USER MOD reduce.3.24.130724 H: found=0, std=0, add=786, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 632 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+ -146:sc= -0.0987 (180deg=-0.849) USER MOD Single : A 2 SER OG : rot 180:sc= -0.0984 USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 LYS NZ :NH3+ 151:sc= -0.0606 (180deg=-0.475) USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 SER OG : rot 180:sc= 0.161 USER MOD Single : A 22 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 23 LYS NZ :NH3+ -107:sc= -0.0909 (180deg=-0.648) USER MOD Single : A 24 SER OG : rot 180:sc= 0 USER MOD Single : A 25 TYR OH : rot 180:sc= 0 USER MOD Single : A 28 GLN : amide:sc= -0.654 X(o=-0.65,f=-0.38) USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 TYR OH : rot 180:sc= 0 USER MOD Single : A 34 THR OG1 : rot 160:sc= -0.722 USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 GLN : amide:sc= -0.189 K(o=-0.19,f=-1.1) USER MOD Single : A 49 ASN : amide:sc= -1.13 K(o=-1.1,f=0.1) USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 57 HIS : no HD1:sc= 0 X(o=0,f=-0.021) USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 ASN : amide:sc= -0.465 K(o=-0.46,f=-1.1) USER MOD Single : A 70 GLN : amide:sc= 0 K(o=0,f=-1.3!) USER MOD Single : A 73 SER OG : rot 180:sc= 0 USER MOD Single : A 77 GLN : amide:sc= 0 X(o=0,f=-0.48) USER MOD Single : A 81 TYR OH : rot 180:sc= 0 USER MOD Single : A 82 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 ASN : amide:sc= -0.121 X(o=-0.12,f=-0.58) USER MOD Single : A 95 TYR OH : rot 180:sc= 0 USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 101 HIS : no HD1:sc= -0.328 X(o=-0.33,f=-0.3) USER MOD Single : A 107 THR OG1 : rot 180:sc= 0 USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 72.902 -14.425 44.722 1.00 0.00 N ATOM 2 CA MET A 1 74.220 -14.635 44.132 1.00 0.00 C ATOM 3 C MET A 1 74.327 -13.935 42.782 1.00 0.00 C ATOM 4 O MET A 1 74.311 -14.583 41.735 1.00 0.00 O ATOM 5 CB MET A 1 74.497 -16.131 43.971 1.00 0.00 C ATOM 6 CG MET A 1 74.429 -16.906 45.276 1.00 0.00 C ATOM 7 SD MET A 1 73.454 -18.417 45.136 1.00 0.00 S ATOM 8 CE MET A 1 73.534 -19.029 46.817 1.00 0.00 C ATOM 0 H1 MET A 1 72.990 -14.366 45.757 1.00 0.00 H new ATOM 0 H2 MET A 1 72.496 -13.539 44.358 1.00 0.00 H new ATOM 0 H3 MET A 1 72.279 -15.220 44.472 1.00 0.00 H new ATOM 0 HA MET A 1 74.965 -14.207 44.802 1.00 0.00 H new ATOM 0 HB2 MET A 1 73.776 -16.552 43.270 1.00 0.00 H new ATOM 0 HB3 MET A 1 75.485 -16.264 43.530 1.00 0.00 H new ATOM 0 HG2 MET A 1 75.439 -17.159 45.597 1.00 0.00 H new ATOM 0 HG3 MET A 1 73.998 -16.270 46.050 1.00 0.00 H new ATOM 0 HE1 MET A 1 72.976 -19.962 46.891 1.00 0.00 H new ATOM 0 HE2 MET A 1 74.574 -19.206 47.091 1.00 0.00 H new ATOM 0 HE3 MET A 1 73.101 -18.292 47.493 1.00 0.00 H new ATOM 16 N SER A 2 74.439 -12.611 42.813 1.00 0.00 N ATOM 17 CA SER A 2 74.546 -11.825 41.590 1.00 0.00 C ATOM 18 C SER A 2 74.880 -10.370 41.908 1.00 0.00 C ATOM 19 O SER A 2 75.195 -10.029 43.046 1.00 0.00 O ATOM 20 CB SER A 2 73.240 -11.897 40.795 1.00 0.00 C ATOM 21 OG SER A 2 72.388 -10.812 41.113 1.00 0.00 O ATOM 0 H SER A 2 74.458 -12.060 43.671 1.00 0.00 H new ATOM 0 HA SER A 2 75.353 -12.243 40.988 1.00 0.00 H new ATOM 0 HB2 SER A 2 73.460 -11.890 39.727 1.00 0.00 H new ATOM 0 HB3 SER A 2 72.732 -12.837 41.009 1.00 0.00 H new ATOM 0 HG SER A 2 71.562 -10.881 40.590 1.00 0.00 H new ATOM 26 N ASP A 3 74.808 -9.517 40.890 1.00 0.00 N ATOM 27 CA ASP A 3 75.100 -8.099 41.060 1.00 0.00 C ATOM 28 C ASP A 3 74.128 -7.457 42.044 1.00 0.00 C ATOM 29 O ASP A 3 73.294 -8.137 42.641 1.00 0.00 O ATOM 30 CB ASP A 3 75.033 -7.379 39.712 1.00 0.00 C ATOM 31 CG ASP A 3 73.610 -7.225 39.209 1.00 0.00 C ATOM 32 OD1 ASP A 3 72.732 -7.982 39.675 1.00 0.00 O ATOM 33 OD2 ASP A 3 73.377 -6.350 38.351 1.00 0.00 O ATOM 0 H ASP A 3 74.550 -9.784 39.940 1.00 0.00 H new ATOM 0 HA ASP A 3 76.108 -8.006 41.463 1.00 0.00 H new ATOM 0 HB2 ASP A 3 75.491 -6.394 39.806 1.00 0.00 H new ATOM 0 HB3 ASP A 3 75.617 -7.933 38.978 1.00 0.00 H new ATOM 37 N ALA A 4 74.244 -6.144 42.210 1.00 0.00 N ATOM 38 CA ALA A 4 73.374 -5.410 43.121 1.00 0.00 C ATOM 39 C ALA A 4 73.022 -4.036 42.558 1.00 0.00 C ATOM 40 O ALA A 4 73.423 -3.688 41.448 1.00 0.00 O ATOM 41 CB ALA A 4 74.037 -5.269 44.484 1.00 0.00 C ATOM 0 H ALA A 4 74.932 -5.567 41.726 1.00 0.00 H new ATOM 0 HA ALA A 4 72.449 -5.975 43.235 1.00 0.00 H new ATOM 0 HB1 ALA A 4 73.377 -4.719 45.155 1.00 0.00 H new ATOM 0 HB2 ALA A 4 74.232 -6.258 44.898 1.00 0.00 H new ATOM 0 HB3 ALA A 4 74.977 -4.729 44.377 1.00 0.00 H new ATOM 47 N GLY A 5 72.268 -3.261 43.329 1.00 0.00 N ATOM 48 CA GLY A 5 71.874 -1.936 42.889 1.00 0.00 C ATOM 49 C GLY A 5 71.249 -1.117 44.003 1.00 0.00 C ATOM 50 O GLY A 5 71.070 -1.608 45.118 1.00 0.00 O ATOM 0 H GLY A 5 71.922 -3.527 44.251 1.00 0.00 H new ATOM 0 HA2 GLY A 5 72.747 -1.411 42.502 1.00 0.00 H new ATOM 0 HA3 GLY A 5 71.165 -2.026 42.066 1.00 0.00 H new ATOM 54 N ARG A 6 70.919 0.135 43.701 1.00 0.00 N ATOM 55 CA ARG A 6 70.314 1.024 44.684 1.00 0.00 C ATOM 56 C ARG A 6 71.191 1.135 45.928 1.00 0.00 C ATOM 57 O ARG A 6 72.286 0.573 45.983 1.00 0.00 O ATOM 58 CB ARG A 6 68.922 0.519 45.072 1.00 0.00 C ATOM 59 CG ARG A 6 68.075 0.095 43.884 1.00 0.00 C ATOM 60 CD ARG A 6 66.601 0.026 44.247 1.00 0.00 C ATOM 61 NE ARG A 6 66.085 -1.338 44.188 1.00 0.00 N ATOM 62 CZ ARG A 6 66.248 -2.228 45.160 1.00 0.00 C ATOM 63 NH1 ARG A 6 66.907 -1.899 46.262 1.00 0.00 N ATOM 64 NH2 ARG A 6 65.748 -3.451 45.033 1.00 0.00 N ATOM 0 H ARG A 6 71.061 0.556 42.783 1.00 0.00 H new ATOM 0 HA ARG A 6 70.222 2.013 44.235 1.00 0.00 H new ATOM 0 HB2 ARG A 6 69.028 -0.326 45.752 1.00 0.00 H new ATOM 0 HB3 ARG A 6 68.399 1.304 45.618 1.00 0.00 H new ATOM 0 HG2 ARG A 6 68.216 0.800 43.065 1.00 0.00 H new ATOM 0 HG3 ARG A 6 68.409 -0.879 43.527 1.00 0.00 H new ATOM 0 HD2 ARG A 6 66.456 0.425 45.251 1.00 0.00 H new ATOM 0 HD3 ARG A 6 66.031 0.659 43.567 1.00 0.00 H new ATOM 0 HE ARG A 6 65.571 -1.623 43.354 1.00 0.00 H new ATOM 0 HH11 ARG A 6 67.291 -0.960 46.365 1.00 0.00 H new ATOM 0 HH12 ARG A 6 67.030 -2.585 47.007 1.00 0.00 H new ATOM 0 HH21 ARG A 6 65.238 -3.708 44.188 1.00 0.00 H new ATOM 0 HH22 ARG A 6 65.874 -4.134 45.780 1.00 0.00 H new ATOM 75 N LYS A 7 70.704 1.863 46.927 1.00 0.00 N ATOM 76 CA LYS A 7 71.441 2.050 48.170 1.00 0.00 C ATOM 77 C LYS A 7 72.750 2.790 47.921 1.00 0.00 C ATOM 78 O LYS A 7 73.232 2.857 46.791 1.00 0.00 O ATOM 79 CB LYS A 7 71.726 0.695 48.826 1.00 0.00 C ATOM 80 CG LYS A 7 70.515 -0.220 48.881 1.00 0.00 C ATOM 81 CD LYS A 7 70.861 -1.567 49.493 1.00 0.00 C ATOM 82 CE LYS A 7 71.203 -2.594 48.423 1.00 0.00 C ATOM 83 NZ LYS A 7 71.877 -3.791 48.999 1.00 0.00 N ATOM 0 H LYS A 7 69.800 2.334 46.899 1.00 0.00 H new ATOM 0 HA LYS A 7 70.827 2.651 48.841 1.00 0.00 H new ATOM 0 HB2 LYS A 7 72.524 0.195 48.277 1.00 0.00 H new ATOM 0 HB3 LYS A 7 72.092 0.861 49.839 1.00 0.00 H new ATOM 0 HG2 LYS A 7 69.726 0.254 49.465 1.00 0.00 H new ATOM 0 HG3 LYS A 7 70.123 -0.367 47.875 1.00 0.00 H new ATOM 0 HD2 LYS A 7 71.706 -1.453 50.173 1.00 0.00 H new ATOM 0 HD3 LYS A 7 70.020 -1.925 50.087 1.00 0.00 H new ATOM 0 HE2 LYS A 7 70.292 -2.902 47.910 1.00 0.00 H new ATOM 0 HE3 LYS A 7 71.851 -2.137 47.675 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 72.094 -4.467 48.239 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 72.760 -3.501 49.466 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 71.249 -4.242 49.695 1.00 0.00 H new ATOM 93 N GLY A 8 73.323 3.344 48.985 1.00 0.00 N ATOM 94 CA GLY A 8 74.572 4.072 48.860 1.00 0.00 C ATOM 95 C GLY A 8 74.379 5.467 48.298 1.00 0.00 C ATOM 96 O GLY A 8 74.708 6.458 48.949 1.00 0.00 O ATOM 0 H GLY A 8 72.945 3.302 49.931 1.00 0.00 H new ATOM 0 HA2 GLY A 8 75.048 4.141 49.838 1.00 0.00 H new ATOM 0 HA3 GLY A 8 75.250 3.515 48.214 1.00 0.00 H new ATOM 100 N PHE A 9 73.842 5.543 47.085 1.00 0.00 N ATOM 101 CA PHE A 9 73.606 6.827 46.434 1.00 0.00 C ATOM 102 C PHE A 9 72.240 7.389 46.818 1.00 0.00 C ATOM 103 O PHE A 9 72.016 8.597 46.761 1.00 0.00 O ATOM 104 CB PHE A 9 73.699 6.676 44.914 1.00 0.00 C ATOM 105 CG PHE A 9 74.687 7.612 44.278 1.00 0.00 C ATOM 106 CD1 PHE A 9 75.994 7.675 44.732 1.00 0.00 C ATOM 107 CD2 PHE A 9 74.307 8.431 43.225 1.00 0.00 C ATOM 108 CE1 PHE A 9 76.904 8.537 44.150 1.00 0.00 C ATOM 109 CE2 PHE A 9 75.212 9.295 42.638 1.00 0.00 C ATOM 110 CZ PHE A 9 76.514 9.347 43.100 1.00 0.00 C ATOM 0 H PHE A 9 73.562 4.732 46.533 1.00 0.00 H new ATOM 0 HA PHE A 9 74.373 7.524 46.771 1.00 0.00 H new ATOM 0 HB2 PHE A 9 73.977 5.650 44.675 1.00 0.00 H new ATOM 0 HB3 PHE A 9 72.715 6.849 44.479 1.00 0.00 H new ATOM 0 HD1 PHE A 9 76.306 7.043 45.550 1.00 0.00 H new ATOM 0 HD2 PHE A 9 73.291 8.393 42.859 1.00 0.00 H new ATOM 0 HE1 PHE A 9 77.919 8.578 44.515 1.00 0.00 H new ATOM 0 HE2 PHE A 9 74.903 9.928 41.820 1.00 0.00 H new ATOM 0 HZ PHE A 9 77.225 10.019 42.642 1.00 0.00 H new ATOM 119 N GLY A 10 71.330 6.501 47.207 1.00 0.00 N ATOM 120 CA GLY A 10 69.997 6.927 47.594 1.00 0.00 C ATOM 121 C GLY A 10 70.017 7.936 48.725 1.00 0.00 C ATOM 122 O GLY A 10 69.473 9.031 48.597 1.00 0.00 O ATOM 0 H GLY A 10 71.492 5.495 47.261 1.00 0.00 H new ATOM 0 HA2 GLY A 10 69.493 7.363 46.731 1.00 0.00 H new ATOM 0 HA3 GLY A 10 69.415 6.057 47.897 1.00 0.00 H new ATOM 126 N GLU A 11 70.643 7.564 49.837 1.00 0.00 N ATOM 127 CA GLU A 11 70.728 8.444 50.996 1.00 0.00 C ATOM 128 C GLU A 11 71.292 9.807 50.605 1.00 0.00 C ATOM 129 O GLU A 11 70.707 10.846 50.911 1.00 0.00 O ATOM 130 CB GLU A 11 71.600 7.812 52.082 1.00 0.00 C ATOM 131 CG GLU A 11 70.862 7.560 53.386 1.00 0.00 C ATOM 132 CD GLU A 11 71.637 8.042 54.598 1.00 0.00 C ATOM 133 OE1 GLU A 11 71.799 9.271 54.748 1.00 0.00 O ATOM 134 OE2 GLU A 11 72.080 7.190 55.396 1.00 0.00 O ATOM 0 H GLU A 11 71.098 6.660 49.960 1.00 0.00 H new ATOM 0 HA GLU A 11 69.720 8.585 51.386 1.00 0.00 H new ATOM 0 HB2 GLU A 11 71.999 6.868 51.712 1.00 0.00 H new ATOM 0 HB3 GLU A 11 72.452 8.463 52.277 1.00 0.00 H new ATOM 0 HG2 GLU A 11 69.895 8.062 53.355 1.00 0.00 H new ATOM 0 HG3 GLU A 11 70.664 6.493 53.487 1.00 0.00 H new ATOM 139 N LYS A 12 72.435 9.794 49.926 1.00 0.00 N ATOM 140 CA LYS A 12 73.079 11.028 49.489 1.00 0.00 C ATOM 141 C LYS A 12 72.162 11.825 48.568 1.00 0.00 C ATOM 142 O LYS A 12 72.028 13.040 48.710 1.00 0.00 O ATOM 143 CB LYS A 12 74.394 10.714 48.772 1.00 0.00 C ATOM 144 CG LYS A 12 75.290 9.756 49.537 1.00 0.00 C ATOM 145 CD LYS A 12 75.578 10.263 50.942 1.00 0.00 C ATOM 146 CE LYS A 12 77.068 10.236 51.249 1.00 0.00 C ATOM 147 NZ LYS A 12 77.839 11.113 50.325 1.00 0.00 N ATOM 0 H LYS A 12 72.934 8.943 49.667 1.00 0.00 H new ATOM 0 HA LYS A 12 73.289 11.631 50.372 1.00 0.00 H new ATOM 0 HB2 LYS A 12 74.172 10.288 47.794 1.00 0.00 H new ATOM 0 HB3 LYS A 12 74.935 11.644 48.599 1.00 0.00 H new ATOM 0 HG2 LYS A 12 74.814 8.777 49.593 1.00 0.00 H new ATOM 0 HG3 LYS A 12 76.228 9.624 48.997 1.00 0.00 H new ATOM 0 HD2 LYS A 12 75.202 11.281 51.047 1.00 0.00 H new ATOM 0 HD3 LYS A 12 75.044 9.650 51.668 1.00 0.00 H new ATOM 0 HE2 LYS A 12 77.233 10.557 52.277 1.00 0.00 H new ATOM 0 HE3 LYS A 12 77.437 9.213 51.172 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 78.690 11.464 50.809 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 78.118 10.570 49.483 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 77.248 11.919 50.037 1.00 0.00 H new ATOM 157 N ALA A 13 71.530 11.134 47.626 1.00 0.00 N ATOM 158 CA ALA A 13 70.624 11.777 46.684 1.00 0.00 C ATOM 159 C ALA A 13 69.579 12.615 47.413 1.00 0.00 C ATOM 160 O ALA A 13 69.426 13.805 47.144 1.00 0.00 O ATOM 161 CB ALA A 13 69.949 10.735 45.805 1.00 0.00 C ATOM 0 H ALA A 13 71.629 10.127 47.495 1.00 0.00 H new ATOM 0 HA ALA A 13 71.210 12.444 46.052 1.00 0.00 H new ATOM 0 HB1 ALA A 13 69.275 11.230 45.106 1.00 0.00 H new ATOM 0 HB2 ALA A 13 70.706 10.182 45.249 1.00 0.00 H new ATOM 0 HB3 ALA A 13 69.381 10.045 46.429 1.00 0.00 H new ATOM 167 N SER A 14 68.861 11.984 48.338 1.00 0.00 N ATOM 168 CA SER A 14 67.827 12.669 49.102 1.00 0.00 C ATOM 169 C SER A 14 68.420 13.826 49.903 1.00 0.00 C ATOM 170 O SER A 14 67.754 14.832 50.145 1.00 0.00 O ATOM 171 CB SER A 14 67.124 11.690 50.044 1.00 0.00 C ATOM 172 OG SER A 14 65.914 11.217 49.479 1.00 0.00 O ATOM 0 H SER A 14 68.978 10.999 48.575 1.00 0.00 H new ATOM 0 HA SER A 14 67.098 13.072 48.399 1.00 0.00 H new ATOM 0 HB2 SER A 14 67.783 10.848 50.256 1.00 0.00 H new ATOM 0 HB3 SER A 14 66.917 12.181 50.995 1.00 0.00 H new ATOM 0 HG SER A 14 65.485 10.592 50.100 1.00 0.00 H new ATOM 177 N GLU A 15 69.675 13.673 50.308 1.00 0.00 N ATOM 178 CA GLU A 15 70.357 14.703 51.082 1.00 0.00 C ATOM 179 C GLU A 15 70.672 15.918 50.213 1.00 0.00 C ATOM 180 O GLU A 15 70.635 17.055 50.680 1.00 0.00 O ATOM 181 CB GLU A 15 71.648 14.148 51.688 1.00 0.00 C ATOM 182 CG GLU A 15 71.418 13.227 52.874 1.00 0.00 C ATOM 183 CD GLU A 15 72.162 13.679 54.116 1.00 0.00 C ATOM 184 OE1 GLU A 15 73.329 13.271 54.291 1.00 0.00 O ATOM 185 OE2 GLU A 15 71.577 14.442 54.913 1.00 0.00 O ATOM 0 H GLU A 15 70.241 12.847 50.114 1.00 0.00 H new ATOM 0 HA GLU A 15 69.692 15.015 51.887 1.00 0.00 H new ATOM 0 HB2 GLU A 15 72.196 13.605 50.918 1.00 0.00 H new ATOM 0 HB3 GLU A 15 72.279 14.980 52.002 1.00 0.00 H new ATOM 0 HG2 GLU A 15 70.351 13.180 53.091 1.00 0.00 H new ATOM 0 HG3 GLU A 15 71.735 12.217 52.612 1.00 0.00 H new ATOM 190 N ALA A 16 70.984 15.665 48.946 1.00 0.00 N ATOM 191 CA ALA A 16 71.304 16.736 48.010 1.00 0.00 C ATOM 192 C ALA A 16 70.093 17.632 47.765 1.00 0.00 C ATOM 193 O ALA A 16 70.133 18.834 48.029 1.00 0.00 O ATOM 194 CB ALA A 16 71.809 16.157 46.697 1.00 0.00 C ATOM 0 H ALA A 16 71.022 14.728 48.544 1.00 0.00 H new ATOM 0 HA ALA A 16 72.092 17.347 48.451 1.00 0.00 H new ATOM 0 HB1 ALA A 16 72.044 16.968 46.008 1.00 0.00 H new ATOM 0 HB2 ALA A 16 72.706 15.566 46.881 1.00 0.00 H new ATOM 0 HB3 ALA A 16 71.039 15.521 46.260 1.00 0.00 H new ATOM 200 N LEU A 17 69.019 17.037 47.258 1.00 0.00 N ATOM 201 CA LEU A 17 67.796 17.781 46.975 1.00 0.00 C ATOM 202 C LEU A 17 67.296 18.502 48.225 1.00 0.00 C ATOM 203 O LEU A 17 66.935 19.679 48.173 1.00 0.00 O ATOM 204 CB LEU A 17 66.711 16.839 46.450 1.00 0.00 C ATOM 205 CG LEU A 17 66.655 15.455 47.097 1.00 0.00 C ATOM 206 CD1 LEU A 17 65.329 15.257 47.818 1.00 0.00 C ATOM 207 CD2 LEU A 17 66.862 14.368 46.052 1.00 0.00 C ATOM 0 H LEU A 17 68.970 16.043 47.035 1.00 0.00 H new ATOM 0 HA LEU A 17 68.022 18.526 46.212 1.00 0.00 H new ATOM 0 HB2 LEU A 17 65.743 17.321 46.585 1.00 0.00 H new ATOM 0 HB3 LEU A 17 66.856 16.711 45.377 1.00 0.00 H new ATOM 0 HG LEU A 17 67.459 15.385 47.829 1.00 0.00 H new ATOM 0 HD11 LEU A 17 65.306 14.267 48.273 1.00 0.00 H new ATOM 0 HD12 LEU A 17 65.220 16.015 48.594 1.00 0.00 H new ATOM 0 HD13 LEU A 17 64.510 15.347 47.105 1.00 0.00 H new ATOM 0 HD21 LEU A 17 66.819 13.390 46.531 1.00 0.00 H new ATOM 0 HD22 LEU A 17 66.080 14.437 45.296 1.00 0.00 H new ATOM 0 HD23 LEU A 17 67.836 14.498 45.580 1.00 0.00 H new ATOM 218 N LYS A 18 67.281 17.789 49.346 1.00 0.00 N ATOM 219 CA LYS A 18 66.831 18.360 50.610 1.00 0.00 C ATOM 220 C LYS A 18 67.495 19.710 50.864 1.00 0.00 C ATOM 221 O LYS A 18 68.685 19.794 51.173 1.00 0.00 O ATOM 222 CB LYS A 18 67.135 17.404 51.763 1.00 0.00 C ATOM 223 CG LYS A 18 65.923 16.626 52.246 1.00 0.00 C ATOM 224 CD LYS A 18 65.254 15.875 51.107 1.00 0.00 C ATOM 225 CE LYS A 18 63.826 16.354 50.886 1.00 0.00 C ATOM 226 NZ LYS A 18 62.887 15.780 51.887 1.00 0.00 N ATOM 0 H LYS A 18 67.575 16.814 49.405 1.00 0.00 H new ATOM 0 HA LYS A 18 65.753 18.511 50.548 1.00 0.00 H new ATOM 0 HB2 LYS A 18 67.905 16.700 51.447 1.00 0.00 H new ATOM 0 HB3 LYS A 18 67.546 17.973 52.597 1.00 0.00 H new ATOM 0 HG2 LYS A 18 66.227 15.921 53.020 1.00 0.00 H new ATOM 0 HG3 LYS A 18 65.208 17.311 52.702 1.00 0.00 H new ATOM 0 HD2 LYS A 18 65.830 16.011 50.192 1.00 0.00 H new ATOM 0 HD3 LYS A 18 65.251 14.807 51.326 1.00 0.00 H new ATOM 0 HE2 LYS A 18 63.795 17.442 50.942 1.00 0.00 H new ATOM 0 HE3 LYS A 18 63.501 16.077 49.883 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 61.926 16.131 51.702 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 62.897 14.742 51.817 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 63.182 16.065 52.843 1.00 0.00 H new ATOM 236 N PRO A 19 66.711 20.790 50.737 1.00 0.00 N ATOM 237 CA PRO A 19 67.203 22.154 50.952 1.00 0.00 C ATOM 238 C PRO A 19 67.516 22.434 52.418 1.00 0.00 C ATOM 239 O PRO A 19 67.501 21.526 53.249 1.00 0.00 O ATOM 240 CB PRO A 19 66.040 23.030 50.477 1.00 0.00 C ATOM 241 CG PRO A 19 64.831 22.173 50.637 1.00 0.00 C ATOM 242 CD PRO A 19 65.285 20.764 50.373 1.00 0.00 C ATOM 0 HA PRO A 19 68.138 22.338 50.422 1.00 0.00 H new ATOM 0 HB2 PRO A 19 65.962 23.940 51.071 1.00 0.00 H new ATOM 0 HB3 PRO A 19 66.173 23.337 49.440 1.00 0.00 H new ATOM 0 HG2 PRO A 19 64.415 22.268 51.640 1.00 0.00 H new ATOM 0 HG3 PRO A 19 64.048 22.468 49.938 1.00 0.00 H new ATOM 0 HD2 PRO A 19 64.730 20.044 50.974 1.00 0.00 H new ATOM 0 HD3 PRO A 19 65.142 20.485 49.329 1.00 0.00 H new ATOM 247 N ASP A 20 67.798 23.695 52.728 1.00 0.00 N ATOM 248 CA ASP A 20 68.112 24.093 54.095 1.00 0.00 C ATOM 249 C ASP A 20 66.986 23.706 55.048 1.00 0.00 C ATOM 250 O ASP A 20 65.959 23.173 54.626 1.00 0.00 O ATOM 251 CB ASP A 20 68.360 25.601 54.164 1.00 0.00 C ATOM 252 CG ASP A 20 67.340 26.393 53.368 1.00 0.00 C ATOM 253 OD1 ASP A 20 66.138 26.067 53.453 1.00 0.00 O ATOM 254 OD2 ASP A 20 67.745 27.338 52.661 1.00 0.00 O ATOM 0 H ASP A 20 67.816 24.458 52.052 1.00 0.00 H new ATOM 0 HA ASP A 20 69.017 23.568 54.401 1.00 0.00 H new ATOM 0 HB2 ASP A 20 68.334 25.923 55.205 1.00 0.00 H new ATOM 0 HB3 ASP A 20 69.359 25.819 53.788 1.00 0.00 H new ATOM 258 N SER A 21 67.185 23.977 56.332 1.00 0.00 N ATOM 259 CA SER A 21 66.188 23.653 57.347 1.00 0.00 C ATOM 260 C SER A 21 64.902 24.440 57.116 1.00 0.00 C ATOM 261 O SER A 21 64.758 25.129 56.106 1.00 0.00 O ATOM 262 CB SER A 21 66.736 23.946 58.744 1.00 0.00 C ATOM 263 OG SER A 21 68.108 24.296 58.691 1.00 0.00 O ATOM 0 H SER A 21 68.028 24.421 56.696 1.00 0.00 H new ATOM 0 HA SER A 21 65.961 22.590 57.271 1.00 0.00 H new ATOM 0 HB2 SER A 21 66.168 24.758 59.198 1.00 0.00 H new ATOM 0 HB3 SER A 21 66.605 23.071 59.380 1.00 0.00 H new ATOM 0 HG SER A 21 68.434 24.480 59.597 1.00 0.00 H new ATOM 268 N GLN A 22 63.972 24.333 58.059 1.00 0.00 N ATOM 269 CA GLN A 22 62.698 25.033 57.958 1.00 0.00 C ATOM 270 C GLN A 22 62.914 26.538 57.831 1.00 0.00 C ATOM 271 O GLN A 22 63.791 27.108 58.478 1.00 0.00 O ATOM 272 CB GLN A 22 61.829 24.734 59.181 1.00 0.00 C ATOM 273 CG GLN A 22 61.724 23.251 59.503 1.00 0.00 C ATOM 274 CD GLN A 22 60.335 22.851 59.961 1.00 0.00 C ATOM 275 OE1 GLN A 22 60.118 22.557 61.138 1.00 0.00 O ATOM 276 NE2 GLN A 22 59.387 22.836 59.034 1.00 0.00 N ATOM 0 H GLN A 22 64.077 23.768 58.902 1.00 0.00 H new ATOM 0 HA GLN A 22 62.187 24.679 57.062 1.00 0.00 H new ATOM 0 HB2 GLN A 22 62.239 25.257 60.045 1.00 0.00 H new ATOM 0 HB3 GLN A 22 60.829 25.133 59.012 1.00 0.00 H new ATOM 0 HG2 GLN A 22 61.992 22.671 58.620 1.00 0.00 H new ATOM 0 HG3 GLN A 22 62.445 23.000 60.281 1.00 0.00 H new ATOM 0 HE21 GLN A 22 59.611 23.087 58.071 1.00 0.00 H new ATOM 0 HE22 GLN A 22 58.434 22.574 59.284 1.00 0.00 H new ATOM 283 N LYS A 23 62.107 27.178 56.991 1.00 0.00 N ATOM 284 CA LYS A 23 62.207 28.616 56.777 1.00 0.00 C ATOM 285 C LYS A 23 60.902 29.314 57.147 1.00 0.00 C ATOM 286 O LYS A 23 59.921 28.664 57.509 1.00 0.00 O ATOM 287 CB LYS A 23 62.558 28.912 55.317 1.00 0.00 C ATOM 288 CG LYS A 23 63.913 28.370 54.896 1.00 0.00 C ATOM 289 CD LYS A 23 65.024 28.876 55.802 1.00 0.00 C ATOM 290 CE LYS A 23 66.350 28.962 55.063 1.00 0.00 C ATOM 291 NZ LYS A 23 67.192 30.083 55.564 1.00 0.00 N ATOM 0 H LYS A 23 61.375 26.722 56.447 1.00 0.00 H new ATOM 0 HA LYS A 23 62.999 28.999 57.421 1.00 0.00 H new ATOM 0 HB2 LYS A 23 61.789 28.485 54.673 1.00 0.00 H new ATOM 0 HB3 LYS A 23 62.542 29.990 55.160 1.00 0.00 H new ATOM 0 HG2 LYS A 23 63.893 27.280 54.918 1.00 0.00 H new ATOM 0 HG3 LYS A 23 64.119 28.664 53.867 1.00 0.00 H new ATOM 0 HD2 LYS A 23 64.759 29.859 56.191 1.00 0.00 H new ATOM 0 HD3 LYS A 23 65.127 28.211 56.660 1.00 0.00 H new ATOM 0 HE2 LYS A 23 66.891 28.023 55.177 1.00 0.00 H new ATOM 0 HE3 LYS A 23 66.164 29.096 53.997 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 67.204 30.849 54.861 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 66.799 30.439 56.458 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 68.162 29.744 55.723 1.00 0.00 H new ATOM 301 N SER A 24 60.899 30.639 57.054 1.00 0.00 N ATOM 302 CA SER A 24 59.714 31.425 57.382 1.00 0.00 C ATOM 303 C SER A 24 59.568 32.610 56.432 1.00 0.00 C ATOM 304 O SER A 24 60.268 32.702 55.425 1.00 0.00 O ATOM 305 CB SER A 24 59.790 31.922 58.828 1.00 0.00 C ATOM 306 OG SER A 24 58.536 31.797 59.476 1.00 0.00 O ATOM 0 H SER A 24 61.702 31.191 56.755 1.00 0.00 H new ATOM 0 HA SER A 24 58.840 30.783 57.271 1.00 0.00 H new ATOM 0 HB2 SER A 24 60.543 31.352 59.373 1.00 0.00 H new ATOM 0 HB3 SER A 24 60.108 32.965 58.841 1.00 0.00 H new ATOM 0 HG SER A 24 58.611 32.119 60.398 1.00 0.00 H new ATOM 311 N TYR A 25 58.653 33.515 56.763 1.00 0.00 N ATOM 312 CA TYR A 25 58.412 34.693 55.939 1.00 0.00 C ATOM 313 C TYR A 25 59.722 35.399 55.601 1.00 0.00 C ATOM 314 O TYR A 25 59.876 35.961 54.518 1.00 0.00 O ATOM 315 CB TYR A 25 57.469 35.660 56.658 1.00 0.00 C ATOM 316 CG TYR A 25 56.504 36.365 55.731 1.00 0.00 C ATOM 317 CD1 TYR A 25 55.492 35.665 55.087 1.00 0.00 C ATOM 318 CD2 TYR A 25 56.605 37.731 55.502 1.00 0.00 C ATOM 319 CE1 TYR A 25 54.608 36.305 54.240 1.00 0.00 C ATOM 320 CE2 TYR A 25 55.724 38.380 54.657 1.00 0.00 C ATOM 321 CZ TYR A 25 54.727 37.662 54.028 1.00 0.00 C ATOM 322 OH TYR A 25 53.850 38.304 53.185 1.00 0.00 O ATOM 0 H TYR A 25 58.067 33.455 57.596 1.00 0.00 H new ATOM 0 HA TYR A 25 57.946 34.366 55.009 1.00 0.00 H new ATOM 0 HB2 TYR A 25 56.902 35.110 57.410 1.00 0.00 H new ATOM 0 HB3 TYR A 25 58.062 36.406 57.188 1.00 0.00 H new ATOM 0 HD1 TYR A 25 55.394 34.602 55.251 1.00 0.00 H new ATOM 0 HD2 TYR A 25 57.384 38.296 55.992 1.00 0.00 H new ATOM 0 HE1 TYR A 25 53.828 35.745 53.746 1.00 0.00 H new ATOM 0 HE2 TYR A 25 55.815 39.443 54.490 1.00 0.00 H new ATOM 0 HH TYR A 25 54.072 39.258 53.147 1.00 0.00 H new ATOM 331 N ALA A 26 60.663 35.365 56.539 1.00 0.00 N ATOM 332 CA ALA A 26 61.961 35.998 56.341 1.00 0.00 C ATOM 333 C ALA A 26 62.592 35.557 55.025 1.00 0.00 C ATOM 334 O ALA A 26 63.110 36.379 54.269 1.00 0.00 O ATOM 335 CB ALA A 26 62.887 35.679 57.505 1.00 0.00 C ATOM 0 H ALA A 26 60.551 34.906 57.443 1.00 0.00 H new ATOM 0 HA ALA A 26 61.808 37.076 56.297 1.00 0.00 H new ATOM 0 HB1 ALA A 26 63.853 36.158 57.344 1.00 0.00 H new ATOM 0 HB2 ALA A 26 62.448 36.050 58.431 1.00 0.00 H new ATOM 0 HB3 ALA A 26 63.025 34.600 57.575 1.00 0.00 H new ATOM 341 N GLU A 27 62.547 34.256 54.758 1.00 0.00 N ATOM 342 CA GLU A 27 63.116 33.707 53.534 1.00 0.00 C ATOM 343 C GLU A 27 62.193 33.958 52.344 1.00 0.00 C ATOM 344 O GLU A 27 62.654 34.207 51.231 1.00 0.00 O ATOM 345 CB GLU A 27 63.369 32.205 53.690 1.00 0.00 C ATOM 346 CG GLU A 27 64.842 31.838 53.741 1.00 0.00 C ATOM 347 CD GLU A 27 65.321 31.168 52.468 1.00 0.00 C ATOM 348 OE1 GLU A 27 64.546 30.383 51.884 1.00 0.00 O ATOM 349 OE2 GLU A 27 66.470 31.430 52.055 1.00 0.00 O ATOM 0 H GLU A 27 62.122 33.562 55.373 1.00 0.00 H new ATOM 0 HA GLU A 27 64.065 34.210 53.348 1.00 0.00 H new ATOM 0 HB2 GLU A 27 62.885 31.856 54.602 1.00 0.00 H new ATOM 0 HB3 GLU A 27 62.901 31.678 52.859 1.00 0.00 H new ATOM 0 HG2 GLU A 27 65.431 32.738 53.917 1.00 0.00 H new ATOM 0 HG3 GLU A 27 65.018 31.172 54.586 1.00 0.00 H new ATOM 354 N GLN A 28 60.889 33.888 52.590 1.00 0.00 N ATOM 355 CA GLN A 28 59.901 34.106 51.539 1.00 0.00 C ATOM 356 C GLN A 28 60.101 35.466 50.879 1.00 0.00 C ATOM 357 O GLN A 28 60.189 35.566 49.655 1.00 0.00 O ATOM 358 CB GLN A 28 58.486 34.006 52.112 1.00 0.00 C ATOM 359 CG GLN A 28 58.202 32.684 52.807 1.00 0.00 C ATOM 360 CD GLN A 28 56.721 32.438 53.011 1.00 0.00 C ATOM 361 OE1 GLN A 28 55.977 33.342 53.395 1.00 0.00 O ATOM 362 NE2 GLN A 28 56.283 31.211 52.753 1.00 0.00 N ATOM 0 H GLN A 28 60.492 33.682 53.507 1.00 0.00 H new ATOM 0 HA GLN A 28 60.034 33.333 50.783 1.00 0.00 H new ATOM 0 HB2 GLN A 28 58.332 34.820 52.821 1.00 0.00 H new ATOM 0 HB3 GLN A 28 57.766 34.145 51.306 1.00 0.00 H new ATOM 0 HG2 GLN A 28 58.624 31.870 52.217 1.00 0.00 H new ATOM 0 HG3 GLN A 28 58.705 32.671 53.774 1.00 0.00 H new ATOM 0 HE21 GLN A 28 56.935 30.493 52.437 1.00 0.00 H new ATOM 0 HE22 GLN A 28 55.295 30.987 52.871 1.00 0.00 H new ATOM 369 N GLY A 29 60.171 36.511 51.697 1.00 0.00 N ATOM 370 CA GLY A 29 60.358 37.851 51.173 1.00 0.00 C ATOM 371 C GLY A 29 61.655 37.996 50.401 1.00 0.00 C ATOM 372 O GLY A 29 61.661 38.467 49.263 1.00 0.00 O ATOM 0 H GLY A 29 60.102 36.454 52.713 1.00 0.00 H new ATOM 0 HA2 GLY A 29 59.521 38.103 50.522 1.00 0.00 H new ATOM 0 HA3 GLY A 29 60.347 38.565 51.997 1.00 0.00 H new ATOM 376 N LYS A 30 62.758 37.590 51.021 1.00 0.00 N ATOM 377 CA LYS A 30 64.069 37.676 50.386 1.00 0.00 C ATOM 378 C LYS A 30 64.043 37.048 48.996 1.00 0.00 C ATOM 379 O LYS A 30 64.378 37.697 48.006 1.00 0.00 O ATOM 380 CB LYS A 30 65.124 36.983 51.251 1.00 0.00 C ATOM 381 CG LYS A 30 65.270 37.590 52.635 1.00 0.00 C ATOM 382 CD LYS A 30 65.918 36.616 53.604 1.00 0.00 C ATOM 383 CE LYS A 30 67.388 36.939 53.819 1.00 0.00 C ATOM 384 NZ LYS A 30 67.924 36.295 55.051 1.00 0.00 N ATOM 0 H LYS A 30 62.771 37.198 51.963 1.00 0.00 H new ATOM 0 HA LYS A 30 64.327 38.730 50.284 1.00 0.00 H new ATOM 0 HB2 LYS A 30 64.864 35.929 51.351 1.00 0.00 H new ATOM 0 HB3 LYS A 30 66.086 37.027 50.741 1.00 0.00 H new ATOM 0 HG2 LYS A 30 65.870 38.498 52.574 1.00 0.00 H new ATOM 0 HG3 LYS A 30 64.289 37.881 53.011 1.00 0.00 H new ATOM 0 HD2 LYS A 30 65.394 36.648 54.559 1.00 0.00 H new ATOM 0 HD3 LYS A 30 65.820 35.600 53.221 1.00 0.00 H new ATOM 0 HE2 LYS A 30 67.963 36.605 52.955 1.00 0.00 H new ATOM 0 HE3 LYS A 30 67.516 38.019 53.889 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 68.929 36.540 55.162 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 67.392 36.633 55.879 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 67.826 35.263 54.974 1.00 0.00 H new ATOM 394 N GLU A 31 63.641 35.783 48.930 1.00 0.00 N ATOM 395 CA GLU A 31 63.570 35.069 47.661 1.00 0.00 C ATOM 396 C GLU A 31 62.583 35.742 46.713 1.00 0.00 C ATOM 397 O GLU A 31 62.713 35.644 45.492 1.00 0.00 O ATOM 398 CB GLU A 31 63.160 33.612 47.892 1.00 0.00 C ATOM 399 CG GLU A 31 64.098 32.855 48.817 1.00 0.00 C ATOM 400 CD GLU A 31 63.525 31.526 49.270 1.00 0.00 C ATOM 401 OE1 GLU A 31 62.361 31.503 49.718 1.00 0.00 O ATOM 402 OE2 GLU A 31 64.243 30.509 49.173 1.00 0.00 O ATOM 0 H GLU A 31 63.360 35.232 49.741 1.00 0.00 H new ATOM 0 HA GLU A 31 64.559 35.092 47.204 1.00 0.00 H new ATOM 0 HB2 GLU A 31 62.154 33.589 48.310 1.00 0.00 H new ATOM 0 HB3 GLU A 31 63.118 33.099 46.931 1.00 0.00 H new ATOM 0 HG2 GLU A 31 65.045 32.683 48.306 1.00 0.00 H new ATOM 0 HG3 GLU A 31 64.315 33.470 49.691 1.00 0.00 H new ATOM 407 N TYR A 32 61.596 36.424 47.282 1.00 0.00 N ATOM 408 CA TYR A 32 60.584 37.111 46.488 1.00 0.00 C ATOM 409 C TYR A 32 61.202 38.256 45.690 1.00 0.00 C ATOM 410 O TYR A 32 60.937 38.409 44.498 1.00 0.00 O ATOM 411 CB TYR A 32 59.473 37.647 47.392 1.00 0.00 C ATOM 412 CG TYR A 32 58.296 38.216 46.633 1.00 0.00 C ATOM 413 CD1 TYR A 32 58.264 39.555 46.265 1.00 0.00 C ATOM 414 CD2 TYR A 32 57.215 37.415 46.284 1.00 0.00 C ATOM 415 CE1 TYR A 32 57.191 40.081 45.571 1.00 0.00 C ATOM 416 CE2 TYR A 32 56.139 37.931 45.591 1.00 0.00 C ATOM 417 CZ TYR A 32 56.130 39.264 45.237 1.00 0.00 C ATOM 418 OH TYR A 32 55.059 39.782 44.545 1.00 0.00 O ATOM 0 H TYR A 32 61.475 36.516 48.291 1.00 0.00 H new ATOM 0 HA TYR A 32 60.159 36.392 45.788 1.00 0.00 H new ATOM 0 HB2 TYR A 32 59.123 36.843 48.039 1.00 0.00 H new ATOM 0 HB3 TYR A 32 59.885 38.421 48.040 1.00 0.00 H new ATOM 0 HD1 TYR A 32 59.093 40.197 46.526 1.00 0.00 H new ATOM 0 HD2 TYR A 32 57.217 36.371 46.560 1.00 0.00 H new ATOM 0 HE1 TYR A 32 57.183 41.124 45.292 1.00 0.00 H new ATOM 0 HE2 TYR A 32 55.308 37.294 45.327 1.00 0.00 H new ATOM 0 HH TYR A 32 54.398 39.075 44.388 1.00 0.00 H new ATOM 427 N ILE A 33 62.029 39.054 46.357 1.00 0.00 N ATOM 428 CA ILE A 33 62.686 40.184 45.711 1.00 0.00 C ATOM 429 C ILE A 33 63.724 39.710 44.698 1.00 0.00 C ATOM 430 O ILE A 33 63.751 40.173 43.558 1.00 0.00 O ATOM 431 CB ILE A 33 63.372 41.101 46.741 1.00 0.00 C ATOM 432 CG1 ILE A 33 62.493 41.255 47.984 1.00 0.00 C ATOM 433 CG2 ILE A 33 63.671 42.458 46.125 1.00 0.00 C ATOM 434 CD1 ILE A 33 62.787 42.506 48.781 1.00 0.00 C ATOM 0 H ILE A 33 62.260 38.939 47.344 1.00 0.00 H new ATOM 0 HA ILE A 33 61.909 40.748 45.195 1.00 0.00 H new ATOM 0 HB ILE A 33 64.315 40.645 47.041 1.00 0.00 H new ATOM 0 HG12 ILE A 33 61.446 41.265 47.680 1.00 0.00 H new ATOM 0 HG13 ILE A 33 62.630 40.385 48.626 1.00 0.00 H new ATOM 0 HG21 ILE A 33 64.156 43.095 46.865 1.00 0.00 H new ATOM 0 HG22 ILE A 33 64.332 42.331 45.267 1.00 0.00 H new ATOM 0 HG23 ILE A 33 62.740 42.923 45.800 1.00 0.00 H new ATOM 0 HD11 ILE A 33 62.127 42.549 49.647 1.00 0.00 H new ATOM 0 HD12 ILE A 33 63.824 42.489 49.116 1.00 0.00 H new ATOM 0 HD13 ILE A 33 62.622 43.383 48.155 1.00 0.00 H new ATOM 445 N THR A 34 64.575 38.781 45.123 1.00 0.00 N ATOM 446 CA THR A 34 65.614 38.243 44.254 1.00 0.00 C ATOM 447 C THR A 34 65.036 37.799 42.916 1.00 0.00 C ATOM 448 O THR A 34 65.544 38.167 41.857 1.00 0.00 O ATOM 449 CB THR A 34 66.333 37.050 44.911 1.00 0.00 C ATOM 450 OG1 THR A 34 65.385 36.034 45.253 1.00 0.00 O ATOM 451 CG2 THR A 34 67.085 37.491 46.158 1.00 0.00 C ATOM 0 H THR A 34 64.565 38.386 46.063 1.00 0.00 H new ATOM 0 HA THR A 34 66.333 39.045 44.088 1.00 0.00 H new ATOM 0 HB THR A 34 67.051 36.649 44.196 1.00 0.00 H new ATOM 0 HG1 THR A 34 65.849 35.178 45.364 1.00 0.00 H new ATOM 0 HG21 THR A 34 67.585 36.631 46.605 1.00 0.00 H new ATOM 0 HG22 THR A 34 67.827 38.243 45.889 1.00 0.00 H new ATOM 0 HG23 THR A 34 66.383 37.915 46.875 1.00 0.00 H new ATOM 459 N ASP A 35 63.971 37.007 42.970 1.00 0.00 N ATOM 460 CA ASP A 35 63.323 36.514 41.760 1.00 0.00 C ATOM 461 C ASP A 35 62.903 37.671 40.859 1.00 0.00 C ATOM 462 O ASP A 35 62.940 37.563 39.634 1.00 0.00 O ATOM 463 CB ASP A 35 62.103 35.662 42.121 1.00 0.00 C ATOM 464 CG ASP A 35 61.954 34.454 41.217 1.00 0.00 C ATOM 465 OD1 ASP A 35 61.770 34.645 39.996 1.00 0.00 O ATOM 466 OD2 ASP A 35 62.021 33.319 41.729 1.00 0.00 O ATOM 0 H ASP A 35 63.538 36.693 43.838 1.00 0.00 H new ATOM 0 HA ASP A 35 64.040 35.897 41.218 1.00 0.00 H new ATOM 0 HB2 ASP A 35 62.188 35.330 43.156 1.00 0.00 H new ATOM 0 HB3 ASP A 35 61.204 36.274 42.056 1.00 0.00 H new ATOM 470 N LYS A 36 62.501 38.778 41.474 1.00 0.00 N ATOM 471 CA LYS A 36 62.073 39.955 40.729 1.00 0.00 C ATOM 472 C LYS A 36 63.261 40.635 40.057 1.00 0.00 C ATOM 473 O LYS A 36 63.185 41.033 38.895 1.00 0.00 O ATOM 474 CB LYS A 36 61.366 40.943 41.659 1.00 0.00 C ATOM 475 CG LYS A 36 60.119 40.376 42.316 1.00 0.00 C ATOM 476 CD LYS A 36 58.856 40.866 41.629 1.00 0.00 C ATOM 477 CE LYS A 36 57.782 41.239 42.641 1.00 0.00 C ATOM 478 NZ LYS A 36 56.849 42.269 42.104 1.00 0.00 N ATOM 0 H LYS A 36 62.463 38.884 42.488 1.00 0.00 H new ATOM 0 HA LYS A 36 61.377 39.631 39.955 1.00 0.00 H new ATOM 0 HB2 LYS A 36 62.063 41.261 42.435 1.00 0.00 H new ATOM 0 HB3 LYS A 36 61.094 41.833 41.091 1.00 0.00 H new ATOM 0 HG2 LYS A 36 60.153 39.287 42.284 1.00 0.00 H new ATOM 0 HG3 LYS A 36 60.098 40.663 43.367 1.00 0.00 H new ATOM 0 HD2 LYS A 36 59.090 41.731 41.009 1.00 0.00 H new ATOM 0 HD3 LYS A 36 58.477 40.090 40.964 1.00 0.00 H new ATOM 0 HE2 LYS A 36 57.219 40.348 42.918 1.00 0.00 H new ATOM 0 HE3 LYS A 36 58.253 41.614 43.550 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 56.132 42.496 42.822 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 57.382 43.129 41.863 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 56.380 41.902 41.251 1.00 0.00 H new ATOM 488 N ALA A 37 64.358 40.763 40.794 1.00 0.00 N ATOM 489 CA ALA A 37 65.564 41.392 40.269 1.00 0.00 C ATOM 490 C ALA A 37 66.204 40.530 39.186 1.00 0.00 C ATOM 491 O ALA A 37 66.927 41.033 38.324 1.00 0.00 O ATOM 492 CB ALA A 37 66.556 41.654 41.392 1.00 0.00 C ATOM 0 H ALA A 37 64.437 40.439 41.758 1.00 0.00 H new ATOM 0 HA ALA A 37 65.281 42.344 39.821 1.00 0.00 H new ATOM 0 HB1 ALA A 37 67.451 42.124 40.984 1.00 0.00 H new ATOM 0 HB2 ALA A 37 66.103 42.316 42.131 1.00 0.00 H new ATOM 0 HB3 ALA A 37 66.826 40.711 41.867 1.00 0.00 H new ATOM 498 N ASP A 38 65.935 39.230 39.234 1.00 0.00 N ATOM 499 CA ASP A 38 66.485 38.299 38.256 1.00 0.00 C ATOM 500 C ASP A 38 65.679 38.333 36.961 1.00 0.00 C ATOM 501 O ASP A 38 66.243 38.310 35.866 1.00 0.00 O ATOM 502 CB ASP A 38 66.498 36.878 38.824 1.00 0.00 C ATOM 503 CG ASP A 38 67.807 36.161 38.558 1.00 0.00 C ATOM 504 OD1 ASP A 38 68.103 35.885 37.377 1.00 0.00 O ATOM 505 OD2 ASP A 38 68.535 35.877 39.532 1.00 0.00 O ATOM 0 H ASP A 38 65.339 38.797 39.940 1.00 0.00 H new ATOM 0 HA ASP A 38 67.508 38.604 38.036 1.00 0.00 H new ATOM 0 HB2 ASP A 38 66.321 36.918 39.899 1.00 0.00 H new ATOM 0 HB3 ASP A 38 65.679 36.307 38.386 1.00 0.00 H new ATOM 509 N LYS A 39 64.359 38.388 37.091 1.00 0.00 N ATOM 510 CA LYS A 39 63.475 38.427 35.933 1.00 0.00 C ATOM 511 C LYS A 39 63.629 39.741 35.175 1.00 0.00 C ATOM 512 O LYS A 39 63.791 39.750 33.954 1.00 0.00 O ATOM 513 CB LYS A 39 62.020 38.244 36.369 1.00 0.00 C ATOM 514 CG LYS A 39 61.503 36.827 36.187 1.00 0.00 C ATOM 515 CD LYS A 39 60.341 36.778 35.209 1.00 0.00 C ATOM 516 CE LYS A 39 59.293 35.765 35.640 1.00 0.00 C ATOM 517 NZ LYS A 39 58.245 36.381 36.500 1.00 0.00 N ATOM 0 H LYS A 39 63.876 38.407 37.989 1.00 0.00 H new ATOM 0 HA LYS A 39 63.753 37.610 35.268 1.00 0.00 H new ATOM 0 HB2 LYS A 39 61.926 38.524 37.418 1.00 0.00 H new ATOM 0 HB3 LYS A 39 61.390 38.927 35.799 1.00 0.00 H new ATOM 0 HG2 LYS A 39 62.309 36.188 35.827 1.00 0.00 H new ATOM 0 HG3 LYS A 39 61.186 36.428 37.150 1.00 0.00 H new ATOM 0 HD2 LYS A 39 59.885 37.765 35.134 1.00 0.00 H new ATOM 0 HD3 LYS A 39 60.710 36.521 34.216 1.00 0.00 H new ATOM 0 HE2 LYS A 39 58.827 35.327 34.757 1.00 0.00 H new ATOM 0 HE3 LYS A 39 59.776 34.952 36.182 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 57.550 35.657 36.772 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 58.686 36.777 37.355 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 57.767 37.140 35.974 1.00 0.00 H new ATOM 527 N VAL A 40 63.578 40.850 35.905 1.00 0.00 N ATOM 528 CA VAL A 40 63.715 42.170 35.302 1.00 0.00 C ATOM 529 C VAL A 40 65.058 42.317 34.598 1.00 0.00 C ATOM 530 O VAL A 40 65.155 42.946 33.546 1.00 0.00 O ATOM 531 CB VAL A 40 63.573 43.286 36.354 1.00 0.00 C ATOM 532 CG1 VAL A 40 64.609 43.114 37.456 1.00 0.00 C ATOM 533 CG2 VAL A 40 63.700 44.653 35.701 1.00 0.00 C ATOM 0 H VAL A 40 63.443 40.861 36.916 1.00 0.00 H new ATOM 0 HA VAL A 40 62.913 42.267 34.570 1.00 0.00 H new ATOM 0 HB VAL A 40 62.583 43.215 36.803 1.00 0.00 H new ATOM 0 HG11 VAL A 40 64.494 43.911 38.191 1.00 0.00 H new ATOM 0 HG12 VAL A 40 64.466 42.149 37.942 1.00 0.00 H new ATOM 0 HG13 VAL A 40 65.609 43.159 37.025 1.00 0.00 H new ATOM 0 HG21 VAL A 40 63.597 45.429 36.459 1.00 0.00 H new ATOM 0 HG22 VAL A 40 64.676 44.739 35.224 1.00 0.00 H new ATOM 0 HG23 VAL A 40 62.918 44.772 34.951 1.00 0.00 H new ATOM 543 N ALA A 41 66.096 41.731 35.189 1.00 0.00 N ATOM 544 CA ALA A 41 67.434 41.794 34.618 1.00 0.00 C ATOM 545 C ALA A 41 67.572 40.844 33.433 1.00 0.00 C ATOM 546 O ALA A 41 68.106 41.212 32.388 1.00 0.00 O ATOM 547 CB ALA A 41 68.477 41.472 35.678 1.00 0.00 C ATOM 0 H ALA A 41 66.034 41.208 36.062 1.00 0.00 H new ATOM 0 HA ALA A 41 67.599 42.809 34.257 1.00 0.00 H new ATOM 0 HB1 ALA A 41 69.472 41.523 35.236 1.00 0.00 H new ATOM 0 HB2 ALA A 41 68.404 42.194 36.492 1.00 0.00 H new ATOM 0 HB3 ALA A 41 68.303 40.468 36.066 1.00 0.00 H new ATOM 553 N GLY A 42 67.087 39.618 33.604 1.00 0.00 N ATOM 554 CA GLY A 42 67.165 38.634 32.541 1.00 0.00 C ATOM 555 C GLY A 42 66.310 39.001 31.345 1.00 0.00 C ATOM 556 O GLY A 42 66.678 38.732 30.201 1.00 0.00 O ATOM 0 H GLY A 42 66.641 39.289 34.460 1.00 0.00 H new ATOM 0 HA2 GLY A 42 68.202 38.529 32.223 1.00 0.00 H new ATOM 0 HA3 GLY A 42 66.850 37.664 32.925 1.00 0.00 H new ATOM 560 N LYS A 43 65.163 39.619 31.608 1.00 0.00 N ATOM 561 CA LYS A 43 64.250 40.024 30.545 1.00 0.00 C ATOM 562 C LYS A 43 64.921 41.021 29.604 1.00 0.00 C ATOM 563 O LYS A 43 64.505 41.182 28.457 1.00 0.00 O ATOM 564 CB LYS A 43 62.984 40.643 31.142 1.00 0.00 C ATOM 565 CG LYS A 43 61.819 39.672 31.233 1.00 0.00 C ATOM 566 CD LYS A 43 61.389 39.185 29.859 1.00 0.00 C ATOM 567 CE LYS A 43 60.013 39.712 29.485 1.00 0.00 C ATOM 568 NZ LYS A 43 60.045 41.163 29.157 1.00 0.00 N ATOM 0 H LYS A 43 64.844 39.850 32.549 1.00 0.00 H new ATOM 0 HA LYS A 43 63.979 39.136 29.973 1.00 0.00 H new ATOM 0 HB2 LYS A 43 63.210 41.022 32.139 1.00 0.00 H new ATOM 0 HB3 LYS A 43 62.687 41.499 30.536 1.00 0.00 H new ATOM 0 HG2 LYS A 43 62.103 38.819 31.850 1.00 0.00 H new ATOM 0 HG3 LYS A 43 60.978 40.157 31.728 1.00 0.00 H new ATOM 0 HD2 LYS A 43 62.117 39.506 29.114 1.00 0.00 H new ATOM 0 HD3 LYS A 43 61.378 38.095 29.845 1.00 0.00 H new ATOM 0 HE2 LYS A 43 59.631 39.155 28.630 1.00 0.00 H new ATOM 0 HE3 LYS A 43 59.322 39.542 30.311 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 59.088 41.484 28.907 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 60.385 41.698 29.981 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 60.684 41.323 28.353 1.00 0.00 H new ATOM 578 N VAL A 44 65.961 41.685 30.097 1.00 0.00 N ATOM 579 CA VAL A 44 66.690 42.663 29.298 1.00 0.00 C ATOM 580 C VAL A 44 67.284 42.020 28.050 1.00 0.00 C ATOM 581 O VAL A 44 67.970 41.002 28.131 1.00 0.00 O ATOM 582 CB VAL A 44 67.821 43.320 30.112 1.00 0.00 C ATOM 583 CG1 VAL A 44 68.504 44.407 29.295 1.00 0.00 C ATOM 584 CG2 VAL A 44 67.280 43.882 31.418 1.00 0.00 C ATOM 0 H VAL A 44 66.318 41.564 31.045 1.00 0.00 H new ATOM 0 HA VAL A 44 65.973 43.429 29.002 1.00 0.00 H new ATOM 0 HB VAL A 44 68.563 42.559 30.351 1.00 0.00 H new ATOM 0 HG11 VAL A 44 69.300 44.860 29.886 1.00 0.00 H new ATOM 0 HG12 VAL A 44 68.927 43.971 28.390 1.00 0.00 H new ATOM 0 HG13 VAL A 44 67.775 45.170 29.023 1.00 0.00 H new ATOM 0 HG21 VAL A 44 68.092 44.342 31.980 1.00 0.00 H new ATOM 0 HG22 VAL A 44 66.517 44.631 31.204 1.00 0.00 H new ATOM 0 HG23 VAL A 44 66.842 43.076 32.007 1.00 0.00 H new ATOM 594 N GLN A 45 67.015 42.625 26.897 1.00 0.00 N ATOM 595 CA GLN A 45 67.524 42.111 25.629 1.00 0.00 C ATOM 596 C GLN A 45 68.524 43.082 25.010 1.00 0.00 C ATOM 597 O GLN A 45 68.232 43.770 24.031 1.00 0.00 O ATOM 598 CB GLN A 45 66.371 41.858 24.658 1.00 0.00 C ATOM 599 CG GLN A 45 65.872 40.422 24.664 1.00 0.00 C ATOM 600 CD GLN A 45 64.390 40.320 24.967 1.00 0.00 C ATOM 601 OE1 GLN A 45 63.621 41.237 24.678 1.00 0.00 O ATOM 602 NE2 GLN A 45 63.981 39.199 25.550 1.00 0.00 N ATOM 0 H GLN A 45 66.449 43.470 26.814 1.00 0.00 H new ATOM 0 HA GLN A 45 68.036 41.169 25.826 1.00 0.00 H new ATOM 0 HB2 GLN A 45 65.544 42.522 24.909 1.00 0.00 H new ATOM 0 HB3 GLN A 45 66.693 42.117 23.650 1.00 0.00 H new ATOM 0 HG2 GLN A 45 66.073 39.968 23.694 1.00 0.00 H new ATOM 0 HG3 GLN A 45 66.431 39.850 25.405 1.00 0.00 H new ATOM 0 HE21 GLN A 45 64.653 38.465 25.772 1.00 0.00 H new ATOM 0 HE22 GLN A 45 62.994 39.072 25.776 1.00 0.00 H new ATOM 609 N PRO A 46 69.730 43.142 25.591 1.00 0.00 N ATOM 610 CA PRO A 46 70.797 44.025 25.112 1.00 0.00 C ATOM 611 C PRO A 46 71.359 43.579 23.766 1.00 0.00 C ATOM 612 O PRO A 46 70.752 42.766 23.070 1.00 0.00 O ATOM 613 CB PRO A 46 71.866 43.913 26.201 1.00 0.00 C ATOM 614 CG PRO A 46 71.631 42.581 26.828 1.00 0.00 C ATOM 615 CD PRO A 46 70.146 42.349 26.762 1.00 0.00 C ATOM 0 HA PRO A 46 70.441 45.042 24.948 1.00 0.00 H new ATOM 0 HB2 PRO A 46 72.869 43.981 25.780 1.00 0.00 H new ATOM 0 HB3 PRO A 46 71.772 44.716 26.932 1.00 0.00 H new ATOM 0 HG2 PRO A 46 72.172 41.798 26.296 1.00 0.00 H new ATOM 0 HG3 PRO A 46 71.983 42.568 27.860 1.00 0.00 H new ATOM 0 HD2 PRO A 46 69.909 41.292 26.637 1.00 0.00 H new ATOM 0 HD3 PRO A 46 69.646 42.682 27.672 1.00 0.00 H new ATOM 620 N GLU A 47 72.521 44.115 23.409 1.00 0.00 N ATOM 621 CA GLU A 47 73.164 43.771 22.145 1.00 0.00 C ATOM 622 C GLU A 47 72.335 44.264 20.961 1.00 0.00 C ATOM 623 O GLU A 47 71.186 43.860 20.784 1.00 0.00 O ATOM 624 CB GLU A 47 73.366 42.258 22.045 1.00 0.00 C ATOM 625 CG GLU A 47 73.861 41.625 23.335 1.00 0.00 C ATOM 626 CD GLU A 47 74.149 40.144 23.184 1.00 0.00 C ATOM 627 OE1 GLU A 47 74.233 39.670 22.031 1.00 0.00 O ATOM 628 OE2 GLU A 47 74.288 39.458 24.219 1.00 0.00 O ATOM 0 H GLU A 47 73.037 44.788 23.976 1.00 0.00 H new ATOM 0 HA GLU A 47 74.136 44.263 22.116 1.00 0.00 H new ATOM 0 HB2 GLU A 47 72.423 41.792 21.760 1.00 0.00 H new ATOM 0 HB3 GLU A 47 74.080 42.047 21.249 1.00 0.00 H new ATOM 0 HG2 GLU A 47 74.766 42.136 23.662 1.00 0.00 H new ATOM 0 HG3 GLU A 47 73.114 41.768 24.116 1.00 0.00 H new ATOM 633 N ASP A 48 72.927 45.139 20.156 1.00 0.00 N ATOM 634 CA ASP A 48 72.245 45.687 18.989 1.00 0.00 C ATOM 635 C ASP A 48 71.876 44.578 18.006 1.00 0.00 C ATOM 636 O ASP A 48 71.997 43.395 18.316 1.00 0.00 O ATOM 637 CB ASP A 48 73.127 46.726 18.297 1.00 0.00 C ATOM 638 CG ASP A 48 73.694 47.743 19.270 1.00 0.00 C ATOM 639 OD1 ASP A 48 74.563 47.365 20.083 1.00 0.00 O ATOM 640 OD2 ASP A 48 73.268 48.916 19.219 1.00 0.00 O ATOM 0 H ASP A 48 73.877 45.484 20.290 1.00 0.00 H new ATOM 0 HA ASP A 48 71.328 46.169 19.327 1.00 0.00 H new ATOM 0 HB2 ASP A 48 73.946 46.221 17.785 1.00 0.00 H new ATOM 0 HB3 ASP A 48 72.545 47.243 17.534 1.00 0.00 H new ATOM 644 N ASN A 49 71.428 44.974 16.819 1.00 0.00 N ATOM 645 CA ASN A 49 71.040 44.016 15.790 1.00 0.00 C ATOM 646 C ASN A 49 72.259 43.277 15.247 1.00 0.00 C ATOM 647 O ASN A 49 72.843 43.678 14.240 1.00 0.00 O ATOM 648 CB ASN A 49 70.310 44.727 14.650 1.00 0.00 C ATOM 649 CG ASN A 49 69.385 45.821 15.148 1.00 0.00 C ATOM 650 OD1 ASN A 49 68.198 45.589 15.377 1.00 0.00 O ATOM 651 ND2 ASN A 49 69.926 47.021 15.317 1.00 0.00 N ATOM 0 H ASN A 49 71.325 45.951 16.546 1.00 0.00 H new ATOM 0 HA ASN A 49 70.368 43.287 16.243 1.00 0.00 H new ATOM 0 HB2 ASN A 49 71.042 45.157 13.966 1.00 0.00 H new ATOM 0 HB3 ASN A 49 69.733 43.998 14.081 1.00 0.00 H new ATOM 0 HD21 ASN A 49 69.353 47.797 15.649 1.00 0.00 H new ATOM 0 HD22 ASN A 49 70.915 47.168 15.115 1.00 0.00 H new ATOM 657 N LYS A 50 72.639 42.197 15.920 1.00 0.00 N ATOM 658 CA LYS A 50 73.788 41.401 15.505 1.00 0.00 C ATOM 659 C LYS A 50 73.837 40.080 16.266 1.00 0.00 C ATOM 660 O LYS A 50 74.911 39.522 16.493 1.00 0.00 O ATOM 661 CB LYS A 50 75.085 42.182 15.734 1.00 0.00 C ATOM 662 CG LYS A 50 75.975 42.255 14.505 1.00 0.00 C ATOM 663 CD LYS A 50 77.444 42.142 14.873 1.00 0.00 C ATOM 664 CE LYS A 50 78.068 40.884 14.289 1.00 0.00 C ATOM 665 NZ LYS A 50 79.493 41.097 13.911 1.00 0.00 N ATOM 0 H LYS A 50 72.168 41.852 16.756 1.00 0.00 H new ATOM 0 HA LYS A 50 73.684 41.185 14.442 1.00 0.00 H new ATOM 0 HB2 LYS A 50 74.838 43.194 16.054 1.00 0.00 H new ATOM 0 HB3 LYS A 50 75.641 41.717 16.548 1.00 0.00 H new ATOM 0 HG2 LYS A 50 75.709 41.455 13.814 1.00 0.00 H new ATOM 0 HG3 LYS A 50 75.801 43.196 13.984 1.00 0.00 H new ATOM 0 HD2 LYS A 50 77.980 43.018 14.509 1.00 0.00 H new ATOM 0 HD3 LYS A 50 77.549 42.132 15.958 1.00 0.00 H new ATOM 0 HE2 LYS A 50 78.002 40.074 15.016 1.00 0.00 H new ATOM 0 HE3 LYS A 50 77.502 40.571 13.411 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 79.883 40.217 13.517 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 79.554 41.852 13.199 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 80.038 41.371 14.753 1.00 0.00 H new ATOM 675 N GLY A 51 72.668 39.582 16.655 1.00 0.00 N ATOM 676 CA GLY A 51 72.599 38.329 17.384 1.00 0.00 C ATOM 677 C GLY A 51 71.400 37.492 16.989 1.00 0.00 C ATOM 678 O GLY A 51 71.067 36.513 17.659 1.00 0.00 O ATOM 0 H GLY A 51 71.766 40.024 16.478 1.00 0.00 H new ATOM 0 HA2 GLY A 51 73.511 37.758 17.206 1.00 0.00 H new ATOM 0 HA3 GLY A 51 72.557 38.537 18.453 1.00 0.00 H new ATOM 682 N VAL A 52 70.742 37.879 15.900 1.00 0.00 N ATOM 683 CA VAL A 52 69.569 37.159 15.418 1.00 0.00 C ATOM 684 C VAL A 52 69.932 35.738 14.999 1.00 0.00 C ATOM 685 O VAL A 52 69.084 34.845 14.995 1.00 0.00 O ATOM 686 CB VAL A 52 68.917 37.883 14.225 1.00 0.00 C ATOM 687 CG1 VAL A 52 67.648 37.165 13.795 1.00 0.00 C ATOM 688 CG2 VAL A 52 68.626 39.334 14.578 1.00 0.00 C ATOM 0 H VAL A 52 71.002 38.687 15.335 1.00 0.00 H new ATOM 0 HA VAL A 52 68.858 37.122 16.243 1.00 0.00 H new ATOM 0 HB VAL A 52 69.615 37.870 13.388 1.00 0.00 H new ATOM 0 HG11 VAL A 52 67.201 37.690 12.951 1.00 0.00 H new ATOM 0 HG12 VAL A 52 67.890 36.144 13.500 1.00 0.00 H new ATOM 0 HG13 VAL A 52 66.942 37.145 14.625 1.00 0.00 H new ATOM 0 HG21 VAL A 52 68.166 39.831 13.724 1.00 0.00 H new ATOM 0 HG22 VAL A 52 67.947 39.372 15.430 1.00 0.00 H new ATOM 0 HG23 VAL A 52 69.557 39.840 14.834 1.00 0.00 H new ATOM 698 N PHE A 53 71.197 35.535 14.648 1.00 0.00 N ATOM 699 CA PHE A 53 71.674 34.223 14.227 1.00 0.00 C ATOM 700 C PHE A 53 71.520 33.201 15.352 1.00 0.00 C ATOM 701 O PHE A 53 70.934 32.136 15.160 1.00 0.00 O ATOM 702 CB PHE A 53 73.138 34.302 13.792 1.00 0.00 C ATOM 703 CG PHE A 53 73.323 34.281 12.302 1.00 0.00 C ATOM 704 CD1 PHE A 53 72.912 35.352 11.523 1.00 0.00 C ATOM 705 CD2 PHE A 53 73.906 33.190 11.678 1.00 0.00 C ATOM 706 CE1 PHE A 53 73.081 35.335 10.152 1.00 0.00 C ATOM 707 CE2 PHE A 53 74.079 33.167 10.307 1.00 0.00 C ATOM 708 CZ PHE A 53 73.664 34.242 9.544 1.00 0.00 C ATOM 0 H PHE A 53 71.911 36.263 14.647 1.00 0.00 H new ATOM 0 HA PHE A 53 71.069 33.900 13.380 1.00 0.00 H new ATOM 0 HB2 PHE A 53 73.579 35.215 14.192 1.00 0.00 H new ATOM 0 HB3 PHE A 53 73.684 33.466 14.230 1.00 0.00 H new ATOM 0 HD1 PHE A 53 72.454 36.210 11.994 1.00 0.00 H new ATOM 0 HD2 PHE A 53 74.229 32.347 12.270 1.00 0.00 H new ATOM 0 HE1 PHE A 53 72.757 36.176 9.557 1.00 0.00 H new ATOM 0 HE2 PHE A 53 74.537 32.311 9.833 1.00 0.00 H new ATOM 0 HZ PHE A 53 73.796 34.227 8.472 1.00 0.00 H new ATOM 717 N GLN A 54 72.050 33.537 16.523 1.00 0.00 N ATOM 718 CA GLN A 54 71.975 32.649 17.677 1.00 0.00 C ATOM 719 C GLN A 54 70.524 32.325 18.019 1.00 0.00 C ATOM 720 O GLN A 54 70.205 31.209 18.423 1.00 0.00 O ATOM 721 CB GLN A 54 72.666 33.287 18.883 1.00 0.00 C ATOM 722 CG GLN A 54 74.001 32.646 19.228 1.00 0.00 C ATOM 723 CD GLN A 54 73.972 31.914 20.554 1.00 0.00 C ATOM 724 OE1 GLN A 54 73.181 30.991 20.750 1.00 0.00 O ATOM 725 NE2 GLN A 54 74.837 32.320 21.476 1.00 0.00 N ATOM 0 H GLN A 54 72.536 34.417 16.698 1.00 0.00 H new ATOM 0 HA GLN A 54 72.486 31.720 17.424 1.00 0.00 H new ATOM 0 HB2 GLN A 54 72.822 34.347 18.683 1.00 0.00 H new ATOM 0 HB3 GLN A 54 72.006 33.219 19.748 1.00 0.00 H new ATOM 0 HG2 GLN A 54 74.279 31.948 18.438 1.00 0.00 H new ATOM 0 HG3 GLN A 54 74.772 33.416 19.259 1.00 0.00 H new ATOM 0 HE21 GLN A 54 75.476 33.089 21.273 1.00 0.00 H new ATOM 0 HE22 GLN A 54 74.863 31.863 22.387 1.00 0.00 H new ATOM 732 N GLY A 55 69.648 33.313 17.857 1.00 0.00 N ATOM 733 CA GLY A 55 68.242 33.114 18.153 1.00 0.00 C ATOM 734 C GLY A 55 67.659 31.920 17.425 1.00 0.00 C ATOM 735 O GLY A 55 66.682 31.322 17.877 1.00 0.00 O ATOM 0 H GLY A 55 69.888 34.247 17.526 1.00 0.00 H new ATOM 0 HA2 GLY A 55 68.116 32.978 19.227 1.00 0.00 H new ATOM 0 HA3 GLY A 55 67.686 34.010 17.878 1.00 0.00 H new ATOM 739 N VAL A 56 68.256 31.573 16.289 1.00 0.00 N ATOM 740 CA VAL A 56 67.790 30.443 15.494 1.00 0.00 C ATOM 741 C VAL A 56 67.753 29.166 16.323 1.00 0.00 C ATOM 742 O VAL A 56 66.993 28.242 16.027 1.00 0.00 O ATOM 743 CB VAL A 56 68.685 30.218 14.261 1.00 0.00 C ATOM 744 CG1 VAL A 56 68.200 29.018 13.461 1.00 0.00 C ATOM 745 CG2 VAL A 56 68.721 31.467 13.393 1.00 0.00 C ATOM 0 H VAL A 56 69.064 32.058 15.899 1.00 0.00 H new ATOM 0 HA VAL A 56 66.781 30.684 15.161 1.00 0.00 H new ATOM 0 HB VAL A 56 69.699 30.012 14.603 1.00 0.00 H new ATOM 0 HG11 VAL A 56 68.844 28.874 12.594 1.00 0.00 H new ATOM 0 HG12 VAL A 56 68.231 28.127 14.087 1.00 0.00 H new ATOM 0 HG13 VAL A 56 67.177 29.192 13.128 1.00 0.00 H new ATOM 0 HG21 VAL A 56 69.358 31.290 12.527 1.00 0.00 H new ATOM 0 HG22 VAL A 56 67.712 31.707 13.058 1.00 0.00 H new ATOM 0 HG23 VAL A 56 69.119 32.301 13.971 1.00 0.00 H new ATOM 755 N HIS A 57 68.580 29.118 17.363 1.00 0.00 N ATOM 756 CA HIS A 57 68.643 27.952 18.237 1.00 0.00 C ATOM 757 C HIS A 57 67.461 27.931 19.201 1.00 0.00 C ATOM 758 O HIS A 57 67.047 26.871 19.670 1.00 0.00 O ATOM 759 CB HIS A 57 69.956 27.945 19.020 1.00 0.00 C ATOM 760 CG HIS A 57 70.142 26.723 19.866 1.00 0.00 C ATOM 761 ND1 HIS A 57 70.367 26.777 21.225 1.00 0.00 N ATOM 762 CD2 HIS A 57 70.132 25.410 19.540 1.00 0.00 C ATOM 763 CE1 HIS A 57 70.491 25.549 21.698 1.00 0.00 C ATOM 764 NE2 HIS A 57 70.352 24.701 20.695 1.00 0.00 N ATOM 0 H HIS A 57 69.216 29.873 17.621 1.00 0.00 H new ATOM 0 HA HIS A 57 68.596 27.059 17.614 1.00 0.00 H new ATOM 0 HB2 HIS A 57 70.788 28.022 18.320 1.00 0.00 H new ATOM 0 HB3 HIS A 57 69.994 28.828 19.658 1.00 0.00 H new ATOM 0 HD2 HIS A 57 69.979 24.996 18.554 1.00 0.00 H new ATOM 0 HE1 HIS A 57 70.675 25.284 22.729 1.00 0.00 H new ATOM 0 HE2 HIS A 57 70.400 23.685 20.767 1.00 0.00 H new ATOM 771 N ASP A 58 66.924 29.111 19.495 1.00 0.00 N ATOM 772 CA ASP A 58 65.789 29.230 20.404 1.00 0.00 C ATOM 773 C ASP A 58 64.618 28.377 19.925 1.00 0.00 C ATOM 774 O ASP A 58 63.772 27.964 20.719 1.00 0.00 O ATOM 775 CB ASP A 58 65.356 30.691 20.526 1.00 0.00 C ATOM 776 CG ASP A 58 64.263 30.888 21.557 1.00 0.00 C ATOM 777 OD1 ASP A 58 64.049 29.970 22.377 1.00 0.00 O ATOM 778 OD2 ASP A 58 63.621 31.958 21.545 1.00 0.00 O ATOM 0 H ASP A 58 67.256 29.998 19.117 1.00 0.00 H new ATOM 0 HA ASP A 58 66.101 28.870 21.384 1.00 0.00 H new ATOM 0 HB2 ASP A 58 66.218 31.301 20.794 1.00 0.00 H new ATOM 0 HB3 ASP A 58 65.005 31.045 19.557 1.00 0.00 H new ATOM 782 N SER A 59 64.575 28.118 18.622 1.00 0.00 N ATOM 783 CA SER A 59 63.504 27.319 18.036 1.00 0.00 C ATOM 784 C SER A 59 63.394 25.966 18.732 1.00 0.00 C ATOM 785 O SER A 59 62.323 25.360 18.766 1.00 0.00 O ATOM 786 CB SER A 59 63.750 27.119 16.539 1.00 0.00 C ATOM 787 OG SER A 59 62.932 26.082 16.022 1.00 0.00 O ATOM 0 H SER A 59 65.269 28.449 17.952 1.00 0.00 H new ATOM 0 HA SER A 59 62.565 27.855 18.173 1.00 0.00 H new ATOM 0 HB2 SER A 59 63.546 28.048 16.006 1.00 0.00 H new ATOM 0 HB3 SER A 59 64.799 26.878 16.369 1.00 0.00 H new ATOM 0 HG SER A 59 63.107 25.975 15.064 1.00 0.00 H new ATOM 792 N ALA A 60 64.508 25.499 19.284 1.00 0.00 N ATOM 793 CA ALA A 60 64.538 24.219 19.981 1.00 0.00 C ATOM 794 C ALA A 60 63.500 24.178 21.098 1.00 0.00 C ATOM 795 O ALA A 60 63.040 23.107 21.490 1.00 0.00 O ATOM 796 CB ALA A 60 65.928 23.954 20.539 1.00 0.00 C ATOM 0 H ALA A 60 65.403 25.988 19.262 1.00 0.00 H new ATOM 0 HA ALA A 60 64.292 23.436 19.263 1.00 0.00 H new ATOM 0 HB1 ALA A 60 65.935 22.995 21.057 1.00 0.00 H new ATOM 0 HB2 ALA A 60 66.650 23.931 19.722 1.00 0.00 H new ATOM 0 HB3 ALA A 60 66.196 24.746 21.238 1.00 0.00 H new ATOM 802 N GLU A 61 63.139 25.352 21.606 1.00 0.00 N ATOM 803 CA GLU A 61 62.156 25.448 22.680 1.00 0.00 C ATOM 804 C GLU A 61 60.883 24.686 22.323 1.00 0.00 C ATOM 805 O GLU A 61 60.233 24.100 23.189 1.00 0.00 O ATOM 806 CB GLU A 61 61.823 26.914 22.965 1.00 0.00 C ATOM 807 CG GLU A 61 60.963 27.112 24.203 1.00 0.00 C ATOM 808 CD GLU A 61 60.129 28.377 24.137 1.00 0.00 C ATOM 809 OE1 GLU A 61 60.619 29.383 23.586 1.00 0.00 O ATOM 810 OE2 GLU A 61 58.985 28.360 24.638 1.00 0.00 O ATOM 0 H GLU A 61 63.511 26.248 21.292 1.00 0.00 H new ATOM 0 HA GLU A 61 62.588 24.999 23.575 1.00 0.00 H new ATOM 0 HB2 GLU A 61 62.751 27.472 23.084 1.00 0.00 H new ATOM 0 HB3 GLU A 61 61.306 27.335 22.103 1.00 0.00 H new ATOM 0 HG2 GLU A 61 60.304 26.252 24.324 1.00 0.00 H new ATOM 0 HG3 GLU A 61 61.604 27.149 25.084 1.00 0.00 H new ATOM 815 N LYS A 62 60.533 24.700 21.041 1.00 0.00 N ATOM 816 CA LYS A 62 59.339 24.010 20.568 1.00 0.00 C ATOM 817 C LYS A 62 59.337 22.552 21.018 1.00 0.00 C ATOM 818 O LYS A 62 60.384 21.910 21.074 1.00 0.00 O ATOM 819 CB LYS A 62 59.254 24.083 19.040 1.00 0.00 C ATOM 820 CG LYS A 62 57.837 24.236 18.516 1.00 0.00 C ATOM 821 CD LYS A 62 57.219 25.552 18.956 1.00 0.00 C ATOM 822 CE LYS A 62 57.196 26.564 17.822 1.00 0.00 C ATOM 823 NZ LYS A 62 56.126 27.584 18.009 1.00 0.00 N ATOM 0 H LYS A 62 61.059 25.181 20.312 1.00 0.00 H new ATOM 0 HA LYS A 62 58.469 24.506 20.999 1.00 0.00 H new ATOM 0 HB2 LYS A 62 59.854 24.923 18.691 1.00 0.00 H new ATOM 0 HB3 LYS A 62 59.693 23.180 18.617 1.00 0.00 H new ATOM 0 HG2 LYS A 62 57.843 24.182 17.427 1.00 0.00 H new ATOM 0 HG3 LYS A 62 57.225 23.408 18.873 1.00 0.00 H new ATOM 0 HD2 LYS A 62 56.203 25.378 19.310 1.00 0.00 H new ATOM 0 HD3 LYS A 62 57.784 25.958 19.795 1.00 0.00 H new ATOM 0 HE2 LYS A 62 58.164 27.061 17.759 1.00 0.00 H new ATOM 0 HE3 LYS A 62 57.042 26.045 16.876 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 56.144 28.255 17.215 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 55.199 27.113 18.044 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 56.287 28.097 18.899 1.00 0.00 H new ATOM 833 N GLY A 63 58.153 22.038 21.335 1.00 0.00 N ATOM 834 CA GLY A 63 58.038 20.659 21.775 1.00 0.00 C ATOM 835 C GLY A 63 56.773 20.410 22.573 1.00 0.00 C ATOM 836 O GLY A 63 56.747 20.610 23.787 1.00 0.00 O ATOM 0 H GLY A 63 57.272 22.551 21.295 1.00 0.00 H new ATOM 0 HA2 GLY A 63 58.052 20.001 20.906 1.00 0.00 H new ATOM 0 HA3 GLY A 63 58.905 20.401 22.384 1.00 0.00 H new ATOM 840 N LYS A 64 55.721 19.971 21.890 1.00 0.00 N ATOM 841 CA LYS A 64 54.448 19.693 22.542 1.00 0.00 C ATOM 842 C LYS A 64 53.937 18.304 22.171 1.00 0.00 C ATOM 843 O LYS A 64 54.525 17.621 21.331 1.00 0.00 O ATOM 844 CB LYS A 64 53.410 20.750 22.153 1.00 0.00 C ATOM 845 CG LYS A 64 52.391 21.030 23.242 1.00 0.00 C ATOM 846 CD LYS A 64 50.971 20.812 22.747 1.00 0.00 C ATOM 847 CE LYS A 64 49.976 20.779 23.897 1.00 0.00 C ATOM 848 NZ LYS A 64 49.366 22.115 24.143 1.00 0.00 N ATOM 0 H LYS A 64 55.726 19.800 20.884 1.00 0.00 H new ATOM 0 HA LYS A 64 54.606 19.727 23.620 1.00 0.00 H new ATOM 0 HB2 LYS A 64 53.925 21.677 21.901 1.00 0.00 H new ATOM 0 HB3 LYS A 64 52.888 20.421 21.254 1.00 0.00 H new ATOM 0 HG2 LYS A 64 52.583 20.381 24.097 1.00 0.00 H new ATOM 0 HG3 LYS A 64 52.502 22.057 23.590 1.00 0.00 H new ATOM 0 HD2 LYS A 64 50.700 21.608 22.054 1.00 0.00 H new ATOM 0 HD3 LYS A 64 50.918 19.875 22.192 1.00 0.00 H new ATOM 0 HE2 LYS A 64 49.190 20.056 23.676 1.00 0.00 H new ATOM 0 HE3 LYS A 64 50.478 20.437 24.802 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 48.694 22.050 24.934 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 50.113 22.799 24.379 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 48.865 22.430 23.288 1.00 0.00 H new ATOM 858 N ASP A 65 52.841 17.893 22.799 1.00 0.00 N ATOM 859 CA ASP A 65 52.251 16.588 22.532 1.00 0.00 C ATOM 860 C ASP A 65 50.728 16.657 22.586 1.00 0.00 C ATOM 861 O ASP A 65 50.150 17.742 22.652 1.00 0.00 O ATOM 862 CB ASP A 65 52.762 15.557 23.542 1.00 0.00 C ATOM 863 CG ASP A 65 54.275 15.524 23.620 1.00 0.00 C ATOM 864 OD1 ASP A 65 54.893 14.779 22.832 1.00 0.00 O ATOM 865 OD2 ASP A 65 54.841 16.245 24.471 1.00 0.00 O ATOM 0 H ASP A 65 52.343 18.446 23.497 1.00 0.00 H new ATOM 0 HA ASP A 65 52.548 16.282 21.529 1.00 0.00 H new ATOM 0 HB2 ASP A 65 52.355 15.785 24.527 1.00 0.00 H new ATOM 0 HB3 ASP A 65 52.394 14.569 23.266 1.00 0.00 H new ATOM 869 N ASN A 66 50.085 15.495 22.555 1.00 0.00 N ATOM 870 CA ASN A 66 48.629 15.426 22.597 1.00 0.00 C ATOM 871 C ASN A 66 48.164 14.081 23.149 1.00 0.00 C ATOM 872 O ASN A 66 48.972 13.278 23.617 1.00 0.00 O ATOM 873 CB ASN A 66 48.046 15.646 21.199 1.00 0.00 C ATOM 874 CG ASN A 66 46.744 16.423 21.233 1.00 0.00 C ATOM 875 OD1 ASN A 66 46.620 17.418 21.948 1.00 0.00 O ATOM 876 ND2 ASN A 66 45.767 15.974 20.456 1.00 0.00 N ATOM 0 H ASN A 66 50.549 14.588 22.501 1.00 0.00 H new ATOM 0 HA ASN A 66 48.272 16.214 23.260 1.00 0.00 H new ATOM 0 HB2 ASN A 66 48.770 16.182 20.586 1.00 0.00 H new ATOM 0 HB3 ASN A 66 47.878 14.680 20.722 1.00 0.00 H new ATOM 0 HD21 ASN A 66 44.869 16.457 20.435 1.00 0.00 H new ATOM 0 HD22 ASN A 66 45.914 15.145 19.880 1.00 0.00 H new ATOM 882 N ALA A 67 46.859 13.841 23.087 1.00 0.00 N ATOM 883 CA ALA A 67 46.287 12.594 23.578 1.00 0.00 C ATOM 884 C ALA A 67 45.201 12.081 22.639 1.00 0.00 C ATOM 885 O ALA A 67 45.030 12.596 21.534 1.00 0.00 O ATOM 886 CB ALA A 67 45.727 12.784 24.980 1.00 0.00 C ATOM 0 H ALA A 67 46.177 14.494 22.701 1.00 0.00 H new ATOM 0 HA ALA A 67 47.082 11.849 23.614 1.00 0.00 H new ATOM 0 HB1 ALA A 67 45.303 11.844 25.333 1.00 0.00 H new ATOM 0 HB2 ALA A 67 46.526 13.097 25.652 1.00 0.00 H new ATOM 0 HB3 ALA A 67 44.950 13.548 24.961 1.00 0.00 H new ATOM 892 N GLU A 68 44.472 11.064 23.083 1.00 0.00 N ATOM 893 CA GLU A 68 43.403 10.481 22.280 1.00 0.00 C ATOM 894 C GLU A 68 42.096 10.430 23.068 1.00 0.00 C ATOM 895 O GLU A 68 41.176 11.205 22.815 1.00 0.00 O ATOM 896 CB GLU A 68 43.790 9.074 21.819 1.00 0.00 C ATOM 897 CG GLU A 68 42.652 8.316 21.156 1.00 0.00 C ATOM 898 CD GLU A 68 42.000 9.105 20.038 1.00 0.00 C ATOM 899 OE1 GLU A 68 42.644 9.280 18.982 1.00 0.00 O ATOM 900 OE2 GLU A 68 40.847 9.549 20.218 1.00 0.00 O ATOM 0 H GLU A 68 44.601 10.626 23.995 1.00 0.00 H new ATOM 0 HA GLU A 68 43.254 11.114 21.405 1.00 0.00 H new ATOM 0 HB2 GLU A 68 44.623 9.146 21.120 1.00 0.00 H new ATOM 0 HB3 GLU A 68 44.143 8.504 22.678 1.00 0.00 H new ATOM 0 HG2 GLU A 68 43.031 7.374 20.758 1.00 0.00 H new ATOM 0 HG3 GLU A 68 41.901 8.067 21.906 1.00 0.00 H new ATOM 905 N GLY A 69 42.024 9.507 24.023 1.00 0.00 N ATOM 906 CA GLY A 69 40.827 9.369 24.831 1.00 0.00 C ATOM 907 C GLY A 69 39.728 8.609 24.116 1.00 0.00 C ATOM 908 O GLY A 69 39.829 8.340 22.920 1.00 0.00 O ATOM 0 H GLY A 69 42.773 8.853 24.251 1.00 0.00 H new ATOM 0 HA2 GLY A 69 41.076 8.854 25.759 1.00 0.00 H new ATOM 0 HA3 GLY A 69 40.461 10.359 25.104 1.00 0.00 H new ATOM 912 N GLN A 70 38.675 8.262 24.851 1.00 0.00 N ATOM 913 CA GLN A 70 37.554 7.526 24.278 1.00 0.00 C ATOM 914 C GLN A 70 36.235 7.979 24.894 1.00 0.00 C ATOM 915 O GLN A 70 35.443 8.668 24.252 1.00 0.00 O ATOM 916 CB GLN A 70 37.742 6.023 24.493 1.00 0.00 C ATOM 917 CG GLN A 70 38.095 5.266 23.222 1.00 0.00 C ATOM 918 CD GLN A 70 38.531 3.840 23.494 1.00 0.00 C ATOM 919 OE1 GLN A 70 39.010 3.523 24.584 1.00 0.00 O ATOM 920 NE2 GLN A 70 38.369 2.971 22.503 1.00 0.00 N ATOM 0 H GLN A 70 38.575 8.479 25.843 1.00 0.00 H new ATOM 0 HA GLN A 70 37.524 7.732 23.208 1.00 0.00 H new ATOM 0 HB2 GLN A 70 38.529 5.866 25.230 1.00 0.00 H new ATOM 0 HB3 GLN A 70 36.826 5.607 24.911 1.00 0.00 H new ATOM 0 HG2 GLN A 70 37.231 5.257 22.557 1.00 0.00 H new ATOM 0 HG3 GLN A 70 38.894 5.793 22.700 1.00 0.00 H new ATOM 0 HE21 GLN A 70 37.968 3.277 21.617 1.00 0.00 H new ATOM 0 HE22 GLN A 70 38.646 1.997 22.628 1.00 0.00 H new ATOM 927 N GLY A 71 36.004 7.587 26.143 1.00 0.00 N ATOM 928 CA GLY A 71 34.779 7.961 26.825 1.00 0.00 C ATOM 929 C GLY A 71 33.543 7.418 26.135 1.00 0.00 C ATOM 930 O GLY A 71 33.628 6.869 25.037 1.00 0.00 O ATOM 0 H GLY A 71 36.644 7.016 26.695 1.00 0.00 H new ATOM 0 HA2 GLY A 71 34.810 7.593 27.850 1.00 0.00 H new ATOM 0 HA3 GLY A 71 34.714 9.048 26.879 1.00 0.00 H new ATOM 934 N GLU A 72 32.392 7.572 26.781 1.00 0.00 N ATOM 935 CA GLU A 72 31.133 7.090 26.222 1.00 0.00 C ATOM 936 C GLU A 72 30.823 7.785 24.900 1.00 0.00 C ATOM 937 O GLU A 72 31.626 8.569 24.395 1.00 0.00 O ATOM 938 CB GLU A 72 29.989 7.319 27.213 1.00 0.00 C ATOM 939 CG GLU A 72 29.821 8.773 27.621 1.00 0.00 C ATOM 940 CD GLU A 72 28.423 9.296 27.353 1.00 0.00 C ATOM 941 OE1 GLU A 72 27.934 9.126 26.215 1.00 0.00 O ATOM 942 OE2 GLU A 72 27.817 9.875 28.278 1.00 0.00 O ATOM 0 H GLU A 72 32.304 8.026 27.690 1.00 0.00 H new ATOM 0 HA GLU A 72 31.233 6.021 26.035 1.00 0.00 H new ATOM 0 HB2 GLU A 72 29.059 6.965 26.769 1.00 0.00 H new ATOM 0 HB3 GLU A 72 30.166 6.718 28.105 1.00 0.00 H new ATOM 0 HG2 GLU A 72 30.047 8.877 28.682 1.00 0.00 H new ATOM 0 HG3 GLU A 72 30.543 9.384 27.080 1.00 0.00 H new ATOM 947 N SER A 73 29.652 7.490 24.344 1.00 0.00 N ATOM 948 CA SER A 73 29.237 8.082 23.077 1.00 0.00 C ATOM 949 C SER A 73 27.742 8.390 23.087 1.00 0.00 C ATOM 950 O SER A 73 26.915 7.518 22.817 1.00 0.00 O ATOM 951 CB SER A 73 29.569 7.142 21.917 1.00 0.00 C ATOM 952 OG SER A 73 30.680 6.320 22.229 1.00 0.00 O ATOM 0 H SER A 73 28.974 6.845 24.751 1.00 0.00 H new ATOM 0 HA SER A 73 29.782 9.016 22.944 1.00 0.00 H new ATOM 0 HB2 SER A 73 28.704 6.519 21.691 1.00 0.00 H new ATOM 0 HB3 SER A 73 29.784 7.726 21.022 1.00 0.00 H new ATOM 0 HG SER A 73 30.871 5.727 21.472 1.00 0.00 H new ATOM 957 N LEU A 74 27.404 9.635 23.398 1.00 0.00 N ATOM 958 CA LEU A 74 26.009 10.061 23.442 1.00 0.00 C ATOM 959 C LEU A 74 25.293 9.719 22.140 1.00 0.00 C ATOM 960 O LEU A 74 24.084 9.490 22.125 1.00 0.00 O ATOM 961 CB LEU A 74 25.921 11.565 23.705 1.00 0.00 C ATOM 962 CG LEU A 74 24.514 12.165 23.715 1.00 0.00 C ATOM 963 CD1 LEU A 74 23.611 11.390 24.661 1.00 0.00 C ATOM 964 CD2 LEU A 74 24.564 13.635 24.106 1.00 0.00 C ATOM 0 H LEU A 74 28.076 10.368 23.624 1.00 0.00 H new ATOM 0 HA LEU A 74 25.519 9.527 24.256 1.00 0.00 H new ATOM 0 HB2 LEU A 74 26.390 11.773 24.667 1.00 0.00 H new ATOM 0 HB3 LEU A 74 26.509 12.081 22.946 1.00 0.00 H new ATOM 0 HG LEU A 74 24.101 12.091 22.709 1.00 0.00 H new ATOM 0 HD11 LEU A 74 22.614 11.831 24.655 1.00 0.00 H new ATOM 0 HD12 LEU A 74 23.550 10.351 24.337 1.00 0.00 H new ATOM 0 HD13 LEU A 74 24.020 11.431 25.670 1.00 0.00 H new ATOM 0 HD21 LEU A 74 23.554 14.046 24.108 1.00 0.00 H new ATOM 0 HD22 LEU A 74 24.997 13.732 25.102 1.00 0.00 H new ATOM 0 HD23 LEU A 74 25.177 14.182 23.389 1.00 0.00 H new ATOM 975 N ALA A 75 26.050 9.682 21.047 1.00 0.00 N ATOM 976 CA ALA A 75 25.489 9.362 19.740 1.00 0.00 C ATOM 977 C ALA A 75 24.745 8.031 19.773 1.00 0.00 C ATOM 978 O ALA A 75 23.672 7.894 19.183 1.00 0.00 O ATOM 979 CB ALA A 75 26.587 9.330 18.688 1.00 0.00 C ATOM 0 H ALA A 75 27.053 9.870 21.041 1.00 0.00 H new ATOM 0 HA ALA A 75 24.773 10.141 19.478 1.00 0.00 H new ATOM 0 HB1 ALA A 75 26.154 9.090 17.717 1.00 0.00 H new ATOM 0 HB2 ALA A 75 27.072 10.305 18.638 1.00 0.00 H new ATOM 0 HB3 ALA A 75 27.324 8.572 18.954 1.00 0.00 H new ATOM 985 N ASP A 76 25.322 7.053 20.462 1.00 0.00 N ATOM 986 CA ASP A 76 24.713 5.733 20.570 1.00 0.00 C ATOM 987 C ASP A 76 23.483 5.774 21.473 1.00 0.00 C ATOM 988 O ASP A 76 22.531 5.020 21.274 1.00 0.00 O ATOM 989 CB ASP A 76 25.726 4.724 21.114 1.00 0.00 C ATOM 990 CG ASP A 76 25.693 3.408 20.361 1.00 0.00 C ATOM 991 OD1 ASP A 76 25.834 3.430 19.120 1.00 0.00 O ATOM 992 OD2 ASP A 76 25.528 2.356 21.013 1.00 0.00 O ATOM 0 H ASP A 76 26.210 7.149 20.954 1.00 0.00 H new ATOM 0 HA ASP A 76 24.400 5.422 19.573 1.00 0.00 H new ATOM 0 HB2 ASP A 76 26.728 5.150 21.052 1.00 0.00 H new ATOM 0 HB3 ASP A 76 25.522 4.541 22.169 1.00 0.00 H new ATOM 996 N GLN A 77 23.513 6.657 22.465 1.00 0.00 N ATOM 997 CA GLN A 77 22.401 6.794 23.398 1.00 0.00 C ATOM 998 C GLN A 77 21.240 7.545 22.756 1.00 0.00 C ATOM 999 O GLN A 77 20.077 7.297 23.073 1.00 0.00 O ATOM 1000 CB GLN A 77 22.857 7.525 24.663 1.00 0.00 C ATOM 1001 CG GLN A 77 21.710 7.978 25.551 1.00 0.00 C ATOM 1002 CD GLN A 77 20.860 6.823 26.043 1.00 0.00 C ATOM 1003 OE1 GLN A 77 21.362 5.721 26.265 1.00 0.00 O ATOM 1004 NE2 GLN A 77 19.568 7.071 26.220 1.00 0.00 N ATOM 0 H GLN A 77 24.294 7.288 22.644 1.00 0.00 H new ATOM 0 HA GLN A 77 22.060 5.794 23.666 1.00 0.00 H new ATOM 0 HB2 GLN A 77 23.512 6.868 25.236 1.00 0.00 H new ATOM 0 HB3 GLN A 77 23.449 8.394 24.377 1.00 0.00 H new ATOM 0 HG2 GLN A 77 22.111 8.519 26.408 1.00 0.00 H new ATOM 0 HG3 GLN A 77 21.082 8.676 24.998 1.00 0.00 H new ATOM 0 HE21 GLN A 77 19.195 8.000 26.023 1.00 0.00 H new ATOM 0 HE22 GLN A 77 18.948 6.333 26.553 1.00 0.00 H new ATOM 1011 N ALA A 78 21.562 8.462 21.850 1.00 0.00 N ATOM 1012 CA ALA A 78 20.546 9.246 21.161 1.00 0.00 C ATOM 1013 C ALA A 78 19.798 8.399 20.138 1.00 0.00 C ATOM 1014 O ALA A 78 18.597 8.575 19.931 1.00 0.00 O ATOM 1015 CB ALA A 78 21.179 10.455 20.487 1.00 0.00 C ATOM 0 H ALA A 78 22.520 8.680 21.576 1.00 0.00 H new ATOM 0 HA ALA A 78 19.826 9.592 21.902 1.00 0.00 H new ATOM 0 HB1 ALA A 78 20.408 11.032 19.976 1.00 0.00 H new ATOM 0 HB2 ALA A 78 21.661 11.080 21.239 1.00 0.00 H new ATOM 0 HB3 ALA A 78 21.922 10.120 19.763 1.00 0.00 H new ATOM 1021 N ARG A 79 20.514 7.479 19.501 1.00 0.00 N ATOM 1022 CA ARG A 79 19.918 6.605 18.498 1.00 0.00 C ATOM 1023 C ARG A 79 18.996 5.579 19.150 1.00 0.00 C ATOM 1024 O ARG A 79 17.853 5.402 18.730 1.00 0.00 O ATOM 1025 CB ARG A 79 21.009 5.891 17.700 1.00 0.00 C ATOM 1026 CG ARG A 79 20.497 4.717 16.881 1.00 0.00 C ATOM 1027 CD ARG A 79 19.461 5.161 15.859 1.00 0.00 C ATOM 1028 NE ARG A 79 19.436 4.284 14.691 1.00 0.00 N ATOM 1029 CZ ARG A 79 18.450 4.276 13.800 1.00 0.00 C ATOM 1030 NH1 ARG A 79 17.415 5.092 13.943 1.00 0.00 N ATOM 1031 NH2 ARG A 79 18.499 3.450 12.764 1.00 0.00 N ATOM 0 H ARG A 79 21.509 7.319 19.662 1.00 0.00 H new ATOM 0 HA ARG A 79 19.327 7.221 17.821 1.00 0.00 H new ATOM 0 HB2 ARG A 79 21.487 6.608 17.032 1.00 0.00 H new ATOM 0 HB3 ARG A 79 21.776 5.536 18.388 1.00 0.00 H new ATOM 0 HG2 ARG A 79 21.331 4.237 16.370 1.00 0.00 H new ATOM 0 HG3 ARG A 79 20.059 3.972 17.545 1.00 0.00 H new ATOM 0 HD2 ARG A 79 18.475 5.174 16.324 1.00 0.00 H new ATOM 0 HD3 ARG A 79 19.678 6.181 15.542 1.00 0.00 H new ATOM 0 HE ARG A 79 20.217 3.643 14.552 1.00 0.00 H new ATOM 0 HH11 ARG A 79 17.374 5.729 14.739 1.00 0.00 H new ATOM 0 HH12 ARG A 79 16.660 5.083 13.257 1.00 0.00 H new ATOM 0 HH21 ARG A 79 19.294 2.821 12.651 1.00 0.00 H new ATOM 0 HH22 ARG A 79 17.742 3.444 12.080 1.00 0.00 H new ATOM 1042 N ASP A 80 19.502 4.906 20.178 1.00 0.00 N ATOM 1043 CA ASP A 80 18.725 3.898 20.889 1.00 0.00 C ATOM 1044 C ASP A 80 17.444 4.500 21.457 1.00 0.00 C ATOM 1045 O ASP A 80 16.396 3.854 21.476 1.00 0.00 O ATOM 1046 CB ASP A 80 19.556 3.281 22.014 1.00 0.00 C ATOM 1047 CG ASP A 80 19.433 1.771 22.064 1.00 0.00 C ATOM 1048 OD1 ASP A 80 18.408 1.276 22.580 1.00 0.00 O ATOM 1049 OD2 ASP A 80 20.360 1.084 21.589 1.00 0.00 O ATOM 0 H ASP A 80 20.447 5.041 20.537 1.00 0.00 H new ATOM 0 HA ASP A 80 18.454 3.117 20.179 1.00 0.00 H new ATOM 0 HB2 ASP A 80 20.603 3.553 21.879 1.00 0.00 H new ATOM 0 HB3 ASP A 80 19.238 3.700 22.969 1.00 0.00 H new ATOM 1053 N TYR A 81 17.536 5.741 21.921 1.00 0.00 N ATOM 1054 CA TYR A 81 16.385 6.430 22.495 1.00 0.00 C ATOM 1055 C TYR A 81 15.459 6.949 21.399 1.00 0.00 C ATOM 1056 O TYR A 81 14.239 6.945 21.549 1.00 0.00 O ATOM 1057 CB TYR A 81 16.847 7.590 23.378 1.00 0.00 C ATOM 1058 CG TYR A 81 15.762 8.132 24.281 1.00 0.00 C ATOM 1059 CD1 TYR A 81 15.017 7.284 25.091 1.00 0.00 C ATOM 1060 CD2 TYR A 81 15.482 9.491 24.325 1.00 0.00 C ATOM 1061 CE1 TYR A 81 14.025 7.773 25.919 1.00 0.00 C ATOM 1062 CE2 TYR A 81 14.492 9.991 25.149 1.00 0.00 C ATOM 1063 CZ TYR A 81 13.767 9.128 25.944 1.00 0.00 C ATOM 1064 OH TYR A 81 12.780 9.621 26.765 1.00 0.00 O ATOM 0 H TYR A 81 18.395 6.291 21.911 1.00 0.00 H new ATOM 0 HA TYR A 81 15.833 5.715 23.105 1.00 0.00 H new ATOM 0 HB2 TYR A 81 17.686 7.258 23.990 1.00 0.00 H new ATOM 0 HB3 TYR A 81 17.215 8.395 22.742 1.00 0.00 H new ATOM 0 HD1 TYR A 81 15.217 6.223 25.073 1.00 0.00 H new ATOM 0 HD2 TYR A 81 16.048 10.170 23.704 1.00 0.00 H new ATOM 0 HE1 TYR A 81 13.456 7.099 26.542 1.00 0.00 H new ATOM 0 HE2 TYR A 81 14.287 11.051 25.170 1.00 0.00 H new ATOM 0 HH TYR A 81 12.727 10.594 26.664 1.00 0.00 H new ATOM 1073 N MET A 82 16.051 7.394 20.295 1.00 0.00 N ATOM 1074 CA MET A 82 15.281 7.915 19.172 1.00 0.00 C ATOM 1075 C MET A 82 14.485 6.803 18.497 1.00 0.00 C ATOM 1076 O MET A 82 13.268 6.902 18.345 1.00 0.00 O ATOM 1077 CB MET A 82 16.208 8.583 18.155 1.00 0.00 C ATOM 1078 CG MET A 82 16.433 10.063 18.418 1.00 0.00 C ATOM 1079 SD MET A 82 15.406 11.118 17.378 1.00 0.00 S ATOM 1080 CE MET A 82 14.668 12.190 18.608 1.00 0.00 C ATOM 0 H MET A 82 17.061 7.404 20.155 1.00 0.00 H new ATOM 0 HA MET A 82 14.582 8.657 19.557 1.00 0.00 H new ATOM 0 HB2 MET A 82 17.170 8.071 18.162 1.00 0.00 H new ATOM 0 HB3 MET A 82 15.788 8.460 17.157 1.00 0.00 H new ATOM 0 HG2 MET A 82 16.223 10.278 19.466 1.00 0.00 H new ATOM 0 HG3 MET A 82 17.483 10.303 18.248 1.00 0.00 H new ATOM 0 HE1 MET A 82 14.003 12.902 18.119 1.00 0.00 H new ATOM 0 HE2 MET A 82 14.098 11.591 19.318 1.00 0.00 H new ATOM 0 HE3 MET A 82 15.453 12.731 19.137 1.00 0.00 H new ATOM 1088 N GLY A 83 15.180 5.742 18.093 1.00 0.00 N ATOM 1089 CA GLY A 83 14.519 4.628 17.440 1.00 0.00 C ATOM 1090 C GLY A 83 13.393 4.050 18.274 1.00 0.00 C ATOM 1091 O GLY A 83 12.410 3.546 17.736 1.00 0.00 O ATOM 0 H GLY A 83 16.188 5.635 18.207 1.00 0.00 H new ATOM 0 HA2 GLY A 83 14.123 4.957 16.479 1.00 0.00 H new ATOM 0 HA3 GLY A 83 15.250 3.847 17.232 1.00 0.00 H new ATOM 1095 N ALA A 84 13.540 4.122 19.593 1.00 0.00 N ATOM 1096 CA ALA A 84 12.527 3.602 20.504 1.00 0.00 C ATOM 1097 C ALA A 84 11.310 4.519 20.553 1.00 0.00 C ATOM 1098 O ALA A 84 10.204 4.082 20.868 1.00 0.00 O ATOM 1099 CB ALA A 84 13.112 3.422 21.897 1.00 0.00 C ATOM 0 H ALA A 84 14.350 4.535 20.055 1.00 0.00 H new ATOM 0 HA ALA A 84 12.202 2.631 20.131 1.00 0.00 H new ATOM 0 HB1 ALA A 84 12.345 3.033 22.566 1.00 0.00 H new ATOM 0 HB2 ALA A 84 13.945 2.721 21.854 1.00 0.00 H new ATOM 0 HB3 ALA A 84 13.466 4.383 22.270 1.00 0.00 H new ATOM 1105 N ALA A 85 11.522 5.794 20.239 1.00 0.00 N ATOM 1106 CA ALA A 85 10.442 6.772 20.247 1.00 0.00 C ATOM 1107 C ALA A 85 9.549 6.612 19.022 1.00 0.00 C ATOM 1108 O ALA A 85 8.337 6.817 19.093 1.00 0.00 O ATOM 1109 CB ALA A 85 11.009 8.184 20.309 1.00 0.00 C ATOM 0 H ALA A 85 12.432 6.173 19.976 1.00 0.00 H new ATOM 0 HA ALA A 85 9.833 6.598 21.134 1.00 0.00 H new ATOM 0 HB1 ALA A 85 10.191 8.905 20.314 1.00 0.00 H new ATOM 0 HB2 ALA A 85 11.600 8.299 21.218 1.00 0.00 H new ATOM 0 HB3 ALA A 85 11.642 8.360 19.439 1.00 0.00 H new ATOM 1115 N LYS A 86 10.155 6.247 17.897 1.00 0.00 N ATOM 1116 CA LYS A 86 9.413 6.061 16.654 1.00 0.00 C ATOM 1117 C LYS A 86 8.427 4.905 16.780 1.00 0.00 C ATOM 1118 O LYS A 86 7.229 5.071 16.548 1.00 0.00 O ATOM 1119 CB LYS A 86 10.379 5.796 15.497 1.00 0.00 C ATOM 1120 CG LYS A 86 11.227 7.001 15.125 1.00 0.00 C ATOM 1121 CD LYS A 86 12.708 6.667 15.143 1.00 0.00 C ATOM 1122 CE LYS A 86 13.432 7.285 13.955 1.00 0.00 C ATOM 1123 NZ LYS A 86 14.610 8.089 14.383 1.00 0.00 N ATOM 0 H LYS A 86 11.157 6.074 17.820 1.00 0.00 H new ATOM 0 HA LYS A 86 8.853 6.974 16.452 1.00 0.00 H new ATOM 0 HB2 LYS A 86 11.036 4.969 15.765 1.00 0.00 H new ATOM 0 HB3 LYS A 86 9.809 5.480 14.624 1.00 0.00 H new ATOM 0 HG2 LYS A 86 10.945 7.353 14.133 1.00 0.00 H new ATOM 0 HG3 LYS A 86 11.028 7.816 15.821 1.00 0.00 H new ATOM 0 HD2 LYS A 86 13.153 7.029 16.070 1.00 0.00 H new ATOM 0 HD3 LYS A 86 12.839 5.585 15.128 1.00 0.00 H new ATOM 0 HE2 LYS A 86 13.757 6.496 13.277 1.00 0.00 H new ATOM 0 HE3 LYS A 86 12.742 7.919 13.398 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 15.077 8.493 13.546 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 14.297 8.857 15.010 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 15.281 7.478 14.892 1.00 0.00 H new ATOM 1133 N SER A 87 8.934 3.733 17.148 1.00 0.00 N ATOM 1134 CA SER A 87 8.097 2.551 17.303 1.00 0.00 C ATOM 1135 C SER A 87 7.025 2.777 18.364 1.00 0.00 C ATOM 1136 O SER A 87 5.860 2.427 18.172 1.00 0.00 O ATOM 1137 CB SER A 87 8.953 1.339 17.678 1.00 0.00 C ATOM 1138 OG SER A 87 8.434 0.150 17.106 1.00 0.00 O ATOM 0 H SER A 87 9.923 3.577 17.345 1.00 0.00 H new ATOM 0 HA SER A 87 7.604 2.359 16.350 1.00 0.00 H new ATOM 0 HB2 SER A 87 9.977 1.493 17.337 1.00 0.00 H new ATOM 0 HB3 SER A 87 8.990 1.238 18.763 1.00 0.00 H new ATOM 0 HG SER A 87 9.000 -0.609 17.359 1.00 0.00 H new ATOM 1143 N LYS A 88 7.426 3.367 19.484 1.00 0.00 N ATOM 1144 CA LYS A 88 6.501 3.644 20.577 1.00 0.00 C ATOM 1145 C LYS A 88 5.434 4.646 20.147 1.00 0.00 C ATOM 1146 O LYS A 88 4.239 4.404 20.314 1.00 0.00 O ATOM 1147 CB LYS A 88 7.261 4.182 21.791 1.00 0.00 C ATOM 1148 CG LYS A 88 8.043 3.118 22.541 1.00 0.00 C ATOM 1149 CD LYS A 88 7.121 2.096 23.185 1.00 0.00 C ATOM 1150 CE LYS A 88 7.383 1.971 24.678 1.00 0.00 C ATOM 1151 NZ LYS A 88 6.908 0.667 25.216 1.00 0.00 N ATOM 0 H LYS A 88 8.386 3.663 19.659 1.00 0.00 H new ATOM 0 HA LYS A 88 6.009 2.710 20.848 1.00 0.00 H new ATOM 0 HB2 LYS A 88 7.948 4.962 21.462 1.00 0.00 H new ATOM 0 HB3 LYS A 88 6.552 4.649 22.475 1.00 0.00 H new ATOM 0 HG2 LYS A 88 8.723 2.614 21.854 1.00 0.00 H new ATOM 0 HG3 LYS A 88 8.657 3.590 23.308 1.00 0.00 H new ATOM 0 HD2 LYS A 88 6.083 2.386 23.020 1.00 0.00 H new ATOM 0 HD3 LYS A 88 7.261 1.126 22.708 1.00 0.00 H new ATOM 0 HE2 LYS A 88 8.451 2.076 24.869 1.00 0.00 H new ATOM 0 HE3 LYS A 88 6.884 2.785 25.204 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 7.104 0.620 26.236 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 5.884 0.578 25.056 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 7.403 -0.109 24.732 1.00 0.00 H new ATOM 1161 N LEU A 89 5.875 5.768 19.591 1.00 0.00 N ATOM 1162 CA LEU A 89 4.957 6.807 19.134 1.00 0.00 C ATOM 1163 C LEU A 89 3.891 6.224 18.210 1.00 0.00 C ATOM 1164 O LEU A 89 2.695 6.393 18.442 1.00 0.00 O ATOM 1165 CB LEU A 89 5.726 7.913 18.410 1.00 0.00 C ATOM 1166 CG LEU A 89 4.890 9.084 17.893 1.00 0.00 C ATOM 1167 CD1 LEU A 89 3.930 9.572 18.966 1.00 0.00 C ATOM 1168 CD2 LEU A 89 5.792 10.217 17.426 1.00 0.00 C ATOM 0 H LEU A 89 6.861 5.983 19.445 1.00 0.00 H new ATOM 0 HA LEU A 89 4.462 7.230 20.008 1.00 0.00 H new ATOM 0 HB2 LEU A 89 6.484 8.305 19.089 1.00 0.00 H new ATOM 0 HB3 LEU A 89 6.253 7.469 17.566 1.00 0.00 H new ATOM 0 HG LEU A 89 4.303 8.738 17.042 1.00 0.00 H new ATOM 0 HD11 LEU A 89 3.344 10.406 18.578 1.00 0.00 H new ATOM 0 HD12 LEU A 89 3.261 8.760 19.252 1.00 0.00 H new ATOM 0 HD13 LEU A 89 4.495 9.900 19.838 1.00 0.00 H new ATOM 0 HD21 LEU A 89 5.180 11.042 17.061 1.00 0.00 H new ATOM 0 HD22 LEU A 89 6.405 10.561 18.259 1.00 0.00 H new ATOM 0 HD23 LEU A 89 6.437 9.861 16.623 1.00 0.00 H new ATOM 1179 N ASN A 90 4.336 5.537 17.163 1.00 0.00 N ATOM 1180 CA ASN A 90 3.422 4.928 16.205 1.00 0.00 C ATOM 1181 C ASN A 90 2.482 3.946 16.897 1.00 0.00 C ATOM 1182 O ASN A 90 1.363 3.713 16.439 1.00 0.00 O ATOM 1183 CB ASN A 90 4.206 4.211 15.103 1.00 0.00 C ATOM 1184 CG ASN A 90 3.710 4.566 13.716 1.00 0.00 C ATOM 1185 OD1 ASN A 90 3.391 5.721 13.435 1.00 0.00 O ATOM 1186 ND2 ASN A 90 3.645 3.571 12.838 1.00 0.00 N ATOM 0 H ASN A 90 5.324 5.388 16.957 1.00 0.00 H new ATOM 0 HA ASN A 90 2.824 5.722 15.758 1.00 0.00 H new ATOM 0 HB2 ASN A 90 5.262 4.469 15.185 1.00 0.00 H new ATOM 0 HB3 ASN A 90 4.129 3.134 15.249 1.00 0.00 H new ATOM 0 HD21 ASN A 90 3.321 3.750 11.888 1.00 0.00 H new ATOM 0 HD22 ASN A 90 3.920 2.628 13.114 1.00 0.00 H new ATOM 1192 N ASP A 91 2.944 3.375 18.004 1.00 0.00 N ATOM 1193 CA ASP A 91 2.145 2.419 18.762 1.00 0.00 C ATOM 1194 C ASP A 91 0.994 3.120 19.477 1.00 0.00 C ATOM 1195 O ASP A 91 -0.100 2.569 19.602 1.00 0.00 O ATOM 1196 CB ASP A 91 3.019 1.683 19.778 1.00 0.00 C ATOM 1197 CG ASP A 91 3.028 0.184 19.556 1.00 0.00 C ATOM 1198 OD1 ASP A 91 3.314 -0.246 18.419 1.00 0.00 O ATOM 1199 OD2 ASP A 91 2.749 -0.561 20.519 1.00 0.00 O ATOM 0 H ASP A 91 3.868 3.558 18.396 1.00 0.00 H new ATOM 0 HA ASP A 91 1.728 1.695 18.061 1.00 0.00 H new ATOM 0 HB2 ASP A 91 4.039 2.062 19.718 1.00 0.00 H new ATOM 0 HB3 ASP A 91 2.659 1.896 20.784 1.00 0.00 H new ATOM 1203 N ALA A 92 1.247 4.338 19.945 1.00 0.00 N ATOM 1204 CA ALA A 92 0.232 5.114 20.646 1.00 0.00 C ATOM 1205 C ALA A 92 -0.710 5.800 19.663 1.00 0.00 C ATOM 1206 O ALA A 92 -1.930 5.767 19.830 1.00 0.00 O ATOM 1207 CB ALA A 92 0.889 6.142 21.556 1.00 0.00 C ATOM 0 H ALA A 92 2.147 4.809 19.851 1.00 0.00 H new ATOM 0 HA ALA A 92 -0.357 4.429 21.256 1.00 0.00 H new ATOM 0 HB1 ALA A 92 0.119 6.715 22.073 1.00 0.00 H new ATOM 0 HB2 ALA A 92 1.516 5.632 22.288 1.00 0.00 H new ATOM 0 HB3 ALA A 92 1.503 6.816 20.959 1.00 0.00 H new ATOM 1213 N VAL A 93 -0.138 6.421 18.637 1.00 0.00 N ATOM 1214 CA VAL A 93 -0.929 7.116 17.628 1.00 0.00 C ATOM 1215 C VAL A 93 -2.001 6.201 17.044 1.00 0.00 C ATOM 1216 O VAL A 93 -3.186 6.529 17.063 1.00 0.00 O ATOM 1217 CB VAL A 93 -0.041 7.642 16.484 1.00 0.00 C ATOM 1218 CG1 VAL A 93 -0.850 8.518 15.540 1.00 0.00 C ATOM 1219 CG2 VAL A 93 1.151 8.404 17.044 1.00 0.00 C ATOM 0 H VAL A 93 0.870 6.457 18.482 1.00 0.00 H new ATOM 0 HA VAL A 93 -1.407 7.960 18.126 1.00 0.00 H new ATOM 0 HB VAL A 93 0.335 6.791 15.917 1.00 0.00 H new ATOM 0 HG11 VAL A 93 -0.206 8.880 14.738 1.00 0.00 H new ATOM 0 HG12 VAL A 93 -1.667 7.936 15.114 1.00 0.00 H new ATOM 0 HG13 VAL A 93 -1.257 9.366 16.090 1.00 0.00 H new ATOM 0 HG21 VAL A 93 1.768 8.769 16.223 1.00 0.00 H new ATOM 0 HG22 VAL A 93 0.798 9.249 17.635 1.00 0.00 H new ATOM 0 HG23 VAL A 93 1.742 7.741 17.676 1.00 0.00 H new ATOM 1229 N GLU A 94 -1.574 5.053 16.529 1.00 0.00 N ATOM 1230 CA GLU A 94 -2.498 4.090 15.940 1.00 0.00 C ATOM 1231 C GLU A 94 -3.665 3.812 16.881 1.00 0.00 C ATOM 1232 O GLU A 94 -4.800 3.626 16.442 1.00 0.00 O ATOM 1233 CB GLU A 94 -1.770 2.785 15.611 1.00 0.00 C ATOM 1234 CG GLU A 94 -1.818 2.417 14.139 1.00 0.00 C ATOM 1235 CD GLU A 94 -2.604 1.145 13.881 1.00 0.00 C ATOM 1236 OE1 GLU A 94 -3.761 1.059 14.340 1.00 0.00 O ATOM 1237 OE2 GLU A 94 -2.059 0.235 13.220 1.00 0.00 O ATOM 0 H GLU A 94 -0.595 4.767 16.507 1.00 0.00 H new ATOM 0 HA GLU A 94 -2.891 4.519 15.018 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -0.729 2.871 15.922 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -2.211 1.976 16.194 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -2.266 3.237 13.578 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -0.801 2.294 13.766 1.00 0.00 H new ATOM 1242 N TYR A 95 -3.378 3.783 18.179 1.00 0.00 N ATOM 1243 CA TYR A 95 -4.402 3.523 19.182 1.00 0.00 C ATOM 1244 C TYR A 95 -5.275 4.755 19.402 1.00 0.00 C ATOM 1245 O TYR A 95 -6.493 4.650 19.548 1.00 0.00 O ATOM 1246 CB TYR A 95 -3.756 3.100 20.502 1.00 0.00 C ATOM 1247 CG TYR A 95 -4.751 2.629 21.540 1.00 0.00 C ATOM 1248 CD1 TYR A 95 -5.525 3.538 22.250 1.00 0.00 C ATOM 1249 CD2 TYR A 95 -4.916 1.277 21.811 1.00 0.00 C ATOM 1250 CE1 TYR A 95 -6.435 3.114 23.200 1.00 0.00 C ATOM 1251 CE2 TYR A 95 -5.823 0.843 22.757 1.00 0.00 C ATOM 1252 CZ TYR A 95 -6.581 1.765 23.449 1.00 0.00 C ATOM 1253 OH TYR A 95 -7.485 1.338 24.394 1.00 0.00 O ATOM 0 H TYR A 95 -2.444 3.937 18.560 1.00 0.00 H new ATOM 0 HA TYR A 95 -5.034 2.713 18.818 1.00 0.00 H new ATOM 0 HB2 TYR A 95 -3.041 2.301 20.307 1.00 0.00 H new ATOM 0 HB3 TYR A 95 -3.192 3.940 20.907 1.00 0.00 H new ATOM 0 HD1 TYR A 95 -5.414 4.595 22.056 1.00 0.00 H new ATOM 0 HD2 TYR A 95 -4.324 0.552 21.272 1.00 0.00 H new ATOM 0 HE1 TYR A 95 -7.028 3.834 23.744 1.00 0.00 H new ATOM 0 HE2 TYR A 95 -5.939 -0.213 22.954 1.00 0.00 H new ATOM 0 HH TYR A 95 -7.466 0.360 24.447 1.00 0.00 H new ATOM 1262 N VAL A 96 -4.641 5.924 19.425 1.00 0.00 N ATOM 1263 CA VAL A 96 -5.358 7.178 19.624 1.00 0.00 C ATOM 1264 C VAL A 96 -6.307 7.459 18.466 1.00 0.00 C ATOM 1265 O VAL A 96 -7.491 7.732 18.671 1.00 0.00 O ATOM 1266 CB VAL A 96 -4.385 8.363 19.776 1.00 0.00 C ATOM 1267 CG1 VAL A 96 -5.146 9.641 20.090 1.00 0.00 C ATOM 1268 CG2 VAL A 96 -3.351 8.068 20.852 1.00 0.00 C ATOM 0 H VAL A 96 -3.633 6.028 19.308 1.00 0.00 H new ATOM 0 HA VAL A 96 -5.934 7.070 20.543 1.00 0.00 H new ATOM 0 HB VAL A 96 -3.861 8.505 18.831 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -4.443 10.467 20.194 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -5.843 9.858 19.281 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -5.699 9.516 21.021 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -2.672 8.915 20.946 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -3.854 7.899 21.804 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -2.785 7.178 20.578 1.00 0.00 H new ATOM 1278 N SER A 97 -5.783 7.390 17.246 1.00 0.00 N ATOM 1279 CA SER A 97 -6.582 7.641 16.054 1.00 0.00 C ATOM 1280 C SER A 97 -7.753 6.666 15.970 1.00 0.00 C ATOM 1281 O SER A 97 -8.816 6.999 15.448 1.00 0.00 O ATOM 1282 CB SER A 97 -5.715 7.524 14.798 1.00 0.00 C ATOM 1283 OG SER A 97 -5.797 8.699 14.010 1.00 0.00 O ATOM 0 H SER A 97 -4.807 7.162 17.058 1.00 0.00 H new ATOM 0 HA SER A 97 -6.979 8.654 16.119 1.00 0.00 H new ATOM 0 HB2 SER A 97 -4.678 7.345 15.083 1.00 0.00 H new ATOM 0 HB3 SER A 97 -6.036 6.665 14.209 1.00 0.00 H new ATOM 0 HG SER A 97 -5.233 8.600 13.215 1.00 0.00 H new ATOM 1288 N GLY A 98 -7.549 5.460 16.491 1.00 0.00 N ATOM 1289 CA GLY A 98 -8.595 4.455 16.466 1.00 0.00 C ATOM 1290 C GLY A 98 -9.641 4.680 17.538 1.00 0.00 C ATOM 1291 O GLY A 98 -10.772 4.208 17.421 1.00 0.00 O ATOM 0 H GLY A 98 -6.678 5.161 16.930 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -9.075 4.459 15.488 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -8.150 3.469 16.598 1.00 0.00 H new ATOM 1295 N ARG A 99 -9.263 5.401 18.589 1.00 0.00 N ATOM 1296 CA ARG A 99 -10.177 5.684 19.690 1.00 0.00 C ATOM 1297 C ARG A 99 -10.976 6.956 19.419 1.00 0.00 C ATOM 1298 O ARG A 99 -12.198 6.974 19.558 1.00 0.00 O ATOM 1299 CB ARG A 99 -9.401 5.825 21.000 1.00 0.00 C ATOM 1300 CG ARG A 99 -9.463 4.588 21.881 1.00 0.00 C ATOM 1301 CD ARG A 99 -10.526 4.723 22.959 1.00 0.00 C ATOM 1302 NE ARG A 99 -10.477 3.623 23.919 1.00 0.00 N ATOM 1303 CZ ARG A 99 -11.466 3.334 24.758 1.00 0.00 C ATOM 1304 NH1 ARG A 99 -12.575 4.061 24.755 1.00 0.00 N ATOM 1305 NH2 ARG A 99 -11.345 2.316 25.601 1.00 0.00 N ATOM 0 H ARG A 99 -8.331 5.800 18.701 1.00 0.00 H new ATOM 0 HA ARG A 99 -10.873 4.850 19.776 1.00 0.00 H new ATOM 0 HB2 ARG A 99 -8.358 6.047 20.773 1.00 0.00 H new ATOM 0 HB3 ARG A 99 -9.794 6.676 21.556 1.00 0.00 H new ATOM 0 HG2 ARG A 99 -9.676 3.713 21.267 1.00 0.00 H new ATOM 0 HG3 ARG A 99 -8.491 4.422 22.346 1.00 0.00 H new ATOM 0 HD2 ARG A 99 -10.391 5.668 23.484 1.00 0.00 H new ATOM 0 HD3 ARG A 99 -11.511 4.754 22.494 1.00 0.00 H new ATOM 0 HE ARG A 99 -9.637 3.045 23.947 1.00 0.00 H new ATOM 0 HH11 ARG A 99 -12.670 4.844 24.108 1.00 0.00 H new ATOM 0 HH12 ARG A 99 -13.333 3.838 25.400 1.00 0.00 H new ATOM 0 HH21 ARG A 99 -10.493 1.756 25.605 1.00 0.00 H new ATOM 0 HH22 ARG A 99 -12.104 2.094 26.245 1.00 0.00 H new ATOM 1316 N VAL A 100 -10.274 8.017 19.034 1.00 0.00 N ATOM 1317 CA VAL A 100 -10.919 9.293 18.743 1.00 0.00 C ATOM 1318 C VAL A 100 -12.073 9.116 17.762 1.00 0.00 C ATOM 1319 O VAL A 100 -13.133 9.722 17.918 1.00 0.00 O ATOM 1320 CB VAL A 100 -9.916 10.308 18.161 1.00 0.00 C ATOM 1321 CG1 VAL A 100 -10.624 11.597 17.775 1.00 0.00 C ATOM 1322 CG2 VAL A 100 -8.798 10.582 19.156 1.00 0.00 C ATOM 0 H VAL A 100 -9.261 8.019 18.916 1.00 0.00 H new ATOM 0 HA VAL A 100 -11.306 9.675 19.688 1.00 0.00 H new ATOM 0 HB VAL A 100 -9.474 9.881 17.261 1.00 0.00 H new ATOM 0 HG11 VAL A 100 -9.900 12.302 17.366 1.00 0.00 H new ATOM 0 HG12 VAL A 100 -11.386 11.383 17.025 1.00 0.00 H new ATOM 0 HG13 VAL A 100 -11.095 12.032 18.657 1.00 0.00 H new ATOM 0 HG21 VAL A 100 -8.099 11.301 18.729 1.00 0.00 H new ATOM 0 HG22 VAL A 100 -9.220 10.989 20.075 1.00 0.00 H new ATOM 0 HG23 VAL A 100 -8.273 9.653 19.378 1.00 0.00 H new ATOM 1332 N HIS A 101 -11.859 8.281 16.749 1.00 0.00 N ATOM 1333 CA HIS A 101 -12.881 8.022 15.743 1.00 0.00 C ATOM 1334 C HIS A 101 -13.220 9.296 14.974 1.00 0.00 C ATOM 1335 O HIS A 101 -12.906 10.401 15.413 1.00 0.00 O ATOM 1336 CB HIS A 101 -14.141 7.459 16.398 1.00 0.00 C ATOM 1337 CG HIS A 101 -15.093 6.830 15.427 1.00 0.00 C ATOM 1338 ND1 HIS A 101 -14.905 5.573 14.895 1.00 0.00 N ATOM 1339 CD2 HIS A 101 -16.247 7.294 14.892 1.00 0.00 C ATOM 1340 CE1 HIS A 101 -15.900 5.289 14.075 1.00 0.00 C ATOM 1341 NE2 HIS A 101 -16.728 6.318 14.056 1.00 0.00 N ATOM 0 H HIS A 101 -10.987 7.773 16.604 1.00 0.00 H new ATOM 0 HA HIS A 101 -12.487 7.287 15.041 1.00 0.00 H new ATOM 0 HB2 HIS A 101 -13.853 6.717 17.143 1.00 0.00 H new ATOM 0 HB3 HIS A 101 -14.654 8.261 16.929 1.00 0.00 H new ATOM 0 HD2 HIS A 101 -16.704 8.253 15.087 1.00 0.00 H new ATOM 0 HE1 HIS A 101 -16.017 4.373 13.516 1.00 0.00 H new ATOM 0 HE2 HIS A 101 -17.586 6.377 13.508 1.00 0.00 H new ATOM 1348 N GLY A 102 -13.864 9.132 13.821 1.00 0.00 N ATOM 1349 CA GLY A 102 -14.233 10.277 13.009 1.00 0.00 C ATOM 1350 C GLY A 102 -14.040 10.023 11.527 1.00 0.00 C ATOM 1351 O GLY A 102 -13.191 10.647 10.891 1.00 0.00 O ATOM 0 H GLY A 102 -14.136 8.228 13.436 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -15.276 10.532 13.198 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -13.635 11.138 13.308 1.00 0.00 H new ATOM 1355 N GLU A 103 -14.824 9.102 10.978 1.00 0.00 N ATOM 1356 CA GLU A 103 -14.733 8.767 9.562 1.00 0.00 C ATOM 1357 C GLU A 103 -16.040 8.160 9.060 1.00 0.00 C ATOM 1358 O GLU A 103 -16.714 7.427 9.784 1.00 0.00 O ATOM 1359 CB GLU A 103 -13.579 7.791 9.321 1.00 0.00 C ATOM 1360 CG GLU A 103 -12.857 8.017 8.003 1.00 0.00 C ATOM 1361 CD GLU A 103 -11.741 7.017 7.769 1.00 0.00 C ATOM 1362 OE1 GLU A 103 -12.040 5.808 7.669 1.00 0.00 O ATOM 1363 OE2 GLU A 103 -10.569 7.441 7.689 1.00 0.00 O ATOM 0 H GLU A 103 -15.530 8.574 11.492 1.00 0.00 H new ATOM 0 HA GLU A 103 -14.545 9.687 9.008 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -12.863 7.879 10.138 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -13.965 6.772 9.344 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -13.574 7.953 7.185 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -12.445 9.026 7.987 1.00 0.00 H new ATOM 1368 N GLU A 104 -16.391 8.472 7.817 1.00 0.00 N ATOM 1369 CA GLU A 104 -17.618 7.958 7.218 1.00 0.00 C ATOM 1370 C GLU A 104 -18.833 8.338 8.060 1.00 0.00 C ATOM 1371 O GLU A 104 -18.708 9.017 9.079 1.00 0.00 O ATOM 1372 CB GLU A 104 -17.542 6.438 7.070 1.00 0.00 C ATOM 1373 CG GLU A 104 -17.845 5.948 5.665 1.00 0.00 C ATOM 1374 CD GLU A 104 -19.182 5.237 5.570 1.00 0.00 C ATOM 1375 OE1 GLU A 104 -19.304 4.123 6.122 1.00 0.00 O ATOM 1376 OE2 GLU A 104 -20.108 5.797 4.944 1.00 0.00 O ATOM 0 H GLU A 104 -15.844 9.078 7.205 1.00 0.00 H new ATOM 0 HA GLU A 104 -17.726 8.406 6.230 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -16.545 6.103 7.355 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -18.244 5.978 7.765 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -17.839 6.796 4.980 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -17.054 5.271 5.342 1.00 0.00 H new ATOM 1381 N ASP A 105 -20.008 7.894 7.626 1.00 0.00 N ATOM 1382 CA ASP A 105 -21.246 8.186 8.338 1.00 0.00 C ATOM 1383 C ASP A 105 -21.176 7.685 9.779 1.00 0.00 C ATOM 1384 O ASP A 105 -20.360 6.832 10.126 1.00 0.00 O ATOM 1385 CB ASP A 105 -22.435 7.545 7.620 1.00 0.00 C ATOM 1386 CG ASP A 105 -23.143 8.515 6.695 1.00 0.00 C ATOM 1387 OD1 ASP A 105 -23.461 9.636 7.142 1.00 0.00 O ATOM 1388 OD2 ASP A 105 -23.380 8.152 5.524 1.00 0.00 O ATOM 0 H ASP A 105 -20.129 7.330 6.784 1.00 0.00 H new ATOM 0 HA ASP A 105 -21.381 9.268 8.354 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -22.089 6.686 7.045 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -23.143 7.170 8.359 1.00 0.00 H new ATOM 1392 N PRO A 106 -22.050 8.229 10.638 1.00 0.00 N ATOM 1393 CA PRO A 106 -22.108 7.853 12.054 1.00 0.00 C ATOM 1394 C PRO A 106 -22.637 6.439 12.258 1.00 0.00 C ATOM 1395 O PRO A 106 -22.952 5.737 11.295 1.00 0.00 O ATOM 1396 CB PRO A 106 -23.073 8.878 12.653 1.00 0.00 C ATOM 1397 CG PRO A 106 -23.931 9.305 11.512 1.00 0.00 C ATOM 1398 CD PRO A 106 -23.053 9.252 10.293 1.00 0.00 C ATOM 0 HA PRO A 106 -21.121 7.855 12.517 1.00 0.00 H new ATOM 0 HB2 PRO A 106 -23.669 8.440 13.454 1.00 0.00 H new ATOM 0 HB3 PRO A 106 -22.536 9.724 13.082 1.00 0.00 H new ATOM 0 HG2 PRO A 106 -24.792 8.645 11.402 1.00 0.00 H new ATOM 0 HG3 PRO A 106 -24.319 10.311 11.670 1.00 0.00 H new ATOM 0 HD2 PRO A 106 -23.618 8.976 9.403 1.00 0.00 H new ATOM 0 HD3 PRO A 106 -22.589 10.217 10.090 1.00 0.00 H new ATOM 1403 N THR A 107 -22.735 6.024 13.517 1.00 0.00 N ATOM 1404 CA THR A 107 -23.226 4.693 13.847 1.00 0.00 C ATOM 1405 C THR A 107 -23.854 4.666 15.236 1.00 0.00 C ATOM 1406 O THR A 107 -23.844 5.668 15.952 1.00 0.00 O ATOM 1407 CB THR A 107 -22.098 3.645 13.785 1.00 0.00 C ATOM 1408 OG1 THR A 107 -20.845 4.290 13.527 1.00 0.00 O ATOM 1409 CG2 THR A 107 -22.375 2.612 12.705 1.00 0.00 C ATOM 0 H THR A 107 -22.480 6.592 14.325 1.00 0.00 H new ATOM 0 HA THR A 107 -23.984 4.444 13.104 1.00 0.00 H new ATOM 0 HB THR A 107 -22.053 3.135 14.747 1.00 0.00 H new ATOM 0 HG1 THR A 107 -20.133 3.618 13.490 1.00 0.00 H new ATOM 0 HG21 THR A 107 -21.564 1.884 12.682 1.00 0.00 H new ATOM 0 HG22 THR A 107 -23.314 2.103 12.921 1.00 0.00 H new ATOM 0 HG23 THR A 107 -22.445 3.108 11.737 1.00 0.00 H new ATOM 1417 N LYS A 108 -24.400 3.514 15.611 1.00 0.00 N ATOM 1418 CA LYS A 108 -25.031 3.356 16.916 1.00 0.00 C ATOM 1419 C LYS A 108 -24.375 2.228 17.705 1.00 0.00 C ATOM 1420 O LYS A 108 -23.821 1.292 17.127 1.00 0.00 O ATOM 1421 CB LYS A 108 -26.527 3.075 16.752 1.00 0.00 C ATOM 1422 CG LYS A 108 -27.336 3.331 18.011 1.00 0.00 C ATOM 1423 CD LYS A 108 -28.804 2.999 17.807 1.00 0.00 C ATOM 1424 CE LYS A 108 -29.472 2.597 19.114 1.00 0.00 C ATOM 1425 NZ LYS A 108 -30.749 3.331 19.333 1.00 0.00 N ATOM 0 H LYS A 108 -24.418 2.676 15.030 1.00 0.00 H new ATOM 0 HA LYS A 108 -24.901 4.286 17.469 1.00 0.00 H new ATOM 0 HB2 LYS A 108 -26.918 3.696 15.946 1.00 0.00 H new ATOM 0 HB3 LYS A 108 -26.662 2.037 16.449 1.00 0.00 H new ATOM 0 HG2 LYS A 108 -26.937 2.732 18.829 1.00 0.00 H new ATOM 0 HG3 LYS A 108 -27.236 4.376 18.303 1.00 0.00 H new ATOM 0 HD2 LYS A 108 -29.318 3.863 17.385 1.00 0.00 H new ATOM 0 HD3 LYS A 108 -28.898 2.188 17.085 1.00 0.00 H new ATOM 0 HE2 LYS A 108 -29.666 1.524 19.108 1.00 0.00 H new ATOM 0 HE3 LYS A 108 -28.793 2.793 19.944 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 -31.173 3.029 20.233 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 -30.561 4.353 19.364 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 -31.406 3.124 18.554 1.00 0.00 H new ATOM 1435 N LYS A 109 -24.443 2.320 19.029 1.00 0.00 N ATOM 1436 CA LYS A 109 -23.857 1.306 19.898 1.00 0.00 C ATOM 1437 C LYS A 109 -22.400 1.048 19.529 1.00 0.00 C ATOM 1438 O LYS A 109 -21.492 1.335 20.308 1.00 0.00 O ATOM 1439 CB LYS A 109 -24.656 0.004 19.806 1.00 0.00 C ATOM 1440 CG LYS A 109 -24.636 -0.813 21.087 1.00 0.00 C ATOM 1441 CD LYS A 109 -25.912 -1.623 21.252 1.00 0.00 C ATOM 1442 CE LYS A 109 -25.673 -2.876 22.077 1.00 0.00 C ATOM 1443 NZ LYS A 109 -26.206 -4.095 21.403 1.00 0.00 N ATOM 0 H LYS A 109 -24.898 3.087 19.524 1.00 0.00 H new ATOM 0 HA LYS A 109 -23.893 1.676 20.923 1.00 0.00 H new ATOM 0 HB2 LYS A 109 -25.689 0.239 19.551 1.00 0.00 H new ATOM 0 HB3 LYS A 109 -24.256 -0.601 18.992 1.00 0.00 H new ATOM 0 HG2 LYS A 109 -23.777 -1.484 21.079 1.00 0.00 H new ATOM 0 HG3 LYS A 109 -24.513 -0.148 21.942 1.00 0.00 H new ATOM 0 HD2 LYS A 109 -26.674 -1.010 21.733 1.00 0.00 H new ATOM 0 HD3 LYS A 109 -26.298 -1.900 20.271 1.00 0.00 H new ATOM 0 HE2 LYS A 109 -24.604 -2.996 22.253 1.00 0.00 H new ATOM 0 HE3 LYS A 109 -26.146 -2.764 23.053 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 -26.023 -4.928 21.998 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 -27.231 -3.991 21.258 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 -25.736 -4.216 20.483 1.00 0.00 H new TER 1453 LYS A 109