USER MOD reduce.3.24.130724 H: found=0, std=0, add=957, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 957 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 GLY N :NH3+ 170:sc=-0.00144 (180deg=-0.106) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= -0.34 USER MOD Single : A 11 SER OG : rot 180:sc= 0 USER MOD Single : A 12 THR OG1 : rot 180:sc= 0.0529 USER MOD Single : A 14 HIS : no HD1:sc= -1.01 K(o=-1,f=-0.29) USER MOD Single : A 17 GLN : amide:sc= 0 X(o=0,f=-0.0091) USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 ASN : amide:sc= 0.294 K(o=0.29,f=-2.5!) USER MOD Single : A 33 SER OG : rot 180:sc= -0.983 USER MOD Single : A 37 THR OG1 : rot -170:sc= -0.234 USER MOD Single : A 44 TYR OH : rot 180:sc= 0 USER MOD Single : A 49 TYR OH : rot 180:sc= 0 USER MOD Single : A 51 THR OG1 : rot 180:sc= 0 USER MOD Single : A 57 SER OG : rot 142:sc= 0.33 USER MOD Single : A 62 SER OG : rot 120:sc= -0.264 USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 GLN : amide:sc= -1.77 K(o=-1.8,f=-4) USER MOD Single : A 74 ASN : amide:sc= -3.23! K(o=-3.2!,f=-0.57) USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 80 ASN : amide:sc= -0.4 X(o=-0.4,f=-0.52) USER MOD Single : A 83 HIS : no HD1:sc= -0.182 K(o=-0.18,f=-0.94) USER MOD Single : A 91 LYS NZ :NH3+ -161:sc= -2.16! (180deg=-2.25!) USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 93 SER OG : rot 180:sc= 0.017 USER MOD Single : A 95 HIS : no HE2:sc= -0.0196 X(o=-0.02,f=-0.43) USER MOD Single : A 99 THR OG1 : rot 76:sc= -0.885 USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 HIS : no HD1:sc= -0.381 X(o=-0.38,f=0.011) USER MOD Single : A 111 THR OG1 : rot 180:sc= -0.0512 USER MOD Single : A 112 THR OG1 : rot 180:sc= 0 USER MOD Single : A 116 THR OG1 : rot 180:sc= 0 USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 121 SER OG : rot 180:sc= -0.21 USER MOD Single : A 122 SER OG : rot 180:sc= 0 USER MOD Single : A 123 SER OG : rot 180:sc= 0 USER MOD Single : A 126 SER OG : rot 180:sc= 0 USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -13.071 -1.422 30.411 1.00 0.00 N ATOM 2 CA GLY A 1 -12.995 -2.901 30.558 1.00 0.00 C ATOM 3 C GLY A 1 -11.917 -3.516 29.687 1.00 0.00 C ATOM 4 O GLY A 1 -12.066 -4.637 29.201 1.00 0.00 O ATOM 0 H1 GLY A 1 -13.924 -1.069 30.890 1.00 0.00 H new ATOM 0 H2 GLY A 1 -12.229 -0.987 30.838 1.00 0.00 H new ATOM 0 H3 GLY A 1 -13.114 -1.175 29.402 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -12.801 -3.150 31.601 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -13.959 -3.339 30.300 1.00 0.00 H new ATOM 10 N SER A 2 -10.828 -2.779 29.489 1.00 0.00 N ATOM 11 CA SER A 2 -9.720 -3.258 28.670 1.00 0.00 C ATOM 12 C SER A 2 -8.418 -3.264 29.464 1.00 0.00 C ATOM 13 O SER A 2 -7.864 -4.322 29.760 1.00 0.00 O ATOM 14 CB SER A 2 -9.566 -2.385 27.424 1.00 0.00 C ATOM 15 OG SER A 2 -8.632 -2.947 26.519 1.00 0.00 O ATOM 0 H SER A 2 -10.689 -1.849 29.884 1.00 0.00 H new ATOM 0 HA SER A 2 -9.943 -4.280 28.365 1.00 0.00 H new ATOM 0 HB2 SER A 2 -10.532 -2.275 26.932 1.00 0.00 H new ATOM 0 HB3 SER A 2 -9.240 -1.386 27.714 1.00 0.00 H new ATOM 0 HG SER A 2 -8.553 -2.371 25.730 1.00 0.00 H new ATOM 21 N SER A 3 -7.933 -2.074 29.806 1.00 0.00 N ATOM 22 CA SER A 3 -6.695 -1.942 30.566 1.00 0.00 C ATOM 23 C SER A 3 -6.978 -1.484 31.993 1.00 0.00 C ATOM 24 O SER A 3 -6.281 -1.874 32.929 1.00 0.00 O ATOM 25 CB SER A 3 -5.753 -0.952 29.877 1.00 0.00 C ATOM 26 OG SER A 3 -6.353 0.327 29.760 1.00 0.00 O ATOM 0 H SER A 3 -8.379 -1.188 29.569 1.00 0.00 H new ATOM 0 HA SER A 3 -6.217 -2.921 30.607 1.00 0.00 H new ATOM 0 HB2 SER A 3 -4.826 -0.872 30.445 1.00 0.00 H new ATOM 0 HB3 SER A 3 -5.489 -1.325 28.887 1.00 0.00 H new ATOM 0 HG SER A 3 -5.730 0.941 29.318 1.00 0.00 H new ATOM 32 N GLY A 4 -8.003 -0.653 32.150 1.00 0.00 N ATOM 33 CA GLY A 4 -8.358 -0.155 33.466 1.00 0.00 C ATOM 34 C GLY A 4 -7.414 0.928 33.950 1.00 0.00 C ATOM 35 O GLY A 4 -6.735 1.572 33.150 1.00 0.00 O ATOM 0 H GLY A 4 -8.594 -0.316 31.390 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -9.374 0.238 33.440 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -8.354 -0.981 34.177 1.00 0.00 H new ATOM 39 N SER A 5 -7.372 1.130 35.263 1.00 0.00 N ATOM 40 CA SER A 5 -6.504 2.143 35.852 1.00 0.00 C ATOM 41 C SER A 5 -5.189 1.528 36.322 1.00 0.00 C ATOM 42 O SER A 5 -5.149 0.372 36.742 1.00 0.00 O ATOM 43 CB SER A 5 -7.208 2.828 37.025 1.00 0.00 C ATOM 44 OG SER A 5 -7.229 1.991 38.167 1.00 0.00 O ATOM 0 H SER A 5 -7.928 0.606 35.939 1.00 0.00 H new ATOM 0 HA SER A 5 -6.283 2.886 35.085 1.00 0.00 H new ATOM 0 HB2 SER A 5 -6.698 3.761 37.264 1.00 0.00 H new ATOM 0 HB3 SER A 5 -8.228 3.086 36.740 1.00 0.00 H new ATOM 0 HG SER A 5 -7.683 2.453 38.903 1.00 0.00 H new ATOM 50 N SER A 6 -4.117 2.309 36.248 1.00 0.00 N ATOM 51 CA SER A 6 -2.801 1.842 36.667 1.00 0.00 C ATOM 52 C SER A 6 -1.973 2.987 37.240 1.00 0.00 C ATOM 53 O SER A 6 -1.429 2.885 38.339 1.00 0.00 O ATOM 54 CB SER A 6 -2.063 1.206 35.487 1.00 0.00 C ATOM 55 OG SER A 6 -1.619 2.193 34.571 1.00 0.00 O ATOM 0 H SER A 6 -4.134 3.268 35.902 1.00 0.00 H new ATOM 0 HA SER A 6 -2.941 1.093 37.447 1.00 0.00 H new ATOM 0 HB2 SER A 6 -1.210 0.635 35.853 1.00 0.00 H new ATOM 0 HB3 SER A 6 -2.722 0.503 34.978 1.00 0.00 H new ATOM 0 HG SER A 6 -1.149 1.761 33.827 1.00 0.00 H new ATOM 61 N GLY A 7 -1.884 4.080 36.487 1.00 0.00 N ATOM 62 CA GLY A 7 -1.122 5.230 36.937 1.00 0.00 C ATOM 63 C GLY A 7 -1.732 6.542 36.485 1.00 0.00 C ATOM 64 O GLY A 7 -2.747 6.555 35.789 1.00 0.00 O ATOM 0 H GLY A 7 -2.326 4.189 35.574 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -1.060 5.218 38.025 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -0.102 5.157 36.558 1.00 0.00 H new ATOM 68 N ASP A 8 -1.111 7.648 36.881 1.00 0.00 N ATOM 69 CA ASP A 8 -1.598 8.972 36.512 1.00 0.00 C ATOM 70 C ASP A 8 -0.440 9.949 36.338 1.00 0.00 C ATOM 71 O ASP A 8 0.571 9.858 37.034 1.00 0.00 O ATOM 72 CB ASP A 8 -2.568 9.495 37.574 1.00 0.00 C ATOM 73 CG ASP A 8 -3.747 10.229 36.968 1.00 0.00 C ATOM 74 OD1 ASP A 8 -4.232 9.797 35.901 1.00 0.00 O ATOM 75 OD2 ASP A 8 -4.187 11.238 37.560 1.00 0.00 O ATOM 0 H ASP A 8 -0.270 7.654 37.457 1.00 0.00 H new ATOM 0 HA ASP A 8 -2.123 8.887 35.561 1.00 0.00 H new ATOM 0 HB2 ASP A 8 -2.932 8.660 38.172 1.00 0.00 H new ATOM 0 HB3 ASP A 8 -2.036 10.164 38.250 1.00 0.00 H new ATOM 80 N ARG A 9 -0.596 10.883 35.405 1.00 0.00 N ATOM 81 CA ARG A 9 0.438 11.878 35.139 1.00 0.00 C ATOM 82 C ARG A 9 1.729 11.210 34.678 1.00 0.00 C ATOM 83 O ARG A 9 2.379 10.498 35.443 1.00 0.00 O ATOM 84 CB ARG A 9 0.702 12.717 36.390 1.00 0.00 C ATOM 85 CG ARG A 9 1.445 14.013 36.108 1.00 0.00 C ATOM 86 CD ARG A 9 0.572 15.001 35.351 1.00 0.00 C ATOM 87 NE ARG A 9 -0.560 15.458 36.153 1.00 0.00 N ATOM 88 CZ ARG A 9 -1.648 16.029 35.641 1.00 0.00 C ATOM 89 NH1 ARG A 9 -1.756 16.215 34.331 1.00 0.00 N ATOM 90 NH2 ARG A 9 -2.632 16.416 36.441 1.00 0.00 N ATOM 0 H ARG A 9 -1.427 10.972 34.821 1.00 0.00 H new ATOM 0 HA ARG A 9 0.083 12.531 34.341 1.00 0.00 H new ATOM 0 HB2 ARG A 9 -0.249 12.950 36.868 1.00 0.00 H new ATOM 0 HB3 ARG A 9 1.279 12.124 37.100 1.00 0.00 H new ATOM 0 HG2 ARG A 9 1.771 14.459 37.048 1.00 0.00 H new ATOM 0 HG3 ARG A 9 2.343 13.800 35.528 1.00 0.00 H new ATOM 0 HD2 ARG A 9 1.173 15.859 35.050 1.00 0.00 H new ATOM 0 HD3 ARG A 9 0.204 14.534 34.438 1.00 0.00 H new ATOM 0 HE ARG A 9 -0.514 15.332 37.164 1.00 0.00 H new ATOM 0 HH11 ARG A 9 -1.003 15.920 33.710 1.00 0.00 H new ATOM 0 HH12 ARG A 9 -2.592 16.653 33.945 1.00 0.00 H new ATOM 0 HH21 ARG A 9 -2.555 16.276 37.448 1.00 0.00 H new ATOM 0 HH22 ARG A 9 -3.466 16.854 36.049 1.00 0.00 H new ATOM 104 N ARG A 10 2.095 11.446 33.422 1.00 0.00 N ATOM 105 CA ARG A 10 3.310 10.866 32.859 1.00 0.00 C ATOM 106 C ARG A 10 4.009 11.859 31.937 1.00 0.00 C ATOM 107 O ARG A 10 3.587 13.009 31.812 1.00 0.00 O ATOM 108 CB ARG A 10 2.980 9.585 32.092 1.00 0.00 C ATOM 109 CG ARG A 10 2.213 8.563 32.916 1.00 0.00 C ATOM 110 CD ARG A 10 2.730 7.153 32.680 1.00 0.00 C ATOM 111 NE ARG A 10 2.674 6.340 33.893 1.00 0.00 N ATOM 112 CZ ARG A 10 3.397 6.585 34.984 1.00 0.00 C ATOM 113 NH1 ARG A 10 4.229 7.618 35.018 1.00 0.00 N ATOM 114 NH2 ARG A 10 3.285 5.796 36.044 1.00 0.00 N ATOM 0 H ARG A 10 1.569 12.034 32.775 1.00 0.00 H new ATOM 0 HA ARG A 10 3.983 10.625 33.682 1.00 0.00 H new ATOM 0 HB2 ARG A 10 2.394 9.841 31.209 1.00 0.00 H new ATOM 0 HB3 ARG A 10 3.907 9.133 31.740 1.00 0.00 H new ATOM 0 HG2 ARG A 10 2.298 8.810 33.974 1.00 0.00 H new ATOM 0 HG3 ARG A 10 1.154 8.610 32.662 1.00 0.00 H new ATOM 0 HD2 ARG A 10 2.140 6.677 31.897 1.00 0.00 H new ATOM 0 HD3 ARG A 10 3.758 7.199 32.321 1.00 0.00 H new ATOM 0 HE ARG A 10 2.044 5.538 33.905 1.00 0.00 H new ATOM 0 HH11 ARG A 10 4.317 8.229 34.206 1.00 0.00 H new ATOM 0 HH12 ARG A 10 4.781 7.801 35.856 1.00 0.00 H new ATOM 0 HH21 ARG A 10 2.645 5.002 36.023 1.00 0.00 H new ATOM 0 HH22 ARG A 10 3.839 5.983 36.880 1.00 0.00 H new ATOM 128 N SER A 11 5.082 11.409 31.294 1.00 0.00 N ATOM 129 CA SER A 11 5.842 12.258 30.384 1.00 0.00 C ATOM 130 C SER A 11 5.917 11.635 28.993 1.00 0.00 C ATOM 131 O SER A 11 6.941 11.725 28.317 1.00 0.00 O ATOM 132 CB SER A 11 7.252 12.490 30.929 1.00 0.00 C ATOM 133 OG SER A 11 7.256 13.505 31.918 1.00 0.00 O ATOM 0 H SER A 11 5.445 10.460 31.387 1.00 0.00 H new ATOM 0 HA SER A 11 5.328 13.216 30.305 1.00 0.00 H new ATOM 0 HB2 SER A 11 7.638 11.563 31.353 1.00 0.00 H new ATOM 0 HB3 SER A 11 7.919 12.770 30.114 1.00 0.00 H new ATOM 0 HG SER A 11 8.169 13.633 32.252 1.00 0.00 H new ATOM 139 N THR A 12 4.825 11.004 28.573 1.00 0.00 N ATOM 140 CA THR A 12 4.767 10.367 27.263 1.00 0.00 C ATOM 141 C THR A 12 4.515 11.398 26.167 1.00 0.00 C ATOM 142 O THR A 12 3.947 12.461 26.420 1.00 0.00 O ATOM 143 CB THR A 12 3.670 9.301 27.238 1.00 0.00 C ATOM 144 OG1 THR A 12 2.532 9.737 27.959 1.00 0.00 O ATOM 145 CG2 THR A 12 4.109 7.979 27.827 1.00 0.00 C ATOM 0 H THR A 12 3.969 10.920 29.121 1.00 0.00 H new ATOM 0 HA THR A 12 5.730 9.892 27.076 1.00 0.00 H new ATOM 0 HB THR A 12 3.435 9.151 26.184 1.00 0.00 H new ATOM 0 HG1 THR A 12 1.841 9.043 27.930 1.00 0.00 H new ATOM 0 HG21 THR A 12 3.285 7.267 27.779 1.00 0.00 H new ATOM 0 HG22 THR A 12 4.956 7.592 27.261 1.00 0.00 H new ATOM 0 HG23 THR A 12 4.403 8.124 28.867 1.00 0.00 H new ATOM 153 N LEU A 13 4.941 11.077 24.950 1.00 0.00 N ATOM 154 CA LEU A 13 4.762 11.975 23.815 1.00 0.00 C ATOM 155 C LEU A 13 4.342 11.199 22.570 1.00 0.00 C ATOM 156 O LEU A 13 3.347 11.532 21.926 1.00 0.00 O ATOM 157 CB LEU A 13 6.054 12.751 23.544 1.00 0.00 C ATOM 158 CG LEU A 13 5.907 14.273 23.544 1.00 0.00 C ATOM 159 CD1 LEU A 13 6.099 14.827 24.947 1.00 0.00 C ATOM 160 CD2 LEU A 13 6.899 14.905 22.579 1.00 0.00 C ATOM 0 H LEU A 13 5.413 10.201 24.724 1.00 0.00 H new ATOM 0 HA LEU A 13 3.970 12.682 24.061 1.00 0.00 H new ATOM 0 HB2 LEU A 13 6.792 12.473 24.297 1.00 0.00 H new ATOM 0 HB3 LEU A 13 6.451 12.440 22.578 1.00 0.00 H new ATOM 0 HG LEU A 13 4.899 14.522 23.212 1.00 0.00 H new ATOM 0 HD11 LEU A 13 5.991 15.911 24.928 1.00 0.00 H new ATOM 0 HD12 LEU A 13 5.349 14.399 25.613 1.00 0.00 H new ATOM 0 HD13 LEU A 13 7.095 14.568 25.307 1.00 0.00 H new ATOM 0 HD21 LEU A 13 6.780 15.988 22.592 1.00 0.00 H new ATOM 0 HD22 LEU A 13 7.914 14.648 22.881 1.00 0.00 H new ATOM 0 HD23 LEU A 13 6.715 14.532 21.572 1.00 0.00 H new ATOM 172 N HIS A 14 5.108 10.165 22.238 1.00 0.00 N ATOM 173 CA HIS A 14 4.816 9.342 21.070 1.00 0.00 C ATOM 174 C HIS A 14 4.850 10.175 19.793 1.00 0.00 C ATOM 175 O HIS A 14 5.142 11.371 19.827 1.00 0.00 O ATOM 176 CB HIS A 14 3.448 8.674 21.220 1.00 0.00 C ATOM 177 CG HIS A 14 3.289 7.916 22.502 1.00 0.00 C ATOM 178 ND1 HIS A 14 2.452 8.324 23.519 1.00 0.00 N ATOM 179 CD2 HIS A 14 3.867 6.768 22.930 1.00 0.00 C ATOM 180 CE1 HIS A 14 2.522 7.460 24.517 1.00 0.00 C ATOM 181 NE2 HIS A 14 3.372 6.507 24.184 1.00 0.00 N ATOM 0 H HIS A 14 5.935 9.877 22.761 1.00 0.00 H new ATOM 0 HA HIS A 14 5.584 8.572 21.000 1.00 0.00 H new ATOM 0 HB2 HIS A 14 2.672 9.437 21.160 1.00 0.00 H new ATOM 0 HB3 HIS A 14 3.291 7.993 20.383 1.00 0.00 H new ATOM 0 HD2 HIS A 14 4.583 6.170 22.386 1.00 0.00 H new ATOM 0 HE1 HIS A 14 1.976 7.523 25.447 1.00 0.00 H new ATOM 0 HE2 HIS A 14 3.621 5.706 24.764 1.00 0.00 H new ATOM 190 N LEU A 15 4.549 9.535 18.667 1.00 0.00 N ATOM 191 CA LEU A 15 4.544 10.216 17.378 1.00 0.00 C ATOM 192 C LEU A 15 3.145 10.711 17.029 1.00 0.00 C ATOM 193 O LEU A 15 2.166 10.345 17.679 1.00 0.00 O ATOM 194 CB LEU A 15 5.054 9.277 16.282 1.00 0.00 C ATOM 195 CG LEU A 15 6.573 9.098 16.236 1.00 0.00 C ATOM 196 CD1 LEU A 15 6.936 7.630 16.071 1.00 0.00 C ATOM 197 CD2 LEU A 15 7.174 9.926 15.109 1.00 0.00 C ATOM 0 H LEU A 15 4.305 8.546 18.622 1.00 0.00 H new ATOM 0 HA LEU A 15 5.207 11.078 17.447 1.00 0.00 H new ATOM 0 HB2 LEU A 15 4.592 8.299 16.419 1.00 0.00 H new ATOM 0 HB3 LEU A 15 4.719 9.655 15.316 1.00 0.00 H new ATOM 0 HG LEU A 15 6.988 9.449 17.181 1.00 0.00 H new ATOM 0 HD11 LEU A 15 8.020 7.525 16.041 1.00 0.00 H new ATOM 0 HD12 LEU A 15 6.539 7.060 16.912 1.00 0.00 H new ATOM 0 HD13 LEU A 15 6.508 7.252 15.142 1.00 0.00 H new ATOM 0 HD21 LEU A 15 8.255 9.786 15.091 1.00 0.00 H new ATOM 0 HD22 LEU A 15 6.751 9.606 14.157 1.00 0.00 H new ATOM 0 HD23 LEU A 15 6.947 10.980 15.271 1.00 0.00 H new ATOM 209 N LEU A 16 3.059 11.547 15.999 1.00 0.00 N ATOM 210 CA LEU A 16 1.778 12.093 15.563 1.00 0.00 C ATOM 211 C LEU A 16 1.715 12.181 14.042 1.00 0.00 C ATOM 212 O LEU A 16 2.646 11.776 13.347 1.00 0.00 O ATOM 213 CB LEU A 16 1.554 13.477 16.176 1.00 0.00 C ATOM 214 CG LEU A 16 2.661 14.496 15.894 1.00 0.00 C ATOM 215 CD1 LEU A 16 2.070 15.814 15.415 1.00 0.00 C ATOM 216 CD2 LEU A 16 3.515 14.714 17.135 1.00 0.00 C ATOM 0 H LEU A 16 3.860 11.861 15.451 1.00 0.00 H new ATOM 0 HA LEU A 16 0.990 11.421 15.903 1.00 0.00 H new ATOM 0 HB2 LEU A 16 0.611 13.875 15.802 1.00 0.00 H new ATOM 0 HB3 LEU A 16 1.448 13.367 17.255 1.00 0.00 H new ATOM 0 HG LEU A 16 3.297 14.099 15.103 1.00 0.00 H new ATOM 0 HD11 LEU A 16 2.874 16.524 15.220 1.00 0.00 H new ATOM 0 HD12 LEU A 16 1.504 15.647 14.499 1.00 0.00 H new ATOM 0 HD13 LEU A 16 1.409 16.216 16.182 1.00 0.00 H new ATOM 0 HD21 LEU A 16 4.297 15.441 16.916 1.00 0.00 H new ATOM 0 HD22 LEU A 16 2.890 15.087 17.946 1.00 0.00 H new ATOM 0 HD23 LEU A 16 3.971 13.770 17.433 1.00 0.00 H new ATOM 228 N GLN A 17 0.610 12.716 13.531 1.00 0.00 N ATOM 229 CA GLN A 17 0.424 12.858 12.091 1.00 0.00 C ATOM 230 C GLN A 17 0.046 14.290 11.730 1.00 0.00 C ATOM 231 O GLN A 17 0.738 14.949 10.954 1.00 0.00 O ATOM 232 CB GLN A 17 -0.654 11.892 11.597 1.00 0.00 C ATOM 233 CG GLN A 17 -0.296 10.428 11.790 1.00 0.00 C ATOM 234 CD GLN A 17 -1.517 9.533 11.858 1.00 0.00 C ATOM 235 OE1 GLN A 17 -2.037 9.091 10.833 1.00 0.00 O ATOM 236 NE2 GLN A 17 -1.983 9.259 13.072 1.00 0.00 N ATOM 0 H GLN A 17 -0.170 13.058 14.093 1.00 0.00 H new ATOM 0 HA GLN A 17 1.368 12.617 11.602 1.00 0.00 H new ATOM 0 HB2 GLN A 17 -1.586 12.102 12.122 1.00 0.00 H new ATOM 0 HB3 GLN A 17 -0.837 12.076 10.538 1.00 0.00 H new ATOM 0 HG2 GLN A 17 0.343 10.103 10.969 1.00 0.00 H new ATOM 0 HG3 GLN A 17 0.283 10.317 12.707 1.00 0.00 H new ATOM 0 HE21 GLN A 17 -1.521 9.646 13.895 1.00 0.00 H new ATOM 0 HE22 GLN A 17 -2.802 8.661 13.181 1.00 0.00 H new ATOM 245 N GLY A 18 -1.055 14.767 12.300 1.00 0.00 N ATOM 246 CA GLY A 18 -1.507 16.119 12.026 1.00 0.00 C ATOM 247 C GLY A 18 -2.408 16.197 10.810 1.00 0.00 C ATOM 248 O GLY A 18 -3.559 16.622 10.909 1.00 0.00 O ATOM 0 H GLY A 18 -1.643 14.242 12.947 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -2.042 16.503 12.895 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -0.641 16.764 11.874 1.00 0.00 H new ATOM 252 N GLY A 19 -1.884 15.787 9.660 1.00 0.00 N ATOM 253 CA GLY A 19 -2.664 15.821 8.436 1.00 0.00 C ATOM 254 C GLY A 19 -3.730 14.744 8.396 1.00 0.00 C ATOM 255 O GLY A 19 -3.848 13.943 9.324 1.00 0.00 O ATOM 0 H GLY A 19 -0.934 15.432 9.553 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -3.136 16.799 8.337 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -1.998 15.700 7.581 1.00 0.00 H new ATOM 259 N ASP A 20 -4.508 14.725 7.319 1.00 0.00 N ATOM 260 CA ASP A 20 -5.570 13.739 7.161 1.00 0.00 C ATOM 261 C ASP A 20 -5.030 12.452 6.544 1.00 0.00 C ATOM 262 O ASP A 20 -3.949 12.439 5.955 1.00 0.00 O ATOM 263 CB ASP A 20 -6.695 14.306 6.291 1.00 0.00 C ATOM 264 CG ASP A 20 -7.929 14.658 7.100 1.00 0.00 C ATOM 265 OD1 ASP A 20 -8.795 13.776 7.275 1.00 0.00 O ATOM 266 OD2 ASP A 20 -8.028 15.815 7.558 1.00 0.00 O ATOM 0 H ASP A 20 -4.423 15.381 6.543 1.00 0.00 H new ATOM 0 HA ASP A 20 -5.967 13.507 8.149 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -6.337 15.196 5.773 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -6.961 13.577 5.525 1.00 0.00 H new ATOM 271 N GLU A 21 -5.790 11.371 6.684 1.00 0.00 N ATOM 272 CA GLU A 21 -5.389 10.078 6.141 1.00 0.00 C ATOM 273 C GLU A 21 -6.584 9.350 5.532 1.00 0.00 C ATOM 274 O GLU A 21 -7.578 9.094 6.210 1.00 0.00 O ATOM 275 CB GLU A 21 -4.751 9.219 7.235 1.00 0.00 C ATOM 276 CG GLU A 21 -3.268 8.962 7.019 1.00 0.00 C ATOM 277 CD GLU A 21 -2.818 7.631 7.590 1.00 0.00 C ATOM 278 OE1 GLU A 21 -3.140 7.350 8.764 1.00 0.00 O ATOM 279 OE2 GLU A 21 -2.145 6.870 6.864 1.00 0.00 O ATOM 0 H GLU A 21 -6.687 11.365 7.169 1.00 0.00 H new ATOM 0 HA GLU A 21 -4.656 10.252 5.354 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -4.890 9.710 8.198 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -5.273 8.264 7.286 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -3.050 8.987 5.951 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -2.693 9.764 7.481 1.00 0.00 H new ATOM 286 N LYS A 22 -6.477 9.018 4.250 1.00 0.00 N ATOM 287 CA LYS A 22 -7.549 8.319 3.549 1.00 0.00 C ATOM 288 C LYS A 22 -7.225 6.836 3.401 1.00 0.00 C ATOM 289 O LYS A 22 -6.059 6.452 3.303 1.00 0.00 O ATOM 290 CB LYS A 22 -7.778 8.943 2.171 1.00 0.00 C ATOM 291 CG LYS A 22 -9.049 8.463 1.489 1.00 0.00 C ATOM 292 CD LYS A 22 -9.515 9.444 0.425 1.00 0.00 C ATOM 293 CE LYS A 22 -10.017 8.724 -0.817 1.00 0.00 C ATOM 294 NZ LYS A 22 -11.505 8.663 -0.862 1.00 0.00 N ATOM 0 H LYS A 22 -5.659 9.221 3.675 1.00 0.00 H new ATOM 0 HA LYS A 22 -8.460 8.417 4.140 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -7.819 10.027 2.275 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -6.925 8.716 1.532 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -8.873 7.488 1.034 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -9.835 8.331 2.233 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -10.310 10.070 0.830 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -8.693 10.107 0.155 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -9.648 9.235 -1.706 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -9.612 7.712 -0.839 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -11.806 8.165 -1.724 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -11.857 8.154 -0.026 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -11.892 9.628 -0.867 1.00 0.00 H new ATOM 308 N LYS A 23 -8.264 6.007 3.384 1.00 0.00 N ATOM 309 CA LYS A 23 -8.088 4.565 3.247 1.00 0.00 C ATOM 310 C LYS A 23 -9.003 4.006 2.161 1.00 0.00 C ATOM 311 O LYS A 23 -10.144 4.447 2.010 1.00 0.00 O ATOM 312 CB LYS A 23 -8.369 3.868 4.581 1.00 0.00 C ATOM 313 CG LYS A 23 -7.291 2.876 4.986 1.00 0.00 C ATOM 314 CD LYS A 23 -7.171 2.770 6.498 1.00 0.00 C ATOM 315 CE LYS A 23 -5.732 2.537 6.928 1.00 0.00 C ATOM 316 NZ LYS A 23 -5.404 3.264 8.185 1.00 0.00 N ATOM 0 H LYS A 23 -9.235 6.308 3.463 1.00 0.00 H new ATOM 0 HA LYS A 23 -7.055 4.374 2.957 1.00 0.00 H new ATOM 0 HB2 LYS A 23 -8.469 4.622 5.362 1.00 0.00 H new ATOM 0 HB3 LYS A 23 -9.324 3.348 4.516 1.00 0.00 H new ATOM 0 HG2 LYS A 23 -7.522 1.896 4.569 1.00 0.00 H new ATOM 0 HG3 LYS A 23 -6.334 3.185 4.565 1.00 0.00 H new ATOM 0 HD2 LYS A 23 -7.546 3.684 6.959 1.00 0.00 H new ATOM 0 HD3 LYS A 23 -7.796 1.952 6.857 1.00 0.00 H new ATOM 0 HE2 LYS A 23 -5.564 1.470 7.072 1.00 0.00 H new ATOM 0 HE3 LYS A 23 -5.059 2.862 6.135 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 -4.414 3.079 8.445 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 -5.539 4.285 8.041 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 -6.029 2.936 8.949 1.00 0.00 H new ATOM 330 N VAL A 24 -8.497 3.036 1.408 1.00 0.00 N ATOM 331 CA VAL A 24 -9.269 2.418 0.337 1.00 0.00 C ATOM 332 C VAL A 24 -9.025 0.914 0.281 1.00 0.00 C ATOM 333 O VAL A 24 -7.974 0.461 -0.173 1.00 0.00 O ATOM 334 CB VAL A 24 -8.923 3.033 -1.032 1.00 0.00 C ATOM 335 CG1 VAL A 24 -9.884 2.536 -2.101 1.00 0.00 C ATOM 336 CG2 VAL A 24 -8.940 4.553 -0.955 1.00 0.00 C ATOM 0 H VAL A 24 -7.555 2.661 1.520 1.00 0.00 H new ATOM 0 HA VAL A 24 -10.320 2.606 0.556 1.00 0.00 H new ATOM 0 HB VAL A 24 -7.917 2.717 -1.306 1.00 0.00 H new ATOM 0 HG11 VAL A 24 -9.623 2.982 -3.061 1.00 0.00 H new ATOM 0 HG12 VAL A 24 -9.816 1.451 -2.175 1.00 0.00 H new ATOM 0 HG13 VAL A 24 -10.902 2.819 -1.835 1.00 0.00 H new ATOM 0 HG21 VAL A 24 -8.693 4.970 -1.932 1.00 0.00 H new ATOM 0 HG22 VAL A 24 -9.932 4.891 -0.657 1.00 0.00 H new ATOM 0 HG23 VAL A 24 -8.207 4.888 -0.222 1.00 0.00 H new ATOM 346 N ASN A 25 -10.002 0.143 0.747 1.00 0.00 N ATOM 347 CA ASN A 25 -9.894 -1.312 0.750 1.00 0.00 C ATOM 348 C ASN A 25 -10.401 -1.900 -0.562 1.00 0.00 C ATOM 349 O ASN A 25 -11.422 -1.464 -1.095 1.00 0.00 O ATOM 350 CB ASN A 25 -10.680 -1.900 1.924 1.00 0.00 C ATOM 351 CG ASN A 25 -12.160 -1.580 1.845 1.00 0.00 C ATOM 352 OD1 ASN A 25 -12.563 -0.421 1.937 1.00 0.00 O ATOM 353 ND2 ASN A 25 -12.980 -2.611 1.675 1.00 0.00 N ATOM 0 H ASN A 25 -10.878 0.501 1.128 1.00 0.00 H new ATOM 0 HA ASN A 25 -8.841 -1.572 0.859 1.00 0.00 H new ATOM 0 HB2 ASN A 25 -10.545 -2.981 1.943 1.00 0.00 H new ATOM 0 HB3 ASN A 25 -10.276 -1.512 2.859 1.00 0.00 H new ATOM 0 HD21 ASN A 25 -13.987 -2.458 1.616 1.00 0.00 H new ATOM 0 HD22 ASN A 25 -12.603 -3.556 1.604 1.00 0.00 H new ATOM 360 N LEU A 26 -9.683 -2.892 -1.078 1.00 0.00 N ATOM 361 CA LEU A 26 -10.060 -3.541 -2.327 1.00 0.00 C ATOM 362 C LEU A 26 -10.027 -5.059 -2.184 1.00 0.00 C ATOM 363 O LEU A 26 -9.043 -5.627 -1.710 1.00 0.00 O ATOM 364 CB LEU A 26 -9.124 -3.104 -3.457 1.00 0.00 C ATOM 365 CG LEU A 26 -9.125 -1.604 -3.753 1.00 0.00 C ATOM 366 CD1 LEU A 26 -8.145 -1.281 -4.870 1.00 0.00 C ATOM 367 CD2 LEU A 26 -10.525 -1.133 -4.116 1.00 0.00 C ATOM 0 H LEU A 26 -8.836 -3.264 -0.649 1.00 0.00 H new ATOM 0 HA LEU A 26 -11.079 -3.239 -2.570 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -8.108 -3.409 -3.205 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -9.401 -3.639 -4.366 1.00 0.00 H new ATOM 0 HG LEU A 26 -8.808 -1.075 -2.854 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -8.159 -0.209 -5.067 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -7.141 -1.582 -4.571 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -8.432 -1.820 -5.773 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -10.507 -0.063 -4.323 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -10.871 -1.668 -5.000 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -11.202 -1.330 -3.285 1.00 0.00 H new ATOM 379 N VAL A 27 -11.110 -5.711 -2.597 1.00 0.00 N ATOM 380 CA VAL A 27 -11.204 -7.163 -2.515 1.00 0.00 C ATOM 381 C VAL A 27 -10.970 -7.806 -3.878 1.00 0.00 C ATOM 382 O VAL A 27 -11.806 -7.707 -4.775 1.00 0.00 O ATOM 383 CB VAL A 27 -12.580 -7.608 -1.980 1.00 0.00 C ATOM 384 CG1 VAL A 27 -12.606 -9.112 -1.755 1.00 0.00 C ATOM 385 CG2 VAL A 27 -12.921 -6.865 -0.697 1.00 0.00 C ATOM 0 H VAL A 27 -11.934 -5.256 -2.991 1.00 0.00 H new ATOM 0 HA VAL A 27 -10.429 -7.492 -1.822 1.00 0.00 H new ATOM 0 HB VAL A 27 -13.335 -7.362 -2.727 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -13.585 -9.407 -1.377 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -12.411 -9.624 -2.697 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -11.840 -9.385 -1.029 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -13.896 -7.193 -0.335 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -12.164 -7.076 0.058 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -12.949 -5.793 -0.894 1.00 0.00 H new ATOM 395 N LEU A 28 -9.824 -8.465 -4.027 1.00 0.00 N ATOM 396 CA LEU A 28 -9.479 -9.124 -5.281 1.00 0.00 C ATOM 397 C LEU A 28 -10.032 -10.543 -5.321 1.00 0.00 C ATOM 398 O LEU A 28 -10.556 -11.045 -4.326 1.00 0.00 O ATOM 399 CB LEU A 28 -7.959 -9.149 -5.466 1.00 0.00 C ATOM 400 CG LEU A 28 -7.303 -7.777 -5.623 1.00 0.00 C ATOM 401 CD1 LEU A 28 -5.794 -7.887 -5.474 1.00 0.00 C ATOM 402 CD2 LEU A 28 -7.665 -7.166 -6.970 1.00 0.00 C ATOM 0 H LEU A 28 -9.120 -8.556 -3.295 1.00 0.00 H new ATOM 0 HA LEU A 28 -9.928 -8.557 -6.096 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -7.512 -9.652 -4.609 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -7.725 -9.749 -6.345 1.00 0.00 H new ATOM 0 HG LEU A 28 -7.678 -7.123 -4.836 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -5.344 -6.901 -5.589 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -5.554 -8.283 -4.487 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -5.401 -8.556 -6.239 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -7.190 -6.190 -7.066 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -7.318 -7.819 -7.771 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -8.747 -7.052 -7.039 1.00 0.00 H new ATOM 414 N GLY A 29 -9.913 -11.187 -6.477 1.00 0.00 N ATOM 415 CA GLY A 29 -10.405 -12.544 -6.626 1.00 0.00 C ATOM 416 C GLY A 29 -9.294 -13.574 -6.566 1.00 0.00 C ATOM 417 O GLY A 29 -9.308 -14.555 -7.308 1.00 0.00 O ATOM 0 H GLY A 29 -9.484 -10.793 -7.314 1.00 0.00 H new ATOM 0 HA2 GLY A 29 -11.132 -12.752 -5.841 1.00 0.00 H new ATOM 0 HA3 GLY A 29 -10.929 -12.635 -7.577 1.00 0.00 H new ATOM 421 N ASP A 30 -8.328 -13.348 -5.681 1.00 0.00 N ATOM 422 CA ASP A 30 -7.203 -14.263 -5.528 1.00 0.00 C ATOM 423 C ASP A 30 -6.426 -14.400 -6.834 1.00 0.00 C ATOM 424 O ASP A 30 -5.754 -15.405 -7.065 1.00 0.00 O ATOM 425 CB ASP A 30 -7.697 -15.637 -5.071 1.00 0.00 C ATOM 426 CG ASP A 30 -8.021 -15.671 -3.590 1.00 0.00 C ATOM 427 OD1 ASP A 30 -7.093 -15.898 -2.785 1.00 0.00 O ATOM 428 OD2 ASP A 30 -9.202 -15.473 -3.236 1.00 0.00 O ATOM 0 H ASP A 30 -8.302 -12.540 -5.060 1.00 0.00 H new ATOM 0 HA ASP A 30 -6.535 -13.851 -4.772 1.00 0.00 H new ATOM 0 HB2 ASP A 30 -8.585 -15.909 -5.641 1.00 0.00 H new ATOM 0 HB3 ASP A 30 -6.936 -16.386 -5.291 1.00 0.00 H new ATOM 433 N GLY A 31 -6.522 -13.382 -7.685 1.00 0.00 N ATOM 434 CA GLY A 31 -5.821 -13.412 -8.955 1.00 0.00 C ATOM 435 C GLY A 31 -6.096 -12.181 -9.797 1.00 0.00 C ATOM 436 O GLY A 31 -6.189 -12.266 -11.021 1.00 0.00 O ATOM 0 H GLY A 31 -7.072 -12.539 -7.518 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -4.749 -13.492 -8.773 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -6.118 -14.302 -9.510 1.00 0.00 H new ATOM 440 N ARG A 32 -6.227 -11.033 -9.139 1.00 0.00 N ATOM 441 CA ARG A 32 -6.494 -9.779 -9.835 1.00 0.00 C ATOM 442 C ARG A 32 -5.368 -8.777 -9.602 1.00 0.00 C ATOM 443 O ARG A 32 -4.383 -9.080 -8.929 1.00 0.00 O ATOM 444 CB ARG A 32 -7.825 -9.186 -9.367 1.00 0.00 C ATOM 445 CG ARG A 32 -9.041 -9.850 -9.995 1.00 0.00 C ATOM 446 CD ARG A 32 -9.799 -8.889 -10.898 1.00 0.00 C ATOM 447 NE ARG A 32 -8.917 -8.223 -11.853 1.00 0.00 N ATOM 448 CZ ARG A 32 -9.348 -7.567 -12.929 1.00 0.00 C ATOM 449 NH1 ARG A 32 -10.648 -7.488 -13.188 1.00 0.00 N ATOM 450 NH2 ARG A 32 -8.479 -6.990 -13.746 1.00 0.00 N ATOM 0 H ARG A 32 -6.153 -10.945 -8.125 1.00 0.00 H new ATOM 0 HA ARG A 32 -6.553 -9.990 -10.903 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -7.892 -9.275 -8.283 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -7.841 -8.121 -9.601 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -8.725 -10.719 -10.572 1.00 0.00 H new ATOM 0 HG3 ARG A 32 -9.704 -10.213 -9.210 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -10.573 -9.434 -11.439 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -10.304 -8.140 -10.288 1.00 0.00 H new ATOM 0 HE ARG A 32 -7.912 -8.263 -11.686 1.00 0.00 H new ATOM 0 HH11 ARG A 32 -11.321 -7.931 -12.562 1.00 0.00 H new ATOM 0 HH12 ARG A 32 -10.974 -6.985 -14.013 1.00 0.00 H new ATOM 0 HH21 ARG A 32 -7.479 -7.048 -13.551 1.00 0.00 H new ATOM 0 HH22 ARG A 32 -8.810 -6.488 -14.570 1.00 0.00 H new ATOM 464 N SER A 33 -5.521 -7.582 -10.164 1.00 0.00 N ATOM 465 CA SER A 33 -4.518 -6.535 -10.019 1.00 0.00 C ATOM 466 C SER A 33 -5.176 -5.175 -9.815 1.00 0.00 C ATOM 467 O SER A 33 -6.331 -4.970 -10.191 1.00 0.00 O ATOM 468 CB SER A 33 -3.609 -6.495 -11.248 1.00 0.00 C ATOM 469 OG SER A 33 -2.504 -7.370 -11.096 1.00 0.00 O ATOM 0 H SER A 33 -6.331 -7.315 -10.724 1.00 0.00 H new ATOM 0 HA SER A 33 -3.917 -6.763 -9.139 1.00 0.00 H new ATOM 0 HB2 SER A 33 -4.179 -6.775 -12.134 1.00 0.00 H new ATOM 0 HB3 SER A 33 -3.252 -5.478 -11.407 1.00 0.00 H new ATOM 0 HG SER A 33 -1.940 -7.327 -11.896 1.00 0.00 H new ATOM 475 N LEU A 34 -4.435 -4.246 -9.217 1.00 0.00 N ATOM 476 CA LEU A 34 -4.948 -2.905 -8.964 1.00 0.00 C ATOM 477 C LEU A 34 -4.826 -2.032 -10.208 1.00 0.00 C ATOM 478 O LEU A 34 -5.686 -1.195 -10.478 1.00 0.00 O ATOM 479 CB LEU A 34 -4.196 -2.260 -7.798 1.00 0.00 C ATOM 480 CG LEU A 34 -4.205 -3.066 -6.497 1.00 0.00 C ATOM 481 CD1 LEU A 34 -3.429 -2.336 -5.413 1.00 0.00 C ATOM 482 CD2 LEU A 34 -5.634 -3.331 -6.047 1.00 0.00 C ATOM 0 H LEU A 34 -3.478 -4.398 -8.899 1.00 0.00 H new ATOM 0 HA LEU A 34 -6.003 -2.990 -8.704 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -3.161 -2.096 -8.099 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -4.630 -1.279 -7.603 1.00 0.00 H new ATOM 0 HG LEU A 34 -3.719 -4.024 -6.680 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -3.446 -2.924 -4.495 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -2.397 -2.196 -5.736 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -3.887 -1.364 -5.230 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -5.623 -3.905 -5.121 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -6.145 -2.383 -5.880 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -6.159 -3.895 -6.817 1.00 0.00 H new ATOM 494 N GLY A 35 -3.750 -2.233 -10.963 1.00 0.00 N ATOM 495 CA GLY A 35 -3.536 -1.457 -12.170 1.00 0.00 C ATOM 496 C GLY A 35 -3.251 0.003 -11.877 1.00 0.00 C ATOM 497 O GLY A 35 -3.867 0.893 -12.462 1.00 0.00 O ATOM 0 H GLY A 35 -3.023 -2.919 -10.760 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -2.702 -1.882 -12.728 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -4.417 -1.531 -12.807 1.00 0.00 H new ATOM 501 N LEU A 36 -2.313 0.250 -10.967 1.00 0.00 N ATOM 502 CA LEU A 36 -1.948 1.613 -10.596 1.00 0.00 C ATOM 503 C LEU A 36 -0.485 1.893 -10.928 1.00 0.00 C ATOM 504 O LEU A 36 0.411 1.175 -10.483 1.00 0.00 O ATOM 505 CB LEU A 36 -2.198 1.842 -9.105 1.00 0.00 C ATOM 506 CG LEU A 36 -3.668 1.811 -8.682 1.00 0.00 C ATOM 507 CD1 LEU A 36 -3.789 1.513 -7.196 1.00 0.00 C ATOM 508 CD2 LEU A 36 -4.346 3.130 -9.020 1.00 0.00 C ATOM 0 H LEU A 36 -1.793 -0.475 -10.474 1.00 0.00 H new ATOM 0 HA LEU A 36 -2.570 2.299 -11.171 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -1.657 1.082 -8.541 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -1.776 2.807 -8.826 1.00 0.00 H new ATOM 0 HG LEU A 36 -4.169 1.015 -9.233 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -4.841 1.495 -6.913 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -3.339 0.544 -6.981 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -3.274 2.286 -6.627 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -5.391 3.091 -8.713 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -3.843 3.942 -8.495 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -4.290 3.303 -10.095 1.00 0.00 H new ATOM 520 N THR A 37 -0.251 2.940 -11.711 1.00 0.00 N ATOM 521 CA THR A 37 1.102 3.316 -12.102 1.00 0.00 C ATOM 522 C THR A 37 1.779 4.132 -11.006 1.00 0.00 C ATOM 523 O THR A 37 1.652 5.357 -10.962 1.00 0.00 O ATOM 524 CB THR A 37 1.077 4.115 -13.406 1.00 0.00 C ATOM 525 OG1 THR A 37 0.251 3.481 -14.366 1.00 0.00 O ATOM 526 CG2 THR A 37 2.446 4.294 -14.025 1.00 0.00 C ATOM 0 H THR A 37 -0.982 3.544 -12.088 1.00 0.00 H new ATOM 0 HA THR A 37 1.675 2.401 -12.256 1.00 0.00 H new ATOM 0 HB THR A 37 0.688 5.097 -13.136 1.00 0.00 H new ATOM 0 HG1 THR A 37 0.370 3.914 -15.237 1.00 0.00 H new ATOM 0 HG21 THR A 37 2.356 4.869 -14.947 1.00 0.00 H new ATOM 0 HG22 THR A 37 3.094 4.825 -13.328 1.00 0.00 H new ATOM 0 HG23 THR A 37 2.875 3.317 -14.247 1.00 0.00 H new ATOM 534 N ILE A 38 2.495 3.447 -10.122 1.00 0.00 N ATOM 535 CA ILE A 38 3.192 4.109 -9.026 1.00 0.00 C ATOM 536 C ILE A 38 4.629 4.445 -9.410 1.00 0.00 C ATOM 537 O ILE A 38 5.234 3.768 -10.243 1.00 0.00 O ATOM 538 CB ILE A 38 3.204 3.233 -7.758 1.00 0.00 C ATOM 539 CG1 ILE A 38 3.864 1.884 -8.048 1.00 0.00 C ATOM 540 CG2 ILE A 38 1.789 3.037 -7.235 1.00 0.00 C ATOM 541 CD1 ILE A 38 4.175 1.083 -6.803 1.00 0.00 C ATOM 0 H ILE A 38 2.608 2.433 -10.143 1.00 0.00 H new ATOM 0 HA ILE A 38 2.649 5.031 -8.818 1.00 0.00 H new ATOM 0 HB ILE A 38 3.786 3.742 -6.990 1.00 0.00 H new ATOM 0 HG12 ILE A 38 3.208 1.299 -8.692 1.00 0.00 H new ATOM 0 HG13 ILE A 38 4.787 2.052 -8.602 1.00 0.00 H new ATOM 0 HG21 ILE A 38 1.815 2.416 -6.339 1.00 0.00 H new ATOM 0 HG22 ILE A 38 1.353 4.006 -6.992 1.00 0.00 H new ATOM 0 HG23 ILE A 38 1.184 2.548 -7.998 1.00 0.00 H new ATOM 0 HD11 ILE A 38 4.641 0.139 -7.085 1.00 0.00 H new ATOM 0 HD12 ILE A 38 4.856 1.649 -6.167 1.00 0.00 H new ATOM 0 HD13 ILE A 38 3.252 0.883 -6.259 1.00 0.00 H new ATOM 553 N ARG A 39 5.169 5.494 -8.800 1.00 0.00 N ATOM 554 CA ARG A 39 6.536 5.920 -9.079 1.00 0.00 C ATOM 555 C ARG A 39 7.233 6.377 -7.802 1.00 0.00 C ATOM 556 O ARG A 39 6.625 7.017 -6.943 1.00 0.00 O ATOM 557 CB ARG A 39 6.539 7.051 -10.109 1.00 0.00 C ATOM 558 CG ARG A 39 5.756 8.278 -9.668 1.00 0.00 C ATOM 559 CD ARG A 39 6.679 9.387 -9.191 1.00 0.00 C ATOM 560 NE ARG A 39 5.958 10.636 -8.956 1.00 0.00 N ATOM 561 CZ ARG A 39 6.544 11.829 -8.884 1.00 0.00 C ATOM 562 NH1 ARG A 39 7.860 11.940 -9.028 1.00 0.00 N ATOM 563 NH2 ARG A 39 5.814 12.915 -8.668 1.00 0.00 N ATOM 0 H ARG A 39 4.682 6.065 -8.109 1.00 0.00 H new ATOM 0 HA ARG A 39 7.081 5.068 -9.484 1.00 0.00 H new ATOM 0 HB2 ARG A 39 7.569 7.342 -10.314 1.00 0.00 H new ATOM 0 HB3 ARG A 39 6.121 6.680 -11.045 1.00 0.00 H new ATOM 0 HG2 ARG A 39 5.149 8.640 -10.497 1.00 0.00 H new ATOM 0 HG3 ARG A 39 5.070 8.004 -8.866 1.00 0.00 H new ATOM 0 HD2 ARG A 39 7.174 9.076 -8.271 1.00 0.00 H new ATOM 0 HD3 ARG A 39 7.460 9.553 -9.933 1.00 0.00 H new ATOM 0 HE ARG A 39 4.946 10.591 -8.840 1.00 0.00 H new ATOM 0 HH11 ARG A 39 8.427 11.108 -9.195 1.00 0.00 H new ATOM 0 HH12 ARG A 39 8.304 12.857 -8.972 1.00 0.00 H new ATOM 0 HH21 ARG A 39 4.803 12.836 -8.557 1.00 0.00 H new ATOM 0 HH22 ARG A 39 6.263 13.829 -8.613 1.00 0.00 H new ATOM 577 N GLY A 40 8.515 6.046 -7.683 1.00 0.00 N ATOM 578 CA GLY A 40 9.274 6.431 -6.507 1.00 0.00 C ATOM 579 C GLY A 40 9.360 5.318 -5.483 1.00 0.00 C ATOM 580 O GLY A 40 8.433 4.518 -5.345 1.00 0.00 O ATOM 0 H GLY A 40 9.041 5.518 -8.379 1.00 0.00 H new ATOM 0 HA2 GLY A 40 10.280 6.723 -6.807 1.00 0.00 H new ATOM 0 HA3 GLY A 40 8.811 7.306 -6.050 1.00 0.00 H new ATOM 584 N GLY A 41 10.475 5.263 -4.761 1.00 0.00 N ATOM 585 CA GLY A 41 10.656 4.235 -3.754 1.00 0.00 C ATOM 586 C GLY A 41 11.978 4.367 -3.023 1.00 0.00 C ATOM 587 O GLY A 41 12.668 5.379 -3.151 1.00 0.00 O ATOM 0 H GLY A 41 11.256 5.912 -4.856 1.00 0.00 H new ATOM 0 HA2 GLY A 41 9.839 4.288 -3.034 1.00 0.00 H new ATOM 0 HA3 GLY A 41 10.602 3.254 -4.226 1.00 0.00 H new ATOM 591 N ALA A 42 12.331 3.342 -2.253 1.00 0.00 N ATOM 592 CA ALA A 42 13.577 3.348 -1.498 1.00 0.00 C ATOM 593 C ALA A 42 14.784 3.329 -2.430 1.00 0.00 C ATOM 594 O ALA A 42 15.786 3.998 -2.179 1.00 0.00 O ATOM 595 CB ALA A 42 13.623 2.161 -0.548 1.00 0.00 C ATOM 0 H ALA A 42 11.771 2.497 -2.136 1.00 0.00 H new ATOM 0 HA ALA A 42 13.616 4.268 -0.915 1.00 0.00 H new ATOM 0 HB1 ALA A 42 14.559 2.178 0.010 1.00 0.00 H new ATOM 0 HB2 ALA A 42 12.785 2.219 0.147 1.00 0.00 H new ATOM 0 HB3 ALA A 42 13.557 1.235 -1.119 1.00 0.00 H new ATOM 601 N GLU A 43 14.681 2.557 -3.508 1.00 0.00 N ATOM 602 CA GLU A 43 15.764 2.450 -4.478 1.00 0.00 C ATOM 603 C GLU A 43 16.030 3.796 -5.147 1.00 0.00 C ATOM 604 O GLU A 43 17.179 4.158 -5.399 1.00 0.00 O ATOM 605 CB GLU A 43 15.427 1.399 -5.538 1.00 0.00 C ATOM 606 CG GLU A 43 16.649 0.699 -6.109 1.00 0.00 C ATOM 607 CD GLU A 43 16.398 -0.768 -6.398 1.00 0.00 C ATOM 608 OE1 GLU A 43 15.752 -1.069 -7.424 1.00 0.00 O ATOM 609 OE2 GLU A 43 16.847 -1.616 -5.599 1.00 0.00 O ATOM 0 H GLU A 43 13.858 1.997 -3.731 1.00 0.00 H new ATOM 0 HA GLU A 43 16.665 2.144 -3.946 1.00 0.00 H new ATOM 0 HB2 GLU A 43 14.763 0.654 -5.101 1.00 0.00 H new ATOM 0 HB3 GLU A 43 14.879 1.877 -6.350 1.00 0.00 H new ATOM 0 HG2 GLU A 43 16.954 1.200 -7.028 1.00 0.00 H new ATOM 0 HG3 GLU A 43 17.477 0.791 -5.406 1.00 0.00 H new ATOM 616 N TYR A 44 14.961 4.532 -5.429 1.00 0.00 N ATOM 617 CA TYR A 44 15.079 5.838 -6.067 1.00 0.00 C ATOM 618 C TYR A 44 15.114 6.964 -5.032 1.00 0.00 C ATOM 619 O TYR A 44 15.133 8.141 -5.389 1.00 0.00 O ATOM 620 CB TYR A 44 13.916 6.060 -7.037 1.00 0.00 C ATOM 621 CG TYR A 44 13.937 5.134 -8.231 1.00 0.00 C ATOM 622 CD1 TYR A 44 13.765 3.764 -8.075 1.00 0.00 C ATOM 623 CD2 TYR A 44 14.129 5.628 -9.515 1.00 0.00 C ATOM 624 CE1 TYR A 44 13.784 2.913 -9.164 1.00 0.00 C ATOM 625 CE2 TYR A 44 14.149 4.785 -10.609 1.00 0.00 C ATOM 626 CZ TYR A 44 13.975 3.428 -10.428 1.00 0.00 C ATOM 627 OH TYR A 44 13.995 2.586 -11.515 1.00 0.00 O ATOM 0 H TYR A 44 14.003 4.247 -5.226 1.00 0.00 H new ATOM 0 HA TYR A 44 16.019 5.855 -6.619 1.00 0.00 H new ATOM 0 HB2 TYR A 44 12.976 5.926 -6.501 1.00 0.00 H new ATOM 0 HB3 TYR A 44 13.939 7.092 -7.388 1.00 0.00 H new ATOM 0 HD1 TYR A 44 13.614 3.357 -7.086 1.00 0.00 H new ATOM 0 HD2 TYR A 44 14.265 6.689 -9.660 1.00 0.00 H new ATOM 0 HE1 TYR A 44 13.650 1.850 -9.025 1.00 0.00 H new ATOM 0 HE2 TYR A 44 14.300 5.186 -11.601 1.00 0.00 H new ATOM 0 HH TYR A 44 14.139 3.109 -12.331 1.00 0.00 H new ATOM 637 N GLY A 45 15.122 6.598 -3.752 1.00 0.00 N ATOM 638 CA GLY A 45 15.155 7.595 -2.698 1.00 0.00 C ATOM 639 C GLY A 45 13.992 8.564 -2.776 1.00 0.00 C ATOM 640 O GLY A 45 14.171 9.772 -2.622 1.00 0.00 O ATOM 0 H GLY A 45 15.106 5.631 -3.428 1.00 0.00 H new ATOM 0 HA2 GLY A 45 15.142 7.095 -1.729 1.00 0.00 H new ATOM 0 HA3 GLY A 45 16.091 8.151 -2.758 1.00 0.00 H new ATOM 644 N LEU A 46 12.797 8.034 -3.017 1.00 0.00 N ATOM 645 CA LEU A 46 11.600 8.861 -3.116 1.00 0.00 C ATOM 646 C LEU A 46 10.383 8.125 -2.567 1.00 0.00 C ATOM 647 O LEU A 46 10.362 6.896 -2.505 1.00 0.00 O ATOM 648 CB LEU A 46 11.353 9.265 -4.571 1.00 0.00 C ATOM 649 CG LEU A 46 10.249 10.305 -4.774 1.00 0.00 C ATOM 650 CD1 LEU A 46 10.610 11.608 -4.077 1.00 0.00 C ATOM 651 CD2 LEU A 46 10.008 10.541 -6.257 1.00 0.00 C ATOM 0 H LEU A 46 12.632 7.036 -3.147 1.00 0.00 H new ATOM 0 HA LEU A 46 11.759 9.759 -2.519 1.00 0.00 H new ATOM 0 HB2 LEU A 46 12.281 9.657 -4.986 1.00 0.00 H new ATOM 0 HB3 LEU A 46 11.100 8.372 -5.143 1.00 0.00 H new ATOM 0 HG LEU A 46 9.329 9.923 -4.332 1.00 0.00 H new ATOM 0 HD11 LEU A 46 9.814 12.336 -4.232 1.00 0.00 H new ATOM 0 HD12 LEU A 46 10.734 11.427 -3.009 1.00 0.00 H new ATOM 0 HD13 LEU A 46 11.541 11.996 -4.490 1.00 0.00 H new ATOM 0 HD21 LEU A 46 9.220 11.283 -6.384 1.00 0.00 H new ATOM 0 HD22 LEU A 46 10.925 10.903 -6.722 1.00 0.00 H new ATOM 0 HD23 LEU A 46 9.706 9.607 -6.730 1.00 0.00 H new ATOM 663 N GLY A 47 9.367 8.886 -2.169 1.00 0.00 N ATOM 664 CA GLY A 47 8.160 8.289 -1.631 1.00 0.00 C ATOM 665 C GLY A 47 7.347 7.569 -2.688 1.00 0.00 C ATOM 666 O GLY A 47 7.745 7.508 -3.852 1.00 0.00 O ATOM 0 H GLY A 47 9.359 9.905 -2.210 1.00 0.00 H new ATOM 0 HA2 GLY A 47 8.427 7.586 -0.842 1.00 0.00 H new ATOM 0 HA3 GLY A 47 7.548 9.066 -1.173 1.00 0.00 H new ATOM 670 N ILE A 48 6.205 7.023 -2.285 1.00 0.00 N ATOM 671 CA ILE A 48 5.335 6.303 -3.206 1.00 0.00 C ATOM 672 C ILE A 48 4.211 7.201 -3.714 1.00 0.00 C ATOM 673 O ILE A 48 3.393 7.689 -2.934 1.00 0.00 O ATOM 674 CB ILE A 48 4.720 5.056 -2.541 1.00 0.00 C ATOM 675 CG1 ILE A 48 5.807 4.235 -1.845 1.00 0.00 C ATOM 676 CG2 ILE A 48 3.991 4.211 -3.574 1.00 0.00 C ATOM 677 CD1 ILE A 48 6.879 3.730 -2.786 1.00 0.00 C ATOM 0 H ILE A 48 5.860 7.066 -1.326 1.00 0.00 H new ATOM 0 HA ILE A 48 5.954 5.988 -4.046 1.00 0.00 H new ATOM 0 HB ILE A 48 3.999 5.380 -1.791 1.00 0.00 H new ATOM 0 HG12 ILE A 48 6.272 4.845 -1.071 1.00 0.00 H new ATOM 0 HG13 ILE A 48 5.344 3.384 -1.345 1.00 0.00 H new ATOM 0 HG21 ILE A 48 3.562 3.334 -3.089 1.00 0.00 H new ATOM 0 HG22 ILE A 48 3.195 4.800 -4.029 1.00 0.00 H new ATOM 0 HG23 ILE A 48 4.693 3.893 -4.345 1.00 0.00 H new ATOM 0 HD11 ILE A 48 7.616 3.157 -2.224 1.00 0.00 H new ATOM 0 HD12 ILE A 48 6.426 3.093 -3.545 1.00 0.00 H new ATOM 0 HD13 ILE A 48 7.369 4.576 -3.268 1.00 0.00 H new ATOM 689 N TYR A 49 4.177 7.411 -5.025 1.00 0.00 N ATOM 690 CA TYR A 49 3.154 8.250 -5.639 1.00 0.00 C ATOM 691 C TYR A 49 2.429 7.497 -6.750 1.00 0.00 C ATOM 692 O TYR A 49 2.667 6.309 -6.966 1.00 0.00 O ATOM 693 CB TYR A 49 3.780 9.529 -6.199 1.00 0.00 C ATOM 694 CG TYR A 49 4.545 10.330 -5.170 1.00 0.00 C ATOM 695 CD1 TYR A 49 3.878 11.040 -4.178 1.00 0.00 C ATOM 696 CD2 TYR A 49 5.933 10.378 -5.190 1.00 0.00 C ATOM 697 CE1 TYR A 49 4.574 11.773 -3.237 1.00 0.00 C ATOM 698 CE2 TYR A 49 6.635 11.109 -4.252 1.00 0.00 C ATOM 699 CZ TYR A 49 5.951 11.805 -3.277 1.00 0.00 C ATOM 700 OH TYR A 49 6.647 12.535 -2.341 1.00 0.00 O ATOM 0 H TYR A 49 4.846 7.012 -5.683 1.00 0.00 H new ATOM 0 HA TYR A 49 2.429 8.516 -4.870 1.00 0.00 H new ATOM 0 HB2 TYR A 49 4.452 9.267 -7.016 1.00 0.00 H new ATOM 0 HB3 TYR A 49 2.993 10.154 -6.622 1.00 0.00 H new ATOM 0 HD1 TYR A 49 2.799 11.018 -4.143 1.00 0.00 H new ATOM 0 HD2 TYR A 49 6.472 9.835 -5.952 1.00 0.00 H new ATOM 0 HE1 TYR A 49 4.041 12.319 -2.473 1.00 0.00 H new ATOM 0 HE2 TYR A 49 7.714 11.136 -4.282 1.00 0.00 H new ATOM 0 HH TYR A 49 7.609 12.451 -2.510 1.00 0.00 H new ATOM 710 N ILE A 50 1.543 8.198 -7.451 1.00 0.00 N ATOM 711 CA ILE A 50 0.784 7.596 -8.540 1.00 0.00 C ATOM 712 C ILE A 50 0.753 8.510 -9.759 1.00 0.00 C ATOM 713 O ILE A 50 0.620 9.727 -9.631 1.00 0.00 O ATOM 714 CB ILE A 50 -0.662 7.283 -8.111 1.00 0.00 C ATOM 715 CG1 ILE A 50 -0.671 6.535 -6.777 1.00 0.00 C ATOM 716 CG2 ILE A 50 -1.369 6.469 -9.184 1.00 0.00 C ATOM 717 CD1 ILE A 50 -2.036 6.476 -6.126 1.00 0.00 C ATOM 0 H ILE A 50 1.334 9.182 -7.284 1.00 0.00 H new ATOM 0 HA ILE A 50 1.288 6.665 -8.800 1.00 0.00 H new ATOM 0 HB ILE A 50 -1.198 8.223 -7.983 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -0.309 5.519 -6.937 1.00 0.00 H new ATOM 0 HG13 ILE A 50 0.028 7.018 -6.094 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -2.390 6.256 -8.866 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -1.390 7.035 -10.115 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -0.835 5.532 -9.341 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -1.967 5.931 -5.185 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -2.392 7.488 -5.934 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -2.734 5.966 -6.790 1.00 0.00 H new ATOM 729 N THR A 51 0.876 7.916 -10.941 1.00 0.00 N ATOM 730 CA THR A 51 0.862 8.677 -12.185 1.00 0.00 C ATOM 731 C THR A 51 0.168 7.895 -13.296 1.00 0.00 C ATOM 732 O THR A 51 0.491 8.050 -14.473 1.00 0.00 O ATOM 733 CB THR A 51 2.290 9.028 -12.608 1.00 0.00 C ATOM 734 OG1 THR A 51 3.069 7.856 -12.764 1.00 0.00 O ATOM 735 CG2 THR A 51 3.003 9.926 -11.620 1.00 0.00 C ATOM 0 H THR A 51 0.987 6.909 -11.064 1.00 0.00 H new ATOM 0 HA THR A 51 0.304 9.597 -12.012 1.00 0.00 H new ATOM 0 HB THR A 51 2.189 9.563 -13.552 1.00 0.00 H new ATOM 0 HG1 THR A 51 3.978 8.101 -13.036 1.00 0.00 H new ATOM 0 HG21 THR A 51 4.010 10.136 -11.980 1.00 0.00 H new ATOM 0 HG22 THR A 51 2.453 10.861 -11.515 1.00 0.00 H new ATOM 0 HG23 THR A 51 3.061 9.428 -10.652 1.00 0.00 H new ATOM 743 N GLY A 52 -0.789 7.056 -12.913 1.00 0.00 N ATOM 744 CA GLY A 52 -1.514 6.263 -13.889 1.00 0.00 C ATOM 745 C GLY A 52 -2.577 5.389 -13.255 1.00 0.00 C ATOM 746 O GLY A 52 -2.447 4.978 -12.101 1.00 0.00 O ATOM 0 H GLY A 52 -1.075 6.911 -11.945 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -1.981 6.927 -14.617 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -0.811 5.635 -14.436 1.00 0.00 H new ATOM 750 N VAL A 53 -3.633 5.103 -14.010 1.00 0.00 N ATOM 751 CA VAL A 53 -4.724 4.271 -13.515 1.00 0.00 C ATOM 752 C VAL A 53 -5.329 3.435 -14.637 1.00 0.00 C ATOM 753 O VAL A 53 -5.814 3.973 -15.633 1.00 0.00 O ATOM 754 CB VAL A 53 -5.833 5.122 -12.870 1.00 0.00 C ATOM 755 CG1 VAL A 53 -6.861 4.234 -12.185 1.00 0.00 C ATOM 756 CG2 VAL A 53 -5.238 6.118 -11.885 1.00 0.00 C ATOM 0 H VAL A 53 -3.756 5.435 -14.967 1.00 0.00 H new ATOM 0 HA VAL A 53 -4.299 3.610 -12.760 1.00 0.00 H new ATOM 0 HB VAL A 53 -6.338 5.681 -13.657 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -7.636 4.855 -11.736 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -7.311 3.566 -12.919 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -6.373 3.644 -11.409 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -6.037 6.710 -11.439 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -4.705 5.580 -11.101 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -4.546 6.778 -12.408 1.00 0.00 H new ATOM 766 N ASP A 54 -5.298 2.117 -14.470 1.00 0.00 N ATOM 767 CA ASP A 54 -5.842 1.205 -15.469 1.00 0.00 C ATOM 768 C ASP A 54 -7.333 1.465 -15.691 1.00 0.00 C ATOM 769 O ASP A 54 -8.153 1.186 -14.818 1.00 0.00 O ATOM 770 CB ASP A 54 -5.628 -0.245 -15.035 1.00 0.00 C ATOM 771 CG ASP A 54 -4.348 -0.835 -15.598 1.00 0.00 C ATOM 772 OD1 ASP A 54 -3.954 -0.439 -16.715 1.00 0.00 O ATOM 773 OD2 ASP A 54 -3.742 -1.692 -14.922 1.00 0.00 O ATOM 0 H ASP A 54 -4.901 1.656 -13.651 1.00 0.00 H new ATOM 0 HA ASP A 54 -5.316 1.379 -16.408 1.00 0.00 H new ATOM 0 HB2 ASP A 54 -5.600 -0.295 -13.947 1.00 0.00 H new ATOM 0 HB3 ASP A 54 -6.476 -0.848 -15.360 1.00 0.00 H new ATOM 778 N PRO A 55 -7.707 2.005 -16.867 1.00 0.00 N ATOM 779 CA PRO A 55 -9.108 2.298 -17.188 1.00 0.00 C ATOM 780 C PRO A 55 -10.001 1.069 -17.055 1.00 0.00 C ATOM 781 O PRO A 55 -10.058 0.231 -17.954 1.00 0.00 O ATOM 782 CB PRO A 55 -9.055 2.762 -18.647 1.00 0.00 C ATOM 783 CG PRO A 55 -7.659 3.240 -18.846 1.00 0.00 C ATOM 784 CD PRO A 55 -6.800 2.373 -17.970 1.00 0.00 C ATOM 0 HA PRO A 55 -9.533 3.037 -16.508 1.00 0.00 H new ATOM 0 HB2 PRO A 55 -9.295 1.947 -19.330 1.00 0.00 H new ATOM 0 HB3 PRO A 55 -9.776 3.558 -18.835 1.00 0.00 H new ATOM 0 HG2 PRO A 55 -7.362 3.155 -19.891 1.00 0.00 H new ATOM 0 HG3 PRO A 55 -7.563 4.290 -18.571 1.00 0.00 H new ATOM 0 HD2 PRO A 55 -6.438 1.494 -18.504 1.00 0.00 H new ATOM 0 HD3 PRO A 55 -5.923 2.910 -17.608 1.00 0.00 H new ATOM 792 N GLY A 56 -10.695 0.967 -15.926 1.00 0.00 N ATOM 793 CA GLY A 56 -11.574 -0.164 -15.697 1.00 0.00 C ATOM 794 C GLY A 56 -10.990 -1.165 -14.720 1.00 0.00 C ATOM 795 O GLY A 56 -11.265 -2.362 -14.807 1.00 0.00 O ATOM 0 H GLY A 56 -10.664 1.647 -15.166 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -12.530 0.195 -15.316 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -11.775 -0.662 -16.646 1.00 0.00 H new ATOM 799 N SER A 57 -10.182 -0.675 -13.786 1.00 0.00 N ATOM 800 CA SER A 57 -9.556 -1.534 -12.788 1.00 0.00 C ATOM 801 C SER A 57 -10.299 -1.453 -11.458 1.00 0.00 C ATOM 802 O SER A 57 -11.268 -0.707 -11.321 1.00 0.00 O ATOM 803 CB SER A 57 -8.091 -1.142 -12.591 1.00 0.00 C ATOM 804 OG SER A 57 -7.981 0.111 -11.937 1.00 0.00 O ATOM 0 H SER A 57 -9.945 0.313 -13.699 1.00 0.00 H new ATOM 0 HA SER A 57 -9.604 -2.561 -13.149 1.00 0.00 H new ATOM 0 HB2 SER A 57 -7.582 -1.907 -12.005 1.00 0.00 H new ATOM 0 HB3 SER A 57 -7.590 -1.096 -13.558 1.00 0.00 H new ATOM 0 HG SER A 57 -7.233 0.085 -11.304 1.00 0.00 H new ATOM 810 N GLU A 58 -9.838 -2.227 -10.480 1.00 0.00 N ATOM 811 CA GLU A 58 -10.459 -2.244 -9.161 1.00 0.00 C ATOM 812 C GLU A 58 -10.177 -0.945 -8.412 1.00 0.00 C ATOM 813 O GLU A 58 -10.996 -0.486 -7.615 1.00 0.00 O ATOM 814 CB GLU A 58 -9.949 -3.438 -8.350 1.00 0.00 C ATOM 815 CG GLU A 58 -10.929 -4.599 -8.297 1.00 0.00 C ATOM 816 CD GLU A 58 -11.918 -4.475 -7.154 1.00 0.00 C ATOM 817 OE1 GLU A 58 -12.290 -3.333 -6.814 1.00 0.00 O ATOM 818 OE2 GLU A 58 -12.319 -5.520 -6.601 1.00 0.00 O ATOM 0 H GLU A 58 -9.037 -2.850 -10.577 1.00 0.00 H new ATOM 0 HA GLU A 58 -11.537 -2.339 -9.293 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -9.010 -3.785 -8.781 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -9.731 -3.110 -7.334 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -11.474 -4.653 -9.240 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -10.376 -5.532 -8.194 1.00 0.00 H new ATOM 825 N ALA A 59 -9.014 -0.357 -8.672 1.00 0.00 N ATOM 826 CA ALA A 59 -8.625 0.889 -8.024 1.00 0.00 C ATOM 827 C ALA A 59 -9.371 2.077 -8.621 1.00 0.00 C ATOM 828 O ALA A 59 -9.830 2.962 -7.900 1.00 0.00 O ATOM 829 CB ALA A 59 -7.122 1.095 -8.138 1.00 0.00 C ATOM 0 H ALA A 59 -8.324 -0.724 -9.328 1.00 0.00 H new ATOM 0 HA ALA A 59 -8.893 0.820 -6.970 1.00 0.00 H new ATOM 0 HB1 ALA A 59 -6.845 2.029 -7.650 1.00 0.00 H new ATOM 0 HB2 ALA A 59 -6.604 0.266 -7.656 1.00 0.00 H new ATOM 0 HB3 ALA A 59 -6.839 1.137 -9.190 1.00 0.00 H new ATOM 835 N GLU A 60 -9.490 2.089 -9.945 1.00 0.00 N ATOM 836 CA GLU A 60 -10.181 3.168 -10.641 1.00 0.00 C ATOM 837 C GLU A 60 -11.671 3.161 -10.310 1.00 0.00 C ATOM 838 O GLU A 60 -12.298 4.216 -10.208 1.00 0.00 O ATOM 839 CB GLU A 60 -9.982 3.039 -12.152 1.00 0.00 C ATOM 840 CG GLU A 60 -10.162 4.348 -12.903 1.00 0.00 C ATOM 841 CD GLU A 60 -11.611 4.790 -12.966 1.00 0.00 C ATOM 842 OE1 GLU A 60 -12.389 4.167 -13.718 1.00 0.00 O ATOM 843 OE2 GLU A 60 -11.966 5.759 -12.263 1.00 0.00 O ATOM 0 H GLU A 60 -9.117 1.363 -10.557 1.00 0.00 H new ATOM 0 HA GLU A 60 -9.756 4.114 -10.306 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -8.982 2.653 -12.347 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -10.688 2.306 -12.542 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -9.570 5.125 -12.419 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -9.775 4.237 -13.916 1.00 0.00 H new ATOM 850 N GLY A 61 -12.230 1.967 -10.143 1.00 0.00 N ATOM 851 CA GLY A 61 -13.639 1.847 -9.824 1.00 0.00 C ATOM 852 C GLY A 61 -13.963 2.339 -8.428 1.00 0.00 C ATOM 853 O GLY A 61 -15.063 2.830 -8.174 1.00 0.00 O ATOM 0 H GLY A 61 -11.732 1.081 -10.223 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -14.222 2.414 -10.550 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -13.942 0.804 -9.917 1.00 0.00 H new ATOM 857 N SER A 62 -13.001 2.209 -7.520 1.00 0.00 N ATOM 858 CA SER A 62 -13.188 2.645 -6.141 1.00 0.00 C ATOM 859 C SER A 62 -13.302 4.163 -6.062 1.00 0.00 C ATOM 860 O SER A 62 -14.296 4.696 -5.566 1.00 0.00 O ATOM 861 CB SER A 62 -12.025 2.164 -5.271 1.00 0.00 C ATOM 862 OG SER A 62 -12.229 2.508 -3.911 1.00 0.00 O ATOM 0 H SER A 62 -12.085 1.805 -7.714 1.00 0.00 H new ATOM 0 HA SER A 62 -14.116 2.209 -5.770 1.00 0.00 H new ATOM 0 HB2 SER A 62 -11.920 1.083 -5.364 1.00 0.00 H new ATOM 0 HB3 SER A 62 -11.094 2.607 -5.626 1.00 0.00 H new ATOM 0 HG SER A 62 -12.253 1.693 -3.367 1.00 0.00 H new ATOM 868 N GLY A 63 -12.279 4.856 -6.552 1.00 0.00 N ATOM 869 CA GLY A 63 -12.285 6.306 -6.526 1.00 0.00 C ATOM 870 C GLY A 63 -10.896 6.889 -6.346 1.00 0.00 C ATOM 871 O GLY A 63 -10.684 7.756 -5.498 1.00 0.00 O ATOM 0 H GLY A 63 -11.446 4.438 -6.967 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -12.716 6.681 -7.454 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -12.928 6.649 -5.715 1.00 0.00 H new ATOM 875 N LEU A 64 -9.949 6.411 -7.146 1.00 0.00 N ATOM 876 CA LEU A 64 -8.574 6.890 -7.073 1.00 0.00 C ATOM 877 C LEU A 64 -8.255 7.814 -8.244 1.00 0.00 C ATOM 878 O LEU A 64 -9.038 7.929 -9.187 1.00 0.00 O ATOM 879 CB LEU A 64 -7.601 5.709 -7.060 1.00 0.00 C ATOM 880 CG LEU A 64 -7.333 5.106 -5.680 1.00 0.00 C ATOM 881 CD1 LEU A 64 -6.915 3.650 -5.807 1.00 0.00 C ATOM 882 CD2 LEU A 64 -6.266 5.906 -4.948 1.00 0.00 C ATOM 0 H LEU A 64 -10.109 5.692 -7.852 1.00 0.00 H new ATOM 0 HA LEU A 64 -8.462 7.455 -6.148 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -7.993 4.928 -7.711 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -6.653 6.034 -7.488 1.00 0.00 H new ATOM 0 HG LEU A 64 -8.255 5.149 -5.100 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -6.728 3.237 -4.816 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -7.710 3.084 -6.292 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -6.006 3.583 -6.405 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -6.088 5.463 -3.968 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -5.342 5.893 -5.526 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -6.603 6.935 -4.825 1.00 0.00 H new ATOM 894 N LYS A 65 -7.100 8.468 -8.177 1.00 0.00 N ATOM 895 CA LYS A 65 -6.678 9.382 -9.233 1.00 0.00 C ATOM 896 C LYS A 65 -5.160 9.532 -9.245 1.00 0.00 C ATOM 897 O LYS A 65 -4.461 8.947 -8.419 1.00 0.00 O ATOM 898 CB LYS A 65 -7.335 10.750 -9.046 1.00 0.00 C ATOM 899 CG LYS A 65 -8.781 10.799 -9.514 1.00 0.00 C ATOM 900 CD LYS A 65 -9.750 10.752 -8.343 1.00 0.00 C ATOM 901 CE LYS A 65 -11.071 11.424 -8.682 1.00 0.00 C ATOM 902 NZ LYS A 65 -11.466 12.424 -7.652 1.00 0.00 N ATOM 0 H LYS A 65 -6.440 8.383 -7.404 1.00 0.00 H new ATOM 0 HA LYS A 65 -6.993 8.964 -10.189 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -7.294 11.023 -7.991 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -6.760 11.498 -9.592 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -8.947 11.710 -10.088 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -8.976 9.961 -10.183 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -9.931 9.715 -8.061 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -9.302 11.244 -7.479 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -10.990 11.915 -9.652 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -11.851 10.668 -8.771 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -12.372 12.859 -7.920 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -11.568 11.952 -6.731 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -10.735 13.160 -7.584 1.00 0.00 H new ATOM 916 N VAL A 66 -4.656 10.320 -10.190 1.00 0.00 N ATOM 917 CA VAL A 66 -3.222 10.548 -10.310 1.00 0.00 C ATOM 918 C VAL A 66 -2.760 11.654 -9.368 1.00 0.00 C ATOM 919 O VAL A 66 -3.479 12.626 -9.137 1.00 0.00 O ATOM 920 CB VAL A 66 -2.832 10.923 -11.753 1.00 0.00 C ATOM 921 CG1 VAL A 66 -3.012 9.732 -12.682 1.00 0.00 C ATOM 922 CG2 VAL A 66 -3.647 12.113 -12.234 1.00 0.00 C ATOM 0 H VAL A 66 -5.220 10.811 -10.883 1.00 0.00 H new ATOM 0 HA VAL A 66 -2.730 9.614 -10.039 1.00 0.00 H new ATOM 0 HB VAL A 66 -1.779 11.206 -11.764 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -2.732 10.016 -13.696 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -2.379 8.910 -12.347 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -4.055 9.415 -12.669 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -3.358 12.363 -13.255 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -4.707 11.862 -12.208 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -3.461 12.968 -11.584 1.00 0.00 H new ATOM 932 N GLY A 67 -1.556 11.498 -8.827 1.00 0.00 N ATOM 933 CA GLY A 67 -1.020 12.494 -7.915 1.00 0.00 C ATOM 934 C GLY A 67 -1.073 12.045 -6.467 1.00 0.00 C ATOM 935 O GLY A 67 -0.312 12.535 -5.632 1.00 0.00 O ATOM 0 H GLY A 67 -0.943 10.702 -9.003 1.00 0.00 H new ATOM 0 HA2 GLY A 67 0.013 12.712 -8.187 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -1.581 13.422 -8.025 1.00 0.00 H new ATOM 939 N ASP A 68 -1.972 11.112 -6.168 1.00 0.00 N ATOM 940 CA ASP A 68 -2.120 10.600 -4.810 1.00 0.00 C ATOM 941 C ASP A 68 -0.806 10.016 -4.300 1.00 0.00 C ATOM 942 O ASP A 68 0.054 9.619 -5.086 1.00 0.00 O ATOM 943 CB ASP A 68 -3.218 9.536 -4.762 1.00 0.00 C ATOM 944 CG ASP A 68 -4.588 10.132 -4.502 1.00 0.00 C ATOM 945 OD1 ASP A 68 -5.117 10.815 -5.404 1.00 0.00 O ATOM 946 OD2 ASP A 68 -5.131 9.917 -3.399 1.00 0.00 O ATOM 0 H ASP A 68 -2.609 10.695 -6.847 1.00 0.00 H new ATOM 0 HA ASP A 68 -2.400 11.432 -4.164 1.00 0.00 H new ATOM 0 HB2 ASP A 68 -3.235 8.992 -5.706 1.00 0.00 H new ATOM 0 HB3 ASP A 68 -2.985 8.812 -3.981 1.00 0.00 H new ATOM 951 N GLN A 69 -0.658 9.967 -2.980 1.00 0.00 N ATOM 952 CA GLN A 69 0.551 9.432 -2.364 1.00 0.00 C ATOM 953 C GLN A 69 0.220 8.270 -1.434 1.00 0.00 C ATOM 954 O GLN A 69 -0.471 8.444 -0.431 1.00 0.00 O ATOM 955 CB GLN A 69 1.280 10.531 -1.589 1.00 0.00 C ATOM 956 CG GLN A 69 2.719 10.181 -1.246 1.00 0.00 C ATOM 957 CD GLN A 69 2.820 9.162 -0.128 1.00 0.00 C ATOM 958 OE1 GLN A 69 1.988 9.133 0.779 1.00 0.00 O ATOM 959 NE2 GLN A 69 3.843 8.317 -0.188 1.00 0.00 N ATOM 0 H GLN A 69 -1.361 10.292 -2.316 1.00 0.00 H new ATOM 0 HA GLN A 69 1.201 9.063 -3.157 1.00 0.00 H new ATOM 0 HB2 GLN A 69 1.268 11.448 -2.178 1.00 0.00 H new ATOM 0 HB3 GLN A 69 0.735 10.737 -0.668 1.00 0.00 H new ATOM 0 HG2 GLN A 69 3.216 9.791 -2.134 1.00 0.00 H new ATOM 0 HG3 GLN A 69 3.250 11.087 -0.956 1.00 0.00 H new ATOM 0 HE21 GLN A 69 4.509 8.377 -0.958 1.00 0.00 H new ATOM 0 HE22 GLN A 69 3.962 7.608 0.536 1.00 0.00 H new ATOM 968 N ILE A 70 0.719 7.085 -1.771 1.00 0.00 N ATOM 969 CA ILE A 70 0.476 5.896 -0.965 1.00 0.00 C ATOM 970 C ILE A 70 1.286 5.934 0.327 1.00 0.00 C ATOM 971 O ILE A 70 2.515 6.008 0.300 1.00 0.00 O ATOM 972 CB ILE A 70 0.825 4.610 -1.739 1.00 0.00 C ATOM 973 CG1 ILE A 70 0.152 4.616 -3.113 1.00 0.00 C ATOM 974 CG2 ILE A 70 0.404 3.382 -0.944 1.00 0.00 C ATOM 975 CD1 ILE A 70 0.697 3.568 -4.059 1.00 0.00 C ATOM 0 H ILE A 70 1.294 6.924 -2.598 1.00 0.00 H new ATOM 0 HA ILE A 70 -0.587 5.888 -0.725 1.00 0.00 H new ATOM 0 HB ILE A 70 1.905 4.574 -1.884 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -0.919 4.456 -2.985 1.00 0.00 H new ATOM 0 HG13 ILE A 70 0.275 5.600 -3.564 1.00 0.00 H new ATOM 0 HG21 ILE A 70 0.657 2.482 -1.504 1.00 0.00 H new ATOM 0 HG22 ILE A 70 0.925 3.372 0.014 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -0.672 3.411 -0.772 1.00 0.00 H new ATOM 0 HD11 ILE A 70 0.173 3.631 -5.013 1.00 0.00 H new ATOM 0 HD12 ILE A 70 1.762 3.739 -4.218 1.00 0.00 H new ATOM 0 HD13 ILE A 70 0.549 2.577 -3.629 1.00 0.00 H new ATOM 987 N LEU A 71 0.589 5.884 1.458 1.00 0.00 N ATOM 988 CA LEU A 71 1.243 5.914 2.761 1.00 0.00 C ATOM 989 C LEU A 71 1.585 4.504 3.232 1.00 0.00 C ATOM 990 O LEU A 71 2.756 4.149 3.362 1.00 0.00 O ATOM 991 CB LEU A 71 0.346 6.604 3.791 1.00 0.00 C ATOM 992 CG LEU A 71 0.149 8.105 3.574 1.00 0.00 C ATOM 993 CD1 LEU A 71 -1.031 8.610 4.391 1.00 0.00 C ATOM 994 CD2 LEU A 71 1.415 8.866 3.935 1.00 0.00 C ATOM 0 H LEU A 71 -0.428 5.823 1.498 1.00 0.00 H new ATOM 0 HA LEU A 71 2.170 6.479 2.660 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -0.630 6.120 3.783 1.00 0.00 H new ATOM 0 HB3 LEU A 71 0.771 6.448 4.783 1.00 0.00 H new ATOM 0 HG LEU A 71 -0.065 8.277 2.519 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -1.157 9.680 4.225 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -1.936 8.086 4.085 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -0.846 8.426 5.449 1.00 0.00 H new ATOM 0 HD21 LEU A 71 1.257 9.932 3.774 1.00 0.00 H new ATOM 0 HD22 LEU A 71 1.660 8.689 4.982 1.00 0.00 H new ATOM 0 HD23 LEU A 71 2.237 8.523 3.307 1.00 0.00 H new ATOM 1006 N GLU A 72 0.554 3.703 3.483 1.00 0.00 N ATOM 1007 CA GLU A 72 0.747 2.332 3.939 1.00 0.00 C ATOM 1008 C GLU A 72 -0.256 1.392 3.276 1.00 0.00 C ATOM 1009 O GLU A 72 -1.341 1.810 2.874 1.00 0.00 O ATOM 1010 CB GLU A 72 0.609 2.252 5.460 1.00 0.00 C ATOM 1011 CG GLU A 72 -0.761 2.670 5.970 1.00 0.00 C ATOM 1012 CD GLU A 72 -0.743 4.027 6.644 1.00 0.00 C ATOM 1013 OE1 GLU A 72 0.032 4.901 6.200 1.00 0.00 O ATOM 1014 OE2 GLU A 72 -1.504 4.217 7.617 1.00 0.00 O ATOM 0 H GLU A 72 -0.422 3.980 3.378 1.00 0.00 H new ATOM 0 HA GLU A 72 1.753 2.021 3.656 1.00 0.00 H new ATOM 0 HB2 GLU A 72 0.811 1.230 5.781 1.00 0.00 H new ATOM 0 HB3 GLU A 72 1.367 2.886 5.919 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -1.464 2.692 5.137 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -1.125 1.923 6.675 1.00 0.00 H new ATOM 1021 N VAL A 73 0.116 0.120 3.166 1.00 0.00 N ATOM 1022 CA VAL A 73 -0.751 -0.878 2.552 1.00 0.00 C ATOM 1023 C VAL A 73 -0.788 -2.157 3.383 1.00 0.00 C ATOM 1024 O VAL A 73 0.251 -2.739 3.693 1.00 0.00 O ATOM 1025 CB VAL A 73 -0.287 -1.222 1.124 1.00 0.00 C ATOM 1026 CG1 VAL A 73 -1.308 -2.110 0.430 1.00 0.00 C ATOM 1027 CG2 VAL A 73 -0.041 0.047 0.324 1.00 0.00 C ATOM 0 H VAL A 73 1.011 -0.243 3.494 1.00 0.00 H new ATOM 0 HA VAL A 73 -1.751 -0.446 2.507 1.00 0.00 H new ATOM 0 HB VAL A 73 0.652 -1.771 1.188 1.00 0.00 H new ATOM 0 HG11 VAL A 73 -0.963 -2.342 -0.577 1.00 0.00 H new ATOM 0 HG12 VAL A 73 -1.429 -3.035 0.994 1.00 0.00 H new ATOM 0 HG13 VAL A 73 -2.265 -1.590 0.375 1.00 0.00 H new ATOM 0 HG21 VAL A 73 0.286 -0.215 -0.682 1.00 0.00 H new ATOM 0 HG22 VAL A 73 -0.963 0.625 0.267 1.00 0.00 H new ATOM 0 HG23 VAL A 73 0.731 0.642 0.813 1.00 0.00 H new ATOM 1037 N ASN A 74 -1.993 -2.586 3.742 1.00 0.00 N ATOM 1038 CA ASN A 74 -2.167 -3.796 4.539 1.00 0.00 C ATOM 1039 C ASN A 74 -1.468 -3.663 5.888 1.00 0.00 C ATOM 1040 O ASN A 74 -1.000 -4.650 6.457 1.00 0.00 O ATOM 1041 CB ASN A 74 -1.623 -5.011 3.784 1.00 0.00 C ATOM 1042 CG ASN A 74 -2.706 -5.747 3.020 1.00 0.00 C ATOM 1043 OD1 ASN A 74 -3.576 -6.385 3.613 1.00 0.00 O ATOM 1044 ND2 ASN A 74 -2.656 -5.664 1.696 1.00 0.00 N ATOM 0 H ASN A 74 -2.863 -2.115 3.494 1.00 0.00 H new ATOM 0 HA ASN A 74 -3.233 -3.936 4.716 1.00 0.00 H new ATOM 0 HB2 ASN A 74 -0.848 -4.687 3.089 1.00 0.00 H new ATOM 0 HB3 ASN A 74 -1.152 -5.694 4.491 1.00 0.00 H new ATOM 0 HD21 ASN A 74 -3.357 -6.140 1.128 1.00 0.00 H new ATOM 0 HD22 ASN A 74 -1.917 -5.124 1.246 1.00 0.00 H new ATOM 1051 N GLY A 75 -1.398 -2.436 6.394 1.00 0.00 N ATOM 1052 CA GLY A 75 -0.753 -2.197 7.672 1.00 0.00 C ATOM 1053 C GLY A 75 0.758 -2.176 7.563 1.00 0.00 C ATOM 1054 O GLY A 75 1.461 -2.495 8.521 1.00 0.00 O ATOM 0 H GLY A 75 -1.776 -1.603 5.942 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -1.098 -1.246 8.078 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -1.053 -2.972 8.377 1.00 0.00 H new ATOM 1058 N ARG A 76 1.260 -1.799 6.392 1.00 0.00 N ATOM 1059 CA ARG A 76 2.698 -1.737 6.158 1.00 0.00 C ATOM 1060 C ARG A 76 3.117 -0.338 5.718 1.00 0.00 C ATOM 1061 O ARG A 76 2.543 0.229 4.790 1.00 0.00 O ATOM 1062 CB ARG A 76 3.108 -2.763 5.100 1.00 0.00 C ATOM 1063 CG ARG A 76 4.610 -2.983 5.017 1.00 0.00 C ATOM 1064 CD ARG A 76 5.005 -4.349 5.557 1.00 0.00 C ATOM 1065 NE ARG A 76 6.456 -4.522 5.600 1.00 0.00 N ATOM 1066 CZ ARG A 76 7.214 -4.689 4.520 1.00 0.00 C ATOM 1067 NH1 ARG A 76 6.666 -4.706 3.311 1.00 0.00 N ATOM 1068 NH2 ARG A 76 8.526 -4.840 4.647 1.00 0.00 N ATOM 0 H ARG A 76 0.691 -1.531 5.589 1.00 0.00 H new ATOM 0 HA ARG A 76 3.205 -1.970 7.095 1.00 0.00 H new ATOM 0 HB2 ARG A 76 2.621 -3.713 5.319 1.00 0.00 H new ATOM 0 HB3 ARG A 76 2.743 -2.435 4.127 1.00 0.00 H new ATOM 0 HG2 ARG A 76 4.935 -2.893 3.981 1.00 0.00 H new ATOM 0 HG3 ARG A 76 5.124 -2.205 5.581 1.00 0.00 H new ATOM 0 HD2 ARG A 76 4.595 -4.475 6.559 1.00 0.00 H new ATOM 0 HD3 ARG A 76 4.565 -5.127 4.932 1.00 0.00 H new ATOM 0 HE ARG A 76 6.914 -4.514 6.511 1.00 0.00 H new ATOM 0 HH11 ARG A 76 5.658 -4.591 3.206 1.00 0.00 H new ATOM 0 HH12 ARG A 76 7.253 -4.834 2.487 1.00 0.00 H new ATOM 0 HH21 ARG A 76 8.953 -4.828 5.573 1.00 0.00 H new ATOM 0 HH22 ARG A 76 9.107 -4.968 3.819 1.00 0.00 H new ATOM 1082 N SER A 77 4.123 0.211 6.391 1.00 0.00 N ATOM 1083 CA SER A 77 4.620 1.544 6.070 1.00 0.00 C ATOM 1084 C SER A 77 5.294 1.558 4.702 1.00 0.00 C ATOM 1085 O SER A 77 6.369 0.986 4.522 1.00 0.00 O ATOM 1086 CB SER A 77 5.604 2.016 7.141 1.00 0.00 C ATOM 1087 OG SER A 77 5.003 2.011 8.424 1.00 0.00 O ATOM 0 H SER A 77 4.610 -0.246 7.162 1.00 0.00 H new ATOM 0 HA SER A 77 3.769 2.225 6.043 1.00 0.00 H new ATOM 0 HB2 SER A 77 6.481 1.368 7.144 1.00 0.00 H new ATOM 0 HB3 SER A 77 5.951 3.021 6.903 1.00 0.00 H new ATOM 0 HG SER A 77 5.653 2.315 9.091 1.00 0.00 H new ATOM 1093 N PHE A 78 4.656 2.216 3.740 1.00 0.00 N ATOM 1094 CA PHE A 78 5.194 2.306 2.388 1.00 0.00 C ATOM 1095 C PHE A 78 5.979 3.601 2.201 1.00 0.00 C ATOM 1096 O PHE A 78 5.570 4.487 1.450 1.00 0.00 O ATOM 1097 CB PHE A 78 4.061 2.225 1.361 1.00 0.00 C ATOM 1098 CG PHE A 78 3.857 0.846 0.801 1.00 0.00 C ATOM 1099 CD1 PHE A 78 3.375 -0.177 1.603 1.00 0.00 C ATOM 1100 CD2 PHE A 78 4.147 0.572 -0.526 1.00 0.00 C ATOM 1101 CE1 PHE A 78 3.186 -1.446 1.091 1.00 0.00 C ATOM 1102 CE2 PHE A 78 3.960 -0.695 -1.044 1.00 0.00 C ATOM 1103 CZ PHE A 78 3.479 -1.706 -0.234 1.00 0.00 C ATOM 0 H PHE A 78 3.765 2.695 3.872 1.00 0.00 H new ATOM 0 HA PHE A 78 5.873 1.467 2.235 1.00 0.00 H new ATOM 0 HB2 PHE A 78 3.134 2.560 1.827 1.00 0.00 H new ATOM 0 HB3 PHE A 78 4.273 2.913 0.543 1.00 0.00 H new ATOM 0 HD1 PHE A 78 3.145 0.020 2.640 1.00 0.00 H new ATOM 0 HD2 PHE A 78 4.524 1.358 -1.163 1.00 0.00 H new ATOM 0 HE1 PHE A 78 2.809 -2.234 1.726 1.00 0.00 H new ATOM 0 HE2 PHE A 78 4.189 -0.895 -2.080 1.00 0.00 H new ATOM 0 HZ PHE A 78 3.332 -2.698 -0.636 1.00 0.00 H new ATOM 1113 N LEU A 79 7.111 3.704 2.890 1.00 0.00 N ATOM 1114 CA LEU A 79 7.956 4.890 2.801 1.00 0.00 C ATOM 1115 C LEU A 79 9.350 4.529 2.300 1.00 0.00 C ATOM 1116 O LEU A 79 9.926 5.236 1.472 1.00 0.00 O ATOM 1117 CB LEU A 79 8.053 5.575 4.166 1.00 0.00 C ATOM 1118 CG LEU A 79 6.720 6.042 4.753 1.00 0.00 C ATOM 1119 CD1 LEU A 79 6.736 5.930 6.269 1.00 0.00 C ATOM 1120 CD2 LEU A 79 6.421 7.471 4.325 1.00 0.00 C ATOM 0 H LEU A 79 7.465 2.981 3.516 1.00 0.00 H new ATOM 0 HA LEU A 79 7.501 5.578 2.088 1.00 0.00 H new ATOM 0 HB2 LEU A 79 8.520 4.885 4.869 1.00 0.00 H new ATOM 0 HB3 LEU A 79 8.715 6.436 4.077 1.00 0.00 H new ATOM 0 HG LEU A 79 5.930 5.396 4.370 1.00 0.00 H new ATOM 0 HD11 LEU A 79 5.779 6.267 6.669 1.00 0.00 H new ATOM 0 HD12 LEU A 79 6.904 4.892 6.555 1.00 0.00 H new ATOM 0 HD13 LEU A 79 7.536 6.551 6.671 1.00 0.00 H new ATOM 0 HD21 LEU A 79 5.469 7.787 4.752 1.00 0.00 H new ATOM 0 HD22 LEU A 79 7.214 8.130 4.679 1.00 0.00 H new ATOM 0 HD23 LEU A 79 6.366 7.521 3.238 1.00 0.00 H new ATOM 1132 N ASN A 80 9.888 3.424 2.806 1.00 0.00 N ATOM 1133 CA ASN A 80 11.215 2.969 2.410 1.00 0.00 C ATOM 1134 C ASN A 80 11.138 1.623 1.696 1.00 0.00 C ATOM 1135 O ASN A 80 12.001 0.763 1.875 1.00 0.00 O ATOM 1136 CB ASN A 80 12.127 2.859 3.634 1.00 0.00 C ATOM 1137 CG ASN A 80 13.583 2.677 3.256 1.00 0.00 C ATOM 1138 OD1 ASN A 80 14.130 3.439 2.458 1.00 0.00 O ATOM 1139 ND2 ASN A 80 14.221 1.662 3.828 1.00 0.00 N ATOM 0 H ASN A 80 9.425 2.827 3.491 1.00 0.00 H new ATOM 0 HA ASN A 80 11.632 3.703 1.720 1.00 0.00 H new ATOM 0 HB2 ASN A 80 12.022 3.757 4.243 1.00 0.00 H new ATOM 0 HB3 ASN A 80 11.806 2.018 4.248 1.00 0.00 H new ATOM 0 HD21 ASN A 80 15.203 1.490 3.611 1.00 0.00 H new ATOM 0 HD22 ASN A 80 13.729 1.055 4.484 1.00 0.00 H new ATOM 1146 N ILE A 81 10.099 1.447 0.886 1.00 0.00 N ATOM 1147 CA ILE A 81 9.908 0.206 0.146 1.00 0.00 C ATOM 1148 C ILE A 81 10.451 0.326 -1.275 1.00 0.00 C ATOM 1149 O ILE A 81 10.345 1.379 -1.904 1.00 0.00 O ATOM 1150 CB ILE A 81 8.419 -0.192 0.089 1.00 0.00 C ATOM 1151 CG1 ILE A 81 8.253 -1.547 -0.599 1.00 0.00 C ATOM 1152 CG2 ILE A 81 7.609 0.878 -0.630 1.00 0.00 C ATOM 1153 CD1 ILE A 81 7.210 -2.432 0.050 1.00 0.00 C ATOM 0 H ILE A 81 9.376 2.149 0.726 1.00 0.00 H new ATOM 0 HA ILE A 81 10.460 -0.569 0.677 1.00 0.00 H new ATOM 0 HB ILE A 81 8.045 -0.278 1.109 1.00 0.00 H new ATOM 0 HG12 ILE A 81 7.982 -1.385 -1.642 1.00 0.00 H new ATOM 0 HG13 ILE A 81 9.211 -2.067 -0.596 1.00 0.00 H new ATOM 0 HG21 ILE A 81 6.561 0.581 -0.661 1.00 0.00 H new ATOM 0 HG22 ILE A 81 7.702 1.824 -0.097 1.00 0.00 H new ATOM 0 HG23 ILE A 81 7.983 0.996 -1.647 1.00 0.00 H new ATOM 0 HD11 ILE A 81 7.147 -3.376 -0.491 1.00 0.00 H new ATOM 0 HD12 ILE A 81 7.490 -2.625 1.086 1.00 0.00 H new ATOM 0 HD13 ILE A 81 6.241 -1.933 0.023 1.00 0.00 H new ATOM 1165 N LEU A 82 11.033 -0.760 -1.774 1.00 0.00 N ATOM 1166 CA LEU A 82 11.593 -0.776 -3.120 1.00 0.00 C ATOM 1167 C LEU A 82 10.503 -0.568 -4.166 1.00 0.00 C ATOM 1168 O LEU A 82 9.321 -0.786 -3.896 1.00 0.00 O ATOM 1169 CB LEU A 82 12.317 -2.100 -3.378 1.00 0.00 C ATOM 1170 CG LEU A 82 13.588 -2.314 -2.555 1.00 0.00 C ATOM 1171 CD1 LEU A 82 13.826 -3.798 -2.319 1.00 0.00 C ATOM 1172 CD2 LEU A 82 14.785 -1.684 -3.250 1.00 0.00 C ATOM 0 H LEU A 82 11.129 -1.640 -1.267 1.00 0.00 H new ATOM 0 HA LEU A 82 12.308 0.043 -3.199 1.00 0.00 H new ATOM 0 HB2 LEU A 82 11.628 -2.919 -3.173 1.00 0.00 H new ATOM 0 HB3 LEU A 82 12.574 -2.156 -4.436 1.00 0.00 H new ATOM 0 HG LEU A 82 13.459 -1.829 -1.588 1.00 0.00 H new ATOM 0 HD11 LEU A 82 14.735 -3.932 -1.732 1.00 0.00 H new ATOM 0 HD12 LEU A 82 12.979 -4.221 -1.779 1.00 0.00 H new ATOM 0 HD13 LEU A 82 13.935 -4.306 -3.277 1.00 0.00 H new ATOM 0 HD21 LEU A 82 15.681 -1.846 -2.650 1.00 0.00 H new ATOM 0 HD22 LEU A 82 14.918 -2.140 -4.231 1.00 0.00 H new ATOM 0 HD23 LEU A 82 14.616 -0.614 -3.368 1.00 0.00 H new ATOM 1184 N HIS A 83 10.906 -0.144 -5.359 1.00 0.00 N ATOM 1185 CA HIS A 83 9.963 0.094 -6.445 1.00 0.00 C ATOM 1186 C HIS A 83 9.305 -1.209 -6.889 1.00 0.00 C ATOM 1187 O HIS A 83 8.089 -1.269 -7.075 1.00 0.00 O ATOM 1188 CB HIS A 83 10.674 0.749 -7.631 1.00 0.00 C ATOM 1189 CG HIS A 83 9.751 1.114 -8.753 1.00 0.00 C ATOM 1190 ND1 HIS A 83 8.380 1.169 -8.612 1.00 0.00 N ATOM 1191 CD2 HIS A 83 10.009 1.446 -10.040 1.00 0.00 C ATOM 1192 CE1 HIS A 83 7.835 1.517 -9.765 1.00 0.00 C ATOM 1193 NE2 HIS A 83 8.801 1.692 -10.646 1.00 0.00 N ATOM 0 H HIS A 83 11.880 0.042 -5.598 1.00 0.00 H new ATOM 0 HA HIS A 83 9.187 0.766 -6.079 1.00 0.00 H new ATOM 0 HB2 HIS A 83 11.187 1.647 -7.286 1.00 0.00 H new ATOM 0 HB3 HIS A 83 11.439 0.069 -8.007 1.00 0.00 H new ATOM 0 HD2 HIS A 83 10.983 1.506 -10.504 1.00 0.00 H new ATOM 0 HE1 HIS A 83 6.778 1.638 -9.954 1.00 0.00 H new ATOM 0 HE2 HIS A 83 8.672 1.966 -11.620 1.00 0.00 H new ATOM 1202 N ASP A 84 10.114 -2.249 -7.055 1.00 0.00 N ATOM 1203 CA ASP A 84 9.610 -3.551 -7.475 1.00 0.00 C ATOM 1204 C ASP A 84 8.774 -4.193 -6.372 1.00 0.00 C ATOM 1205 O ASP A 84 7.752 -4.825 -6.642 1.00 0.00 O ATOM 1206 CB ASP A 84 10.770 -4.473 -7.854 1.00 0.00 C ATOM 1207 CG ASP A 84 11.116 -4.390 -9.328 1.00 0.00 C ATOM 1208 OD1 ASP A 84 10.184 -4.268 -10.151 1.00 0.00 O ATOM 1209 OD2 ASP A 84 12.319 -4.447 -9.660 1.00 0.00 O ATOM 0 H ASP A 84 11.122 -2.216 -6.905 1.00 0.00 H new ATOM 0 HA ASP A 84 8.974 -3.402 -8.348 1.00 0.00 H new ATOM 0 HB2 ASP A 84 11.647 -4.211 -7.262 1.00 0.00 H new ATOM 0 HB3 ASP A 84 10.511 -5.501 -7.602 1.00 0.00 H new ATOM 1214 N GLU A 85 9.217 -4.028 -5.130 1.00 0.00 N ATOM 1215 CA GLU A 85 8.509 -4.591 -3.985 1.00 0.00 C ATOM 1216 C GLU A 85 7.092 -4.034 -3.894 1.00 0.00 C ATOM 1217 O GLU A 85 6.153 -4.752 -3.553 1.00 0.00 O ATOM 1218 CB GLU A 85 9.271 -4.295 -2.693 1.00 0.00 C ATOM 1219 CG GLU A 85 8.892 -5.211 -1.540 1.00 0.00 C ATOM 1220 CD GLU A 85 9.977 -5.299 -0.485 1.00 0.00 C ATOM 1221 OE1 GLU A 85 11.073 -5.809 -0.801 1.00 0.00 O ATOM 1222 OE2 GLU A 85 9.732 -4.858 0.658 1.00 0.00 O ATOM 0 H GLU A 85 10.062 -3.510 -4.890 1.00 0.00 H new ATOM 0 HA GLU A 85 8.447 -5.671 -4.122 1.00 0.00 H new ATOM 0 HB2 GLU A 85 10.340 -4.387 -2.883 1.00 0.00 H new ATOM 0 HB3 GLU A 85 9.086 -3.261 -2.401 1.00 0.00 H new ATOM 0 HG2 GLU A 85 7.972 -4.849 -1.081 1.00 0.00 H new ATOM 0 HG3 GLU A 85 8.684 -6.209 -1.927 1.00 0.00 H new ATOM 1229 N ALA A 86 6.947 -2.749 -4.201 1.00 0.00 N ATOM 1230 CA ALA A 86 5.644 -2.095 -4.153 1.00 0.00 C ATOM 1231 C ALA A 86 4.695 -2.687 -5.190 1.00 0.00 C ATOM 1232 O ALA A 86 3.494 -2.805 -4.951 1.00 0.00 O ATOM 1233 CB ALA A 86 5.798 -0.598 -4.369 1.00 0.00 C ATOM 0 H ALA A 86 7.715 -2.140 -4.485 1.00 0.00 H new ATOM 0 HA ALA A 86 5.214 -2.266 -3.166 1.00 0.00 H new ATOM 0 HB1 ALA A 86 4.818 -0.122 -4.331 1.00 0.00 H new ATOM 0 HB2 ALA A 86 6.434 -0.181 -3.588 1.00 0.00 H new ATOM 0 HB3 ALA A 86 6.252 -0.416 -5.343 1.00 0.00 H new ATOM 1239 N VAL A 87 5.243 -3.057 -6.343 1.00 0.00 N ATOM 1240 CA VAL A 87 4.446 -3.637 -7.417 1.00 0.00 C ATOM 1241 C VAL A 87 4.130 -5.101 -7.137 1.00 0.00 C ATOM 1242 O VAL A 87 3.006 -5.557 -7.354 1.00 0.00 O ATOM 1243 CB VAL A 87 5.168 -3.531 -8.773 1.00 0.00 C ATOM 1244 CG1 VAL A 87 4.244 -3.954 -9.905 1.00 0.00 C ATOM 1245 CG2 VAL A 87 5.682 -2.116 -8.995 1.00 0.00 C ATOM 0 H VAL A 87 6.236 -2.965 -6.557 1.00 0.00 H new ATOM 0 HA VAL A 87 3.517 -3.069 -7.463 1.00 0.00 H new ATOM 0 HB VAL A 87 6.024 -4.206 -8.762 1.00 0.00 H new ATOM 0 HG11 VAL A 87 4.772 -3.872 -10.855 1.00 0.00 H new ATOM 0 HG12 VAL A 87 3.930 -4.986 -9.752 1.00 0.00 H new ATOM 0 HG13 VAL A 87 3.367 -3.307 -9.920 1.00 0.00 H new ATOM 0 HG21 VAL A 87 6.189 -2.060 -9.958 1.00 0.00 H new ATOM 0 HG22 VAL A 87 4.844 -1.419 -8.985 1.00 0.00 H new ATOM 0 HG23 VAL A 87 6.381 -1.854 -8.201 1.00 0.00 H new ATOM 1255 N ARG A 88 5.126 -5.835 -6.652 1.00 0.00 N ATOM 1256 CA ARG A 88 4.954 -7.249 -6.341 1.00 0.00 C ATOM 1257 C ARG A 88 4.035 -7.433 -5.138 1.00 0.00 C ATOM 1258 O ARG A 88 3.150 -8.289 -5.145 1.00 0.00 O ATOM 1259 CB ARG A 88 6.310 -7.902 -6.067 1.00 0.00 C ATOM 1260 CG ARG A 88 7.152 -8.105 -7.317 1.00 0.00 C ATOM 1261 CD ARG A 88 7.366 -9.581 -7.613 1.00 0.00 C ATOM 1262 NE ARG A 88 8.036 -9.790 -8.895 1.00 0.00 N ATOM 1263 CZ ARG A 88 7.418 -9.733 -10.073 1.00 0.00 C ATOM 1264 NH1 ARG A 88 6.119 -9.472 -10.136 1.00 0.00 N ATOM 1265 NH2 ARG A 88 8.104 -9.935 -11.190 1.00 0.00 N ATOM 0 H ARG A 88 6.061 -5.473 -6.466 1.00 0.00 H new ATOM 0 HA ARG A 88 4.495 -7.732 -7.204 1.00 0.00 H new ATOM 0 HB2 ARG A 88 6.865 -7.284 -5.361 1.00 0.00 H new ATOM 0 HB3 ARG A 88 6.149 -8.867 -5.587 1.00 0.00 H new ATOM 0 HG2 ARG A 88 6.663 -7.630 -8.167 1.00 0.00 H new ATOM 0 HG3 ARG A 88 8.117 -7.615 -7.190 1.00 0.00 H new ATOM 0 HD2 ARG A 88 7.960 -10.028 -6.816 1.00 0.00 H new ATOM 0 HD3 ARG A 88 6.404 -10.093 -7.619 1.00 0.00 H new ATOM 0 HE ARG A 88 9.036 -9.991 -8.887 1.00 0.00 H new ATOM 0 HH11 ARG A 88 5.588 -9.314 -9.279 1.00 0.00 H new ATOM 0 HH12 ARG A 88 5.651 -9.430 -11.041 1.00 0.00 H new ATOM 0 HH21 ARG A 88 9.103 -10.134 -11.146 1.00 0.00 H new ATOM 0 HH22 ARG A 88 7.632 -9.892 -12.093 1.00 0.00 H new ATOM 1279 N LEU A 89 4.251 -6.624 -4.105 1.00 0.00 N ATOM 1280 CA LEU A 89 3.443 -6.697 -2.894 1.00 0.00 C ATOM 1281 C LEU A 89 1.995 -6.315 -3.184 1.00 0.00 C ATOM 1282 O LEU A 89 1.064 -6.900 -2.628 1.00 0.00 O ATOM 1283 CB LEU A 89 4.020 -5.779 -1.815 1.00 0.00 C ATOM 1284 CG LEU A 89 3.378 -5.922 -0.434 1.00 0.00 C ATOM 1285 CD1 LEU A 89 3.457 -7.364 0.045 1.00 0.00 C ATOM 1286 CD2 LEU A 89 4.050 -4.990 0.564 1.00 0.00 C ATOM 0 H LEU A 89 4.979 -5.910 -4.083 1.00 0.00 H new ATOM 0 HA LEU A 89 3.463 -7.726 -2.534 1.00 0.00 H new ATOM 0 HB2 LEU A 89 5.088 -5.976 -1.725 1.00 0.00 H new ATOM 0 HB3 LEU A 89 3.913 -4.745 -2.144 1.00 0.00 H new ATOM 0 HG LEU A 89 2.327 -5.644 -0.512 1.00 0.00 H new ATOM 0 HD11 LEU A 89 2.995 -7.446 1.029 1.00 0.00 H new ATOM 0 HD12 LEU A 89 2.931 -8.010 -0.658 1.00 0.00 H new ATOM 0 HD13 LEU A 89 4.501 -7.670 0.107 1.00 0.00 H new ATOM 0 HD21 LEU A 89 3.581 -5.104 1.541 1.00 0.00 H new ATOM 0 HD22 LEU A 89 5.109 -5.239 0.638 1.00 0.00 H new ATOM 0 HD23 LEU A 89 3.942 -3.959 0.228 1.00 0.00 H new ATOM 1298 N LEU A 90 1.811 -5.329 -4.056 1.00 0.00 N ATOM 1299 CA LEU A 90 0.476 -4.868 -4.419 1.00 0.00 C ATOM 1300 C LEU A 90 -0.216 -5.874 -5.332 1.00 0.00 C ATOM 1301 O LEU A 90 -1.434 -6.044 -5.276 1.00 0.00 O ATOM 1302 CB LEU A 90 0.554 -3.504 -5.108 1.00 0.00 C ATOM 1303 CG LEU A 90 0.812 -2.321 -4.175 1.00 0.00 C ATOM 1304 CD1 LEU A 90 1.164 -1.077 -4.975 1.00 0.00 C ATOM 1305 CD2 LEU A 90 -0.401 -2.065 -3.293 1.00 0.00 C ATOM 0 H LEU A 90 2.570 -4.834 -4.524 1.00 0.00 H new ATOM 0 HA LEU A 90 -0.110 -4.771 -3.505 1.00 0.00 H new ATOM 0 HB2 LEU A 90 1.346 -3.537 -5.856 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -0.381 -3.329 -5.641 1.00 0.00 H new ATOM 0 HG LEU A 90 1.658 -2.566 -3.533 1.00 0.00 H new ATOM 0 HD11 LEU A 90 1.344 -0.245 -4.294 1.00 0.00 H new ATOM 0 HD12 LEU A 90 2.062 -1.265 -5.564 1.00 0.00 H new ATOM 0 HD13 LEU A 90 0.339 -0.828 -5.642 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -0.200 -1.220 -2.635 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -1.265 -1.841 -3.919 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -0.608 -2.951 -2.693 1.00 0.00 H new ATOM 1317 N LYS A 91 0.568 -6.539 -6.174 1.00 0.00 N ATOM 1318 CA LYS A 91 0.031 -7.529 -7.100 1.00 0.00 C ATOM 1319 C LYS A 91 0.423 -8.941 -6.674 1.00 0.00 C ATOM 1320 O LYS A 91 1.198 -9.615 -7.355 1.00 0.00 O ATOM 1321 CB LYS A 91 0.529 -7.253 -8.520 1.00 0.00 C ATOM 1322 CG LYS A 91 -0.346 -6.280 -9.294 1.00 0.00 C ATOM 1323 CD LYS A 91 -0.310 -4.889 -8.681 1.00 0.00 C ATOM 1324 CE LYS A 91 -0.251 -3.810 -9.749 1.00 0.00 C ATOM 1325 NZ LYS A 91 1.145 -3.363 -10.011 1.00 0.00 N ATOM 0 H LYS A 91 1.578 -6.410 -6.234 1.00 0.00 H new ATOM 0 HA LYS A 91 -1.056 -7.454 -7.084 1.00 0.00 H new ATOM 0 HB2 LYS A 91 1.543 -6.856 -8.470 1.00 0.00 H new ATOM 0 HB3 LYS A 91 0.582 -8.194 -9.067 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -0.010 -6.231 -10.330 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -1.373 -6.645 -9.309 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -1.194 -4.741 -8.061 1.00 0.00 H new ATOM 0 HD3 LYS A 91 0.557 -4.801 -8.026 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -0.690 -4.189 -10.672 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -0.853 -2.957 -9.436 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 1.130 -2.437 -10.484 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 1.659 -3.284 -9.110 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 1.622 -4.056 -10.622 1.00 0.00 H new ATOM 1339 N SER A 92 -0.116 -9.383 -5.543 1.00 0.00 N ATOM 1340 CA SER A 92 0.178 -10.714 -5.025 1.00 0.00 C ATOM 1341 C SER A 92 -0.883 -11.154 -4.022 1.00 0.00 C ATOM 1342 O SER A 92 -1.383 -12.278 -4.084 1.00 0.00 O ATOM 1343 CB SER A 92 1.558 -10.736 -4.367 1.00 0.00 C ATOM 1344 OG SER A 92 1.896 -12.041 -3.930 1.00 0.00 O ATOM 0 H SER A 92 -0.759 -8.839 -4.967 1.00 0.00 H new ATOM 0 HA SER A 92 0.172 -11.411 -5.863 1.00 0.00 H new ATOM 0 HB2 SER A 92 2.307 -10.381 -5.075 1.00 0.00 H new ATOM 0 HB3 SER A 92 1.571 -10.051 -3.519 1.00 0.00 H new ATOM 0 HG SER A 92 2.783 -12.027 -3.515 1.00 0.00 H new ATOM 1350 N SER A 93 -1.223 -10.262 -3.098 1.00 0.00 N ATOM 1351 CA SER A 93 -2.225 -10.558 -2.081 1.00 0.00 C ATOM 1352 C SER A 93 -3.631 -10.286 -2.606 1.00 0.00 C ATOM 1353 O SER A 93 -3.812 -9.955 -3.778 1.00 0.00 O ATOM 1354 CB SER A 93 -1.968 -9.726 -0.823 1.00 0.00 C ATOM 1355 OG SER A 93 -2.458 -10.383 0.333 1.00 0.00 O ATOM 0 H SER A 93 -0.819 -9.328 -3.032 1.00 0.00 H new ATOM 0 HA SER A 93 -2.149 -11.616 -1.830 1.00 0.00 H new ATOM 0 HB2 SER A 93 -0.899 -9.544 -0.716 1.00 0.00 H new ATOM 0 HB3 SER A 93 -2.448 -8.753 -0.923 1.00 0.00 H new ATOM 0 HG SER A 93 -2.280 -9.831 1.123 1.00 0.00 H new ATOM 1361 N ARG A 94 -4.622 -10.427 -1.733 1.00 0.00 N ATOM 1362 CA ARG A 94 -6.011 -10.197 -2.109 1.00 0.00 C ATOM 1363 C ARG A 94 -6.514 -8.871 -1.545 1.00 0.00 C ATOM 1364 O ARG A 94 -6.661 -7.892 -2.276 1.00 0.00 O ATOM 1365 CB ARG A 94 -6.893 -11.343 -1.613 1.00 0.00 C ATOM 1366 CG ARG A 94 -6.783 -12.603 -2.457 1.00 0.00 C ATOM 1367 CD ARG A 94 -5.638 -13.487 -1.990 1.00 0.00 C ATOM 1368 NE ARG A 94 -6.008 -14.296 -0.831 1.00 0.00 N ATOM 1369 CZ ARG A 94 -5.346 -15.382 -0.442 1.00 0.00 C ATOM 1370 NH1 ARG A 94 -4.279 -15.795 -1.117 1.00 0.00 N ATOM 1371 NH2 ARG A 94 -5.750 -16.059 0.624 1.00 0.00 N ATOM 0 H ARG A 94 -4.489 -10.700 -0.759 1.00 0.00 H new ATOM 0 HA ARG A 94 -6.064 -10.153 -3.197 1.00 0.00 H new ATOM 0 HB2 ARG A 94 -6.622 -11.580 -0.584 1.00 0.00 H new ATOM 0 HB3 ARG A 94 -7.932 -11.013 -1.601 1.00 0.00 H new ATOM 0 HG2 ARG A 94 -7.719 -13.160 -2.405 1.00 0.00 H new ATOM 0 HG3 ARG A 94 -6.631 -12.331 -3.501 1.00 0.00 H new ATOM 0 HD2 ARG A 94 -5.330 -14.141 -2.805 1.00 0.00 H new ATOM 0 HD3 ARG A 94 -4.779 -12.865 -1.738 1.00 0.00 H new ATOM 0 HE ARG A 94 -6.823 -14.011 -0.288 1.00 0.00 H new ATOM 0 HH11 ARG A 94 -3.964 -15.279 -1.938 1.00 0.00 H new ATOM 0 HH12 ARG A 94 -3.775 -16.629 -0.814 1.00 0.00 H new ATOM 0 HH21 ARG A 94 -6.569 -15.747 1.146 1.00 0.00 H new ATOM 0 HH22 ARG A 94 -5.242 -16.892 0.922 1.00 0.00 H new ATOM 1385 N HIS A 95 -6.776 -8.849 -0.243 1.00 0.00 N ATOM 1386 CA HIS A 95 -7.262 -7.643 0.418 1.00 0.00 C ATOM 1387 C HIS A 95 -6.162 -6.591 0.507 1.00 0.00 C ATOM 1388 O HIS A 95 -5.208 -6.739 1.271 1.00 0.00 O ATOM 1389 CB HIS A 95 -7.780 -7.976 1.818 1.00 0.00 C ATOM 1390 CG HIS A 95 -8.983 -7.180 2.216 1.00 0.00 C ATOM 1391 ND1 HIS A 95 -9.952 -7.657 3.075 1.00 0.00 N ATOM 1392 CD2 HIS A 95 -9.374 -5.931 1.869 1.00 0.00 C ATOM 1393 CE1 HIS A 95 -10.885 -6.736 3.237 1.00 0.00 C ATOM 1394 NE2 HIS A 95 -10.558 -5.680 2.517 1.00 0.00 N ATOM 0 H HIS A 95 -6.660 -9.652 0.375 1.00 0.00 H new ATOM 0 HA HIS A 95 -8.080 -7.238 -0.177 1.00 0.00 H new ATOM 0 HB2 HIS A 95 -8.026 -9.037 1.863 1.00 0.00 H new ATOM 0 HB3 HIS A 95 -6.984 -7.802 2.542 1.00 0.00 H new ATOM 0 HD1 HIS A 95 -9.948 -8.577 3.516 1.00 0.00 H new ATOM 0 HD2 HIS A 95 -8.852 -5.257 1.206 1.00 0.00 H new ATOM 0 HE1 HIS A 95 -11.766 -6.831 3.854 1.00 0.00 H new ATOM 1403 N LEU A 96 -6.302 -5.529 -0.279 1.00 0.00 N ATOM 1404 CA LEU A 96 -5.319 -4.450 -0.290 1.00 0.00 C ATOM 1405 C LEU A 96 -5.931 -3.149 0.217 1.00 0.00 C ATOM 1406 O LEU A 96 -6.737 -2.522 -0.471 1.00 0.00 O ATOM 1407 CB LEU A 96 -4.766 -4.250 -1.703 1.00 0.00 C ATOM 1408 CG LEU A 96 -4.061 -5.470 -2.299 1.00 0.00 C ATOM 1409 CD1 LEU A 96 -3.610 -5.181 -3.723 1.00 0.00 C ATOM 1410 CD2 LEU A 96 -2.878 -5.876 -1.434 1.00 0.00 C ATOM 0 H LEU A 96 -7.086 -5.392 -0.917 1.00 0.00 H new ATOM 0 HA LEU A 96 -4.503 -4.730 0.377 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -5.587 -3.966 -2.361 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -4.065 -3.415 -1.688 1.00 0.00 H new ATOM 0 HG LEU A 96 -4.768 -6.300 -2.325 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -3.110 -6.059 -4.132 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -4.477 -4.938 -4.337 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -2.919 -4.338 -3.722 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -2.388 -6.745 -1.873 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -2.169 -5.050 -1.377 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -3.228 -6.124 -0.432 1.00 0.00 H new ATOM 1422 N ILE A 97 -5.543 -2.749 1.424 1.00 0.00 N ATOM 1423 CA ILE A 97 -6.053 -1.521 2.022 1.00 0.00 C ATOM 1424 C ILE A 97 -5.065 -0.375 1.847 1.00 0.00 C ATOM 1425 O ILE A 97 -4.278 -0.077 2.746 1.00 0.00 O ATOM 1426 CB ILE A 97 -6.346 -1.707 3.522 1.00 0.00 C ATOM 1427 CG1 ILE A 97 -7.167 -2.978 3.751 1.00 0.00 C ATOM 1428 CG2 ILE A 97 -7.076 -0.492 4.075 1.00 0.00 C ATOM 1429 CD1 ILE A 97 -6.325 -4.186 4.102 1.00 0.00 C ATOM 0 H ILE A 97 -4.878 -3.257 2.006 1.00 0.00 H new ATOM 0 HA ILE A 97 -6.982 -1.279 1.506 1.00 0.00 H new ATOM 0 HB ILE A 97 -5.398 -1.809 4.051 1.00 0.00 H new ATOM 0 HG12 ILE A 97 -7.883 -2.799 4.553 1.00 0.00 H new ATOM 0 HG13 ILE A 97 -7.743 -3.196 2.852 1.00 0.00 H new ATOM 0 HG21 ILE A 97 -7.276 -0.639 5.136 1.00 0.00 H new ATOM 0 HG22 ILE A 97 -6.458 0.396 3.942 1.00 0.00 H new ATOM 0 HG23 ILE A 97 -8.018 -0.361 3.543 1.00 0.00 H new ATOM 0 HD11 ILE A 97 -6.973 -5.050 4.250 1.00 0.00 H new ATOM 0 HD12 ILE A 97 -5.627 -4.391 3.291 1.00 0.00 H new ATOM 0 HD13 ILE A 97 -5.769 -3.988 5.018 1.00 0.00 H new ATOM 1441 N LEU A 98 -5.108 0.265 0.683 1.00 0.00 N ATOM 1442 CA LEU A 98 -4.214 1.379 0.389 1.00 0.00 C ATOM 1443 C LEU A 98 -4.605 2.617 1.189 1.00 0.00 C ATOM 1444 O LEU A 98 -5.789 2.908 1.363 1.00 0.00 O ATOM 1445 CB LEU A 98 -4.235 1.697 -1.107 1.00 0.00 C ATOM 1446 CG LEU A 98 -3.506 0.686 -1.995 1.00 0.00 C ATOM 1447 CD1 LEU A 98 -4.483 -0.335 -2.554 1.00 0.00 C ATOM 1448 CD2 LEU A 98 -2.773 1.398 -3.122 1.00 0.00 C ATOM 0 H LEU A 98 -5.753 0.031 -0.072 1.00 0.00 H new ATOM 0 HA LEU A 98 -3.204 1.087 0.677 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -5.273 1.763 -1.434 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -3.789 2.680 -1.260 1.00 0.00 H new ATOM 0 HG LEU A 98 -2.771 0.159 -1.386 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -3.947 -1.046 -3.183 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -4.963 -0.867 -1.733 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -5.242 0.175 -3.148 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -2.260 0.664 -3.743 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -3.489 1.951 -3.730 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -2.044 2.090 -2.701 1.00 0.00 H new ATOM 1460 N THR A 99 -3.603 3.344 1.672 1.00 0.00 N ATOM 1461 CA THR A 99 -3.840 4.553 2.452 1.00 0.00 C ATOM 1462 C THR A 99 -3.199 5.765 1.782 1.00 0.00 C ATOM 1463 O THR A 99 -2.008 6.024 1.955 1.00 0.00 O ATOM 1464 CB THR A 99 -3.288 4.388 3.869 1.00 0.00 C ATOM 1465 OG1 THR A 99 -3.513 3.073 4.344 1.00 0.00 O ATOM 1466 CG2 THR A 99 -3.902 5.348 4.865 1.00 0.00 C ATOM 0 H THR A 99 -2.618 3.117 1.537 1.00 0.00 H new ATOM 0 HA THR A 99 -4.916 4.716 2.506 1.00 0.00 H new ATOM 0 HB THR A 99 -2.222 4.603 3.792 1.00 0.00 H new ATOM 0 HG1 THR A 99 -2.876 2.459 3.922 1.00 0.00 H new ATOM 0 HG21 THR A 99 -3.467 5.178 5.850 1.00 0.00 H new ATOM 0 HG22 THR A 99 -3.703 6.373 4.552 1.00 0.00 H new ATOM 0 HG23 THR A 99 -4.979 5.185 4.911 1.00 0.00 H new ATOM 1474 N VAL A 100 -3.995 6.501 1.016 1.00 0.00 N ATOM 1475 CA VAL A 100 -3.504 7.685 0.320 1.00 0.00 C ATOM 1476 C VAL A 100 -3.938 8.962 1.030 1.00 0.00 C ATOM 1477 O VAL A 100 -4.746 8.924 1.958 1.00 0.00 O ATOM 1478 CB VAL A 100 -4.003 7.727 -1.137 1.00 0.00 C ATOM 1479 CG1 VAL A 100 -3.405 6.583 -1.941 1.00 0.00 C ATOM 1480 CG2 VAL A 100 -5.523 7.684 -1.182 1.00 0.00 C ATOM 0 H VAL A 100 -4.983 6.299 0.861 1.00 0.00 H new ATOM 0 HA VAL A 100 -2.416 7.624 0.323 1.00 0.00 H new ATOM 0 HB VAL A 100 -3.676 8.664 -1.587 1.00 0.00 H new ATOM 0 HG11 VAL A 100 -3.770 6.630 -2.967 1.00 0.00 H new ATOM 0 HG12 VAL A 100 -2.318 6.665 -1.938 1.00 0.00 H new ATOM 0 HG13 VAL A 100 -3.698 5.633 -1.495 1.00 0.00 H new ATOM 0 HG21 VAL A 100 -5.857 7.715 -2.219 1.00 0.00 H new ATOM 0 HG22 VAL A 100 -5.875 6.765 -0.714 1.00 0.00 H new ATOM 0 HG23 VAL A 100 -5.927 8.542 -0.645 1.00 0.00 H new ATOM 1490 N LYS A 101 -3.396 10.092 0.588 1.00 0.00 N ATOM 1491 CA LYS A 101 -3.726 11.382 1.181 1.00 0.00 C ATOM 1492 C LYS A 101 -3.925 12.442 0.102 1.00 0.00 C ATOM 1493 O LYS A 101 -3.592 12.224 -1.063 1.00 0.00 O ATOM 1494 CB LYS A 101 -2.624 11.821 2.146 1.00 0.00 C ATOM 1495 CG LYS A 101 -1.221 11.658 1.583 1.00 0.00 C ATOM 1496 CD LYS A 101 -0.200 12.433 2.399 1.00 0.00 C ATOM 1497 CE LYS A 101 -0.345 13.932 2.195 1.00 0.00 C ATOM 1498 NZ LYS A 101 0.957 14.641 2.335 1.00 0.00 N ATOM 0 H LYS A 101 -2.726 10.140 -0.179 1.00 0.00 H new ATOM 0 HA LYS A 101 -4.659 11.271 1.733 1.00 0.00 H new ATOM 0 HB2 LYS A 101 -2.781 12.866 2.412 1.00 0.00 H new ATOM 0 HB3 LYS A 101 -2.707 11.242 3.066 1.00 0.00 H new ATOM 0 HG2 LYS A 101 -0.953 10.602 1.571 1.00 0.00 H new ATOM 0 HG3 LYS A 101 -1.200 12.003 0.549 1.00 0.00 H new ATOM 0 HD2 LYS A 101 -0.321 12.195 3.456 1.00 0.00 H new ATOM 0 HD3 LYS A 101 0.805 12.122 2.116 1.00 0.00 H new ATOM 0 HE2 LYS A 101 -0.759 14.125 1.205 1.00 0.00 H new ATOM 0 HE3 LYS A 101 -1.055 14.330 2.920 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 0.814 15.661 2.189 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 1.340 14.478 3.288 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 1.627 14.280 1.626 1.00 0.00 H new ATOM 1512 N ASP A 102 -4.470 13.587 0.497 1.00 0.00 N ATOM 1513 CA ASP A 102 -4.713 14.679 -0.437 1.00 0.00 C ATOM 1514 C ASP A 102 -3.400 15.241 -0.972 1.00 0.00 C ATOM 1515 O ASP A 102 -2.786 16.111 -0.351 1.00 0.00 O ATOM 1516 CB ASP A 102 -5.516 15.790 0.243 1.00 0.00 C ATOM 1517 CG ASP A 102 -6.733 15.257 0.974 1.00 0.00 C ATOM 1518 OD1 ASP A 102 -7.492 14.471 0.368 1.00 0.00 O ATOM 1519 OD2 ASP A 102 -6.927 15.624 2.151 1.00 0.00 O ATOM 0 H ASP A 102 -4.752 13.783 1.458 1.00 0.00 H new ATOM 0 HA ASP A 102 -5.287 14.285 -1.276 1.00 0.00 H new ATOM 0 HB2 ASP A 102 -4.875 16.319 0.948 1.00 0.00 H new ATOM 0 HB3 ASP A 102 -5.834 16.516 -0.506 1.00 0.00 H new ATOM 1524 N VAL A 103 -2.973 14.739 -2.126 1.00 0.00 N ATOM 1525 CA VAL A 103 -1.732 15.191 -2.744 1.00 0.00 C ATOM 1526 C VAL A 103 -1.996 15.811 -4.112 1.00 0.00 C ATOM 1527 O VAL A 103 -1.387 16.818 -4.476 1.00 0.00 O ATOM 1528 CB VAL A 103 -0.728 14.034 -2.902 1.00 0.00 C ATOM 1529 CG1 VAL A 103 0.613 14.554 -3.399 1.00 0.00 C ATOM 1530 CG2 VAL A 103 -0.563 13.283 -1.589 1.00 0.00 C ATOM 0 H VAL A 103 -3.468 14.019 -2.652 1.00 0.00 H new ATOM 0 HA VAL A 103 -1.304 15.944 -2.082 1.00 0.00 H new ATOM 0 HB VAL A 103 -1.120 13.338 -3.644 1.00 0.00 H new ATOM 0 HG11 VAL A 103 1.309 13.722 -3.504 1.00 0.00 H new ATOM 0 HG12 VAL A 103 0.479 15.040 -4.365 1.00 0.00 H new ATOM 0 HG13 VAL A 103 1.012 15.273 -2.684 1.00 0.00 H new ATOM 0 HG21 VAL A 103 0.150 12.470 -1.722 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -0.196 13.966 -0.823 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -1.525 12.875 -1.280 1.00 0.00 H new ATOM 1540 N GLY A 104 -2.905 15.203 -4.868 1.00 0.00 N ATOM 1541 CA GLY A 104 -3.232 15.709 -6.188 1.00 0.00 C ATOM 1542 C GLY A 104 -4.480 16.573 -6.194 1.00 0.00 C ATOM 1543 O GLY A 104 -4.739 17.290 -7.161 1.00 0.00 O ATOM 0 H GLY A 104 -3.421 14.368 -4.589 1.00 0.00 H new ATOM 0 HA2 GLY A 104 -2.392 16.290 -6.568 1.00 0.00 H new ATOM 0 HA3 GLY A 104 -3.373 14.870 -6.869 1.00 0.00 H new ATOM 1547 N ARG A 105 -5.256 16.504 -5.116 1.00 0.00 N ATOM 1548 CA ARG A 105 -6.483 17.287 -5.006 1.00 0.00 C ATOM 1549 C ARG A 105 -6.205 18.775 -5.194 1.00 0.00 C ATOM 1550 O ARG A 105 -5.624 19.424 -4.324 1.00 0.00 O ATOM 1551 CB ARG A 105 -7.142 17.050 -3.646 1.00 0.00 C ATOM 1552 CG ARG A 105 -7.564 15.607 -3.419 1.00 0.00 C ATOM 1553 CD ARG A 105 -8.856 15.280 -4.151 1.00 0.00 C ATOM 1554 NE ARG A 105 -9.976 15.099 -3.231 1.00 0.00 N ATOM 1555 CZ ARG A 105 -11.254 15.154 -3.598 1.00 0.00 C ATOM 1556 NH1 ARG A 105 -11.578 15.388 -4.864 1.00 0.00 N ATOM 1557 NH2 ARG A 105 -12.210 14.977 -2.697 1.00 0.00 N ATOM 0 H ARG A 105 -5.057 15.915 -4.307 1.00 0.00 H new ATOM 0 HA ARG A 105 -7.160 16.962 -5.796 1.00 0.00 H new ATOM 0 HB2 ARG A 105 -6.448 17.345 -2.859 1.00 0.00 H new ATOM 0 HB3 ARG A 105 -8.017 17.694 -3.558 1.00 0.00 H new ATOM 0 HG2 ARG A 105 -6.773 14.938 -3.759 1.00 0.00 H new ATOM 0 HG3 ARG A 105 -7.695 15.429 -2.352 1.00 0.00 H new ATOM 0 HD2 ARG A 105 -9.089 16.082 -4.852 1.00 0.00 H new ATOM 0 HD3 ARG A 105 -8.720 14.372 -4.739 1.00 0.00 H new ATOM 0 HE ARG A 105 -9.766 14.920 -2.249 1.00 0.00 H new ATOM 0 HH11 ARG A 105 -10.846 15.527 -5.561 1.00 0.00 H new ATOM 0 HH12 ARG A 105 -12.559 15.429 -5.140 1.00 0.00 H new ATOM 0 HH21 ARG A 105 -11.966 14.799 -1.723 1.00 0.00 H new ATOM 0 HH22 ARG A 105 -13.190 15.019 -2.978 1.00 0.00 H new ATOM 1571 N LEU A 106 -6.624 19.309 -6.337 1.00 0.00 N ATOM 1572 CA LEU A 106 -6.420 20.722 -6.641 1.00 0.00 C ATOM 1573 C LEU A 106 -7.305 21.159 -7.808 1.00 0.00 C ATOM 1574 O LEU A 106 -7.331 20.510 -8.853 1.00 0.00 O ATOM 1575 CB LEU A 106 -4.950 20.984 -6.975 1.00 0.00 C ATOM 1576 CG LEU A 106 -4.468 22.411 -6.697 1.00 0.00 C ATOM 1577 CD1 LEU A 106 -3.105 22.393 -6.022 1.00 0.00 C ATOM 1578 CD2 LEU A 106 -4.414 23.216 -7.988 1.00 0.00 C ATOM 0 H LEU A 106 -7.106 18.786 -7.068 1.00 0.00 H new ATOM 0 HA LEU A 106 -6.695 21.303 -5.761 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -4.334 20.290 -6.403 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -4.787 20.760 -8.029 1.00 0.00 H new ATOM 0 HG LEU A 106 -5.178 22.889 -6.022 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -2.779 23.416 -5.833 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -3.174 21.853 -5.078 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -2.384 21.897 -6.672 1.00 0.00 H new ATOM 0 HD21 LEU A 106 -4.070 24.227 -7.772 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -3.725 22.739 -8.685 1.00 0.00 H new ATOM 0 HD23 LEU A 106 -5.409 23.259 -8.432 1.00 0.00 H new ATOM 1590 N PRO A 107 -8.047 22.272 -7.648 1.00 0.00 N ATOM 1591 CA PRO A 107 -8.933 22.784 -8.697 1.00 0.00 C ATOM 1592 C PRO A 107 -8.161 23.436 -9.840 1.00 0.00 C ATOM 1593 O PRO A 107 -6.939 23.321 -9.923 1.00 0.00 O ATOM 1594 CB PRO A 107 -9.781 23.823 -7.964 1.00 0.00 C ATOM 1595 CG PRO A 107 -8.913 24.298 -6.852 1.00 0.00 C ATOM 1596 CD PRO A 107 -8.083 23.113 -6.435 1.00 0.00 C ATOM 0 HA PRO A 107 -9.515 21.990 -9.165 1.00 0.00 H new ATOM 0 HB2 PRO A 107 -10.063 24.643 -8.625 1.00 0.00 H new ATOM 0 HB3 PRO A 107 -10.705 23.386 -7.587 1.00 0.00 H new ATOM 0 HG2 PRO A 107 -8.279 25.123 -7.177 1.00 0.00 H new ATOM 0 HG3 PRO A 107 -9.513 24.666 -6.020 1.00 0.00 H new ATOM 0 HD2 PRO A 107 -7.082 23.413 -6.125 1.00 0.00 H new ATOM 0 HD3 PRO A 107 -8.532 22.585 -5.594 1.00 0.00 H new ATOM 1604 N HIS A 108 -8.884 24.122 -10.719 1.00 0.00 N ATOM 1605 CA HIS A 108 -8.270 24.793 -11.857 1.00 0.00 C ATOM 1606 C HIS A 108 -8.801 26.217 -12.001 1.00 0.00 C ATOM 1607 O HIS A 108 -9.703 26.630 -11.273 1.00 0.00 O ATOM 1608 CB HIS A 108 -8.532 24.007 -13.143 1.00 0.00 C ATOM 1609 CG HIS A 108 -7.354 23.960 -14.067 1.00 0.00 C ATOM 1610 ND1 HIS A 108 -6.356 23.015 -13.966 1.00 0.00 N ATOM 1611 CD2 HIS A 108 -7.020 24.749 -15.116 1.00 0.00 C ATOM 1612 CE1 HIS A 108 -5.456 23.225 -14.912 1.00 0.00 C ATOM 1613 NE2 HIS A 108 -5.837 24.270 -15.623 1.00 0.00 N ATOM 0 H HIS A 108 -9.897 24.227 -10.664 1.00 0.00 H new ATOM 0 HA HIS A 108 -7.195 24.841 -11.681 1.00 0.00 H new ATOM 0 HB2 HIS A 108 -8.821 22.988 -12.884 1.00 0.00 H new ATOM 0 HB3 HIS A 108 -9.377 24.455 -13.667 1.00 0.00 H new ATOM 0 HD2 HIS A 108 -7.579 25.596 -15.485 1.00 0.00 H new ATOM 0 HE1 HIS A 108 -4.562 22.641 -15.075 1.00 0.00 H new ATOM 0 HE2 HIS A 108 -5.334 24.659 -16.420 1.00 0.00 H new ATOM 1622 N ALA A 109 -8.235 26.962 -12.944 1.00 0.00 N ATOM 1623 CA ALA A 109 -8.651 28.339 -13.184 1.00 0.00 C ATOM 1624 C ALA A 109 -9.373 28.470 -14.520 1.00 0.00 C ATOM 1625 O ALA A 109 -9.401 27.532 -15.316 1.00 0.00 O ATOM 1626 CB ALA A 109 -7.447 29.269 -13.138 1.00 0.00 C ATOM 0 H ALA A 109 -7.486 26.635 -13.555 1.00 0.00 H new ATOM 0 HA ALA A 109 -9.348 28.625 -12.396 1.00 0.00 H new ATOM 0 HB1 ALA A 109 -7.772 30.294 -13.319 1.00 0.00 H new ATOM 0 HB2 ALA A 109 -6.975 29.205 -12.157 1.00 0.00 H new ATOM 0 HB3 ALA A 109 -6.731 28.975 -13.905 1.00 0.00 H new ATOM 1632 N ARG A 110 -9.954 29.641 -14.760 1.00 0.00 N ATOM 1633 CA ARG A 110 -10.677 29.896 -16.001 1.00 0.00 C ATOM 1634 C ARG A 110 -9.969 30.961 -16.832 1.00 0.00 C ATOM 1635 O ARG A 110 -10.222 32.156 -16.674 1.00 0.00 O ATOM 1636 CB ARG A 110 -12.111 30.336 -15.699 1.00 0.00 C ATOM 1637 CG ARG A 110 -13.117 29.893 -16.750 1.00 0.00 C ATOM 1638 CD ARG A 110 -14.509 29.743 -16.158 1.00 0.00 C ATOM 1639 NE ARG A 110 -15.553 29.907 -17.168 1.00 0.00 N ATOM 1640 CZ ARG A 110 -16.829 30.157 -16.881 1.00 0.00 C ATOM 1641 NH1 ARG A 110 -17.223 30.273 -15.620 1.00 0.00 N ATOM 1642 NH2 ARG A 110 -17.713 30.293 -17.861 1.00 0.00 N ATOM 0 H ARG A 110 -9.938 30.428 -14.112 1.00 0.00 H new ATOM 0 HA ARG A 110 -10.703 28.970 -16.576 1.00 0.00 H new ATOM 0 HB2 ARG A 110 -12.409 29.935 -14.730 1.00 0.00 H new ATOM 0 HB3 ARG A 110 -12.139 31.422 -15.616 1.00 0.00 H new ATOM 0 HG2 ARG A 110 -13.142 30.620 -17.561 1.00 0.00 H new ATOM 0 HG3 ARG A 110 -12.800 28.944 -17.182 1.00 0.00 H new ATOM 0 HD2 ARG A 110 -14.603 28.760 -15.696 1.00 0.00 H new ATOM 0 HD3 ARG A 110 -14.649 30.481 -15.368 1.00 0.00 H new ATOM 0 HE ARG A 110 -15.289 29.825 -18.150 1.00 0.00 H new ATOM 0 HH11 ARG A 110 -16.547 30.171 -14.863 1.00 0.00 H new ATOM 0 HH12 ARG A 110 -18.202 30.465 -15.407 1.00 0.00 H new ATOM 0 HH21 ARG A 110 -17.415 30.206 -18.833 1.00 0.00 H new ATOM 0 HH22 ARG A 110 -18.691 30.484 -17.643 1.00 0.00 H new ATOM 1656 N THR A 111 -9.082 30.521 -17.718 1.00 0.00 N ATOM 1657 CA THR A 111 -8.338 31.437 -18.574 1.00 0.00 C ATOM 1658 C THR A 111 -8.242 30.897 -19.997 1.00 0.00 C ATOM 1659 O THR A 111 -8.372 29.694 -20.225 1.00 0.00 O ATOM 1660 CB THR A 111 -6.935 31.671 -18.010 1.00 0.00 C ATOM 1661 OG1 THR A 111 -6.178 32.496 -18.877 1.00 0.00 O ATOM 1662 CG2 THR A 111 -6.155 30.392 -17.796 1.00 0.00 C ATOM 0 H THR A 111 -8.861 29.536 -17.862 1.00 0.00 H new ATOM 0 HA THR A 111 -8.875 32.385 -18.600 1.00 0.00 H new ATOM 0 HB THR A 111 -7.088 32.150 -17.043 1.00 0.00 H new ATOM 0 HG1 THR A 111 -5.285 32.635 -18.499 1.00 0.00 H new ATOM 0 HG21 THR A 111 -5.170 30.629 -17.395 1.00 0.00 H new ATOM 0 HG22 THR A 111 -6.689 29.754 -17.092 1.00 0.00 H new ATOM 0 HG23 THR A 111 -6.044 29.870 -18.747 1.00 0.00 H new ATOM 1670 N THR A 112 -8.014 31.793 -20.951 1.00 0.00 N ATOM 1671 CA THR A 112 -7.900 31.408 -22.352 1.00 0.00 C ATOM 1672 C THR A 112 -6.562 31.852 -22.933 1.00 0.00 C ATOM 1673 O THR A 112 -5.747 31.025 -23.344 1.00 0.00 O ATOM 1674 CB THR A 112 -9.047 32.013 -23.164 1.00 0.00 C ATOM 1675 OG1 THR A 112 -10.177 32.240 -22.342 1.00 0.00 O ATOM 1676 CG2 THR A 112 -9.488 31.142 -24.320 1.00 0.00 C ATOM 0 H THR A 112 -7.904 32.792 -20.779 1.00 0.00 H new ATOM 0 HA THR A 112 -7.957 30.321 -22.409 1.00 0.00 H new ATOM 0 HB THR A 112 -8.655 32.948 -23.565 1.00 0.00 H new ATOM 0 HG1 THR A 112 -10.899 32.629 -22.879 1.00 0.00 H new ATOM 0 HG21 THR A 112 -10.304 31.630 -24.853 1.00 0.00 H new ATOM 0 HG22 THR A 112 -8.650 30.989 -25.000 1.00 0.00 H new ATOM 0 HG23 THR A 112 -9.828 30.178 -23.941 1.00 0.00 H new ATOM 1684 N VAL A 113 -6.341 33.162 -22.962 1.00 0.00 N ATOM 1685 CA VAL A 113 -5.101 33.716 -23.491 1.00 0.00 C ATOM 1686 C VAL A 113 -3.944 33.496 -22.521 1.00 0.00 C ATOM 1687 O VAL A 113 -4.129 33.507 -21.304 1.00 0.00 O ATOM 1688 CB VAL A 113 -5.239 35.223 -23.783 1.00 0.00 C ATOM 1689 CG1 VAL A 113 -5.570 35.990 -22.512 1.00 0.00 C ATOM 1690 CG2 VAL A 113 -3.970 35.764 -24.427 1.00 0.00 C ATOM 0 H VAL A 113 -7.005 33.859 -22.625 1.00 0.00 H new ATOM 0 HA VAL A 113 -4.891 33.193 -24.424 1.00 0.00 H new ATOM 0 HB VAL A 113 -6.061 35.361 -24.485 1.00 0.00 H new ATOM 0 HG11 VAL A 113 -5.663 37.052 -22.741 1.00 0.00 H new ATOM 0 HG12 VAL A 113 -6.511 35.624 -22.101 1.00 0.00 H new ATOM 0 HG13 VAL A 113 -4.774 35.845 -21.782 1.00 0.00 H new ATOM 0 HG21 VAL A 113 -4.088 36.829 -24.625 1.00 0.00 H new ATOM 0 HG22 VAL A 113 -3.127 35.611 -23.753 1.00 0.00 H new ATOM 0 HG23 VAL A 113 -3.785 35.239 -25.364 1.00 0.00 H new ATOM 1700 N ASP A 114 -2.749 33.293 -23.069 1.00 0.00 N ATOM 1701 CA ASP A 114 -1.562 33.070 -22.252 1.00 0.00 C ATOM 1702 C ASP A 114 -0.311 33.578 -22.961 1.00 0.00 C ATOM 1703 O ASP A 114 0.507 34.283 -22.371 1.00 0.00 O ATOM 1704 CB ASP A 114 -1.414 31.581 -21.928 1.00 0.00 C ATOM 1705 CG ASP A 114 -1.103 31.337 -20.464 1.00 0.00 C ATOM 1706 OD1 ASP A 114 -0.317 32.117 -19.886 1.00 0.00 O ATOM 1707 OD2 ASP A 114 -1.647 30.367 -19.896 1.00 0.00 O ATOM 0 H ASP A 114 -2.578 33.278 -24.074 1.00 0.00 H new ATOM 0 HA ASP A 114 -1.680 33.626 -21.322 1.00 0.00 H new ATOM 0 HB2 ASP A 114 -2.335 31.061 -22.193 1.00 0.00 H new ATOM 0 HB3 ASP A 114 -0.620 31.155 -22.541 1.00 0.00 H new ATOM 1712 N GLU A 115 -0.169 33.215 -24.231 1.00 0.00 N ATOM 1713 CA GLU A 115 0.982 33.634 -25.022 1.00 0.00 C ATOM 1714 C GLU A 115 0.616 34.794 -25.944 1.00 0.00 C ATOM 1715 O GLU A 115 0.721 34.687 -27.167 1.00 0.00 O ATOM 1716 CB GLU A 115 1.518 32.459 -25.843 1.00 0.00 C ATOM 1717 CG GLU A 115 2.218 31.401 -25.007 1.00 0.00 C ATOM 1718 CD GLU A 115 1.412 30.122 -24.887 1.00 0.00 C ATOM 1719 OE1 GLU A 115 0.180 30.212 -24.707 1.00 0.00 O ATOM 1720 OE2 GLU A 115 2.013 29.031 -24.972 1.00 0.00 O ATOM 0 H GLU A 115 -0.837 32.631 -24.735 1.00 0.00 H new ATOM 0 HA GLU A 115 1.760 33.972 -24.337 1.00 0.00 H new ATOM 0 HB2 GLU A 115 0.691 31.996 -26.382 1.00 0.00 H new ATOM 0 HB3 GLU A 115 2.214 32.837 -26.592 1.00 0.00 H new ATOM 0 HG2 GLU A 115 3.187 31.175 -25.452 1.00 0.00 H new ATOM 0 HG3 GLU A 115 2.410 31.799 -24.011 1.00 0.00 H new ATOM 1727 N THR A 116 0.185 35.901 -25.349 1.00 0.00 N ATOM 1728 CA THR A 116 -0.198 37.081 -26.116 1.00 0.00 C ATOM 1729 C THR A 116 1.007 37.982 -26.367 1.00 0.00 C ATOM 1730 O THR A 116 1.076 38.672 -27.384 1.00 0.00 O ATOM 1731 CB THR A 116 -1.287 37.861 -25.379 1.00 0.00 C ATOM 1732 OG1 THR A 116 -1.529 39.106 -26.011 1.00 0.00 O ATOM 1733 CG2 THR A 116 -0.949 38.140 -23.931 1.00 0.00 C ATOM 0 H THR A 116 0.092 36.006 -24.339 1.00 0.00 H new ATOM 0 HA THR A 116 -0.586 36.748 -27.078 1.00 0.00 H new ATOM 0 HB THR A 116 -2.170 37.223 -25.413 1.00 0.00 H new ATOM 0 HG1 THR A 116 -2.230 39.589 -25.525 1.00 0.00 H new ATOM 0 HG21 THR A 116 -1.764 38.696 -23.468 1.00 0.00 H new ATOM 0 HG22 THR A 116 -0.807 37.197 -23.402 1.00 0.00 H new ATOM 0 HG23 THR A 116 -0.033 38.728 -23.878 1.00 0.00 H new ATOM 1741 N LYS A 117 1.954 37.970 -25.435 1.00 0.00 N ATOM 1742 CA LYS A 117 3.157 38.787 -25.557 1.00 0.00 C ATOM 1743 C LYS A 117 3.931 38.431 -26.822 1.00 0.00 C ATOM 1744 O LYS A 117 4.475 37.333 -26.940 1.00 0.00 O ATOM 1745 CB LYS A 117 4.051 38.601 -24.329 1.00 0.00 C ATOM 1746 CG LYS A 117 3.686 39.510 -23.167 1.00 0.00 C ATOM 1747 CD LYS A 117 4.878 39.757 -22.256 1.00 0.00 C ATOM 1748 CE LYS A 117 5.469 41.141 -22.472 1.00 0.00 C ATOM 1749 NZ LYS A 117 4.710 42.190 -21.737 1.00 0.00 N ATOM 0 H LYS A 117 1.912 37.404 -24.587 1.00 0.00 H new ATOM 0 HA LYS A 117 2.852 39.831 -25.622 1.00 0.00 H new ATOM 0 HB2 LYS A 117 3.991 37.563 -24.000 1.00 0.00 H new ATOM 0 HB3 LYS A 117 5.087 38.786 -24.613 1.00 0.00 H new ATOM 0 HG2 LYS A 117 3.316 40.461 -23.550 1.00 0.00 H new ATOM 0 HG3 LYS A 117 2.875 39.061 -22.593 1.00 0.00 H new ATOM 0 HD2 LYS A 117 4.570 39.650 -21.216 1.00 0.00 H new ATOM 0 HD3 LYS A 117 5.641 39.002 -22.442 1.00 0.00 H new ATOM 0 HE2 LYS A 117 6.508 41.147 -22.143 1.00 0.00 H new ATOM 0 HE3 LYS A 117 5.470 41.373 -23.537 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 5.145 43.119 -21.910 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 3.724 42.202 -22.068 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 4.730 41.983 -20.718 1.00 0.00 H new ATOM 1763 N TRP A 118 3.975 39.366 -27.765 1.00 0.00 N ATOM 1764 CA TRP A 118 4.683 39.152 -29.022 1.00 0.00 C ATOM 1765 C TRP A 118 4.911 40.471 -29.751 1.00 0.00 C ATOM 1766 O TRP A 118 6.001 40.727 -30.265 1.00 0.00 O ATOM 1767 CB TRP A 118 3.896 38.191 -29.917 1.00 0.00 C ATOM 1768 CG TRP A 118 4.687 37.683 -31.082 1.00 0.00 C ATOM 1769 CD1 TRP A 118 6.000 37.307 -31.080 1.00 0.00 C ATOM 1770 CD2 TRP A 118 4.219 37.497 -32.423 1.00 0.00 C ATOM 1771 NE1 TRP A 118 6.375 36.897 -32.337 1.00 0.00 N ATOM 1772 CE2 TRP A 118 5.298 37.005 -33.179 1.00 0.00 C ATOM 1773 CE3 TRP A 118 2.989 37.699 -33.057 1.00 0.00 C ATOM 1774 CZ2 TRP A 118 5.186 36.711 -34.535 1.00 0.00 C ATOM 1775 CZ3 TRP A 118 2.878 37.407 -34.404 1.00 0.00 C ATOM 1776 CH2 TRP A 118 3.971 36.917 -35.130 1.00 0.00 C ATOM 0 H TRP A 118 3.529 40.279 -27.683 1.00 0.00 H new ATOM 0 HA TRP A 118 5.654 38.713 -28.792 1.00 0.00 H new ATOM 0 HB2 TRP A 118 3.558 37.344 -29.320 1.00 0.00 H new ATOM 0 HB3 TRP A 118 3.004 38.697 -30.286 1.00 0.00 H new ATOM 0 HD1 TRP A 118 6.649 37.329 -30.217 1.00 0.00 H new ATOM 0 HE1 TRP A 118 7.303 36.566 -32.601 1.00 0.00 H new ATOM 0 HE3 TRP A 118 2.141 38.076 -32.505 1.00 0.00 H new ATOM 0 HZ2 TRP A 118 6.028 36.334 -35.097 1.00 0.00 H new ATOM 0 HZ3 TRP A 118 1.933 37.559 -34.904 1.00 0.00 H new ATOM 0 HH2 TRP A 118 3.852 36.697 -36.181 1.00 0.00 H new ATOM 1787 N ILE A 119 3.878 41.305 -29.792 1.00 0.00 N ATOM 1788 CA ILE A 119 3.966 42.600 -30.458 1.00 0.00 C ATOM 1789 C ILE A 119 3.761 43.742 -29.467 1.00 0.00 C ATOM 1790 O ILE A 119 2.631 44.151 -29.202 1.00 0.00 O ATOM 1791 CB ILE A 119 2.926 42.723 -31.589 1.00 0.00 C ATOM 1792 CG1 ILE A 119 2.988 41.500 -32.508 1.00 0.00 C ATOM 1793 CG2 ILE A 119 3.152 44.002 -32.380 1.00 0.00 C ATOM 1794 CD1 ILE A 119 1.629 40.922 -32.836 1.00 0.00 C ATOM 0 H ILE A 119 2.970 41.108 -29.372 1.00 0.00 H new ATOM 0 HA ILE A 119 4.966 42.668 -30.886 1.00 0.00 H new ATOM 0 HB ILE A 119 1.932 42.766 -31.144 1.00 0.00 H new ATOM 0 HG12 ILE A 119 3.489 41.777 -33.435 1.00 0.00 H new ATOM 0 HG13 ILE A 119 3.597 40.730 -32.034 1.00 0.00 H new ATOM 0 HG21 ILE A 119 2.410 44.074 -33.175 1.00 0.00 H new ATOM 0 HG22 ILE A 119 3.058 44.862 -31.716 1.00 0.00 H new ATOM 0 HG23 ILE A 119 4.151 43.988 -32.816 1.00 0.00 H new ATOM 0 HD11 ILE A 119 1.749 40.059 -33.491 1.00 0.00 H new ATOM 0 HD12 ILE A 119 1.133 40.613 -31.916 1.00 0.00 H new ATOM 0 HD13 ILE A 119 1.024 41.677 -33.338 1.00 0.00 H new ATOM 1806 N ALA A 120 4.862 44.251 -28.925 1.00 0.00 N ATOM 1807 CA ALA A 120 4.804 45.346 -27.964 1.00 0.00 C ATOM 1808 C ALA A 120 4.627 46.686 -28.669 1.00 0.00 C ATOM 1809 O ALA A 120 5.604 47.360 -28.998 1.00 0.00 O ATOM 1810 CB ALA A 120 6.059 45.361 -27.104 1.00 0.00 C ATOM 0 H ALA A 120 5.805 43.923 -29.135 1.00 0.00 H new ATOM 0 HA ALA A 120 3.939 45.187 -27.321 1.00 0.00 H new ATOM 0 HB1 ALA A 120 6.002 46.184 -26.391 1.00 0.00 H new ATOM 0 HB2 ALA A 120 6.141 44.418 -26.564 1.00 0.00 H new ATOM 0 HB3 ALA A 120 6.934 45.492 -27.740 1.00 0.00 H new ATOM 1816 N SER A 121 3.375 47.068 -28.898 1.00 0.00 N ATOM 1817 CA SER A 121 3.070 48.328 -29.565 1.00 0.00 C ATOM 1818 C SER A 121 3.458 49.514 -28.688 1.00 0.00 C ATOM 1819 O SER A 121 4.299 50.330 -29.066 1.00 0.00 O ATOM 1820 CB SER A 121 1.582 48.400 -29.910 1.00 0.00 C ATOM 1821 OG SER A 121 0.783 48.363 -28.740 1.00 0.00 O ATOM 0 H SER A 121 2.555 46.523 -28.631 1.00 0.00 H new ATOM 0 HA SER A 121 3.651 48.373 -30.486 1.00 0.00 H new ATOM 0 HB2 SER A 121 1.378 49.316 -30.464 1.00 0.00 H new ATOM 0 HB3 SER A 121 1.316 47.568 -30.562 1.00 0.00 H new ATOM 0 HG SER A 121 -0.164 48.412 -28.989 1.00 0.00 H new ATOM 1827 N SER A 122 2.840 49.604 -27.515 1.00 0.00 N ATOM 1828 CA SER A 122 3.121 50.690 -26.584 1.00 0.00 C ATOM 1829 C SER A 122 3.966 50.198 -25.413 1.00 0.00 C ATOM 1830 O SER A 122 3.846 49.048 -24.988 1.00 0.00 O ATOM 1831 CB SER A 122 1.816 51.297 -26.066 1.00 0.00 C ATOM 1832 OG SER A 122 2.061 52.482 -25.329 1.00 0.00 O ATOM 0 H SER A 122 2.141 48.938 -27.187 1.00 0.00 H new ATOM 0 HA SER A 122 3.683 51.456 -27.118 1.00 0.00 H new ATOM 0 HB2 SER A 122 1.156 51.517 -26.905 1.00 0.00 H new ATOM 0 HB3 SER A 122 1.300 50.573 -25.435 1.00 0.00 H new ATOM 0 HG SER A 122 1.211 52.851 -25.011 1.00 0.00 H new ATOM 1838 N SER A 123 4.820 51.075 -24.896 1.00 0.00 N ATOM 1839 CA SER A 123 5.685 50.729 -23.774 1.00 0.00 C ATOM 1840 C SER A 123 6.023 51.965 -22.946 1.00 0.00 C ATOM 1841 O SER A 123 6.795 52.821 -23.376 1.00 0.00 O ATOM 1842 CB SER A 123 6.971 50.072 -24.278 1.00 0.00 C ATOM 1843 OG SER A 123 7.350 50.592 -25.541 1.00 0.00 O ATOM 0 H SER A 123 4.932 52.030 -25.236 1.00 0.00 H new ATOM 0 HA SER A 123 5.149 50.023 -23.139 1.00 0.00 H new ATOM 0 HB2 SER A 123 7.773 50.236 -23.558 1.00 0.00 H new ATOM 0 HB3 SER A 123 6.827 48.994 -24.354 1.00 0.00 H new ATOM 0 HG SER A 123 8.176 50.157 -25.840 1.00 0.00 H new ATOM 1849 N GLY A 124 5.438 52.051 -21.755 1.00 0.00 N ATOM 1850 CA GLY A 124 5.690 53.184 -20.886 1.00 0.00 C ATOM 1851 C GLY A 124 4.824 53.165 -19.639 1.00 0.00 C ATOM 1852 O GLY A 124 5.307 52.849 -18.553 1.00 0.00 O ATOM 0 H GLY A 124 4.794 51.356 -21.377 1.00 0.00 H new ATOM 0 HA2 GLY A 124 6.740 53.188 -20.595 1.00 0.00 H new ATOM 0 HA3 GLY A 124 5.508 54.107 -21.436 1.00 0.00 H new ATOM 1856 N PRO A 125 3.529 53.499 -19.767 1.00 0.00 N ATOM 1857 CA PRO A 125 2.601 53.514 -18.631 1.00 0.00 C ATOM 1858 C PRO A 125 2.282 52.112 -18.117 1.00 0.00 C ATOM 1859 O PRO A 125 1.674 51.955 -17.058 1.00 0.00 O ATOM 1860 CB PRO A 125 1.345 54.170 -19.207 1.00 0.00 C ATOM 1861 CG PRO A 125 1.407 53.892 -20.668 1.00 0.00 C ATOM 1862 CD PRO A 125 2.868 53.889 -21.027 1.00 0.00 C ATOM 0 HA PRO A 125 3.020 54.040 -17.773 1.00 0.00 H new ATOM 0 HB2 PRO A 125 0.441 53.752 -18.763 1.00 0.00 H new ATOM 0 HB3 PRO A 125 1.332 55.242 -19.008 1.00 0.00 H new ATOM 0 HG2 PRO A 125 0.945 52.933 -20.903 1.00 0.00 H new ATOM 0 HG3 PRO A 125 0.868 54.652 -21.233 1.00 0.00 H new ATOM 0 HD2 PRO A 125 3.083 53.183 -21.829 1.00 0.00 H new ATOM 0 HD3 PRO A 125 3.200 54.870 -21.368 1.00 0.00 H new ATOM 1870 N SER A 126 2.693 51.095 -18.870 1.00 0.00 N ATOM 1871 CA SER A 126 2.447 49.709 -18.484 1.00 0.00 C ATOM 1872 C SER A 126 3.029 49.414 -17.106 1.00 0.00 C ATOM 1873 O SER A 126 2.498 48.592 -16.359 1.00 0.00 O ATOM 1874 CB SER A 126 3.049 48.756 -19.519 1.00 0.00 C ATOM 1875 OG SER A 126 2.776 47.406 -19.188 1.00 0.00 O ATOM 0 H SER A 126 3.197 51.205 -19.750 1.00 0.00 H new ATOM 0 HA SER A 126 1.369 49.557 -18.442 1.00 0.00 H new ATOM 0 HB2 SER A 126 2.643 48.981 -20.505 1.00 0.00 H new ATOM 0 HB3 SER A 126 4.127 48.909 -19.576 1.00 0.00 H new ATOM 0 HG SER A 126 3.170 46.817 -19.865 1.00 0.00 H new ATOM 1881 N SER A 127 4.124 50.090 -16.774 1.00 0.00 N ATOM 1882 CA SER A 127 4.778 49.901 -15.484 1.00 0.00 C ATOM 1883 C SER A 127 4.247 50.894 -14.455 1.00 0.00 C ATOM 1884 O SER A 127 3.741 50.502 -13.403 1.00 0.00 O ATOM 1885 CB SER A 127 6.293 50.060 -15.628 1.00 0.00 C ATOM 1886 OG SER A 127 6.982 49.300 -14.650 1.00 0.00 O ATOM 0 H SER A 127 4.577 50.774 -17.380 1.00 0.00 H new ATOM 0 HA SER A 127 4.557 48.892 -15.137 1.00 0.00 H new ATOM 0 HB2 SER A 127 6.602 49.742 -16.624 1.00 0.00 H new ATOM 0 HB3 SER A 127 6.562 51.112 -15.531 1.00 0.00 H new ATOM 0 HG SER A 127 7.948 49.418 -14.765 1.00 0.00 H new ATOM 1892 N GLY A 128 4.367 52.180 -14.765 1.00 0.00 N ATOM 1893 CA GLY A 128 3.895 53.209 -13.857 1.00 0.00 C ATOM 1894 C GLY A 128 4.726 53.293 -12.592 1.00 0.00 C ATOM 1895 O GLY A 128 4.446 54.177 -11.755 1.00 0.00 O ATOM 1896 OXT GLY A 128 5.658 52.476 -12.439 1.00 0.00 O ATOM 0 H GLY A 128 4.783 52.528 -15.629 1.00 0.00 H new ATOM 0 HA2 GLY A 128 3.914 54.173 -14.365 1.00 0.00 H new ATOM 0 HA3 GLY A 128 2.857 53.008 -13.593 1.00 0.00 H new TER 1900 GLY A 128