USER MOD reduce.3.24.130724 H: found=0, std=0, add=1018, rem=0, adj=10 USER MOD reduce.3.24.130724 removed 1014 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 Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 140:sc= -0.354 (180deg=-1.25) USER MOD Single : A 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 LYS NZ :NH3+ 146:sc= -0.492 (180deg=-2.02!) USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 MET CE :methyl -154:sc= -0.568 (180deg=-0.835) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 CYS SG : rot -101:sc= -0.112 USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 LYS NZ :NH3+ -154:sc= -0.0514 (180deg=-0.445) USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET N :NH3+ 156:sc= -0.0262 (180deg=-0.485) USER MOD Single : B 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 16 LYS NZ :NH3+ -158:sc= 0.815 (180deg=0.513) USER MOD Single : B 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 38 MET CE :methyl -118:sc= -0.441 (180deg=-3.32!) USER MOD Single : B 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 41 CYS SG : rot -65:sc= 0.591 USER MOD Single : B 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 47 LYS NZ :NH3+ 170:sc= 0.695 (180deg=0.628) USER MOD Single : B 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -7.448 8.680 -3.846 1.00 44.04 N ATOM 2 CA MET A 1 -8.703 8.831 -4.575 1.00 11.35 C ATOM 3 C MET A 1 -9.062 7.545 -5.312 1.00 11.02 C ATOM 4 O MET A 1 -9.748 7.574 -6.333 1.00 73.41 O ATOM 5 CB MET A 1 -8.604 9.992 -5.567 1.00 34.01 C ATOM 6 CG MET A 1 -7.727 9.688 -6.771 1.00 54.23 C ATOM 7 SD MET A 1 -7.049 11.177 -7.529 1.00 45.04 S ATOM 8 CE MET A 1 -7.339 10.837 -9.263 1.00 70.33 C ATOM 0 H1 MET A 1 -6.889 9.553 -3.933 1.00 44.04 H new ATOM 0 H2 MET A 1 -7.649 8.496 -2.842 1.00 44.04 H new ATOM 0 H3 MET A 1 -6.910 7.883 -4.242 1.00 44.04 H new ATOM 0 HA MET A 1 -9.491 9.046 -3.853 1.00 11.35 H new ATOM 0 HB2 MET A 1 -9.605 10.250 -5.913 1.00 34.01 H new ATOM 0 HB3 MET A 1 -8.209 10.867 -5.051 1.00 34.01 H new ATOM 0 HG2 MET A 1 -6.909 9.036 -6.465 1.00 54.23 H new ATOM 0 HG3 MET A 1 -8.310 9.141 -7.512 1.00 54.23 H new ATOM 0 HE1 MET A 1 -6.972 11.670 -9.863 1.00 70.33 H new ATOM 0 HE2 MET A 1 -6.814 9.925 -9.548 1.00 70.33 H new ATOM 0 HE3 MET A 1 -8.408 10.709 -9.435 1.00 70.33 H new ATOM 18 N LYS A 2 -8.594 6.418 -4.788 1.00 1.34 N ATOM 19 CA LYS A 2 -8.866 5.120 -5.395 1.00 3.25 C ATOM 20 C LYS A 2 -9.805 4.296 -4.520 1.00 40.41 C ATOM 21 O LYS A 2 -10.770 3.709 -5.009 1.00 62.25 O ATOM 22 CB LYS A 2 -7.559 4.355 -5.621 1.00 12.41 C ATOM 23 CG LYS A 2 -7.265 4.071 -7.083 1.00 63.33 C ATOM 24 CD LYS A 2 -8.297 3.131 -7.686 1.00 24.00 C ATOM 25 CE LYS A 2 -7.814 2.548 -9.006 1.00 53.34 C ATOM 26 NZ LYS A 2 -8.691 2.948 -10.142 1.00 35.34 N ATOM 0 H LYS A 2 -8.024 6.377 -3.943 1.00 1.34 H new ATOM 0 HA LYS A 2 -9.350 5.291 -6.356 1.00 3.25 H new ATOM 0 HB2 LYS A 2 -6.734 4.929 -5.198 1.00 12.41 H new ATOM 0 HB3 LYS A 2 -7.602 3.411 -5.078 1.00 12.41 H new ATOM 0 HG2 LYS A 2 -7.253 5.007 -7.641 1.00 63.33 H new ATOM 0 HG3 LYS A 2 -6.272 3.631 -7.177 1.00 63.33 H new ATOM 0 HD2 LYS A 2 -8.508 2.323 -6.986 1.00 24.00 H new ATOM 0 HD3 LYS A 2 -9.232 3.668 -7.844 1.00 24.00 H new ATOM 0 HE2 LYS A 2 -6.794 2.882 -9.199 1.00 53.34 H new ATOM 0 HE3 LYS A 2 -7.785 1.461 -8.934 1.00 53.34 H new ATOM 0 HZ1 LYS A 2 -8.329 2.531 -11.023 1.00 35.34 H new ATOM 0 HZ2 LYS A 2 -9.659 2.608 -9.970 1.00 35.34 H new ATOM 0 HZ3 LYS A 2 -8.698 3.985 -10.227 1.00 35.34 H new ATOM 40 N LYS A 3 -9.517 4.258 -3.224 1.00 4.20 N ATOM 41 CA LYS A 3 -10.337 3.509 -2.279 1.00 33.42 C ATOM 42 C LYS A 3 -11.053 4.449 -1.314 1.00 44.11 C ATOM 43 O LYS A 3 -11.470 4.042 -0.230 1.00 10.22 O ATOM 44 CB LYS A 3 -9.473 2.518 -1.496 1.00 14.11 C ATOM 45 CG LYS A 3 -8.139 3.093 -1.051 1.00 44.44 C ATOM 46 CD LYS A 3 -7.429 2.169 -0.076 1.00 54.15 C ATOM 47 CE LYS A 3 -7.132 0.817 -0.706 1.00 53.43 C ATOM 48 NZ LYS A 3 -5.722 0.398 -0.479 1.00 61.13 N ATOM 0 H LYS A 3 -8.721 4.738 -2.803 1.00 4.20 H new ATOM 0 HA LYS A 3 -11.088 2.958 -2.846 1.00 33.42 H new ATOM 0 HB2 LYS A 3 -10.025 2.182 -0.618 1.00 14.11 H new ATOM 0 HB3 LYS A 3 -9.292 1.639 -2.115 1.00 14.11 H new ATOM 0 HG2 LYS A 3 -7.505 3.260 -1.922 1.00 44.44 H new ATOM 0 HG3 LYS A 3 -8.299 4.064 -0.582 1.00 44.44 H new ATOM 0 HD2 LYS A 3 -6.498 2.631 0.253 1.00 54.15 H new ATOM 0 HD3 LYS A 3 -8.047 2.030 0.811 1.00 54.15 H new ATOM 0 HE2 LYS A 3 -7.805 0.067 -0.291 1.00 53.43 H new ATOM 0 HE3 LYS A 3 -7.329 0.864 -1.777 1.00 53.43 H new ATOM 0 HZ1 LYS A 3 -5.680 -0.636 -0.374 1.00 61.13 H new ATOM 0 HZ2 LYS A 3 -5.139 0.687 -1.290 1.00 61.13 H new ATOM 0 HZ3 LYS A 3 -5.361 0.849 0.386 1.00 61.13 H new ATOM 62 N LEU A 4 -11.193 5.707 -1.718 1.00 53.13 N ATOM 63 CA LEU A 4 -11.860 6.706 -0.889 1.00 75.42 C ATOM 64 C LEU A 4 -10.999 7.081 0.311 1.00 11.23 C ATOM 65 O LEU A 4 -10.503 8.204 0.405 1.00 41.42 O ATOM 66 CB LEU A 4 -13.216 6.178 -0.413 1.00 44.44 C ATOM 67 CG LEU A 4 -14.041 5.416 -1.450 1.00 31.21 C ATOM 68 CD1 LEU A 4 -14.251 3.975 -1.010 1.00 14.24 C ATOM 69 CD2 LEU A 4 -15.378 6.105 -1.680 1.00 52.21 C ATOM 0 H LEU A 4 -10.854 6.059 -2.613 1.00 53.13 H new ATOM 0 HA LEU A 4 -12.016 7.599 -1.494 1.00 75.42 H new ATOM 0 HB2 LEU A 4 -13.048 5.522 0.442 1.00 44.44 H new ATOM 0 HB3 LEU A 4 -13.807 7.022 -0.057 1.00 44.44 H new ATOM 0 HG LEU A 4 -13.491 5.411 -2.391 1.00 31.21 H new ATOM 0 HD11 LEU A 4 -14.840 3.448 -1.760 1.00 14.24 H new ATOM 0 HD12 LEU A 4 -13.284 3.484 -0.897 1.00 14.24 H new ATOM 0 HD13 LEU A 4 -14.779 3.959 -0.057 1.00 14.24 H new ATOM 0 HD21 LEU A 4 -15.951 5.548 -2.421 1.00 52.21 H new ATOM 0 HD22 LEU A 4 -15.934 6.142 -0.743 1.00 52.21 H new ATOM 0 HD23 LEU A 4 -15.207 7.119 -2.040 1.00 52.21 H new ATOM 81 N ARG A 5 -10.822 6.134 1.227 1.00 63.52 N ATOM 82 CA ARG A 5 -10.018 6.365 2.421 1.00 71.04 C ATOM 83 C ARG A 5 -8.644 6.917 2.054 1.00 63.23 C ATOM 84 O ARG A 5 -8.059 7.700 2.801 1.00 43.01 O ATOM 85 CB ARG A 5 -9.864 5.068 3.217 1.00 21.02 C ATOM 86 CG ARG A 5 -11.119 4.662 3.971 1.00 65.30 C ATOM 87 CD ARG A 5 -11.866 3.551 3.250 1.00 74.11 C ATOM 88 NE ARG A 5 -11.093 2.313 3.201 1.00 52.20 N ATOM 89 CZ ARG A 5 -11.452 1.249 2.493 1.00 64.43 C ATOM 90 NH1 ARG A 5 -12.567 1.272 1.775 1.00 22.54 N ATOM 91 NH2 ARG A 5 -10.695 0.159 2.499 1.00 44.23 N ATOM 0 H ARG A 5 -11.225 5.199 1.165 1.00 63.52 H new ATOM 0 HA ARG A 5 -10.532 7.102 3.038 1.00 71.04 H new ATOM 0 HB2 ARG A 5 -9.584 4.265 2.535 1.00 21.02 H new ATOM 0 HB3 ARG A 5 -9.045 5.183 3.927 1.00 21.02 H new ATOM 0 HG2 ARG A 5 -10.851 4.330 4.974 1.00 65.30 H new ATOM 0 HG3 ARG A 5 -11.772 5.527 4.085 1.00 65.30 H new ATOM 0 HD2 ARG A 5 -12.815 3.366 3.754 1.00 74.11 H new ATOM 0 HD3 ARG A 5 -12.101 3.872 2.235 1.00 74.11 H new ATOM 0 HE ARG A 5 -10.229 2.263 3.741 1.00 52.20 H new ATOM 0 HH11 ARG A 5 -13.151 2.108 1.766 1.00 22.54 H new ATOM 0 HH12 ARG A 5 -12.841 0.453 1.232 1.00 22.54 H new ATOM 0 HH21 ARG A 5 -9.836 0.138 3.048 1.00 44.23 H new ATOM 0 HH22 ARG A 5 -10.972 -0.658 1.954 1.00 44.23 H new ATOM 105 N GLU A 6 -8.136 6.502 0.897 1.00 30.03 N ATOM 106 CA GLU A 6 -6.830 6.953 0.432 1.00 21.30 C ATOM 107 C GLU A 6 -6.762 8.477 0.394 1.00 73.34 C ATOM 108 O GLU A 6 -5.824 9.081 0.913 1.00 34.42 O ATOM 109 CB GLU A 6 -6.533 6.384 -0.957 1.00 73.01 C ATOM 110 CG GLU A 6 -5.092 6.574 -1.398 1.00 64.35 C ATOM 111 CD GLU A 6 -4.288 5.291 -1.333 1.00 25.14 C ATOM 112 OE1 GLU A 6 -4.764 4.265 -1.864 1.00 15.53 O ATOM 113 OE2 GLU A 6 -3.183 5.311 -0.752 1.00 24.14 O ATOM 0 H GLU A 6 -8.609 5.855 0.266 1.00 30.03 H new ATOM 0 HA GLU A 6 -6.079 6.590 1.133 1.00 21.30 H new ATOM 0 HB2 GLU A 6 -6.768 5.320 -0.962 1.00 73.01 H new ATOM 0 HB3 GLU A 6 -7.192 6.859 -1.683 1.00 73.01 H new ATOM 0 HG2 GLU A 6 -5.076 6.957 -2.418 1.00 64.35 H new ATOM 0 HG3 GLU A 6 -4.619 7.327 -0.767 1.00 64.35 H new ATOM 120 N GLU A 7 -7.765 9.092 -0.225 1.00 51.25 N ATOM 121 CA GLU A 7 -7.820 10.545 -0.333 1.00 41.04 C ATOM 122 C GLU A 7 -8.141 11.179 1.018 1.00 2.15 C ATOM 123 O GLU A 7 -7.631 12.249 1.350 1.00 70.12 O ATOM 124 CB GLU A 7 -8.868 10.964 -1.367 1.00 21.05 C ATOM 125 CG GLU A 7 -8.515 12.243 -2.106 1.00 42.20 C ATOM 126 CD GLU A 7 -9.541 12.608 -3.161 1.00 45.11 C ATOM 127 OE1 GLU A 7 -10.324 11.720 -3.559 1.00 71.02 O ATOM 128 OE2 GLU A 7 -9.561 13.781 -3.590 1.00 53.40 O ATOM 0 H GLU A 7 -8.550 8.607 -0.659 1.00 51.25 H new ATOM 0 HA GLU A 7 -6.840 10.896 -0.657 1.00 41.04 H new ATOM 0 HB2 GLU A 7 -8.994 10.159 -2.091 1.00 21.05 H new ATOM 0 HB3 GLU A 7 -9.827 11.096 -0.867 1.00 21.05 H new ATOM 0 HG2 GLU A 7 -8.429 13.060 -1.390 1.00 42.20 H new ATOM 0 HG3 GLU A 7 -7.539 12.128 -2.578 1.00 42.20 H new ATOM 135 N ALA A 8 -8.990 10.511 1.792 1.00 21.31 N ATOM 136 CA ALA A 8 -9.377 11.007 3.106 1.00 54.23 C ATOM 137 C ALA A 8 -8.153 11.318 3.960 1.00 21.43 C ATOM 138 O ALA A 8 -8.160 12.259 4.752 1.00 33.52 O ATOM 139 CB ALA A 8 -10.270 9.995 3.809 1.00 13.22 C ATOM 0 H ALA A 8 -9.423 9.625 1.531 1.00 21.31 H new ATOM 0 HA ALA A 8 -9.934 11.934 2.967 1.00 54.23 H new ATOM 0 HB1 ALA A 8 -10.552 10.378 4.790 1.00 13.22 H new ATOM 0 HB2 ALA A 8 -11.167 9.826 3.214 1.00 13.22 H new ATOM 0 HB3 ALA A 8 -9.731 9.055 3.928 1.00 13.22 H new ATOM 145 N ALA A 9 -7.103 10.521 3.791 1.00 10.11 N ATOM 146 CA ALA A 9 -5.870 10.713 4.545 1.00 0.41 C ATOM 147 C ALA A 9 -5.140 11.973 4.093 1.00 13.24 C ATOM 148 O ALA A 9 -4.479 12.640 4.890 1.00 4.13 O ATOM 149 CB ALA A 9 -4.967 9.497 4.399 1.00 65.43 C ATOM 0 H ALA A 9 -7.081 9.737 3.139 1.00 10.11 H new ATOM 0 HA ALA A 9 -6.132 10.834 5.596 1.00 0.41 H new ATOM 0 HB1 ALA A 9 -4.050 9.654 4.967 1.00 65.43 H new ATOM 0 HB2 ALA A 9 -5.482 8.614 4.778 1.00 65.43 H new ATOM 0 HB3 ALA A 9 -4.721 9.350 3.347 1.00 65.43 H new ATOM 155 N LYS A 10 -5.264 12.295 2.810 1.00 71.22 N ATOM 156 CA LYS A 10 -4.617 13.475 2.251 1.00 43.55 C ATOM 157 C LYS A 10 -5.322 14.749 2.707 1.00 1.44 C ATOM 158 O LYS A 10 -4.689 15.792 2.885 1.00 21.21 O ATOM 159 CB LYS A 10 -4.610 13.403 0.722 1.00 15.50 C ATOM 160 CG LYS A 10 -3.246 13.087 0.134 1.00 75.25 C ATOM 161 CD LYS A 10 -3.352 12.111 -1.026 1.00 10.21 C ATOM 162 CE LYS A 10 -1.989 11.818 -1.634 1.00 31.32 C ATOM 163 NZ LYS A 10 -1.526 10.439 -1.318 1.00 32.32 N ATOM 0 H LYS A 10 -5.807 11.754 2.137 1.00 71.22 H new ATOM 0 HA LYS A 10 -3.589 13.500 2.612 1.00 43.55 H new ATOM 0 HB2 LYS A 10 -5.321 12.642 0.399 1.00 15.50 H new ATOM 0 HB3 LYS A 10 -4.958 14.355 0.320 1.00 15.50 H new ATOM 0 HG2 LYS A 10 -2.773 14.008 -0.206 1.00 75.25 H new ATOM 0 HG3 LYS A 10 -2.604 12.666 0.908 1.00 75.25 H new ATOM 0 HD2 LYS A 10 -3.805 11.182 -0.681 1.00 10.21 H new ATOM 0 HD3 LYS A 10 -4.012 12.522 -1.790 1.00 10.21 H new ATOM 0 HE2 LYS A 10 -2.039 11.946 -2.715 1.00 31.32 H new ATOM 0 HE3 LYS A 10 -1.262 12.540 -1.261 1.00 31.32 H new ATOM 0 HZ1 LYS A 10 -0.594 10.278 -1.750 1.00 32.32 H new ATOM 0 HZ2 LYS A 10 -1.454 10.325 -0.287 1.00 32.32 H new ATOM 0 HZ3 LYS A 10 -2.206 9.749 -1.696 1.00 32.32 H new ATOM 177 N LEU A 11 -6.633 14.659 2.896 1.00 34.31 N ATOM 178 CA LEU A 11 -7.424 15.804 3.334 1.00 12.23 C ATOM 179 C LEU A 11 -6.843 16.412 4.607 1.00 72.24 C ATOM 180 O LEU A 11 -6.923 17.622 4.821 1.00 13.31 O ATOM 181 CB LEU A 11 -8.876 15.386 3.571 1.00 3.02 C ATOM 182 CG LEU A 11 -9.798 15.441 2.352 1.00 21.22 C ATOM 183 CD1 LEU A 11 -11.145 14.811 2.672 1.00 42.20 C ATOM 184 CD2 LEU A 11 -9.977 16.877 1.883 1.00 14.40 C ATOM 0 H LEU A 11 -7.172 13.805 2.753 1.00 34.31 H new ATOM 0 HA LEU A 11 -7.394 16.557 2.547 1.00 12.23 H new ATOM 0 HB2 LEU A 11 -8.881 14.368 3.960 1.00 3.02 H new ATOM 0 HB3 LEU A 11 -9.295 16.026 4.348 1.00 3.02 H new ATOM 0 HG LEU A 11 -9.336 14.871 1.546 1.00 21.22 H new ATOM 0 HD11 LEU A 11 -11.787 14.859 1.793 1.00 42.20 H new ATOM 0 HD12 LEU A 11 -11.001 13.769 2.959 1.00 42.20 H new ATOM 0 HD13 LEU A 11 -11.614 15.352 3.494 1.00 42.20 H new ATOM 0 HD21 LEU A 11 -10.636 16.897 1.015 1.00 14.40 H new ATOM 0 HD22 LEU A 11 -10.416 17.470 2.685 1.00 14.40 H new ATOM 0 HD23 LEU A 11 -9.007 17.295 1.612 1.00 14.40 H new ATOM 196 N PHE A 12 -6.259 15.566 5.447 1.00 33.25 N ATOM 197 CA PHE A 12 -5.664 16.019 6.699 1.00 54.31 C ATOM 198 C PHE A 12 -4.538 17.014 6.436 1.00 13.11 C ATOM 199 O PHE A 12 -4.270 17.894 7.254 1.00 13.31 O ATOM 200 CB PHE A 12 -5.130 14.827 7.496 1.00 33.52 C ATOM 201 CG PHE A 12 -6.110 14.291 8.501 1.00 12.25 C ATOM 202 CD1 PHE A 12 -7.408 13.986 8.129 1.00 50.23 C ATOM 203 CD2 PHE A 12 -5.731 14.094 9.820 1.00 33.33 C ATOM 204 CE1 PHE A 12 -8.312 13.492 9.051 1.00 51.14 C ATOM 205 CE2 PHE A 12 -6.630 13.601 10.747 1.00 60.15 C ATOM 206 CZ PHE A 12 -7.922 13.301 10.363 1.00 65.22 C ATOM 0 H PHE A 12 -6.185 14.562 5.284 1.00 33.25 H new ATOM 0 HA PHE A 12 -6.439 16.518 7.281 1.00 54.31 H new ATOM 0 HB2 PHE A 12 -4.858 14.030 6.804 1.00 33.52 H new ATOM 0 HB3 PHE A 12 -4.218 15.125 8.013 1.00 33.52 H new ATOM 0 HD1 PHE A 12 -7.718 14.136 7.105 1.00 50.23 H new ATOM 0 HD2 PHE A 12 -4.722 14.328 10.127 1.00 33.33 H new ATOM 0 HE1 PHE A 12 -9.321 13.256 8.747 1.00 51.14 H new ATOM 0 HE2 PHE A 12 -6.322 13.451 11.771 1.00 60.15 H new ATOM 0 HZ PHE A 12 -8.626 12.918 11.087 1.00 65.22 H new ATOM 216 N GLU A 13 -3.881 16.867 5.290 1.00 70.43 N ATOM 217 CA GLU A 13 -2.783 17.753 4.920 1.00 21.32 C ATOM 218 C GLU A 13 -3.303 19.137 4.543 1.00 74.32 C ATOM 219 O GLU A 13 -2.641 20.145 4.780 1.00 11.34 O ATOM 220 CB GLU A 13 -1.990 17.158 3.755 1.00 24.50 C ATOM 221 CG GLU A 13 -0.724 17.930 3.423 1.00 41.40 C ATOM 222 CD GLU A 13 -0.826 18.685 2.112 1.00 75.13 C ATOM 223 OE1 GLU A 13 0.141 18.638 1.324 1.00 3.14 O ATOM 224 OE2 GLU A 13 -1.873 19.322 1.874 1.00 71.10 O ATOM 0 H GLU A 13 -4.090 16.143 4.602 1.00 70.43 H new ATOM 0 HA GLU A 13 -2.125 17.855 5.783 1.00 21.32 H new ATOM 0 HB2 GLU A 13 -1.725 16.128 3.995 1.00 24.50 H new ATOM 0 HB3 GLU A 13 -2.628 17.125 2.872 1.00 24.50 H new ATOM 0 HG2 GLU A 13 -0.511 18.634 4.227 1.00 41.40 H new ATOM 0 HG3 GLU A 13 0.117 17.238 3.375 1.00 41.40 H new ATOM 231 N GLU A 14 -4.494 19.174 3.952 1.00 15.22 N ATOM 232 CA GLU A 14 -5.102 20.434 3.541 1.00 35.43 C ATOM 233 C GLU A 14 -5.164 21.415 4.708 1.00 14.44 C ATOM 234 O GLU A 14 -4.819 22.588 4.565 1.00 12.20 O ATOM 235 CB GLU A 14 -6.509 20.190 2.990 1.00 55.41 C ATOM 236 CG GLU A 14 -6.755 20.843 1.641 1.00 23.22 C ATOM 237 CD GLU A 14 -6.092 20.093 0.501 1.00 4.41 C ATOM 238 OE1 GLU A 14 -5.275 20.708 -0.216 1.00 45.30 O ATOM 239 OE2 GLU A 14 -6.390 18.894 0.326 1.00 22.43 O ATOM 0 H GLU A 14 -5.056 18.347 3.748 1.00 15.22 H new ATOM 0 HA GLU A 14 -4.482 20.869 2.757 1.00 35.43 H new ATOM 0 HB2 GLU A 14 -6.674 19.116 2.900 1.00 55.41 H new ATOM 0 HB3 GLU A 14 -7.241 20.566 3.705 1.00 55.41 H new ATOM 0 HG2 GLU A 14 -7.828 20.899 1.459 1.00 23.22 H new ATOM 0 HG3 GLU A 14 -6.382 21.867 1.663 1.00 23.22 H new ATOM 246 N TRP A 15 -5.607 20.927 5.861 1.00 11.13 N ATOM 247 CA TRP A 15 -5.714 21.760 7.053 1.00 74.35 C ATOM 248 C TRP A 15 -4.350 22.305 7.461 1.00 52.40 C ATOM 249 O TRP A 15 -4.191 23.507 7.683 1.00 30.43 O ATOM 250 CB TRP A 15 -6.323 20.961 8.206 1.00 54.23 C ATOM 251 CG TRP A 15 -7.554 20.199 7.816 1.00 41.13 C ATOM 252 CD1 TRP A 15 -8.477 20.560 6.876 1.00 34.51 C ATOM 253 CD2 TRP A 15 -7.997 18.950 8.357 1.00 23.41 C ATOM 254 NE1 TRP A 15 -9.467 19.609 6.800 1.00 5.12 N ATOM 255 CE2 TRP A 15 -9.195 18.610 7.697 1.00 2.43 C ATOM 256 CE3 TRP A 15 -7.496 18.083 9.333 1.00 25.32 C ATOM 257 CZ2 TRP A 15 -9.897 17.444 7.985 1.00 54.30 C ATOM 258 CZ3 TRP A 15 -8.195 16.925 9.617 1.00 61.12 C ATOM 259 CH2 TRP A 15 -9.385 16.613 8.944 1.00 3.45 C ATOM 0 H TRP A 15 -5.898 19.959 5.996 1.00 11.13 H new ATOM 0 HA TRP A 15 -6.366 22.602 6.820 1.00 74.35 H new ATOM 0 HB2 TRP A 15 -5.578 20.263 8.588 1.00 54.23 H new ATOM 0 HB3 TRP A 15 -6.569 21.642 9.021 1.00 54.23 H new ATOM 0 HD1 TRP A 15 -8.435 21.460 6.280 1.00 34.51 H new ATOM 0 HE1 TRP A 15 -10.274 19.642 6.177 1.00 5.12 H new ATOM 0 HE3 TRP A 15 -6.579 18.314 9.855 1.00 25.32 H new ATOM 0 HZ2 TRP A 15 -10.815 17.203 7.469 1.00 54.30 H new ATOM 0 HZ3 TRP A 15 -7.818 16.249 10.370 1.00 61.12 H new ATOM 0 HH2 TRP A 15 -9.907 15.700 9.187 1.00 3.45 H new ATOM 270 N LYS A 16 -3.368 21.416 7.560 1.00 24.41 N ATOM 271 CA LYS A 16 -2.016 21.808 7.940 1.00 42.12 C ATOM 272 C LYS A 16 -1.452 22.835 6.964 1.00 64.43 C ATOM 273 O LYS A 16 -0.677 23.711 7.346 1.00 51.41 O ATOM 274 CB LYS A 16 -1.102 20.582 7.990 1.00 23.30 C ATOM 275 CG LYS A 16 -1.588 19.499 8.939 1.00 44.11 C ATOM 276 CD LYS A 16 -0.787 18.218 8.781 1.00 52.32 C ATOM 277 CE LYS A 16 -1.694 17.001 8.686 1.00 51.23 C ATOM 278 NZ LYS A 16 -1.035 15.775 9.216 1.00 42.03 N ATOM 0 H LYS A 16 -3.483 20.418 7.382 1.00 24.41 H new ATOM 0 HA LYS A 16 -2.062 22.261 8.931 1.00 42.12 H new ATOM 0 HB2 LYS A 16 -1.015 20.163 6.988 1.00 23.30 H new ATOM 0 HB3 LYS A 16 -0.103 20.896 8.292 1.00 23.30 H new ATOM 0 HG2 LYS A 16 -1.510 19.853 9.967 1.00 44.11 H new ATOM 0 HG3 LYS A 16 -2.642 19.295 8.751 1.00 44.11 H new ATOM 0 HD2 LYS A 16 -0.168 18.283 7.886 1.00 52.32 H new ATOM 0 HD3 LYS A 16 -0.111 18.104 9.628 1.00 52.32 H new ATOM 0 HE2 LYS A 16 -2.613 17.189 9.242 1.00 51.23 H new ATOM 0 HE3 LYS A 16 -1.978 16.840 7.646 1.00 51.23 H new ATOM 0 HZ1 LYS A 16 -1.686 14.968 9.133 1.00 42.03 H new ATOM 0 HZ2 LYS A 16 -0.172 15.581 8.670 1.00 42.03 H new ATOM 0 HZ3 LYS A 16 -0.787 15.919 10.216 1.00 42.03 H new ATOM 292 N LYS A 17 -1.847 22.723 5.700 1.00 73.55 N ATOM 293 CA LYS A 17 -1.385 23.643 4.668 1.00 23.35 C ATOM 294 C LYS A 17 -1.667 25.089 5.062 1.00 4.35 C ATOM 295 O LYS A 17 -0.774 25.938 5.028 1.00 72.20 O ATOM 296 CB LYS A 17 -2.061 23.326 3.332 1.00 44.41 C ATOM 297 CG LYS A 17 -1.092 23.243 2.164 1.00 54.42 C ATOM 298 CD LYS A 17 -1.813 23.368 0.833 1.00 3.41 C ATOM 299 CE LYS A 17 -1.688 24.772 0.260 1.00 2.13 C ATOM 300 NZ LYS A 17 -2.413 24.911 -1.033 1.00 35.20 N ATOM 0 H LYS A 17 -2.487 22.003 5.366 1.00 73.55 H new ATOM 0 HA LYS A 17 -0.308 23.517 4.561 1.00 23.35 H new ATOM 0 HB2 LYS A 17 -2.593 22.379 3.420 1.00 44.41 H new ATOM 0 HB3 LYS A 17 -2.807 24.092 3.121 1.00 44.41 H new ATOM 0 HG2 LYS A 17 -0.347 24.034 2.251 1.00 54.42 H new ATOM 0 HG3 LYS A 17 -0.556 22.295 2.201 1.00 54.42 H new ATOM 0 HD2 LYS A 17 -1.401 22.648 0.126 1.00 3.41 H new ATOM 0 HD3 LYS A 17 -2.866 23.120 0.964 1.00 3.41 H new ATOM 0 HE2 LYS A 17 -2.082 25.493 0.976 1.00 2.13 H new ATOM 0 HE3 LYS A 17 -0.635 25.012 0.113 1.00 2.13 H new ATOM 0 HZ1 LYS A 17 -2.303 25.882 -1.390 1.00 35.20 H new ATOM 0 HZ2 LYS A 17 -2.020 24.241 -1.725 1.00 35.20 H new ATOM 0 HZ3 LYS A 17 -3.423 24.707 -0.889 1.00 35.20 H new ATOM 314 N LEU A 18 -2.911 25.363 5.437 1.00 73.23 N ATOM 315 CA LEU A 18 -3.311 26.708 5.839 1.00 35.12 C ATOM 316 C LEU A 18 -2.750 27.052 7.216 1.00 71.05 C ATOM 317 O LEU A 18 -2.498 28.218 7.519 1.00 34.14 O ATOM 318 CB LEU A 18 -4.835 26.825 5.852 1.00 72.03 C ATOM 319 CG LEU A 18 -5.487 27.257 4.538 1.00 1.11 C ATOM 320 CD1 LEU A 18 -5.120 28.696 4.208 1.00 34.42 C ATOM 321 CD2 LEU A 18 -5.074 26.327 3.407 1.00 51.02 C ATOM 0 H LEU A 18 -3.661 24.672 5.471 1.00 73.23 H new ATOM 0 HA LEU A 18 -2.906 27.414 5.115 1.00 35.12 H new ATOM 0 HB2 LEU A 18 -5.251 25.860 6.140 1.00 72.03 H new ATOM 0 HB3 LEU A 18 -5.118 27.538 6.626 1.00 72.03 H new ATOM 0 HG LEU A 18 -6.569 27.197 4.654 1.00 1.11 H new ATOM 0 HD11 LEU A 18 -5.593 28.986 3.270 1.00 34.42 H new ATOM 0 HD12 LEU A 18 -5.466 29.352 5.007 1.00 34.42 H new ATOM 0 HD13 LEU A 18 -4.038 28.782 4.111 1.00 34.42 H new ATOM 0 HD21 LEU A 18 -5.547 26.649 2.480 1.00 51.02 H new ATOM 0 HD22 LEU A 18 -3.991 26.355 3.290 1.00 51.02 H new ATOM 0 HD23 LEU A 18 -5.388 25.309 3.640 1.00 51.02 H new ATOM 333 N ALA A 19 -2.558 26.031 8.043 1.00 21.44 N ATOM 334 CA ALA A 19 -2.024 26.226 9.386 1.00 24.33 C ATOM 335 C ALA A 19 -0.583 26.725 9.336 1.00 41.13 C ATOM 336 O ALA A 19 -0.202 27.619 10.091 1.00 24.34 O ATOM 337 CB ALA A 19 -2.107 24.931 10.180 1.00 62.21 C ATOM 0 H ALA A 19 -2.764 25.060 7.808 1.00 21.44 H new ATOM 0 HA ALA A 19 -2.628 26.985 9.884 1.00 24.33 H new ATOM 0 HB1 ALA A 19 -1.705 25.091 11.180 1.00 62.21 H new ATOM 0 HB2 ALA A 19 -3.148 24.615 10.253 1.00 62.21 H new ATOM 0 HB3 ALA A 19 -1.528 24.157 9.676 1.00 62.21 H new ATOM 343 N GLU A 20 0.211 26.143 8.443 1.00 40.33 N ATOM 344 CA GLU A 20 1.609 26.530 8.298 1.00 63.54 C ATOM 345 C GLU A 20 1.727 27.973 7.816 1.00 22.50 C ATOM 346 O GLU A 20 2.518 28.751 8.346 1.00 4.11 O ATOM 347 CB GLU A 20 2.321 25.593 7.318 1.00 50.43 C ATOM 348 CG GLU A 20 2.618 24.220 7.897 1.00 71.10 C ATOM 349 CD GLU A 20 3.295 23.301 6.899 1.00 3.14 C ATOM 350 OE1 GLU A 20 3.923 23.817 5.949 1.00 2.31 O ATOM 351 OE2 GLU A 20 3.199 22.068 7.066 1.00 10.34 O ATOM 0 H GLU A 20 -0.090 25.402 7.810 1.00 40.33 H new ATOM 0 HA GLU A 20 2.085 26.452 9.276 1.00 63.54 H new ATOM 0 HB2 GLU A 20 1.705 25.477 6.426 1.00 50.43 H new ATOM 0 HB3 GLU A 20 3.256 26.055 7.001 1.00 50.43 H new ATOM 0 HG2 GLU A 20 3.255 24.330 8.775 1.00 71.10 H new ATOM 0 HG3 GLU A 20 1.688 23.763 8.234 1.00 71.10 H new ATOM 358 N GLU A 21 0.934 28.320 6.806 1.00 3.54 N ATOM 359 CA GLU A 21 0.952 29.669 6.252 1.00 41.11 C ATOM 360 C GLU A 21 0.439 30.682 7.271 1.00 53.23 C ATOM 361 O GLU A 21 0.862 31.838 7.280 1.00 13.35 O ATOM 362 CB GLU A 21 0.102 29.733 4.981 1.00 34.42 C ATOM 363 CG GLU A 21 0.327 30.992 4.162 1.00 64.22 C ATOM 364 CD GLU A 21 -0.815 31.278 3.206 1.00 60.41 C ATOM 365 OE1 GLU A 21 -1.867 30.615 3.325 1.00 63.24 O ATOM 366 OE2 GLU A 21 -0.657 32.162 2.339 1.00 51.53 O ATOM 0 H GLU A 21 0.273 27.687 6.356 1.00 3.54 H new ATOM 0 HA GLU A 21 1.984 29.919 6.004 1.00 41.11 H new ATOM 0 HB2 GLU A 21 0.322 28.863 4.362 1.00 34.42 H new ATOM 0 HB3 GLU A 21 -0.951 29.671 5.255 1.00 34.42 H new ATOM 0 HG2 GLU A 21 0.454 31.840 4.834 1.00 64.22 H new ATOM 0 HG3 GLU A 21 1.253 30.892 3.596 1.00 64.22 H new ATOM 373 N ALA A 22 -0.476 30.240 8.128 1.00 62.54 N ATOM 374 CA ALA A 22 -1.046 31.107 9.151 1.00 12.51 C ATOM 375 C ALA A 22 -0.023 31.420 10.238 1.00 20.45 C ATOM 376 O ALA A 22 -0.049 32.493 10.839 1.00 44.12 O ATOM 377 CB ALA A 22 -2.284 30.463 9.759 1.00 62.23 C ATOM 0 H ALA A 22 -0.838 29.286 8.134 1.00 62.54 H new ATOM 0 HA ALA A 22 -1.333 32.046 8.677 1.00 12.51 H new ATOM 0 HB1 ALA A 22 -2.699 31.122 10.522 1.00 62.23 H new ATOM 0 HB2 ALA A 22 -3.027 30.296 8.980 1.00 62.23 H new ATOM 0 HB3 ALA A 22 -2.013 29.509 10.212 1.00 62.23 H new ATOM 383 N ALA A 23 0.877 30.474 10.486 1.00 34.24 N ATOM 384 CA ALA A 23 1.911 30.650 11.500 1.00 72.52 C ATOM 385 C ALA A 23 2.795 31.849 11.180 1.00 3.20 C ATOM 386 O ALA A 23 3.292 32.525 12.081 1.00 12.42 O ATOM 387 CB ALA A 23 2.752 29.388 11.620 1.00 71.42 C ATOM 0 H ALA A 23 0.911 29.578 9.999 1.00 34.24 H new ATOM 0 HA ALA A 23 1.421 30.839 12.455 1.00 72.52 H new ATOM 0 HB1 ALA A 23 3.520 29.533 12.380 1.00 71.42 H new ATOM 0 HB2 ALA A 23 2.114 28.551 11.904 1.00 71.42 H new ATOM 0 HB3 ALA A 23 3.226 29.174 10.662 1.00 71.42 H new ATOM 393 N LYS A 24 2.989 32.109 9.892 1.00 52.04 N ATOM 394 CA LYS A 24 3.813 33.229 9.452 1.00 31.20 C ATOM 395 C LYS A 24 3.177 34.559 9.840 1.00 73.35 C ATOM 396 O LYS A 24 3.864 35.488 10.265 1.00 24.23 O ATOM 397 CB LYS A 24 4.018 33.172 7.936 1.00 11.35 C ATOM 398 CG LYS A 24 5.464 33.367 7.511 1.00 22.14 C ATOM 399 CD LYS A 24 6.305 32.139 7.820 1.00 3.51 C ATOM 400 CE LYS A 24 7.357 31.901 6.747 1.00 13.12 C ATOM 401 NZ LYS A 24 8.611 31.331 7.316 1.00 51.54 N ATOM 0 H LYS A 24 2.586 31.559 9.133 1.00 52.04 H new ATOM 0 HA LYS A 24 4.781 33.152 9.947 1.00 31.20 H new ATOM 0 HB2 LYS A 24 3.666 32.209 7.566 1.00 11.35 H new ATOM 0 HB3 LYS A 24 3.403 33.939 7.465 1.00 11.35 H new ATOM 0 HG2 LYS A 24 5.505 33.578 6.442 1.00 22.14 H new ATOM 0 HG3 LYS A 24 5.881 34.234 8.023 1.00 22.14 H new ATOM 0 HD2 LYS A 24 6.792 32.264 8.787 1.00 3.51 H new ATOM 0 HD3 LYS A 24 5.659 31.264 7.899 1.00 3.51 H new ATOM 0 HE2 LYS A 24 6.959 31.222 5.993 1.00 13.12 H new ATOM 0 HE3 LYS A 24 7.581 32.841 6.243 1.00 13.12 H new ATOM 0 HZ1 LYS A 24 9.303 31.183 6.553 1.00 51.54 H new ATOM 0 HZ2 LYS A 24 9.005 31.990 8.018 1.00 51.54 H new ATOM 0 HZ3 LYS A 24 8.402 30.421 7.775 1.00 51.54 H new ATOM 415 N LEU A 25 1.858 34.644 9.692 1.00 11.44 N ATOM 416 CA LEU A 25 1.128 35.861 10.029 1.00 3.51 C ATOM 417 C LEU A 25 1.220 36.156 11.523 1.00 33.12 C ATOM 418 O LEU A 25 1.295 37.315 11.935 1.00 75.53 O ATOM 419 CB LEU A 25 -0.339 35.732 9.613 1.00 24.45 C ATOM 420 CG LEU A 25 -0.836 36.746 8.583 1.00 41.23 C ATOM 421 CD1 LEU A 25 -0.864 38.144 9.181 1.00 20.43 C ATOM 422 CD2 LEU A 25 0.038 36.715 7.338 1.00 64.20 C ATOM 0 H LEU A 25 1.274 33.885 9.341 1.00 11.44 H new ATOM 0 HA LEU A 25 1.582 36.689 9.485 1.00 3.51 H new ATOM 0 HB2 LEU A 25 -0.495 34.731 9.212 1.00 24.45 H new ATOM 0 HB3 LEU A 25 -0.958 35.818 10.506 1.00 24.45 H new ATOM 0 HG LEU A 25 -1.852 36.475 8.296 1.00 41.23 H new ATOM 0 HD11 LEU A 25 -1.220 38.853 8.433 1.00 20.43 H new ATOM 0 HD12 LEU A 25 -1.532 38.158 10.042 1.00 20.43 H new ATOM 0 HD13 LEU A 25 0.141 38.425 9.497 1.00 20.43 H new ATOM 0 HD21 LEU A 25 -0.331 37.443 6.616 1.00 64.20 H new ATOM 0 HD22 LEU A 25 1.065 36.960 7.608 1.00 64.20 H new ATOM 0 HD23 LEU A 25 0.007 35.719 6.896 1.00 64.20 H new ATOM 434 N LEU A 26 1.217 35.100 12.330 1.00 41.42 N ATOM 435 CA LEU A 26 1.303 35.246 13.779 1.00 31.33 C ATOM 436 C LEU A 26 2.670 35.782 14.193 1.00 34.20 C ATOM 437 O LEU A 26 2.777 36.589 15.115 1.00 53.25 O ATOM 438 CB LEU A 26 1.041 33.902 14.462 1.00 44.43 C ATOM 439 CG LEU A 26 -0.405 33.632 14.878 1.00 11.51 C ATOM 440 CD1 LEU A 26 -1.258 33.301 13.664 1.00 13.43 C ATOM 441 CD2 LEU A 26 -0.464 32.503 15.897 1.00 31.14 C ATOM 0 H LEU A 26 1.156 34.135 12.006 1.00 41.42 H new ATOM 0 HA LEU A 26 0.543 35.962 14.093 1.00 31.33 H new ATOM 0 HB2 LEU A 26 1.359 33.106 13.788 1.00 44.43 H new ATOM 0 HB3 LEU A 26 1.671 33.839 15.349 1.00 44.43 H new ATOM 0 HG LEU A 26 -0.804 34.535 15.341 1.00 11.51 H new ATOM 0 HD11 LEU A 26 -2.284 33.112 13.981 1.00 13.43 H new ATOM 0 HD12 LEU A 26 -1.242 34.140 12.968 1.00 13.43 H new ATOM 0 HD13 LEU A 26 -0.861 32.413 13.171 1.00 13.43 H new ATOM 0 HD21 LEU A 26 -1.501 32.324 16.182 1.00 31.14 H new ATOM 0 HD22 LEU A 26 -0.046 31.596 15.460 1.00 31.14 H new ATOM 0 HD23 LEU A 26 0.113 32.779 16.780 1.00 31.14 H new ATOM 453 N GLU A 27 3.711 35.328 13.503 1.00 25.03 N ATOM 454 CA GLU A 27 5.071 35.764 13.798 1.00 32.34 C ATOM 455 C GLU A 27 5.510 36.865 12.838 1.00 2.25 C ATOM 456 O GLU A 27 6.699 37.159 12.714 1.00 22.23 O ATOM 457 CB GLU A 27 6.039 34.582 13.713 1.00 0.31 C ATOM 458 CG GLU A 27 6.321 34.127 12.291 1.00 41.14 C ATOM 459 CD GLU A 27 6.844 32.705 12.226 1.00 4.53 C ATOM 460 OE1 GLU A 27 6.420 31.879 13.060 1.00 5.14 O ATOM 461 OE2 GLU A 27 7.679 32.420 11.342 1.00 63.02 O ATOM 0 H GLU A 27 3.639 34.659 12.736 1.00 25.03 H new ATOM 0 HA GLU A 27 5.085 36.164 14.812 1.00 32.34 H new ATOM 0 HB2 GLU A 27 6.979 34.858 14.190 1.00 0.31 H new ATOM 0 HB3 GLU A 27 5.628 33.746 14.278 1.00 0.31 H new ATOM 0 HG2 GLU A 27 5.407 34.201 11.702 1.00 41.14 H new ATOM 0 HG3 GLU A 27 7.049 34.799 11.836 1.00 41.14 H new ATOM 468 N GLY A 28 4.541 37.472 12.159 1.00 1.40 N ATOM 469 CA GLY A 28 4.848 38.533 11.218 1.00 43.14 C ATOM 470 C GLY A 28 5.486 39.735 11.887 1.00 25.42 C ATOM 471 O GLY A 28 6.287 40.441 11.275 1.00 33.21 O ATOM 0 H GLY A 28 3.550 37.248 12.244 1.00 1.40 H new ATOM 0 HA2 GLY A 28 5.519 38.150 10.450 1.00 43.14 H new ATOM 0 HA3 GLY A 28 3.933 38.844 10.715 1.00 43.14 H new ATOM 475 N GLY A 29 5.131 39.968 13.146 1.00 73.44 N ATOM 476 CA GLY A 29 5.683 41.094 13.876 1.00 53.41 C ATOM 477 C GLY A 29 6.732 40.672 14.886 1.00 32.23 C ATOM 478 O GLY A 29 7.543 41.485 15.327 1.00 44.45 O ATOM 0 H GLY A 29 4.471 39.397 13.674 1.00 73.44 H new ATOM 0 HA2 GLY A 29 6.124 41.799 13.171 1.00 53.41 H new ATOM 0 HA3 GLY A 29 4.878 41.619 14.390 1.00 53.41 H new ATOM 482 N GLY A 30 6.715 39.395 15.255 1.00 71.01 N ATOM 483 CA GLY A 30 7.676 38.889 16.219 1.00 23.33 C ATOM 484 C GLY A 30 9.042 38.655 15.606 1.00 1.45 C ATOM 485 O GLY A 30 9.370 39.223 14.565 1.00 13.31 O ATOM 0 H GLY A 30 6.054 38.702 14.904 1.00 71.01 H new ATOM 0 HA2 GLY A 30 7.767 39.597 17.043 1.00 23.33 H new ATOM 0 HA3 GLY A 30 7.305 37.955 16.641 1.00 23.33 H new ATOM 489 N GLY A 31 9.845 37.816 16.255 1.00 73.44 N ATOM 490 CA GLY A 31 11.175 37.525 15.754 1.00 23.45 C ATOM 491 C GLY A 31 11.253 36.176 15.064 1.00 1.30 C ATOM 492 O GLY A 31 10.234 35.620 14.658 1.00 64.42 O ATOM 0 H GLY A 31 9.597 37.333 17.119 1.00 73.44 H new ATOM 0 HA2 GLY A 31 11.475 38.305 15.055 1.00 23.45 H new ATOM 0 HA3 GLY A 31 11.885 37.548 16.581 1.00 23.45 H new ATOM 496 N GLY A 32 12.467 35.650 14.932 1.00 14.13 N ATOM 497 CA GLY A 32 12.651 34.364 14.286 1.00 21.12 C ATOM 498 C GLY A 32 12.729 33.222 15.279 1.00 35.34 C ATOM 499 O GLY A 32 12.271 32.114 14.999 1.00 51.15 O ATOM 0 H GLY A 32 13.326 36.091 15.261 1.00 14.13 H new ATOM 0 HA2 GLY A 32 11.826 34.186 13.596 1.00 21.12 H new ATOM 0 HA3 GLY A 32 13.564 34.387 13.691 1.00 21.12 H new ATOM 503 N GLY A 33 13.313 33.490 16.443 1.00 1.12 N ATOM 504 CA GLY A 33 13.440 32.465 17.463 1.00 25.34 C ATOM 505 C GLY A 33 12.941 32.929 18.816 1.00 51.10 C ATOM 506 O GLY A 33 13.731 33.284 19.689 1.00 35.12 O ATOM 0 H GLY A 33 13.700 34.398 16.698 1.00 1.12 H new ATOM 0 HA2 GLY A 33 12.881 31.581 17.157 1.00 25.34 H new ATOM 0 HA3 GLY A 33 14.485 32.168 17.547 1.00 25.34 H new ATOM 510 N GLY A 34 11.622 32.928 18.991 1.00 2.21 N ATOM 511 CA GLY A 34 11.041 33.356 20.249 1.00 53.21 C ATOM 512 C GLY A 34 9.631 33.890 20.085 1.00 1.32 C ATOM 513 O GLY A 34 9.432 34.983 19.557 1.00 50.54 O ATOM 0 H GLY A 34 10.947 32.638 18.284 1.00 2.21 H new ATOM 0 HA2 GLY A 34 11.030 32.517 20.945 1.00 53.21 H new ATOM 0 HA3 GLY A 34 11.670 34.129 20.692 1.00 53.21 H new ATOM 517 N GLY A 35 8.650 33.116 20.539 1.00 62.20 N ATOM 518 CA GLY A 35 7.264 33.534 20.428 1.00 24.13 C ATOM 519 C GLY A 35 6.294 32.399 20.689 1.00 12.12 C ATOM 520 O GLY A 35 6.366 31.352 20.046 1.00 71.33 O ATOM 0 H GLY A 35 8.790 32.208 20.981 1.00 62.20 H new ATOM 0 HA2 GLY A 35 7.073 34.341 21.136 1.00 24.13 H new ATOM 0 HA3 GLY A 35 7.088 33.936 19.430 1.00 24.13 H new ATOM 524 N GLU A 36 5.386 32.606 21.639 1.00 62.41 N ATOM 525 CA GLU A 36 4.399 31.589 21.984 1.00 14.12 C ATOM 526 C GLU A 36 3.336 31.469 20.897 1.00 43.22 C ATOM 527 O GLU A 36 2.795 30.389 20.657 1.00 54.25 O ATOM 528 CB GLU A 36 3.739 31.923 23.324 1.00 41.13 C ATOM 529 CG GLU A 36 2.559 31.027 23.662 1.00 24.42 C ATOM 530 CD GLU A 36 1.902 31.399 24.976 1.00 34.42 C ATOM 531 OE1 GLU A 36 2.392 32.336 25.639 1.00 54.14 O ATOM 532 OE2 GLU A 36 0.899 30.751 25.342 1.00 71.22 O ATOM 0 H GLU A 36 5.314 33.467 22.182 1.00 62.41 H new ATOM 0 HA GLU A 36 4.915 30.633 22.068 1.00 14.12 H new ATOM 0 HB2 GLU A 36 4.484 31.843 24.116 1.00 41.13 H new ATOM 0 HB3 GLU A 36 3.403 32.960 23.306 1.00 41.13 H new ATOM 0 HG2 GLU A 36 1.821 31.087 22.862 1.00 24.42 H new ATOM 0 HG3 GLU A 36 2.896 29.991 23.709 1.00 24.42 H new ATOM 539 N LEU A 37 3.041 32.587 20.240 1.00 0.54 N ATOM 540 CA LEU A 37 2.043 32.609 19.178 1.00 44.40 C ATOM 541 C LEU A 37 2.356 31.561 18.113 1.00 15.41 C ATOM 542 O LEU A 37 1.452 31.006 17.490 1.00 52.30 O ATOM 543 CB LEU A 37 1.980 33.997 18.539 1.00 10.52 C ATOM 544 CG LEU A 37 1.053 35.007 19.217 1.00 13.33 C ATOM 545 CD1 LEU A 37 -0.401 34.598 19.043 1.00 74.01 C ATOM 546 CD2 LEU A 37 1.399 35.140 20.693 1.00 15.30 C ATOM 0 H LEU A 37 3.479 33.489 20.425 1.00 0.54 H new ATOM 0 HA LEU A 37 1.075 32.374 19.619 1.00 44.40 H new ATOM 0 HB2 LEU A 37 2.987 34.413 18.522 1.00 10.52 H new ATOM 0 HB3 LEU A 37 1.664 33.884 17.502 1.00 10.52 H new ATOM 0 HG LEU A 37 1.195 35.978 18.742 1.00 13.33 H new ATOM 0 HD11 LEU A 37 -1.045 35.329 19.532 1.00 74.01 H new ATOM 0 HD12 LEU A 37 -0.642 34.555 17.981 1.00 74.01 H new ATOM 0 HD13 LEU A 37 -0.559 33.617 19.491 1.00 74.01 H new ATOM 0 HD21 LEU A 37 0.730 35.863 21.160 1.00 15.30 H new ATOM 0 HD22 LEU A 37 1.286 34.172 21.182 1.00 15.30 H new ATOM 0 HD23 LEU A 37 2.429 35.481 20.796 1.00 15.30 H new ATOM 558 N MET A 38 3.642 31.295 17.914 1.00 25.23 N ATOM 559 CA MET A 38 4.074 30.311 16.928 1.00 24.14 C ATOM 560 C MET A 38 3.712 28.898 17.374 1.00 10.54 C ATOM 561 O MET A 38 3.420 28.031 16.551 1.00 3.23 O ATOM 562 CB MET A 38 5.583 30.415 16.700 1.00 5.44 C ATOM 563 CG MET A 38 6.075 31.843 16.523 1.00 13.02 C ATOM 564 SD MET A 38 7.761 31.923 15.887 1.00 74.24 S ATOM 565 CE MET A 38 8.467 33.172 16.958 1.00 51.44 C ATOM 0 H MET A 38 4.403 31.746 18.422 1.00 25.23 H new ATOM 0 HA MET A 38 3.557 30.521 15.992 1.00 24.14 H new ATOM 0 HB2 MET A 38 6.102 29.963 17.545 1.00 5.44 H new ATOM 0 HB3 MET A 38 5.849 29.836 15.816 1.00 5.44 H new ATOM 0 HG2 MET A 38 5.408 32.371 15.841 1.00 13.02 H new ATOM 0 HG3 MET A 38 6.027 32.361 17.481 1.00 13.02 H new ATOM 0 HE1 MET A 38 9.294 33.664 16.447 1.00 51.44 H new ATOM 0 HE2 MET A 38 7.705 33.910 17.208 1.00 51.44 H new ATOM 0 HE3 MET A 38 8.832 32.703 17.872 1.00 51.44 H new ATOM 575 N LYS A 39 3.732 28.674 18.684 1.00 24.25 N ATOM 576 CA LYS A 39 3.405 27.367 19.242 1.00 23.24 C ATOM 577 C LYS A 39 1.901 27.118 19.199 1.00 54.13 C ATOM 578 O LYS A 39 1.451 26.024 18.860 1.00 35.55 O ATOM 579 CB LYS A 39 3.910 27.263 20.683 1.00 63.50 C ATOM 580 CG LYS A 39 3.460 25.999 21.395 1.00 24.42 C ATOM 581 CD LYS A 39 2.232 26.250 22.255 1.00 4.25 C ATOM 582 CE LYS A 39 2.463 25.813 23.694 1.00 52.51 C ATOM 583 NZ LYS A 39 3.243 26.823 24.462 1.00 72.10 N ATOM 0 H LYS A 39 3.971 29.381 19.379 1.00 24.25 H new ATOM 0 HA LYS A 39 3.898 26.607 18.636 1.00 23.24 H new ATOM 0 HB2 LYS A 39 4.999 27.301 20.681 1.00 63.50 H new ATOM 0 HB3 LYS A 39 3.562 28.130 21.245 1.00 63.50 H new ATOM 0 HG2 LYS A 39 3.238 25.225 20.660 1.00 24.42 H new ATOM 0 HG3 LYS A 39 4.271 25.623 22.018 1.00 24.42 H new ATOM 0 HD2 LYS A 39 1.980 27.310 22.231 1.00 4.25 H new ATOM 0 HD3 LYS A 39 1.380 25.710 21.842 1.00 4.25 H new ATOM 0 HE2 LYS A 39 1.502 25.648 24.182 1.00 52.51 H new ATOM 0 HE3 LYS A 39 2.993 24.861 23.704 1.00 52.51 H new ATOM 0 HZ1 LYS A 39 3.379 26.488 25.437 1.00 72.10 H new ATOM 0 HZ2 LYS A 39 4.170 26.962 24.011 1.00 72.10 H new ATOM 0 HZ3 LYS A 39 2.725 27.725 24.475 1.00 72.10 H new ATOM 597 N LEU A 40 1.127 28.141 19.545 1.00 45.40 N ATOM 598 CA LEU A 40 -0.328 28.036 19.545 1.00 30.51 C ATOM 599 C LEU A 40 -0.847 27.664 18.160 1.00 24.31 C ATOM 600 O LEU A 40 -1.877 27.003 18.028 1.00 53.23 O ATOM 601 CB LEU A 40 -0.955 29.354 20.001 1.00 62.25 C ATOM 602 CG LEU A 40 -2.204 29.237 20.875 1.00 62.40 C ATOM 603 CD1 LEU A 40 -1.830 29.270 22.349 1.00 65.41 C ATOM 604 CD2 LEU A 40 -3.190 30.348 20.548 1.00 40.33 C ATOM 0 H LEU A 40 1.483 29.053 19.829 1.00 45.40 H new ATOM 0 HA LEU A 40 -0.610 27.247 20.242 1.00 30.51 H new ATOM 0 HB2 LEU A 40 -0.203 29.920 20.551 1.00 62.25 H new ATOM 0 HB3 LEU A 40 -1.209 29.938 19.116 1.00 62.25 H new ATOM 0 HG LEU A 40 -2.682 28.281 20.664 1.00 62.40 H new ATOM 0 HD11 LEU A 40 -2.732 29.186 22.955 1.00 65.41 H new ATOM 0 HD12 LEU A 40 -1.163 28.438 22.574 1.00 65.41 H new ATOM 0 HD13 LEU A 40 -1.327 30.210 22.576 1.00 65.41 H new ATOM 0 HD21 LEU A 40 -4.073 30.249 21.180 1.00 40.33 H new ATOM 0 HD22 LEU A 40 -2.721 31.315 20.729 1.00 40.33 H new ATOM 0 HD23 LEU A 40 -3.484 30.277 19.501 1.00 40.33 H new ATOM 616 N CYS A 41 -0.125 28.091 17.129 1.00 71.32 N ATOM 617 CA CYS A 41 -0.512 27.803 15.753 1.00 32.43 C ATOM 618 C CYS A 41 -0.202 26.353 15.394 1.00 71.31 C ATOM 619 O CYS A 41 -1.050 25.642 14.857 1.00 54.00 O ATOM 620 CB CYS A 41 0.211 28.744 14.789 1.00 4.10 C ATOM 621 SG CYS A 41 -0.766 29.214 13.344 1.00 64.24 S ATOM 0 H CYS A 41 0.731 28.638 17.221 1.00 71.32 H new ATOM 0 HA CYS A 41 -1.587 27.960 15.664 1.00 32.43 H new ATOM 0 HB2 CYS A 41 0.500 29.646 15.328 1.00 4.10 H new ATOM 0 HB3 CYS A 41 1.131 28.265 14.452 1.00 4.10 H new ATOM 0 HG CYS A 41 -0.383 28.517 12.316 1.00 64.24 H new ATOM 627 N GLU A 42 1.020 25.922 15.693 1.00 1.23 N ATOM 628 CA GLU A 42 1.442 24.558 15.398 1.00 31.14 C ATOM 629 C GLU A 42 0.630 23.551 16.208 1.00 70.30 C ATOM 630 O GLU A 42 0.390 22.430 15.761 1.00 33.53 O ATOM 631 CB GLU A 42 2.932 24.385 15.698 1.00 13.23 C ATOM 632 CG GLU A 42 3.632 23.415 14.762 1.00 2.44 C ATOM 633 CD GLU A 42 4.696 22.592 15.464 1.00 24.32 C ATOM 634 OE1 GLU A 42 5.698 23.182 15.917 1.00 2.54 O ATOM 635 OE2 GLU A 42 4.526 21.359 15.559 1.00 23.14 O ATOM 0 H GLU A 42 1.734 26.498 16.139 1.00 1.23 H new ATOM 0 HA GLU A 42 1.268 24.372 14.338 1.00 31.14 H new ATOM 0 HB2 GLU A 42 3.422 25.356 15.634 1.00 13.23 H new ATOM 0 HB3 GLU A 42 3.049 24.036 16.724 1.00 13.23 H new ATOM 0 HG2 GLU A 42 2.894 22.746 14.319 1.00 2.44 H new ATOM 0 HG3 GLU A 42 4.089 23.971 13.944 1.00 2.44 H new ATOM 642 N GLU A 43 0.209 23.960 17.401 1.00 1.52 N ATOM 643 CA GLU A 43 -0.574 23.093 18.273 1.00 43.21 C ATOM 644 C GLU A 43 -1.802 22.555 17.544 1.00 30.12 C ATOM 645 O GLU A 43 -2.211 21.413 17.757 1.00 44.32 O ATOM 646 CB GLU A 43 -1.006 23.853 19.529 1.00 55.32 C ATOM 647 CG GLU A 43 -0.374 23.326 20.807 1.00 52.45 C ATOM 648 CD GLU A 43 -1.382 23.147 21.925 1.00 55.42 C ATOM 649 OE1 GLU A 43 -2.416 23.848 21.909 1.00 50.31 O ATOM 650 OE2 GLU A 43 -1.139 22.307 22.816 1.00 31.33 O ATOM 0 H GLU A 43 0.397 24.886 17.785 1.00 1.52 H new ATOM 0 HA GLU A 43 0.053 22.250 18.564 1.00 43.21 H new ATOM 0 HB2 GLU A 43 -0.748 24.906 19.413 1.00 55.32 H new ATOM 0 HB3 GLU A 43 -2.091 23.799 19.621 1.00 55.32 H new ATOM 0 HG2 GLU A 43 0.109 22.371 20.602 1.00 52.45 H new ATOM 0 HG3 GLU A 43 0.406 24.014 21.133 1.00 52.45 H new ATOM 657 N ALA A 44 -2.383 23.384 16.684 1.00 53.52 N ATOM 658 CA ALA A 44 -3.562 22.991 15.922 1.00 52.44 C ATOM 659 C ALA A 44 -3.228 21.889 14.922 1.00 3.25 C ATOM 660 O ALA A 44 -3.916 20.871 14.853 1.00 42.31 O ATOM 661 CB ALA A 44 -4.154 24.196 15.205 1.00 3.44 C ATOM 0 H ALA A 44 -2.057 24.332 16.497 1.00 53.52 H new ATOM 0 HA ALA A 44 -4.301 22.599 16.621 1.00 52.44 H new ATOM 0 HB1 ALA A 44 -5.034 23.887 14.640 1.00 3.44 H new ATOM 0 HB2 ALA A 44 -4.440 24.951 15.937 1.00 3.44 H new ATOM 0 HB3 ALA A 44 -3.413 24.614 14.523 1.00 3.44 H new ATOM 667 N ALA A 45 -2.167 22.100 14.150 1.00 43.04 N ATOM 668 CA ALA A 45 -1.741 21.124 13.155 1.00 64.10 C ATOM 669 C ALA A 45 -1.245 19.844 13.818 1.00 44.12 C ATOM 670 O ALA A 45 -1.281 18.768 13.220 1.00 1.40 O ATOM 671 CB ALA A 45 -0.656 21.716 12.266 1.00 31.52 C ATOM 0 H ALA A 45 -1.587 22.938 14.195 1.00 43.04 H new ATOM 0 HA ALA A 45 -2.603 20.871 12.538 1.00 64.10 H new ATOM 0 HB1 ALA A 45 -0.347 20.976 11.527 1.00 31.52 H new ATOM 0 HB2 ALA A 45 -1.044 22.598 11.756 1.00 31.52 H new ATOM 0 HB3 ALA A 45 0.201 21.998 12.877 1.00 31.52 H new ATOM 677 N LYS A 46 -0.781 19.968 15.057 1.00 21.32 N ATOM 678 CA LYS A 46 -0.278 18.820 15.804 1.00 64.10 C ATOM 679 C LYS A 46 -1.380 17.789 16.025 1.00 11.13 C ATOM 680 O LYS A 46 -1.153 16.586 15.895 1.00 34.13 O ATOM 681 CB LYS A 46 0.291 19.272 17.150 1.00 41.31 C ATOM 682 CG LYS A 46 1.630 18.640 17.488 1.00 3.42 C ATOM 683 CD LYS A 46 2.590 19.655 18.087 1.00 11.30 C ATOM 684 CE LYS A 46 3.599 18.990 19.011 1.00 72.50 C ATOM 685 NZ LYS A 46 4.913 19.690 18.995 1.00 61.11 N ATOM 0 H LYS A 46 -0.743 20.851 15.565 1.00 21.32 H new ATOM 0 HA LYS A 46 0.516 18.356 15.218 1.00 64.10 H new ATOM 0 HB2 LYS A 46 0.402 20.356 17.142 1.00 41.31 H new ATOM 0 HB3 LYS A 46 -0.424 19.031 17.937 1.00 41.31 H new ATOM 0 HG2 LYS A 46 1.480 17.821 18.191 1.00 3.42 H new ATOM 0 HG3 LYS A 46 2.068 18.210 16.587 1.00 3.42 H new ATOM 0 HD2 LYS A 46 3.116 20.176 17.287 1.00 11.30 H new ATOM 0 HD3 LYS A 46 2.028 20.406 18.641 1.00 11.30 H new ATOM 0 HE2 LYS A 46 3.207 18.978 20.028 1.00 72.50 H new ATOM 0 HE3 LYS A 46 3.737 17.952 18.710 1.00 72.50 H new ATOM 0 HZ1 LYS A 46 5.572 19.206 19.637 1.00 61.11 H new ATOM 0 HZ2 LYS A 46 5.300 19.680 18.030 1.00 61.11 H new ATOM 0 HZ3 LYS A 46 4.786 20.674 19.307 1.00 61.11 H new ATOM 699 N LYS A 47 -2.573 18.268 16.357 1.00 14.41 N ATOM 700 CA LYS A 47 -3.712 17.389 16.595 1.00 20.41 C ATOM 701 C LYS A 47 -3.986 16.513 15.376 1.00 42.34 C ATOM 702 O LYS A 47 -4.484 15.395 15.502 1.00 20.14 O ATOM 703 CB LYS A 47 -4.956 18.212 16.935 1.00 61.20 C ATOM 704 CG LYS A 47 -6.095 17.385 17.505 1.00 35.23 C ATOM 705 CD LYS A 47 -5.828 16.988 18.948 1.00 72.30 C ATOM 706 CE LYS A 47 -6.869 16.001 19.456 1.00 31.10 C ATOM 707 NZ LYS A 47 -6.953 16.001 20.943 1.00 13.14 N ATOM 0 H LYS A 47 -2.777 19.261 16.468 1.00 14.41 H new ATOM 0 HA LYS A 47 -3.471 16.743 17.439 1.00 20.41 H new ATOM 0 HB2 LYS A 47 -4.685 18.985 17.654 1.00 61.20 H new ATOM 0 HB3 LYS A 47 -5.302 18.720 16.035 1.00 61.20 H new ATOM 0 HG2 LYS A 47 -7.023 17.954 17.449 1.00 35.23 H new ATOM 0 HG3 LYS A 47 -6.234 16.489 16.900 1.00 35.23 H new ATOM 0 HD2 LYS A 47 -4.835 16.544 19.027 1.00 72.30 H new ATOM 0 HD3 LYS A 47 -5.831 17.878 19.578 1.00 72.30 H new ATOM 0 HE2 LYS A 47 -7.843 16.253 19.037 1.00 31.10 H new ATOM 0 HE3 LYS A 47 -6.621 14.999 19.106 1.00 31.10 H new ATOM 0 HZ1 LYS A 47 -7.673 15.316 21.250 1.00 13.14 H new ATOM 0 HZ2 LYS A 47 -6.030 15.736 21.343 1.00 13.14 H new ATOM 0 HZ3 LYS A 47 -7.215 16.951 21.276 1.00 13.14 H new ATOM 721 N ALA A 48 -3.657 17.029 14.197 1.00 64.41 N ATOM 722 CA ALA A 48 -3.864 16.293 12.956 1.00 40.10 C ATOM 723 C ALA A 48 -2.940 15.084 12.874 1.00 31.55 C ATOM 724 O ALA A 48 -3.352 14.004 12.448 1.00 11.44 O ATOM 725 CB ALA A 48 -3.649 17.206 11.758 1.00 61.34 C ATOM 0 H ALA A 48 -3.246 17.954 14.075 1.00 64.41 H new ATOM 0 HA ALA A 48 -4.893 15.933 12.944 1.00 40.10 H new ATOM 0 HB1 ALA A 48 -3.807 16.643 10.838 1.00 61.34 H new ATOM 0 HB2 ALA A 48 -4.355 18.035 11.801 1.00 61.34 H new ATOM 0 HB3 ALA A 48 -2.631 17.595 11.775 1.00 61.34 H new ATOM 731 N GLU A 49 -1.689 15.271 13.282 1.00 10.33 N ATOM 732 CA GLU A 49 -0.707 14.194 13.254 1.00 3.21 C ATOM 733 C GLU A 49 -1.014 13.148 14.321 1.00 14.30 C ATOM 734 O GLU A 49 -0.765 11.959 14.128 1.00 14.55 O ATOM 735 CB GLU A 49 0.702 14.753 13.462 1.00 3.54 C ATOM 736 CG GLU A 49 1.705 14.283 12.421 1.00 74.33 C ATOM 737 CD GLU A 49 2.647 13.222 12.957 1.00 4.44 C ATOM 738 OE1 GLU A 49 3.221 13.435 14.045 1.00 2.31 O ATOM 739 OE2 GLU A 49 2.811 12.181 12.288 1.00 33.12 O ATOM 0 H GLU A 49 -1.332 16.158 13.636 1.00 10.33 H new ATOM 0 HA GLU A 49 -0.760 13.715 12.276 1.00 3.21 H new ATOM 0 HB2 GLU A 49 0.658 15.842 13.445 1.00 3.54 H new ATOM 0 HB3 GLU A 49 1.056 14.464 14.451 1.00 3.54 H new ATOM 0 HG2 GLU A 49 1.169 13.886 11.559 1.00 74.33 H new ATOM 0 HG3 GLU A 49 2.286 15.136 12.070 1.00 74.33 H new ATOM 746 N GLU A 50 -1.555 13.602 15.447 1.00 40.25 N ATOM 747 CA GLU A 50 -1.896 12.706 16.546 1.00 1.21 C ATOM 748 C GLU A 50 -3.088 11.826 16.182 1.00 12.01 C ATOM 749 O GLU A 50 -3.191 10.684 16.631 1.00 74.30 O ATOM 750 CB GLU A 50 -2.208 13.508 17.811 1.00 43.52 C ATOM 751 CG GLU A 50 -1.902 12.761 19.098 1.00 42.23 C ATOM 752 CD GLU A 50 -1.136 13.606 20.095 1.00 10.30 C ATOM 753 OE1 GLU A 50 -1.671 13.857 21.196 1.00 63.54 O ATOM 754 OE2 GLU A 50 0.000 14.018 19.777 1.00 13.41 O ATOM 0 H GLU A 50 -1.767 14.584 15.622 1.00 40.25 H new ATOM 0 HA GLU A 50 -1.036 12.063 16.735 1.00 1.21 H new ATOM 0 HB2 GLU A 50 -1.634 14.435 17.794 1.00 43.52 H new ATOM 0 HB3 GLU A 50 -3.262 13.785 17.804 1.00 43.52 H new ATOM 0 HG2 GLU A 50 -2.836 12.428 19.551 1.00 42.23 H new ATOM 0 HG3 GLU A 50 -1.324 11.867 18.866 1.00 42.23 H new ATOM 761 N LEU A 51 -3.987 12.366 15.366 1.00 33.45 N ATOM 762 CA LEU A 51 -5.172 11.631 14.941 1.00 74.44 C ATOM 763 C LEU A 51 -4.805 10.529 13.952 1.00 72.53 C ATOM 764 O LEU A 51 -5.479 9.502 13.874 1.00 34.43 O ATOM 765 CB LEU A 51 -6.186 12.585 14.306 1.00 72.31 C ATOM 766 CG LEU A 51 -7.372 12.986 15.184 1.00 0.41 C ATOM 767 CD1 LEU A 51 -8.141 14.135 14.550 1.00 14.53 C ATOM 768 CD2 LEU A 51 -8.289 11.795 15.419 1.00 14.31 C ATOM 0 H LEU A 51 -3.917 13.310 14.986 1.00 33.45 H new ATOM 0 HA LEU A 51 -5.618 11.169 15.822 1.00 74.44 H new ATOM 0 HB2 LEU A 51 -5.662 13.491 14.003 1.00 72.31 H new ATOM 0 HB3 LEU A 51 -6.572 12.121 13.398 1.00 72.31 H new ATOM 0 HG LEU A 51 -6.989 13.320 16.148 1.00 0.41 H new ATOM 0 HD11 LEU A 51 -8.981 14.407 15.189 1.00 14.53 H new ATOM 0 HD12 LEU A 51 -7.481 14.994 14.434 1.00 14.53 H new ATOM 0 HD13 LEU A 51 -8.513 13.828 13.572 1.00 14.53 H new ATOM 0 HD21 LEU A 51 -9.127 12.099 16.046 1.00 14.31 H new ATOM 0 HD22 LEU A 51 -8.664 11.431 14.463 1.00 14.31 H new ATOM 0 HD23 LEU A 51 -7.733 11.001 15.917 1.00 14.31 H new ATOM 780 N PHE A 52 -3.733 10.749 13.200 1.00 5.12 N ATOM 781 CA PHE A 52 -3.274 9.775 12.217 1.00 71.33 C ATOM 782 C PHE A 52 -3.070 8.407 12.862 1.00 21.42 C ATOM 783 O PHE A 52 -3.284 7.372 12.231 1.00 31.51 O ATOM 784 CB PHE A 52 -1.971 10.246 11.569 1.00 21.30 C ATOM 785 CG PHE A 52 -2.033 10.303 10.069 1.00 73.32 C ATOM 786 CD1 PHE A 52 -1.128 9.592 9.298 1.00 3.53 C ATOM 787 CD2 PHE A 52 -2.997 11.067 9.431 1.00 34.42 C ATOM 788 CE1 PHE A 52 -1.182 9.642 7.917 1.00 2.42 C ATOM 789 CE2 PHE A 52 -3.056 11.120 8.052 1.00 72.35 C ATOM 790 CZ PHE A 52 -2.147 10.408 7.294 1.00 64.54 C ATOM 0 H PHE A 52 -3.165 11.594 13.252 1.00 5.12 H new ATOM 0 HA PHE A 52 -4.041 9.684 11.448 1.00 71.33 H new ATOM 0 HB2 PHE A 52 -1.721 11.235 11.952 1.00 21.30 H new ATOM 0 HB3 PHE A 52 -1.164 9.576 11.866 1.00 21.30 H new ATOM 0 HD1 PHE A 52 -0.371 8.992 9.781 1.00 3.53 H new ATOM 0 HD2 PHE A 52 -3.710 11.627 10.018 1.00 34.42 H new ATOM 0 HE1 PHE A 52 -0.471 9.083 7.327 1.00 2.42 H new ATOM 0 HE2 PHE A 52 -3.813 11.718 7.566 1.00 72.35 H new ATOM 0 HZ PHE A 52 -2.191 10.450 6.216 1.00 64.54 H new ATOM 800 N LYS A 53 -2.654 8.411 14.124 1.00 2.31 N ATOM 801 CA LYS A 53 -2.420 7.173 14.856 1.00 13.02 C ATOM 802 C LYS A 53 -3.695 6.337 14.934 1.00 44.42 C ATOM 803 O LYS A 53 -3.693 5.151 14.602 1.00 31.14 O ATOM 804 CB LYS A 53 -1.912 7.479 16.267 1.00 73.21 C ATOM 805 CG LYS A 53 -1.057 6.372 16.859 1.00 54.21 C ATOM 806 CD LYS A 53 -0.505 6.761 18.220 1.00 41.50 C ATOM 807 CE LYS A 53 1.014 6.689 18.247 1.00 21.25 C ATOM 808 NZ LYS A 53 1.510 5.331 17.890 1.00 1.14 N ATOM 0 H LYS A 53 -2.472 9.259 14.661 1.00 2.31 H new ATOM 0 HA LYS A 53 -1.663 6.601 14.319 1.00 13.02 H new ATOM 0 HB2 LYS A 53 -1.332 8.401 16.243 1.00 73.21 H new ATOM 0 HB3 LYS A 53 -2.766 7.656 16.921 1.00 73.21 H new ATOM 0 HG2 LYS A 53 -1.651 5.463 16.953 1.00 54.21 H new ATOM 0 HG3 LYS A 53 -0.233 6.146 16.182 1.00 54.21 H new ATOM 0 HD2 LYS A 53 -0.827 7.772 18.469 1.00 41.50 H new ATOM 0 HD3 LYS A 53 -0.915 6.099 18.983 1.00 41.50 H new ATOM 0 HE2 LYS A 53 1.425 7.421 17.551 1.00 21.25 H new ATOM 0 HE3 LYS A 53 1.373 6.957 19.241 1.00 21.25 H new ATOM 0 HZ1 LYS A 53 2.443 5.177 18.323 1.00 1.14 H new ATOM 0 HZ2 LYS A 53 0.843 4.614 18.242 1.00 1.14 H new ATOM 0 HZ3 LYS A 53 1.590 5.251 16.856 1.00 1.14 H new ATOM 822 N LEU A 54 -4.781 6.964 15.371 1.00 14.04 N ATOM 823 CA LEU A 54 -6.064 6.278 15.491 1.00 1.24 C ATOM 824 C LEU A 54 -6.663 6.002 14.116 1.00 23.41 C ATOM 825 O LEU A 54 -7.230 4.936 13.878 1.00 62.13 O ATOM 826 CB LEU A 54 -7.036 7.114 16.325 1.00 1.15 C ATOM 827 CG LEU A 54 -7.643 6.419 17.544 1.00 13.31 C ATOM 828 CD1 LEU A 54 -7.090 7.016 18.829 1.00 54.00 C ATOM 829 CD2 LEU A 54 -9.161 6.523 17.515 1.00 15.32 C ATOM 0 H LEU A 54 -4.800 7.945 15.648 1.00 14.04 H new ATOM 0 HA LEU A 54 -5.894 5.325 15.991 1.00 1.24 H new ATOM 0 HB2 LEU A 54 -6.515 8.010 16.664 1.00 1.15 H new ATOM 0 HB3 LEU A 54 -7.849 7.444 15.678 1.00 1.15 H new ATOM 0 HG LEU A 54 -7.370 5.364 17.511 1.00 13.31 H new ATOM 0 HD11 LEU A 54 -7.533 6.509 19.686 1.00 54.00 H new ATOM 0 HD12 LEU A 54 -6.008 6.890 18.853 1.00 54.00 H new ATOM 0 HD13 LEU A 54 -7.332 8.078 18.871 1.00 54.00 H new ATOM 0 HD21 LEU A 54 -9.577 6.023 18.390 1.00 15.32 H new ATOM 0 HD22 LEU A 54 -9.454 7.573 17.524 1.00 15.32 H new ATOM 0 HD23 LEU A 54 -9.541 6.048 16.611 1.00 15.32 H new ATOM 841 N ALA A 55 -6.532 6.969 13.214 1.00 1.32 N ATOM 842 CA ALA A 55 -7.057 6.829 11.861 1.00 11.02 C ATOM 843 C ALA A 55 -6.406 5.654 11.139 1.00 63.11 C ATOM 844 O ALA A 55 -7.025 5.019 10.286 1.00 34.24 O ATOM 845 CB ALA A 55 -6.846 8.115 11.077 1.00 10.33 C ATOM 0 H ALA A 55 -6.067 7.858 13.396 1.00 1.32 H new ATOM 0 HA ALA A 55 -8.127 6.631 11.931 1.00 11.02 H new ATOM 0 HB1 ALA A 55 -7.243 7.996 10.069 1.00 10.33 H new ATOM 0 HB2 ALA A 55 -7.363 8.934 11.576 1.00 10.33 H new ATOM 0 HB3 ALA A 55 -5.780 8.338 11.023 1.00 10.33 H new ATOM 851 N GLU A 56 -5.154 5.373 11.486 1.00 21.32 N ATOM 852 CA GLU A 56 -4.419 4.275 10.868 1.00 10.23 C ATOM 853 C GLU A 56 -5.074 2.933 11.188 1.00 44.35 C ATOM 854 O GLU A 56 -5.310 2.120 10.296 1.00 34.44 O ATOM 855 CB GLU A 56 -2.966 4.271 11.346 1.00 22.44 C ATOM 856 CG GLU A 56 -2.029 3.486 10.443 1.00 32.30 C ATOM 857 CD GLU A 56 -0.824 2.940 11.184 1.00 41.42 C ATOM 858 OE1 GLU A 56 -0.449 1.777 10.930 1.00 43.42 O ATOM 859 OE2 GLU A 56 -0.258 3.677 12.018 1.00 3.34 O ATOM 0 H GLU A 56 -4.628 5.890 12.191 1.00 21.32 H new ATOM 0 HA GLU A 56 -4.439 4.422 9.788 1.00 10.23 H new ATOM 0 HB2 GLU A 56 -2.613 5.300 11.415 1.00 22.44 H new ATOM 0 HB3 GLU A 56 -2.924 3.851 12.351 1.00 22.44 H new ATOM 0 HG2 GLU A 56 -2.576 2.660 9.989 1.00 32.30 H new ATOM 0 HG3 GLU A 56 -1.690 4.129 9.631 1.00 32.30 H new ATOM 866 N GLU A 57 -5.366 2.714 12.465 1.00 13.33 N ATOM 867 CA GLU A 57 -5.992 1.472 12.902 1.00 52.13 C ATOM 868 C GLU A 57 -7.473 1.451 12.537 1.00 52.25 C ATOM 869 O GLU A 57 -8.058 0.388 12.328 1.00 44.21 O ATOM 870 CB GLU A 57 -5.826 1.295 14.413 1.00 30.21 C ATOM 871 CG GLU A 57 -4.741 0.301 14.794 1.00 73.42 C ATOM 872 CD GLU A 57 -4.443 0.303 16.280 1.00 53.22 C ATOM 873 OE1 GLU A 57 -5.306 -0.155 17.059 1.00 1.20 O ATOM 874 OE2 GLU A 57 -3.349 0.763 16.666 1.00 3.13 O ATOM 0 H GLU A 57 -5.179 3.380 13.215 1.00 13.33 H new ATOM 0 HA GLU A 57 -5.497 0.647 12.390 1.00 52.13 H new ATOM 0 HB2 GLU A 57 -5.595 2.262 14.860 1.00 30.21 H new ATOM 0 HB3 GLU A 57 -6.774 0.966 14.838 1.00 30.21 H new ATOM 0 HG2 GLU A 57 -5.048 -0.700 14.490 1.00 73.42 H new ATOM 0 HG3 GLU A 57 -3.829 0.536 14.244 1.00 73.42 H new ATOM 881 N ARG A 58 -8.075 2.635 12.464 1.00 25.41 N ATOM 882 CA ARG A 58 -9.488 2.753 12.125 1.00 15.51 C ATOM 883 C ARG A 58 -9.710 2.533 10.632 1.00 44.33 C ATOM 884 O ARG A 58 -10.199 1.484 10.214 1.00 30.32 O ATOM 885 CB ARG A 58 -10.018 4.129 12.534 1.00 5.51 C ATOM 886 CG ARG A 58 -10.387 4.227 14.005 1.00 42.31 C ATOM 887 CD ARG A 58 -11.673 3.477 14.307 1.00 74.03 C ATOM 888 NE ARG A 58 -12.445 4.118 15.369 1.00 5.11 N ATOM 889 CZ ARG A 58 -13.558 3.606 15.881 1.00 70.13 C ATOM 890 NH1 ARG A 58 -14.028 2.450 15.431 1.00 2.24 N ATOM 891 NH2 ARG A 58 -14.204 4.249 16.846 1.00 63.14 N ATOM 0 H ARG A 58 -7.606 3.525 12.635 1.00 25.41 H new ATOM 0 HA ARG A 58 -10.033 1.983 12.672 1.00 15.51 H new ATOM 0 HB2 ARG A 58 -9.263 4.882 12.307 1.00 5.51 H new ATOM 0 HB3 ARG A 58 -10.895 4.365 11.932 1.00 5.51 H new ATOM 0 HG2 ARG A 58 -9.577 3.822 14.612 1.00 42.31 H new ATOM 0 HG3 ARG A 58 -10.501 5.275 14.284 1.00 42.31 H new ATOM 0 HD2 ARG A 58 -12.279 3.419 13.403 1.00 74.03 H new ATOM 0 HD3 ARG A 58 -11.436 2.454 14.598 1.00 74.03 H new ATOM 0 HE ARG A 58 -12.110 5.008 15.738 1.00 5.11 H new ATOM 0 HH11 ARG A 58 -13.534 1.952 14.690 1.00 2.24 H new ATOM 0 HH12 ARG A 58 -14.883 2.059 15.826 1.00 2.24 H new ATOM 0 HH21 ARG A 58 -13.846 5.138 17.195 1.00 63.14 H new ATOM 0 HH22 ARG A 58 -15.059 3.854 17.238 1.00 63.14 H new ATOM 905 N LEU A 59 -9.349 3.531 9.832 1.00 45.23 N ATOM 906 CA LEU A 59 -9.509 3.448 8.385 1.00 3.22 C ATOM 907 C LEU A 59 -8.803 2.216 7.829 1.00 34.53 C ATOM 908 O LEU A 59 -9.191 1.679 6.790 1.00 55.41 O ATOM 909 CB LEU A 59 -8.958 4.710 7.717 1.00 61.21 C ATOM 910 CG LEU A 59 -9.462 6.040 8.278 1.00 30.03 C ATOM 911 CD1 LEU A 59 -8.818 7.206 7.545 1.00 52.35 C ATOM 912 CD2 LEU A 59 -10.978 6.119 8.183 1.00 45.12 C ATOM 0 H LEU A 59 -8.944 4.407 10.162 1.00 45.23 H new ATOM 0 HA LEU A 59 -10.574 3.364 8.167 1.00 3.22 H new ATOM 0 HB2 LEU A 59 -7.871 4.694 7.796 1.00 61.21 H new ATOM 0 HB3 LEU A 59 -9.201 4.671 6.655 1.00 61.21 H new ATOM 0 HG LEU A 59 -9.181 6.099 9.330 1.00 30.03 H new ATOM 0 HD11 LEU A 59 -9.188 8.144 7.958 1.00 52.35 H new ATOM 0 HD12 LEU A 59 -7.736 7.159 7.666 1.00 52.35 H new ATOM 0 HD13 LEU A 59 -9.067 7.152 6.485 1.00 52.35 H new ATOM 0 HD21 LEU A 59 -11.319 7.072 8.587 1.00 45.12 H new ATOM 0 HD22 LEU A 59 -11.282 6.038 7.139 1.00 45.12 H new ATOM 0 HD23 LEU A 59 -11.421 5.304 8.755 1.00 45.12 H new ATOM 924 N LYS A 60 -7.764 1.770 8.528 1.00 43.03 N ATOM 925 CA LYS A 60 -7.005 0.599 8.107 1.00 33.22 C ATOM 926 C LYS A 60 -6.467 0.778 6.691 1.00 23.21 C ATOM 927 O LYS A 60 -7.060 0.299 5.725 1.00 44.14 O ATOM 928 CB LYS A 60 -7.881 -0.655 8.175 1.00 52.31 C ATOM 929 CG LYS A 60 -8.022 -1.222 9.577 1.00 33.43 C ATOM 930 CD LYS A 60 -7.549 -2.665 9.644 1.00 1.21 C ATOM 931 CE LYS A 60 -7.664 -3.225 11.054 1.00 52.14 C ATOM 932 NZ LYS A 60 -8.873 -4.080 11.213 1.00 52.03 N ATOM 0 H LYS A 60 -7.429 2.202 9.389 1.00 43.03 H new ATOM 0 HA LYS A 60 -6.160 0.483 8.786 1.00 33.22 H new ATOM 0 HB2 LYS A 60 -8.871 -0.418 7.787 1.00 52.31 H new ATOM 0 HB3 LYS A 60 -7.458 -1.420 7.524 1.00 52.31 H new ATOM 0 HG2 LYS A 60 -7.445 -0.616 10.275 1.00 33.43 H new ATOM 0 HG3 LYS A 60 -9.064 -1.165 9.891 1.00 33.43 H new ATOM 0 HD2 LYS A 60 -8.140 -3.275 8.960 1.00 1.21 H new ATOM 0 HD3 LYS A 60 -6.513 -2.725 9.311 1.00 1.21 H new ATOM 0 HE2 LYS A 60 -6.773 -3.808 11.287 1.00 52.14 H new ATOM 0 HE3 LYS A 60 -7.703 -2.403 11.769 1.00 52.14 H new ATOM 0 HZ1 LYS A 60 -8.916 -4.443 12.187 1.00 52.03 H new ATOM 0 HZ2 LYS A 60 -9.725 -3.517 11.015 1.00 52.03 H new ATOM 0 HZ3 LYS A 60 -8.824 -4.878 10.548 1.00 52.03 H new ATOM 946 N LYS A 61 -5.338 1.469 6.576 1.00 24.41 N ATOM 947 CA LYS A 61 -4.716 1.710 5.279 1.00 42.03 C ATOM 948 C LYS A 61 -4.370 0.394 4.588 1.00 43.52 C ATOM 949 O LYS A 61 -3.792 -0.505 5.199 1.00 74.21 O ATOM 950 CB LYS A 61 -3.455 2.559 5.444 1.00 2.35 C ATOM 951 CG LYS A 61 -3.708 4.053 5.336 1.00 24.23 C ATOM 952 CD LYS A 61 -2.565 4.762 4.628 1.00 23.52 C ATOM 953 CE LYS A 61 -1.938 5.829 5.511 1.00 44.32 C ATOM 954 NZ LYS A 61 -1.194 6.843 4.713 1.00 10.31 N ATOM 0 H LYS A 61 -4.835 1.872 7.366 1.00 24.41 H new ATOM 0 HA LYS A 61 -5.430 2.250 4.657 1.00 42.03 H new ATOM 0 HB2 LYS A 61 -3.007 2.344 6.414 1.00 2.35 H new ATOM 0 HB3 LYS A 61 -2.729 2.266 4.686 1.00 2.35 H new ATOM 0 HG2 LYS A 61 -4.637 4.227 4.794 1.00 24.23 H new ATOM 0 HG3 LYS A 61 -3.837 4.474 6.333 1.00 24.23 H new ATOM 0 HD2 LYS A 61 -1.806 4.034 4.341 1.00 23.52 H new ATOM 0 HD3 LYS A 61 -2.932 5.219 3.709 1.00 23.52 H new ATOM 0 HE2 LYS A 61 -2.717 6.324 6.091 1.00 44.32 H new ATOM 0 HE3 LYS A 61 -1.260 5.359 6.223 1.00 44.32 H new ATOM 0 HZ1 LYS A 61 -0.782 7.553 5.351 1.00 10.31 H new ATOM 0 HZ2 LYS A 61 -0.434 6.375 4.179 1.00 10.31 H new ATOM 0 HZ3 LYS A 61 -1.846 7.310 4.051 1.00 10.31 H new ATOM 968 N LEU A 62 -4.726 0.290 3.313 1.00 62.31 N ATOM 969 CA LEU A 62 -4.451 -0.916 2.539 1.00 64.12 C ATOM 970 C LEU A 62 -5.074 -2.141 3.199 1.00 14.21 C ATOM 971 O LEU A 62 -6.260 -2.397 2.997 1.00 2.42 O ATOM 972 CB LEU A 62 -2.942 -1.115 2.388 1.00 21.31 C ATOM 973 CG LEU A 62 -2.200 -0.044 1.586 1.00 34.43 C ATOM 974 CD1 LEU A 62 -0.803 0.170 2.147 1.00 14.14 C ATOM 975 CD2 LEU A 62 -2.132 -0.430 0.116 1.00 30.52 C ATOM 0 H LEU A 62 -5.205 1.025 2.793 1.00 62.31 H new ATOM 0 HA LEU A 62 -4.896 -0.794 1.551 1.00 64.12 H new ATOM 0 HB2 LEU A 62 -2.501 -1.165 3.384 1.00 21.31 H new ATOM 0 HB3 LEU A 62 -2.769 -2.081 1.913 1.00 21.31 H new ATOM 0 HG LEU A 62 -2.751 0.893 1.670 1.00 34.43 H new ATOM 0 HD11 LEU A 62 -0.290 0.935 1.564 1.00 14.14 H new ATOM 0 HD12 LEU A 62 -0.874 0.492 3.186 1.00 14.14 H new ATOM 0 HD13 LEU A 62 -0.243 -0.763 2.094 1.00 14.14 H new ATOM 0 HD21 LEU A 62 -1.601 0.343 -0.439 1.00 30.52 H new ATOM 0 HD22 LEU A 62 -1.604 -1.378 0.013 1.00 30.52 H new ATOM 0 HD23 LEU A 62 -3.142 -0.532 -0.280 1.00 30.52 H new TER 987 LEU A 62 ATOM 988 N MET B 1 -8.279 48.978 17.581 1.00 43.50 N ATOM 989 CA MET B 1 -9.043 47.738 17.613 1.00 14.21 C ATOM 990 C MET B 1 -8.196 46.564 17.131 1.00 20.03 C ATOM 991 O MET B 1 -8.694 45.659 16.460 1.00 43.42 O ATOM 992 CB MET B 1 -10.299 47.865 16.749 1.00 61.40 C ATOM 993 CG MET B 1 -10.002 48.106 15.277 1.00 11.41 C ATOM 994 SD MET B 1 -10.898 49.522 14.611 1.00 14.34 S ATOM 995 CE MET B 1 -9.552 50.666 14.315 1.00 22.44 C ATOM 0 H1 MET B 1 -8.931 49.785 17.510 1.00 43.50 H new ATOM 0 H2 MET B 1 -7.717 49.062 18.452 1.00 43.50 H new ATOM 0 H3 MET B 1 -7.643 48.973 16.758 1.00 43.50 H new ATOM 0 HA MET B 1 -9.339 47.550 18.645 1.00 14.21 H new ATOM 0 HB2 MET B 1 -10.891 46.955 16.848 1.00 61.40 H new ATOM 0 HB3 MET B 1 -10.909 48.685 17.127 1.00 61.40 H new ATOM 0 HG2 MET B 1 -8.931 48.265 15.148 1.00 11.41 H new ATOM 0 HG3 MET B 1 -10.263 47.215 14.707 1.00 11.41 H new ATOM 0 HE1 MET B 1 -9.947 51.594 13.901 1.00 22.44 H new ATOM 0 HE2 MET B 1 -9.040 50.877 15.254 1.00 22.44 H new ATOM 0 HE3 MET B 1 -8.848 50.225 13.609 1.00 22.44 H new ATOM 1005 N LYS B 2 -6.913 46.585 17.476 1.00 15.23 N ATOM 1006 CA LYS B 2 -5.996 45.523 17.081 1.00 63.31 C ATOM 1007 C LYS B 2 -5.859 45.462 15.563 1.00 33.53 C ATOM 1008 O LYS B 2 -6.694 45.994 14.831 1.00 75.30 O ATOM 1009 CB LYS B 2 -6.483 44.174 17.615 1.00 41.45 C ATOM 1010 CG LYS B 2 -6.904 44.215 19.074 1.00 52.20 C ATOM 1011 CD LYS B 2 -8.417 44.250 19.217 1.00 0.22 C ATOM 1012 CE LYS B 2 -8.874 43.539 20.481 1.00 22.22 C ATOM 1013 NZ LYS B 2 -8.803 44.427 21.674 1.00 33.04 N ATOM 0 H LYS B 2 -6.484 47.327 18.029 1.00 15.23 H new ATOM 0 HA LYS B 2 -5.018 45.743 17.509 1.00 63.31 H new ATOM 0 HB2 LYS B 2 -7.326 43.836 17.012 1.00 41.45 H new ATOM 0 HB3 LYS B 2 -5.689 43.437 17.495 1.00 41.45 H new ATOM 0 HG2 LYS B 2 -6.509 43.341 19.592 1.00 52.20 H new ATOM 0 HG3 LYS B 2 -6.472 45.093 19.554 1.00 52.20 H new ATOM 0 HD2 LYS B 2 -8.758 45.285 19.237 1.00 0.22 H new ATOM 0 HD3 LYS B 2 -8.877 43.780 18.348 1.00 0.22 H new ATOM 0 HE2 LYS B 2 -9.898 43.188 20.350 1.00 22.22 H new ATOM 0 HE3 LYS B 2 -8.254 42.658 20.647 1.00 22.22 H new ATOM 0 HZ1 LYS B 2 -9.123 43.905 22.515 1.00 33.04 H new ATOM 0 HZ2 LYS B 2 -7.822 44.742 21.814 1.00 33.04 H new ATOM 0 HZ3 LYS B 2 -9.415 45.255 21.527 1.00 33.04 H new ATOM 1027 N LYS B 3 -4.801 44.807 15.095 1.00 72.31 N ATOM 1028 CA LYS B 3 -4.556 44.671 13.665 1.00 62.23 C ATOM 1029 C LYS B 3 -4.038 43.276 13.331 1.00 23.41 C ATOM 1030 O LYS B 3 -4.458 42.666 12.346 1.00 13.24 O ATOM 1031 CB LYS B 3 -3.551 45.726 13.196 1.00 12.23 C ATOM 1032 CG LYS B 3 -3.918 47.142 13.608 1.00 33.21 C ATOM 1033 CD LYS B 3 -3.219 47.546 14.895 1.00 54.14 C ATOM 1034 CE LYS B 3 -4.067 48.511 15.710 1.00 42.24 C ATOM 1035 NZ LYS B 3 -3.442 48.826 17.025 1.00 72.34 N ATOM 0 H LYS B 3 -4.099 44.362 15.687 1.00 72.31 H new ATOM 0 HA LYS B 3 -5.502 44.822 13.144 1.00 62.23 H new ATOM 0 HB2 LYS B 3 -2.568 45.483 13.598 1.00 12.23 H new ATOM 0 HB3 LYS B 3 -3.471 45.682 12.110 1.00 12.23 H new ATOM 0 HG2 LYS B 3 -3.647 47.836 12.812 1.00 33.21 H new ATOM 0 HG3 LYS B 3 -4.997 47.215 13.740 1.00 33.21 H new ATOM 0 HD2 LYS B 3 -3.005 46.657 15.489 1.00 54.14 H new ATOM 0 HD3 LYS B 3 -2.261 48.011 14.660 1.00 54.14 H new ATOM 0 HE2 LYS B 3 -4.211 49.433 15.146 1.00 42.24 H new ATOM 0 HE3 LYS B 3 -5.055 48.079 15.872 1.00 42.24 H new ATOM 0 HZ1 LYS B 3 -4.051 49.486 17.549 1.00 72.34 H new ATOM 0 HZ2 LYS B 3 -3.328 47.950 17.574 1.00 72.34 H new ATOM 0 HZ3 LYS B 3 -2.510 49.262 16.871 1.00 72.34 H new ATOM 1049 N LEU B 4 -3.123 42.777 14.155 1.00 71.05 N ATOM 1050 CA LEU B 4 -2.549 41.452 13.948 1.00 40.52 C ATOM 1051 C LEU B 4 -3.349 40.389 14.693 1.00 74.42 C ATOM 1052 O LEU B 4 -3.475 39.255 14.230 1.00 21.33 O ATOM 1053 CB LEU B 4 -1.092 41.428 14.414 1.00 1.22 C ATOM 1054 CG LEU B 4 -0.836 41.915 15.841 1.00 24.14 C ATOM 1055 CD1 LEU B 4 0.106 40.966 16.567 1.00 4.31 C ATOM 1056 CD2 LEU B 4 -0.268 43.327 15.829 1.00 62.22 C ATOM 0 H LEU B 4 -2.763 43.270 14.972 1.00 71.05 H new ATOM 0 HA LEU B 4 -2.588 41.229 12.882 1.00 40.52 H new ATOM 0 HB2 LEU B 4 -0.721 40.407 14.328 1.00 1.22 H new ATOM 0 HB3 LEU B 4 -0.503 42.040 13.731 1.00 1.22 H new ATOM 0 HG LEU B 4 -1.786 41.932 16.375 1.00 24.14 H new ATOM 0 HD11 LEU B 4 0.277 41.328 17.581 1.00 4.31 H new ATOM 0 HD12 LEU B 4 -0.339 39.972 16.607 1.00 4.31 H new ATOM 0 HD13 LEU B 4 1.056 40.918 16.034 1.00 4.31 H new ATOM 0 HD21 LEU B 4 -0.092 43.657 16.853 1.00 62.22 H new ATOM 0 HD22 LEU B 4 0.673 43.336 15.278 1.00 62.22 H new ATOM 0 HD23 LEU B 4 -0.977 44.000 15.347 1.00 62.22 H new ATOM 1068 N ARG B 5 -3.892 40.763 15.847 1.00 24.12 N ATOM 1069 CA ARG B 5 -4.682 39.842 16.655 1.00 61.25 C ATOM 1070 C ARG B 5 -5.980 39.471 15.944 1.00 43.32 C ATOM 1071 O ARG B 5 -6.404 38.316 15.968 1.00 42.20 O ATOM 1072 CB ARG B 5 -4.994 40.464 18.017 1.00 21.24 C ATOM 1073 CG ARG B 5 -3.768 40.648 18.897 1.00 34.44 C ATOM 1074 CD ARG B 5 -3.399 42.115 19.039 1.00 43.14 C ATOM 1075 NE ARG B 5 -2.280 42.312 19.957 1.00 41.33 N ATOM 1076 CZ ARG B 5 -1.673 43.480 20.136 1.00 32.23 C ATOM 1077 NH1 ARG B 5 -2.075 44.549 19.463 1.00 43.11 N ATOM 1078 NH2 ARG B 5 -0.663 43.580 20.990 1.00 23.21 N ATOM 0 H ARG B 5 -3.799 41.698 16.244 1.00 24.12 H new ATOM 0 HA ARG B 5 -4.097 38.934 16.803 1.00 61.25 H new ATOM 0 HB2 ARG B 5 -5.470 41.433 17.864 1.00 21.24 H new ATOM 0 HB3 ARG B 5 -5.714 39.834 18.539 1.00 21.24 H new ATOM 0 HG2 ARG B 5 -3.959 40.223 19.882 1.00 34.44 H new ATOM 0 HG3 ARG B 5 -2.928 40.100 18.471 1.00 34.44 H new ATOM 0 HD2 ARG B 5 -3.141 42.520 18.061 1.00 43.14 H new ATOM 0 HD3 ARG B 5 -4.264 42.673 19.397 1.00 43.14 H new ATOM 0 HE ARG B 5 -1.946 41.509 20.490 1.00 41.33 H new ATOM 0 HH11 ARG B 5 -2.852 44.476 18.806 1.00 43.11 H new ATOM 0 HH12 ARG B 5 -1.607 45.445 19.602 1.00 43.11 H new ATOM 0 HH21 ARG B 5 -0.352 42.760 21.510 1.00 23.21 H new ATOM 0 HH22 ARG B 5 -0.198 44.477 21.127 1.00 23.21 H new ATOM 1092 N GLU B 6 -6.605 40.459 15.311 1.00 51.01 N ATOM 1093 CA GLU B 6 -7.856 40.236 14.594 1.00 12.44 C ATOM 1094 C GLU B 6 -7.623 39.396 13.342 1.00 42.42 C ATOM 1095 O GLU B 6 -8.495 38.639 12.920 1.00 74.33 O ATOM 1096 CB GLU B 6 -8.497 41.573 14.215 1.00 62.24 C ATOM 1097 CG GLU B 6 -9.974 41.464 13.874 1.00 20.11 C ATOM 1098 CD GLU B 6 -10.845 41.305 15.104 1.00 73.14 C ATOM 1099 OE1 GLU B 6 -10.329 40.836 16.140 1.00 53.23 O ATOM 1100 OE2 GLU B 6 -12.045 41.648 15.030 1.00 10.53 O ATOM 0 H GLU B 6 -6.266 41.421 15.280 1.00 51.01 H new ATOM 0 HA GLU B 6 -8.532 39.692 15.254 1.00 12.44 H new ATOM 0 HB2 GLU B 6 -8.374 42.273 15.042 1.00 62.24 H new ATOM 0 HB3 GLU B 6 -7.965 41.992 13.361 1.00 62.24 H new ATOM 0 HG2 GLU B 6 -10.284 42.354 13.327 1.00 20.11 H new ATOM 0 HG3 GLU B 6 -10.128 40.613 13.211 1.00 20.11 H new ATOM 1107 N GLU B 7 -6.439 39.538 12.754 1.00 50.13 N ATOM 1108 CA GLU B 7 -6.092 38.794 11.549 1.00 51.34 C ATOM 1109 C GLU B 7 -5.850 37.322 11.869 1.00 11.44 C ATOM 1110 O GLU B 7 -6.439 36.436 11.252 1.00 71.34 O ATOM 1111 CB GLU B 7 -4.849 39.396 10.892 1.00 63.32 C ATOM 1112 CG GLU B 7 -5.159 40.262 9.682 1.00 21.21 C ATOM 1113 CD GLU B 7 -5.807 41.580 10.058 1.00 73.14 C ATOM 1114 OE1 GLU B 7 -5.225 42.638 9.742 1.00 64.25 O ATOM 1115 OE2 GLU B 7 -6.895 41.553 10.670 1.00 75.35 O ATOM 0 H GLU B 7 -5.705 40.161 13.092 1.00 50.13 H new ATOM 0 HA GLU B 7 -6.930 38.864 10.856 1.00 51.34 H new ATOM 0 HB2 GLU B 7 -4.313 39.994 11.629 1.00 63.32 H new ATOM 0 HB3 GLU B 7 -4.181 38.589 10.589 1.00 63.32 H new ATOM 0 HG2 GLU B 7 -4.237 40.458 9.135 1.00 21.21 H new ATOM 0 HG3 GLU B 7 -5.820 39.716 9.009 1.00 21.21 H new ATOM 1122 N ALA B 8 -4.977 37.070 12.839 1.00 14.23 N ATOM 1123 CA ALA B 8 -4.656 35.707 13.243 1.00 12.20 C ATOM 1124 C ALA B 8 -5.920 34.922 13.576 1.00 34.33 C ATOM 1125 O ALA B 8 -6.098 33.792 13.121 1.00 10.42 O ATOM 1126 CB ALA B 8 -3.710 35.718 14.436 1.00 52.24 C ATOM 0 H ALA B 8 -4.479 37.792 13.360 1.00 14.23 H new ATOM 0 HA ALA B 8 -4.162 35.213 12.406 1.00 12.20 H new ATOM 0 HB1 ALA B 8 -3.479 34.693 14.727 1.00 52.24 H new ATOM 0 HB2 ALA B 8 -2.789 36.235 14.165 1.00 52.24 H new ATOM 0 HB3 ALA B 8 -4.184 36.234 15.271 1.00 52.24 H new ATOM 1132 N ALA B 9 -6.795 35.527 14.372 1.00 32.25 N ATOM 1133 CA ALA B 9 -8.043 34.883 14.765 1.00 44.35 C ATOM 1134 C ALA B 9 -8.849 34.458 13.542 1.00 31.41 C ATOM 1135 O ALA B 9 -9.596 33.481 13.587 1.00 50.11 O ATOM 1136 CB ALA B 9 -8.864 35.817 15.641 1.00 51.44 C ATOM 0 H ALA B 9 -6.663 36.462 14.758 1.00 32.25 H new ATOM 0 HA ALA B 9 -7.798 33.987 15.336 1.00 44.35 H new ATOM 0 HB1 ALA B 9 -9.793 35.324 15.927 1.00 51.44 H new ATOM 0 HB2 ALA B 9 -8.296 36.069 16.536 1.00 51.44 H new ATOM 0 HB3 ALA B 9 -9.092 36.728 15.088 1.00 51.44 H new ATOM 1142 N LYS B 10 -8.693 35.198 12.449 1.00 31.35 N ATOM 1143 CA LYS B 10 -9.405 34.897 11.214 1.00 64.33 C ATOM 1144 C LYS B 10 -8.797 33.684 10.516 1.00 63.14 C ATOM 1145 O LYS B 10 -9.513 32.862 9.941 1.00 50.42 O ATOM 1146 CB LYS B 10 -9.374 36.107 10.275 1.00 31.03 C ATOM 1147 CG LYS B 10 -10.729 36.768 10.091 1.00 63.24 C ATOM 1148 CD LYS B 10 -10.650 38.271 10.302 1.00 20.45 C ATOM 1149 CE LYS B 10 -9.994 38.965 9.118 1.00 50.32 C ATOM 1150 NZ LYS B 10 -10.948 39.162 7.992 1.00 72.22 N ATOM 0 H LYS B 10 -8.079 36.011 12.394 1.00 31.35 H new ATOM 0 HA LYS B 10 -10.440 34.667 11.468 1.00 64.33 H new ATOM 0 HB2 LYS B 10 -8.671 36.842 10.666 1.00 31.03 H new ATOM 0 HB3 LYS B 10 -8.998 35.792 9.302 1.00 31.03 H new ATOM 0 HG2 LYS B 10 -11.103 36.560 9.089 1.00 63.24 H new ATOM 0 HG3 LYS B 10 -11.443 36.338 10.794 1.00 63.24 H new ATOM 0 HD2 LYS B 10 -11.653 38.672 10.451 1.00 20.45 H new ATOM 0 HD3 LYS B 10 -10.084 38.483 11.209 1.00 20.45 H new ATOM 0 HE2 LYS B 10 -9.602 39.931 9.435 1.00 50.32 H new ATOM 0 HE3 LYS B 10 -9.145 38.374 8.775 1.00 50.32 H new ATOM 0 HZ1 LYS B 10 -10.463 39.638 7.205 1.00 72.22 H new ATOM 0 HZ2 LYS B 10 -11.303 38.238 7.672 1.00 72.22 H new ATOM 0 HZ3 LYS B 10 -11.746 39.748 8.311 1.00 72.22 H new ATOM 1164 N LEU B 11 -7.475 33.578 10.571 1.00 3.54 N ATOM 1165 CA LEU B 11 -6.770 32.464 9.945 1.00 12.44 C ATOM 1166 C LEU B 11 -7.281 31.129 10.479 1.00 11.13 C ATOM 1167 O LEU B 11 -7.312 30.131 9.758 1.00 64.02 O ATOM 1168 CB LEU B 11 -5.265 32.583 10.194 1.00 62.25 C ATOM 1169 CG LEU B 11 -4.497 33.488 9.231 1.00 5.53 C ATOM 1170 CD1 LEU B 11 -3.243 34.034 9.898 1.00 43.33 C ATOM 1171 CD2 LEU B 11 -4.141 32.735 7.958 1.00 3.22 C ATOM 0 H LEU B 11 -6.869 34.249 11.042 1.00 3.54 H new ATOM 0 HA LEU B 11 -6.959 32.502 8.872 1.00 12.44 H new ATOM 0 HB2 LEU B 11 -5.113 32.952 11.208 1.00 62.25 H new ATOM 0 HB3 LEU B 11 -4.829 31.585 10.149 1.00 62.25 H new ATOM 0 HG LEU B 11 -5.138 34.328 8.964 1.00 5.53 H new ATOM 0 HD11 LEU B 11 -2.709 34.676 9.198 1.00 43.33 H new ATOM 0 HD12 LEU B 11 -3.522 34.611 10.780 1.00 43.33 H new ATOM 0 HD13 LEU B 11 -2.599 33.206 10.195 1.00 43.33 H new ATOM 0 HD21 LEU B 11 -3.595 33.396 7.285 1.00 3.22 H new ATOM 0 HD22 LEU B 11 -3.519 31.875 8.206 1.00 3.22 H new ATOM 0 HD23 LEU B 11 -5.054 32.394 7.470 1.00 3.22 H new ATOM 1183 N PHE B 12 -7.682 31.118 11.746 1.00 65.15 N ATOM 1184 CA PHE B 12 -8.192 29.906 12.376 1.00 42.23 C ATOM 1185 C PHE B 12 -9.454 29.417 11.671 1.00 65.52 C ATOM 1186 O PHE B 12 -9.669 28.214 11.524 1.00 13.21 O ATOM 1187 CB PHE B 12 -8.488 30.160 13.855 1.00 12.14 C ATOM 1188 CG PHE B 12 -7.286 29.999 14.742 1.00 60.15 C ATOM 1189 CD1 PHE B 12 -6.111 30.678 14.468 1.00 4.23 C ATOM 1190 CD2 PHE B 12 -7.333 29.169 15.851 1.00 64.32 C ATOM 1191 CE1 PHE B 12 -5.003 30.533 15.282 1.00 40.24 C ATOM 1192 CE2 PHE B 12 -6.229 29.020 16.668 1.00 10.32 C ATOM 1193 CZ PHE B 12 -5.063 29.702 16.384 1.00 4.13 C ATOM 0 H PHE B 12 -7.664 31.935 12.357 1.00 65.15 H new ATOM 0 HA PHE B 12 -7.427 29.134 12.293 1.00 42.23 H new ATOM 0 HB2 PHE B 12 -8.882 31.170 13.970 1.00 12.14 H new ATOM 0 HB3 PHE B 12 -9.268 29.473 14.185 1.00 12.14 H new ATOM 0 HD1 PHE B 12 -6.059 31.329 13.608 1.00 4.23 H new ATOM 0 HD2 PHE B 12 -8.242 28.633 16.079 1.00 64.32 H new ATOM 0 HE1 PHE B 12 -4.092 31.068 15.057 1.00 40.24 H new ATOM 0 HE2 PHE B 12 -6.278 28.370 17.529 1.00 10.32 H new ATOM 0 HZ PHE B 12 -4.199 29.586 17.022 1.00 4.13 H new ATOM 1203 N GLU B 13 -10.286 30.359 11.236 1.00 42.30 N ATOM 1204 CA GLU B 13 -11.526 30.023 10.548 1.00 50.53 C ATOM 1205 C GLU B 13 -11.242 29.329 9.219 1.00 4.41 C ATOM 1206 O GLU B 13 -12.007 28.473 8.779 1.00 24.22 O ATOM 1207 CB GLU B 13 -12.359 31.285 10.308 1.00 32.13 C ATOM 1208 CG GLU B 13 -13.812 31.144 10.730 1.00 21.31 C ATOM 1209 CD GLU B 13 -14.576 32.451 10.638 1.00 41.04 C ATOM 1210 OE1 GLU B 13 -15.005 32.810 9.521 1.00 20.42 O ATOM 1211 OE2 GLU B 13 -14.745 33.114 11.682 1.00 25.22 O ATOM 0 H GLU B 13 -10.123 31.360 11.348 1.00 42.30 H new ATOM 0 HA GLU B 13 -12.089 29.338 11.182 1.00 50.53 H new ATOM 0 HB2 GLU B 13 -11.910 32.116 10.853 1.00 32.13 H new ATOM 0 HB3 GLU B 13 -12.320 31.540 9.249 1.00 32.13 H new ATOM 0 HG2 GLU B 13 -14.298 30.398 10.101 1.00 21.31 H new ATOM 0 HG3 GLU B 13 -13.855 30.774 11.754 1.00 21.31 H new ATOM 1218 N GLU B 14 -10.134 29.707 8.587 1.00 60.12 N ATOM 1219 CA GLU B 14 -9.749 29.122 7.308 1.00 75.50 C ATOM 1220 C GLU B 14 -9.704 27.598 7.399 1.00 44.23 C ATOM 1221 O GLU B 14 -10.194 26.899 6.512 1.00 30.12 O ATOM 1222 CB GLU B 14 -8.386 29.658 6.866 1.00 22.23 C ATOM 1223 CG GLU B 14 -8.345 31.170 6.720 1.00 12.11 C ATOM 1224 CD GLU B 14 -8.857 31.640 5.373 1.00 5.02 C ATOM 1225 OE1 GLU B 14 -9.732 30.957 4.799 1.00 1.33 O ATOM 1226 OE2 GLU B 14 -8.383 32.689 4.890 1.00 4.51 O ATOM 0 H GLU B 14 -9.489 30.414 8.939 1.00 60.12 H new ATOM 0 HA GLU B 14 -10.499 29.403 6.568 1.00 75.50 H new ATOM 0 HB2 GLU B 14 -7.632 29.351 7.591 1.00 22.23 H new ATOM 0 HB3 GLU B 14 -8.117 29.202 5.913 1.00 22.23 H new ATOM 0 HG2 GLU B 14 -8.943 31.624 7.510 1.00 12.11 H new ATOM 0 HG3 GLU B 14 -7.321 31.517 6.856 1.00 12.11 H new ATOM 1233 N TRP B 15 -9.112 27.094 8.475 1.00 25.34 N ATOM 1234 CA TRP B 15 -9.001 25.653 8.681 1.00 41.44 C ATOM 1235 C TRP B 15 -10.375 24.993 8.654 1.00 10.14 C ATOM 1236 O TRP B 15 -10.568 23.968 8.001 1.00 74.43 O ATOM 1237 CB TRP B 15 -8.306 25.361 10.011 1.00 11.34 C ATOM 1238 CG TRP B 15 -7.027 26.122 10.194 1.00 72.41 C ATOM 1239 CD1 TRP B 15 -6.184 26.555 9.211 1.00 3.31 C ATOM 1240 CD2 TRP B 15 -6.445 26.535 11.435 1.00 55.12 C ATOM 1241 NE1 TRP B 15 -5.114 27.214 9.766 1.00 1.34 N ATOM 1242 CE2 TRP B 15 -5.251 27.216 11.129 1.00 53.12 C ATOM 1243 CE3 TRP B 15 -6.819 26.399 12.776 1.00 25.40 C ATOM 1244 CZ2 TRP B 15 -4.430 27.757 12.114 1.00 11.35 C ATOM 1245 CZ3 TRP B 15 -6.002 26.936 13.752 1.00 13.03 C ATOM 1246 CH2 TRP B 15 -4.819 27.608 13.418 1.00 52.23 C ATOM 0 H TRP B 15 -8.702 27.660 9.218 1.00 25.34 H new ATOM 0 HA TRP B 15 -8.404 25.238 7.869 1.00 41.44 H new ATOM 0 HB2 TRP B 15 -8.985 25.604 10.828 1.00 11.34 H new ATOM 0 HB3 TRP B 15 -8.097 24.293 10.077 1.00 11.34 H new ATOM 0 HD1 TRP B 15 -6.336 26.402 8.153 1.00 3.31 H new ATOM 0 HE1 TRP B 15 -4.343 27.634 9.247 1.00 1.34 H new ATOM 0 HE3 TRP B 15 -7.730 25.884 13.043 1.00 25.40 H new ATOM 0 HZ2 TRP B 15 -3.518 28.276 11.859 1.00 11.35 H new ATOM 0 HZ3 TRP B 15 -6.280 26.836 14.791 1.00 13.03 H new ATOM 0 HH2 TRP B 15 -4.202 28.016 14.205 1.00 52.23 H new ATOM 1257 N LYS B 16 -11.326 25.586 9.369 1.00 22.33 N ATOM 1258 CA LYS B 16 -12.683 25.056 9.426 1.00 4.02 C ATOM 1259 C LYS B 16 -13.315 25.028 8.038 1.00 2.42 C ATOM 1260 O LYS B 16 -14.169 24.189 7.750 1.00 2.13 O ATOM 1261 CB LYS B 16 -13.541 25.898 10.372 1.00 74.15 C ATOM 1262 CG LYS B 16 -14.473 25.073 11.243 1.00 50.43 C ATOM 1263 CD LYS B 16 -14.860 25.819 12.509 1.00 11.00 C ATOM 1264 CE LYS B 16 -16.136 26.625 12.314 1.00 1.45 C ATOM 1265 NZ LYS B 16 -17.350 25.830 12.647 1.00 63.20 N ATOM 0 H LYS B 16 -11.181 26.434 9.917 1.00 22.33 H new ATOM 0 HA LYS B 16 -12.632 24.035 9.803 1.00 4.02 H new ATOM 0 HB2 LYS B 16 -12.887 26.490 11.013 1.00 74.15 H new ATOM 0 HB3 LYS B 16 -14.133 26.600 9.785 1.00 74.15 H new ATOM 0 HG2 LYS B 16 -15.371 24.821 10.679 1.00 50.43 H new ATOM 0 HG3 LYS B 16 -13.988 24.133 11.507 1.00 50.43 H new ATOM 0 HD2 LYS B 16 -14.999 25.108 13.323 1.00 11.00 H new ATOM 0 HD3 LYS B 16 -14.049 26.485 12.802 1.00 11.00 H new ATOM 0 HE2 LYS B 16 -16.102 27.516 12.941 1.00 1.45 H new ATOM 0 HE3 LYS B 16 -16.197 26.965 11.280 1.00 1.45 H new ATOM 0 HZ1 LYS B 16 -18.177 26.242 12.170 1.00 63.20 H new ATOM 0 HZ2 LYS B 16 -17.220 24.848 12.329 1.00 63.20 H new ATOM 0 HZ3 LYS B 16 -17.502 25.843 13.676 1.00 63.20 H new ATOM 1279 N LYS B 17 -12.890 25.950 7.180 1.00 13.22 N ATOM 1280 CA LYS B 17 -13.413 26.031 5.822 1.00 2.14 C ATOM 1281 C LYS B 17 -13.145 24.736 5.059 1.00 40.31 C ATOM 1282 O LYS B 17 -14.055 24.155 4.467 1.00 22.33 O ATOM 1283 CB LYS B 17 -12.781 27.211 5.080 1.00 71.14 C ATOM 1284 CG LYS B 17 -13.784 28.044 4.299 1.00 2.31 C ATOM 1285 CD LYS B 17 -13.149 29.311 3.751 1.00 2.25 C ATOM 1286 CE LYS B 17 -14.199 30.273 3.215 1.00 24.14 C ATOM 1287 NZ LYS B 17 -13.839 30.790 1.865 1.00 31.14 N ATOM 0 H LYS B 17 -12.184 26.652 7.402 1.00 13.22 H new ATOM 0 HA LYS B 17 -14.491 26.182 5.882 1.00 2.14 H new ATOM 0 HB2 LYS B 17 -12.271 27.851 5.800 1.00 71.14 H new ATOM 0 HB3 LYS B 17 -12.022 26.834 4.395 1.00 71.14 H new ATOM 0 HG2 LYS B 17 -14.187 27.453 3.477 1.00 2.31 H new ATOM 0 HG3 LYS B 17 -14.622 28.306 4.945 1.00 2.31 H new ATOM 0 HD2 LYS B 17 -12.573 29.800 4.537 1.00 2.25 H new ATOM 0 HD3 LYS B 17 -12.449 29.054 2.956 1.00 2.25 H new ATOM 0 HE2 LYS B 17 -15.163 29.767 3.165 1.00 24.14 H new ATOM 0 HE3 LYS B 17 -14.313 31.109 3.906 1.00 24.14 H new ATOM 0 HZ1 LYS B 17 -14.579 31.442 1.534 1.00 31.14 H new ATOM 0 HZ2 LYS B 17 -12.931 31.294 1.917 1.00 31.14 H new ATOM 0 HZ3 LYS B 17 -13.755 29.995 1.200 1.00 31.14 H new ATOM 1301 N LEU B 18 -11.895 24.291 5.078 1.00 3.14 N ATOM 1302 CA LEU B 18 -11.508 23.064 4.390 1.00 45.23 C ATOM 1303 C LEU B 18 -12.095 21.841 5.086 1.00 55.11 C ATOM 1304 O LEU B 18 -12.404 20.838 4.444 1.00 73.23 O ATOM 1305 CB LEU B 18 -9.984 22.948 4.330 1.00 21.11 C ATOM 1306 CG LEU B 18 -9.246 24.122 3.685 1.00 51.23 C ATOM 1307 CD1 LEU B 18 -7.745 23.881 3.696 1.00 14.23 C ATOM 1308 CD2 LEU B 18 -9.741 24.348 2.264 1.00 52.50 C ATOM 0 H LEU B 18 -11.131 24.761 5.563 1.00 3.14 H new ATOM 0 HA LEU B 18 -11.903 23.106 3.375 1.00 45.23 H new ATOM 0 HB2 LEU B 18 -9.609 22.823 5.346 1.00 21.11 H new ATOM 0 HB3 LEU B 18 -9.730 22.040 3.783 1.00 21.11 H new ATOM 0 HG LEU B 18 -9.453 25.020 4.268 1.00 51.23 H new ATOM 0 HD11 LEU B 18 -7.237 24.727 3.233 1.00 14.23 H new ATOM 0 HD12 LEU B 18 -7.402 23.771 4.725 1.00 14.23 H new ATOM 0 HD13 LEU B 18 -7.518 22.972 3.138 1.00 14.23 H new ATOM 0 HD21 LEU B 18 -9.205 25.187 1.821 1.00 52.50 H new ATOM 0 HD22 LEU B 18 -9.565 23.451 1.670 1.00 52.50 H new ATOM 0 HD23 LEU B 18 -10.808 24.568 2.281 1.00 52.50 H new ATOM 1320 N ALA B 19 -12.248 21.933 6.403 1.00 55.33 N ATOM 1321 CA ALA B 19 -12.803 20.835 7.186 1.00 52.44 C ATOM 1322 C ALA B 19 -14.211 20.485 6.718 1.00 72.33 C ATOM 1323 O ALA B 19 -14.549 19.312 6.563 1.00 30.53 O ATOM 1324 CB ALA B 19 -12.809 21.192 8.665 1.00 42.04 C ATOM 0 H ALA B 19 -11.996 22.756 6.950 1.00 55.33 H new ATOM 0 HA ALA B 19 -12.171 19.959 7.038 1.00 52.44 H new ATOM 0 HB1 ALA B 19 -13.226 20.363 9.238 1.00 42.04 H new ATOM 0 HB2 ALA B 19 -11.789 21.385 8.997 1.00 42.04 H new ATOM 0 HB3 ALA B 19 -13.417 22.083 8.822 1.00 42.04 H new ATOM 1330 N GLU B 20 -15.029 21.509 6.496 1.00 11.31 N ATOM 1331 CA GLU B 20 -16.402 21.307 6.047 1.00 14.44 C ATOM 1332 C GLU B 20 -16.433 20.633 4.679 1.00 51.43 C ATOM 1333 O GLU B 20 -17.226 19.723 4.442 1.00 13.02 O ATOM 1334 CB GLU B 20 -17.145 22.644 5.989 1.00 23.42 C ATOM 1335 CG GLU B 20 -18.636 22.500 5.733 1.00 11.34 C ATOM 1336 CD GLU B 20 -19.470 22.812 6.961 1.00 3.14 C ATOM 1337 OE1 GLU B 20 -19.672 24.010 7.251 1.00 34.40 O ATOM 1338 OE2 GLU B 20 -19.920 21.859 7.632 1.00 65.44 O ATOM 0 H GLU B 20 -14.765 22.486 6.620 1.00 11.31 H new ATOM 0 HA GLU B 20 -16.900 20.655 6.764 1.00 14.44 H new ATOM 0 HB2 GLU B 20 -16.996 23.174 6.930 1.00 23.42 H new ATOM 0 HB3 GLU B 20 -16.708 23.260 5.203 1.00 23.42 H new ATOM 0 HG2 GLU B 20 -18.928 23.166 4.921 1.00 11.34 H new ATOM 0 HG3 GLU B 20 -18.848 21.483 5.403 1.00 11.34 H new ATOM 1345 N GLU B 21 -15.566 21.090 3.781 1.00 5.21 N ATOM 1346 CA GLU B 21 -15.496 20.533 2.435 1.00 3.42 C ATOM 1347 C GLU B 21 -15.055 19.073 2.474 1.00 25.21 C ATOM 1348 O GLU B 21 -15.445 18.273 1.624 1.00 42.23 O ATOM 1349 CB GLU B 21 -14.529 21.347 1.573 1.00 43.04 C ATOM 1350 CG GLU B 21 -15.223 22.224 0.544 1.00 40.23 C ATOM 1351 CD GLU B 21 -14.791 23.675 0.628 1.00 52.33 C ATOM 1352 OE1 GLU B 21 -15.388 24.425 1.428 1.00 44.13 O ATOM 1353 OE2 GLU B 21 -13.857 24.060 -0.106 1.00 15.51 O ATOM 0 H GLU B 21 -14.903 21.844 3.961 1.00 5.21 H new ATOM 0 HA GLU B 21 -16.492 20.582 1.996 1.00 3.42 H new ATOM 0 HB2 GLU B 21 -13.918 21.975 2.221 1.00 43.04 H new ATOM 0 HB3 GLU B 21 -13.851 20.665 1.059 1.00 43.04 H new ATOM 0 HG2 GLU B 21 -15.011 21.843 -0.455 1.00 40.23 H new ATOM 0 HG3 GLU B 21 -16.302 22.161 0.687 1.00 40.23 H new ATOM 1360 N ALA B 22 -14.237 18.734 3.465 1.00 32.53 N ATOM 1361 CA ALA B 22 -13.743 17.370 3.615 1.00 74.32 C ATOM 1362 C ALA B 22 -14.865 16.423 4.029 1.00 31.15 C ATOM 1363 O ALA B 22 -14.858 15.246 3.673 1.00 35.45 O ATOM 1364 CB ALA B 22 -12.613 17.328 4.632 1.00 25.44 C ATOM 0 H ALA B 22 -13.902 19.385 4.176 1.00 32.53 H new ATOM 0 HA ALA B 22 -13.361 17.039 2.649 1.00 74.32 H new ATOM 0 HB1 ALA B 22 -12.253 16.304 4.734 1.00 25.44 H new ATOM 0 HB2 ALA B 22 -11.797 17.967 4.296 1.00 25.44 H new ATOM 0 HB3 ALA B 22 -12.978 17.683 5.596 1.00 25.44 H new ATOM 1370 N ALA B 23 -15.826 16.945 4.784 1.00 42.23 N ATOM 1371 CA ALA B 23 -16.955 16.146 5.246 1.00 3.02 C ATOM 1372 C ALA B 23 -17.659 15.464 4.077 1.00 23.25 C ATOM 1373 O ALA B 23 -18.222 14.380 4.225 1.00 33.14 O ATOM 1374 CB ALA B 23 -17.934 17.014 6.021 1.00 70.35 C ATOM 0 H ALA B 23 -15.845 17.918 5.089 1.00 42.23 H new ATOM 0 HA ALA B 23 -16.572 15.370 5.909 1.00 3.02 H new ATOM 0 HB1 ALA B 23 -18.772 16.404 6.360 1.00 70.35 H new ATOM 0 HB2 ALA B 23 -17.430 17.450 6.884 1.00 70.35 H new ATOM 0 HB3 ALA B 23 -18.303 17.811 5.376 1.00 70.35 H new ATOM 1380 N LYS B 24 -17.623 16.106 2.914 1.00 0.24 N ATOM 1381 CA LYS B 24 -18.256 15.563 1.720 1.00 65.31 C ATOM 1382 C LYS B 24 -17.483 14.357 1.194 1.00 11.42 C ATOM 1383 O LYS B 24 -18.066 13.433 0.626 1.00 23.20 O ATOM 1384 CB LYS B 24 -18.348 16.636 0.632 1.00 2.03 C ATOM 1385 CG LYS B 24 -19.557 16.482 -0.274 1.00 34.24 C ATOM 1386 CD LYS B 24 -19.322 17.123 -1.632 1.00 1.15 C ATOM 1387 CE LYS B 24 -20.632 17.490 -2.310 1.00 11.14 C ATOM 1388 NZ LYS B 24 -20.608 17.185 -3.767 1.00 55.41 N ATOM 0 H LYS B 24 -17.161 17.005 2.774 1.00 0.24 H new ATOM 0 HA LYS B 24 -19.262 15.240 1.989 1.00 65.31 H new ATOM 0 HB2 LYS B 24 -18.381 17.618 1.104 1.00 2.03 H new ATOM 0 HB3 LYS B 24 -17.443 16.604 0.025 1.00 2.03 H new ATOM 0 HG2 LYS B 24 -19.782 15.424 -0.404 1.00 34.24 H new ATOM 0 HG3 LYS B 24 -20.427 16.937 0.199 1.00 34.24 H new ATOM 0 HD2 LYS B 24 -18.710 18.017 -1.512 1.00 1.15 H new ATOM 0 HD3 LYS B 24 -18.762 16.437 -2.267 1.00 1.15 H new ATOM 0 HE2 LYS B 24 -21.450 16.945 -1.839 1.00 11.14 H new ATOM 0 HE3 LYS B 24 -20.831 18.552 -2.165 1.00 11.14 H new ATOM 0 HZ1 LYS B 24 -21.519 17.450 -4.192 1.00 55.41 H new ATOM 0 HZ2 LYS B 24 -19.844 17.724 -4.222 1.00 55.41 H new ATOM 0 HZ3 LYS B 24 -20.444 16.168 -3.906 1.00 55.41 H new ATOM 1402 N LEU B 25 -16.169 14.371 1.390 1.00 52.10 N ATOM 1403 CA LEU B 25 -15.317 13.277 0.938 1.00 3.40 C ATOM 1404 C LEU B 25 -15.495 12.047 1.820 1.00 52.11 C ATOM 1405 O LEU B 25 -15.380 10.912 1.354 1.00 4.50 O ATOM 1406 CB LEU B 25 -13.850 13.713 0.942 1.00 43.34 C ATOM 1407 CG LEU B 25 -13.229 13.992 -0.428 1.00 32.44 C ATOM 1408 CD1 LEU B 25 -12.950 15.477 -0.595 1.00 62.41 C ATOM 1409 CD2 LEU B 25 -11.952 13.184 -0.608 1.00 73.14 C ATOM 0 H LEU B 25 -15.671 15.128 1.859 1.00 52.10 H new ATOM 0 HA LEU B 25 -15.611 13.017 -0.079 1.00 3.40 H new ATOM 0 HB2 LEU B 25 -13.761 14.614 1.549 1.00 43.34 H new ATOM 0 HB3 LEU B 25 -13.263 12.938 1.434 1.00 43.34 H new ATOM 0 HG LEU B 25 -13.939 13.688 -1.197 1.00 32.44 H new ATOM 0 HD11 LEU B 25 -12.508 15.656 -1.575 1.00 62.41 H new ATOM 0 HD12 LEU B 25 -13.883 16.034 -0.510 1.00 62.41 H new ATOM 0 HD13 LEU B 25 -12.258 15.807 0.180 1.00 62.41 H new ATOM 0 HD21 LEU B 25 -11.523 13.394 -1.588 1.00 73.14 H new ATOM 0 HD22 LEU B 25 -11.236 13.457 0.167 1.00 73.14 H new ATOM 0 HD23 LEU B 25 -12.180 12.121 -0.533 1.00 73.14 H new ATOM 1421 N LEU B 26 -15.781 12.277 3.097 1.00 2.42 N ATOM 1422 CA LEU B 26 -15.979 11.187 4.046 1.00 23.44 C ATOM 1423 C LEU B 26 -17.368 10.576 3.892 1.00 24.11 C ATOM 1424 O LEU B 26 -17.575 9.399 4.184 1.00 1.14 O ATOM 1425 CB LEU B 26 -15.785 11.688 5.478 1.00 3.31 C ATOM 1426 CG LEU B 26 -14.359 11.620 6.027 1.00 72.22 C ATOM 1427 CD1 LEU B 26 -13.947 10.176 6.262 1.00 31.23 C ATOM 1428 CD2 LEU B 26 -13.389 12.306 5.076 1.00 22.21 C ATOM 0 H LEU B 26 -15.881 13.209 3.499 1.00 2.42 H new ATOM 0 HA LEU B 26 -15.238 10.416 3.835 1.00 23.44 H new ATOM 0 HB2 LEU B 26 -16.123 12.723 5.528 1.00 3.31 H new ATOM 0 HB3 LEU B 26 -16.434 11.109 6.135 1.00 3.31 H new ATOM 0 HG LEU B 26 -14.332 12.144 6.982 1.00 72.22 H new ATOM 0 HD11 LEU B 26 -12.930 10.147 6.653 1.00 31.23 H new ATOM 0 HD12 LEU B 26 -14.625 9.717 6.981 1.00 31.23 H new ATOM 0 HD13 LEU B 26 -13.990 9.628 5.321 1.00 31.23 H new ATOM 0 HD21 LEU B 26 -12.379 12.248 5.482 1.00 22.21 H new ATOM 0 HD22 LEU B 26 -13.419 11.810 4.106 1.00 22.21 H new ATOM 0 HD23 LEU B 26 -13.673 13.352 4.958 1.00 22.21 H new ATOM 1440 N GLU B 27 -18.316 11.385 3.429 1.00 12.30 N ATOM 1441 CA GLU B 27 -19.686 10.923 3.236 1.00 5.14 C ATOM 1442 C GLU B 27 -19.810 10.116 1.947 1.00 31.25 C ATOM 1443 O GLU B 27 -20.667 9.241 1.831 1.00 44.15 O ATOM 1444 CB GLU B 27 -20.648 12.112 3.200 1.00 60.14 C ATOM 1445 CG GLU B 27 -21.226 12.469 4.559 1.00 32.31 C ATOM 1446 CD GLU B 27 -22.741 12.411 4.582 1.00 71.22 C ATOM 1447 OE1 GLU B 27 -23.362 13.359 5.107 1.00 61.31 O ATOM 1448 OE2 GLU B 27 -23.306 11.419 4.075 1.00 71.11 O ATOM 0 H GLU B 27 -18.161 12.362 3.181 1.00 12.30 H new ATOM 0 HA GLU B 27 -19.947 10.279 4.075 1.00 5.14 H new ATOM 0 HB2 GLU B 27 -20.125 12.980 2.798 1.00 60.14 H new ATOM 0 HB3 GLU B 27 -21.465 11.887 2.515 1.00 60.14 H new ATOM 0 HG2 GLU B 27 -20.829 11.786 5.310 1.00 32.31 H new ATOM 0 HG3 GLU B 27 -20.900 13.472 4.836 1.00 32.31 H new ATOM 1455 N GLY B 28 -18.946 10.415 0.982 1.00 23.01 N ATOM 1456 CA GLY B 28 -18.976 9.709 -0.286 1.00 2.03 C ATOM 1457 C GLY B 28 -18.767 8.216 -0.123 1.00 1.32 C ATOM 1458 O GLY B 28 -19.189 7.428 -0.967 1.00 61.32 O ATOM 0 H GLY B 28 -18.226 11.133 1.055 1.00 23.01 H new ATOM 0 HA2 GLY B 28 -19.934 9.888 -0.775 1.00 2.03 H new ATOM 0 HA3 GLY B 28 -18.203 10.112 -0.941 1.00 2.03 H new ATOM 1462 N GLY B 29 -18.110 7.828 0.966 1.00 43.21 N ATOM 1463 CA GLY B 29 -17.855 6.421 1.216 1.00 42.32 C ATOM 1464 C GLY B 29 -18.906 5.791 2.108 1.00 33.22 C ATOM 1465 O GLY B 29 -18.656 5.526 3.282 1.00 14.24 O ATOM 0 H GLY B 29 -17.750 8.462 1.679 1.00 43.21 H new ATOM 0 HA2 GLY B 29 -17.821 5.887 0.267 1.00 42.32 H new ATOM 0 HA3 GLY B 29 -16.875 6.309 1.680 1.00 42.32 H new ATOM 1469 N GLY B 30 -20.088 5.551 1.548 1.00 14.41 N ATOM 1470 CA GLY B 30 -21.164 4.952 2.316 1.00 61.12 C ATOM 1471 C GLY B 30 -22.144 5.981 2.843 1.00 42.12 C ATOM 1472 O GLY B 30 -22.455 6.958 2.163 1.00 42.21 O ATOM 0 H GLY B 30 -20.319 5.761 0.577 1.00 14.41 H new ATOM 0 HA2 GLY B 30 -21.696 4.235 1.691 1.00 61.12 H new ATOM 0 HA3 GLY B 30 -20.742 4.395 3.153 1.00 61.12 H new ATOM 1476 N GLY B 31 -22.634 5.762 4.060 1.00 73.55 N ATOM 1477 CA GLY B 31 -23.581 6.686 4.656 1.00 53.02 C ATOM 1478 C GLY B 31 -24.785 5.980 5.249 1.00 3.52 C ATOM 1479 O GLY B 31 -25.816 5.841 4.594 1.00 14.32 O ATOM 0 H GLY B 31 -22.392 4.961 4.643 1.00 73.55 H new ATOM 0 HA2 GLY B 31 -23.081 7.262 5.435 1.00 53.02 H new ATOM 0 HA3 GLY B 31 -23.916 7.396 3.900 1.00 53.02 H new ATOM 1483 N GLY B 32 -24.651 5.533 6.494 1.00 73.31 N ATOM 1484 CA GLY B 32 -25.744 4.841 7.154 1.00 53.20 C ATOM 1485 C GLY B 32 -26.482 5.728 8.137 1.00 1.12 C ATOM 1486 O GLY B 32 -26.524 6.948 7.974 1.00 21.53 O ATOM 0 H GLY B 32 -23.807 5.637 7.057 1.00 73.31 H new ATOM 0 HA2 GLY B 32 -26.444 4.475 6.403 1.00 53.20 H new ATOM 0 HA3 GLY B 32 -25.354 3.969 7.678 1.00 53.20 H new ATOM 1490 N GLY B 33 -27.069 5.116 9.160 1.00 34.12 N ATOM 1491 CA GLY B 33 -27.803 5.873 10.157 1.00 22.41 C ATOM 1492 C GLY B 33 -26.888 6.607 11.118 1.00 25.44 C ATOM 1493 O GLY B 33 -27.298 7.569 11.765 1.00 63.03 O ATOM 0 H GLY B 33 -27.049 4.108 9.317 1.00 34.12 H new ATOM 0 HA2 GLY B 33 -28.452 6.592 9.657 1.00 22.41 H new ATOM 0 HA3 GLY B 33 -28.448 5.198 10.719 1.00 22.41 H new ATOM 1497 N GLY B 34 -25.643 6.150 11.213 1.00 22.33 N ATOM 1498 CA GLY B 34 -24.687 6.779 12.105 1.00 44.20 C ATOM 1499 C GLY B 34 -23.698 7.660 11.367 1.00 12.00 C ATOM 1500 O GLY B 34 -23.839 8.882 11.348 1.00 50.32 O ATOM 0 H GLY B 34 -25.279 5.355 10.688 1.00 22.33 H new ATOM 0 HA2 GLY B 34 -25.222 7.377 12.842 1.00 44.20 H new ATOM 0 HA3 GLY B 34 -24.144 6.009 12.653 1.00 44.20 H new ATOM 1504 N GLY B 35 -22.693 7.039 10.760 1.00 22.24 N ATOM 1505 CA GLY B 35 -21.690 7.790 10.027 1.00 4.22 C ATOM 1506 C GLY B 35 -20.626 8.376 10.935 1.00 32.43 C ATOM 1507 O GLY B 35 -20.587 9.586 11.155 1.00 33.34 O ATOM 0 H GLY B 35 -22.555 6.028 10.762 1.00 22.24 H new ATOM 0 HA2 GLY B 35 -21.217 7.138 9.292 1.00 4.22 H new ATOM 0 HA3 GLY B 35 -22.175 8.595 9.474 1.00 4.22 H new ATOM 1511 N GLU B 36 -19.763 7.513 11.465 1.00 45.20 N ATOM 1512 CA GLU B 36 -18.695 7.953 12.355 1.00 75.12 C ATOM 1513 C GLU B 36 -17.606 8.687 11.579 1.00 14.21 C ATOM 1514 O GLU B 36 -16.919 9.554 12.120 1.00 12.34 O ATOM 1515 CB GLU B 36 -18.093 6.756 13.094 1.00 54.22 C ATOM 1516 CG GLU B 36 -16.832 7.094 13.872 1.00 31.22 C ATOM 1517 CD GLU B 36 -16.225 5.882 14.554 1.00 61.15 C ATOM 1518 OE1 GLU B 36 -15.058 5.556 14.254 1.00 0.24 O ATOM 1519 OE2 GLU B 36 -16.918 5.260 15.386 1.00 41.13 O ATOM 0 H GLU B 36 -19.783 6.508 11.294 1.00 45.20 H new ATOM 0 HA GLU B 36 -19.124 8.642 13.082 1.00 75.12 H new ATOM 0 HB2 GLU B 36 -18.837 6.352 13.781 1.00 54.22 H new ATOM 0 HB3 GLU B 36 -17.866 5.971 12.373 1.00 54.22 H new ATOM 0 HG2 GLU B 36 -16.098 7.531 13.195 1.00 31.22 H new ATOM 0 HG3 GLU B 36 -17.064 7.850 14.622 1.00 31.22 H new ATOM 1526 N LEU B 37 -17.454 8.333 10.308 1.00 32.11 N ATOM 1527 CA LEU B 37 -16.447 8.956 9.456 1.00 65.43 C ATOM 1528 C LEU B 37 -16.683 10.459 9.344 1.00 14.42 C ATOM 1529 O LEU B 37 -15.742 11.233 9.167 1.00 34.41 O ATOM 1530 CB LEU B 37 -16.465 8.322 8.064 1.00 71.21 C ATOM 1531 CG LEU B 37 -15.623 7.058 7.891 1.00 33.22 C ATOM 1532 CD1 LEU B 37 -14.143 7.380 8.028 1.00 43.32 C ATOM 1533 CD2 LEU B 37 -16.036 5.999 8.903 1.00 2.02 C ATOM 0 H LEU B 37 -18.015 7.618 9.845 1.00 32.11 H new ATOM 0 HA LEU B 37 -15.470 8.792 9.911 1.00 65.43 H new ATOM 0 HB2 LEU B 37 -17.498 8.084 7.808 1.00 71.21 H new ATOM 0 HB3 LEU B 37 -16.121 9.065 7.344 1.00 71.21 H new ATOM 0 HG LEU B 37 -15.797 6.663 6.890 1.00 33.22 H new ATOM 0 HD11 LEU B 37 -13.559 6.468 7.902 1.00 43.32 H new ATOM 0 HD12 LEU B 37 -13.856 8.103 7.265 1.00 43.32 H new ATOM 0 HD13 LEU B 37 -13.952 7.800 9.016 1.00 43.32 H new ATOM 0 HD21 LEU B 37 -15.426 5.106 8.765 1.00 2.02 H new ATOM 0 HD22 LEU B 37 -15.892 6.384 9.912 1.00 2.02 H new ATOM 0 HD23 LEU B 37 -17.086 5.747 8.758 1.00 2.02 H new ATOM 1545 N MET B 38 -17.944 10.865 9.454 1.00 25.43 N ATOM 1546 CA MET B 38 -18.302 12.276 9.369 1.00 5.34 C ATOM 1547 C MET B 38 -17.790 13.040 10.586 1.00 53.41 C ATOM 1548 O MET B 38 -17.238 14.133 10.459 1.00 3.14 O ATOM 1549 CB MET B 38 -19.819 12.433 9.255 1.00 63.22 C ATOM 1550 CG MET B 38 -20.445 11.535 8.200 1.00 33.33 C ATOM 1551 SD MET B 38 -22.226 11.770 8.056 1.00 74.52 S ATOM 1552 CE MET B 38 -22.720 10.198 7.353 1.00 61.12 C ATOM 0 H MET B 38 -18.734 10.237 9.602 1.00 25.43 H new ATOM 0 HA MET B 38 -17.833 12.692 8.477 1.00 5.34 H new ATOM 0 HB2 MET B 38 -20.272 12.215 10.222 1.00 63.22 H new ATOM 0 HB3 MET B 38 -20.052 13.472 9.021 1.00 63.22 H new ATOM 0 HG2 MET B 38 -19.977 11.733 7.236 1.00 33.33 H new ATOM 0 HG3 MET B 38 -20.239 10.493 8.446 1.00 33.33 H new ATOM 0 HE1 MET B 38 -23.168 10.362 6.373 1.00 61.12 H new ATOM 0 HE2 MET B 38 -21.846 9.555 7.249 1.00 61.12 H new ATOM 0 HE3 MET B 38 -23.447 9.719 8.009 1.00 61.12 H new ATOM 1562 N LYS B 39 -17.979 12.459 11.766 1.00 11.23 N ATOM 1563 CA LYS B 39 -17.536 13.084 13.007 1.00 24.02 C ATOM 1564 C LYS B 39 -16.029 12.929 13.187 1.00 60.23 C ATOM 1565 O LYS B 39 -15.377 13.774 13.803 1.00 63.40 O ATOM 1566 CB LYS B 39 -18.269 12.470 14.202 1.00 2.13 C ATOM 1567 CG LYS B 39 -17.967 10.995 14.407 1.00 64.11 C ATOM 1568 CD LYS B 39 -18.496 10.498 15.742 1.00 51.02 C ATOM 1569 CE LYS B 39 -19.659 9.535 15.557 1.00 11.24 C ATOM 1570 NZ LYS B 39 -20.764 9.808 16.519 1.00 25.12 N ATOM 0 H LYS B 39 -18.436 11.556 11.889 1.00 11.23 H new ATOM 0 HA LYS B 39 -17.770 14.147 12.952 1.00 24.02 H new ATOM 0 HB2 LYS B 39 -17.997 13.017 15.105 1.00 2.13 H new ATOM 0 HB3 LYS B 39 -19.343 12.597 14.064 1.00 2.13 H new ATOM 0 HG2 LYS B 39 -18.414 10.415 13.599 1.00 64.11 H new ATOM 0 HG3 LYS B 39 -16.890 10.833 14.358 1.00 64.11 H new ATOM 0 HD2 LYS B 39 -17.695 10.002 16.290 1.00 51.02 H new ATOM 0 HD3 LYS B 39 -18.817 11.347 16.346 1.00 51.02 H new ATOM 0 HE2 LYS B 39 -20.037 9.614 14.538 1.00 11.24 H new ATOM 0 HE3 LYS B 39 -19.308 8.512 15.688 1.00 11.24 H new ATOM 0 HZ1 LYS B 39 -21.537 9.131 16.361 1.00 25.12 H new ATOM 0 HZ2 LYS B 39 -20.410 9.708 17.492 1.00 25.12 H new ATOM 0 HZ3 LYS B 39 -21.117 10.776 16.377 1.00 25.12 H new ATOM 1584 N LEU B 40 -15.482 11.847 12.645 1.00 24.05 N ATOM 1585 CA LEU B 40 -14.050 11.582 12.744 1.00 2.21 C ATOM 1586 C LEU B 40 -13.241 12.749 12.187 1.00 65.41 C ATOM 1587 O LEU B 40 -12.289 13.214 12.816 1.00 70.13 O ATOM 1588 CB LEU B 40 -13.696 10.296 11.995 1.00 44.43 C ATOM 1589 CG LEU B 40 -12.543 9.477 12.576 1.00 44.42 C ATOM 1590 CD1 LEU B 40 -12.804 7.989 12.401 1.00 45.32 C ATOM 1591 CD2 LEU B 40 -11.227 9.870 11.920 1.00 2.34 C ATOM 0 H LEU B 40 -16.007 11.139 12.132 1.00 24.05 H new ATOM 0 HA LEU B 40 -13.800 11.461 13.798 1.00 2.21 H new ATOM 0 HB2 LEU B 40 -14.583 9.664 11.960 1.00 44.43 H new ATOM 0 HB3 LEU B 40 -13.449 10.555 10.966 1.00 44.43 H new ATOM 0 HG LEU B 40 -12.473 9.690 13.643 1.00 44.42 H new ATOM 0 HD11 LEU B 40 -11.973 7.422 12.820 1.00 45.32 H new ATOM 0 HD12 LEU B 40 -13.725 7.718 12.917 1.00 45.32 H new ATOM 0 HD13 LEU B 40 -12.901 7.759 11.340 1.00 45.32 H new ATOM 0 HD21 LEU B 40 -10.417 9.277 12.345 1.00 2.34 H new ATOM 0 HD22 LEU B 40 -11.286 9.686 10.847 1.00 2.34 H new ATOM 0 HD23 LEU B 40 -11.034 10.928 12.097 1.00 2.34 H new ATOM 1603 N CYS B 41 -13.626 13.218 11.005 1.00 21.22 N ATOM 1604 CA CYS B 41 -12.936 14.331 10.363 1.00 62.45 C ATOM 1605 C CYS B 41 -13.276 15.650 11.050 1.00 10.14 C ATOM 1606 O CYS B 41 -12.415 16.512 11.220 1.00 13.42 O ATOM 1607 CB CYS B 41 -13.310 14.404 8.882 1.00 21.14 C ATOM 1608 SG CYS B 41 -11.896 14.306 7.759 1.00 21.40 S ATOM 0 H CYS B 41 -14.412 12.845 10.472 1.00 21.22 H new ATOM 0 HA CYS B 41 -11.863 14.161 10.452 1.00 62.45 H new ATOM 0 HB2 CYS B 41 -14.000 13.592 8.652 1.00 21.14 H new ATOM 0 HB3 CYS B 41 -13.843 15.337 8.698 1.00 21.14 H new ATOM 0 HG CYS B 41 -11.133 15.344 7.930 1.00 21.40 H new ATOM 1614 N GLU B 42 -14.538 15.799 11.442 1.00 42.23 N ATOM 1615 CA GLU B 42 -14.991 17.015 12.108 1.00 34.13 C ATOM 1616 C GLU B 42 -14.276 17.202 13.442 1.00 11.21 C ATOM 1617 O GLU B 42 -14.063 18.329 13.890 1.00 4.15 O ATOM 1618 CB GLU B 42 -16.504 16.966 12.331 1.00 64.33 C ATOM 1619 CG GLU B 42 -17.145 18.338 12.455 1.00 23.01 C ATOM 1620 CD GLU B 42 -17.048 18.902 13.859 1.00 11.41 C ATOM 1621 OE1 GLU B 42 -17.758 18.395 14.752 1.00 70.41 O ATOM 1622 OE2 GLU B 42 -16.263 19.851 14.065 1.00 62.11 O ATOM 0 H GLU B 42 -15.263 15.094 11.310 1.00 42.23 H new ATOM 0 HA GLU B 42 -14.752 17.862 11.465 1.00 34.13 H new ATOM 0 HB2 GLU B 42 -16.968 16.431 11.502 1.00 64.33 H new ATOM 0 HB3 GLU B 42 -16.711 16.394 13.236 1.00 64.33 H new ATOM 0 HG2 GLU B 42 -16.664 19.024 11.758 1.00 23.01 H new ATOM 0 HG3 GLU B 42 -18.194 18.273 12.165 1.00 23.01 H new ATOM 1629 N GLU B 43 -13.908 16.091 14.072 1.00 14.10 N ATOM 1630 CA GLU B 43 -13.219 16.134 15.356 1.00 24.25 C ATOM 1631 C GLU B 43 -11.975 17.015 15.276 1.00 41.31 C ATOM 1632 O GLU B 43 -11.651 17.735 16.220 1.00 42.25 O ATOM 1633 CB GLU B 43 -12.828 14.721 15.798 1.00 44.15 C ATOM 1634 CG GLU B 43 -13.300 14.369 17.198 1.00 1.55 C ATOM 1635 CD GLU B 43 -12.529 15.106 18.277 1.00 65.01 C ATOM 1636 OE1 GLU B 43 -12.760 16.322 18.445 1.00 74.13 O ATOM 1637 OE2 GLU B 43 -11.694 14.467 18.950 1.00 4.52 O ATOM 0 H GLU B 43 -14.075 15.151 13.714 1.00 14.10 H new ATOM 0 HA GLU B 43 -13.901 16.562 16.091 1.00 24.25 H new ATOM 0 HB2 GLU B 43 -13.242 14.001 15.092 1.00 44.15 H new ATOM 0 HB3 GLU B 43 -11.743 14.623 15.754 1.00 44.15 H new ATOM 0 HG2 GLU B 43 -14.360 14.604 17.290 1.00 1.55 H new ATOM 0 HG3 GLU B 43 -13.197 13.295 17.353 1.00 1.55 H new ATOM 1644 N ALA B 44 -11.283 16.951 14.143 1.00 52.53 N ATOM 1645 CA ALA B 44 -10.078 17.743 13.940 1.00 5.44 C ATOM 1646 C ALA B 44 -10.395 19.236 13.935 1.00 31.53 C ATOM 1647 O ALA B 44 -9.709 20.027 14.582 1.00 73.44 O ATOM 1648 CB ALA B 44 -9.396 17.343 12.639 1.00 71.11 C ATOM 0 H ALA B 44 -11.537 16.359 13.352 1.00 52.53 H new ATOM 0 HA ALA B 44 -9.400 17.545 14.770 1.00 5.44 H new ATOM 0 HB1 ALA B 44 -8.497 17.943 12.500 1.00 71.11 H new ATOM 0 HB2 ALA B 44 -9.125 16.288 12.679 1.00 71.11 H new ATOM 0 HB3 ALA B 44 -10.077 17.511 11.805 1.00 71.11 H new ATOM 1654 N ALA B 45 -11.436 19.611 13.201 1.00 41.44 N ATOM 1655 CA ALA B 45 -11.845 21.007 13.113 1.00 43.54 C ATOM 1656 C ALA B 45 -12.417 21.496 14.440 1.00 42.44 C ATOM 1657 O ALA B 45 -12.366 22.686 14.749 1.00 4.53 O ATOM 1658 CB ALA B 45 -12.862 21.191 11.997 1.00 42.25 C ATOM 0 H ALA B 45 -12.012 18.968 12.658 1.00 41.44 H new ATOM 0 HA ALA B 45 -10.962 21.605 12.886 1.00 43.54 H new ATOM 0 HB1 ALA B 45 -13.158 22.239 11.944 1.00 42.25 H new ATOM 0 HB2 ALA B 45 -12.419 20.890 11.048 1.00 42.25 H new ATOM 0 HB3 ALA B 45 -13.739 20.576 12.199 1.00 42.25 H new ATOM 1664 N LYS B 46 -12.965 20.571 15.219 1.00 15.25 N ATOM 1665 CA LYS B 46 -13.548 20.905 16.514 1.00 64.21 C ATOM 1666 C LYS B 46 -12.499 21.508 17.442 1.00 3.05 C ATOM 1667 O LYS B 46 -12.777 22.454 18.180 1.00 71.55 O ATOM 1668 CB LYS B 46 -14.160 19.660 17.158 1.00 32.21 C ATOM 1669 CG LYS B 46 -15.505 19.915 17.817 1.00 4.23 C ATOM 1670 CD LYS B 46 -16.218 18.616 18.150 1.00 14.32 C ATOM 1671 CE LYS B 46 -17.031 18.738 19.430 1.00 4.05 C ATOM 1672 NZ LYS B 46 -17.950 17.581 19.616 1.00 52.30 N ATOM 0 H LYS B 46 -13.018 19.582 14.976 1.00 15.25 H new ATOM 0 HA LYS B 46 -14.333 21.644 16.352 1.00 64.21 H new ATOM 0 HB2 LYS B 46 -14.278 18.888 16.397 1.00 32.21 H new ATOM 0 HB3 LYS B 46 -13.468 19.269 17.904 1.00 32.21 H new ATOM 0 HG2 LYS B 46 -15.360 20.496 18.728 1.00 4.23 H new ATOM 0 HG3 LYS B 46 -16.129 20.514 17.153 1.00 4.23 H new ATOM 0 HD2 LYS B 46 -16.875 18.339 17.326 1.00 14.32 H new ATOM 0 HD3 LYS B 46 -15.486 17.815 18.258 1.00 14.32 H new ATOM 0 HE2 LYS B 46 -16.356 18.807 20.283 1.00 4.05 H new ATOM 0 HE3 LYS B 46 -17.610 19.661 19.406 1.00 4.05 H new ATOM 0 HZ1 LYS B 46 -18.486 17.702 20.499 1.00 52.30 H new ATOM 0 HZ2 LYS B 46 -18.611 17.530 18.814 1.00 52.30 H new ATOM 0 HZ3 LYS B 46 -17.396 16.702 19.665 1.00 52.30 H new ATOM 1686 N LYS B 47 -11.291 20.956 17.402 1.00 22.23 N ATOM 1687 CA LYS B 47 -10.198 21.440 18.238 1.00 70.45 C ATOM 1688 C LYS B 47 -9.916 22.913 17.964 1.00 42.42 C ATOM 1689 O LYS B 47 -9.538 23.660 18.866 1.00 22.13 O ATOM 1690 CB LYS B 47 -8.935 20.613 17.990 1.00 2.20 C ATOM 1691 CG LYS B 47 -7.820 20.895 18.982 1.00 1.22 C ATOM 1692 CD LYS B 47 -7.714 19.799 20.029 1.00 4.21 C ATOM 1693 CE LYS B 47 -8.550 20.120 21.258 1.00 1.54 C ATOM 1694 NZ LYS B 47 -7.817 20.997 22.213 1.00 3.34 N ATOM 0 H LYS B 47 -11.044 20.172 16.799 1.00 22.23 H new ATOM 0 HA LYS B 47 -10.496 21.333 19.281 1.00 70.45 H new ATOM 0 HB2 LYS B 47 -9.190 19.554 18.034 1.00 2.20 H new ATOM 0 HB3 LYS B 47 -8.572 20.812 16.982 1.00 2.20 H new ATOM 0 HG2 LYS B 47 -6.873 20.984 18.450 1.00 1.22 H new ATOM 0 HG3 LYS B 47 -8.001 21.851 19.472 1.00 1.22 H new ATOM 0 HD2 LYS B 47 -8.043 18.852 19.601 1.00 4.21 H new ATOM 0 HD3 LYS B 47 -6.671 19.672 20.320 1.00 4.21 H new ATOM 0 HE2 LYS B 47 -9.474 20.610 20.951 1.00 1.54 H new ATOM 0 HE3 LYS B 47 -8.831 19.193 21.758 1.00 1.54 H new ATOM 0 HZ1 LYS B 47 -8.471 21.331 22.950 1.00 3.34 H new ATOM 0 HZ2 LYS B 47 -7.043 20.460 22.654 1.00 3.34 H new ATOM 0 HZ3 LYS B 47 -7.424 21.814 21.703 1.00 3.34 H new ATOM 1708 N ALA B 48 -10.105 23.326 16.715 1.00 22.34 N ATOM 1709 CA ALA B 48 -9.873 24.711 16.324 1.00 75.13 C ATOM 1710 C ALA B 48 -10.802 25.656 17.078 1.00 52.30 C ATOM 1711 O ALA B 48 -10.379 26.712 17.547 1.00 61.21 O ATOM 1712 CB ALA B 48 -10.058 24.873 14.822 1.00 72.22 C ATOM 0 H ALA B 48 -10.418 22.721 15.956 1.00 22.34 H new ATOM 0 HA ALA B 48 -8.846 24.969 16.583 1.00 75.13 H new ATOM 0 HB1 ALA B 48 -9.882 25.912 14.544 1.00 72.22 H new ATOM 0 HB2 ALA B 48 -9.350 24.232 14.297 1.00 72.22 H new ATOM 0 HB3 ALA B 48 -11.075 24.592 14.548 1.00 72.22 H new ATOM 1718 N GLU B 49 -12.069 25.269 17.191 1.00 64.32 N ATOM 1719 CA GLU B 49 -13.057 26.085 17.887 1.00 75.54 C ATOM 1720 C GLU B 49 -12.796 26.090 19.391 1.00 70.50 C ATOM 1721 O GLU B 49 -13.046 27.084 20.071 1.00 30.33 O ATOM 1722 CB GLU B 49 -14.469 25.567 17.605 1.00 62.21 C ATOM 1723 CG GLU B 49 -14.805 25.492 16.125 1.00 53.04 C ATOM 1724 CD GLU B 49 -15.674 26.647 15.666 1.00 60.24 C ATOM 1725 OE1 GLU B 49 -16.866 26.412 15.373 1.00 62.34 O ATOM 1726 OE2 GLU B 49 -15.164 27.784 15.598 1.00 43.25 O ATOM 0 H GLU B 49 -12.435 24.396 16.810 1.00 64.32 H new ATOM 0 HA GLU B 49 -12.972 27.107 17.517 1.00 75.54 H new ATOM 0 HB2 GLU B 49 -14.578 24.575 18.044 1.00 62.21 H new ATOM 0 HB3 GLU B 49 -15.191 26.216 18.101 1.00 62.21 H new ATOM 0 HG2 GLU B 49 -13.881 25.484 15.546 1.00 53.04 H new ATOM 0 HG3 GLU B 49 -15.318 24.552 15.920 1.00 53.04 H new ATOM 1733 N GLU B 50 -12.293 24.970 19.901 1.00 72.03 N ATOM 1734 CA GLU B 50 -12.000 24.845 21.324 1.00 21.11 C ATOM 1735 C GLU B 50 -10.789 25.690 21.707 1.00 40.23 C ATOM 1736 O GLU B 50 -10.683 26.169 22.837 1.00 2.21 O ATOM 1737 CB GLU B 50 -11.748 23.380 21.689 1.00 32.22 C ATOM 1738 CG GLU B 50 -11.835 23.101 23.180 1.00 23.43 C ATOM 1739 CD GLU B 50 -11.476 21.669 23.527 1.00 21.41 C ATOM 1740 OE1 GLU B 50 -12.401 20.838 23.648 1.00 52.21 O ATOM 1741 OE2 GLU B 50 -10.271 21.378 23.676 1.00 20.34 O ATOM 0 H GLU B 50 -12.080 24.138 19.351 1.00 72.03 H new ATOM 0 HA GLU B 50 -12.865 25.208 21.879 1.00 21.11 H new ATOM 0 HB2 GLU B 50 -12.473 22.755 21.168 1.00 32.22 H new ATOM 0 HB3 GLU B 50 -10.760 23.090 21.331 1.00 32.22 H new ATOM 0 HG2 GLU B 50 -11.167 23.778 23.712 1.00 23.43 H new ATOM 0 HG3 GLU B 50 -12.846 23.313 23.527 1.00 23.43 H new ATOM 1748 N LEU B 51 -9.877 25.871 20.758 1.00 64.51 N ATOM 1749 CA LEU B 51 -8.672 26.659 20.994 1.00 34.40 C ATOM 1750 C LEU B 51 -9.007 28.142 21.119 1.00 25.10 C ATOM 1751 O LEU B 51 -8.310 28.890 21.804 1.00 43.11 O ATOM 1752 CB LEU B 51 -7.669 26.445 19.859 1.00 63.04 C ATOM 1753 CG LEU B 51 -6.386 25.700 20.229 1.00 3.31 C ATOM 1754 CD1 LEU B 51 -6.602 24.196 20.155 1.00 51.51 C ATOM 1755 CD2 LEU B 51 -5.242 26.122 19.318 1.00 70.33 C ATOM 0 H LEU B 51 -9.949 25.483 19.818 1.00 64.51 H new ATOM 0 HA LEU B 51 -8.227 26.326 21.932 1.00 34.40 H new ATOM 0 HB2 LEU B 51 -8.167 25.896 19.060 1.00 63.04 H new ATOM 0 HB3 LEU B 51 -7.396 27.419 19.454 1.00 63.04 H new ATOM 0 HG LEU B 51 -6.121 25.959 21.254 1.00 3.31 H new ATOM 0 HD11 LEU B 51 -5.678 23.682 20.421 1.00 51.51 H new ATOM 0 HD12 LEU B 51 -7.391 23.907 20.849 1.00 51.51 H new ATOM 0 HD13 LEU B 51 -6.891 23.919 19.141 1.00 51.51 H new ATOM 0 HD21 LEU B 51 -4.337 25.582 19.596 1.00 70.33 H new ATOM 0 HD22 LEU B 51 -5.498 25.894 18.283 1.00 70.33 H new ATOM 0 HD23 LEU B 51 -5.071 27.194 19.421 1.00 70.33 H new ATOM 1767 N PHE B 52 -10.081 28.559 20.455 1.00 5.43 N ATOM 1768 CA PHE B 52 -10.509 29.952 20.493 1.00 4.00 C ATOM 1769 C PHE B 52 -10.729 30.414 21.930 1.00 51.04 C ATOM 1770 O PHE B 52 -10.497 31.576 22.264 1.00 24.01 O ATOM 1771 CB PHE B 52 -11.794 30.134 19.683 1.00 43.21 C ATOM 1772 CG PHE B 52 -11.621 31.007 18.472 1.00 21.44 C ATOM 1773 CD1 PHE B 52 -11.514 30.447 17.209 1.00 70.30 C ATOM 1774 CD2 PHE B 52 -11.565 32.385 18.597 1.00 74.11 C ATOM 1775 CE1 PHE B 52 -11.355 31.247 16.093 1.00 32.30 C ATOM 1776 CE2 PHE B 52 -11.406 33.189 17.485 1.00 64.04 C ATOM 1777 CZ PHE B 52 -11.300 32.619 16.231 1.00 65.24 C ATOM 0 H PHE B 52 -10.670 27.952 19.885 1.00 5.43 H new ATOM 0 HA PHE B 52 -9.720 30.561 20.052 1.00 4.00 H new ATOM 0 HB2 PHE B 52 -12.156 29.156 19.367 1.00 43.21 H new ATOM 0 HB3 PHE B 52 -12.561 30.566 20.326 1.00 43.21 H new ATOM 0 HD1 PHE B 52 -11.555 29.374 17.095 1.00 70.30 H new ATOM 0 HD2 PHE B 52 -11.647 32.836 19.575 1.00 74.11 H new ATOM 0 HE1 PHE B 52 -11.274 30.799 15.114 1.00 32.30 H new ATOM 0 HE2 PHE B 52 -11.365 34.262 17.596 1.00 64.04 H new ATOM 0 HZ PHE B 52 -11.174 33.246 15.361 1.00 65.24 H new ATOM 1787 N LYS B 53 -11.181 29.495 22.777 1.00 51.44 N ATOM 1788 CA LYS B 53 -11.434 29.807 24.179 1.00 34.31 C ATOM 1789 C LYS B 53 -10.158 30.273 24.872 1.00 70.12 C ATOM 1790 O LYS B 53 -10.158 31.277 25.585 1.00 14.22 O ATOM 1791 CB LYS B 53 -12.000 28.581 24.901 1.00 2.12 C ATOM 1792 CG LYS B 53 -13.007 28.923 25.985 1.00 3.23 C ATOM 1793 CD LYS B 53 -12.661 28.248 27.301 1.00 43.41 C ATOM 1794 CE LYS B 53 -13.388 28.898 28.468 1.00 2.54 C ATOM 1795 NZ LYS B 53 -14.316 27.949 29.142 1.00 32.44 N ATOM 0 H LYS B 53 -11.379 28.529 22.517 1.00 51.44 H new ATOM 0 HA LYS B 53 -12.164 30.615 24.219 1.00 34.31 H new ATOM 0 HB2 LYS B 53 -12.474 27.926 24.170 1.00 2.12 H new ATOM 0 HB3 LYS B 53 -11.178 28.020 25.345 1.00 2.12 H new ATOM 0 HG2 LYS B 53 -13.038 30.003 26.126 1.00 3.23 H new ATOM 0 HG3 LYS B 53 -14.003 28.615 25.668 1.00 3.23 H new ATOM 0 HD2 LYS B 53 -12.924 27.192 27.250 1.00 43.41 H new ATOM 0 HD3 LYS B 53 -11.585 28.301 27.466 1.00 43.41 H new ATOM 0 HE2 LYS B 53 -12.659 29.267 29.190 1.00 2.54 H new ATOM 0 HE3 LYS B 53 -13.949 29.762 28.111 1.00 2.54 H new ATOM 0 HZ1 LYS B 53 -14.792 28.430 29.932 1.00 32.44 H new ATOM 0 HZ2 LYS B 53 -15.027 27.616 28.460 1.00 32.44 H new ATOM 0 HZ3 LYS B 53 -13.778 27.137 29.506 1.00 32.44 H new ATOM 1809 N LEU B 54 -9.071 29.539 24.657 1.00 71.11 N ATOM 1810 CA LEU B 54 -7.787 29.879 25.261 1.00 62.42 C ATOM 1811 C LEU B 54 -7.128 31.037 24.519 1.00 22.05 C ATOM 1812 O LEU B 54 -6.521 31.914 25.132 1.00 4.43 O ATOM 1813 CB LEU B 54 -6.861 28.661 25.255 1.00 64.21 C ATOM 1814 CG LEU B 54 -6.585 28.023 26.616 1.00 34.33 C ATOM 1815 CD1 LEU B 54 -5.744 28.949 27.481 1.00 5.00 C ATOM 1816 CD2 LEU B 54 -7.891 27.676 27.317 1.00 20.10 C ATOM 0 H LEU B 54 -9.053 28.705 24.069 1.00 71.11 H new ATOM 0 HA LEU B 54 -7.966 30.186 26.291 1.00 62.42 H new ATOM 0 HB2 LEU B 54 -7.294 27.903 24.602 1.00 64.21 H new ATOM 0 HB3 LEU B 54 -5.909 28.956 24.814 1.00 64.21 H new ATOM 0 HG LEU B 54 -6.025 27.102 26.456 1.00 34.33 H new ATOM 0 HD11 LEU B 54 -5.558 28.477 28.446 1.00 5.00 H new ATOM 0 HD12 LEU B 54 -4.794 29.147 26.985 1.00 5.00 H new ATOM 0 HD13 LEU B 54 -6.276 29.888 27.633 1.00 5.00 H new ATOM 0 HD21 LEU B 54 -7.675 27.223 28.285 1.00 20.10 H new ATOM 0 HD22 LEU B 54 -8.477 28.583 27.464 1.00 20.10 H new ATOM 0 HD23 LEU B 54 -8.457 26.973 26.705 1.00 20.10 H new ATOM 1828 N ALA B 55 -7.252 31.034 23.196 1.00 43.34 N ATOM 1829 CA ALA B 55 -6.672 32.087 22.371 1.00 21.14 C ATOM 1830 C ALA B 55 -7.203 33.457 22.775 1.00 54.34 C ATOM 1831 O ALA B 55 -6.532 34.472 22.592 1.00 14.12 O ATOM 1832 CB ALA B 55 -6.956 31.821 20.899 1.00 14.42 C ATOM 0 H ALA B 55 -7.749 30.314 22.672 1.00 43.34 H new ATOM 0 HA ALA B 55 -5.593 32.085 22.528 1.00 21.14 H new ATOM 0 HB1 ALA B 55 -6.517 32.615 20.295 1.00 14.42 H new ATOM 0 HB2 ALA B 55 -6.521 30.864 20.612 1.00 14.42 H new ATOM 0 HB3 ALA B 55 -8.033 31.794 20.735 1.00 14.42 H new ATOM 1838 N GLU B 56 -8.414 33.479 23.325 1.00 73.12 N ATOM 1839 CA GLU B 56 -9.036 34.726 23.754 1.00 4.10 C ATOM 1840 C GLU B 56 -8.232 35.376 24.877 1.00 70.23 C ATOM 1841 O GLU B 56 -8.002 36.585 24.869 1.00 40.44 O ATOM 1842 CB GLU B 56 -10.471 34.473 24.220 1.00 22.35 C ATOM 1843 CG GLU B 56 -11.501 34.599 23.110 1.00 55.13 C ATOM 1844 CD GLU B 56 -12.919 34.693 23.639 1.00 60.03 C ATOM 1845 OE1 GLU B 56 -13.753 33.846 23.255 1.00 2.32 O ATOM 1846 OE2 GLU B 56 -13.196 35.613 24.436 1.00 11.30 O ATOM 0 H GLU B 56 -8.983 32.647 23.484 1.00 73.12 H new ATOM 0 HA GLU B 56 -9.053 35.405 22.902 1.00 4.10 H new ATOM 0 HB2 GLU B 56 -10.534 33.474 24.651 1.00 22.35 H new ATOM 0 HB3 GLU B 56 -10.716 35.178 25.014 1.00 22.35 H new ATOM 0 HG2 GLU B 56 -11.280 35.484 22.513 1.00 55.13 H new ATOM 0 HG3 GLU B 56 -11.421 33.739 22.446 1.00 55.13 H new ATOM 1853 N GLU B 57 -7.810 34.565 25.841 1.00 25.04 N ATOM 1854 CA GLU B 57 -7.034 35.061 26.972 1.00 3.14 C ATOM 1855 C GLU B 57 -5.582 35.305 26.570 1.00 74.31 C ATOM 1856 O GLU B 57 -4.896 36.142 27.157 1.00 54.40 O ATOM 1857 CB GLU B 57 -7.092 34.069 28.135 1.00 74.33 C ATOM 1858 CG GLU B 57 -7.384 34.721 29.476 1.00 13.15 C ATOM 1859 CD GLU B 57 -8.479 34.008 30.245 1.00 14.31 C ATOM 1860 OE1 GLU B 57 -9.548 34.618 30.458 1.00 10.24 O ATOM 1861 OE2 GLU B 57 -8.267 32.840 30.636 1.00 62.22 O ATOM 0 H GLU B 57 -7.992 33.562 25.862 1.00 25.04 H new ATOM 0 HA GLU B 57 -7.470 36.008 27.290 1.00 3.14 H new ATOM 0 HB2 GLU B 57 -7.860 33.324 27.928 1.00 74.33 H new ATOM 0 HB3 GLU B 57 -6.142 33.539 28.197 1.00 74.33 H new ATOM 0 HG2 GLU B 57 -6.474 34.734 30.075 1.00 13.15 H new ATOM 0 HG3 GLU B 57 -7.675 35.759 29.315 1.00 13.15 H new ATOM 1868 N ARG B 58 -5.120 34.567 25.565 1.00 71.01 N ATOM 1869 CA ARG B 58 -3.750 34.701 25.086 1.00 62.45 C ATOM 1870 C ARG B 58 -3.548 36.041 24.385 1.00 15.42 C ATOM 1871 O ARG B 58 -2.465 36.627 24.441 1.00 33.43 O ATOM 1872 CB ARG B 58 -3.408 33.557 24.129 1.00 11.52 C ATOM 1873 CG ARG B 58 -3.444 32.186 24.784 1.00 72.32 C ATOM 1874 CD ARG B 58 -2.097 31.820 25.389 1.00 63.45 C ATOM 1875 NE ARG B 58 -2.185 30.645 26.251 1.00 44.21 N ATOM 1876 CZ ARG B 58 -2.686 30.673 27.481 1.00 55.01 C ATOM 1877 NH1 ARG B 58 -3.142 31.809 27.990 1.00 1.10 N ATOM 1878 NH2 ARG B 58 -2.732 29.562 28.205 1.00 51.22 N ATOM 0 H ARG B 58 -5.675 33.871 25.067 1.00 71.01 H new ATOM 0 HA ARG B 58 -3.084 34.657 25.948 1.00 62.45 H new ATOM 0 HB2 ARG B 58 -4.109 33.570 23.294 1.00 11.52 H new ATOM 0 HB3 ARG B 58 -2.415 33.726 23.714 1.00 11.52 H new ATOM 0 HG2 ARG B 58 -4.208 32.173 25.561 1.00 72.32 H new ATOM 0 HG3 ARG B 58 -3.728 31.436 24.045 1.00 72.32 H new ATOM 0 HD2 ARG B 58 -1.380 31.630 24.590 1.00 63.45 H new ATOM 0 HD3 ARG B 58 -1.717 32.664 25.964 1.00 63.45 H new ATOM 0 HE ARG B 58 -1.843 29.755 25.889 1.00 44.21 H new ATOM 0 HH11 ARG B 58 -3.109 32.665 27.437 1.00 1.10 H new ATOM 0 HH12 ARG B 58 -3.526 31.827 28.935 1.00 1.10 H new ATOM 0 HH21 ARG B 58 -2.383 28.686 27.817 1.00 51.22 H new ATOM 0 HH22 ARG B 58 -3.117 29.584 29.149 1.00 51.22 H new ATOM 1892 N LEU B 59 -4.596 36.523 23.726 1.00 33.42 N ATOM 1893 CA LEU B 59 -4.535 37.794 23.013 1.00 1.45 C ATOM 1894 C LEU B 59 -5.153 38.914 23.843 1.00 51.21 C ATOM 1895 O LEU B 59 -4.807 40.084 23.683 1.00 44.21 O ATOM 1896 CB LEU B 59 -5.254 37.682 21.668 1.00 3.45 C ATOM 1897 CG LEU B 59 -4.390 37.264 20.478 1.00 61.00 C ATOM 1898 CD1 LEU B 59 -3.631 35.985 20.793 1.00 33.54 C ATOM 1899 CD2 LEU B 59 -5.248 37.084 19.234 1.00 43.11 C ATOM 0 H LEU B 59 -5.499 36.052 23.671 1.00 33.42 H new ATOM 0 HA LEU B 59 -3.486 38.034 22.837 1.00 1.45 H new ATOM 0 HB2 LEU B 59 -6.067 36.963 21.772 1.00 3.45 H new ATOM 0 HB3 LEU B 59 -5.709 38.646 21.440 1.00 3.45 H new ATOM 0 HG LEU B 59 -3.665 38.054 20.284 1.00 61.00 H new ATOM 0 HD11 LEU B 59 -3.021 35.703 19.935 1.00 33.54 H new ATOM 0 HD12 LEU B 59 -2.987 36.147 21.657 1.00 33.54 H new ATOM 0 HD13 LEU B 59 -4.339 35.186 21.013 1.00 33.54 H new ATOM 0 HD21 LEU B 59 -4.617 36.787 18.397 1.00 43.11 H new ATOM 0 HD22 LEU B 59 -5.996 36.313 19.417 1.00 43.11 H new ATOM 0 HD23 LEU B 59 -5.746 38.024 18.997 1.00 43.11 H new ATOM 1911 N LYS B 60 -6.069 38.547 24.732 1.00 74.14 N ATOM 1912 CA LYS B 60 -6.736 39.519 25.591 1.00 10.53 C ATOM 1913 C LYS B 60 -6.443 39.236 27.062 1.00 44.34 C ATOM 1914 O LYS B 60 -6.951 38.271 27.632 1.00 3.05 O ATOM 1915 CB LYS B 60 -8.246 39.495 25.348 1.00 61.25 C ATOM 1916 CG LYS B 60 -8.952 40.771 25.773 1.00 1.02 C ATOM 1917 CD LYS B 60 -10.452 40.567 25.888 1.00 60.55 C ATOM 1918 CE LYS B 60 -11.157 40.861 24.573 1.00 24.20 C ATOM 1919 NZ LYS B 60 -12.481 41.509 24.785 1.00 63.30 N ATOM 0 H LYS B 60 -6.367 37.582 24.877 1.00 74.14 H new ATOM 0 HA LYS B 60 -6.351 40.508 25.345 1.00 10.53 H new ATOM 0 HB2 LYS B 60 -8.432 39.323 24.288 1.00 61.25 H new ATOM 0 HB3 LYS B 60 -8.679 38.653 25.888 1.00 61.25 H new ATOM 0 HG2 LYS B 60 -8.555 41.105 26.731 1.00 1.02 H new ATOM 0 HG3 LYS B 60 -8.746 41.560 25.050 1.00 1.02 H new ATOM 0 HD2 LYS B 60 -10.658 39.541 26.191 1.00 60.55 H new ATOM 0 HD3 LYS B 60 -10.850 41.216 26.668 1.00 60.55 H new ATOM 0 HE2 LYS B 60 -10.529 41.509 23.962 1.00 24.20 H new ATOM 0 HE3 LYS B 60 -11.292 39.933 24.018 1.00 24.20 H new ATOM 0 HZ1 LYS B 60 -12.929 41.693 23.865 1.00 63.30 H new ATOM 0 HZ2 LYS B 60 -13.089 40.880 25.347 1.00 63.30 H new ATOM 0 HZ3 LYS B 60 -12.350 42.408 25.292 1.00 63.30 H new ATOM 1933 N LYS B 61 -5.622 40.087 27.670 1.00 24.50 N ATOM 1934 CA LYS B 61 -5.263 39.931 29.074 1.00 32.15 C ATOM 1935 C LYS B 61 -6.113 40.840 29.957 1.00 65.10 C ATOM 1936 O LYS B 61 -6.978 40.372 30.697 1.00 32.33 O ATOM 1937 CB LYS B 61 -3.779 40.244 29.281 1.00 74.41 C ATOM 1938 CG LYS B 61 -2.850 39.180 28.723 1.00 72.24 C ATOM 1939 CD LYS B 61 -1.637 39.798 28.048 1.00 32.45 C ATOM 1940 CE LYS B 61 -0.560 40.158 29.061 1.00 43.23 C ATOM 1941 NZ LYS B 61 0.113 41.442 28.719 1.00 10.54 N ATOM 0 H LYS B 61 -5.193 40.891 27.212 1.00 24.50 H new ATOM 0 HA LYS B 61 -5.453 38.896 29.358 1.00 32.15 H new ATOM 0 HB2 LYS B 61 -3.548 41.199 28.810 1.00 74.41 H new ATOM 0 HB3 LYS B 61 -3.586 40.360 30.347 1.00 74.41 H new ATOM 0 HG2 LYS B 61 -2.524 38.522 29.528 1.00 72.24 H new ATOM 0 HG3 LYS B 61 -3.391 38.562 28.006 1.00 72.24 H new ATOM 0 HD2 LYS B 61 -1.231 39.100 27.316 1.00 32.45 H new ATOM 0 HD3 LYS B 61 -1.939 40.692 27.502 1.00 32.45 H new ATOM 0 HE2 LYS B 61 -1.005 40.234 30.053 1.00 43.23 H new ATOM 0 HE3 LYS B 61 0.181 39.359 29.104 1.00 43.23 H new ATOM 0 HZ1 LYS B 61 0.840 41.654 29.432 1.00 10.54 H new ATOM 0 HZ2 LYS B 61 0.559 41.362 27.783 1.00 10.54 H new ATOM 0 HZ3 LYS B 61 -0.590 42.209 28.703 1.00 10.54 H new ATOM 1955 N LEU B 62 -5.860 42.142 29.872 1.00 53.03 N ATOM 1956 CA LEU B 62 -6.604 43.118 30.663 1.00 72.50 C ATOM 1957 C LEU B 62 -7.041 44.297 29.800 1.00 61.14 C ATOM 1958 O LEU B 62 -6.571 44.464 28.675 1.00 42.32 O ATOM 1959 CB LEU B 62 -5.749 43.614 31.830 1.00 54.54 C ATOM 1960 CG LEU B 62 -6.502 43.935 33.123 1.00 44.41 C ATOM 1961 CD1 LEU B 62 -5.563 43.871 34.317 1.00 32.11 C ATOM 1962 CD2 LEU B 62 -7.158 45.306 33.032 1.00 21.43 C ATOM 0 H LEU B 62 -5.147 42.546 29.265 1.00 53.03 H new ATOM 0 HA LEU B 62 -7.495 42.629 31.056 1.00 72.50 H new ATOM 0 HB2 LEU B 62 -4.995 42.858 32.050 1.00 54.54 H new ATOM 0 HB3 LEU B 62 -5.217 44.510 31.510 1.00 54.54 H new ATOM 0 HG LEU B 62 -7.284 43.188 33.260 1.00 44.41 H new ATOM 0 HD11 LEU B 62 -6.116 44.102 35.227 1.00 32.11 H new ATOM 0 HD12 LEU B 62 -5.140 42.869 34.394 1.00 32.11 H new ATOM 0 HD13 LEU B 62 -4.759 44.596 34.187 1.00 32.11 H new ATOM 0 HD21 LEU B 62 -7.689 45.518 33.960 1.00 21.43 H new ATOM 0 HD22 LEU B 62 -6.393 46.065 32.870 1.00 21.43 H new ATOM 0 HD23 LEU B 62 -7.862 45.318 32.200 1.00 21.43 H new TER 1974 LEU B 62