USER MOD reduce.3.24.130724 H: found=0, std=0, add=1018, rem=0, adj=9 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+ -115:sc= -1.18 (180deg=-1.55!) USER MOD Single : A 2 LYS NZ :NH3+ 174:sc=-0.00472 (180deg=-0.105) USER MOD Single : A 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) 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 167:sc= 0 (180deg=-0.407) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 CYS SG : rot -63:sc= -0.717 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+ 173:sc= 0 (180deg=-0.0402) USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0267) USER MOD Single : B 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET N :NH3+ 137:sc= 0.0889 (180deg=-0.0333) 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+ 180:sc= 0 (180deg=0) USER MOD Single : B 17 LYS NZ :NH3+ 171:sc= 0.0726 (180deg=0.056) USER MOD Single : B 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 38 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 41 CYS SG : rot -25:sc= 0.056 USER MOD Single : B 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) 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 -8.569 -1.758 -0.142 1.00 0.00 N ATOM 2 CA MET A 1 -9.337 -2.004 -1.357 1.00 52.33 C ATOM 3 C MET A 1 -10.342 -0.882 -1.600 1.00 71.33 C ATOM 4 O MET A 1 -11.416 -1.107 -2.160 1.00 10.03 O ATOM 5 CB MET A 1 -10.066 -3.346 -1.263 1.00 0.54 C ATOM 6 CG MET A 1 -9.169 -4.495 -0.832 1.00 64.13 C ATOM 7 SD MET A 1 -9.115 -5.826 -2.048 1.00 1.24 S ATOM 8 CE MET A 1 -7.931 -6.933 -1.285 1.00 42.52 C ATOM 0 H1 MET A 1 -7.569 -1.610 -0.387 1.00 0.00 H new ATOM 0 H2 MET A 1 -8.937 -0.911 0.336 1.00 0.00 H new ATOM 0 H3 MET A 1 -8.652 -2.577 0.493 1.00 0.00 H new ATOM 0 HA MET A 1 -8.642 -2.035 -2.196 1.00 52.33 H new ATOM 0 HB2 MET A 1 -10.890 -3.254 -0.556 1.00 0.54 H new ATOM 0 HB3 MET A 1 -10.504 -3.581 -2.233 1.00 0.54 H new ATOM 0 HG2 MET A 1 -8.159 -4.120 -0.664 1.00 64.13 H new ATOM 0 HG3 MET A 1 -9.524 -4.891 0.119 1.00 64.13 H new ATOM 0 HE1 MET A 1 -7.790 -7.808 -1.919 1.00 42.52 H new ATOM 0 HE2 MET A 1 -6.979 -6.417 -1.160 1.00 42.52 H new ATOM 0 HE3 MET A 1 -8.303 -7.248 -0.310 1.00 42.52 H new ATOM 18 N LYS A 2 -9.987 0.326 -1.176 1.00 34.21 N ATOM 19 CA LYS A 2 -10.857 1.484 -1.348 1.00 51.43 C ATOM 20 C LYS A 2 -10.076 2.675 -1.895 1.00 25.12 C ATOM 21 O LYS A 2 -8.846 2.693 -1.859 1.00 22.52 O ATOM 22 CB LYS A 2 -11.512 1.858 -0.016 1.00 4.23 C ATOM 23 CG LYS A 2 -12.794 1.094 0.267 1.00 4.12 C ATOM 24 CD LYS A 2 -13.923 1.540 -0.647 1.00 22.22 C ATOM 25 CE LYS A 2 -15.152 0.660 -0.486 1.00 14.04 C ATOM 26 NZ LYS A 2 -15.681 0.698 0.907 1.00 61.31 N ATOM 0 H LYS A 2 -9.102 0.529 -0.710 1.00 34.21 H new ATOM 0 HA LYS A 2 -11.633 1.220 -2.066 1.00 51.43 H new ATOM 0 HB2 LYS A 2 -10.804 1.674 0.792 1.00 4.23 H new ATOM 0 HB3 LYS A 2 -11.728 2.926 -0.014 1.00 4.23 H new ATOM 0 HG2 LYS A 2 -12.619 0.026 0.136 1.00 4.12 H new ATOM 0 HG3 LYS A 2 -13.086 1.244 1.307 1.00 4.12 H new ATOM 0 HD2 LYS A 2 -14.184 2.575 -0.426 1.00 22.22 H new ATOM 0 HD3 LYS A 2 -13.587 1.511 -1.683 1.00 22.22 H new ATOM 0 HE2 LYS A 2 -15.927 0.988 -1.178 1.00 14.04 H new ATOM 0 HE3 LYS A 2 -14.901 -0.367 -0.752 1.00 14.04 H new ATOM 0 HZ1 LYS A 2 -16.575 0.168 0.953 1.00 61.31 H new ATOM 0 HZ2 LYS A 2 -14.989 0.267 1.553 1.00 61.31 H new ATOM 0 HZ3 LYS A 2 -15.849 1.685 1.188 1.00 61.31 H new ATOM 40 N LYS A 3 -10.798 3.669 -2.400 1.00 72.43 N ATOM 41 CA LYS A 3 -10.175 4.865 -2.953 1.00 33.34 C ATOM 42 C LYS A 3 -10.415 6.070 -2.049 1.00 40.42 C ATOM 43 O LYS A 3 -9.618 7.009 -2.024 1.00 4.31 O ATOM 44 CB LYS A 3 -10.719 5.148 -4.354 1.00 4.01 C ATOM 45 CG LYS A 3 -12.229 5.027 -4.456 1.00 42.02 C ATOM 46 CD LYS A 3 -12.835 6.212 -5.189 1.00 62.54 C ATOM 47 CE LYS A 3 -12.646 7.505 -4.412 1.00 24.11 C ATOM 48 NZ LYS A 3 -11.899 8.523 -5.202 1.00 2.04 N ATOM 0 H LYS A 3 -11.817 3.670 -2.438 1.00 72.43 H new ATOM 0 HA LYS A 3 -9.101 4.689 -3.017 1.00 33.34 H new ATOM 0 HB2 LYS A 3 -10.422 6.153 -4.654 1.00 4.01 H new ATOM 0 HB3 LYS A 3 -10.259 4.456 -5.060 1.00 4.01 H new ATOM 0 HG2 LYS A 3 -12.487 4.105 -4.977 1.00 42.02 H new ATOM 0 HG3 LYS A 3 -12.658 4.958 -3.456 1.00 42.02 H new ATOM 0 HD2 LYS A 3 -12.374 6.307 -6.172 1.00 62.54 H new ATOM 0 HD3 LYS A 3 -13.898 6.036 -5.351 1.00 62.54 H new ATOM 0 HE2 LYS A 3 -13.620 7.906 -4.132 1.00 24.11 H new ATOM 0 HE3 LYS A 3 -12.109 7.297 -3.487 1.00 24.11 H new ATOM 0 HZ1 LYS A 3 -11.791 9.390 -4.637 1.00 2.04 H new ATOM 0 HZ2 LYS A 3 -10.960 8.151 -5.448 1.00 2.04 H new ATOM 0 HZ3 LYS A 3 -12.424 8.740 -6.073 1.00 2.04 H new ATOM 62 N LEU A 4 -11.516 6.037 -1.307 1.00 44.12 N ATOM 63 CA LEU A 4 -11.861 7.127 -0.400 1.00 23.52 C ATOM 64 C LEU A 4 -10.958 7.118 0.829 1.00 15.40 C ATOM 65 O LEU A 4 -10.733 8.155 1.453 1.00 15.05 O ATOM 66 CB LEU A 4 -13.326 7.016 0.028 1.00 11.55 C ATOM 67 CG LEU A 4 -13.628 6.004 1.133 1.00 25.54 C ATOM 68 CD1 LEU A 4 -13.680 6.691 2.488 1.00 53.40 C ATOM 69 CD2 LEU A 4 -14.935 5.279 0.849 1.00 60.11 C ATOM 0 H LEU A 4 -12.186 5.268 -1.315 1.00 44.12 H new ATOM 0 HA LEU A 4 -11.714 8.068 -0.929 1.00 23.52 H new ATOM 0 HB2 LEU A 4 -13.662 7.998 0.361 1.00 11.55 H new ATOM 0 HB3 LEU A 4 -13.921 6.756 -0.848 1.00 11.55 H new ATOM 0 HG LEU A 4 -12.824 5.268 1.154 1.00 25.54 H new ATOM 0 HD11 LEU A 4 -13.896 5.954 3.262 1.00 53.40 H new ATOM 0 HD12 LEU A 4 -12.719 7.162 2.694 1.00 53.40 H new ATOM 0 HD13 LEU A 4 -14.462 7.450 2.481 1.00 53.40 H new ATOM 0 HD21 LEU A 4 -15.134 4.562 1.646 1.00 60.11 H new ATOM 0 HD22 LEU A 4 -15.749 6.002 0.800 1.00 60.11 H new ATOM 0 HD23 LEU A 4 -14.860 4.752 -0.102 1.00 60.11 H new ATOM 81 N ARG A 5 -10.442 5.942 1.169 1.00 55.02 N ATOM 82 CA ARG A 5 -9.562 5.799 2.324 1.00 63.22 C ATOM 83 C ARG A 5 -8.347 6.712 2.198 1.00 51.31 C ATOM 84 O ARG A 5 -8.060 7.507 3.093 1.00 75.22 O ATOM 85 CB ARG A 5 -9.108 4.345 2.469 1.00 45.21 C ATOM 86 CG ARG A 5 -8.073 4.136 3.561 1.00 55.50 C ATOM 87 CD ARG A 5 -6.664 4.087 2.993 1.00 11.33 C ATOM 88 NE ARG A 5 -5.832 3.101 3.677 1.00 31.14 N ATOM 89 CZ ARG A 5 -4.535 2.941 3.438 1.00 33.23 C ATOM 90 NH1 ARG A 5 -3.925 3.700 2.537 1.00 34.20 N ATOM 91 NH2 ARG A 5 -3.845 2.022 4.102 1.00 63.42 N ATOM 0 H ARG A 5 -10.617 5.074 0.662 1.00 55.02 H new ATOM 0 HA ARG A 5 -10.122 6.088 3.214 1.00 63.22 H new ATOM 0 HB2 ARG A 5 -9.977 3.721 2.680 1.00 45.21 H new ATOM 0 HB3 ARG A 5 -8.695 4.006 1.519 1.00 45.21 H new ATOM 0 HG2 ARG A 5 -8.144 4.943 4.290 1.00 55.50 H new ATOM 0 HG3 ARG A 5 -8.285 3.208 4.091 1.00 55.50 H new ATOM 0 HD2 ARG A 5 -6.710 3.848 1.930 1.00 11.33 H new ATOM 0 HD3 ARG A 5 -6.204 5.071 3.079 1.00 11.33 H new ATOM 0 HE ARG A 5 -6.271 2.502 4.377 1.00 31.14 H new ATOM 0 HH11 ARG A 5 -4.452 4.408 2.026 1.00 34.20 H new ATOM 0 HH12 ARG A 5 -2.929 3.575 2.355 1.00 34.20 H new ATOM 0 HH21 ARG A 5 -4.311 1.438 4.797 1.00 63.42 H new ATOM 0 HH22 ARG A 5 -2.849 1.900 3.918 1.00 63.42 H new ATOM 105 N GLU A 6 -7.637 6.593 1.081 1.00 43.10 N ATOM 106 CA GLU A 6 -6.452 7.408 0.839 1.00 0.14 C ATOM 107 C GLU A 6 -6.837 8.853 0.537 1.00 41.02 C ATOM 108 O GLU A 6 -6.074 9.780 0.807 1.00 21.22 O ATOM 109 CB GLU A 6 -5.638 6.832 -0.322 1.00 13.51 C ATOM 110 CG GLU A 6 -6.273 7.062 -1.683 1.00 1.35 C ATOM 111 CD GLU A 6 -6.085 5.885 -2.620 1.00 23.42 C ATOM 112 OE1 GLU A 6 -6.777 4.862 -2.434 1.00 14.25 O ATOM 113 OE2 GLU A 6 -5.246 5.985 -3.540 1.00 44.31 O ATOM 0 H GLU A 6 -7.861 5.941 0.330 1.00 43.10 H new ATOM 0 HA GLU A 6 -5.843 7.394 1.743 1.00 0.14 H new ATOM 0 HB2 GLU A 6 -4.644 7.278 -0.314 1.00 13.51 H new ATOM 0 HB3 GLU A 6 -5.508 5.761 -0.167 1.00 13.51 H new ATOM 0 HG2 GLU A 6 -7.338 7.253 -1.555 1.00 1.35 H new ATOM 0 HG3 GLU A 6 -5.841 7.955 -2.135 1.00 1.35 H new ATOM 120 N GLU A 7 -8.028 9.037 -0.027 1.00 10.11 N ATOM 121 CA GLU A 7 -8.514 10.369 -0.367 1.00 62.31 C ATOM 122 C GLU A 7 -8.763 11.195 0.890 1.00 35.12 C ATOM 123 O GLU A 7 -8.202 12.278 1.055 1.00 34.43 O ATOM 124 CB GLU A 7 -9.800 10.271 -1.190 1.00 31.31 C ATOM 125 CG GLU A 7 -9.791 11.135 -2.440 1.00 24.31 C ATOM 126 CD GLU A 7 -9.893 12.616 -2.127 1.00 20.53 C ATOM 127 OE1 GLU A 7 -10.084 12.958 -0.941 1.00 74.10 O ATOM 128 OE2 GLU A 7 -9.782 13.431 -3.066 1.00 61.44 O ATOM 0 H GLU A 7 -8.673 8.281 -0.257 1.00 10.11 H new ATOM 0 HA GLU A 7 -7.748 10.867 -0.961 1.00 62.31 H new ATOM 0 HB2 GLU A 7 -9.958 9.232 -1.478 1.00 31.31 H new ATOM 0 HB3 GLU A 7 -10.644 10.561 -0.565 1.00 31.31 H new ATOM 0 HG2 GLU A 7 -8.874 10.948 -3.000 1.00 24.31 H new ATOM 0 HG3 GLU A 7 -10.622 10.845 -3.083 1.00 24.31 H new ATOM 135 N ALA A 8 -9.608 10.676 1.775 1.00 61.44 N ATOM 136 CA ALA A 8 -9.931 11.363 3.019 1.00 4.52 C ATOM 137 C ALA A 8 -8.667 11.729 3.788 1.00 23.25 C ATOM 138 O ALA A 8 -8.518 12.858 4.256 1.00 74.00 O ATOM 139 CB ALA A 8 -10.843 10.500 3.878 1.00 14.23 C ATOM 0 H ALA A 8 -10.082 9.781 1.653 1.00 61.44 H new ATOM 0 HA ALA A 8 -10.453 12.287 2.770 1.00 4.52 H new ATOM 0 HB1 ALA A 8 -11.076 11.026 4.804 1.00 14.23 H new ATOM 0 HB2 ALA A 8 -11.766 10.294 3.336 1.00 14.23 H new ATOM 0 HB3 ALA A 8 -10.342 9.561 4.111 1.00 14.23 H new ATOM 145 N ALA A 9 -7.757 10.768 3.915 1.00 70.11 N ATOM 146 CA ALA A 9 -6.505 10.990 4.626 1.00 73.01 C ATOM 147 C ALA A 9 -5.752 12.186 4.052 1.00 23.43 C ATOM 148 O ALA A 9 -5.050 12.894 4.773 1.00 3.55 O ATOM 149 CB ALA A 9 -5.637 9.741 4.570 1.00 61.33 C ATOM 0 H ALA A 9 -7.864 9.828 3.534 1.00 70.11 H new ATOM 0 HA ALA A 9 -6.741 11.208 5.667 1.00 73.01 H new ATOM 0 HB1 ALA A 9 -4.705 9.921 5.105 1.00 61.33 H new ATOM 0 HB2 ALA A 9 -6.167 8.909 5.034 1.00 61.33 H new ATOM 0 HB3 ALA A 9 -5.417 9.497 3.531 1.00 61.33 H new ATOM 155 N LYS A 10 -5.901 12.404 2.750 1.00 72.41 N ATOM 156 CA LYS A 10 -5.237 13.513 2.078 1.00 33.13 C ATOM 157 C LYS A 10 -5.884 14.843 2.452 1.00 12.03 C ATOM 158 O LYS A 10 -5.197 15.844 2.656 1.00 35.23 O ATOM 159 CB LYS A 10 -5.284 13.320 0.561 1.00 43.01 C ATOM 160 CG LYS A 10 -4.066 13.870 -0.160 1.00 62.22 C ATOM 161 CD LYS A 10 -3.234 12.759 -0.777 1.00 23.54 C ATOM 162 CE LYS A 10 -2.131 13.315 -1.666 1.00 53.12 C ATOM 163 NZ LYS A 10 -1.750 12.358 -2.742 1.00 75.34 N ATOM 0 H LYS A 10 -6.477 11.826 2.139 1.00 72.41 H new ATOM 0 HA LYS A 10 -4.197 13.531 2.404 1.00 33.13 H new ATOM 0 HB2 LYS A 10 -5.376 12.256 0.341 1.00 43.01 H new ATOM 0 HB3 LYS A 10 -6.178 13.805 0.169 1.00 43.01 H new ATOM 0 HG2 LYS A 10 -4.385 14.562 -0.939 1.00 62.22 H new ATOM 0 HG3 LYS A 10 -3.454 14.438 0.540 1.00 62.22 H new ATOM 0 HD2 LYS A 10 -2.794 12.151 0.013 1.00 23.54 H new ATOM 0 HD3 LYS A 10 -3.878 12.103 -1.362 1.00 23.54 H new ATOM 0 HE2 LYS A 10 -2.463 14.252 -2.114 1.00 53.12 H new ATOM 0 HE3 LYS A 10 -1.256 13.545 -1.058 1.00 53.12 H new ATOM 0 HZ1 LYS A 10 -0.996 12.774 -3.326 1.00 75.34 H new ATOM 0 HZ2 LYS A 10 -1.409 11.473 -2.315 1.00 75.34 H new ATOM 0 HZ3 LYS A 10 -2.578 12.158 -3.338 1.00 75.34 H new ATOM 177 N LEU A 11 -7.210 14.845 2.542 1.00 21.22 N ATOM 178 CA LEU A 11 -7.950 16.051 2.894 1.00 52.42 C ATOM 179 C LEU A 11 -7.544 16.557 4.275 1.00 23.10 C ATOM 180 O LEU A 11 -7.567 17.759 4.540 1.00 64.41 O ATOM 181 CB LEU A 11 -9.455 15.778 2.860 1.00 13.45 C ATOM 182 CG LEU A 11 -10.211 16.332 1.652 1.00 63.55 C ATOM 183 CD1 LEU A 11 -10.072 17.844 1.583 1.00 50.24 C ATOM 184 CD2 LEU A 11 -9.707 15.689 0.368 1.00 34.51 C ATOM 0 H LEU A 11 -7.794 14.025 2.376 1.00 21.22 H new ATOM 0 HA LEU A 11 -7.710 16.821 2.161 1.00 52.42 H new ATOM 0 HB2 LEU A 11 -9.609 14.700 2.896 1.00 13.45 H new ATOM 0 HB3 LEU A 11 -9.900 16.194 3.764 1.00 13.45 H new ATOM 0 HG LEU A 11 -11.268 16.090 1.766 1.00 63.55 H new ATOM 0 HD11 LEU A 11 -10.617 18.220 0.717 1.00 50.24 H new ATOM 0 HD12 LEU A 11 -10.481 18.289 2.490 1.00 50.24 H new ATOM 0 HD13 LEU A 11 -9.019 18.109 1.492 1.00 50.24 H new ATOM 0 HD21 LEU A 11 -10.256 16.095 -0.482 1.00 34.51 H new ATOM 0 HD22 LEU A 11 -8.644 15.900 0.248 1.00 34.51 H new ATOM 0 HD23 LEU A 11 -9.859 14.611 0.417 1.00 34.51 H new ATOM 196 N PHE A 12 -7.171 15.630 5.151 1.00 33.04 N ATOM 197 CA PHE A 12 -6.758 15.982 6.506 1.00 41.12 C ATOM 198 C PHE A 12 -5.518 16.871 6.483 1.00 63.15 C ATOM 199 O PHE A 12 -5.351 17.742 7.336 1.00 34.43 O ATOM 200 CB PHE A 12 -6.478 14.717 7.320 1.00 20.32 C ATOM 201 CG PHE A 12 -7.655 14.254 8.131 1.00 71.52 C ATOM 202 CD1 PHE A 12 -8.884 14.037 7.530 1.00 75.33 C ATOM 203 CD2 PHE A 12 -7.531 14.035 9.494 1.00 20.31 C ATOM 204 CE1 PHE A 12 -9.969 13.609 8.273 1.00 22.05 C ATOM 205 CE2 PHE A 12 -8.612 13.607 10.241 1.00 13.51 C ATOM 206 CZ PHE A 12 -9.832 13.396 9.630 1.00 73.41 C ATOM 0 H PHE A 12 -7.146 14.631 4.948 1.00 33.04 H new ATOM 0 HA PHE A 12 -7.571 16.536 6.975 1.00 41.12 H new ATOM 0 HB2 PHE A 12 -6.176 13.918 6.643 1.00 20.32 H new ATOM 0 HB3 PHE A 12 -5.637 14.903 7.988 1.00 20.32 H new ATOM 0 HD1 PHE A 12 -8.996 14.204 6.469 1.00 75.33 H new ATOM 0 HD2 PHE A 12 -6.580 14.201 9.977 1.00 20.31 H new ATOM 0 HE1 PHE A 12 -10.922 13.442 7.793 1.00 22.05 H new ATOM 0 HE2 PHE A 12 -8.503 13.438 11.302 1.00 13.51 H new ATOM 0 HZ PHE A 12 -10.678 13.065 10.213 1.00 73.41 H new ATOM 216 N GLU A 13 -4.652 16.643 5.500 1.00 30.32 N ATOM 217 CA GLU A 13 -3.427 17.422 5.368 1.00 2.11 C ATOM 218 C GLU A 13 -3.734 18.848 4.919 1.00 42.01 C ATOM 219 O GLU A 13 -3.024 19.788 5.276 1.00 60.45 O ATOM 220 CB GLU A 13 -2.478 16.755 4.370 1.00 63.13 C ATOM 221 CG GLU A 13 -1.019 17.129 4.574 1.00 24.10 C ATOM 222 CD GLU A 13 -0.096 15.928 4.520 1.00 73.24 C ATOM 223 OE1 GLU A 13 -0.347 15.023 3.696 1.00 20.21 O ATOM 224 OE2 GLU A 13 0.877 15.891 5.302 1.00 73.31 O ATOM 0 H GLU A 13 -4.776 15.926 4.785 1.00 30.32 H new ATOM 0 HA GLU A 13 -2.946 17.463 6.345 1.00 2.11 H new ATOM 0 HB2 GLU A 13 -2.582 15.673 4.450 1.00 63.13 H new ATOM 0 HB3 GLU A 13 -2.777 17.029 3.358 1.00 63.13 H new ATOM 0 HG2 GLU A 13 -0.721 17.846 3.809 1.00 24.10 H new ATOM 0 HG3 GLU A 13 -0.907 17.626 5.538 1.00 24.10 H new ATOM 231 N GLU A 14 -4.797 18.999 4.135 1.00 25.13 N ATOM 232 CA GLU A 14 -5.197 20.309 3.637 1.00 50.24 C ATOM 233 C GLU A 14 -5.339 21.308 4.782 1.00 22.45 C ATOM 234 O GLU A 14 -4.903 22.454 4.677 1.00 74.00 O ATOM 235 CB GLU A 14 -6.518 20.206 2.871 1.00 65.14 C ATOM 236 CG GLU A 14 -6.575 21.088 1.635 1.00 1.52 C ATOM 237 CD GLU A 14 -7.030 20.335 0.400 1.00 2.30 C ATOM 238 OE1 GLU A 14 -6.305 19.414 -0.033 1.00 12.51 O ATOM 239 OE2 GLU A 14 -8.109 20.666 -0.134 1.00 61.21 O ATOM 0 H GLU A 14 -5.396 18.231 3.832 1.00 25.13 H new ATOM 0 HA GLU A 14 -4.419 20.665 2.962 1.00 50.24 H new ATOM 0 HB2 GLU A 14 -6.677 19.169 2.575 1.00 65.14 H new ATOM 0 HB3 GLU A 14 -7.337 20.476 3.538 1.00 65.14 H new ATOM 0 HG2 GLU A 14 -7.254 21.921 1.819 1.00 1.52 H new ATOM 0 HG3 GLU A 14 -5.589 21.515 1.453 1.00 1.52 H new ATOM 246 N TRP A 15 -5.949 20.863 5.875 1.00 44.25 N ATOM 247 CA TRP A 15 -6.148 21.717 7.040 1.00 54.12 C ATOM 248 C TRP A 15 -4.812 22.173 7.615 1.00 71.43 C ATOM 249 O TRP A 15 -4.619 23.354 7.901 1.00 11.35 O ATOM 250 CB TRP A 15 -6.952 20.975 8.109 1.00 33.13 C ATOM 251 CG TRP A 15 -8.178 20.302 7.572 1.00 63.22 C ATOM 252 CD1 TRP A 15 -8.934 20.704 6.509 1.00 5.44 C ATOM 253 CD2 TRP A 15 -8.790 19.109 8.074 1.00 41.54 C ATOM 254 NE1 TRP A 15 -9.980 19.835 6.319 1.00 65.40 N ATOM 255 CE2 TRP A 15 -9.914 18.846 7.265 1.00 11.21 C ATOM 256 CE3 TRP A 15 -8.499 18.237 9.125 1.00 14.52 C ATOM 257 CZ2 TRP A 15 -10.743 17.749 7.479 1.00 55.04 C ATOM 258 CZ3 TRP A 15 -9.324 17.148 9.336 1.00 11.24 C ATOM 259 CH2 TRP A 15 -10.435 16.912 8.516 1.00 62.43 C ATOM 0 H TRP A 15 -6.314 19.916 5.979 1.00 44.25 H new ATOM 0 HA TRP A 15 -6.705 22.599 6.723 1.00 54.12 H new ATOM 0 HB2 TRP A 15 -6.313 20.228 8.580 1.00 33.13 H new ATOM 0 HB3 TRP A 15 -7.245 21.680 8.887 1.00 33.13 H new ATOM 0 HD1 TRP A 15 -8.738 21.578 5.905 1.00 5.44 H new ATOM 0 HE1 TRP A 15 -10.691 19.913 5.592 1.00 65.40 H new ATOM 0 HE3 TRP A 15 -7.644 18.410 9.762 1.00 14.52 H new ATOM 0 HZ2 TRP A 15 -11.600 17.565 6.848 1.00 55.04 H new ATOM 0 HZ3 TRP A 15 -9.108 16.468 10.147 1.00 11.24 H new ATOM 0 HH2 TRP A 15 -11.061 16.052 8.706 1.00 62.43 H new ATOM 270 N LYS A 16 -3.892 21.229 7.782 1.00 2.32 N ATOM 271 CA LYS A 16 -2.572 21.534 8.321 1.00 1.04 C ATOM 272 C LYS A 16 -1.782 22.418 7.361 1.00 21.21 C ATOM 273 O LYS A 16 -0.910 23.181 7.776 1.00 13.30 O ATOM 274 CB LYS A 16 -1.799 20.243 8.594 1.00 34.31 C ATOM 275 CG LYS A 16 -0.360 20.474 9.022 1.00 34.31 C ATOM 276 CD LYS A 16 0.591 20.411 7.837 1.00 14.40 C ATOM 277 CE LYS A 16 1.650 19.337 8.029 1.00 43.42 C ATOM 278 NZ LYS A 16 2.178 18.841 6.727 1.00 51.21 N ATOM 0 H LYS A 16 -4.036 20.246 7.552 1.00 2.32 H new ATOM 0 HA LYS A 16 -2.707 22.075 9.258 1.00 1.04 H new ATOM 0 HB2 LYS A 16 -2.314 19.679 9.371 1.00 34.31 H new ATOM 0 HB3 LYS A 16 -1.807 19.627 7.694 1.00 34.31 H new ATOM 0 HG2 LYS A 16 -0.275 21.447 9.507 1.00 34.31 H new ATOM 0 HG3 LYS A 16 -0.074 19.724 9.760 1.00 34.31 H new ATOM 0 HD2 LYS A 16 0.027 20.208 6.927 1.00 14.40 H new ATOM 0 HD3 LYS A 16 1.073 21.379 7.704 1.00 14.40 H new ATOM 0 HE2 LYS A 16 2.470 19.738 8.625 1.00 43.42 H new ATOM 0 HE3 LYS A 16 1.226 18.504 8.590 1.00 43.42 H new ATOM 0 HZ1 LYS A 16 2.897 18.110 6.900 1.00 51.21 H new ATOM 0 HZ2 LYS A 16 1.400 18.436 6.169 1.00 51.21 H new ATOM 0 HZ3 LYS A 16 2.606 19.631 6.202 1.00 51.21 H new ATOM 292 N LYS A 17 -2.093 22.311 6.073 1.00 71.24 N ATOM 293 CA LYS A 17 -1.415 23.101 5.053 1.00 41.23 C ATOM 294 C LYS A 17 -1.587 24.593 5.318 1.00 50.00 C ATOM 295 O LYS A 17 -0.614 25.348 5.332 1.00 52.13 O ATOM 296 CB LYS A 17 -1.958 22.753 3.665 1.00 13.00 C ATOM 297 CG LYS A 17 -0.888 22.713 2.587 1.00 73.15 C ATOM 298 CD LYS A 17 -1.461 23.054 1.221 1.00 22.04 C ATOM 299 CE LYS A 17 -0.424 23.726 0.334 1.00 42.31 C ATOM 300 NZ LYS A 17 0.123 22.791 -0.688 1.00 74.41 N ATOM 0 H LYS A 17 -2.811 21.684 5.711 1.00 71.24 H new ATOM 0 HA LYS A 17 -0.352 22.863 5.091 1.00 41.23 H new ATOM 0 HB2 LYS A 17 -2.453 21.783 3.710 1.00 13.00 H new ATOM 0 HB3 LYS A 17 -2.716 23.485 3.386 1.00 13.00 H new ATOM 0 HG2 LYS A 17 -0.093 23.416 2.835 1.00 73.15 H new ATOM 0 HG3 LYS A 17 -0.438 21.721 2.557 1.00 73.15 H new ATOM 0 HD2 LYS A 17 -1.820 22.145 0.738 1.00 22.04 H new ATOM 0 HD3 LYS A 17 -2.321 23.713 1.340 1.00 22.04 H new ATOM 0 HE2 LYS A 17 -0.874 24.585 -0.164 1.00 42.31 H new ATOM 0 HE3 LYS A 17 0.390 24.106 0.951 1.00 42.31 H new ATOM 0 HZ1 LYS A 17 0.826 23.287 -1.272 1.00 74.41 H new ATOM 0 HZ2 LYS A 17 0.575 21.984 -0.213 1.00 74.41 H new ATOM 0 HZ3 LYS A 17 -0.650 22.448 -1.294 1.00 74.41 H new ATOM 314 N LEU A 18 -2.830 25.013 5.527 1.00 33.10 N ATOM 315 CA LEU A 18 -3.130 26.416 5.794 1.00 64.33 C ATOM 316 C LEU A 18 -2.701 26.806 7.204 1.00 52.31 C ATOM 317 O LEU A 18 -2.325 27.950 7.456 1.00 41.22 O ATOM 318 CB LEU A 18 -4.624 26.682 5.610 1.00 15.40 C ATOM 319 CG LEU A 18 -5.176 26.470 4.200 1.00 1.30 C ATOM 320 CD1 LEU A 18 -6.662 26.148 4.251 1.00 3.02 C ATOM 321 CD2 LEU A 18 -4.924 27.698 3.338 1.00 41.33 C ATOM 0 H LEU A 18 -3.647 24.402 5.517 1.00 33.10 H new ATOM 0 HA LEU A 18 -2.569 27.024 5.084 1.00 64.33 H new ATOM 0 HB2 LEU A 18 -5.174 26.037 6.295 1.00 15.40 H new ATOM 0 HB3 LEU A 18 -4.829 27.710 5.908 1.00 15.40 H new ATOM 0 HG LEU A 18 -4.657 25.623 3.751 1.00 1.30 H new ATOM 0 HD11 LEU A 18 -7.037 26.000 3.238 1.00 3.02 H new ATOM 0 HD12 LEU A 18 -6.818 25.239 4.832 1.00 3.02 H new ATOM 0 HD13 LEU A 18 -7.197 26.974 4.720 1.00 3.02 H new ATOM 0 HD21 LEU A 18 -5.324 27.529 2.338 1.00 41.33 H new ATOM 0 HD22 LEU A 18 -5.416 28.563 3.784 1.00 41.33 H new ATOM 0 HD23 LEU A 18 -3.852 27.884 3.274 1.00 41.33 H new ATOM 333 N ALA A 19 -2.758 25.845 8.121 1.00 3.31 N ATOM 334 CA ALA A 19 -2.372 26.087 9.506 1.00 44.31 C ATOM 335 C ALA A 19 -0.879 26.384 9.616 1.00 41.44 C ATOM 336 O ALA A 19 -0.468 27.269 10.365 1.00 31.30 O ATOM 337 CB ALA A 19 -2.740 24.893 10.373 1.00 63.23 C ATOM 0 H ALA A 19 -3.068 24.892 7.930 1.00 3.31 H new ATOM 0 HA ALA A 19 -2.917 26.961 9.862 1.00 44.31 H new ATOM 0 HB1 ALA A 19 -2.446 25.088 11.404 1.00 63.23 H new ATOM 0 HB2 ALA A 19 -3.817 24.728 10.328 1.00 63.23 H new ATOM 0 HB3 ALA A 19 -2.222 24.006 10.009 1.00 63.23 H new ATOM 343 N GLU A 20 -0.076 25.638 8.865 1.00 62.25 N ATOM 344 CA GLU A 20 1.371 25.821 8.881 1.00 71.23 C ATOM 345 C GLU A 20 1.753 27.185 8.316 1.00 40.41 C ATOM 346 O GLU A 20 2.608 27.879 8.866 1.00 32.41 O ATOM 347 CB GLU A 20 2.056 24.713 8.076 1.00 44.51 C ATOM 348 CG GLU A 20 3.548 24.931 7.891 1.00 34.42 C ATOM 349 CD GLU A 20 3.927 25.183 6.445 1.00 44.14 C ATOM 350 OE1 GLU A 20 4.331 26.322 6.128 1.00 2.10 O ATOM 351 OE2 GLU A 20 3.818 24.244 5.630 1.00 25.44 O ATOM 0 H GLU A 20 -0.402 24.902 8.238 1.00 62.25 H new ATOM 0 HA GLU A 20 1.707 25.769 9.917 1.00 71.23 H new ATOM 0 HB2 GLU A 20 1.896 23.759 8.578 1.00 44.51 H new ATOM 0 HB3 GLU A 20 1.583 24.641 7.096 1.00 44.51 H new ATOM 0 HG2 GLU A 20 3.865 25.778 8.499 1.00 34.42 H new ATOM 0 HG3 GLU A 20 4.087 24.057 8.257 1.00 34.42 H new ATOM 358 N GLU A 21 1.111 27.565 7.215 1.00 13.13 N ATOM 359 CA GLU A 21 1.385 28.846 6.575 1.00 15.50 C ATOM 360 C GLU A 21 0.925 30.004 7.459 1.00 25.00 C ATOM 361 O GLU A 21 1.517 31.082 7.443 1.00 12.44 O ATOM 362 CB GLU A 21 0.690 28.921 5.214 1.00 55.30 C ATOM 363 CG GLU A 21 1.629 29.262 4.070 1.00 0.35 C ATOM 364 CD GLU A 21 1.734 28.147 3.049 1.00 31.43 C ATOM 365 OE1 GLU A 21 1.093 28.256 1.982 1.00 34.34 O ATOM 366 OE2 GLU A 21 2.457 27.164 3.316 1.00 62.11 O ATOM 0 H GLU A 21 0.398 27.004 6.748 1.00 13.13 H new ATOM 0 HA GLU A 21 2.462 28.928 6.429 1.00 15.50 H new ATOM 0 HB2 GLU A 21 0.211 27.964 5.007 1.00 55.30 H new ATOM 0 HB3 GLU A 21 -0.101 29.670 5.260 1.00 55.30 H new ATOM 0 HG2 GLU A 21 1.280 30.169 3.577 1.00 0.35 H new ATOM 0 HG3 GLU A 21 2.620 29.477 4.470 1.00 0.35 H new ATOM 373 N ALA A 22 -0.134 29.771 8.225 1.00 72.20 N ATOM 374 CA ALA A 22 -0.673 30.792 9.115 1.00 52.15 C ATOM 375 C ALA A 22 0.248 31.022 10.308 1.00 23.53 C ATOM 376 O ALA A 22 0.342 32.134 10.827 1.00 52.04 O ATOM 377 CB ALA A 22 -2.065 30.399 9.588 1.00 30.21 C ATOM 0 H ALA A 22 -0.637 28.884 8.248 1.00 72.20 H new ATOM 0 HA ALA A 22 -0.741 31.726 8.557 1.00 52.15 H new ATOM 0 HB1 ALA A 22 -2.455 31.171 10.252 1.00 30.21 H new ATOM 0 HB2 ALA A 22 -2.725 30.293 8.727 1.00 30.21 H new ATOM 0 HB3 ALA A 22 -2.013 29.451 10.124 1.00 30.21 H new ATOM 383 N ALA A 23 0.927 29.964 10.738 1.00 33.24 N ATOM 384 CA ALA A 23 1.843 30.051 11.870 1.00 41.54 C ATOM 385 C ALA A 23 2.887 31.139 11.648 1.00 4.33 C ATOM 386 O ALA A 23 3.360 31.764 12.597 1.00 24.12 O ATOM 387 CB ALA A 23 2.518 28.709 12.107 1.00 71.30 C ATOM 0 H ALA A 23 0.860 29.036 10.320 1.00 33.24 H new ATOM 0 HA ALA A 23 1.264 30.315 12.755 1.00 41.54 H new ATOM 0 HB1 ALA A 23 3.199 28.789 12.955 1.00 71.30 H new ATOM 0 HB2 ALA A 23 1.761 27.954 12.319 1.00 71.30 H new ATOM 0 HB3 ALA A 23 3.078 28.421 11.217 1.00 71.30 H new ATOM 393 N LYS A 24 3.245 31.362 10.387 1.00 54.02 N ATOM 394 CA LYS A 24 4.233 32.375 10.038 1.00 12.42 C ATOM 395 C LYS A 24 3.649 33.777 10.181 1.00 71.23 C ATOM 396 O LYS A 24 4.359 34.726 10.517 1.00 44.23 O ATOM 397 CB LYS A 24 4.730 32.161 8.608 1.00 5.32 C ATOM 398 CG LYS A 24 5.473 30.851 8.411 1.00 71.42 C ATOM 399 CD LYS A 24 5.644 30.522 6.937 1.00 74.12 C ATOM 400 CE LYS A 24 6.861 29.640 6.701 1.00 44.54 C ATOM 401 NZ LYS A 24 7.201 29.543 5.254 1.00 11.45 N ATOM 0 H LYS A 24 2.864 30.853 9.589 1.00 54.02 H new ATOM 0 HA LYS A 24 5.073 32.279 10.726 1.00 12.42 H new ATOM 0 HB2 LYS A 24 3.879 32.192 7.928 1.00 5.32 H new ATOM 0 HB3 LYS A 24 5.387 32.986 8.333 1.00 5.32 H new ATOM 0 HG2 LYS A 24 6.452 30.912 8.887 1.00 71.42 H new ATOM 0 HG3 LYS A 24 4.929 30.045 8.904 1.00 71.42 H new ATOM 0 HD2 LYS A 24 4.751 30.017 6.570 1.00 74.12 H new ATOM 0 HD3 LYS A 24 5.746 31.445 6.366 1.00 74.12 H new ATOM 0 HE2 LYS A 24 7.713 30.042 7.249 1.00 44.54 H new ATOM 0 HE3 LYS A 24 6.670 28.643 7.097 1.00 44.54 H new ATOM 0 HZ1 LYS A 24 8.035 28.934 5.134 1.00 11.45 H new ATOM 0 HZ2 LYS A 24 6.397 29.136 4.735 1.00 11.45 H new ATOM 0 HZ3 LYS A 24 7.408 30.492 4.882 1.00 11.45 H new ATOM 415 N LEU A 25 2.351 33.900 9.926 1.00 42.43 N ATOM 416 CA LEU A 25 1.670 35.187 10.027 1.00 4.04 C ATOM 417 C LEU A 25 1.448 35.572 11.485 1.00 51.42 C ATOM 418 O LEU A 25 1.441 36.754 11.833 1.00 1.10 O ATOM 419 CB LEU A 25 0.331 35.137 9.289 1.00 10.12 C ATOM 420 CG LEU A 25 0.350 35.595 7.830 1.00 54.10 C ATOM 421 CD1 LEU A 25 -0.649 34.796 7.008 1.00 41.44 C ATOM 422 CD2 LEU A 25 0.053 37.084 7.735 1.00 22.23 C ATOM 0 H LEU A 25 1.749 33.125 9.648 1.00 42.43 H new ATOM 0 HA LEU A 25 2.304 35.944 9.564 1.00 4.04 H new ATOM 0 HB2 LEU A 25 -0.041 34.113 9.322 1.00 10.12 H new ATOM 0 HB3 LEU A 25 -0.384 35.754 9.833 1.00 10.12 H new ATOM 0 HG LEU A 25 1.347 35.418 7.425 1.00 54.10 H new ATOM 0 HD11 LEU A 25 -0.622 35.135 5.972 1.00 41.44 H new ATOM 0 HD12 LEU A 25 -0.391 33.738 7.050 1.00 41.44 H new ATOM 0 HD13 LEU A 25 -1.651 34.941 7.411 1.00 41.44 H new ATOM 0 HD21 LEU A 25 0.071 37.393 6.690 1.00 22.23 H new ATOM 0 HD22 LEU A 25 -0.932 37.286 8.156 1.00 22.23 H new ATOM 0 HD23 LEU A 25 0.807 37.642 8.291 1.00 22.23 H new ATOM 434 N LEU A 26 1.267 34.568 12.335 1.00 72.40 N ATOM 435 CA LEU A 26 1.046 34.799 13.758 1.00 13.52 C ATOM 436 C LEU A 26 2.342 35.204 14.453 1.00 3.02 C ATOM 437 O LEU A 26 2.326 35.939 15.439 1.00 14.23 O ATOM 438 CB LEU A 26 0.472 33.544 14.417 1.00 54.31 C ATOM 439 CG LEU A 26 -1.038 33.547 14.666 1.00 22.32 C ATOM 440 CD1 LEU A 26 -1.771 32.894 13.505 1.00 45.40 C ATOM 441 CD2 LEU A 26 -1.363 32.837 15.971 1.00 74.24 C ATOM 0 H LEU A 26 1.269 33.585 12.063 1.00 72.40 H new ATOM 0 HA LEU A 26 0.330 35.615 13.860 1.00 13.52 H new ATOM 0 HB2 LEU A 26 0.715 32.686 13.791 1.00 54.31 H new ATOM 0 HB3 LEU A 26 0.977 33.396 15.371 1.00 54.31 H new ATOM 0 HG LEU A 26 -1.373 34.581 14.745 1.00 22.32 H new ATOM 0 HD11 LEU A 26 -2.843 32.905 13.699 1.00 45.40 H new ATOM 0 HD12 LEU A 26 -1.563 33.444 12.588 1.00 45.40 H new ATOM 0 HD13 LEU A 26 -1.433 31.864 13.395 1.00 45.40 H new ATOM 0 HD21 LEU A 26 -2.441 32.848 16.133 1.00 74.24 H new ATOM 0 HD22 LEU A 26 -1.014 31.805 15.921 1.00 74.24 H new ATOM 0 HD23 LEU A 26 -0.867 33.348 16.796 1.00 74.24 H new ATOM 453 N GLU A 27 3.464 34.721 13.927 1.00 13.44 N ATOM 454 CA GLU A 27 4.770 35.034 14.497 1.00 45.41 C ATOM 455 C GLU A 27 5.375 36.264 13.825 1.00 72.34 C ATOM 456 O GLU A 27 6.175 36.980 14.424 1.00 5.35 O ATOM 457 CB GLU A 27 5.715 33.840 14.347 1.00 51.22 C ATOM 458 CG GLU A 27 6.208 33.628 12.926 1.00 50.33 C ATOM 459 CD GLU A 27 7.061 32.383 12.784 1.00 1.21 C ATOM 460 OE1 GLU A 27 8.276 32.463 13.064 1.00 75.41 O ATOM 461 OE2 GLU A 27 6.516 31.330 12.393 1.00 71.34 O ATOM 0 H GLU A 27 3.495 34.113 13.109 1.00 13.44 H new ATOM 0 HA GLU A 27 4.635 35.250 15.557 1.00 45.41 H new ATOM 0 HB2 GLU A 27 6.574 33.983 15.003 1.00 51.22 H new ATOM 0 HB3 GLU A 27 5.203 32.938 14.683 1.00 51.22 H new ATOM 0 HG2 GLU A 27 5.352 33.556 12.255 1.00 50.33 H new ATOM 0 HG3 GLU A 27 6.786 34.497 12.612 1.00 50.33 H new ATOM 468 N GLY A 28 4.986 36.500 12.576 1.00 25.55 N ATOM 469 CA GLY A 28 5.501 37.642 11.842 1.00 54.11 C ATOM 470 C GLY A 28 6.514 37.246 10.787 1.00 63.40 C ATOM 471 O GLY A 28 6.316 37.499 9.600 1.00 4.23 O ATOM 0 H GLY A 28 4.324 35.921 12.059 1.00 25.55 H new ATOM 0 HA2 GLY A 28 4.673 38.167 11.366 1.00 54.11 H new ATOM 0 HA3 GLY A 28 5.963 38.340 12.540 1.00 54.11 H new ATOM 475 N GLY A 29 7.604 36.621 11.220 1.00 32.42 N ATOM 476 CA GLY A 29 8.638 36.200 10.292 1.00 40.13 C ATOM 477 C GLY A 29 9.943 35.868 10.987 1.00 55.24 C ATOM 478 O GLY A 29 10.602 34.887 10.649 1.00 34.45 O ATOM 0 H GLY A 29 7.790 36.398 12.198 1.00 32.42 H new ATOM 0 HA2 GLY A 29 8.292 35.326 9.740 1.00 40.13 H new ATOM 0 HA3 GLY A 29 8.810 36.991 9.562 1.00 40.13 H new ATOM 482 N GLY A 30 10.317 36.691 11.963 1.00 33.11 N ATOM 483 CA GLY A 30 11.552 36.464 12.691 1.00 30.31 C ATOM 484 C GLY A 30 11.312 35.893 14.074 1.00 35.43 C ATOM 485 O GLY A 30 11.843 36.397 15.063 1.00 13.23 O ATOM 0 H GLY A 30 9.787 37.510 12.262 1.00 33.11 H new ATOM 0 HA2 GLY A 30 12.184 35.781 12.124 1.00 30.31 H new ATOM 0 HA3 GLY A 30 12.097 37.404 12.779 1.00 30.31 H new ATOM 489 N GLY A 31 10.508 34.836 14.146 1.00 21.20 N ATOM 490 CA GLY A 31 10.212 34.214 15.424 1.00 65.24 C ATOM 491 C GLY A 31 11.352 33.349 15.925 1.00 42.41 C ATOM 492 O GLY A 31 12.417 33.298 15.313 1.00 64.52 O ATOM 0 H GLY A 31 10.056 34.399 13.342 1.00 21.20 H new ATOM 0 HA2 GLY A 31 9.997 34.988 16.160 1.00 65.24 H new ATOM 0 HA3 GLY A 31 9.313 33.605 15.329 1.00 65.24 H new ATOM 496 N GLY A 32 11.128 32.669 17.045 1.00 54.00 N ATOM 497 CA GLY A 32 12.153 31.813 17.612 1.00 24.11 C ATOM 498 C GLY A 32 12.261 31.955 19.117 1.00 44.12 C ATOM 499 O GLY A 32 11.960 31.021 19.858 1.00 21.25 O ATOM 0 H GLY A 32 10.254 32.696 17.570 1.00 54.00 H new ATOM 0 HA2 GLY A 32 11.933 30.775 17.363 1.00 24.11 H new ATOM 0 HA3 GLY A 32 13.114 32.053 17.158 1.00 24.11 H new ATOM 503 N GLY A 33 12.693 33.128 19.571 1.00 25.33 N ATOM 504 CA GLY A 33 12.834 33.367 20.995 1.00 24.20 C ATOM 505 C GLY A 33 11.533 33.170 21.747 1.00 53.14 C ATOM 506 O GLY A 33 11.232 32.069 22.206 1.00 22.23 O ATOM 0 H GLY A 33 12.948 33.917 18.977 1.00 25.33 H new ATOM 0 HA2 GLY A 33 13.590 32.694 21.400 1.00 24.20 H new ATOM 0 HA3 GLY A 33 13.193 34.384 21.156 1.00 24.20 H new ATOM 510 N GLY A 34 10.757 34.243 21.875 1.00 72.33 N ATOM 511 CA GLY A 34 9.490 34.162 22.580 1.00 24.12 C ATOM 512 C GLY A 34 8.301 34.243 21.644 1.00 52.04 C ATOM 513 O GLY A 34 7.544 35.213 21.672 1.00 2.44 O ATOM 0 H GLY A 34 10.983 35.166 21.504 1.00 72.33 H new ATOM 0 HA2 GLY A 34 9.447 33.226 23.137 1.00 24.12 H new ATOM 0 HA3 GLY A 34 9.431 34.970 23.309 1.00 24.12 H new ATOM 517 N GLY A 35 8.135 33.221 20.809 1.00 13.22 N ATOM 518 CA GLY A 35 7.028 33.201 19.872 1.00 63.44 C ATOM 519 C GLY A 35 5.984 32.161 20.228 1.00 24.11 C ATOM 520 O GLY A 35 5.890 31.120 19.579 1.00 24.13 O ATOM 0 H GLY A 35 8.748 32.407 20.765 1.00 13.22 H new ATOM 0 HA2 GLY A 35 6.561 34.186 19.846 1.00 63.44 H new ATOM 0 HA3 GLY A 35 7.408 33.001 18.870 1.00 63.44 H new ATOM 524 N GLU A 36 5.199 32.442 21.264 1.00 4.21 N ATOM 525 CA GLU A 36 4.159 31.521 21.706 1.00 22.41 C ATOM 526 C GLU A 36 3.020 31.460 20.693 1.00 31.43 C ATOM 527 O GLU A 36 2.381 30.421 20.522 1.00 41.14 O ATOM 528 CB GLU A 36 3.620 31.945 23.073 1.00 74.04 C ATOM 529 CG GLU A 36 2.394 31.162 23.514 1.00 61.54 C ATOM 530 CD GLU A 36 1.910 31.563 24.893 1.00 62.31 C ATOM 531 OE1 GLU A 36 2.223 30.842 25.864 1.00 71.41 O ATOM 532 OE2 GLU A 36 1.218 32.596 25.003 1.00 64.15 O ATOM 0 H GLU A 36 5.264 33.300 21.812 1.00 4.21 H new ATOM 0 HA GLU A 36 4.600 30.528 21.790 1.00 22.41 H new ATOM 0 HB2 GLU A 36 4.406 31.823 23.818 1.00 74.04 H new ATOM 0 HB3 GLU A 36 3.372 33.006 23.043 1.00 74.04 H new ATOM 0 HG2 GLU A 36 1.591 31.315 22.793 1.00 61.54 H new ATOM 0 HG3 GLU A 36 2.627 30.097 23.510 1.00 61.54 H new ATOM 539 N LEU A 37 2.771 32.581 20.024 1.00 74.43 N ATOM 540 CA LEU A 37 1.708 32.655 19.028 1.00 54.44 C ATOM 541 C LEU A 37 1.872 31.568 17.971 1.00 0.04 C ATOM 542 O LEU A 37 0.891 31.062 17.429 1.00 2.01 O ATOM 543 CB LEU A 37 1.702 34.033 18.363 1.00 71.23 C ATOM 544 CG LEU A 37 1.312 35.210 19.258 1.00 64.01 C ATOM 545 CD1 LEU A 37 1.711 36.527 18.611 1.00 42.44 C ATOM 546 CD2 LEU A 37 -0.181 35.186 19.550 1.00 0.24 C ATOM 0 H LEU A 37 3.290 33.450 20.153 1.00 74.43 H new ATOM 0 HA LEU A 37 0.757 32.498 19.536 1.00 54.44 H new ATOM 0 HB2 LEU A 37 2.696 34.224 17.959 1.00 71.23 H new ATOM 0 HB3 LEU A 37 1.015 34.003 17.517 1.00 71.23 H new ATOM 0 HG LEU A 37 1.847 35.117 20.203 1.00 64.01 H new ATOM 0 HD11 LEU A 37 1.426 37.353 19.262 1.00 42.44 H new ATOM 0 HD12 LEU A 37 2.790 36.544 18.455 1.00 42.44 H new ATOM 0 HD13 LEU A 37 1.204 36.629 17.652 1.00 42.44 H new ATOM 0 HD21 LEU A 37 -0.441 36.031 20.188 1.00 0.24 H new ATOM 0 HD22 LEU A 37 -0.736 35.254 18.614 1.00 0.24 H new ATOM 0 HD23 LEU A 37 -0.438 34.256 20.057 1.00 0.24 H new ATOM 558 N MET A 38 3.122 31.213 17.686 1.00 60.14 N ATOM 559 CA MET A 38 3.415 30.182 16.697 1.00 1.13 C ATOM 560 C MET A 38 3.118 28.794 17.254 1.00 62.15 C ATOM 561 O MET A 38 2.768 27.877 16.510 1.00 44.14 O ATOM 562 CB MET A 38 4.879 30.267 16.260 1.00 53.24 C ATOM 563 CG MET A 38 5.232 29.314 15.129 1.00 41.41 C ATOM 564 SD MET A 38 6.790 28.453 15.408 1.00 35.30 S ATOM 565 CE MET A 38 7.967 29.742 15.009 1.00 41.11 C ATOM 0 H MET A 38 3.946 31.624 18.125 1.00 60.14 H new ATOM 0 HA MET A 38 2.774 30.351 15.832 1.00 1.13 H new ATOM 0 HB2 MET A 38 5.097 31.288 15.946 1.00 53.24 H new ATOM 0 HB3 MET A 38 5.518 30.054 17.117 1.00 53.24 H new ATOM 0 HG2 MET A 38 4.433 28.582 15.013 1.00 41.41 H new ATOM 0 HG3 MET A 38 5.292 29.872 14.194 1.00 41.41 H new ATOM 0 HE1 MET A 38 8.959 29.447 15.349 1.00 41.11 H new ATOM 0 HE2 MET A 38 7.985 29.897 13.930 1.00 41.11 H new ATOM 0 HE3 MET A 38 7.674 30.668 15.504 1.00 41.11 H new ATOM 575 N LYS A 39 3.261 28.644 18.566 1.00 51.13 N ATOM 576 CA LYS A 39 3.007 27.368 19.223 1.00 23.42 C ATOM 577 C LYS A 39 1.509 27.096 19.324 1.00 13.44 C ATOM 578 O LYS A 39 1.069 25.950 19.234 1.00 50.54 O ATOM 579 CB LYS A 39 3.634 27.356 20.619 1.00 15.20 C ATOM 580 CG LYS A 39 3.242 26.149 21.452 1.00 71.23 C ATOM 581 CD LYS A 39 2.376 26.545 22.636 1.00 72.01 C ATOM 582 CE LYS A 39 2.468 25.525 23.761 1.00 71.25 C ATOM 583 NZ LYS A 39 1.946 26.067 25.045 1.00 33.12 N ATOM 0 H LYS A 39 3.552 29.392 19.196 1.00 51.13 H new ATOM 0 HA LYS A 39 3.461 26.581 18.621 1.00 23.42 H new ATOM 0 HB2 LYS A 39 4.719 27.382 20.521 1.00 15.20 H new ATOM 0 HB3 LYS A 39 3.340 28.263 21.148 1.00 15.20 H new ATOM 0 HG2 LYS A 39 2.703 25.435 20.829 1.00 71.23 H new ATOM 0 HG3 LYS A 39 4.140 25.645 21.809 1.00 71.23 H new ATOM 0 HD2 LYS A 39 2.686 27.523 23.004 1.00 72.01 H new ATOM 0 HD3 LYS A 39 1.339 26.640 22.314 1.00 72.01 H new ATOM 0 HE2 LYS A 39 1.906 24.632 23.488 1.00 71.25 H new ATOM 0 HE3 LYS A 39 3.506 25.220 23.891 1.00 71.25 H new ATOM 0 HZ1 LYS A 39 2.026 25.342 25.786 1.00 33.12 H new ATOM 0 HZ2 LYS A 39 2.499 26.904 25.319 1.00 33.12 H new ATOM 0 HZ3 LYS A 39 0.948 26.334 24.929 1.00 33.12 H new ATOM 597 N LEU A 40 0.732 28.157 19.512 1.00 32.22 N ATOM 598 CA LEU A 40 -0.718 28.034 19.625 1.00 21.32 C ATOM 599 C LEU A 40 -1.318 27.478 18.337 1.00 33.11 C ATOM 600 O LEU A 40 -2.189 26.609 18.371 1.00 73.41 O ATOM 601 CB LEU A 40 -1.341 29.392 19.947 1.00 53.12 C ATOM 602 CG LEU A 40 -2.000 29.519 21.321 1.00 11.52 C ATOM 603 CD1 LEU A 40 -1.566 30.807 22.004 1.00 40.53 C ATOM 604 CD2 LEU A 40 -3.515 29.466 21.193 1.00 73.52 C ATOM 0 H LEU A 40 1.081 29.112 19.589 1.00 32.22 H new ATOM 0 HA LEU A 40 -0.938 27.340 20.436 1.00 21.32 H new ATOM 0 HB2 LEU A 40 -0.565 30.153 19.866 1.00 53.12 H new ATOM 0 HB3 LEU A 40 -2.088 29.616 19.186 1.00 53.12 H new ATOM 0 HG LEU A 40 -1.678 28.679 21.936 1.00 11.52 H new ATOM 0 HD11 LEU A 40 -2.045 30.880 22.980 1.00 40.53 H new ATOM 0 HD12 LEU A 40 -0.483 30.805 22.130 1.00 40.53 H new ATOM 0 HD13 LEU A 40 -1.858 31.660 21.392 1.00 40.53 H new ATOM 0 HD21 LEU A 40 -3.967 29.558 22.181 1.00 73.52 H new ATOM 0 HD22 LEU A 40 -3.856 30.286 20.560 1.00 73.52 H new ATOM 0 HD23 LEU A 40 -3.809 28.516 20.746 1.00 73.52 H new ATOM 616 N CYS A 41 -0.845 27.985 17.204 1.00 73.14 N ATOM 617 CA CYS A 41 -1.335 27.538 15.904 1.00 64.50 C ATOM 618 C CYS A 41 -0.918 26.096 15.633 1.00 62.33 C ATOM 619 O CYS A 41 -1.732 25.273 15.214 1.00 51.41 O ATOM 620 CB CYS A 41 -0.807 28.450 14.796 1.00 3.31 C ATOM 621 SG CYS A 41 -2.098 29.330 13.887 1.00 52.12 S ATOM 0 H CYS A 41 -0.124 28.705 17.159 1.00 73.14 H new ATOM 0 HA CYS A 41 -2.424 27.587 15.917 1.00 64.50 H new ATOM 0 HB2 CYS A 41 -0.125 29.179 15.234 1.00 3.31 H new ATOM 0 HB3 CYS A 41 -0.226 27.852 14.094 1.00 3.31 H new ATOM 0 HG CYS A 41 -2.858 28.472 13.273 1.00 52.12 H new ATOM 627 N GLU A 42 0.355 25.797 15.873 1.00 75.32 N ATOM 628 CA GLU A 42 0.879 24.454 15.653 1.00 64.23 C ATOM 629 C GLU A 42 0.110 23.427 16.480 1.00 44.14 C ATOM 630 O GLU A 42 -0.041 22.276 16.072 1.00 53.31 O ATOM 631 CB GLU A 42 2.367 24.399 16.005 1.00 52.12 C ATOM 632 CG GLU A 42 3.043 23.104 15.589 1.00 71.44 C ATOM 633 CD GLU A 42 4.416 23.329 14.986 1.00 74.44 C ATOM 634 OE1 GLU A 42 4.572 23.106 13.768 1.00 40.25 O ATOM 635 OE2 GLU A 42 5.333 23.727 15.733 1.00 23.45 O ATOM 0 H GLU A 42 1.042 26.466 16.220 1.00 75.32 H new ATOM 0 HA GLU A 42 0.754 24.211 14.598 1.00 64.23 H new ATOM 0 HB2 GLU A 42 2.876 25.235 15.526 1.00 52.12 H new ATOM 0 HB3 GLU A 42 2.482 24.530 17.081 1.00 52.12 H new ATOM 0 HG2 GLU A 42 3.134 22.451 16.457 1.00 71.44 H new ATOM 0 HG3 GLU A 42 2.413 22.586 14.866 1.00 71.44 H new ATOM 642 N GLU A 43 -0.372 23.854 17.642 1.00 15.21 N ATOM 643 CA GLU A 43 -1.123 22.971 18.527 1.00 52.34 C ATOM 644 C GLU A 43 -2.346 22.400 17.815 1.00 51.23 C ATOM 645 O GLU A 43 -2.693 21.233 17.994 1.00 13.10 O ATOM 646 CB GLU A 43 -1.558 23.724 19.786 1.00 34.14 C ATOM 647 CG GLU A 43 -2.109 22.820 20.876 1.00 61.33 C ATOM 648 CD GLU A 43 -1.118 22.590 22.000 1.00 22.13 C ATOM 649 OE1 GLU A 43 -1.025 21.442 22.483 1.00 43.24 O ATOM 650 OE2 GLU A 43 -0.436 23.557 22.397 1.00 2.23 O ATOM 0 H GLU A 43 -0.256 24.805 17.993 1.00 15.21 H new ATOM 0 HA GLU A 43 -0.471 22.145 18.813 1.00 52.34 H new ATOM 0 HB2 GLU A 43 -0.706 24.277 20.181 1.00 34.14 H new ATOM 0 HB3 GLU A 43 -2.317 24.458 19.516 1.00 34.14 H new ATOM 0 HG2 GLU A 43 -3.019 23.261 21.283 1.00 61.33 H new ATOM 0 HG3 GLU A 43 -2.388 21.860 20.440 1.00 61.33 H new ATOM 657 N ALA A 44 -2.996 23.232 17.008 1.00 62.14 N ATOM 658 CA ALA A 44 -4.179 22.810 16.268 1.00 45.14 C ATOM 659 C ALA A 44 -3.838 21.708 15.270 1.00 40.21 C ATOM 660 O ALA A 44 -4.541 20.701 15.180 1.00 63.22 O ATOM 661 CB ALA A 44 -4.804 23.999 15.551 1.00 73.42 C ATOM 0 H ALA A 44 -2.723 24.202 16.850 1.00 62.14 H new ATOM 0 HA ALA A 44 -4.900 22.409 16.981 1.00 45.14 H new ATOM 0 HB1 ALA A 44 -5.686 23.670 15.002 1.00 73.42 H new ATOM 0 HB2 ALA A 44 -5.092 24.754 16.282 1.00 73.42 H new ATOM 0 HB3 ALA A 44 -4.082 24.425 14.855 1.00 73.42 H new ATOM 667 N ALA A 45 -2.758 21.905 14.523 1.00 4.22 N ATOM 668 CA ALA A 45 -2.324 20.927 13.533 1.00 25.11 C ATOM 669 C ALA A 45 -1.830 19.650 14.204 1.00 43.10 C ATOM 670 O ALA A 45 -1.918 18.563 13.633 1.00 53.03 O ATOM 671 CB ALA A 45 -1.235 21.518 12.649 1.00 35.25 C ATOM 0 H ALA A 45 -2.167 22.734 14.584 1.00 4.22 H new ATOM 0 HA ALA A 45 -3.181 20.671 12.911 1.00 25.11 H new ATOM 0 HB1 ALA A 45 -0.920 20.777 11.914 1.00 35.25 H new ATOM 0 HB2 ALA A 45 -1.622 22.398 12.134 1.00 35.25 H new ATOM 0 HB3 ALA A 45 -0.382 21.804 13.264 1.00 35.25 H new ATOM 677 N LYS A 46 -1.309 19.788 15.418 1.00 62.14 N ATOM 678 CA LYS A 46 -0.801 18.645 16.168 1.00 44.21 C ATOM 679 C LYS A 46 -1.929 17.680 16.518 1.00 24.25 C ATOM 680 O LYS A 46 -1.725 16.467 16.576 1.00 72.13 O ATOM 681 CB LYS A 46 -0.103 19.117 17.445 1.00 31.44 C ATOM 682 CG LYS A 46 0.977 18.168 17.934 1.00 71.01 C ATOM 683 CD LYS A 46 1.894 18.839 18.944 1.00 63.44 C ATOM 684 CE LYS A 46 3.326 18.908 18.435 1.00 32.33 C ATOM 685 NZ LYS A 46 4.086 17.666 18.747 1.00 42.14 N ATOM 0 H LYS A 46 -1.227 20.681 15.904 1.00 62.14 H new ATOM 0 HA LYS A 46 -0.080 18.121 15.541 1.00 44.21 H new ATOM 0 HB2 LYS A 46 0.340 20.097 17.266 1.00 31.44 H new ATOM 0 HB3 LYS A 46 -0.848 19.243 18.231 1.00 31.44 H new ATOM 0 HG2 LYS A 46 0.514 17.291 18.388 1.00 71.01 H new ATOM 0 HG3 LYS A 46 1.564 17.816 17.086 1.00 71.01 H new ATOM 0 HD2 LYS A 46 1.532 19.846 19.154 1.00 63.44 H new ATOM 0 HD3 LYS A 46 1.867 18.288 19.884 1.00 63.44 H new ATOM 0 HE2 LYS A 46 3.321 19.069 17.357 1.00 32.33 H new ATOM 0 HE3 LYS A 46 3.830 19.764 18.883 1.00 32.33 H new ATOM 0 HZ1 LYS A 46 5.057 17.753 18.384 1.00 42.14 H new ATOM 0 HZ2 LYS A 46 4.113 17.525 19.777 1.00 42.14 H new ATOM 0 HZ3 LYS A 46 3.620 16.852 18.298 1.00 42.14 H new ATOM 699 N LYS A 47 -3.117 18.226 16.751 1.00 62.50 N ATOM 700 CA LYS A 47 -4.278 17.413 17.093 1.00 54.00 C ATOM 701 C LYS A 47 -4.629 16.458 15.957 1.00 23.45 C ATOM 702 O LYS A 47 -5.024 15.317 16.192 1.00 61.24 O ATOM 703 CB LYS A 47 -5.478 18.310 17.409 1.00 63.43 C ATOM 704 CG LYS A 47 -6.044 18.100 18.803 1.00 31.23 C ATOM 705 CD LYS A 47 -5.158 18.731 19.864 1.00 40.43 C ATOM 706 CE LYS A 47 -4.754 17.720 20.926 1.00 41.52 C ATOM 707 NZ LYS A 47 -5.838 17.499 21.923 1.00 70.00 N ATOM 0 H LYS A 47 -3.302 19.228 16.709 1.00 62.50 H new ATOM 0 HA LYS A 47 -4.030 16.823 17.975 1.00 54.00 H new ATOM 0 HB2 LYS A 47 -5.180 19.353 17.300 1.00 63.43 H new ATOM 0 HB3 LYS A 47 -6.263 18.125 16.676 1.00 63.43 H new ATOM 0 HG2 LYS A 47 -7.044 18.530 18.860 1.00 31.23 H new ATOM 0 HG3 LYS A 47 -6.145 17.033 18.999 1.00 31.23 H new ATOM 0 HD2 LYS A 47 -4.265 19.144 19.395 1.00 40.43 H new ATOM 0 HD3 LYS A 47 -5.685 19.562 20.333 1.00 40.43 H new ATOM 0 HE2 LYS A 47 -4.501 16.773 20.449 1.00 41.52 H new ATOM 0 HE3 LYS A 47 -3.857 18.069 21.437 1.00 41.52 H new ATOM 0 HZ1 LYS A 47 -5.523 16.804 22.629 1.00 70.00 H new ATOM 0 HZ2 LYS A 47 -6.062 18.397 22.397 1.00 70.00 H new ATOM 0 HZ3 LYS A 47 -6.687 17.142 21.440 1.00 70.00 H new ATOM 721 N ALA A 48 -4.480 16.933 14.724 1.00 34.25 N ATOM 722 CA ALA A 48 -4.776 16.119 13.551 1.00 54.14 C ATOM 723 C ALA A 48 -3.876 14.890 13.493 1.00 52.11 C ATOM 724 O ALA A 48 -4.261 13.853 12.954 1.00 10.14 O ATOM 725 CB ALA A 48 -4.626 16.947 12.284 1.00 43.10 C ATOM 0 H ALA A 48 -4.156 17.877 14.512 1.00 34.25 H new ATOM 0 HA ALA A 48 -5.808 15.776 13.628 1.00 54.14 H new ATOM 0 HB1 ALA A 48 -4.850 16.327 11.416 1.00 43.10 H new ATOM 0 HB2 ALA A 48 -5.317 17.790 12.316 1.00 43.10 H new ATOM 0 HB3 ALA A 48 -3.604 17.318 12.211 1.00 43.10 H new ATOM 731 N GLU A 49 -2.675 15.015 14.051 1.00 70.13 N ATOM 732 CA GLU A 49 -1.721 13.913 14.060 1.00 3.33 C ATOM 733 C GLU A 49 -2.122 12.853 15.081 1.00 55.44 C ATOM 734 O GLU A 49 -1.891 11.661 14.877 1.00 14.21 O ATOM 735 CB GLU A 49 -0.315 14.430 14.372 1.00 61.21 C ATOM 736 CG GLU A 49 0.589 14.511 13.153 1.00 31.01 C ATOM 737 CD GLU A 49 1.969 15.042 13.484 1.00 3.14 C ATOM 738 OE1 GLU A 49 2.926 14.705 12.755 1.00 52.15 O ATOM 739 OE2 GLU A 49 2.095 15.795 14.472 1.00 2.24 O ATOM 0 H GLU A 49 -2.341 15.867 14.502 1.00 70.13 H new ATOM 0 HA GLU A 49 -1.723 13.457 13.070 1.00 3.33 H new ATOM 0 HB2 GLU A 49 -0.393 15.420 14.822 1.00 61.21 H new ATOM 0 HB3 GLU A 49 0.147 13.778 15.113 1.00 61.21 H new ATOM 0 HG2 GLU A 49 0.682 13.520 12.708 1.00 31.01 H new ATOM 0 HG3 GLU A 49 0.126 15.154 12.404 1.00 31.01 H new ATOM 746 N GLU A 50 -2.725 13.297 16.180 1.00 34.31 N ATOM 747 CA GLU A 50 -3.157 12.386 17.234 1.00 60.24 C ATOM 748 C GLU A 50 -4.405 11.616 16.809 1.00 1.43 C ATOM 749 O GLU A 50 -4.608 10.469 17.211 1.00 41.01 O ATOM 750 CB GLU A 50 -3.436 13.159 18.524 1.00 42.32 C ATOM 751 CG GLU A 50 -3.444 12.286 19.768 1.00 23.31 C ATOM 752 CD GLU A 50 -3.590 13.090 21.045 1.00 4.32 C ATOM 753 OE1 GLU A 50 -3.353 14.316 21.004 1.00 41.21 O ATOM 754 OE2 GLU A 50 -3.941 12.495 22.084 1.00 40.21 O ATOM 0 H GLU A 50 -2.925 14.280 16.363 1.00 34.31 H new ATOM 0 HA GLU A 50 -2.354 11.672 17.414 1.00 60.24 H new ATOM 0 HB2 GLU A 50 -2.682 13.937 18.641 1.00 42.32 H new ATOM 0 HB3 GLU A 50 -4.400 13.660 18.436 1.00 42.32 H new ATOM 0 HG2 GLU A 50 -4.262 11.569 19.699 1.00 23.31 H new ATOM 0 HG3 GLU A 50 -2.519 11.711 19.809 1.00 23.31 H new ATOM 761 N LEU A 51 -5.239 12.256 15.996 1.00 72.44 N ATOM 762 CA LEU A 51 -6.468 11.632 15.517 1.00 45.05 C ATOM 763 C LEU A 51 -6.167 10.586 14.449 1.00 65.03 C ATOM 764 O LEU A 51 -6.843 9.561 14.361 1.00 32.20 O ATOM 765 CB LEU A 51 -7.415 12.694 14.954 1.00 34.22 C ATOM 766 CG LEU A 51 -8.696 12.942 15.753 1.00 22.32 C ATOM 767 CD1 LEU A 51 -9.562 11.693 15.774 1.00 63.33 C ATOM 768 CD2 LEU A 51 -8.362 13.385 17.170 1.00 74.34 C ATOM 0 H LEU A 51 -5.087 13.205 15.655 1.00 72.44 H new ATOM 0 HA LEU A 51 -6.948 11.135 16.360 1.00 45.05 H new ATOM 0 HB2 LEU A 51 -6.870 13.635 14.878 1.00 34.22 H new ATOM 0 HB3 LEU A 51 -7.693 12.404 13.941 1.00 34.22 H new ATOM 0 HG LEU A 51 -9.257 13.740 15.266 1.00 22.32 H new ATOM 0 HD11 LEU A 51 -10.469 11.888 16.347 1.00 63.33 H new ATOM 0 HD12 LEU A 51 -9.830 11.419 14.754 1.00 63.33 H new ATOM 0 HD13 LEU A 51 -9.010 10.875 16.237 1.00 63.33 H new ATOM 0 HD21 LEU A 51 -9.285 13.557 17.724 1.00 74.34 H new ATOM 0 HD22 LEU A 51 -7.780 12.609 17.666 1.00 74.34 H new ATOM 0 HD23 LEU A 51 -7.782 14.307 17.136 1.00 74.34 H new ATOM 780 N PHE A 52 -5.147 10.850 13.639 1.00 4.31 N ATOM 781 CA PHE A 52 -4.756 9.931 12.577 1.00 4.41 C ATOM 782 C PHE A 52 -4.468 8.542 13.138 1.00 15.43 C ATOM 783 O PHE A 52 -4.713 7.531 12.482 1.00 73.35 O ATOM 784 CB PHE A 52 -3.523 10.462 11.843 1.00 43.43 C ATOM 785 CG PHE A 52 -3.773 10.762 10.392 1.00 61.40 C ATOM 786 CD1 PHE A 52 -3.891 9.735 9.469 1.00 51.32 C ATOM 787 CD2 PHE A 52 -3.888 12.071 9.951 1.00 10.13 C ATOM 788 CE1 PHE A 52 -4.122 10.008 8.133 1.00 3.35 C ATOM 789 CE2 PHE A 52 -4.118 12.349 8.617 1.00 73.11 C ATOM 790 CZ PHE A 52 -4.234 11.317 7.707 1.00 4.11 C ATOM 0 H PHE A 52 -4.576 11.693 13.698 1.00 4.31 H new ATOM 0 HA PHE A 52 -5.585 9.855 11.873 1.00 4.41 H new ATOM 0 HB2 PHE A 52 -3.177 11.369 12.339 1.00 43.43 H new ATOM 0 HB3 PHE A 52 -2.720 9.729 11.921 1.00 43.43 H new ATOM 0 HD1 PHE A 52 -3.802 8.710 9.797 1.00 51.32 H new ATOM 0 HD2 PHE A 52 -3.797 12.883 10.658 1.00 10.13 H new ATOM 0 HE1 PHE A 52 -4.215 9.199 7.424 1.00 3.35 H new ATOM 0 HE2 PHE A 52 -4.207 13.373 8.286 1.00 73.11 H new ATOM 0 HZ PHE A 52 -4.412 11.533 6.664 1.00 4.11 H new ATOM 800 N LYS A 53 -3.944 8.502 14.359 1.00 74.32 N ATOM 801 CA LYS A 53 -3.622 7.238 15.013 1.00 50.20 C ATOM 802 C LYS A 53 -4.870 6.376 15.174 1.00 32.43 C ATOM 803 O LYS A 53 -4.848 5.176 14.895 1.00 64.22 O ATOM 804 CB LYS A 53 -2.987 7.495 16.381 1.00 13.21 C ATOM 805 CG LYS A 53 -1.779 6.619 16.665 1.00 71.44 C ATOM 806 CD LYS A 53 -0.530 7.451 16.899 1.00 4.24 C ATOM 807 CE LYS A 53 0.699 6.572 17.080 1.00 51.22 C ATOM 808 NZ LYS A 53 1.131 5.952 15.797 1.00 10.15 N ATOM 0 H LYS A 53 -3.733 9.330 14.916 1.00 74.32 H new ATOM 0 HA LYS A 53 -2.911 6.703 14.384 1.00 50.20 H new ATOM 0 HB2 LYS A 53 -2.689 8.542 16.443 1.00 13.21 H new ATOM 0 HB3 LYS A 53 -3.735 7.330 17.156 1.00 13.21 H new ATOM 0 HG2 LYS A 53 -1.975 6.001 17.541 1.00 71.44 H new ATOM 0 HG3 LYS A 53 -1.614 5.942 15.827 1.00 71.44 H new ATOM 0 HD2 LYS A 53 -0.376 8.124 16.055 1.00 4.24 H new ATOM 0 HD3 LYS A 53 -0.667 8.074 17.783 1.00 4.24 H new ATOM 0 HE2 LYS A 53 1.515 7.168 17.488 1.00 51.22 H new ATOM 0 HE3 LYS A 53 0.482 5.789 17.807 1.00 51.22 H new ATOM 0 HZ1 LYS A 53 2.036 5.458 15.937 1.00 10.15 H new ATOM 0 HZ2 LYS A 53 0.411 5.272 15.480 1.00 10.15 H new ATOM 0 HZ3 LYS A 53 1.249 6.692 15.076 1.00 10.15 H new ATOM 822 N LEU A 54 -5.957 6.993 15.625 1.00 3.12 N ATOM 823 CA LEU A 54 -7.215 6.282 15.822 1.00 64.22 C ATOM 824 C LEU A 54 -7.896 6.000 14.485 1.00 34.43 C ATOM 825 O LEU A 54 -8.331 4.879 14.224 1.00 43.01 O ATOM 826 CB LEU A 54 -8.148 7.094 16.720 1.00 35.14 C ATOM 827 CG LEU A 54 -8.568 6.426 18.030 1.00 41.03 C ATOM 828 CD1 LEU A 54 -7.406 6.393 19.010 1.00 73.12 C ATOM 829 CD2 LEU A 54 -9.762 7.148 18.638 1.00 33.12 C ATOM 0 H LEU A 54 -5.992 7.985 15.861 1.00 3.12 H new ATOM 0 HA LEU A 54 -6.994 5.330 16.305 1.00 64.22 H new ATOM 0 HB2 LEU A 54 -7.659 8.039 16.958 1.00 35.14 H new ATOM 0 HB3 LEU A 54 -9.047 7.334 16.153 1.00 35.14 H new ATOM 0 HG LEU A 54 -8.862 5.399 17.814 1.00 41.03 H new ATOM 0 HD11 LEU A 54 -7.724 5.914 19.936 1.00 73.12 H new ATOM 0 HD12 LEU A 54 -6.580 5.830 18.576 1.00 73.12 H new ATOM 0 HD13 LEU A 54 -7.080 7.411 19.222 1.00 73.12 H new ATOM 0 HD21 LEU A 54 -10.047 6.659 19.569 1.00 33.12 H new ATOM 0 HD22 LEU A 54 -9.496 8.186 18.840 1.00 33.12 H new ATOM 0 HD23 LEU A 54 -10.599 7.117 17.941 1.00 33.12 H new ATOM 841 N ALA A 55 -7.981 7.024 13.643 1.00 34.20 N ATOM 842 CA ALA A 55 -8.605 6.885 12.333 1.00 63.11 C ATOM 843 C ALA A 55 -7.926 5.792 11.515 1.00 75.51 C ATOM 844 O ALA A 55 -8.535 5.204 10.622 1.00 45.33 O ATOM 845 CB ALA A 55 -8.562 8.209 11.585 1.00 12.41 C ATOM 0 H ALA A 55 -7.626 7.959 13.844 1.00 34.20 H new ATOM 0 HA ALA A 55 -9.646 6.598 12.482 1.00 63.11 H new ATOM 0 HB1 ALA A 55 -9.031 8.091 10.608 1.00 12.41 H new ATOM 0 HB2 ALA A 55 -9.098 8.967 12.156 1.00 12.41 H new ATOM 0 HB3 ALA A 55 -7.525 8.519 11.454 1.00 12.41 H new ATOM 851 N GLU A 56 -6.662 5.524 11.827 1.00 4.53 N ATOM 852 CA GLU A 56 -5.901 4.502 11.118 1.00 33.41 C ATOM 853 C GLU A 56 -6.614 3.154 11.179 1.00 72.30 C ATOM 854 O GLU A 56 -6.836 2.511 10.153 1.00 12.42 O ATOM 855 CB GLU A 56 -4.496 4.376 11.713 1.00 53.02 C ATOM 856 CG GLU A 56 -3.546 3.554 10.859 1.00 2.12 C ATOM 857 CD GLU A 56 -3.261 2.188 11.452 1.00 14.24 C ATOM 858 OE1 GLU A 56 -4.173 1.615 12.084 1.00 21.34 O ATOM 859 OE2 GLU A 56 -2.127 1.693 11.286 1.00 63.21 O ATOM 0 H GLU A 56 -6.144 6.000 12.565 1.00 4.53 H new ATOM 0 HA GLU A 56 -5.820 4.804 10.074 1.00 33.41 H new ATOM 0 HB2 GLU A 56 -4.078 5.373 11.850 1.00 53.02 H new ATOM 0 HB3 GLU A 56 -4.568 3.922 12.701 1.00 53.02 H new ATOM 0 HG2 GLU A 56 -3.972 3.432 9.863 1.00 2.12 H new ATOM 0 HG3 GLU A 56 -2.608 4.097 10.740 1.00 2.12 H new ATOM 866 N GLU A 57 -6.967 2.732 12.389 1.00 41.21 N ATOM 867 CA GLU A 57 -7.653 1.460 12.583 1.00 71.05 C ATOM 868 C GLU A 57 -9.107 1.550 12.126 1.00 23.41 C ATOM 869 O GLU A 57 -9.710 0.548 11.742 1.00 42.04 O ATOM 870 CB GLU A 57 -7.595 1.043 14.055 1.00 1.40 C ATOM 871 CG GLU A 57 -6.989 -0.332 14.274 1.00 22.41 C ATOM 872 CD GLU A 57 -6.368 -0.483 15.650 1.00 22.33 C ATOM 873 OE1 GLU A 57 -6.651 -1.499 16.319 1.00 25.34 O ATOM 874 OE2 GLU A 57 -5.601 0.414 16.057 1.00 70.30 O ATOM 0 H GLU A 57 -6.790 3.252 13.249 1.00 41.21 H new ATOM 0 HA GLU A 57 -7.146 0.708 11.979 1.00 71.05 H new ATOM 0 HB2 GLU A 57 -7.014 1.780 14.610 1.00 1.40 H new ATOM 0 HB3 GLU A 57 -8.604 1.056 14.468 1.00 1.40 H new ATOM 0 HG2 GLU A 57 -7.761 -1.090 14.142 1.00 22.41 H new ATOM 0 HG3 GLU A 57 -6.229 -0.515 13.514 1.00 22.41 H new ATOM 881 N ARG A 58 -9.661 2.756 12.171 1.00 22.23 N ATOM 882 CA ARG A 58 -11.043 2.977 11.763 1.00 53.31 C ATOM 883 C ARG A 58 -11.209 2.755 10.262 1.00 74.34 C ATOM 884 O ARG A 58 -12.258 2.299 9.804 1.00 32.51 O ATOM 885 CB ARG A 58 -11.486 4.395 12.131 1.00 22.43 C ATOM 886 CG ARG A 58 -11.462 4.671 13.626 1.00 43.15 C ATOM 887 CD ARG A 58 -12.646 4.027 14.329 1.00 32.23 C ATOM 888 NE ARG A 58 -12.646 4.302 15.764 1.00 22.31 N ATOM 889 CZ ARG A 58 -13.337 3.592 16.648 1.00 1.01 C ATOM 890 NH1 ARG A 58 -14.080 2.569 16.248 1.00 40.11 N ATOM 891 NH2 ARG A 58 -13.286 3.904 17.937 1.00 21.13 N ATOM 0 H ARG A 58 -9.175 3.595 12.486 1.00 22.23 H new ATOM 0 HA ARG A 58 -11.670 2.259 12.291 1.00 53.31 H new ATOM 0 HB2 ARG A 58 -10.837 5.112 11.627 1.00 22.43 H new ATOM 0 HB3 ARG A 58 -12.496 4.560 11.756 1.00 22.43 H new ATOM 0 HG2 ARG A 58 -10.533 4.291 14.053 1.00 43.15 H new ATOM 0 HG3 ARG A 58 -11.476 5.747 13.799 1.00 43.15 H new ATOM 0 HD2 ARG A 58 -13.573 4.395 13.889 1.00 32.23 H new ATOM 0 HD3 ARG A 58 -12.622 2.949 14.166 1.00 32.23 H new ATOM 0 HE ARG A 58 -12.084 5.082 16.105 1.00 22.31 H new ATOM 0 HH11 ARG A 58 -14.122 2.325 15.258 1.00 40.11 H new ATOM 0 HH12 ARG A 58 -14.609 2.026 16.930 1.00 40.11 H new ATOM 0 HH21 ARG A 58 -12.716 4.690 18.249 1.00 21.13 H new ATOM 0 HH22 ARG A 58 -13.817 3.358 18.615 1.00 21.13 H new ATOM 905 N LEU A 59 -10.170 3.079 9.502 1.00 35.14 N ATOM 906 CA LEU A 59 -10.200 2.915 8.053 1.00 21.24 C ATOM 907 C LEU A 59 -9.490 1.631 7.636 1.00 44.12 C ATOM 908 O LEU A 59 -9.784 1.059 6.586 1.00 52.34 O ATOM 909 CB LEU A 59 -9.547 4.118 7.371 1.00 61.00 C ATOM 910 CG LEU A 59 -10.487 5.257 6.972 1.00 70.50 C ATOM 911 CD1 LEU A 59 -11.287 5.734 8.174 1.00 34.52 C ATOM 912 CD2 LEU A 59 -9.702 6.408 6.360 1.00 75.33 C ATOM 0 H LEU A 59 -9.295 3.457 9.865 1.00 35.14 H new ATOM 0 HA LEU A 59 -11.242 2.850 7.740 1.00 21.24 H new ATOM 0 HB2 LEU A 59 -8.785 4.520 8.039 1.00 61.00 H new ATOM 0 HB3 LEU A 59 -9.033 3.768 6.476 1.00 61.00 H new ATOM 0 HG LEU A 59 -11.184 4.881 6.223 1.00 70.50 H new ATOM 0 HD11 LEU A 59 -11.950 6.544 7.871 1.00 34.52 H new ATOM 0 HD12 LEU A 59 -11.879 4.908 8.568 1.00 34.52 H new ATOM 0 HD13 LEU A 59 -10.606 6.092 8.946 1.00 34.52 H new ATOM 0 HD21 LEU A 59 -10.387 7.209 6.082 1.00 75.33 H new ATOM 0 HD22 LEU A 59 -8.981 6.783 7.086 1.00 75.33 H new ATOM 0 HD23 LEU A 59 -9.175 6.058 5.473 1.00 75.33 H new ATOM 924 N LYS A 60 -8.554 1.182 8.465 1.00 11.31 N ATOM 925 CA LYS A 60 -7.803 -0.036 8.185 1.00 44.02 C ATOM 926 C LYS A 60 -8.369 -1.216 8.968 1.00 12.11 C ATOM 927 O LYS A 60 -8.055 -1.401 10.144 1.00 73.54 O ATOM 928 CB LYS A 60 -6.325 0.160 8.533 1.00 74.45 C ATOM 929 CG LYS A 60 -5.395 -0.776 7.781 1.00 22.02 C ATOM 930 CD LYS A 60 -3.966 -0.261 7.784 1.00 21.11 C ATOM 931 CE LYS A 60 -3.032 -1.206 7.042 1.00 2.13 C ATOM 932 NZ LYS A 60 -1.605 -0.802 7.186 1.00 54.10 N ATOM 0 H LYS A 60 -8.297 1.644 9.337 1.00 11.31 H new ATOM 0 HA LYS A 60 -7.893 -0.252 7.121 1.00 44.02 H new ATOM 0 HB2 LYS A 60 -6.043 1.190 8.317 1.00 74.45 H new ATOM 0 HB3 LYS A 60 -6.189 0.010 9.604 1.00 74.45 H new ATOM 0 HG2 LYS A 60 -5.427 -1.766 8.236 1.00 22.02 H new ATOM 0 HG3 LYS A 60 -5.741 -0.886 6.753 1.00 22.02 H new ATOM 0 HD2 LYS A 60 -3.932 0.725 7.320 1.00 21.11 H new ATOM 0 HD3 LYS A 60 -3.623 -0.141 8.812 1.00 21.11 H new ATOM 0 HE2 LYS A 60 -3.163 -2.219 7.423 1.00 2.13 H new ATOM 0 HE3 LYS A 60 -3.299 -1.225 5.985 1.00 2.13 H new ATOM 0 HZ1 LYS A 60 -1.001 -1.470 6.667 1.00 54.10 H new ATOM 0 HZ2 LYS A 60 -1.474 0.155 6.800 1.00 54.10 H new ATOM 0 HZ3 LYS A 60 -1.342 -0.808 8.192 1.00 54.10 H new ATOM 946 N LYS A 61 -9.205 -2.011 8.310 1.00 25.45 N ATOM 947 CA LYS A 61 -9.813 -3.175 8.943 1.00 72.33 C ATOM 948 C LYS A 61 -8.757 -4.221 9.288 1.00 35.25 C ATOM 949 O LYS A 61 -7.978 -4.639 8.430 1.00 62.02 O ATOM 950 CB LYS A 61 -10.870 -3.789 8.021 1.00 13.31 C ATOM 951 CG LYS A 61 -11.709 -4.864 8.690 1.00 73.12 C ATOM 952 CD LYS A 61 -12.757 -5.423 7.743 1.00 63.05 C ATOM 953 CE LYS A 61 -13.396 -6.686 8.300 1.00 63.31 C ATOM 954 NZ LYS A 61 -12.492 -7.864 8.181 1.00 54.12 N ATOM 0 H LYS A 61 -9.477 -1.870 7.337 1.00 25.45 H new ATOM 0 HA LYS A 61 -10.290 -2.847 9.866 1.00 72.33 H new ATOM 0 HB2 LYS A 61 -11.528 -2.999 7.659 1.00 13.31 H new ATOM 0 HB3 LYS A 61 -10.375 -4.216 7.149 1.00 13.31 H new ATOM 0 HG2 LYS A 61 -11.061 -5.670 9.034 1.00 73.12 H new ATOM 0 HG3 LYS A 61 -12.198 -4.449 9.571 1.00 73.12 H new ATOM 0 HD2 LYS A 61 -13.527 -4.672 7.567 1.00 63.05 H new ATOM 0 HD3 LYS A 61 -12.298 -5.641 6.779 1.00 63.05 H new ATOM 0 HE2 LYS A 61 -13.654 -6.531 9.348 1.00 63.31 H new ATOM 0 HE3 LYS A 61 -14.326 -6.887 7.769 1.00 63.31 H new ATOM 0 HZ1 LYS A 61 -13.010 -8.727 8.444 1.00 54.12 H new ATOM 0 HZ2 LYS A 61 -12.157 -7.947 7.200 1.00 54.12 H new ATOM 0 HZ3 LYS A 61 -11.677 -7.742 8.816 1.00 54.12 H new ATOM 968 N LEU A 62 -8.736 -4.640 10.549 1.00 51.04 N ATOM 969 CA LEU A 62 -7.777 -5.638 11.008 1.00 22.42 C ATOM 970 C LEU A 62 -8.163 -7.030 10.518 1.00 14.33 C ATOM 971 O LEU A 62 -7.683 -8.018 11.073 1.00 50.23 O ATOM 972 CB LEU A 62 -7.690 -5.627 12.535 1.00 52.33 C ATOM 973 CG LEU A 62 -7.415 -4.269 13.182 1.00 10.11 C ATOM 974 CD1 LEU A 62 -8.666 -3.743 13.869 1.00 0.44 C ATOM 975 CD2 LEU A 62 -6.264 -4.373 14.172 1.00 70.55 C ATOM 0 H LEU A 62 -9.373 -4.304 11.272 1.00 51.04 H new ATOM 0 HA LEU A 62 -6.801 -5.385 10.594 1.00 22.42 H new ATOM 0 HB2 LEU A 62 -8.627 -6.015 12.935 1.00 52.33 H new ATOM 0 HB3 LEU A 62 -6.904 -6.318 12.839 1.00 52.33 H new ATOM 0 HG LEU A 62 -7.132 -3.565 12.399 1.00 10.11 H new ATOM 0 HD11 LEU A 62 -8.452 -2.776 14.324 1.00 0.44 H new ATOM 0 HD12 LEU A 62 -9.464 -3.630 13.135 1.00 0.44 H new ATOM 0 HD13 LEU A 62 -8.980 -4.446 14.641 1.00 0.44 H new ATOM 0 HD21 LEU A 62 -6.082 -3.397 14.623 1.00 70.55 H new ATOM 0 HD22 LEU A 62 -6.518 -5.091 14.952 1.00 70.55 H new ATOM 0 HD23 LEU A 62 -5.366 -4.705 13.652 1.00 70.55 H new TER 987 LEU A 62 ATOM 988 N MET B 1 -6.098 50.048 10.320 1.00 30.23 N ATOM 989 CA MET B 1 -6.607 49.224 11.411 1.00 4.11 C ATOM 990 C MET B 1 -6.069 47.799 11.313 1.00 50.42 C ATOM 991 O MET B 1 -5.540 47.395 10.278 1.00 22.43 O ATOM 992 CB MET B 1 -8.136 49.208 11.395 1.00 63.03 C ATOM 993 CG MET B 1 -8.724 48.690 10.092 1.00 53.45 C ATOM 994 SD MET B 1 -10.307 47.858 10.326 1.00 24.13 S ATOM 995 CE MET B 1 -10.909 47.794 8.640 1.00 12.22 C ATOM 0 H1 MET B 1 -6.868 50.633 9.939 1.00 30.23 H new ATOM 0 H2 MET B 1 -5.339 50.663 10.675 1.00 30.23 H new ATOM 0 H3 MET B 1 -5.724 49.435 9.568 1.00 30.23 H new ATOM 0 HA MET B 1 -6.266 49.657 12.351 1.00 4.11 H new ATOM 0 HB2 MET B 1 -8.493 48.588 12.217 1.00 63.03 H new ATOM 0 HB3 MET B 1 -8.504 50.218 11.574 1.00 63.03 H new ATOM 0 HG2 MET B 1 -8.854 49.522 9.400 1.00 53.45 H new ATOM 0 HG3 MET B 1 -8.020 47.999 9.630 1.00 53.45 H new ATOM 0 HE1 MET B 1 -11.883 47.305 8.620 1.00 12.22 H new ATOM 0 HE2 MET B 1 -11.003 48.807 8.248 1.00 12.22 H new ATOM 0 HE3 MET B 1 -10.208 47.231 8.024 1.00 12.22 H new ATOM 1005 N LYS B 2 -6.210 47.044 12.397 1.00 64.21 N ATOM 1006 CA LYS B 2 -5.741 45.664 12.434 1.00 65.42 C ATOM 1007 C LYS B 2 -4.226 45.599 12.264 1.00 2.42 C ATOM 1008 O LYS B 2 -3.601 46.556 11.803 1.00 32.51 O ATOM 1009 CB LYS B 2 -6.422 44.842 11.338 1.00 63.22 C ATOM 1010 CG LYS B 2 -6.304 43.342 11.540 1.00 73.52 C ATOM 1011 CD LYS B 2 -7.480 42.601 10.924 1.00 11.25 C ATOM 1012 CE LYS B 2 -7.449 42.671 9.405 1.00 34.23 C ATOM 1013 NZ LYS B 2 -8.007 41.438 8.782 1.00 13.05 N ATOM 0 H LYS B 2 -6.645 47.365 13.262 1.00 64.21 H new ATOM 0 HA LYS B 2 -5.999 45.246 13.407 1.00 65.42 H new ATOM 0 HB2 LYS B 2 -7.477 45.112 11.296 1.00 63.22 H new ATOM 0 HB3 LYS B 2 -5.986 45.106 10.374 1.00 63.22 H new ATOM 0 HG2 LYS B 2 -5.375 42.986 11.094 1.00 73.52 H new ATOM 0 HG3 LYS B 2 -6.252 43.121 12.606 1.00 73.52 H new ATOM 0 HD2 LYS B 2 -7.461 41.558 11.242 1.00 11.25 H new ATOM 0 HD3 LYS B 2 -8.413 43.029 11.290 1.00 11.25 H new ATOM 0 HE2 LYS B 2 -8.019 43.537 9.070 1.00 34.23 H new ATOM 0 HE3 LYS B 2 -6.422 42.815 9.069 1.00 34.23 H new ATOM 0 HZ1 LYS B 2 -7.968 41.524 7.746 1.00 13.05 H new ATOM 0 HZ2 LYS B 2 -7.448 40.614 9.082 1.00 13.05 H new ATOM 0 HZ3 LYS B 2 -8.995 41.314 9.082 1.00 13.05 H new ATOM 1027 N LYS B 3 -3.640 44.467 12.637 1.00 73.13 N ATOM 1028 CA LYS B 3 -2.200 44.276 12.525 1.00 65.22 C ATOM 1029 C LYS B 3 -1.862 42.807 12.290 1.00 40.42 C ATOM 1030 O LYS B 3 -1.053 42.476 11.422 1.00 32.11 O ATOM 1031 CB LYS B 3 -1.498 44.776 13.788 1.00 34.04 C ATOM 1032 CG LYS B 3 -1.347 46.287 13.844 1.00 42.20 C ATOM 1033 CD LYS B 3 -2.410 46.922 14.723 1.00 54.44 C ATOM 1034 CE LYS B 3 -2.187 46.595 16.192 1.00 62.33 C ATOM 1035 NZ LYS B 3 -2.471 47.763 17.070 1.00 43.01 N ATOM 0 H LYS B 3 -4.142 43.666 13.020 1.00 73.13 H new ATOM 0 HA LYS B 3 -1.848 44.853 11.669 1.00 65.22 H new ATOM 0 HB2 LYS B 3 -2.059 44.443 14.661 1.00 34.04 H new ATOM 0 HB3 LYS B 3 -0.511 44.318 13.850 1.00 34.04 H new ATOM 0 HG2 LYS B 3 -0.358 46.541 14.227 1.00 42.20 H new ATOM 0 HG3 LYS B 3 -1.414 46.698 12.837 1.00 42.20 H new ATOM 0 HD2 LYS B 3 -2.400 48.003 14.584 1.00 54.44 H new ATOM 0 HD3 LYS B 3 -3.395 46.570 14.416 1.00 54.44 H new ATOM 0 HE2 LYS B 3 -2.827 45.761 16.479 1.00 62.33 H new ATOM 0 HE3 LYS B 3 -1.157 46.272 16.340 1.00 62.33 H new ATOM 0 HZ1 LYS B 3 -2.307 47.499 18.063 1.00 43.01 H new ATOM 0 HZ2 LYS B 3 -1.843 48.551 16.813 1.00 43.01 H new ATOM 0 HZ3 LYS B 3 -3.462 48.056 16.949 1.00 43.01 H new ATOM 1049 N LEU B 4 -2.487 41.930 13.068 1.00 43.42 N ATOM 1050 CA LEU B 4 -2.254 40.495 12.944 1.00 41.14 C ATOM 1051 C LEU B 4 -3.111 39.717 13.936 1.00 74.04 C ATOM 1052 O LEU B 4 -3.619 38.640 13.622 1.00 34.01 O ATOM 1053 CB LEU B 4 -0.775 40.177 13.170 1.00 2.12 C ATOM 1054 CG LEU B 4 -0.121 40.849 14.378 1.00 50.33 C ATOM 1055 CD1 LEU B 4 0.383 39.805 15.362 1.00 62.20 C ATOM 1056 CD2 LEU B 4 1.015 41.759 13.933 1.00 64.40 C ATOM 0 H LEU B 4 -3.159 42.187 13.791 1.00 43.42 H new ATOM 0 HA LEU B 4 -2.534 40.192 11.935 1.00 41.14 H new ATOM 0 HB2 LEU B 4 -0.668 39.098 13.278 1.00 2.12 H new ATOM 0 HB3 LEU B 4 -0.222 40.464 12.276 1.00 2.12 H new ATOM 0 HG LEU B 4 -0.872 41.459 14.881 1.00 50.33 H new ATOM 0 HD11 LEU B 4 0.845 40.302 16.215 1.00 62.20 H new ATOM 0 HD12 LEU B 4 -0.453 39.196 15.706 1.00 62.20 H new ATOM 0 HD13 LEU B 4 1.119 39.168 14.871 1.00 62.20 H new ATOM 0 HD21 LEU B 4 1.468 42.228 14.806 1.00 64.40 H new ATOM 0 HD22 LEU B 4 1.767 41.171 13.406 1.00 64.40 H new ATOM 0 HD23 LEU B 4 0.625 42.530 13.268 1.00 64.40 H new ATOM 1068 N ARG B 5 -3.269 40.269 15.134 1.00 12.03 N ATOM 1069 CA ARG B 5 -4.066 39.627 16.173 1.00 33.12 C ATOM 1070 C ARG B 5 -5.455 39.271 15.650 1.00 15.14 C ATOM 1071 O ARG B 5 -5.871 38.115 15.705 1.00 21.43 O ATOM 1072 CB ARG B 5 -4.186 40.542 17.392 1.00 14.40 C ATOM 1073 CG ARG B 5 -3.273 40.149 18.542 1.00 50.22 C ATOM 1074 CD ARG B 5 -1.812 40.155 18.120 1.00 61.15 C ATOM 1075 NE ARG B 5 -0.915 39.936 19.251 1.00 0.10 N ATOM 1076 CZ ARG B 5 -0.622 40.870 20.149 1.00 5.41 C ATOM 1077 NH1 ARG B 5 -1.152 42.082 20.047 1.00 73.33 N ATOM 1078 NH2 ARG B 5 0.204 40.595 21.150 1.00 14.31 N ATOM 0 H ARG B 5 -2.856 41.160 15.410 1.00 12.03 H new ATOM 0 HA ARG B 5 -3.561 38.707 16.467 1.00 33.12 H new ATOM 0 HB2 ARG B 5 -3.958 41.565 17.092 1.00 14.40 H new ATOM 0 HB3 ARG B 5 -5.219 40.535 17.741 1.00 14.40 H new ATOM 0 HG2 ARG B 5 -3.416 40.839 19.373 1.00 50.22 H new ATOM 0 HG3 ARG B 5 -3.545 39.157 18.901 1.00 50.22 H new ATOM 0 HD2 ARG B 5 -1.648 39.380 17.372 1.00 61.15 H new ATOM 0 HD3 ARG B 5 -1.575 41.109 17.649 1.00 61.15 H new ATOM 0 HE ARG B 5 -0.490 39.015 19.357 1.00 0.10 H new ATOM 0 HH11 ARG B 5 -1.786 42.298 19.278 1.00 73.33 H new ATOM 0 HH12 ARG B 5 -0.925 42.797 20.738 1.00 73.33 H new ATOM 0 HH21 ARG B 5 0.615 39.665 21.231 1.00 14.31 H new ATOM 0 HH22 ARG B 5 0.428 41.313 21.839 1.00 14.31 H new ATOM 1092 N GLU B 6 -6.167 40.274 15.147 1.00 1.33 N ATOM 1093 CA GLU B 6 -7.509 40.067 14.617 1.00 1.30 C ATOM 1094 C GLU B 6 -7.472 39.187 13.371 1.00 44.00 C ATOM 1095 O GLU B 6 -8.385 38.399 13.128 1.00 14.32 O ATOM 1096 CB GLU B 6 -8.165 41.409 14.287 1.00 12.44 C ATOM 1097 CG GLU B 6 -8.050 42.434 15.405 1.00 72.25 C ATOM 1098 CD GLU B 6 -9.306 43.268 15.561 1.00 1.13 C ATOM 1099 OE1 GLU B 6 -9.226 44.500 15.371 1.00 3.12 O ATOM 1100 OE2 GLU B 6 -10.368 42.692 15.874 1.00 32.31 O ATOM 0 H GLU B 6 -5.837 41.238 15.095 1.00 1.33 H new ATOM 0 HA GLU B 6 -8.099 39.561 15.381 1.00 1.30 H new ATOM 0 HB2 GLU B 6 -7.708 41.815 13.385 1.00 12.44 H new ATOM 0 HB3 GLU B 6 -9.219 41.244 14.064 1.00 12.44 H new ATOM 0 HG2 GLU B 6 -7.840 41.921 16.343 1.00 72.25 H new ATOM 0 HG3 GLU B 6 -7.204 43.091 15.205 1.00 72.25 H new ATOM 1107 N GLU B 7 -6.409 39.330 12.585 1.00 70.04 N ATOM 1108 CA GLU B 7 -6.254 38.549 11.362 1.00 74.13 C ATOM 1109 C GLU B 7 -6.166 37.058 11.677 1.00 3.34 C ATOM 1110 O GLU B 7 -6.639 36.222 10.908 1.00 52.24 O ATOM 1111 CB GLU B 7 -5.004 38.995 10.601 1.00 11.01 C ATOM 1112 CG GLU B 7 -4.760 38.215 9.321 1.00 31.40 C ATOM 1113 CD GLU B 7 -4.014 39.024 8.278 1.00 63.24 C ATOM 1114 OE1 GLU B 7 -3.004 39.664 8.636 1.00 4.22 O ATOM 1115 OE2 GLU B 7 -4.440 39.016 7.103 1.00 14.32 O ATOM 0 H GLU B 7 -5.644 39.978 12.772 1.00 70.04 H new ATOM 0 HA GLU B 7 -7.131 38.720 10.738 1.00 74.13 H new ATOM 0 HB2 GLU B 7 -5.095 40.054 10.359 1.00 11.01 H new ATOM 0 HB3 GLU B 7 -4.136 38.890 11.252 1.00 11.01 H new ATOM 0 HG2 GLU B 7 -4.191 37.314 9.552 1.00 31.40 H new ATOM 0 HG3 GLU B 7 -5.716 37.892 8.909 1.00 31.40 H new ATOM 1122 N ALA B 8 -5.556 36.733 12.812 1.00 51.41 N ATOM 1123 CA ALA B 8 -5.406 35.345 13.229 1.00 55.34 C ATOM 1124 C ALA B 8 -6.766 34.687 13.443 1.00 1.34 C ATOM 1125 O ALA B 8 -7.057 33.641 12.864 1.00 60.34 O ATOM 1126 CB ALA B 8 -4.573 35.263 14.500 1.00 62.40 C ATOM 0 H ALA B 8 -5.157 37.413 13.459 1.00 51.41 H new ATOM 0 HA ALA B 8 -4.891 34.806 12.434 1.00 55.34 H new ATOM 0 HB1 ALA B 8 -4.469 34.220 14.800 1.00 62.40 H new ATOM 0 HB2 ALA B 8 -3.586 35.688 14.316 1.00 62.40 H new ATOM 0 HB3 ALA B 8 -5.066 35.822 15.295 1.00 62.40 H new ATOM 1132 N ALA B 9 -7.594 35.307 14.277 1.00 30.21 N ATOM 1133 CA ALA B 9 -8.922 34.782 14.566 1.00 53.01 C ATOM 1134 C ALA B 9 -9.702 34.523 13.281 1.00 4.23 C ATOM 1135 O ALA B 9 -10.500 33.589 13.203 1.00 51.21 O ATOM 1136 CB ALA B 9 -9.686 35.743 15.464 1.00 43.33 C ATOM 0 H ALA B 9 -7.368 36.174 14.765 1.00 30.21 H new ATOM 0 HA ALA B 9 -8.804 33.832 15.087 1.00 53.01 H new ATOM 0 HB1 ALA B 9 -10.676 35.338 15.671 1.00 43.33 H new ATOM 0 HB2 ALA B 9 -9.144 35.874 16.401 1.00 43.33 H new ATOM 0 HB3 ALA B 9 -9.786 36.707 14.964 1.00 43.33 H new ATOM 1142 N LYS B 10 -9.465 35.357 12.273 1.00 15.10 N ATOM 1143 CA LYS B 10 -10.144 35.218 10.990 1.00 52.41 C ATOM 1144 C LYS B 10 -9.555 34.066 10.184 1.00 32.41 C ATOM 1145 O LYS B 10 -10.259 33.404 9.420 1.00 53.10 O ATOM 1146 CB LYS B 10 -10.039 36.520 10.192 1.00 24.44 C ATOM 1147 CG LYS B 10 -10.619 36.423 8.791 1.00 14.23 C ATOM 1148 CD LYS B 10 -9.526 36.301 7.742 1.00 61.43 C ATOM 1149 CE LYS B 10 -9.093 37.665 7.227 1.00 34.31 C ATOM 1150 NZ LYS B 10 -9.061 37.711 5.739 1.00 42.31 N ATOM 0 H LYS B 10 -8.808 36.136 12.320 1.00 15.10 H new ATOM 0 HA LYS B 10 -11.194 35.001 11.184 1.00 52.41 H new ATOM 0 HB2 LYS B 10 -10.554 37.312 10.735 1.00 24.44 H new ATOM 0 HB3 LYS B 10 -8.991 36.811 10.123 1.00 24.44 H new ATOM 0 HG2 LYS B 10 -11.282 35.560 8.730 1.00 14.23 H new ATOM 0 HG3 LYS B 10 -11.225 37.305 8.585 1.00 14.23 H new ATOM 0 HD2 LYS B 10 -8.667 35.783 8.168 1.00 61.43 H new ATOM 0 HD3 LYS B 10 -9.884 35.694 6.911 1.00 61.43 H new ATOM 0 HE2 LYS B 10 -9.777 38.428 7.599 1.00 34.31 H new ATOM 0 HE3 LYS B 10 -8.105 37.904 7.619 1.00 34.31 H new ATOM 0 HZ1 LYS B 10 -8.761 38.657 5.427 1.00 42.31 H new ATOM 0 HZ2 LYS B 10 -8.390 37.001 5.384 1.00 42.31 H new ATOM 0 HZ3 LYS B 10 -10.010 37.508 5.365 1.00 42.31 H new ATOM 1164 N LEU B 11 -8.260 33.829 10.359 1.00 34.34 N ATOM 1165 CA LEU B 11 -7.575 32.754 9.649 1.00 50.04 C ATOM 1166 C LEU B 11 -8.093 31.390 10.095 1.00 42.32 C ATOM 1167 O LEU B 11 -8.122 30.440 9.313 1.00 74.51 O ATOM 1168 CB LEU B 11 -6.066 32.841 9.884 1.00 63.45 C ATOM 1169 CG LEU B 11 -5.247 33.466 8.755 1.00 24.04 C ATOM 1170 CD1 LEU B 11 -4.036 34.196 9.316 1.00 61.31 C ATOM 1171 CD2 LEU B 11 -4.814 32.402 7.756 1.00 32.43 C ATOM 0 H LEU B 11 -7.663 34.367 10.987 1.00 34.34 H new ATOM 0 HA LEU B 11 -7.778 32.869 8.584 1.00 50.04 H new ATOM 0 HB2 LEU B 11 -5.893 33.416 10.793 1.00 63.45 H new ATOM 0 HB3 LEU B 11 -5.688 31.835 10.066 1.00 63.45 H new ATOM 0 HG LEU B 11 -5.875 34.190 8.235 1.00 24.04 H new ATOM 0 HD11 LEU B 11 -3.464 34.635 8.498 1.00 61.31 H new ATOM 0 HD12 LEU B 11 -4.367 34.985 9.991 1.00 61.31 H new ATOM 0 HD13 LEU B 11 -3.407 33.492 9.861 1.00 61.31 H new ATOM 0 HD21 LEU B 11 -4.232 32.866 6.960 1.00 32.43 H new ATOM 0 HD22 LEU B 11 -4.204 31.654 8.263 1.00 32.43 H new ATOM 0 HD23 LEU B 11 -5.695 31.923 7.330 1.00 32.43 H new ATOM 1183 N PHE B 12 -8.504 31.303 11.356 1.00 30.52 N ATOM 1184 CA PHE B 12 -9.023 30.056 11.906 1.00 34.54 C ATOM 1185 C PHE B 12 -10.186 29.534 11.069 1.00 64.04 C ATOM 1186 O PHE B 12 -10.439 28.331 11.020 1.00 14.45 O ATOM 1187 CB PHE B 12 -9.474 30.261 13.354 1.00 23.31 C ATOM 1188 CG PHE B 12 -8.396 29.984 14.362 1.00 20.42 C ATOM 1189 CD1 PHE B 12 -7.119 30.491 14.188 1.00 31.01 C ATOM 1190 CD2 PHE B 12 -8.660 29.215 15.485 1.00 45.22 C ATOM 1191 CE1 PHE B 12 -6.125 30.238 15.115 1.00 23.44 C ATOM 1192 CE2 PHE B 12 -7.670 28.958 16.414 1.00 13.50 C ATOM 1193 CZ PHE B 12 -6.401 29.470 16.229 1.00 25.44 C ATOM 0 H PHE B 12 -8.488 32.081 12.016 1.00 30.52 H new ATOM 0 HA PHE B 12 -8.222 29.317 11.883 1.00 34.54 H new ATOM 0 HB2 PHE B 12 -9.820 31.287 13.477 1.00 23.31 H new ATOM 0 HB3 PHE B 12 -10.325 29.611 13.556 1.00 23.31 H new ATOM 0 HD1 PHE B 12 -6.897 31.091 13.318 1.00 31.01 H new ATOM 0 HD2 PHE B 12 -9.651 28.812 15.635 1.00 45.22 H new ATOM 0 HE1 PHE B 12 -5.134 30.641 14.968 1.00 23.44 H new ATOM 0 HE2 PHE B 12 -7.889 28.357 17.284 1.00 13.50 H new ATOM 0 HZ PHE B 12 -5.626 29.270 16.954 1.00 25.44 H new ATOM 1203 N GLU B 13 -10.892 30.449 10.411 1.00 4.21 N ATOM 1204 CA GLU B 13 -12.029 30.082 9.576 1.00 71.25 C ATOM 1205 C GLU B 13 -11.568 29.342 8.324 1.00 73.15 C ATOM 1206 O GLU B 13 -12.269 28.467 7.815 1.00 41.21 O ATOM 1207 CB GLU B 13 -12.824 31.329 9.181 1.00 72.31 C ATOM 1208 CG GLU B 13 -14.319 31.200 9.425 1.00 63.22 C ATOM 1209 CD GLU B 13 -14.772 31.934 10.671 1.00 34.11 C ATOM 1210 OE1 GLU B 13 -15.081 33.140 10.570 1.00 43.04 O ATOM 1211 OE2 GLU B 13 -14.817 31.304 11.749 1.00 2.13 O ATOM 0 H GLU B 13 -10.696 31.450 10.441 1.00 4.21 H new ATOM 0 HA GLU B 13 -12.672 29.418 10.154 1.00 71.25 H new ATOM 0 HB2 GLU B 13 -12.445 32.184 9.741 1.00 72.31 H new ATOM 0 HB3 GLU B 13 -12.653 31.539 8.125 1.00 72.31 H new ATOM 0 HG2 GLU B 13 -14.859 31.589 8.562 1.00 63.22 H new ATOM 0 HG3 GLU B 13 -14.579 30.145 9.514 1.00 63.22 H new ATOM 1218 N GLU B 14 -10.386 29.699 7.833 1.00 63.33 N ATOM 1219 CA GLU B 14 -9.832 29.070 6.640 1.00 73.42 C ATOM 1220 C GLU B 14 -9.837 27.550 6.775 1.00 64.42 C ATOM 1221 O GLU B 14 -10.296 26.838 5.881 1.00 10.12 O ATOM 1222 CB GLU B 14 -8.407 29.566 6.388 1.00 53.43 C ATOM 1223 CG GLU B 14 -8.331 31.040 6.028 1.00 43.32 C ATOM 1224 CD GLU B 14 -8.865 31.329 4.637 1.00 30.02 C ATOM 1225 OE1 GLU B 14 -8.903 32.516 4.252 1.00 5.14 O ATOM 1226 OE2 GLU B 14 -9.245 30.368 3.936 1.00 31.11 O ATOM 0 H GLU B 14 -9.793 30.421 8.243 1.00 63.33 H new ATOM 0 HA GLU B 14 -10.459 29.345 5.792 1.00 73.42 H new ATOM 0 HB2 GLU B 14 -7.806 29.387 7.279 1.00 53.43 H new ATOM 0 HB3 GLU B 14 -7.965 28.980 5.582 1.00 53.43 H new ATOM 0 HG2 GLU B 14 -8.897 31.618 6.758 1.00 43.32 H new ATOM 0 HG3 GLU B 14 -7.295 31.373 6.092 1.00 43.32 H new ATOM 1233 N TRP B 15 -9.322 27.060 7.897 1.00 35.02 N ATOM 1234 CA TRP B 15 -9.265 25.625 8.149 1.00 54.14 C ATOM 1235 C TRP B 15 -10.659 25.008 8.098 1.00 64.43 C ATOM 1236 O TRP B 15 -10.898 24.051 7.359 1.00 2.41 O ATOM 1237 CB TRP B 15 -8.623 25.350 9.511 1.00 42.44 C ATOM 1238 CG TRP B 15 -7.331 26.083 9.716 1.00 74.25 C ATOM 1239 CD1 TRP B 15 -6.432 26.444 8.755 1.00 63.44 C ATOM 1240 CD2 TRP B 15 -6.796 26.540 10.962 1.00 13.35 C ATOM 1241 NE1 TRP B 15 -5.369 27.099 9.328 1.00 23.12 N ATOM 1242 CE2 TRP B 15 -5.568 27.172 10.681 1.00 22.40 C ATOM 1243 CE3 TRP B 15 -7.233 26.479 12.288 1.00 13.55 C ATOM 1244 CZ2 TRP B 15 -4.776 27.736 11.677 1.00 63.53 C ATOM 1245 CZ3 TRP B 15 -6.446 27.040 13.276 1.00 21.04 C ATOM 1246 CH2 TRP B 15 -5.229 27.663 12.967 1.00 65.54 C ATOM 0 H TRP B 15 -8.938 27.635 8.647 1.00 35.02 H new ATOM 0 HA TRP B 15 -8.656 25.168 7.369 1.00 54.14 H new ATOM 0 HB2 TRP B 15 -9.322 25.633 10.298 1.00 42.44 H new ATOM 0 HB3 TRP B 15 -8.445 24.279 9.612 1.00 42.44 H new ATOM 0 HD1 TRP B 15 -6.540 26.244 7.699 1.00 63.44 H new ATOM 0 HE1 TRP B 15 -4.562 27.471 8.827 1.00 23.12 H new ATOM 0 HE3 TRP B 15 -8.169 26.002 12.536 1.00 13.55 H new ATOM 0 HZ2 TRP B 15 -3.837 28.214 11.441 1.00 63.53 H new ATOM 0 HZ3 TRP B 15 -6.774 26.998 14.304 1.00 21.04 H new ATOM 0 HH2 TRP B 15 -4.637 28.094 13.761 1.00 65.54 H new ATOM 1257 N LYS B 16 -11.575 25.559 8.884 1.00 53.55 N ATOM 1258 CA LYS B 16 -12.947 25.065 8.927 1.00 21.32 C ATOM 1259 C LYS B 16 -13.547 25.005 7.526 1.00 0.21 C ATOM 1260 O LYS B 16 -14.319 24.101 7.208 1.00 65.34 O ATOM 1261 CB LYS B 16 -13.806 25.958 9.824 1.00 5.45 C ATOM 1262 CG LYS B 16 -15.091 25.297 10.289 1.00 73.35 C ATOM 1263 CD LYS B 16 -15.126 25.148 11.801 1.00 24.14 C ATOM 1264 CE LYS B 16 -15.926 26.265 12.453 1.00 72.43 C ATOM 1265 NZ LYS B 16 -17.394 26.052 12.309 1.00 32.41 N ATOM 0 H LYS B 16 -11.393 26.350 9.502 1.00 53.55 H new ATOM 0 HA LYS B 16 -12.930 24.056 9.340 1.00 21.32 H new ATOM 0 HB2 LYS B 16 -13.222 26.251 10.696 1.00 5.45 H new ATOM 0 HB3 LYS B 16 -14.052 26.872 9.283 1.00 5.45 H new ATOM 0 HG2 LYS B 16 -15.945 25.889 9.961 1.00 73.35 H new ATOM 0 HG3 LYS B 16 -15.186 24.316 9.824 1.00 73.35 H new ATOM 0 HD2 LYS B 16 -15.564 24.185 12.063 1.00 24.14 H new ATOM 0 HD3 LYS B 16 -14.108 25.152 12.192 1.00 24.14 H new ATOM 0 HE2 LYS B 16 -15.670 26.326 13.511 1.00 72.43 H new ATOM 0 HE3 LYS B 16 -15.651 27.219 12.003 1.00 72.43 H new ATOM 0 HZ1 LYS B 16 -17.905 26.834 12.766 1.00 32.41 H new ATOM 0 HZ2 LYS B 16 -17.643 26.019 11.300 1.00 32.41 H new ATOM 0 HZ3 LYS B 16 -17.660 25.154 12.761 1.00 32.41 H new ATOM 1279 N LYS B 17 -13.187 25.974 6.691 1.00 3.12 N ATOM 1280 CA LYS B 17 -13.688 26.031 5.323 1.00 44.12 C ATOM 1281 C LYS B 17 -13.373 24.740 4.574 1.00 23.11 C ATOM 1282 O LYS B 17 -14.239 24.170 3.908 1.00 2.33 O ATOM 1283 CB LYS B 17 -13.076 27.224 4.584 1.00 43.24 C ATOM 1284 CG LYS B 17 -14.046 27.917 3.641 1.00 11.12 C ATOM 1285 CD LYS B 17 -14.197 27.152 2.337 1.00 52.31 C ATOM 1286 CE LYS B 17 -15.274 27.765 1.454 1.00 12.32 C ATOM 1287 NZ LYS B 17 -16.430 26.845 1.269 1.00 60.21 N ATOM 0 H LYS B 17 -12.550 26.731 6.938 1.00 3.12 H new ATOM 0 HA LYS B 17 -14.771 26.152 5.363 1.00 44.12 H new ATOM 0 HB2 LYS B 17 -12.714 27.947 5.315 1.00 43.24 H new ATOM 0 HB3 LYS B 17 -12.210 26.884 4.016 1.00 43.24 H new ATOM 0 HG2 LYS B 17 -15.019 28.012 4.123 1.00 11.12 H new ATOM 0 HG3 LYS B 17 -13.694 28.927 3.433 1.00 11.12 H new ATOM 0 HD2 LYS B 17 -13.246 27.148 1.804 1.00 52.31 H new ATOM 0 HD3 LYS B 17 -14.447 26.113 2.550 1.00 52.31 H new ATOM 0 HE2 LYS B 17 -15.620 28.698 1.898 1.00 12.32 H new ATOM 0 HE3 LYS B 17 -14.848 28.013 0.482 1.00 12.32 H new ATOM 0 HZ1 LYS B 17 -17.204 27.351 0.793 1.00 60.21 H new ATOM 0 HZ2 LYS B 17 -16.138 26.033 0.688 1.00 60.21 H new ATOM 0 HZ3 LYS B 17 -16.757 26.507 2.197 1.00 60.21 H new ATOM 1301 N LEU B 18 -12.131 24.283 4.689 1.00 65.12 N ATOM 1302 CA LEU B 18 -11.703 23.057 4.023 1.00 73.21 C ATOM 1303 C LEU B 18 -12.269 21.828 4.728 1.00 12.13 C ATOM 1304 O LEU B 18 -12.462 20.781 4.112 1.00 11.24 O ATOM 1305 CB LEU B 18 -10.175 22.980 3.988 1.00 42.32 C ATOM 1306 CG LEU B 18 -9.509 23.469 2.702 1.00 4.41 C ATOM 1307 CD1 LEU B 18 -9.820 22.530 1.548 1.00 44.23 C ATOM 1308 CD2 LEU B 18 -9.957 24.887 2.375 1.00 62.03 C ATOM 0 H LEU B 18 -11.403 24.742 5.236 1.00 65.12 H new ATOM 0 HA LEU B 18 -12.084 23.075 3.002 1.00 73.21 H new ATOM 0 HB2 LEU B 18 -9.782 23.563 4.821 1.00 42.32 H new ATOM 0 HB3 LEU B 18 -9.879 21.944 4.156 1.00 42.32 H new ATOM 0 HG LEU B 18 -8.430 23.476 2.855 1.00 4.41 H new ATOM 0 HD11 LEU B 18 -9.337 22.895 0.642 1.00 44.23 H new ATOM 0 HD12 LEU B 18 -9.448 21.532 1.781 1.00 44.23 H new ATOM 0 HD13 LEU B 18 -10.898 22.488 1.393 1.00 44.23 H new ATOM 0 HD21 LEU B 18 -9.473 25.219 1.456 1.00 62.03 H new ATOM 0 HD22 LEU B 18 -11.039 24.905 2.242 1.00 62.03 H new ATOM 0 HD23 LEU B 18 -9.680 25.553 3.192 1.00 62.03 H new ATOM 1320 N ALA B 19 -12.535 21.966 6.023 1.00 60.13 N ATOM 1321 CA ALA B 19 -13.084 20.869 6.811 1.00 2.13 C ATOM 1322 C ALA B 19 -14.463 20.464 6.303 1.00 62.13 C ATOM 1323 O ALA B 19 -14.765 19.278 6.178 1.00 50.01 O ATOM 1324 CB ALA B 19 -13.153 21.258 8.280 1.00 73.22 C ATOM 0 H ALA B 19 -12.379 22.826 6.548 1.00 60.13 H new ATOM 0 HA ALA B 19 -12.421 20.010 6.705 1.00 2.13 H new ATOM 0 HB1 ALA B 19 -13.565 20.430 8.857 1.00 73.22 H new ATOM 0 HB2 ALA B 19 -12.152 21.490 8.642 1.00 73.22 H new ATOM 0 HB3 ALA B 19 -13.792 22.133 8.395 1.00 73.22 H new ATOM 1330 N GLU B 20 -15.296 21.458 6.012 1.00 74.05 N ATOM 1331 CA GLU B 20 -16.646 21.204 5.519 1.00 20.24 C ATOM 1332 C GLU B 20 -16.607 20.525 4.153 1.00 34.23 C ATOM 1333 O GLU B 20 -17.387 19.614 3.879 1.00 33.43 O ATOM 1334 CB GLU B 20 -17.435 22.511 5.429 1.00 1.52 C ATOM 1335 CG GLU B 20 -18.941 22.321 5.501 1.00 24.25 C ATOM 1336 CD GLU B 20 -19.689 23.632 5.631 1.00 43.45 C ATOM 1337 OE1 GLU B 20 -19.229 24.638 5.050 1.00 51.33 O ATOM 1338 OE2 GLU B 20 -20.735 23.654 6.313 1.00 3.14 O ATOM 0 H GLU B 20 -15.061 22.446 6.109 1.00 74.05 H new ATOM 0 HA GLU B 20 -17.143 20.537 6.223 1.00 20.24 H new ATOM 0 HB2 GLU B 20 -17.122 23.171 6.238 1.00 1.52 H new ATOM 0 HB3 GLU B 20 -17.185 23.012 4.494 1.00 1.52 H new ATOM 0 HG2 GLU B 20 -19.281 21.801 4.606 1.00 24.25 H new ATOM 0 HG3 GLU B 20 -19.183 21.683 6.351 1.00 24.25 H new ATOM 1345 N GLU B 21 -15.692 20.977 3.300 1.00 34.42 N ATOM 1346 CA GLU B 21 -15.553 20.414 1.962 1.00 15.45 C ATOM 1347 C GLU B 21 -15.051 18.975 2.027 1.00 33.42 C ATOM 1348 O GLU B 21 -15.399 18.146 1.186 1.00 33.01 O ATOM 1349 CB GLU B 21 -14.593 21.263 1.125 1.00 13.20 C ATOM 1350 CG GLU B 21 -15.294 22.264 0.223 1.00 54.05 C ATOM 1351 CD GLU B 21 -14.486 23.530 0.016 1.00 63.32 C ATOM 1352 OE1 GLU B 21 -15.037 24.499 -0.545 1.00 41.51 O ATOM 1353 OE2 GLU B 21 -13.303 23.550 0.414 1.00 51.33 O ATOM 0 H GLU B 21 -15.037 21.730 3.512 1.00 34.42 H new ATOM 0 HA GLU B 21 -16.536 20.417 1.490 1.00 15.45 H new ATOM 0 HB2 GLU B 21 -13.919 21.799 1.793 1.00 13.20 H new ATOM 0 HB3 GLU B 21 -13.978 20.604 0.513 1.00 13.20 H new ATOM 0 HG2 GLU B 21 -15.490 21.801 -0.744 1.00 54.05 H new ATOM 0 HG3 GLU B 21 -16.261 22.521 0.655 1.00 54.05 H new ATOM 1360 N ALA B 22 -14.229 18.686 3.031 1.00 62.32 N ATOM 1361 CA ALA B 22 -13.681 17.347 3.207 1.00 20.34 C ATOM 1362 C ALA B 22 -14.767 16.356 3.612 1.00 4.44 C ATOM 1363 O ALA B 22 -14.708 15.178 3.260 1.00 51.05 O ATOM 1364 CB ALA B 22 -12.568 17.365 4.245 1.00 31.11 C ATOM 0 H ALA B 22 -13.928 19.361 3.734 1.00 62.32 H new ATOM 0 HA ALA B 22 -13.269 17.023 2.252 1.00 20.34 H new ATOM 0 HB1 ALA B 22 -12.168 16.359 4.367 1.00 31.11 H new ATOM 0 HB2 ALA B 22 -11.773 18.034 3.915 1.00 31.11 H new ATOM 0 HB3 ALA B 22 -12.965 17.715 5.198 1.00 31.11 H new ATOM 1370 N ALA B 23 -15.758 16.842 4.353 1.00 61.23 N ATOM 1371 CA ALA B 23 -16.858 15.999 4.803 1.00 1.40 C ATOM 1372 C ALA B 23 -17.617 15.407 3.620 1.00 24.34 C ATOM 1373 O ALA B 23 -18.139 14.295 3.698 1.00 74.52 O ATOM 1374 CB ALA B 23 -17.802 16.795 5.692 1.00 31.20 C ATOM 0 H ALA B 23 -15.821 17.815 4.654 1.00 61.23 H new ATOM 0 HA ALA B 23 -16.439 15.175 5.381 1.00 1.40 H new ATOM 0 HB1 ALA B 23 -18.619 16.153 6.021 1.00 31.20 H new ATOM 0 HB2 ALA B 23 -17.258 17.165 6.561 1.00 31.20 H new ATOM 0 HB3 ALA B 23 -18.206 17.638 5.131 1.00 31.20 H new ATOM 1380 N LYS B 24 -17.673 16.156 2.525 1.00 71.03 N ATOM 1381 CA LYS B 24 -18.367 15.706 1.324 1.00 23.22 C ATOM 1382 C LYS B 24 -17.566 14.623 0.607 1.00 51.52 C ATOM 1383 O LYS B 24 -18.136 13.723 -0.012 1.00 22.53 O ATOM 1384 CB LYS B 24 -18.612 16.885 0.378 1.00 31.54 C ATOM 1385 CG LYS B 24 -19.282 18.071 1.048 1.00 13.11 C ATOM 1386 CD LYS B 24 -19.451 19.233 0.083 1.00 33.02 C ATOM 1387 CE LYS B 24 -19.822 20.515 0.813 1.00 72.31 C ATOM 1388 NZ LYS B 24 -21.278 20.577 1.120 1.00 60.22 N ATOM 0 H LYS B 24 -17.246 17.079 2.444 1.00 71.03 H new ATOM 0 HA LYS B 24 -19.326 15.285 1.625 1.00 23.22 H new ATOM 0 HB2 LYS B 24 -17.659 17.206 -0.043 1.00 31.54 H new ATOM 0 HB3 LYS B 24 -19.232 16.550 -0.454 1.00 31.54 H new ATOM 0 HG2 LYS B 24 -20.257 17.771 1.432 1.00 13.11 H new ATOM 0 HG3 LYS B 24 -18.687 18.391 1.904 1.00 13.11 H new ATOM 0 HD2 LYS B 24 -18.525 19.384 -0.472 1.00 33.02 H new ATOM 0 HD3 LYS B 24 -20.224 18.992 -0.647 1.00 33.02 H new ATOM 0 HE2 LYS B 24 -19.252 20.583 1.740 1.00 72.31 H new ATOM 0 HE3 LYS B 24 -19.543 21.374 0.203 1.00 72.31 H new ATOM 0 HZ1 LYS B 24 -21.490 21.465 1.617 1.00 60.22 H new ATOM 0 HZ2 LYS B 24 -21.822 20.538 0.234 1.00 60.22 H new ATOM 0 HZ3 LYS B 24 -21.540 19.771 1.723 1.00 60.22 H new ATOM 1402 N LEU B 25 -16.243 14.716 0.695 1.00 41.14 N ATOM 1403 CA LEU B 25 -15.365 13.743 0.056 1.00 65.24 C ATOM 1404 C LEU B 25 -15.345 12.432 0.835 1.00 72.45 C ATOM 1405 O LEU B 25 -15.197 11.354 0.255 1.00 52.31 O ATOM 1406 CB LEU B 25 -13.946 14.303 -0.055 1.00 3.51 C ATOM 1407 CG LEU B 25 -13.282 14.183 -1.427 1.00 42.41 C ATOM 1408 CD1 LEU B 25 -13.084 12.722 -1.798 1.00 61.21 C ATOM 1409 CD2 LEU B 25 -14.111 14.897 -2.485 1.00 25.34 C ATOM 0 H LEU B 25 -15.756 15.455 1.202 1.00 41.14 H new ATOM 0 HA LEU B 25 -15.751 13.545 -0.944 1.00 65.24 H new ATOM 0 HB2 LEU B 25 -13.970 15.356 0.224 1.00 3.51 H new ATOM 0 HB3 LEU B 25 -13.318 13.794 0.676 1.00 3.51 H new ATOM 0 HG LEU B 25 -12.303 14.660 -1.379 1.00 42.41 H new ATOM 0 HD11 LEU B 25 -12.610 12.656 -2.777 1.00 61.21 H new ATOM 0 HD12 LEU B 25 -12.449 12.241 -1.055 1.00 61.21 H new ATOM 0 HD13 LEU B 25 -14.051 12.220 -1.828 1.00 61.21 H new ATOM 0 HD21 LEU B 25 -13.623 14.801 -3.455 1.00 25.34 H new ATOM 0 HD22 LEU B 25 -15.104 14.450 -2.532 1.00 25.34 H new ATOM 0 HD23 LEU B 25 -14.200 15.952 -2.226 1.00 25.34 H new ATOM 1421 N LEU B 26 -15.499 12.529 2.151 1.00 2.12 N ATOM 1422 CA LEU B 26 -15.502 11.350 3.010 1.00 2.23 C ATOM 1423 C LEU B 26 -16.847 10.634 2.947 1.00 73.14 C ATOM 1424 O LEU B 26 -16.919 9.414 3.090 1.00 21.25 O ATOM 1425 CB LEU B 26 -15.189 11.746 4.453 1.00 14.21 C ATOM 1426 CG LEU B 26 -15.510 10.700 5.521 1.00 11.11 C ATOM 1427 CD1 LEU B 26 -14.357 10.570 6.505 1.00 25.01 C ATOM 1428 CD2 LEU B 26 -16.797 11.058 6.250 1.00 11.32 C ATOM 0 H LEU B 26 -15.623 13.412 2.646 1.00 2.12 H new ATOM 0 HA LEU B 26 -14.731 10.668 2.652 1.00 2.23 H new ATOM 0 HB2 LEU B 26 -14.129 11.991 4.520 1.00 14.21 H new ATOM 0 HB3 LEU B 26 -15.741 12.656 4.687 1.00 14.21 H new ATOM 0 HG LEU B 26 -15.651 9.738 5.028 1.00 11.11 H new ATOM 0 HD11 LEU B 26 -14.604 9.821 7.258 1.00 25.01 H new ATOM 0 HD12 LEU B 26 -13.456 10.266 5.972 1.00 25.01 H new ATOM 0 HD13 LEU B 26 -14.184 11.530 6.991 1.00 25.01 H new ATOM 0 HD21 LEU B 26 -17.009 10.302 7.006 1.00 11.32 H new ATOM 0 HD22 LEU B 26 -16.685 12.030 6.730 1.00 11.32 H new ATOM 0 HD23 LEU B 26 -17.620 11.098 5.537 1.00 11.32 H new ATOM 1440 N GLU B 27 -17.911 11.402 2.730 1.00 34.41 N ATOM 1441 CA GLU B 27 -19.254 10.839 2.647 1.00 12.23 C ATOM 1442 C GLU B 27 -19.555 10.356 1.231 1.00 34.52 C ATOM 1443 O GLU B 27 -20.364 9.451 1.032 1.00 51.51 O ATOM 1444 CB GLU B 27 -20.293 11.877 3.075 1.00 44.44 C ATOM 1445 CG GLU B 27 -20.297 12.156 4.568 1.00 10.44 C ATOM 1446 CD GLU B 27 -21.254 11.259 5.328 1.00 64.03 C ATOM 1447 OE1 GLU B 27 -22.313 11.756 5.764 1.00 13.21 O ATOM 1448 OE2 GLU B 27 -20.945 10.059 5.484 1.00 15.31 O ATOM 0 H GLU B 27 -17.869 12.414 2.609 1.00 34.41 H new ATOM 0 HA GLU B 27 -19.305 9.985 3.322 1.00 12.23 H new ATOM 0 HB2 GLU B 27 -20.105 12.808 2.541 1.00 44.44 H new ATOM 0 HB3 GLU B 27 -21.283 11.532 2.776 1.00 44.44 H new ATOM 0 HG2 GLU B 27 -19.289 12.021 4.961 1.00 10.44 H new ATOM 0 HG3 GLU B 27 -20.569 13.198 4.738 1.00 10.44 H new ATOM 1455 N GLY B 28 -18.896 10.966 0.251 1.00 0.22 N ATOM 1456 CA GLY B 28 -19.106 10.585 -1.134 1.00 14.43 C ATOM 1457 C GLY B 28 -20.552 10.734 -1.562 1.00 1.24 C ATOM 1458 O GLY B 28 -21.145 9.802 -2.103 1.00 53.43 O ATOM 0 H GLY B 28 -18.220 11.717 0.391 1.00 0.22 H new ATOM 0 HA2 GLY B 28 -18.475 11.199 -1.776 1.00 14.43 H new ATOM 0 HA3 GLY B 28 -18.793 9.550 -1.275 1.00 14.43 H new ATOM 1462 N GLY B 29 -21.122 11.911 -1.319 1.00 31.13 N ATOM 1463 CA GLY B 29 -22.504 12.157 -1.689 1.00 24.32 C ATOM 1464 C GLY B 29 -23.408 12.307 -0.482 1.00 64.15 C ATOM 1465 O GLY B 29 -24.092 13.319 -0.334 1.00 54.13 O ATOM 0 H GLY B 29 -20.651 12.698 -0.873 1.00 31.13 H new ATOM 0 HA2 GLY B 29 -22.559 13.061 -2.295 1.00 24.32 H new ATOM 0 HA3 GLY B 29 -22.863 11.335 -2.308 1.00 24.32 H new ATOM 1469 N GLY B 30 -23.414 11.296 0.382 1.00 3.50 N ATOM 1470 CA GLY B 30 -24.247 11.340 1.570 1.00 3.32 C ATOM 1471 C GLY B 30 -23.852 10.296 2.594 1.00 60.54 C ATOM 1472 O GLY B 30 -23.077 9.387 2.297 1.00 62.13 O ATOM 0 H GLY B 30 -22.857 10.448 0.280 1.00 3.50 H new ATOM 0 HA2 GLY B 30 -24.180 12.330 2.021 1.00 3.32 H new ATOM 0 HA3 GLY B 30 -25.288 11.190 1.285 1.00 3.32 H new ATOM 1476 N GLY B 31 -24.385 10.424 3.805 1.00 1.34 N ATOM 1477 CA GLY B 31 -24.070 9.477 4.858 1.00 53.54 C ATOM 1478 C GLY B 31 -24.832 8.174 4.714 1.00 44.20 C ATOM 1479 O GLY B 31 -24.466 7.320 3.907 1.00 41.51 O ATOM 0 H GLY B 31 -25.029 11.167 4.076 1.00 1.34 H new ATOM 0 HA2 GLY B 31 -23.000 9.271 4.849 1.00 53.54 H new ATOM 0 HA3 GLY B 31 -24.300 9.924 5.825 1.00 53.54 H new ATOM 1483 N GLY B 32 -25.894 8.020 5.499 1.00 3.12 N ATOM 1484 CA GLY B 32 -26.690 6.809 5.440 1.00 42.22 C ATOM 1485 C GLY B 32 -26.252 5.776 6.460 1.00 13.45 C ATOM 1486 O GLY B 32 -25.069 5.454 6.557 1.00 54.10 O ATOM 0 H GLY B 32 -26.217 8.713 6.175 1.00 3.12 H new ATOM 0 HA2 GLY B 32 -27.738 7.058 5.607 1.00 42.22 H new ATOM 0 HA3 GLY B 32 -26.620 6.380 4.440 1.00 42.22 H new ATOM 1490 N GLY B 33 -27.209 5.258 7.224 1.00 50.31 N ATOM 1491 CA GLY B 33 -26.895 4.264 8.234 1.00 2.11 C ATOM 1492 C GLY B 33 -25.847 4.746 9.216 1.00 30.13 C ATOM 1493 O GLY B 33 -24.826 4.089 9.418 1.00 22.52 O ATOM 0 H GLY B 33 -28.196 5.509 7.162 1.00 50.31 H new ATOM 0 HA2 GLY B 33 -27.804 4.002 8.776 1.00 2.11 H new ATOM 0 HA3 GLY B 33 -26.541 3.355 7.747 1.00 2.11 H new ATOM 1497 N GLY B 34 -26.097 5.899 9.829 1.00 35.13 N ATOM 1498 CA GLY B 34 -25.157 6.450 10.787 1.00 23.24 C ATOM 1499 C GLY B 34 -23.896 6.972 10.128 1.00 4.11 C ATOM 1500 O GLY B 34 -23.951 7.876 9.296 1.00 3.40 O ATOM 0 H GLY B 34 -26.935 6.462 9.679 1.00 35.13 H new ATOM 0 HA2 GLY B 34 -25.637 7.259 11.338 1.00 23.24 H new ATOM 0 HA3 GLY B 34 -24.892 5.682 11.514 1.00 23.24 H new ATOM 1504 N GLY B 35 -22.754 6.401 10.500 1.00 71.34 N ATOM 1505 CA GLY B 35 -21.490 6.828 9.929 1.00 33.04 C ATOM 1506 C GLY B 35 -20.680 7.679 10.888 1.00 51.41 C ATOM 1507 O GLY B 35 -20.981 8.856 11.090 1.00 72.15 O ATOM 0 H GLY B 35 -22.682 5.650 11.187 1.00 71.34 H new ATOM 0 HA2 GLY B 35 -20.908 5.951 9.645 1.00 33.04 H new ATOM 0 HA3 GLY B 35 -21.679 7.394 9.017 1.00 33.04 H new ATOM 1511 N GLU B 36 -19.650 7.084 11.481 1.00 51.13 N ATOM 1512 CA GLU B 36 -18.796 7.795 12.425 1.00 52.42 C ATOM 1513 C GLU B 36 -17.728 8.600 11.692 1.00 4.35 C ATOM 1514 O GLU B 36 -17.251 9.621 12.190 1.00 13.00 O ATOM 1515 CB GLU B 36 -18.137 6.811 13.392 1.00 33.34 C ATOM 1516 CG GLU B 36 -17.039 7.434 14.240 1.00 73.11 C ATOM 1517 CD GLU B 36 -16.385 6.433 15.174 1.00 44.44 C ATOM 1518 OE1 GLU B 36 -15.526 6.850 15.979 1.00 34.42 O ATOM 1519 OE2 GLU B 36 -16.732 5.237 15.099 1.00 61.12 O ATOM 0 H GLU B 36 -19.387 6.111 11.324 1.00 51.13 H new ATOM 0 HA GLU B 36 -19.420 8.485 12.992 1.00 52.42 H new ATOM 0 HB2 GLU B 36 -18.900 6.394 14.049 1.00 33.34 H new ATOM 0 HB3 GLU B 36 -17.718 5.981 12.823 1.00 33.34 H new ATOM 0 HG2 GLU B 36 -16.281 7.865 13.586 1.00 73.11 H new ATOM 0 HG3 GLU B 36 -17.457 8.252 14.826 1.00 73.11 H new ATOM 1526 N LEU B 37 -17.353 8.134 10.506 1.00 74.45 N ATOM 1527 CA LEU B 37 -16.339 8.808 9.703 1.00 13.22 C ATOM 1528 C LEU B 37 -16.674 10.287 9.534 1.00 62.34 C ATOM 1529 O LEU B 37 -15.784 11.136 9.513 1.00 22.12 O ATOM 1530 CB LEU B 37 -16.218 8.140 8.333 1.00 64.23 C ATOM 1531 CG LEU B 37 -15.056 7.162 8.163 1.00 63.32 C ATOM 1532 CD1 LEU B 37 -13.726 7.874 8.351 1.00 1.33 C ATOM 1533 CD2 LEU B 37 -15.186 6.004 9.142 1.00 62.33 C ATOM 0 H LEU B 37 -17.737 7.291 10.079 1.00 74.45 H new ATOM 0 HA LEU B 37 -15.385 8.728 10.224 1.00 13.22 H new ATOM 0 HB2 LEU B 37 -17.147 7.608 8.127 1.00 64.23 H new ATOM 0 HB3 LEU B 37 -16.123 8.920 7.578 1.00 64.23 H new ATOM 0 HG LEU B 37 -15.090 6.761 7.150 1.00 63.32 H new ATOM 0 HD11 LEU B 37 -12.911 7.161 8.226 1.00 1.33 H new ATOM 0 HD12 LEU B 37 -13.630 8.668 7.610 1.00 1.33 H new ATOM 0 HD13 LEU B 37 -13.682 8.304 9.352 1.00 1.33 H new ATOM 0 HD21 LEU B 37 -14.350 5.318 9.007 1.00 62.33 H new ATOM 0 HD22 LEU B 37 -15.179 6.388 10.162 1.00 62.33 H new ATOM 0 HD23 LEU B 37 -16.122 5.476 8.959 1.00 62.33 H new ATOM 1545 N MET B 38 -17.963 10.586 9.415 1.00 64.44 N ATOM 1546 CA MET B 38 -18.416 11.962 9.250 1.00 4.42 C ATOM 1547 C MET B 38 -18.351 12.718 10.574 1.00 24.02 C ATOM 1548 O MET B 38 -18.135 13.929 10.599 1.00 4.23 O ATOM 1549 CB MET B 38 -19.844 11.991 8.703 1.00 11.21 C ATOM 1550 CG MET B 38 -20.898 11.634 9.738 1.00 71.52 C ATOM 1551 SD MET B 38 -22.302 10.753 9.026 1.00 4.42 S ATOM 1552 CE MET B 38 -23.598 11.976 9.211 1.00 21.11 C ATOM 0 H MET B 38 -18.712 9.894 9.430 1.00 64.44 H new ATOM 0 HA MET B 38 -17.753 12.453 8.538 1.00 4.42 H new ATOM 0 HB2 MET B 38 -20.054 12.986 8.311 1.00 11.21 H new ATOM 0 HB3 MET B 38 -19.918 11.296 7.866 1.00 11.21 H new ATOM 0 HG2 MET B 38 -20.445 11.019 10.515 1.00 71.52 H new ATOM 0 HG3 MET B 38 -21.252 12.546 10.219 1.00 71.52 H new ATOM 0 HE1 MET B 38 -24.533 11.578 8.815 1.00 21.11 H new ATOM 0 HE2 MET B 38 -23.724 12.216 10.267 1.00 21.11 H new ATOM 0 HE3 MET B 38 -23.327 12.879 8.664 1.00 21.11 H new ATOM 1562 N LYS B 39 -18.538 11.994 11.672 1.00 52.44 N ATOM 1563 CA LYS B 39 -18.500 12.596 13.000 1.00 72.25 C ATOM 1564 C LYS B 39 -17.063 12.860 13.436 1.00 15.14 C ATOM 1565 O LYS B 39 -16.795 13.791 14.198 1.00 63.31 O ATOM 1566 CB LYS B 39 -19.193 11.684 14.015 1.00 31.32 C ATOM 1567 CG LYS B 39 -19.372 12.320 15.382 1.00 41.42 C ATOM 1568 CD LYS B 39 -20.531 13.303 15.391 1.00 1.30 C ATOM 1569 CE LYS B 39 -20.305 14.421 16.398 1.00 51.21 C ATOM 1570 NZ LYS B 39 -21.590 14.966 16.918 1.00 55.34 N ATOM 0 H LYS B 39 -18.717 10.990 11.669 1.00 52.44 H new ATOM 0 HA LYS B 39 -19.028 13.548 12.956 1.00 72.25 H new ATOM 0 HB2 LYS B 39 -20.170 11.398 13.626 1.00 31.32 H new ATOM 0 HB3 LYS B 39 -18.613 10.768 14.123 1.00 31.32 H new ATOM 0 HG2 LYS B 39 -19.547 11.543 16.126 1.00 41.42 H new ATOM 0 HG3 LYS B 39 -18.455 12.835 15.668 1.00 41.42 H new ATOM 0 HD2 LYS B 39 -20.657 13.728 14.395 1.00 1.30 H new ATOM 0 HD3 LYS B 39 -21.455 12.776 15.631 1.00 1.30 H new ATOM 0 HE2 LYS B 39 -19.707 14.046 17.229 1.00 51.21 H new ATOM 0 HE3 LYS B 39 -19.734 15.222 15.929 1.00 51.21 H new ATOM 0 HZ1 LYS B 39 -21.394 15.725 17.601 1.00 55.34 H new ATOM 0 HZ2 LYS B 39 -22.150 15.346 16.129 1.00 55.34 H new ATOM 0 HZ3 LYS B 39 -22.124 14.207 17.388 1.00 55.34 H new ATOM 1584 N LEU B 40 -16.141 12.037 12.949 1.00 10.14 N ATOM 1585 CA LEU B 40 -14.729 12.183 13.287 1.00 32.54 C ATOM 1586 C LEU B 40 -14.120 13.387 12.575 1.00 61.32 C ATOM 1587 O LEU B 40 -13.279 14.091 13.135 1.00 43.42 O ATOM 1588 CB LEU B 40 -13.961 10.913 12.916 1.00 4.31 C ATOM 1589 CG LEU B 40 -12.502 10.853 13.370 1.00 53.53 C ATOM 1590 CD1 LEU B 40 -12.124 9.434 13.765 1.00 11.41 C ATOM 1591 CD2 LEU B 40 -11.580 11.368 12.274 1.00 40.12 C ATOM 0 H LEU B 40 -16.346 11.262 12.319 1.00 10.14 H new ATOM 0 HA LEU B 40 -14.653 12.344 14.362 1.00 32.54 H new ATOM 0 HB2 LEU B 40 -14.488 10.058 13.339 1.00 4.31 H new ATOM 0 HB3 LEU B 40 -13.988 10.800 11.832 1.00 4.31 H new ATOM 0 HG LEU B 40 -12.387 11.494 14.244 1.00 53.53 H new ATOM 0 HD11 LEU B 40 -11.082 9.411 14.085 1.00 11.41 H new ATOM 0 HD12 LEU B 40 -12.763 9.102 14.583 1.00 11.41 H new ATOM 0 HD13 LEU B 40 -12.256 8.771 12.910 1.00 11.41 H new ATOM 0 HD21 LEU B 40 -10.546 11.318 12.615 1.00 40.12 H new ATOM 0 HD22 LEU B 40 -11.698 10.754 11.381 1.00 40.12 H new ATOM 0 HD23 LEU B 40 -11.835 12.402 12.040 1.00 40.12 H new ATOM 1603 N CYS B 41 -14.551 13.616 11.340 1.00 11.31 N ATOM 1604 CA CYS B 41 -14.049 14.736 10.550 1.00 35.03 C ATOM 1605 C CYS B 41 -14.539 16.064 11.119 1.00 45.04 C ATOM 1606 O CYS B 41 -13.865 17.086 11.002 1.00 44.24 O ATOM 1607 CB CYS B 41 -14.488 14.597 9.093 1.00 43.25 C ATOM 1608 SG CYS B 41 -13.921 15.937 8.020 1.00 5.34 S ATOM 0 H CYS B 41 -15.247 13.042 10.863 1.00 11.31 H new ATOM 0 HA CYS B 41 -12.960 14.722 10.595 1.00 35.03 H new ATOM 0 HB2 CYS B 41 -14.116 13.650 8.701 1.00 43.25 H new ATOM 0 HB3 CYS B 41 -15.576 14.552 9.055 1.00 43.25 H new ATOM 0 HG CYS B 41 -13.712 17.004 8.732 1.00 5.34 H new ATOM 1614 N GLU B 42 -15.719 16.040 11.732 1.00 70.00 N ATOM 1615 CA GLU B 42 -16.300 17.243 12.315 1.00 5.43 C ATOM 1616 C GLU B 42 -15.586 17.621 13.609 1.00 31.14 C ATOM 1617 O GLU B 42 -15.422 18.801 13.918 1.00 32.22 O ATOM 1618 CB GLU B 42 -17.792 17.037 12.584 1.00 12.30 C ATOM 1619 CG GLU B 42 -18.540 18.325 12.886 1.00 31.24 C ATOM 1620 CD GLU B 42 -19.543 18.684 11.807 1.00 11.31 C ATOM 1621 OE1 GLU B 42 -20.591 19.274 12.145 1.00 35.40 O ATOM 1622 OE2 GLU B 42 -19.281 18.375 10.626 1.00 21.04 O ATOM 0 H GLU B 42 -16.290 15.201 11.837 1.00 70.00 H new ATOM 0 HA GLU B 42 -16.176 18.057 11.601 1.00 5.43 H new ATOM 0 HB2 GLU B 42 -18.246 16.558 11.717 1.00 12.30 H new ATOM 0 HB3 GLU B 42 -17.910 16.353 13.424 1.00 12.30 H new ATOM 0 HG2 GLU B 42 -19.058 18.225 13.840 1.00 31.24 H new ATOM 0 HG3 GLU B 42 -17.824 19.139 12.997 1.00 31.24 H new ATOM 1629 N GLU B 43 -15.164 16.609 14.362 1.00 22.11 N ATOM 1630 CA GLU B 43 -14.469 16.834 15.624 1.00 10.43 C ATOM 1631 C GLU B 43 -13.268 17.755 15.426 1.00 53.12 C ATOM 1632 O GLU B 43 -13.050 18.684 16.204 1.00 10.30 O ATOM 1633 CB GLU B 43 -14.012 15.504 16.225 1.00 72.11 C ATOM 1634 CG GLU B 43 -14.284 15.383 17.715 1.00 51.24 C ATOM 1635 CD GLU B 43 -15.637 14.766 18.013 1.00 60.13 C ATOM 1636 OE1 GLU B 43 -16.656 15.475 17.876 1.00 25.01 O ATOM 1637 OE2 GLU B 43 -15.677 13.574 18.382 1.00 33.50 O ATOM 0 H GLU B 43 -15.291 15.626 14.120 1.00 22.11 H new ATOM 0 HA GLU B 43 -15.165 17.314 16.312 1.00 10.43 H new ATOM 0 HB2 GLU B 43 -14.515 14.688 15.705 1.00 72.11 H new ATOM 0 HB3 GLU B 43 -12.943 15.384 16.049 1.00 72.11 H new ATOM 0 HG2 GLU B 43 -13.503 14.777 18.175 1.00 51.24 H new ATOM 0 HG3 GLU B 43 -14.231 16.371 18.172 1.00 51.24 H new ATOM 1644 N ALA B 44 -12.491 17.489 14.381 1.00 54.45 N ATOM 1645 CA ALA B 44 -11.314 18.293 14.080 1.00 42.23 C ATOM 1646 C ALA B 44 -11.679 19.766 13.928 1.00 15.01 C ATOM 1647 O ALA B 44 -11.031 20.638 14.505 1.00 1.44 O ATOM 1648 CB ALA B 44 -10.635 17.783 12.817 1.00 14.44 C ATOM 0 H ALA B 44 -12.656 16.722 13.729 1.00 54.45 H new ATOM 0 HA ALA B 44 -10.620 18.202 14.915 1.00 42.23 H new ATOM 0 HB1 ALA B 44 -9.757 18.393 12.604 1.00 14.44 H new ATOM 0 HB2 ALA B 44 -10.330 16.746 12.961 1.00 14.44 H new ATOM 0 HB3 ALA B 44 -11.331 17.844 11.980 1.00 14.44 H new ATOM 1654 N ALA B 45 -12.720 20.036 13.147 1.00 75.41 N ATOM 1655 CA ALA B 45 -13.171 21.404 12.921 1.00 73.25 C ATOM 1656 C ALA B 45 -13.820 21.982 14.175 1.00 23.15 C ATOM 1657 O ALA B 45 -13.830 23.197 14.376 1.00 52.14 O ATOM 1658 CB ALA B 45 -14.145 21.451 11.752 1.00 63.21 C ATOM 0 H ALA B 45 -13.267 19.326 12.660 1.00 75.41 H new ATOM 0 HA ALA B 45 -12.300 22.013 12.680 1.00 73.25 H new ATOM 0 HB1 ALA B 45 -14.474 22.478 11.594 1.00 63.21 H new ATOM 0 HB2 ALA B 45 -13.651 21.086 10.852 1.00 63.21 H new ATOM 0 HB3 ALA B 45 -15.008 20.823 11.972 1.00 63.21 H new ATOM 1664 N LYS B 46 -14.358 21.105 15.015 1.00 53.11 N ATOM 1665 CA LYS B 46 -15.008 21.529 16.249 1.00 32.35 C ATOM 1666 C LYS B 46 -13.994 22.127 17.220 1.00 74.32 C ATOM 1667 O LYS B 46 -14.291 23.087 17.931 1.00 54.24 O ATOM 1668 CB LYS B 46 -15.721 20.344 16.907 1.00 43.41 C ATOM 1669 CG LYS B 46 -17.053 20.711 17.538 1.00 13.24 C ATOM 1670 CD LYS B 46 -17.392 19.792 18.700 1.00 65.13 C ATOM 1671 CE LYS B 46 -17.760 20.581 19.946 1.00 53.14 C ATOM 1672 NZ LYS B 46 -19.176 21.041 19.913 1.00 73.23 N ATOM 0 H LYS B 46 -14.357 20.096 14.864 1.00 53.11 H new ATOM 0 HA LYS B 46 -15.742 22.295 15.999 1.00 32.35 H new ATOM 0 HB2 LYS B 46 -15.884 19.568 16.159 1.00 43.41 H new ATOM 0 HB3 LYS B 46 -15.071 19.918 17.672 1.00 43.41 H new ATOM 0 HG2 LYS B 46 -17.019 21.743 17.887 1.00 13.24 H new ATOM 0 HG3 LYS B 46 -17.840 20.654 16.786 1.00 13.24 H new ATOM 0 HD2 LYS B 46 -18.222 19.142 18.421 1.00 65.13 H new ATOM 0 HD3 LYS B 46 -16.540 19.147 18.915 1.00 65.13 H new ATOM 0 HE2 LYS B 46 -17.600 19.962 20.829 1.00 53.14 H new ATOM 0 HE3 LYS B 46 -17.100 21.444 20.038 1.00 53.14 H new ATOM 0 HZ1 LYS B 46 -19.388 21.575 20.780 1.00 73.23 H new ATOM 0 HZ2 LYS B 46 -19.323 21.653 19.085 1.00 73.23 H new ATOM 0 HZ3 LYS B 46 -19.807 20.217 19.851 1.00 73.23 H new ATOM 1686 N LYS B 47 -12.795 21.554 17.244 1.00 72.25 N ATOM 1687 CA LYS B 47 -11.736 22.030 18.126 1.00 45.32 C ATOM 1688 C LYS B 47 -11.371 23.476 17.804 1.00 52.22 C ATOM 1689 O LYS B 47 -11.152 24.286 18.704 1.00 34.22 O ATOM 1690 CB LYS B 47 -10.499 21.141 17.997 1.00 20.33 C ATOM 1691 CG LYS B 47 -9.788 20.892 19.316 1.00 12.10 C ATOM 1692 CD LYS B 47 -10.181 19.553 19.918 1.00 2.44 C ATOM 1693 CE LYS B 47 -11.583 19.595 20.505 1.00 41.30 C ATOM 1694 NZ LYS B 47 -11.924 18.335 21.220 1.00 60.01 N ATOM 0 H LYS B 47 -12.533 20.759 16.662 1.00 72.25 H new ATOM 0 HA LYS B 47 -12.103 21.985 19.151 1.00 45.32 H new ATOM 0 HB2 LYS B 47 -10.793 20.184 17.566 1.00 20.33 H new ATOM 0 HB3 LYS B 47 -9.801 21.603 17.299 1.00 20.33 H new ATOM 0 HG2 LYS B 47 -8.710 20.919 19.160 1.00 12.10 H new ATOM 0 HG3 LYS B 47 -10.029 21.692 20.017 1.00 12.10 H new ATOM 0 HD2 LYS B 47 -10.129 18.779 19.152 1.00 2.44 H new ATOM 0 HD3 LYS B 47 -9.468 19.279 20.696 1.00 2.44 H new ATOM 0 HE2 LYS B 47 -11.663 20.436 21.194 1.00 41.30 H new ATOM 0 HE3 LYS B 47 -12.306 19.766 19.707 1.00 41.30 H new ATOM 0 HZ1 LYS B 47 -12.888 18.404 21.605 1.00 60.01 H new ATOM 0 HZ2 LYS B 47 -11.873 17.535 20.557 1.00 60.01 H new ATOM 0 HZ3 LYS B 47 -11.250 18.184 21.998 1.00 60.01 H new ATOM 1708 N ALA B 48 -11.310 23.793 16.515 1.00 40.40 N ATOM 1709 CA ALA B 48 -10.976 25.142 16.075 1.00 61.10 C ATOM 1710 C ALA B 48 -11.953 26.164 16.645 1.00 52.03 C ATOM 1711 O ALA B 48 -11.551 27.235 17.100 1.00 63.21 O ATOM 1712 CB ALA B 48 -10.961 25.214 14.555 1.00 32.02 C ATOM 0 H ALA B 48 -11.488 23.134 15.757 1.00 40.40 H new ATOM 0 HA ALA B 48 -9.981 25.382 16.449 1.00 61.10 H new ATOM 0 HB1 ALA B 48 -10.710 26.227 14.241 1.00 32.02 H new ATOM 0 HB2 ALA B 48 -10.217 24.519 14.165 1.00 32.02 H new ATOM 0 HB3 ALA B 48 -11.945 24.948 14.168 1.00 32.02 H new ATOM 1718 N GLU B 49 -13.239 25.826 16.618 1.00 62.21 N ATOM 1719 CA GLU B 49 -14.273 26.716 17.131 1.00 51.33 C ATOM 1720 C GLU B 49 -14.176 26.845 18.649 1.00 21.41 C ATOM 1721 O GLU B 49 -14.470 27.899 19.212 1.00 71.45 O ATOM 1722 CB GLU B 49 -15.660 26.201 16.740 1.00 71.11 C ATOM 1723 CG GLU B 49 -16.694 27.303 16.574 1.00 61.30 C ATOM 1724 CD GLU B 49 -17.720 27.313 17.690 1.00 35.30 C ATOM 1725 OE1 GLU B 49 -18.663 26.497 17.635 1.00 55.11 O ATOM 1726 OE2 GLU B 49 -17.580 28.137 18.618 1.00 12.13 O ATOM 0 H GLU B 49 -13.589 24.943 16.246 1.00 62.21 H new ATOM 0 HA GLU B 49 -14.121 27.701 16.689 1.00 51.33 H new ATOM 0 HB2 GLU B 49 -15.582 25.644 15.806 1.00 71.11 H new ATOM 0 HB3 GLU B 49 -16.006 25.501 17.500 1.00 71.11 H new ATOM 0 HG2 GLU B 49 -16.189 28.268 16.541 1.00 61.30 H new ATOM 0 HG3 GLU B 49 -17.203 27.177 15.618 1.00 61.30 H new ATOM 1733 N GLU B 50 -13.762 25.765 19.303 1.00 21.30 N ATOM 1734 CA GLU B 50 -13.627 25.757 20.755 1.00 73.15 C ATOM 1735 C GLU B 50 -12.396 26.545 21.191 1.00 33.23 C ATOM 1736 O GLU B 50 -12.346 27.076 22.302 1.00 43.52 O ATOM 1737 CB GLU B 50 -13.536 24.320 21.273 1.00 70.02 C ATOM 1738 CG GLU B 50 -13.194 24.226 22.751 1.00 72.21 C ATOM 1739 CD GLU B 50 -13.511 22.864 23.338 1.00 53.34 C ATOM 1740 OE1 GLU B 50 -12.571 22.180 23.791 1.00 5.41 O ATOM 1741 OE2 GLU B 50 -14.702 22.484 23.345 1.00 24.42 O ATOM 0 H GLU B 50 -13.514 24.885 18.851 1.00 21.30 H new ATOM 0 HA GLU B 50 -14.511 26.233 21.179 1.00 73.15 H new ATOM 0 HB2 GLU B 50 -14.487 23.818 21.096 1.00 70.02 H new ATOM 0 HB3 GLU B 50 -12.781 23.783 20.699 1.00 70.02 H new ATOM 0 HG2 GLU B 50 -12.134 24.439 22.889 1.00 72.21 H new ATOM 0 HG3 GLU B 50 -13.747 24.990 23.297 1.00 72.21 H new ATOM 1748 N LEU B 51 -11.403 26.616 20.312 1.00 51.41 N ATOM 1749 CA LEU B 51 -10.171 27.340 20.605 1.00 24.41 C ATOM 1750 C LEU B 51 -10.411 28.846 20.608 1.00 45.14 C ATOM 1751 O LEU B 51 -9.744 29.590 21.326 1.00 15.14 O ATOM 1752 CB LEU B 51 -9.092 26.985 19.581 1.00 63.33 C ATOM 1753 CG LEU B 51 -7.866 26.249 20.123 1.00 0.33 C ATOM 1754 CD1 LEU B 51 -7.242 27.028 21.271 1.00 10.52 C ATOM 1755 CD2 LEU B 51 -8.242 24.845 20.572 1.00 72.32 C ATOM 0 H LEU B 51 -11.427 26.181 19.390 1.00 51.41 H new ATOM 0 HA LEU B 51 -9.832 27.044 21.598 1.00 24.41 H new ATOM 0 HB2 LEU B 51 -9.546 26.370 18.804 1.00 63.33 H new ATOM 0 HB3 LEU B 51 -8.756 27.905 19.103 1.00 63.33 H new ATOM 0 HG LEU B 51 -7.131 26.168 19.322 1.00 0.33 H new ATOM 0 HD11 LEU B 51 -6.371 26.490 21.645 1.00 10.52 H new ATOM 0 HD12 LEU B 51 -6.936 28.013 20.919 1.00 10.52 H new ATOM 0 HD13 LEU B 51 -7.971 27.140 22.073 1.00 10.52 H new ATOM 0 HD21 LEU B 51 -7.357 24.336 20.955 1.00 72.32 H new ATOM 0 HD22 LEU B 51 -8.995 24.904 21.358 1.00 72.32 H new ATOM 0 HD23 LEU B 51 -8.643 24.288 19.726 1.00 72.32 H new ATOM 1767 N PHE B 52 -11.368 29.289 19.799 1.00 74.31 N ATOM 1768 CA PHE B 52 -11.697 30.706 19.708 1.00 1.44 C ATOM 1769 C PHE B 52 -11.975 31.290 21.091 1.00 23.44 C ATOM 1770 O PHE B 52 -11.680 32.455 21.356 1.00 43.32 O ATOM 1771 CB PHE B 52 -12.913 30.913 18.802 1.00 34.22 C ATOM 1772 CG PHE B 52 -12.734 32.016 17.800 1.00 10.45 C ATOM 1773 CD1 PHE B 52 -12.494 33.316 18.216 1.00 15.14 C ATOM 1774 CD2 PHE B 52 -12.805 31.755 16.441 1.00 14.45 C ATOM 1775 CE1 PHE B 52 -12.328 34.334 17.297 1.00 12.15 C ATOM 1776 CE2 PHE B 52 -12.639 32.769 15.517 1.00 2.41 C ATOM 1777 CZ PHE B 52 -12.401 34.061 15.946 1.00 43.20 C ATOM 0 H PHE B 52 -11.929 28.686 19.197 1.00 74.31 H new ATOM 0 HA PHE B 52 -10.840 31.225 19.278 1.00 1.44 H new ATOM 0 HB2 PHE B 52 -13.124 29.984 18.273 1.00 34.22 H new ATOM 0 HB3 PHE B 52 -13.783 31.133 19.420 1.00 34.22 H new ATOM 0 HD1 PHE B 52 -12.436 33.536 19.272 1.00 15.14 H new ATOM 0 HD2 PHE B 52 -12.992 30.747 16.100 1.00 14.45 H new ATOM 0 HE1 PHE B 52 -12.141 35.342 17.635 1.00 12.15 H new ATOM 0 HE2 PHE B 52 -12.695 32.552 14.461 1.00 2.41 H new ATOM 0 HZ PHE B 52 -12.272 34.855 15.226 1.00 43.20 H new ATOM 1787 N LYS B 53 -12.542 30.471 21.969 1.00 73.41 N ATOM 1788 CA LYS B 53 -12.860 30.902 23.325 1.00 11.44 C ATOM 1789 C LYS B 53 -11.587 31.170 24.122 1.00 35.43 C ATOM 1790 O LYS B 53 -11.493 32.160 24.848 1.00 52.40 O ATOM 1791 CB LYS B 53 -13.707 29.843 24.034 1.00 33.05 C ATOM 1792 CG LYS B 53 -14.735 30.426 24.988 1.00 72.02 C ATOM 1793 CD LYS B 53 -14.490 29.972 26.418 1.00 10.04 C ATOM 1794 CE LYS B 53 -15.441 30.654 27.390 1.00 21.11 C ATOM 1795 NZ LYS B 53 -16.217 29.667 28.191 1.00 11.32 N ATOM 0 H LYS B 53 -12.791 29.503 21.766 1.00 73.41 H new ATOM 0 HA LYS B 53 -13.430 31.829 23.261 1.00 11.44 H new ATOM 0 HB2 LYS B 53 -14.220 29.239 23.285 1.00 33.05 H new ATOM 0 HB3 LYS B 53 -13.048 29.174 24.587 1.00 33.05 H new ATOM 0 HG2 LYS B 53 -14.701 31.514 24.940 1.00 72.02 H new ATOM 0 HG3 LYS B 53 -15.735 30.124 24.676 1.00 72.02 H new ATOM 0 HD2 LYS B 53 -14.614 28.891 26.484 1.00 10.04 H new ATOM 0 HD3 LYS B 53 -13.460 30.193 26.700 1.00 10.04 H new ATOM 0 HE2 LYS B 53 -14.874 31.300 28.060 1.00 21.11 H new ATOM 0 HE3 LYS B 53 -16.129 31.294 26.837 1.00 21.11 H new ATOM 0 HZ1 LYS B 53 -16.853 30.171 28.841 1.00 11.32 H new ATOM 0 HZ2 LYS B 53 -16.778 29.067 27.553 1.00 11.32 H new ATOM 0 HZ3 LYS B 53 -15.562 29.073 28.739 1.00 11.32 H new ATOM 1809 N LEU B 54 -10.609 30.281 23.982 1.00 53.33 N ATOM 1810 CA LEU B 54 -9.341 30.421 24.689 1.00 11.24 C ATOM 1811 C LEU B 54 -8.502 31.543 24.084 1.00 73.30 C ATOM 1812 O LEU B 54 -7.820 32.275 24.799 1.00 13.24 O ATOM 1813 CB LEU B 54 -8.562 29.106 24.646 1.00 41.14 C ATOM 1814 CG LEU B 54 -8.742 28.179 25.849 1.00 72.14 C ATOM 1815 CD1 LEU B 54 -8.195 28.828 27.110 1.00 41.32 C ATOM 1816 CD2 LEU B 54 -10.210 27.817 26.027 1.00 70.43 C ATOM 0 H LEU B 54 -10.670 29.456 23.385 1.00 53.33 H new ATOM 0 HA LEU B 54 -9.558 30.673 25.727 1.00 11.24 H new ATOM 0 HB2 LEU B 54 -8.855 28.563 23.747 1.00 41.14 H new ATOM 0 HB3 LEU B 54 -7.502 29.338 24.547 1.00 41.14 H new ATOM 0 HG LEU B 54 -8.181 27.263 25.665 1.00 72.14 H new ATOM 0 HD11 LEU B 54 -8.332 28.153 27.955 1.00 41.32 H new ATOM 0 HD12 LEU B 54 -7.133 29.036 26.981 1.00 41.32 H new ATOM 0 HD13 LEU B 54 -8.727 29.760 27.300 1.00 41.32 H new ATOM 0 HD21 LEU B 54 -10.320 27.157 26.887 1.00 70.43 H new ATOM 0 HD22 LEU B 54 -10.791 28.725 26.189 1.00 70.43 H new ATOM 0 HD23 LEU B 54 -10.571 27.310 25.132 1.00 70.43 H new ATOM 1828 N ALA B 55 -8.560 31.670 22.762 1.00 11.34 N ATOM 1829 CA ALA B 55 -7.809 32.704 22.061 1.00 13.34 C ATOM 1830 C ALA B 55 -8.359 34.091 22.376 1.00 52.22 C ATOM 1831 O ALA B 55 -7.628 35.080 22.347 1.00 32.54 O ATOM 1832 CB ALA B 55 -7.835 32.451 20.562 1.00 25.01 C ATOM 0 H ALA B 55 -9.119 31.070 22.156 1.00 11.34 H new ATOM 0 HA ALA B 55 -6.776 32.665 22.406 1.00 13.34 H new ATOM 0 HB1 ALA B 55 -7.270 33.231 20.052 1.00 25.01 H new ATOM 0 HB2 ALA B 55 -7.387 31.480 20.349 1.00 25.01 H new ATOM 0 HB3 ALA B 55 -8.866 32.460 20.209 1.00 25.01 H new ATOM 1838 N GLU B 56 -9.653 34.155 22.675 1.00 1.23 N ATOM 1839 CA GLU B 56 -10.301 35.423 22.993 1.00 73.13 C ATOM 1840 C GLU B 56 -9.761 35.997 24.300 1.00 71.44 C ATOM 1841 O GLU B 56 -9.521 37.198 24.409 1.00 41.41 O ATOM 1842 CB GLU B 56 -11.816 35.235 23.092 1.00 35.14 C ATOM 1843 CG GLU B 56 -12.569 36.516 23.411 1.00 32.33 C ATOM 1844 CD GLU B 56 -13.165 36.510 24.806 1.00 62.13 C ATOM 1845 OE1 GLU B 56 -14.391 36.718 24.925 1.00 54.14 O ATOM 1846 OE2 GLU B 56 -12.409 36.298 25.775 1.00 21.14 O ATOM 0 H GLU B 56 -10.273 33.345 22.704 1.00 1.23 H new ATOM 0 HA GLU B 56 -10.081 36.126 22.190 1.00 73.13 H new ATOM 0 HB2 GLU B 56 -12.186 34.831 22.150 1.00 35.14 H new ATOM 0 HB3 GLU B 56 -12.032 34.495 23.863 1.00 35.14 H new ATOM 0 HG2 GLU B 56 -11.892 37.365 23.313 1.00 32.33 H new ATOM 0 HG3 GLU B 56 -13.365 36.657 22.680 1.00 32.33 H new ATOM 1853 N GLU B 57 -9.574 35.127 25.288 1.00 50.24 N ATOM 1854 CA GLU B 57 -9.064 35.549 26.588 1.00 74.25 C ATOM 1855 C GLU B 57 -7.559 35.793 26.529 1.00 15.12 C ATOM 1856 O GLU B 57 -7.017 36.579 27.306 1.00 21.52 O ATOM 1857 CB GLU B 57 -9.380 34.493 27.650 1.00 15.01 C ATOM 1858 CG GLU B 57 -9.702 35.081 29.015 1.00 61.54 C ATOM 1859 CD GLU B 57 -8.764 34.586 30.099 1.00 3.22 C ATOM 1860 OE1 GLU B 57 -9.158 33.673 30.853 1.00 52.21 O ATOM 1861 OE2 GLU B 57 -7.636 35.113 30.192 1.00 22.04 O ATOM 0 H GLU B 57 -9.767 34.128 25.214 1.00 50.24 H new ATOM 0 HA GLU B 57 -9.555 36.484 26.857 1.00 74.25 H new ATOM 0 HB2 GLU B 57 -10.225 33.893 27.313 1.00 15.01 H new ATOM 0 HB3 GLU B 57 -8.528 33.819 27.745 1.00 15.01 H new ATOM 0 HG2 GLU B 57 -9.647 36.168 28.960 1.00 61.54 H new ATOM 0 HG3 GLU B 57 -10.728 34.827 29.283 1.00 61.54 H new ATOM 1868 N ARG B 58 -6.892 35.114 25.603 1.00 24.41 N ATOM 1869 CA ARG B 58 -5.449 35.254 25.443 1.00 33.12 C ATOM 1870 C ARG B 58 -5.107 36.553 24.719 1.00 2.23 C ATOM 1871 O ARG B 58 -4.643 37.515 25.333 1.00 20.21 O ATOM 1872 CB ARG B 58 -4.881 34.062 24.671 1.00 21.03 C ATOM 1873 CG ARG B 58 -4.939 32.754 25.442 1.00 75.55 C ATOM 1874 CD ARG B 58 -3.691 32.548 26.286 1.00 63.44 C ATOM 1875 NE ARG B 58 -3.023 31.287 25.974 1.00 33.31 N ATOM 1876 CZ ARG B 58 -3.436 30.106 26.420 1.00 51.30 C ATOM 1877 NH1 ARG B 58 -4.511 30.025 27.192 1.00 73.22 N ATOM 1878 NH2 ARG B 58 -2.774 29.003 26.094 1.00 4.33 N ATOM 0 H ARG B 58 -7.327 34.461 24.951 1.00 24.41 H new ATOM 0 HA ARG B 58 -4.999 35.281 26.436 1.00 33.12 H new ATOM 0 HB2 ARG B 58 -5.432 33.948 23.738 1.00 21.03 H new ATOM 0 HB3 ARG B 58 -3.845 34.272 24.406 1.00 21.03 H new ATOM 0 HG2 ARG B 58 -5.819 32.748 26.085 1.00 75.55 H new ATOM 0 HG3 ARG B 58 -5.049 31.924 24.744 1.00 75.55 H new ATOM 0 HD2 ARG B 58 -3.001 33.375 26.120 1.00 63.44 H new ATOM 0 HD3 ARG B 58 -3.960 32.564 27.342 1.00 63.44 H new ATOM 0 HE ARG B 58 -2.194 31.315 25.381 1.00 33.31 H new ATOM 0 HH11 ARG B 58 -5.022 30.871 27.444 1.00 73.22 H new ATOM 0 HH12 ARG B 58 -4.826 29.117 27.533 1.00 73.22 H new ATOM 0 HH21 ARG B 58 -1.947 29.061 25.500 1.00 4.33 H new ATOM 0 HH22 ARG B 58 -3.092 28.097 26.437 1.00 4.33 H new ATOM 1892 N LEU B 59 -5.337 36.573 23.411 1.00 55.14 N ATOM 1893 CA LEU B 59 -5.053 37.754 22.603 1.00 64.43 C ATOM 1894 C LEU B 59 -5.718 38.993 23.194 1.00 72.32 C ATOM 1895 O LEU B 59 -5.153 40.087 23.169 1.00 70.51 O ATOM 1896 CB LEU B 59 -5.535 37.540 21.165 1.00 35.24 C ATOM 1897 CG LEU B 59 -5.050 36.263 20.479 1.00 32.12 C ATOM 1898 CD1 LEU B 59 -5.644 36.149 19.083 1.00 60.20 C ATOM 1899 CD2 LEU B 59 -3.530 36.234 20.418 1.00 44.40 C ATOM 0 H LEU B 59 -5.719 35.785 22.887 1.00 55.14 H new ATOM 0 HA LEU B 59 -3.974 37.910 22.600 1.00 64.43 H new ATOM 0 HB2 LEU B 59 -6.625 37.537 21.165 1.00 35.24 H new ATOM 0 HB3 LEU B 59 -5.218 38.394 20.566 1.00 35.24 H new ATOM 0 HG LEU B 59 -5.386 35.408 21.066 1.00 32.12 H new ATOM 0 HD11 LEU B 59 -5.288 35.234 18.610 1.00 60.20 H new ATOM 0 HD12 LEU B 59 -6.732 36.123 19.151 1.00 60.20 H new ATOM 0 HD13 LEU B 59 -5.339 37.009 18.486 1.00 60.20 H new ATOM 0 HD21 LEU B 59 -3.203 35.318 19.926 1.00 44.40 H new ATOM 0 HD22 LEU B 59 -3.172 37.096 19.855 1.00 44.40 H new ATOM 0 HD23 LEU B 59 -3.125 36.268 21.429 1.00 44.40 H new ATOM 1911 N LYS B 60 -6.921 38.813 23.729 1.00 53.22 N ATOM 1912 CA LYS B 60 -7.663 39.915 24.331 1.00 1.21 C ATOM 1913 C LYS B 60 -7.826 39.704 25.833 1.00 42.45 C ATOM 1914 O LYS B 60 -8.704 38.963 26.275 1.00 72.24 O ATOM 1915 CB LYS B 60 -9.037 40.051 23.672 1.00 11.53 C ATOM 1916 CG LYS B 60 -9.492 41.492 23.506 1.00 23.14 C ATOM 1917 CD LYS B 60 -9.195 42.013 22.110 1.00 21.03 C ATOM 1918 CE LYS B 60 -7.821 42.661 22.038 1.00 23.50 C ATOM 1919 NZ LYS B 60 -7.764 43.729 21.001 1.00 60.33 N ATOM 0 H LYS B 60 -7.403 37.915 23.758 1.00 53.22 H new ATOM 0 HA LYS B 60 -7.097 40.833 24.170 1.00 1.21 H new ATOM 0 HB2 LYS B 60 -9.010 39.572 22.693 1.00 11.53 H new ATOM 0 HB3 LYS B 60 -9.773 39.513 24.270 1.00 11.53 H new ATOM 0 HG2 LYS B 60 -10.562 41.561 23.701 1.00 23.14 H new ATOM 0 HG3 LYS B 60 -8.992 42.120 24.244 1.00 23.14 H new ATOM 0 HD2 LYS B 60 -9.249 41.192 21.395 1.00 21.03 H new ATOM 0 HD3 LYS B 60 -9.956 42.738 21.821 1.00 21.03 H new ATOM 0 HE2 LYS B 60 -7.568 43.085 23.010 1.00 23.50 H new ATOM 0 HE3 LYS B 60 -7.072 41.900 21.817 1.00 23.50 H new ATOM 0 HZ1 LYS B 60 -6.811 44.146 20.984 1.00 60.33 H new ATOM 0 HZ2 LYS B 60 -7.980 43.320 20.069 1.00 60.33 H new ATOM 0 HZ3 LYS B 60 -8.461 44.468 21.225 1.00 60.33 H new ATOM 1933 N LYS B 61 -6.976 40.362 26.614 1.00 4.32 N ATOM 1934 CA LYS B 61 -7.028 40.249 28.067 1.00 1.35 C ATOM 1935 C LYS B 61 -8.227 41.005 28.629 1.00 60.33 C ATOM 1936 O LYS B 61 -9.132 40.406 29.212 1.00 74.24 O ATOM 1937 CB LYS B 61 -5.736 40.789 28.687 1.00 44.15 C ATOM 1938 CG LYS B 61 -5.091 39.834 29.677 1.00 45.15 C ATOM 1939 CD LYS B 61 -3.579 39.980 29.688 1.00 1.22 C ATOM 1940 CE LYS B 61 -3.136 41.121 30.591 1.00 33.12 C ATOM 1941 NZ LYS B 61 -2.936 42.385 29.830 1.00 1.24 N ATOM 0 H LYS B 61 -6.243 40.979 26.265 1.00 4.32 H new ATOM 0 HA LYS B 61 -7.134 39.194 28.321 1.00 1.35 H new ATOM 0 HB2 LYS B 61 -5.025 41.009 27.891 1.00 44.15 H new ATOM 0 HB3 LYS B 61 -5.951 41.731 29.191 1.00 44.15 H new ATOM 0 HG2 LYS B 61 -5.483 40.025 30.676 1.00 45.15 H new ATOM 0 HG3 LYS B 61 -5.357 38.808 29.421 1.00 45.15 H new ATOM 0 HD2 LYS B 61 -3.125 39.049 30.027 1.00 1.22 H new ATOM 0 HD3 LYS B 61 -3.222 40.158 28.674 1.00 1.22 H new ATOM 0 HE2 LYS B 61 -3.883 41.280 31.369 1.00 33.12 H new ATOM 0 HE3 LYS B 61 -2.207 40.848 31.092 1.00 33.12 H new ATOM 0 HZ1 LYS B 61 -2.635 43.138 30.481 1.00 1.24 H new ATOM 0 HZ2 LYS B 61 -2.205 42.241 29.104 1.00 1.24 H new ATOM 0 HZ3 LYS B 61 -3.829 42.660 29.372 1.00 1.24 H new ATOM 1955 N LEU B 62 -8.229 42.321 28.450 1.00 74.24 N ATOM 1956 CA LEU B 62 -9.319 43.157 28.938 1.00 55.24 C ATOM 1957 C LEU B 62 -9.477 43.020 30.450 1.00 50.42 C ATOM 1958 O LEU B 62 -9.569 44.016 31.167 1.00 55.11 O ATOM 1959 CB LEU B 62 -10.629 42.782 28.242 1.00 73.41 C ATOM 1960 CG LEU B 62 -11.198 43.821 27.275 1.00 20.34 C ATOM 1961 CD1 LEU B 62 -10.609 43.636 25.886 1.00 63.14 C ATOM 1962 CD2 LEU B 62 -12.716 43.732 27.230 1.00 2.40 C ATOM 0 H LEU B 62 -7.488 42.832 27.970 1.00 74.24 H new ATOM 0 HA LEU B 62 -9.077 44.195 28.708 1.00 55.24 H new ATOM 0 HB2 LEU B 62 -10.473 41.853 27.694 1.00 73.41 H new ATOM 0 HB3 LEU B 62 -11.378 42.579 29.007 1.00 73.41 H new ATOM 0 HG LEU B 62 -10.923 44.813 27.634 1.00 20.34 H new ATOM 0 HD11 LEU B 62 -11.026 44.384 25.212 1.00 63.14 H new ATOM 0 HD12 LEU B 62 -9.526 43.751 25.932 1.00 63.14 H new ATOM 0 HD13 LEU B 62 -10.852 42.640 25.517 1.00 63.14 H new ATOM 0 HD21 LEU B 62 -13.104 44.479 26.537 1.00 2.40 H new ATOM 0 HD22 LEU B 62 -13.012 42.738 26.896 1.00 2.40 H new ATOM 0 HD23 LEU B 62 -13.121 43.916 28.225 1.00 2.40 H new TER 1974 LEU B 62