22 LEU B 128 -14.740 11.130 7.229 1.00 0.00 H new ATOM 0 HD23 LEU B 128 -14.841 10.942 8.996 1.00 0.00 H new ATOM 1684 N GLU B 129 -19.823 12.199 7.878 1.00 0.00 N ATOM 1685 CA GLU B 129 -20.717 13.244 8.380 1.00 0.00 C ATOM 1686 C GLU B 129 -22.182 12.811 8.352 1.00 0.00 C ATOM 1687 O GLU B 129 -22.953 13.163 9.246 1.00 0.00 O ATOM 1688 CB GLU B 129 -20.541 14.534 7.581 1.00 0.00 C ATOM 1689 CG GLU B 129 -19.186 15.191 7.776 1.00 0.00 C ATOM 1690 CD GLU B 129 -19.114 16.572 7.159 1.00 0.00 C ATOM 1691 OE1 GLU B 129 -18.635 16.699 6.015 1.00 0.00 O ATOM 1692 OE2 GLU B 129 -19.551 17.542 7.813 1.00 0.00 O ATOM 0 H GLU B 129 -19.267 12.476 7.069 1.00 0.00 H new ATOM 0 HA GLU B 129 -20.443 13.424 9.420 1.00 0.00 H new ATOM 0 HB2 GLU B 129 -20.681 14.317 6.522 1.00 0.00 H new ATOM 0 HB3 GLU B 129 -21.322 15.239 7.868 1.00 0.00 H new ATOM 0 HG2 GLU B 129 -18.971 15.262 8.842 1.00 0.00 H new ATOM 0 HG3 GLU B 129 -18.414 14.560 7.336 1.00 0.00 H new ATOM 1699 N SER B 130 -22.565 12.047 7.335 1.00 0.00 N ATOM 1700 CA SER B 130 -23.928 11.582 7.197 1.00 0.00 C ATOM 1701 C SER B 130 -24.304 10.582 8.291 1.00 0.00 C ATOM 1702 O SER B 130 -25.484 10.359 8.558 1.00 0.00 O ATOM 1703 CB SER B 130 -24.100 10.962 5.820 1.00 0.00 C ATOM 1704 OG SER B 130 -23.914 11.930 4.797 1.00 0.00 O ATOM 0 H SER B 130 -21.939 11.738 6.591 1.00 0.00 H new ATOM 0 HA SER B 130 -24.599 12.434 7.306 1.00 0.00 H new ATOM 0 HB2 SER B 130 -23.384 10.150 5.691 1.00 0.00 H new ATOM 0 HB3 SER B 130 -25.095 10.526 5.736 1.00 0.00 H new ATOM 0 HG SER B 130 -22.958 12.014 4.596 1.00 0.00 H new ATOM 1710 N GLY B 131 -23.303 9.987 8.928 1.00 0.00 N ATOM 1711 CA GLY B 131 -23.565 9.066 10.015 1.00 0.00 C ATOM 1712 C GLY B 131 -23.178 7.643 9.680 1.00 0.00 C ATOM 1713 O GLY B 131 -22.994 6.814 10.573 1.00 0.00 O ATOM 0 H GLY B 131 -22.316 10.126 8.711 1.00 0.00 H new ATOM 0 HA2 GLY B 131 -23.016 9.389 10.900 1.00 0.00 H new ATOM 0 HA3 GLY B 131 -24.625 9.100 10.267 1.00 0.00 H new ATOM 1717 N LEU B 132 -23.045 7.361 8.392 1.00 0.00 N ATOM 1718 CA LEU B 132 -22.683 6.033 7.932 1.00 0.00 C ATOM 1719 C LEU B 132 -21.290 5.680 8.443 1.00 0.00 C ATOM 1720 O LEU B 132 -21.110 4.664 9.113 1.00 0.00 O ATOM 1721 CB LEU B 132 -22.749 5.986 6.396 1.00 0.00 C ATOM 1722 CG LEU B 132 -22.660 4.599 5.743 1.00 0.00 C ATOM 1723 CD1 LEU B 132 -21.233 4.080 5.766 1.00 0.00 C ATOM 1724 CD2 LEU B 132 -23.597 3.616 6.433 1.00 0.00 C ATOM 0 H LEU B 132 -23.184 8.041 7.644 1.00 0.00 H new ATOM 0 HA LEU B 132 -23.384 5.296 8.323 1.00 0.00 H new ATOM 0 HB2 LEU B 132 -23.683 6.451 6.081 1.00 0.00 H new ATOM 0 HB3 LEU B 132 -21.939 6.600 6.002 1.00 0.00 H new ATOM 0 HG LEU B 132 -22.970 4.697 4.703 1.00 0.00 H new ATOM 0 HD11 LEU B 132 -21.196 3.096 5.298 1.00 0.00 H new ATOM 0 HD12 LEU B 132 -20.587 4.767 5.219 1.00 0.00 H new ATOM 0 HD13 LEU B 132 -20.890 4.004 6.798 1.00 0.00 H new ATOM 0 HD21 LEU B 132 -23.517 2.640 5.954 1.00 0.00 H new ATOM 0 HD22 LEU B 132 -23.322 3.528 7.484 1.00 0.00 H new ATOM 0 HD23 LEU B 132 -24.623 3.976 6.355 1.00 0.00 H new ATOM 1736 N THR B 133 -20.328 6.550 8.151 1.00 0.00 N ATOM 1737 CA THR B 133 -18.945 6.363 8.576 1.00 0.00 C ATOM 1738 C THR B 133 -18.347 5.096 7.959 1.00 0.00 C ATOM 1739 O THR B 133 -18.397 4.028 8.601 1.00 0.00 O ATOM 1740 CB THR B 133 -18.839 6.306 10.115 1.00 0.00 C ATOM 1741 OG1 THR B 133 -19.586 7.391 10.693 1.00 0.00 O ATOM 1742 CG2 THR B 133 -17.388 6.394 10.568 1.00 0.00 C ATOM 1743 OXT THR B 133 -17.838 5.176 6.821 1.00 0.00 O ATOM 0 H THR B 133 -20.485 7.403 7.614 1.00 0.00 H new ATOM 0 HA THR B 133 -18.375 7.222 8.223 1.00 0.00 H new ATOM 0 HB THR B 133 -19.249 5.353 10.449 1.00 0.00 H new ATOM 0 HG1 THR B 133 -19.518 7.351 11.670 1.00 0.00 H new ATOM 0 HG21 THR B 133 -17.343 6.351 11.656 1.00 0.00 H new ATOM 0 HG22 THR B 133 -16.825 5.560 10.149 1.00 0.00 H new ATOM 0 HG23 THR B 133 -16.956 7.333 10.224 1.00 0.00 H new TER 1751 THR B 133