USER MOD reduce.3.24.130724 H: found=0, std=0, add=868, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 864 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 87 LYS NZ :NH3+ -148:sc= 0.307 (180deg=-0.56) USER MOD Set 1.2: A 90 HIS : no HD1:sc= 0 X(o=0.31,f=0.24) USER MOD Set 2.1: A 64 SER OG : rot 121:sc= 1.2 USER MOD Set 2.2: A 67 ASN : amide:sc= 1.09 K(o=2.3,f=-3.1) USER MOD Single : A 1 MET CE :methyl 178:sc= 0 (180deg=-0.0157) USER MOD Single : A 1 MET N :NH3+ -129:sc= -0.206 (180deg=-0.438) USER MOD Single : A 4 THR OG1 : rot 180:sc= 0 USER MOD Single : A 6 CYS SG : rot 180:sc= 0 USER MOD Single : A 7 THR OG1 : rot 180:sc= 0.0341 USER MOD Single : A 11 MET CE :methyl 148:sc= -0.533 (180deg=-3.11) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 15 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 19 THR OG1 : rot 180:sc= 0 USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 25 LYS NZ :NH3+ 169:sc= 0.0581 (180deg=0.0356) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 30 THR OG1 : rot 180:sc= -0.0299 USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 TYR OH : rot 180:sc= 0 USER MOD Single : A 42 GLN : amide:sc= 0 K(o=0,f=-0.69) USER MOD Single : A 44 THR OG1 : rot 180:sc= -0.247 USER MOD Single : A 51 SER OG : rot -120:sc= 0.0668 USER MOD Single : A 54 SER OG : rot -88:sc= 1.1 USER MOD Single : A 55 SER OG : rot 177:sc= -0.304 USER MOD Single : A 59 ASN : amide:sc= -1.14 K(o=-1.1,f=-3.5!) USER MOD Single : A 60 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 61 ASN : amide:sc= -0.445 X(o=-0.44,f=0.02) USER MOD Single : A 66 THR OG1 : rot -55:sc= 0.847 USER MOD Single : A 78 SER OG : rot -33:sc= 0.875 USER MOD Single : A 79 LYS NZ :NH3+ -158:sc= 0.747 (180deg=0.477) USER MOD Single : A 91 THR OG1 : rot -160:sc= 0.418 USER MOD Single : A 97 TYR OH : rot 132:sc= 0.741 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 5.668 -0.317 -1.460 1.00 24.24 N ATOM 2 CA MET A 1 4.261 -0.466 -1.812 1.00 20.24 C ATOM 3 C MET A 1 4.011 -1.807 -2.495 1.00 54.54 C ATOM 4 O MET A 1 4.377 -2.001 -3.654 1.00 53.41 O ATOM 5 CB MET A 1 3.818 0.677 -2.727 1.00 3.13 C ATOM 6 CG MET A 1 4.004 2.055 -2.112 1.00 21.44 C ATOM 7 SD MET A 1 2.943 2.324 -0.679 1.00 1.41 S ATOM 8 CE MET A 1 4.137 2.216 0.652 1.00 41.42 C ATOM 0 H1 MET A 1 5.749 -0.045 -0.459 1.00 24.24 H new ATOM 0 H2 MET A 1 6.162 -1.219 -1.615 1.00 24.24 H new ATOM 0 H3 MET A 1 6.098 0.420 -2.055 1.00 24.24 H new ATOM 0 HA MET A 1 3.676 -0.432 -0.893 1.00 20.24 H new ATOM 0 HB2 MET A 1 4.381 0.625 -3.659 1.00 3.13 H new ATOM 0 HB3 MET A 1 2.767 0.541 -2.982 1.00 3.13 H new ATOM 0 HG2 MET A 1 5.046 2.179 -1.816 1.00 21.44 H new ATOM 0 HG3 MET A 1 3.793 2.816 -2.864 1.00 21.44 H new ATOM 0 HE1 MET A 1 3.638 2.397 1.604 1.00 41.42 H new ATOM 0 HE2 MET A 1 4.584 1.222 0.660 1.00 41.42 H new ATOM 0 HE3 MET A 1 4.917 2.963 0.503 1.00 41.42 H new ATOM 18 N ALA A 2 3.385 -2.728 -1.770 1.00 50.03 N ATOM 19 CA ALA A 2 3.085 -4.049 -2.308 1.00 75.02 C ATOM 20 C ALA A 2 2.066 -4.777 -1.438 1.00 71.40 C ATOM 21 O ALA A 2 1.989 -4.548 -0.231 1.00 65.04 O ATOM 22 CB ALA A 2 4.359 -4.871 -2.432 1.00 40.33 C ATOM 0 H ALA A 2 3.076 -2.584 -0.809 1.00 50.03 H new ATOM 0 HA ALA A 2 2.652 -3.920 -3.300 1.00 75.02 H new ATOM 0 HB1 ALA A 2 4.119 -5.855 -2.835 1.00 40.33 H new ATOM 0 HB2 ALA A 2 5.055 -4.365 -3.101 1.00 40.33 H new ATOM 0 HB3 ALA A 2 4.817 -4.983 -1.449 1.00 40.33 H new ATOM 28 N ALA A 3 1.285 -5.655 -2.059 1.00 34.34 N ATOM 29 CA ALA A 3 0.271 -6.418 -1.340 1.00 65.10 C ATOM 30 C ALA A 3 0.626 -7.901 -1.301 1.00 55.20 C ATOM 31 O ALA A 3 0.515 -8.603 -2.307 1.00 23.34 O ATOM 32 CB ALA A 3 -1.094 -6.216 -1.980 1.00 61.12 C ATOM 0 H ALA A 3 1.335 -5.856 -3.058 1.00 34.34 H new ATOM 0 HA ALA A 3 0.236 -6.053 -0.314 1.00 65.10 H new ATOM 0 HB1 ALA A 3 -1.841 -6.791 -1.433 1.00 61.12 H new ATOM 0 HB2 ALA A 3 -1.357 -5.159 -1.950 1.00 61.12 H new ATOM 0 HB3 ALA A 3 -1.064 -6.553 -3.016 1.00 61.12 H new ATOM 38 N THR A 4 1.052 -8.372 -0.134 1.00 24.25 N ATOM 39 CA THR A 4 1.425 -9.771 0.036 1.00 74.11 C ATOM 40 C THR A 4 0.952 -10.306 1.383 1.00 63.42 C ATOM 41 O THR A 4 1.579 -11.192 1.964 1.00 30.24 O ATOM 42 CB THR A 4 2.949 -9.964 -0.075 1.00 33.23 C ATOM 43 OG1 THR A 4 3.623 -9.049 0.796 1.00 40.44 O ATOM 44 CG2 THR A 4 3.419 -9.751 -1.506 1.00 32.23 C ATOM 0 H THR A 4 1.148 -7.805 0.708 1.00 24.25 H new ATOM 0 HA THR A 4 0.937 -10.328 -0.764 1.00 74.11 H new ATOM 0 HB THR A 4 3.186 -10.986 0.219 1.00 33.23 H new ATOM 0 HG1 THR A 4 4.591 -9.179 0.721 1.00 40.44 H new ATOM 0 HG21 THR A 4 4.498 -9.893 -1.559 1.00 32.23 H new ATOM 0 HG22 THR A 4 2.926 -10.469 -2.162 1.00 32.23 H new ATOM 0 HG23 THR A 4 3.170 -8.739 -1.824 1.00 32.23 H new ATOM 52 N VAL A 5 -0.157 -9.764 1.874 1.00 13.20 N ATOM 53 CA VAL A 5 -0.715 -10.189 3.152 1.00 1.55 C ATOM 54 C VAL A 5 -2.118 -9.627 3.354 1.00 61.11 C ATOM 55 O VAL A 5 -2.351 -8.431 3.173 1.00 61.45 O ATOM 56 CB VAL A 5 0.177 -9.747 4.328 1.00 13.32 C ATOM 57 CG1 VAL A 5 0.288 -8.230 4.374 1.00 72.41 C ATOM 58 CG2 VAL A 5 -0.366 -10.290 5.641 1.00 14.54 C ATOM 0 H VAL A 5 -0.687 -9.029 1.406 1.00 13.20 H new ATOM 0 HA VAL A 5 -0.763 -11.278 3.130 1.00 1.55 H new ATOM 0 HB VAL A 5 1.176 -10.156 4.177 1.00 13.32 H new ATOM 0 HG11 VAL A 5 0.922 -7.937 5.211 1.00 72.41 H new ATOM 0 HG12 VAL A 5 0.726 -7.869 3.443 1.00 72.41 H new ATOM 0 HG13 VAL A 5 -0.704 -7.796 4.501 1.00 72.41 H new ATOM 0 HG21 VAL A 5 0.276 -9.968 6.461 1.00 14.54 H new ATOM 0 HG22 VAL A 5 -1.376 -9.912 5.801 1.00 14.54 H new ATOM 0 HG23 VAL A 5 -0.388 -11.379 5.603 1.00 14.54 H new ATOM 68 N CYS A 6 -3.049 -10.497 3.730 1.00 4.10 N ATOM 69 CA CYS A 6 -4.430 -10.088 3.956 1.00 34.03 C ATOM 70 C CYS A 6 -4.839 -10.332 5.405 1.00 12.23 C ATOM 71 O CYS A 6 -4.818 -11.465 5.886 1.00 34.41 O ATOM 72 CB CYS A 6 -5.369 -10.845 3.015 1.00 44.42 C ATOM 73 SG CYS A 6 -5.379 -10.215 1.320 1.00 41.21 S ATOM 0 H CYS A 6 -2.872 -11.490 3.885 1.00 4.10 H new ATOM 0 HA CYS A 6 -4.505 -9.020 3.751 1.00 34.03 H new ATOM 0 HB2 CYS A 6 -5.081 -11.896 2.999 1.00 44.42 H new ATOM 0 HB3 CYS A 6 -6.382 -10.798 3.415 1.00 44.42 H new ATOM 0 HG CYS A 6 -6.200 -10.920 0.600 1.00 41.21 H new ATOM 79 N THR A 7 -5.210 -9.260 6.099 1.00 42.43 N ATOM 80 CA THR A 7 -5.621 -9.356 7.494 1.00 44.04 C ATOM 81 C THR A 7 -7.127 -9.561 7.610 1.00 24.44 C ATOM 82 O THR A 7 -7.889 -9.141 6.739 1.00 21.43 O ATOM 83 CB THR A 7 -5.223 -8.096 8.285 1.00 50.53 C ATOM 84 OG1 THR A 7 -4.575 -7.157 7.418 1.00 31.53 O ATOM 85 CG2 THR A 7 -4.298 -8.450 9.439 1.00 63.51 C ATOM 0 H THR A 7 -5.234 -8.315 5.717 1.00 42.43 H new ATOM 0 HA THR A 7 -5.106 -10.219 7.917 1.00 44.04 H new ATOM 0 HB THR A 7 -6.130 -7.649 8.692 1.00 50.53 H new ATOM 0 HG1 THR A 7 -4.327 -6.358 7.928 1.00 31.53 H new ATOM 0 HG21 THR A 7 -4.031 -7.544 9.982 1.00 63.51 H new ATOM 0 HG22 THR A 7 -4.805 -9.141 10.113 1.00 63.51 H new ATOM 0 HG23 THR A 7 -3.394 -8.919 9.050 1.00 63.51 H new ATOM 93 N ILE A 8 -7.549 -10.209 8.691 1.00 3.43 N ATOM 94 CA ILE A 8 -8.964 -10.467 8.922 1.00 75.52 C ATOM 95 C ILE A 8 -9.396 -9.975 10.299 1.00 52.01 C ATOM 96 O ILE A 8 -8.650 -9.272 10.980 1.00 31.51 O ATOM 97 CB ILE A 8 -9.289 -11.968 8.801 1.00 75.05 C ATOM 98 CG1 ILE A 8 -8.005 -12.776 8.606 1.00 21.34 C ATOM 99 CG2 ILE A 8 -10.253 -12.210 7.648 1.00 11.23 C ATOM 100 CD1 ILE A 8 -7.422 -12.660 7.215 1.00 32.03 C ATOM 0 H ILE A 8 -6.931 -10.565 9.420 1.00 3.43 H new ATOM 0 HA ILE A 8 -9.513 -9.921 8.155 1.00 75.52 H new ATOM 0 HB ILE A 8 -9.767 -12.297 9.724 1.00 75.05 H new ATOM 0 HG12 ILE A 8 -7.262 -12.443 9.331 1.00 21.34 H new ATOM 0 HG13 ILE A 8 -8.210 -13.825 8.819 1.00 21.34 H new ATOM 0 HG21 ILE A 8 -10.473 -13.275 7.575 1.00 11.23 H new ATOM 0 HG22 ILE A 8 -11.177 -11.660 7.825 1.00 11.23 H new ATOM 0 HG23 ILE A 8 -9.800 -11.869 6.717 1.00 11.23 H new ATOM 0 HD11 ILE A 8 -6.514 -13.259 7.150 1.00 32.03 H new ATOM 0 HD12 ILE A 8 -8.147 -13.021 6.485 1.00 32.03 H new ATOM 0 HD13 ILE A 8 -7.185 -11.617 7.006 1.00 32.03 H new ATOM 112 N ALA A 9 -10.605 -10.350 10.703 1.00 34.11 N ATOM 113 CA ALA A 9 -11.135 -9.950 12.001 1.00 54.04 C ATOM 114 C ALA A 9 -10.083 -10.101 13.094 1.00 70.22 C ATOM 115 O ALA A 9 -9.892 -9.203 13.914 1.00 54.23 O ATOM 116 CB ALA A 9 -12.373 -10.767 12.340 1.00 30.30 C ATOM 0 H ALA A 9 -11.236 -10.930 10.150 1.00 34.11 H new ATOM 0 HA ALA A 9 -11.412 -8.897 11.944 1.00 54.04 H new ATOM 0 HB1 ALA A 9 -12.758 -10.458 13.312 1.00 30.30 H new ATOM 0 HB2 ALA A 9 -13.136 -10.604 11.579 1.00 30.30 H new ATOM 0 HB3 ALA A 9 -12.113 -11.825 12.373 1.00 30.30 H new ATOM 122 N ASP A 10 -9.403 -11.242 13.100 1.00 33.51 N ATOM 123 CA ASP A 10 -8.369 -11.511 14.093 1.00 75.21 C ATOM 124 C ASP A 10 -7.419 -12.601 13.607 1.00 51.25 C ATOM 125 O ASP A 10 -7.276 -13.644 14.244 1.00 14.54 O ATOM 126 CB ASP A 10 -9.004 -11.926 15.421 1.00 23.04 C ATOM 127 CG ASP A 10 -9.536 -10.742 16.204 1.00 51.43 C ATOM 128 OD1 ASP A 10 -8.748 -10.118 16.944 1.00 10.34 O ATOM 129 OD2 ASP A 10 -10.741 -10.439 16.076 1.00 52.02 O ATOM 0 H ASP A 10 -9.549 -11.996 12.428 1.00 33.51 H new ATOM 0 HA ASP A 10 -7.796 -10.596 14.243 1.00 75.21 H new ATOM 0 HB2 ASP A 10 -9.818 -12.625 15.228 1.00 23.04 H new ATOM 0 HB3 ASP A 10 -8.265 -12.454 16.024 1.00 23.04 H new ATOM 134 N MET A 11 -6.772 -12.352 12.473 1.00 53.25 N ATOM 135 CA MET A 11 -5.835 -13.312 11.901 1.00 74.11 C ATOM 136 C MET A 11 -5.006 -12.669 10.794 1.00 61.43 C ATOM 137 O MET A 11 -5.371 -11.622 10.258 1.00 71.42 O ATOM 138 CB MET A 11 -6.588 -14.526 11.352 1.00 45.25 C ATOM 139 CG MET A 11 -5.688 -15.715 11.056 1.00 34.43 C ATOM 140 SD MET A 11 -6.614 -17.176 10.545 1.00 52.43 S ATOM 141 CE MET A 11 -7.523 -16.527 9.144 1.00 11.23 C ATOM 0 H MET A 11 -6.879 -11.494 11.932 1.00 53.25 H new ATOM 0 HA MET A 11 -5.160 -13.639 12.692 1.00 74.11 H new ATOM 0 HB2 MET A 11 -7.349 -14.827 12.071 1.00 45.25 H new ATOM 0 HB3 MET A 11 -7.109 -14.238 10.439 1.00 45.25 H new ATOM 0 HG2 MET A 11 -4.981 -15.445 10.271 1.00 34.43 H new ATOM 0 HG3 MET A 11 -5.103 -15.953 11.944 1.00 34.43 H new ATOM 0 HE1 MET A 11 -7.670 -17.317 8.408 1.00 11.23 H new ATOM 0 HE2 MET A 11 -8.492 -16.158 9.479 1.00 11.23 H new ATOM 0 HE3 MET A 11 -6.960 -15.710 8.692 1.00 11.23 H new ATOM 151 N THR A 12 -3.887 -13.302 10.455 1.00 20.40 N ATOM 152 CA THR A 12 -3.005 -12.792 9.413 1.00 13.41 C ATOM 153 C THR A 12 -2.738 -13.852 8.351 1.00 41.54 C ATOM 154 O THR A 12 -1.938 -14.764 8.557 1.00 22.12 O ATOM 155 CB THR A 12 -1.662 -12.316 9.997 1.00 24.33 C ATOM 156 OG1 THR A 12 -1.868 -11.732 11.288 1.00 20.03 O ATOM 157 CG2 THR A 12 -0.999 -11.303 9.076 1.00 14.34 C ATOM 0 H THR A 12 -3.570 -14.170 10.888 1.00 20.40 H new ATOM 0 HA THR A 12 -3.514 -11.944 8.955 1.00 13.41 H new ATOM 0 HB THR A 12 -1.006 -13.181 10.091 1.00 24.33 H new ATOM 0 HG1 THR A 12 -1.009 -11.434 11.653 1.00 20.03 H new ATOM 0 HG21 THR A 12 -0.052 -10.982 9.510 1.00 14.34 H new ATOM 0 HG22 THR A 12 -0.816 -11.760 8.104 1.00 14.34 H new ATOM 0 HG23 THR A 12 -1.653 -10.440 8.953 1.00 14.34 H new ATOM 165 N VAL A 13 -3.412 -13.725 7.212 1.00 12.11 N ATOM 166 CA VAL A 13 -3.246 -14.671 6.116 1.00 62.53 C ATOM 167 C VAL A 13 -2.193 -14.186 5.126 1.00 64.41 C ATOM 168 O VAL A 13 -2.158 -13.009 4.768 1.00 4.24 O ATOM 169 CB VAL A 13 -4.572 -14.901 5.366 1.00 23.02 C ATOM 170 CG1 VAL A 13 -4.365 -15.844 4.191 1.00 45.23 C ATOM 171 CG2 VAL A 13 -5.632 -15.442 6.314 1.00 50.24 C ATOM 0 H VAL A 13 -4.078 -12.976 7.025 1.00 12.11 H new ATOM 0 HA VAL A 13 -2.919 -15.612 6.558 1.00 62.53 H new ATOM 0 HB VAL A 13 -4.919 -13.944 4.976 1.00 23.02 H new ATOM 0 HG11 VAL A 13 -5.313 -15.994 3.674 1.00 45.23 H new ATOM 0 HG12 VAL A 13 -3.640 -15.412 3.501 1.00 45.23 H new ATOM 0 HG13 VAL A 13 -3.994 -16.802 4.555 1.00 45.23 H new ATOM 0 HG21 VAL A 13 -6.562 -15.599 5.768 1.00 50.24 H new ATOM 0 HG22 VAL A 13 -5.294 -16.389 6.735 1.00 50.24 H new ATOM 0 HG23 VAL A 13 -5.800 -14.726 7.119 1.00 50.24 H new ATOM 181 N ASP A 14 -1.336 -15.102 4.686 1.00 10.44 N ATOM 182 CA ASP A 14 -0.282 -14.768 3.736 1.00 43.13 C ATOM 183 C ASP A 14 -0.587 -15.350 2.359 1.00 21.22 C ATOM 184 O ASP A 14 -0.784 -16.556 2.215 1.00 61.34 O ATOM 185 CB ASP A 14 1.068 -15.287 4.235 1.00 34.00 C ATOM 186 CG ASP A 14 2.119 -14.196 4.302 1.00 34.52 C ATOM 187 OD1 ASP A 14 2.070 -13.273 3.463 1.00 74.41 O ATOM 188 OD2 ASP A 14 2.991 -14.267 5.194 1.00 54.53 O ATOM 0 H ASP A 14 -1.351 -16.081 4.972 1.00 10.44 H new ATOM 0 HA ASP A 14 -0.236 -13.682 3.650 1.00 43.13 H new ATOM 0 HB2 ASP A 14 0.942 -15.727 5.224 1.00 34.00 H new ATOM 0 HB3 ASP A 14 1.415 -16.082 3.575 1.00 34.00 H new ATOM 193 N MET A 15 -0.625 -14.485 1.351 1.00 14.44 N ATOM 194 CA MET A 15 -0.907 -14.914 -0.014 1.00 2.33 C ATOM 195 C MET A 15 0.358 -15.428 -0.694 1.00 2.14 C ATOM 196 O MET A 15 0.297 -16.035 -1.763 1.00 3.40 O ATOM 197 CB MET A 15 -1.501 -13.758 -0.822 1.00 23.51 C ATOM 198 CG MET A 15 -0.482 -12.697 -1.203 1.00 1.40 C ATOM 199 SD MET A 15 -1.191 -11.386 -2.219 1.00 31.52 S ATOM 200 CE MET A 15 -1.121 -12.141 -3.842 1.00 11.03 C ATOM 0 H MET A 15 -0.464 -13.483 1.454 1.00 14.44 H new ATOM 0 HA MET A 15 -1.631 -15.727 0.029 1.00 2.33 H new ATOM 0 HB2 MET A 15 -1.956 -14.156 -1.729 1.00 23.51 H new ATOM 0 HB3 MET A 15 -2.299 -13.293 -0.243 1.00 23.51 H new ATOM 0 HG2 MET A 15 -0.061 -12.262 -0.297 1.00 1.40 H new ATOM 0 HG3 MET A 15 0.340 -13.166 -1.744 1.00 1.40 H new ATOM 0 HE1 MET A 15 -1.526 -11.451 -4.582 1.00 11.03 H new ATOM 0 HE2 MET A 15 -0.086 -12.374 -4.091 1.00 11.03 H new ATOM 0 HE3 MET A 15 -1.709 -13.059 -3.842 1.00 11.03 H new ATOM 210 N VAL A 16 1.504 -15.181 -0.066 1.00 40.15 N ATOM 211 CA VAL A 16 2.783 -15.620 -0.611 1.00 4.32 C ATOM 212 C VAL A 16 3.344 -16.795 0.182 1.00 72.21 C ATOM 213 O VAL A 16 4.008 -17.671 -0.373 1.00 33.11 O ATOM 214 CB VAL A 16 3.815 -14.476 -0.611 1.00 22.22 C ATOM 215 CG1 VAL A 16 3.453 -13.430 -1.653 1.00 53.43 C ATOM 216 CG2 VAL A 16 3.916 -13.850 0.772 1.00 24.51 C ATOM 0 H VAL A 16 1.572 -14.680 0.820 1.00 40.15 H new ATOM 0 HA VAL A 16 2.598 -15.934 -1.638 1.00 4.32 H new ATOM 0 HB VAL A 16 4.790 -14.889 -0.870 1.00 22.22 H new ATOM 0 HG11 VAL A 16 4.193 -12.630 -1.638 1.00 53.43 H new ATOM 0 HG12 VAL A 16 3.437 -13.891 -2.641 1.00 53.43 H new ATOM 0 HG13 VAL A 16 2.469 -13.018 -1.428 1.00 53.43 H new ATOM 0 HG21 VAL A 16 4.649 -13.044 0.754 1.00 24.51 H new ATOM 0 HG22 VAL A 16 2.944 -13.450 1.062 1.00 24.51 H new ATOM 0 HG23 VAL A 16 4.227 -14.607 1.492 1.00 24.51 H new ATOM 226 N ARG A 17 3.072 -16.808 1.483 1.00 74.13 N ATOM 227 CA ARG A 17 3.549 -17.876 2.353 1.00 62.03 C ATOM 228 C ARG A 17 2.451 -18.906 2.603 1.00 42.42 C ATOM 229 O ARG A 17 2.724 -20.027 3.031 1.00 0.04 O ATOM 230 CB ARG A 17 4.035 -17.299 3.684 1.00 63.53 C ATOM 231 CG ARG A 17 5.278 -16.434 3.555 1.00 24.40 C ATOM 232 CD ARG A 17 6.197 -16.596 4.756 1.00 33.53 C ATOM 233 NE ARG A 17 5.577 -16.114 5.988 1.00 44.33 N ATOM 234 CZ ARG A 17 6.243 -15.933 7.123 1.00 52.40 C ATOM 235 NH1 ARG A 17 7.542 -16.193 7.183 1.00 54.43 N ATOM 236 NH2 ARG A 17 5.609 -15.490 8.202 1.00 61.25 N ATOM 0 H ARG A 17 2.524 -16.091 1.958 1.00 74.13 H new ATOM 0 HA ARG A 17 4.381 -18.372 1.854 1.00 62.03 H new ATOM 0 HB2 ARG A 17 3.235 -16.706 4.127 1.00 63.53 H new ATOM 0 HB3 ARG A 17 4.243 -18.119 4.371 1.00 63.53 H new ATOM 0 HG2 ARG A 17 5.816 -16.701 2.645 1.00 24.40 H new ATOM 0 HG3 ARG A 17 4.986 -15.388 3.457 1.00 24.40 H new ATOM 0 HD2 ARG A 17 6.462 -17.647 4.871 1.00 33.53 H new ATOM 0 HD3 ARG A 17 7.124 -16.051 4.579 1.00 33.53 H new ATOM 0 HE ARG A 17 4.579 -15.905 5.976 1.00 44.33 H new ATOM 0 HH11 ARG A 17 8.033 -16.533 6.356 1.00 54.43 H new ATOM 0 HH12 ARG A 17 8.050 -16.053 8.056 1.00 54.43 H new ATOM 0 HH21 ARG A 17 4.610 -15.288 8.160 1.00 61.25 H new ATOM 0 HH22 ARG A 17 6.121 -15.351 9.073 1.00 61.25 H new ATOM 250 N ARG A 18 1.210 -18.516 2.333 1.00 75.33 N ATOM 251 CA ARG A 18 0.070 -19.405 2.530 1.00 4.50 C ATOM 252 C ARG A 18 -0.001 -19.884 3.977 1.00 51.30 C ATOM 253 O ARG A 18 -0.043 -21.085 4.244 1.00 72.33 O ATOM 254 CB ARG A 18 0.164 -20.606 1.588 1.00 40.03 C ATOM 255 CG ARG A 18 -0.303 -20.308 0.172 1.00 4.33 C ATOM 256 CD ARG A 18 0.710 -19.459 -0.581 1.00 12.12 C ATOM 257 NE ARG A 18 0.532 -19.550 -2.028 1.00 23.25 N ATOM 258 CZ ARG A 18 0.826 -20.634 -2.737 1.00 63.10 C ATOM 259 NH1 ARG A 18 1.309 -21.713 -2.136 1.00 40.13 N ATOM 260 NH2 ARG A 18 0.637 -20.640 -4.050 1.00 60.34 N ATOM 0 H ARG A 18 0.968 -17.591 1.977 1.00 75.33 H new ATOM 0 HA ARG A 18 -0.838 -18.846 2.305 1.00 4.50 H new ATOM 0 HB2 ARG A 18 1.197 -20.951 1.556 1.00 40.03 H new ATOM 0 HB3 ARG A 18 -0.433 -21.423 1.994 1.00 40.03 H new ATOM 0 HG2 ARG A 18 -0.465 -21.243 -0.363 1.00 4.33 H new ATOM 0 HG3 ARG A 18 -1.261 -19.789 0.205 1.00 4.33 H new ATOM 0 HD2 ARG A 18 0.615 -18.419 -0.269 1.00 12.12 H new ATOM 0 HD3 ARG A 18 1.718 -19.780 -0.319 1.00 12.12 H new ATOM 0 HE ARG A 18 0.162 -18.737 -2.521 1.00 23.25 H new ATOM 0 HH11 ARG A 18 1.456 -21.712 -1.127 1.00 40.13 H new ATOM 0 HH12 ARG A 18 1.534 -22.544 -2.683 1.00 40.13 H new ATOM 0 HH21 ARG A 18 0.266 -19.812 -4.516 1.00 60.34 H new ATOM 0 HH22 ARG A 18 0.863 -21.473 -4.594 1.00 60.34 H new ATOM 274 N THR A 19 -0.014 -18.936 4.909 1.00 1.21 N ATOM 275 CA THR A 19 -0.078 -19.260 6.328 1.00 35.34 C ATOM 276 C THR A 19 -1.190 -18.480 7.021 1.00 43.21 C ATOM 277 O THR A 19 -1.835 -17.627 6.412 1.00 54.40 O ATOM 278 CB THR A 19 1.258 -18.964 7.034 1.00 43.51 C ATOM 279 OG1 THR A 19 1.413 -17.552 7.217 1.00 50.35 O ATOM 280 CG2 THR A 19 2.428 -19.507 6.227 1.00 1.24 C ATOM 0 H THR A 19 0.019 -17.937 4.706 1.00 1.21 H new ATOM 0 HA THR A 19 -0.288 -20.327 6.398 1.00 35.34 H new ATOM 0 HB THR A 19 1.247 -19.457 8.006 1.00 43.51 H new ATOM 0 HG1 THR A 19 2.264 -17.372 7.668 1.00 50.35 H new ATOM 0 HG21 THR A 19 3.361 -19.286 6.745 1.00 1.24 H new ATOM 0 HG22 THR A 19 2.322 -20.586 6.114 1.00 1.24 H new ATOM 0 HG23 THR A 19 2.440 -19.038 5.243 1.00 1.24 H new ATOM 288 N VAL A 20 -1.408 -18.777 8.298 1.00 2.32 N ATOM 289 CA VAL A 20 -2.441 -18.101 9.075 1.00 44.05 C ATOM 290 C VAL A 20 -1.984 -17.868 10.510 1.00 13.53 C ATOM 291 O VAL A 20 -1.710 -18.815 11.247 1.00 61.41 O ATOM 292 CB VAL A 20 -3.751 -18.910 9.089 1.00 12.11 C ATOM 293 CG1 VAL A 20 -4.598 -18.577 7.870 1.00 63.21 C ATOM 294 CG2 VAL A 20 -3.456 -20.401 9.153 1.00 40.22 C ATOM 0 H VAL A 20 -0.883 -19.481 8.817 1.00 2.32 H new ATOM 0 HA VAL A 20 -2.622 -17.140 8.594 1.00 44.05 H new ATOM 0 HB VAL A 20 -4.317 -18.637 9.980 1.00 12.11 H new ATOM 0 HG11 VAL A 20 -5.520 -19.158 7.897 1.00 63.21 H new ATOM 0 HG12 VAL A 20 -4.839 -17.514 7.874 1.00 63.21 H new ATOM 0 HG13 VAL A 20 -4.043 -18.820 6.964 1.00 63.21 H new ATOM 0 HG21 VAL A 20 -4.393 -20.957 9.162 1.00 40.22 H new ATOM 0 HG22 VAL A 20 -2.869 -20.693 8.282 1.00 40.22 H new ATOM 0 HG23 VAL A 20 -2.894 -20.622 10.060 1.00 40.22 H new ATOM 304 N ILE A 21 -1.906 -16.600 10.902 1.00 62.24 N ATOM 305 CA ILE A 21 -1.484 -16.242 12.250 1.00 33.33 C ATOM 306 C ILE A 21 -2.635 -15.631 13.042 1.00 34.21 C ATOM 307 O ILE A 21 -3.060 -14.507 12.773 1.00 65.30 O ATOM 308 CB ILE A 21 -0.308 -15.249 12.227 1.00 5.03 C ATOM 309 CG1 ILE A 21 0.929 -15.904 11.609 1.00 23.12 C ATOM 310 CG2 ILE A 21 -0.005 -14.754 13.634 1.00 64.23 C ATOM 311 CD1 ILE A 21 0.945 -15.859 10.097 1.00 4.54 C ATOM 0 H ILE A 21 -2.130 -15.804 10.305 1.00 62.24 H new ATOM 0 HA ILE A 21 -1.161 -17.163 12.734 1.00 33.33 H new ATOM 0 HB ILE A 21 -0.587 -14.392 11.614 1.00 5.03 H new ATOM 0 HG12 ILE A 21 1.821 -15.407 11.989 1.00 23.12 H new ATOM 0 HG13 ILE A 21 0.981 -16.943 11.934 1.00 23.12 H new ATOM 0 HG21 ILE A 21 0.829 -14.053 13.601 1.00 64.23 H new ATOM 0 HG22 ILE A 21 -0.884 -14.254 14.041 1.00 64.23 H new ATOM 0 HG23 ILE A 21 0.257 -15.600 14.269 1.00 64.23 H new ATOM 0 HD11 ILE A 21 1.850 -16.341 9.728 1.00 4.54 H new ATOM 0 HD12 ILE A 21 0.071 -16.382 9.708 1.00 4.54 H new ATOM 0 HD13 ILE A 21 0.925 -14.821 9.764 1.00 4.54 H new ATOM 323 N ARG A 22 -3.136 -16.379 14.021 1.00 45.53 N ATOM 324 CA ARG A 22 -4.237 -15.910 14.853 1.00 73.23 C ATOM 325 C ARG A 22 -3.722 -15.368 16.183 1.00 60.13 C ATOM 326 O ARG A 22 -3.091 -16.089 16.955 1.00 2.15 O ATOM 327 CB ARG A 22 -5.233 -17.044 15.103 1.00 21.44 C ATOM 328 CG ARG A 22 -5.984 -17.482 13.857 1.00 71.14 C ATOM 329 CD ARG A 22 -6.865 -18.691 14.132 1.00 4.14 C ATOM 330 NE ARG A 22 -7.114 -19.473 12.925 1.00 54.04 N ATOM 331 CZ ARG A 22 -8.143 -20.302 12.786 1.00 61.23 C ATOM 332 NH1 ARG A 22 -9.013 -20.456 13.774 1.00 0.12 N ATOM 333 NH2 ARG A 22 -8.303 -20.979 11.656 1.00 61.22 N ATOM 0 H ARG A 22 -2.797 -17.312 14.257 1.00 45.53 H new ATOM 0 HA ARG A 22 -4.741 -15.102 14.323 1.00 73.23 H new ATOM 0 HB2 ARG A 22 -4.699 -17.900 15.515 1.00 21.44 H new ATOM 0 HB3 ARG A 22 -5.953 -16.724 15.857 1.00 21.44 H new ATOM 0 HG2 ARG A 22 -6.598 -16.658 13.493 1.00 71.14 H new ATOM 0 HG3 ARG A 22 -5.272 -17.722 13.067 1.00 71.14 H new ATOM 0 HD2 ARG A 22 -6.389 -19.323 14.882 1.00 4.14 H new ATOM 0 HD3 ARG A 22 -7.815 -18.359 14.551 1.00 4.14 H new ATOM 0 HE ARG A 22 -6.463 -19.378 12.146 1.00 54.04 H new ATOM 0 HH11 ARG A 22 -8.894 -19.937 14.644 1.00 0.12 H new ATOM 0 HH12 ARG A 22 -9.802 -21.093 13.664 1.00 0.12 H new ATOM 0 HH21 ARG A 22 -7.636 -20.863 10.893 1.00 61.22 H new ATOM 0 HH22 ARG A 22 -9.093 -21.615 11.550 1.00 61.22 H new ATOM 347 N SER A 23 -3.995 -14.093 16.442 1.00 33.51 N ATOM 348 CA SER A 23 -3.556 -13.453 17.676 1.00 23.33 C ATOM 349 C SER A 23 -2.045 -13.583 17.847 1.00 12.33 C ATOM 350 O SER A 23 -1.533 -13.575 18.966 1.00 42.23 O ATOM 351 CB SER A 23 -4.271 -14.071 18.879 1.00 33.21 C ATOM 352 OG SER A 23 -4.449 -13.117 19.912 1.00 21.51 O ATOM 0 H SER A 23 -4.518 -13.483 15.814 1.00 33.51 H new ATOM 0 HA SER A 23 -3.809 -12.394 17.617 1.00 23.33 H new ATOM 0 HB2 SER A 23 -5.240 -14.461 18.569 1.00 33.21 H new ATOM 0 HB3 SER A 23 -3.693 -14.915 19.255 1.00 33.21 H new ATOM 0 HG SER A 23 -4.909 -13.536 20.669 1.00 21.51 H new ATOM 358 N GLY A 24 -1.337 -13.702 16.728 1.00 12.11 N ATOM 359 CA GLY A 24 0.107 -13.832 16.775 1.00 45.45 C ATOM 360 C GLY A 24 0.555 -15.270 16.941 1.00 24.10 C ATOM 361 O GLY A 24 1.713 -15.535 17.265 1.00 3.43 O ATOM 0 H GLY A 24 -1.738 -13.711 15.790 1.00 12.11 H new ATOM 0 HA2 GLY A 24 0.535 -13.425 15.859 1.00 45.45 H new ATOM 0 HA3 GLY A 24 0.496 -13.236 17.601 1.00 45.45 H new ATOM 365 N LYS A 25 -0.364 -16.204 16.721 1.00 50.35 N ATOM 366 CA LYS A 25 -0.059 -17.624 16.848 1.00 11.21 C ATOM 367 C LYS A 25 -0.425 -18.376 15.572 1.00 13.35 C ATOM 368 O LYS A 25 -1.600 -18.492 15.223 1.00 12.42 O ATOM 369 CB LYS A 25 -0.810 -18.223 18.039 1.00 14.23 C ATOM 370 CG LYS A 25 -0.335 -17.700 19.384 1.00 42.34 C ATOM 371 CD LYS A 25 -1.143 -16.493 19.830 1.00 43.53 C ATOM 372 CE LYS A 25 -0.346 -15.608 20.776 1.00 10.32 C ATOM 373 NZ LYS A 25 -1.231 -14.844 21.698 1.00 12.52 N ATOM 0 H LYS A 25 -1.327 -16.003 16.454 1.00 50.35 H new ATOM 0 HA LYS A 25 1.013 -17.726 17.014 1.00 11.21 H new ATOM 0 HB2 LYS A 25 -1.874 -18.010 17.931 1.00 14.23 H new ATOM 0 HB3 LYS A 25 -0.698 -19.307 18.020 1.00 14.23 H new ATOM 0 HG2 LYS A 25 -0.416 -18.489 20.131 1.00 42.34 H new ATOM 0 HG3 LYS A 25 0.719 -17.429 19.319 1.00 42.34 H new ATOM 0 HD2 LYS A 25 -1.446 -15.914 18.958 1.00 43.53 H new ATOM 0 HD3 LYS A 25 -2.055 -16.827 20.324 1.00 43.53 H new ATOM 0 HE2 LYS A 25 0.340 -16.224 21.358 1.00 10.32 H new ATOM 0 HE3 LYS A 25 0.262 -14.913 20.197 1.00 10.32 H new ATOM 0 HZ1 LYS A 25 -0.656 -14.401 22.443 1.00 12.52 H new ATOM 0 HZ2 LYS A 25 -1.735 -14.107 21.164 1.00 12.52 H new ATOM 0 HZ3 LYS A 25 -1.921 -15.490 22.132 1.00 12.52 H new ATOM 387 N LYS A 26 0.588 -18.886 14.881 1.00 74.43 N ATOM 388 CA LYS A 26 0.373 -19.630 13.645 1.00 41.00 C ATOM 389 C LYS A 26 -0.313 -20.963 13.924 1.00 21.45 C ATOM 390 O LYS A 26 0.181 -21.773 14.710 1.00 71.23 O ATOM 391 CB LYS A 26 1.706 -19.870 12.932 1.00 53.52 C ATOM 392 CG LYS A 26 1.567 -20.626 11.622 1.00 42.53 C ATOM 393 CD LYS A 26 2.923 -20.914 10.998 1.00 35.24 C ATOM 394 CE LYS A 26 3.449 -19.713 10.228 1.00 72.12 C ATOM 395 NZ LYS A 26 4.837 -19.934 9.737 1.00 62.24 N ATOM 0 H LYS A 26 1.566 -18.798 15.155 1.00 74.43 H new ATOM 0 HA LYS A 26 -0.275 -19.036 13.001 1.00 41.00 H new ATOM 0 HB2 LYS A 26 2.183 -18.909 12.739 1.00 53.52 H new ATOM 0 HB3 LYS A 26 2.368 -20.427 13.595 1.00 53.52 H new ATOM 0 HG2 LYS A 26 1.039 -21.564 11.796 1.00 42.53 H new ATOM 0 HG3 LYS A 26 0.962 -20.044 10.927 1.00 42.53 H new ATOM 0 HD2 LYS A 26 3.633 -21.186 11.779 1.00 35.24 H new ATOM 0 HD3 LYS A 26 2.842 -21.770 10.328 1.00 35.24 H new ATOM 0 HE2 LYS A 26 2.793 -19.508 9.382 1.00 72.12 H new ATOM 0 HE3 LYS A 26 3.427 -18.832 10.869 1.00 72.12 H new ATOM 0 HZ1 LYS A 26 5.159 -19.093 9.217 1.00 62.24 H new ATOM 0 HZ2 LYS A 26 5.468 -20.104 10.546 1.00 62.24 H new ATOM 0 HZ3 LYS A 26 4.854 -20.759 9.104 1.00 62.24 H new ATOM 409 N ILE A 27 -1.451 -21.185 13.276 1.00 35.15 N ATOM 410 CA ILE A 27 -2.203 -22.422 13.454 1.00 3.51 C ATOM 411 C ILE A 27 -1.648 -23.534 12.571 1.00 44.33 C ATOM 412 O ILE A 27 -1.208 -23.288 11.447 1.00 53.22 O ATOM 413 CB ILE A 27 -3.696 -22.224 13.134 1.00 51.13 C ATOM 414 CG1 ILE A 27 -4.294 -21.141 14.034 1.00 32.11 C ATOM 415 CG2 ILE A 27 -4.451 -23.534 13.299 1.00 71.42 C ATOM 416 CD1 ILE A 27 -4.321 -21.520 15.498 1.00 13.34 C ATOM 0 H ILE A 27 -1.873 -20.525 12.623 1.00 35.15 H new ATOM 0 HA ILE A 27 -2.099 -22.707 14.501 1.00 3.51 H new ATOM 0 HB ILE A 27 -3.790 -21.901 12.097 1.00 51.13 H new ATOM 0 HG12 ILE A 27 -3.719 -20.223 13.915 1.00 32.11 H new ATOM 0 HG13 ILE A 27 -5.310 -20.926 13.704 1.00 32.11 H new ATOM 0 HG21 ILE A 27 -5.505 -23.378 13.069 1.00 71.42 H new ATOM 0 HG22 ILE A 27 -4.038 -24.280 12.620 1.00 71.42 H new ATOM 0 HG23 ILE A 27 -4.352 -23.884 14.326 1.00 71.42 H new ATOM 0 HD11 ILE A 27 -4.757 -20.706 16.077 1.00 13.34 H new ATOM 0 HD12 ILE A 27 -4.920 -22.421 15.630 1.00 13.34 H new ATOM 0 HD13 ILE A 27 -3.304 -21.707 15.844 1.00 13.34 H new ATOM 428 N HIS A 28 -1.672 -24.759 13.086 1.00 51.14 N ATOM 429 CA HIS A 28 -1.173 -25.911 12.342 1.00 14.34 C ATOM 430 C HIS A 28 -2.325 -26.701 11.728 1.00 41.31 C ATOM 431 O HIS A 28 -3.416 -26.771 12.295 1.00 21.24 O ATOM 432 CB HIS A 28 -0.349 -26.817 13.257 1.00 11.35 C ATOM 433 CG HIS A 28 0.473 -27.826 12.518 1.00 65.34 C ATOM 434 ND1 HIS A 28 1.754 -27.574 12.074 1.00 44.11 N ATOM 435 CD2 HIS A 28 0.191 -29.097 12.146 1.00 45.24 C ATOM 436 CE1 HIS A 28 2.224 -28.645 11.459 1.00 1.14 C ATOM 437 NE2 HIS A 28 1.295 -29.584 11.490 1.00 43.55 N ATOM 0 H HIS A 28 -2.031 -24.980 14.015 1.00 51.14 H new ATOM 0 HA HIS A 28 -0.536 -25.545 11.537 1.00 14.34 H new ATOM 0 HB2 HIS A 28 0.311 -26.200 13.867 1.00 11.35 H new ATOM 0 HB3 HIS A 28 -1.021 -27.337 13.940 1.00 11.35 H new ATOM 0 HD2 HIS A 28 -0.731 -29.629 12.331 1.00 45.24 H new ATOM 0 HE1 HIS A 28 3.201 -28.737 11.008 1.00 1.14 H new ATOM 0 HE2 HIS A 28 1.383 -30.519 11.091 1.00 43.55 H new ATOM 445 N LEU A 29 -2.076 -27.293 10.565 1.00 5.31 N ATOM 446 CA LEU A 29 -3.092 -28.078 9.873 1.00 43.54 C ATOM 447 C LEU A 29 -2.458 -29.231 9.102 1.00 25.22 C ATOM 448 O LEU A 29 -1.238 -29.401 9.109 1.00 22.32 O ATOM 449 CB LEU A 29 -3.888 -27.187 8.917 1.00 61.54 C ATOM 450 CG LEU A 29 -3.094 -26.097 8.197 1.00 62.04 C ATOM 451 CD1 LEU A 29 -1.977 -26.710 7.365 1.00 35.25 C ATOM 452 CD2 LEU A 29 -4.013 -25.257 7.322 1.00 72.54 C ATOM 0 H LEU A 29 -1.179 -27.244 10.081 1.00 5.31 H new ATOM 0 HA LEU A 29 -3.767 -28.494 10.621 1.00 43.54 H new ATOM 0 HB2 LEU A 29 -4.357 -27.823 8.166 1.00 61.54 H new ATOM 0 HB3 LEU A 29 -4.691 -26.712 9.480 1.00 61.54 H new ATOM 0 HG LEU A 29 -2.645 -25.447 8.948 1.00 62.04 H new ATOM 0 HD11 LEU A 29 -1.423 -25.919 6.860 1.00 35.25 H new ATOM 0 HD12 LEU A 29 -1.303 -27.267 8.015 1.00 35.25 H new ATOM 0 HD13 LEU A 29 -2.404 -27.384 6.623 1.00 35.25 H new ATOM 0 HD21 LEU A 29 -3.430 -24.486 6.817 1.00 72.54 H new ATOM 0 HD22 LEU A 29 -4.491 -25.895 6.579 1.00 72.54 H new ATOM 0 HD23 LEU A 29 -4.776 -24.787 7.942 1.00 72.54 H new ATOM 464 N THR A 30 -3.293 -30.022 8.436 1.00 54.52 N ATOM 465 CA THR A 30 -2.815 -31.158 7.659 1.00 31.33 C ATOM 466 C THR A 30 -2.836 -30.852 6.166 1.00 4.02 C ATOM 467 O THR A 30 -3.202 -29.753 5.753 1.00 12.31 O ATOM 468 CB THR A 30 -3.663 -32.417 7.925 1.00 3.23 C ATOM 469 OG1 THR A 30 -3.010 -33.570 7.383 1.00 74.33 O ATOM 470 CG2 THR A 30 -5.048 -32.276 7.312 1.00 2.23 C ATOM 0 H THR A 30 -4.305 -29.896 8.419 1.00 54.52 H new ATOM 0 HA THR A 30 -1.789 -31.346 7.974 1.00 31.33 H new ATOM 0 HB THR A 30 -3.771 -32.535 9.003 1.00 3.23 H new ATOM 0 HG1 THR A 30 -3.554 -34.366 7.557 1.00 74.33 H new ATOM 0 HG21 THR A 30 -5.628 -33.177 7.513 1.00 2.23 H new ATOM 0 HG22 THR A 30 -5.553 -31.414 7.748 1.00 2.23 H new ATOM 0 HG23 THR A 30 -4.957 -32.136 6.235 1.00 2.23 H new ATOM 478 N GLY A 31 -2.440 -31.832 5.360 1.00 62.41 N ATOM 479 CA GLY A 31 -2.421 -31.647 3.921 1.00 70.34 C ATOM 480 C GLY A 31 -3.777 -31.252 3.369 1.00 24.42 C ATOM 481 O GLY A 31 -3.899 -30.256 2.657 1.00 55.41 O ATOM 0 H GLY A 31 -2.132 -32.751 5.678 1.00 62.41 H new ATOM 0 HA2 GLY A 31 -1.691 -30.879 3.666 1.00 70.34 H new ATOM 0 HA3 GLY A 31 -2.093 -32.570 3.443 1.00 70.34 H new ATOM 485 N LYS A 32 -4.798 -32.036 3.697 1.00 71.31 N ATOM 486 CA LYS A 32 -6.152 -31.765 3.230 1.00 53.42 C ATOM 487 C LYS A 32 -6.611 -30.377 3.667 1.00 24.14 C ATOM 488 O LYS A 32 -7.041 -29.569 2.846 1.00 53.32 O ATOM 489 CB LYS A 32 -7.120 -32.824 3.762 1.00 23.31 C ATOM 490 CG LYS A 32 -6.800 -34.232 3.289 1.00 54.22 C ATOM 491 CD LYS A 32 -7.916 -35.203 3.636 1.00 72.24 C ATOM 492 CE LYS A 32 -9.106 -35.042 2.702 1.00 41.12 C ATOM 493 NZ LYS A 32 -8.920 -35.795 1.431 1.00 63.51 N ATOM 0 H LYS A 32 -4.713 -32.865 4.285 1.00 71.31 H new ATOM 0 HA LYS A 32 -6.147 -31.801 2.141 1.00 53.42 H new ATOM 0 HB2 LYS A 32 -7.105 -32.803 4.852 1.00 23.31 H new ATOM 0 HB3 LYS A 32 -8.133 -32.567 3.452 1.00 23.31 H new ATOM 0 HG2 LYS A 32 -6.642 -34.228 2.210 1.00 54.22 H new ATOM 0 HG3 LYS A 32 -5.869 -34.568 3.746 1.00 54.22 H new ATOM 0 HD2 LYS A 32 -7.542 -36.225 3.577 1.00 72.24 H new ATOM 0 HD3 LYS A 32 -8.235 -35.039 4.665 1.00 72.24 H new ATOM 0 HE2 LYS A 32 -10.010 -35.391 3.202 1.00 41.12 H new ATOM 0 HE3 LYS A 32 -9.253 -33.985 2.480 1.00 41.12 H new ATOM 0 HZ1 LYS A 32 -9.752 -35.660 0.822 1.00 63.51 H new ATOM 0 HZ2 LYS A 32 -8.072 -35.445 0.941 1.00 63.51 H new ATOM 0 HZ3 LYS A 32 -8.806 -36.807 1.641 1.00 63.51 H new ATOM 507 N GLU A 33 -6.513 -30.109 4.966 1.00 53.33 N ATOM 508 CA GLU A 33 -6.918 -28.818 5.511 1.00 62.03 C ATOM 509 C GLU A 33 -6.137 -27.682 4.856 1.00 72.14 C ATOM 510 O GLU A 33 -6.667 -26.591 4.644 1.00 35.20 O ATOM 511 CB GLU A 33 -6.706 -28.790 7.026 1.00 45.03 C ATOM 512 CG GLU A 33 -7.561 -29.795 7.779 1.00 51.31 C ATOM 513 CD GLU A 33 -7.218 -29.863 9.254 1.00 13.34 C ATOM 514 OE1 GLU A 33 -6.947 -28.799 9.849 1.00 1.44 O ATOM 515 OE2 GLU A 33 -7.221 -30.979 9.814 1.00 50.01 O ATOM 0 H GLU A 33 -6.157 -30.767 5.659 1.00 53.33 H new ATOM 0 HA GLU A 33 -7.978 -28.678 5.297 1.00 62.03 H new ATOM 0 HB2 GLU A 33 -5.656 -28.986 7.241 1.00 45.03 H new ATOM 0 HB3 GLU A 33 -6.926 -27.789 7.397 1.00 45.03 H new ATOM 0 HG2 GLU A 33 -8.612 -29.529 7.666 1.00 51.31 H new ATOM 0 HG3 GLU A 33 -7.432 -30.782 7.334 1.00 51.31 H new ATOM 522 N TYR A 34 -4.875 -27.946 4.538 1.00 61.44 N ATOM 523 CA TYR A 34 -4.020 -26.946 3.910 1.00 65.55 C ATOM 524 C TYR A 34 -4.485 -26.647 2.488 1.00 63.13 C ATOM 525 O TYR A 34 -4.406 -25.510 2.022 1.00 25.23 O ATOM 526 CB TYR A 34 -2.567 -27.426 3.893 1.00 40.54 C ATOM 527 CG TYR A 34 -1.627 -26.482 3.177 1.00 64.32 C ATOM 528 CD1 TYR A 34 -1.650 -25.117 3.436 1.00 32.41 C ATOM 529 CD2 TYR A 34 -0.715 -26.956 2.241 1.00 54.51 C ATOM 530 CE1 TYR A 34 -0.793 -24.252 2.784 1.00 15.42 C ATOM 531 CE2 TYR A 34 0.146 -26.097 1.585 1.00 30.43 C ATOM 532 CZ TYR A 34 0.103 -24.746 1.860 1.00 20.42 C ATOM 533 OH TYR A 34 0.959 -23.888 1.208 1.00 35.12 O ATOM 0 H TYR A 34 -4.421 -28.844 4.705 1.00 61.44 H new ATOM 0 HA TYR A 34 -4.086 -26.029 4.495 1.00 65.55 H new ATOM 0 HB2 TYR A 34 -2.224 -27.558 4.919 1.00 40.54 H new ATOM 0 HB3 TYR A 34 -2.522 -28.404 3.414 1.00 40.54 H new ATOM 0 HD1 TYR A 34 -2.350 -24.726 4.159 1.00 32.41 H new ATOM 0 HD2 TYR A 34 -0.679 -28.013 2.023 1.00 54.51 H new ATOM 0 HE1 TYR A 34 -0.825 -23.194 2.997 1.00 15.42 H new ATOM 0 HE2 TYR A 34 0.849 -26.481 0.861 1.00 30.43 H new ATOM 0 HH TYR A 34 1.525 -24.397 0.591 1.00 35.12 H new ATOM 543 N VAL A 35 -4.971 -27.677 1.802 1.00 13.11 N ATOM 544 CA VAL A 35 -5.452 -27.526 0.434 1.00 44.22 C ATOM 545 C VAL A 35 -6.744 -26.719 0.391 1.00 35.01 C ATOM 546 O VAL A 35 -6.972 -25.939 -0.535 1.00 33.23 O ATOM 547 CB VAL A 35 -5.691 -28.894 -0.231 1.00 72.32 C ATOM 548 CG1 VAL A 35 -6.515 -28.735 -1.500 1.00 43.30 C ATOM 549 CG2 VAL A 35 -4.367 -29.581 -0.528 1.00 63.02 C ATOM 0 H VAL A 35 -5.042 -28.625 2.172 1.00 13.11 H new ATOM 0 HA VAL A 35 -4.677 -26.993 -0.117 1.00 44.22 H new ATOM 0 HB VAL A 35 -6.252 -29.521 0.462 1.00 72.32 H new ATOM 0 HG11 VAL A 35 -6.673 -29.712 -1.956 1.00 43.30 H new ATOM 0 HG12 VAL A 35 -7.479 -28.289 -1.255 1.00 43.30 H new ATOM 0 HG13 VAL A 35 -5.984 -28.090 -2.200 1.00 43.30 H new ATOM 0 HG21 VAL A 35 -4.555 -30.546 -0.998 1.00 63.02 H new ATOM 0 HG22 VAL A 35 -3.777 -28.959 -1.201 1.00 63.02 H new ATOM 0 HG23 VAL A 35 -3.818 -29.731 0.402 1.00 63.02 H new ATOM 559 N LEU A 36 -7.588 -26.911 1.399 1.00 54.21 N ATOM 560 CA LEU A 36 -8.860 -26.200 1.478 1.00 70.22 C ATOM 561 C LEU A 36 -8.648 -24.751 1.904 1.00 35.13 C ATOM 562 O LEU A 36 -9.337 -23.846 1.430 1.00 24.20 O ATOM 563 CB LEU A 36 -9.799 -26.902 2.461 1.00 5.53 C ATOM 564 CG LEU A 36 -10.700 -27.987 1.871 1.00 1.33 C ATOM 565 CD1 LEU A 36 -11.767 -27.369 0.981 1.00 11.45 C ATOM 566 CD2 LEU A 36 -9.874 -29.000 1.092 1.00 35.11 C ATOM 0 H LEU A 36 -7.415 -27.553 2.173 1.00 54.21 H new ATOM 0 HA LEU A 36 -9.313 -26.205 0.487 1.00 70.22 H new ATOM 0 HB2 LEU A 36 -9.196 -27.349 3.252 1.00 5.53 H new ATOM 0 HB3 LEU A 36 -10.431 -26.148 2.930 1.00 5.53 H new ATOM 0 HG LEU A 36 -11.196 -28.506 2.691 1.00 1.33 H new ATOM 0 HD11 LEU A 36 -12.399 -28.156 0.570 1.00 11.45 H new ATOM 0 HD12 LEU A 36 -12.378 -26.683 1.568 1.00 11.45 H new ATOM 0 HD13 LEU A 36 -11.290 -26.824 0.166 1.00 11.45 H new ATOM 0 HD21 LEU A 36 -10.531 -29.765 0.679 1.00 35.11 H new ATOM 0 HD22 LEU A 36 -9.350 -28.495 0.280 1.00 35.11 H new ATOM 0 HD23 LEU A 36 -9.148 -29.466 1.758 1.00 35.11 H new ATOM 578 N LEU A 37 -7.691 -24.537 2.800 1.00 34.54 N ATOM 579 CA LEU A 37 -7.387 -23.197 3.290 1.00 62.32 C ATOM 580 C LEU A 37 -6.589 -22.409 2.256 1.00 12.52 C ATOM 581 O LEU A 37 -6.936 -21.276 1.924 1.00 1.40 O ATOM 582 CB LEU A 37 -6.604 -23.278 4.602 1.00 53.33 C ATOM 583 CG LEU A 37 -7.438 -23.245 5.883 1.00 3.13 C ATOM 584 CD1 LEU A 37 -8.230 -21.950 5.972 1.00 3.30 C ATOM 585 CD2 LEU A 37 -8.369 -24.447 5.945 1.00 42.11 C ATOM 0 H LEU A 37 -7.112 -25.274 3.202 1.00 34.54 H new ATOM 0 HA LEU A 37 -8.329 -22.678 3.468 1.00 62.32 H new ATOM 0 HB2 LEU A 37 -6.019 -24.198 4.597 1.00 53.33 H new ATOM 0 HB3 LEU A 37 -5.896 -22.450 4.631 1.00 53.33 H new ATOM 0 HG LEU A 37 -6.760 -23.291 6.735 1.00 3.13 H new ATOM 0 HD11 LEU A 37 -8.817 -21.945 6.890 1.00 3.30 H new ATOM 0 HD12 LEU A 37 -7.544 -21.103 5.976 1.00 3.30 H new ATOM 0 HD13 LEU A 37 -8.898 -21.872 5.114 1.00 3.30 H new ATOM 0 HD21 LEU A 37 -8.955 -24.407 6.863 1.00 42.11 H new ATOM 0 HD22 LEU A 37 -9.040 -24.432 5.086 1.00 42.11 H new ATOM 0 HD23 LEU A 37 -7.780 -25.364 5.930 1.00 42.11 H new ATOM 597 N GLU A 38 -5.521 -23.017 1.751 1.00 42.25 N ATOM 598 CA GLU A 38 -4.675 -22.371 0.753 1.00 13.24 C ATOM 599 C GLU A 38 -5.510 -21.849 -0.412 1.00 55.31 C ATOM 600 O GLU A 38 -5.203 -20.807 -0.994 1.00 20.32 O ATOM 601 CB GLU A 38 -3.617 -23.349 0.239 1.00 40.20 C ATOM 602 CG GLU A 38 -4.175 -24.419 -0.684 1.00 22.31 C ATOM 603 CD GLU A 38 -3.109 -25.378 -1.176 1.00 64.44 C ATOM 604 OE1 GLU A 38 -2.024 -25.428 -0.558 1.00 55.42 O ATOM 605 OE2 GLU A 38 -3.358 -26.079 -2.179 1.00 64.14 O ATOM 0 H GLU A 38 -5.221 -23.955 2.016 1.00 42.25 H new ATOM 0 HA GLU A 38 -4.177 -21.526 1.228 1.00 13.24 H new ATOM 0 HB2 GLU A 38 -2.845 -22.791 -0.291 1.00 40.20 H new ATOM 0 HB3 GLU A 38 -3.135 -23.830 1.090 1.00 40.20 H new ATOM 0 HG2 GLU A 38 -4.948 -24.980 -0.159 1.00 22.31 H new ATOM 0 HG3 GLU A 38 -4.653 -23.942 -1.540 1.00 22.31 H new ATOM 612 N LEU A 39 -6.568 -22.579 -0.748 1.00 62.24 N ATOM 613 CA LEU A 39 -7.448 -22.191 -1.845 1.00 33.31 C ATOM 614 C LEU A 39 -8.416 -21.097 -1.405 1.00 43.04 C ATOM 615 O LEU A 39 -8.686 -20.156 -2.153 1.00 14.24 O ATOM 616 CB LEU A 39 -8.229 -23.405 -2.352 1.00 35.04 C ATOM 617 CG LEU A 39 -8.191 -23.646 -3.861 1.00 45.11 C ATOM 618 CD1 LEU A 39 -8.690 -22.420 -4.610 1.00 65.13 C ATOM 619 CD2 LEU A 39 -6.782 -24.009 -4.307 1.00 44.20 C ATOM 0 H LEU A 39 -6.837 -23.443 -0.277 1.00 62.24 H new ATOM 0 HA LEU A 39 -6.830 -21.801 -2.654 1.00 33.31 H new ATOM 0 HB2 LEU A 39 -7.844 -24.294 -1.853 1.00 35.04 H new ATOM 0 HB3 LEU A 39 -9.270 -23.295 -2.048 1.00 35.04 H new ATOM 0 HG LEU A 39 -8.851 -24.482 -4.093 1.00 45.11 H new ATOM 0 HD11 LEU A 39 -8.656 -22.610 -5.683 1.00 65.13 H new ATOM 0 HD12 LEU A 39 -9.716 -22.204 -4.312 1.00 65.13 H new ATOM 0 HD13 LEU A 39 -8.056 -21.566 -4.373 1.00 65.13 H new ATOM 0 HD21 LEU A 39 -6.773 -24.177 -5.384 1.00 44.20 H new ATOM 0 HD22 LEU A 39 -6.101 -23.194 -4.061 1.00 44.20 H new ATOM 0 HD23 LEU A 39 -6.461 -24.916 -3.795 1.00 44.20 H new ATOM 631 N LEU A 40 -8.932 -21.225 -0.188 1.00 73.23 N ATOM 632 CA LEU A 40 -9.868 -20.246 0.353 1.00 53.33 C ATOM 633 C LEU A 40 -9.218 -18.870 0.456 1.00 42.14 C ATOM 634 O LEU A 40 -9.805 -17.862 0.059 1.00 61.42 O ATOM 635 CB LEU A 40 -10.365 -20.692 1.729 1.00 52.21 C ATOM 636 CG LEU A 40 -11.877 -20.866 1.872 1.00 35.44 C ATOM 637 CD1 LEU A 40 -12.355 -22.067 1.070 1.00 43.33 C ATOM 638 CD2 LEU A 40 -12.260 -21.016 3.338 1.00 55.15 C ATOM 0 H LEU A 40 -8.718 -21.997 0.443 1.00 73.23 H new ATOM 0 HA LEU A 40 -10.716 -20.177 -0.328 1.00 53.33 H new ATOM 0 HB2 LEU A 40 -9.885 -21.639 1.977 1.00 52.21 H new ATOM 0 HB3 LEU A 40 -10.032 -19.963 2.467 1.00 52.21 H new ATOM 0 HG LEU A 40 -12.365 -19.974 1.478 1.00 35.44 H new ATOM 0 HD11 LEU A 40 -13.434 -22.175 1.184 1.00 43.33 H new ATOM 0 HD12 LEU A 40 -12.114 -21.920 0.017 1.00 43.33 H new ATOM 0 HD13 LEU A 40 -11.860 -22.968 1.433 1.00 43.33 H new ATOM 0 HD21 LEU A 40 -13.340 -21.139 3.421 1.00 55.15 H new ATOM 0 HD22 LEU A 40 -11.762 -21.891 3.757 1.00 55.15 H new ATOM 0 HD23 LEU A 40 -11.953 -20.126 3.887 1.00 55.15 H new ATOM 650 N LEU A 41 -8.002 -18.835 0.989 1.00 44.13 N ATOM 651 CA LEU A 41 -7.269 -17.583 1.142 1.00 51.41 C ATOM 652 C LEU A 41 -6.799 -17.058 -0.211 1.00 10.30 C ATOM 653 O LEU A 41 -6.937 -15.872 -0.509 1.00 14.33 O ATOM 654 CB LEU A 41 -6.069 -17.781 2.070 1.00 52.13 C ATOM 655 CG LEU A 41 -5.099 -18.898 1.683 1.00 34.13 C ATOM 656 CD1 LEU A 41 -3.928 -18.338 0.892 1.00 41.03 C ATOM 657 CD2 LEU A 41 -4.607 -19.629 2.924 1.00 64.24 C ATOM 0 H LEU A 41 -7.502 -19.659 1.323 1.00 44.13 H new ATOM 0 HA LEU A 41 -7.943 -16.848 1.582 1.00 51.41 H new ATOM 0 HB2 LEU A 41 -5.513 -16.845 2.117 1.00 52.13 H new ATOM 0 HB3 LEU A 41 -6.441 -17.982 3.075 1.00 52.13 H new ATOM 0 HG LEU A 41 -5.628 -19.611 1.051 1.00 34.13 H new ATOM 0 HD11 LEU A 41 -3.249 -19.148 0.626 1.00 41.03 H new ATOM 0 HD12 LEU A 41 -4.297 -17.861 -0.016 1.00 41.03 H new ATOM 0 HD13 LEU A 41 -3.397 -17.604 1.498 1.00 41.03 H new ATOM 0 HD21 LEU A 41 -3.918 -20.421 2.631 1.00 64.24 H new ATOM 0 HD22 LEU A 41 -4.094 -18.926 3.581 1.00 64.24 H new ATOM 0 HD23 LEU A 41 -5.456 -20.064 3.451 1.00 64.24 H new ATOM 669 N GLN A 42 -6.245 -17.950 -1.026 1.00 53.30 N ATOM 670 CA GLN A 42 -5.757 -17.576 -2.348 1.00 5.11 C ATOM 671 C GLN A 42 -6.847 -16.879 -3.155 1.00 34.43 C ATOM 672 O GLN A 42 -6.613 -15.833 -3.759 1.00 14.41 O ATOM 673 CB GLN A 42 -5.260 -18.812 -3.100 1.00 32.12 C ATOM 674 CG GLN A 42 -4.723 -18.505 -4.488 1.00 51.13 C ATOM 675 CD GLN A 42 -4.462 -19.756 -5.303 1.00 73.32 C ATOM 676 OE1 GLN A 42 -4.364 -20.856 -4.759 1.00 24.33 O ATOM 677 NE2 GLN A 42 -4.349 -19.595 -6.616 1.00 52.04 N ATOM 0 H GLN A 42 -6.123 -18.936 -0.794 1.00 53.30 H new ATOM 0 HA GLN A 42 -4.928 -16.881 -2.217 1.00 5.11 H new ATOM 0 HB2 GLN A 42 -4.476 -19.292 -2.514 1.00 32.12 H new ATOM 0 HB3 GLN A 42 -6.078 -19.528 -3.186 1.00 32.12 H new ATOM 0 HG2 GLN A 42 -5.436 -17.873 -5.018 1.00 51.13 H new ATOM 0 HG3 GLN A 42 -3.798 -17.935 -4.398 1.00 51.13 H new ATOM 0 HE21 GLN A 42 -4.437 -18.665 -7.025 1.00 52.04 H new ATOM 0 HE22 GLN A 42 -4.174 -20.401 -7.216 1.00 52.04 H new ATOM 686 N ARG A 43 -8.039 -17.467 -3.160 1.00 72.52 N ATOM 687 CA ARG A 43 -9.166 -16.904 -3.894 1.00 62.03 C ATOM 688 C ARG A 43 -10.104 -16.151 -2.956 1.00 1.41 C ATOM 689 O ARG A 43 -11.298 -16.019 -3.227 1.00 70.22 O ATOM 690 CB ARG A 43 -9.933 -18.010 -4.620 1.00 75.32 C ATOM 691 CG ARG A 43 -9.220 -18.537 -5.855 1.00 34.43 C ATOM 692 CD ARG A 43 -9.020 -17.443 -6.892 1.00 22.42 C ATOM 693 NE ARG A 43 -8.634 -17.986 -8.192 1.00 1.33 N ATOM 694 CZ ARG A 43 -8.162 -17.243 -9.187 1.00 71.20 C ATOM 695 NH1 ARG A 43 -8.018 -15.934 -9.032 1.00 33.34 N ATOM 696 NH2 ARG A 43 -7.832 -17.810 -10.341 1.00 15.13 N ATOM 0 H ARG A 43 -8.249 -18.333 -2.664 1.00 72.52 H new ATOM 0 HA ARG A 43 -8.774 -16.201 -4.629 1.00 62.03 H new ATOM 0 HB2 ARG A 43 -10.103 -18.836 -3.929 1.00 75.32 H new ATOM 0 HB3 ARG A 43 -10.913 -17.630 -4.911 1.00 75.32 H new ATOM 0 HG2 ARG A 43 -8.253 -18.950 -5.569 1.00 34.43 H new ATOM 0 HG3 ARG A 43 -9.799 -19.352 -6.291 1.00 34.43 H new ATOM 0 HD2 ARG A 43 -9.941 -16.870 -6.997 1.00 22.42 H new ATOM 0 HD3 ARG A 43 -8.252 -16.751 -6.546 1.00 22.42 H new ATOM 0 HE ARG A 43 -8.732 -18.990 -8.344 1.00 1.33 H new ATOM 0 HH11 ARG A 43 -8.270 -15.495 -8.147 1.00 33.34 H new ATOM 0 HH12 ARG A 43 -7.655 -15.367 -9.798 1.00 33.34 H new ATOM 0 HH21 ARG A 43 -7.941 -18.817 -10.464 1.00 15.13 H new ATOM 0 HH22 ARG A 43 -7.470 -17.239 -11.105 1.00 15.13 H new ATOM 710 N THR A 44 -9.556 -15.657 -1.850 1.00 23.32 N ATOM 711 CA THR A 44 -10.343 -14.919 -0.870 1.00 41.24 C ATOM 712 C THR A 44 -11.088 -13.761 -1.524 1.00 52.03 C ATOM 713 O THR A 44 -10.563 -13.096 -2.416 1.00 62.54 O ATOM 714 CB THR A 44 -9.457 -14.369 0.263 1.00 23.13 C ATOM 715 OG1 THR A 44 -10.269 -13.731 1.255 1.00 54.14 O ATOM 716 CG2 THR A 44 -8.437 -13.379 -0.279 1.00 13.44 C ATOM 0 H THR A 44 -8.569 -15.755 -1.611 1.00 23.32 H new ATOM 0 HA THR A 44 -11.063 -15.621 -0.450 1.00 41.24 H new ATOM 0 HB THR A 44 -8.923 -15.205 0.715 1.00 23.13 H new ATOM 0 HG1 THR A 44 -9.698 -13.386 1.973 1.00 54.14 H new ATOM 0 HG21 THR A 44 -7.823 -13.004 0.540 1.00 13.44 H new ATOM 0 HG22 THR A 44 -7.801 -13.876 -1.011 1.00 13.44 H new ATOM 0 HG23 THR A 44 -8.955 -12.546 -0.754 1.00 13.44 H new ATOM 724 N GLY A 45 -12.317 -13.524 -1.074 1.00 4.02 N ATOM 725 CA GLY A 45 -13.114 -12.445 -1.627 1.00 11.25 C ATOM 726 C GLY A 45 -14.023 -12.911 -2.747 1.00 1.53 C ATOM 727 O GLY A 45 -15.052 -12.292 -3.016 1.00 72.43 O ATOM 0 H GLY A 45 -12.774 -14.060 -0.337 1.00 4.02 H new ATOM 0 HA2 GLY A 45 -13.717 -12.000 -0.835 1.00 11.25 H new ATOM 0 HA3 GLY A 45 -12.452 -11.664 -2.001 1.00 11.25 H new ATOM 731 N GLU A 46 -13.641 -14.003 -3.402 1.00 1.45 N ATOM 732 CA GLU A 46 -14.429 -14.548 -4.501 1.00 23.24 C ATOM 733 C GLU A 46 -14.795 -16.006 -4.236 1.00 52.31 C ATOM 734 O GLU A 46 -14.094 -16.712 -3.512 1.00 21.40 O ATOM 735 CB GLU A 46 -13.656 -14.436 -5.816 1.00 43.13 C ATOM 736 CG GLU A 46 -12.189 -14.813 -5.695 1.00 2.14 C ATOM 737 CD GLU A 46 -11.424 -14.605 -6.987 1.00 43.41 C ATOM 738 OE1 GLU A 46 -11.920 -15.038 -8.048 1.00 33.14 O ATOM 739 OE2 GLU A 46 -10.328 -14.008 -6.937 1.00 41.55 O ATOM 0 H GLU A 46 -12.792 -14.527 -3.191 1.00 1.45 H new ATOM 0 HA GLU A 46 -15.349 -13.968 -4.578 1.00 23.24 H new ATOM 0 HB2 GLU A 46 -14.127 -15.078 -6.560 1.00 43.13 H new ATOM 0 HB3 GLU A 46 -13.730 -13.413 -6.185 1.00 43.13 H new ATOM 0 HG2 GLU A 46 -11.729 -14.219 -4.905 1.00 2.14 H new ATOM 0 HG3 GLU A 46 -12.110 -15.858 -5.395 1.00 2.14 H new ATOM 746 N VAL A 47 -15.900 -16.449 -4.828 1.00 43.13 N ATOM 747 CA VAL A 47 -16.360 -17.822 -4.658 1.00 13.30 C ATOM 748 C VAL A 47 -15.712 -18.750 -5.679 1.00 5.32 C ATOM 749 O VAL A 47 -15.712 -18.469 -6.878 1.00 75.02 O ATOM 750 CB VAL A 47 -17.892 -17.921 -4.791 1.00 44.50 C ATOM 751 CG1 VAL A 47 -18.374 -19.308 -4.396 1.00 64.25 C ATOM 752 CG2 VAL A 47 -18.569 -16.852 -3.947 1.00 14.30 C ATOM 0 H VAL A 47 -16.493 -15.877 -5.429 1.00 43.13 H new ATOM 0 HA VAL A 47 -16.068 -18.131 -3.654 1.00 13.30 H new ATOM 0 HB VAL A 47 -18.161 -17.753 -5.834 1.00 44.50 H new ATOM 0 HG11 VAL A 47 -19.458 -19.359 -4.496 1.00 64.25 H new ATOM 0 HG12 VAL A 47 -17.914 -20.052 -5.047 1.00 64.25 H new ATOM 0 HG13 VAL A 47 -18.096 -19.509 -3.362 1.00 64.25 H new ATOM 0 HG21 VAL A 47 -19.651 -16.936 -4.052 1.00 14.30 H new ATOM 0 HG22 VAL A 47 -18.295 -16.987 -2.901 1.00 14.30 H new ATOM 0 HG23 VAL A 47 -18.247 -15.866 -4.282 1.00 14.30 H new ATOM 762 N LEU A 48 -15.158 -19.857 -5.196 1.00 13.30 N ATOM 763 CA LEU A 48 -14.505 -20.828 -6.067 1.00 35.34 C ATOM 764 C LEU A 48 -15.295 -22.132 -6.116 1.00 73.21 C ATOM 765 O LEU A 48 -16.111 -22.426 -5.242 1.00 24.44 O ATOM 766 CB LEU A 48 -13.080 -21.100 -5.582 1.00 73.10 C ATOM 767 CG LEU A 48 -12.855 -21.007 -4.072 1.00 74.24 C ATOM 768 CD1 LEU A 48 -11.726 -21.931 -3.643 1.00 40.31 C ATOM 769 CD2 LEU A 48 -12.557 -19.572 -3.665 1.00 51.40 C ATOM 0 H LEU A 48 -15.148 -20.104 -4.206 1.00 13.30 H new ATOM 0 HA LEU A 48 -14.466 -20.410 -7.073 1.00 35.34 H new ATOM 0 HB2 LEU A 48 -12.790 -22.098 -5.912 1.00 73.10 H new ATOM 0 HB3 LEU A 48 -12.410 -20.395 -6.073 1.00 73.10 H new ATOM 0 HG LEU A 48 -13.768 -21.324 -3.567 1.00 74.24 H new ATOM 0 HD11 LEU A 48 -11.580 -21.851 -2.566 1.00 40.31 H new ATOM 0 HD12 LEU A 48 -11.980 -22.959 -3.900 1.00 40.31 H new ATOM 0 HD13 LEU A 48 -10.807 -21.645 -4.155 1.00 40.31 H new ATOM 0 HD21 LEU A 48 -12.400 -19.525 -2.587 1.00 51.40 H new ATOM 0 HD22 LEU A 48 -11.659 -19.227 -4.178 1.00 51.40 H new ATOM 0 HD23 LEU A 48 -13.398 -18.934 -3.937 1.00 51.40 H new ATOM 781 N PRO A 49 -15.048 -22.935 -7.162 1.00 11.21 N ATOM 782 CA PRO A 49 -15.724 -24.222 -7.349 1.00 70.11 C ATOM 783 C PRO A 49 -15.286 -25.261 -6.323 1.00 31.42 C ATOM 784 O PRO A 49 -14.326 -25.049 -5.581 1.00 74.35 O ATOM 785 CB PRO A 49 -15.296 -24.646 -8.756 1.00 63.31 C ATOM 786 CG PRO A 49 -13.996 -23.954 -8.981 1.00 51.34 C ATOM 787 CD PRO A 49 -14.089 -22.648 -8.242 1.00 13.30 C ATOM 0 HA PRO A 49 -16.804 -24.137 -7.224 1.00 70.11 H new ATOM 0 HB2 PRO A 49 -15.186 -25.728 -8.827 1.00 63.31 H new ATOM 0 HB3 PRO A 49 -16.036 -24.351 -9.500 1.00 63.31 H new ATOM 0 HG2 PRO A 49 -13.165 -24.554 -8.610 1.00 51.34 H new ATOM 0 HG3 PRO A 49 -13.820 -23.789 -10.044 1.00 51.34 H new ATOM 0 HD2 PRO A 49 -13.121 -22.339 -7.848 1.00 13.30 H new ATOM 0 HD3 PRO A 49 -14.441 -21.844 -8.889 1.00 13.30 H new ATOM 795 N ARG A 50 -15.995 -26.385 -6.286 1.00 11.13 N ATOM 796 CA ARG A 50 -15.679 -27.457 -5.349 1.00 54.15 C ATOM 797 C ARG A 50 -14.815 -28.523 -6.015 1.00 63.34 C ATOM 798 O ARG A 50 -13.908 -29.078 -5.395 1.00 30.22 O ATOM 799 CB ARG A 50 -16.965 -28.089 -4.813 1.00 22.30 C ATOM 800 CG ARG A 50 -16.931 -28.362 -3.318 1.00 74.51 C ATOM 801 CD ARG A 50 -17.729 -29.607 -2.961 1.00 62.23 C ATOM 802 NE ARG A 50 -18.750 -29.333 -1.954 1.00 3.04 N ATOM 803 CZ ARG A 50 -19.919 -28.766 -2.228 1.00 33.22 C ATOM 804 NH1 ARG A 50 -20.215 -28.416 -3.472 1.00 4.21 N ATOM 805 NH2 ARG A 50 -20.797 -28.549 -1.256 1.00 62.23 N ATOM 0 H ARG A 50 -16.792 -26.577 -6.894 1.00 11.13 H new ATOM 0 HA ARG A 50 -15.119 -27.027 -4.518 1.00 54.15 H new ATOM 0 HB2 ARG A 50 -17.804 -27.429 -5.035 1.00 22.30 H new ATOM 0 HB3 ARG A 50 -17.147 -29.025 -5.341 1.00 22.30 H new ATOM 0 HG2 ARG A 50 -15.898 -28.485 -2.993 1.00 74.51 H new ATOM 0 HG3 ARG A 50 -17.334 -27.503 -2.781 1.00 74.51 H new ATOM 0 HD2 ARG A 50 -18.203 -30.004 -3.859 1.00 62.23 H new ATOM 0 HD3 ARG A 50 -17.052 -30.377 -2.591 1.00 62.23 H new ATOM 0 HE ARG A 50 -18.555 -29.591 -0.987 1.00 3.04 H new ATOM 0 HH11 ARG A 50 -19.544 -28.582 -4.222 1.00 4.21 H new ATOM 0 HH12 ARG A 50 -21.114 -27.981 -3.679 1.00 4.21 H new ATOM 0 HH21 ARG A 50 -20.574 -28.818 -0.298 1.00 62.23 H new ATOM 0 HH22 ARG A 50 -21.695 -28.113 -1.468 1.00 62.23 H new ATOM 819 N SER A 51 -15.102 -28.805 -7.282 1.00 53.12 N ATOM 820 CA SER A 51 -14.354 -29.808 -8.031 1.00 52.33 C ATOM 821 C SER A 51 -12.873 -29.448 -8.091 1.00 23.14 C ATOM 822 O SER A 51 -12.007 -30.292 -7.857 1.00 21.44 O ATOM 823 CB SER A 51 -14.916 -29.940 -9.448 1.00 64.23 C ATOM 824 OG SER A 51 -16.330 -29.858 -9.446 1.00 53.22 O ATOM 0 H SER A 51 -15.847 -28.353 -7.811 1.00 53.12 H new ATOM 0 HA SER A 51 -14.457 -30.763 -7.516 1.00 52.33 H new ATOM 0 HB2 SER A 51 -14.504 -29.154 -10.081 1.00 64.23 H new ATOM 0 HB3 SER A 51 -14.605 -30.892 -9.879 1.00 64.23 H new ATOM 0 HG SER A 51 -16.706 -30.686 -9.812 1.00 53.22 H new ATOM 830 N LEU A 52 -12.588 -28.189 -8.405 1.00 73.21 N ATOM 831 CA LEU A 52 -11.211 -27.716 -8.496 1.00 15.53 C ATOM 832 C LEU A 52 -10.436 -28.050 -7.226 1.00 1.05 C ATOM 833 O LEU A 52 -9.366 -28.657 -7.282 1.00 3.53 O ATOM 834 CB LEU A 52 -11.186 -26.206 -8.740 1.00 2.31 C ATOM 835 CG LEU A 52 -9.801 -25.565 -8.836 1.00 2.33 C ATOM 836 CD1 LEU A 52 -8.962 -26.263 -9.894 1.00 44.04 C ATOM 837 CD2 LEU A 52 -9.921 -24.079 -9.142 1.00 2.01 C ATOM 0 H LEU A 52 -13.292 -27.477 -8.601 1.00 73.21 H new ATOM 0 HA LEU A 52 -10.733 -28.222 -9.335 1.00 15.53 H new ATOM 0 HB2 LEU A 52 -11.725 -25.998 -9.664 1.00 2.31 H new ATOM 0 HB3 LEU A 52 -11.735 -25.719 -7.934 1.00 2.31 H new ATOM 0 HG LEU A 52 -9.302 -25.678 -7.874 1.00 2.33 H new ATOM 0 HD11 LEU A 52 -7.980 -25.793 -9.948 1.00 44.04 H new ATOM 0 HD12 LEU A 52 -8.847 -27.315 -9.632 1.00 44.04 H new ATOM 0 HD13 LEU A 52 -9.456 -26.182 -10.862 1.00 44.04 H new ATOM 0 HD21 LEU A 52 -8.926 -23.639 -9.207 1.00 2.01 H new ATOM 0 HD22 LEU A 52 -10.440 -23.944 -10.091 1.00 2.01 H new ATOM 0 HD23 LEU A 52 -10.484 -23.588 -8.348 1.00 2.01 H new ATOM 849 N ILE A 53 -10.984 -27.653 -6.082 1.00 43.51 N ATOM 850 CA ILE A 53 -10.345 -27.913 -4.798 1.00 63.23 C ATOM 851 C ILE A 53 -10.045 -29.398 -4.625 1.00 32.42 C ATOM 852 O ILE A 53 -8.921 -29.782 -4.302 1.00 1.21 O ATOM 853 CB ILE A 53 -11.223 -27.438 -3.626 1.00 5.34 C ATOM 854 CG1 ILE A 53 -11.530 -25.945 -3.763 1.00 30.23 C ATOM 855 CG2 ILE A 53 -10.534 -27.723 -2.299 1.00 52.41 C ATOM 856 CD1 ILE A 53 -12.758 -25.508 -2.994 1.00 65.04 C ATOM 0 H ILE A 53 -11.869 -27.150 -6.018 1.00 43.51 H new ATOM 0 HA ILE A 53 -9.410 -27.352 -4.791 1.00 63.23 H new ATOM 0 HB ILE A 53 -12.164 -27.987 -3.650 1.00 5.34 H new ATOM 0 HG12 ILE A 53 -10.670 -25.372 -3.415 1.00 30.23 H new ATOM 0 HG13 ILE A 53 -11.667 -25.706 -4.818 1.00 30.23 H new ATOM 0 HG21 ILE A 53 -11.167 -27.382 -1.480 1.00 52.41 H new ATOM 0 HG22 ILE A 53 -10.361 -28.795 -2.202 1.00 52.41 H new ATOM 0 HG23 ILE A 53 -9.580 -27.197 -2.264 1.00 52.41 H new ATOM 0 HD11 ILE A 53 -12.915 -24.439 -3.137 1.00 65.04 H new ATOM 0 HD12 ILE A 53 -13.628 -26.054 -3.357 1.00 65.04 H new ATOM 0 HD13 ILE A 53 -12.616 -25.716 -1.933 1.00 65.04 H new ATOM 868 N SER A 54 -11.059 -30.230 -4.843 1.00 65.32 N ATOM 869 CA SER A 54 -10.905 -31.674 -4.709 1.00 63.23 C ATOM 870 C SER A 54 -9.753 -32.180 -5.572 1.00 24.10 C ATOM 871 O SER A 54 -9.094 -33.163 -5.233 1.00 4.12 O ATOM 872 CB SER A 54 -12.201 -32.385 -5.102 1.00 32.10 C ATOM 873 OG SER A 54 -12.086 -33.787 -4.932 1.00 22.14 O ATOM 0 H SER A 54 -11.995 -29.929 -5.113 1.00 65.32 H new ATOM 0 HA SER A 54 -10.679 -31.895 -3.666 1.00 63.23 H new ATOM 0 HB2 SER A 54 -13.024 -32.008 -4.495 1.00 32.10 H new ATOM 0 HB3 SER A 54 -12.442 -32.160 -6.141 1.00 32.10 H new ATOM 0 HG SER A 54 -11.727 -34.188 -5.751 1.00 22.14 H new ATOM 879 N SER A 55 -9.516 -31.501 -6.690 1.00 1.33 N ATOM 880 CA SER A 55 -8.446 -31.882 -7.604 1.00 72.52 C ATOM 881 C SER A 55 -7.080 -31.564 -7.005 1.00 43.43 C ATOM 882 O SER A 55 -6.088 -32.233 -7.300 1.00 12.53 O ATOM 883 CB SER A 55 -8.610 -31.161 -8.943 1.00 44.13 C ATOM 884 OG SER A 55 -7.971 -31.874 -9.988 1.00 43.21 O ATOM 0 H SER A 55 -10.051 -30.684 -6.984 1.00 1.33 H new ATOM 0 HA SER A 55 -8.508 -32.958 -7.769 1.00 72.52 H new ATOM 0 HB2 SER A 55 -9.670 -31.048 -9.171 1.00 44.13 H new ATOM 0 HB3 SER A 55 -8.190 -30.158 -8.873 1.00 44.13 H new ATOM 0 HG SER A 55 -8.132 -31.419 -10.841 1.00 43.21 H new ATOM 890 N LEU A 56 -7.035 -30.537 -6.163 1.00 71.31 N ATOM 891 CA LEU A 56 -5.791 -30.128 -5.521 1.00 43.21 C ATOM 892 C LEU A 56 -5.359 -31.146 -4.470 1.00 54.05 C ATOM 893 O LEU A 56 -4.236 -31.099 -3.970 1.00 24.21 O ATOM 894 CB LEU A 56 -5.956 -28.751 -4.876 1.00 2.22 C ATOM 895 CG LEU A 56 -5.290 -27.583 -5.606 1.00 35.43 C ATOM 896 CD1 LEU A 56 -3.782 -27.628 -5.421 1.00 23.52 C ATOM 897 CD2 LEU A 56 -5.649 -27.605 -7.084 1.00 53.14 C ATOM 0 H LEU A 56 -7.846 -29.973 -5.909 1.00 71.31 H new ATOM 0 HA LEU A 56 -5.017 -30.074 -6.287 1.00 43.21 H new ATOM 0 HB2 LEU A 56 -7.021 -28.538 -4.788 1.00 2.22 H new ATOM 0 HB3 LEU A 56 -5.556 -28.796 -3.863 1.00 2.22 H new ATOM 0 HG LEU A 56 -5.660 -26.652 -5.176 1.00 35.43 H new ATOM 0 HD11 LEU A 56 -3.326 -26.790 -5.947 1.00 23.52 H new ATOM 0 HD12 LEU A 56 -3.544 -27.563 -4.359 1.00 23.52 H new ATOM 0 HD13 LEU A 56 -3.394 -28.564 -5.824 1.00 23.52 H new ATOM 0 HD21 LEU A 56 -5.167 -26.767 -7.588 1.00 53.14 H new ATOM 0 HD22 LEU A 56 -5.308 -28.540 -7.527 1.00 53.14 H new ATOM 0 HD23 LEU A 56 -6.730 -27.523 -7.197 1.00 53.14 H new ATOM 909 N VAL A 57 -6.260 -32.067 -4.142 1.00 25.40 N ATOM 910 CA VAL A 57 -5.971 -33.100 -3.153 1.00 52.54 C ATOM 911 C VAL A 57 -6.193 -34.492 -3.732 1.00 71.34 C ATOM 912 O VAL A 57 -5.239 -35.198 -4.060 1.00 74.30 O ATOM 913 CB VAL A 57 -6.846 -32.933 -1.897 1.00 3.25 C ATOM 914 CG1 VAL A 57 -6.050 -32.284 -0.774 1.00 40.24 C ATOM 915 CG2 VAL A 57 -8.090 -32.120 -2.218 1.00 54.51 C ATOM 0 H VAL A 57 -7.195 -32.119 -4.546 1.00 25.40 H new ATOM 0 HA VAL A 57 -4.923 -32.989 -2.875 1.00 52.54 H new ATOM 0 HB VAL A 57 -7.162 -33.921 -1.562 1.00 3.25 H new ATOM 0 HG11 VAL A 57 -6.685 -32.174 0.105 1.00 40.24 H new ATOM 0 HG12 VAL A 57 -5.193 -32.910 -0.527 1.00 40.24 H new ATOM 0 HG13 VAL A 57 -5.702 -31.302 -1.095 1.00 40.24 H new ATOM 0 HG21 VAL A 57 -8.696 -32.012 -1.319 1.00 54.51 H new ATOM 0 HG22 VAL A 57 -7.797 -31.134 -2.579 1.00 54.51 H new ATOM 0 HG23 VAL A 57 -8.670 -32.630 -2.987 1.00 54.51 H new ATOM 925 N TRP A 58 -7.457 -34.881 -3.856 1.00 40.20 N ATOM 926 CA TRP A 58 -7.804 -36.190 -4.397 1.00 35.25 C ATOM 927 C TRP A 58 -7.831 -36.160 -5.921 1.00 22.43 C ATOM 928 O TRP A 58 -6.916 -36.658 -6.576 1.00 11.40 O ATOM 929 CB TRP A 58 -9.163 -36.642 -3.859 1.00 74.24 C ATOM 930 CG TRP A 58 -9.597 -37.976 -4.388 1.00 13.11 C ATOM 931 CD1 TRP A 58 -10.799 -38.278 -4.963 1.00 25.21 C ATOM 932 CD2 TRP A 58 -8.834 -39.187 -4.388 1.00 20.21 C ATOM 933 NE1 TRP A 58 -10.828 -39.605 -5.320 1.00 40.34 N ATOM 934 CE2 TRP A 58 -9.635 -40.184 -4.979 1.00 64.02 C ATOM 935 CE3 TRP A 58 -7.552 -39.526 -3.948 1.00 63.31 C ATOM 936 CZ2 TRP A 58 -9.193 -41.495 -5.139 1.00 53.23 C ATOM 937 CZ3 TRP A 58 -7.115 -40.828 -4.107 1.00 54.25 C ATOM 938 CH2 TRP A 58 -7.934 -41.799 -4.700 1.00 3.05 C ATOM 0 H TRP A 58 -8.258 -34.309 -3.589 1.00 40.20 H new ATOM 0 HA TRP A 58 -7.041 -36.901 -4.080 1.00 35.25 H new ATOM 0 HB2 TRP A 58 -9.118 -36.688 -2.771 1.00 74.24 H new ATOM 0 HB3 TRP A 58 -9.914 -35.895 -4.116 1.00 74.24 H new ATOM 0 HD1 TRP A 58 -11.607 -37.578 -5.115 1.00 25.21 H new ATOM 0 HE1 TRP A 58 -11.612 -40.081 -5.767 1.00 40.34 H new ATOM 0 HE3 TRP A 58 -6.914 -38.784 -3.492 1.00 63.31 H new ATOM 0 HZ2 TRP A 58 -9.823 -42.245 -5.594 1.00 53.23 H new ATOM 0 HZ3 TRP A 58 -6.126 -41.102 -3.769 1.00 54.25 H new ATOM 0 HH2 TRP A 58 -7.563 -42.807 -4.812 1.00 3.05 H new ATOM 949 N ASN A 59 -8.885 -35.574 -6.479 1.00 1.02 N ATOM 950 CA ASN A 59 -9.030 -35.480 -7.927 1.00 23.01 C ATOM 951 C ASN A 59 -10.256 -34.651 -8.298 1.00 65.35 C ATOM 952 O ASN A 59 -11.072 -34.315 -7.442 1.00 15.31 O ATOM 953 CB ASN A 59 -9.139 -36.877 -8.541 1.00 74.10 C ATOM 954 CG ASN A 59 -10.555 -37.420 -8.494 1.00 41.55 C ATOM 955 OD1 ASN A 59 -11.312 -37.130 -7.568 1.00 55.55 O ATOM 956 ND2 ASN A 59 -10.918 -38.212 -9.496 1.00 62.03 N ATOM 0 H ASN A 59 -9.651 -35.157 -5.950 1.00 1.02 H new ATOM 0 HA ASN A 59 -8.145 -34.984 -8.325 1.00 23.01 H new ATOM 0 HB2 ASN A 59 -8.800 -36.843 -9.576 1.00 74.10 H new ATOM 0 HB3 ASN A 59 -8.474 -37.558 -8.009 1.00 74.10 H new ATOM 0 HD21 ASN A 59 -11.858 -38.607 -9.519 1.00 62.03 H new ATOM 0 HD22 ASN A 59 -10.257 -38.425 -10.243 1.00 62.03 H new ATOM 963 N MET A 60 -10.377 -34.327 -9.581 1.00 43.55 N ATOM 964 CA MET A 60 -11.504 -33.539 -10.067 1.00 1.32 C ATOM 965 C MET A 60 -12.623 -34.444 -10.571 1.00 70.31 C ATOM 966 O MET A 60 -12.403 -35.622 -10.849 1.00 62.23 O ATOM 967 CB MET A 60 -11.052 -32.597 -11.184 1.00 42.41 C ATOM 968 CG MET A 60 -10.774 -33.304 -12.500 1.00 61.24 C ATOM 969 SD MET A 60 -9.788 -32.305 -13.632 1.00 4.24 S ATOM 970 CE MET A 60 -10.051 -33.178 -15.173 1.00 32.21 C ATOM 0 H MET A 60 -9.709 -34.598 -10.303 1.00 43.55 H new ATOM 0 HA MET A 60 -11.886 -32.947 -9.235 1.00 1.32 H new ATOM 0 HB2 MET A 60 -11.820 -31.840 -11.343 1.00 42.41 H new ATOM 0 HB3 MET A 60 -10.151 -32.074 -10.864 1.00 42.41 H new ATOM 0 HG2 MET A 60 -10.254 -34.241 -12.301 1.00 61.24 H new ATOM 0 HG3 MET A 60 -11.720 -33.560 -12.977 1.00 61.24 H new ATOM 0 HE1 MET A 60 -9.503 -32.679 -15.972 1.00 32.21 H new ATOM 0 HE2 MET A 60 -9.696 -34.204 -15.075 1.00 32.21 H new ATOM 0 HE3 MET A 60 -11.115 -33.184 -15.411 1.00 32.21 H new ATOM 980 N ASN A 61 -13.824 -33.886 -10.686 1.00 43.10 N ATOM 981 CA ASN A 61 -14.977 -34.644 -11.156 1.00 74.21 C ATOM 982 C ASN A 61 -16.152 -33.718 -11.454 1.00 54.21 C ATOM 983 O ASN A 61 -16.340 -32.701 -10.786 1.00 35.14 O ATOM 984 CB ASN A 61 -15.387 -35.687 -10.114 1.00 72.25 C ATOM 985 CG ASN A 61 -16.263 -36.777 -10.701 1.00 60.34 C ATOM 986 OD1 ASN A 61 -15.824 -37.551 -11.553 1.00 0.41 O ATOM 987 ND2 ASN A 61 -17.509 -36.843 -10.248 1.00 33.24 N ATOM 0 H ASN A 61 -14.024 -32.912 -10.460 1.00 43.10 H new ATOM 0 HA ASN A 61 -14.695 -35.152 -12.078 1.00 74.21 H new ATOM 0 HB2 ASN A 61 -14.493 -36.136 -9.682 1.00 72.25 H new ATOM 0 HB3 ASN A 61 -15.920 -35.194 -9.301 1.00 72.25 H new ATOM 0 HD21 ASN A 61 -18.145 -37.556 -10.606 1.00 33.24 H new ATOM 0 HD22 ASN A 61 -17.831 -36.181 -9.542 1.00 33.24 H new ATOM 994 N PHE A 62 -16.941 -34.077 -12.462 1.00 1.32 N ATOM 995 CA PHE A 62 -18.098 -33.278 -12.849 1.00 42.02 C ATOM 996 C PHE A 62 -18.991 -32.995 -11.645 1.00 74.30 C ATOM 997 O PHE A 62 -19.660 -31.963 -11.583 1.00 72.53 O ATOM 998 CB PHE A 62 -18.900 -33.997 -13.936 1.00 2.10 C ATOM 999 CG PHE A 62 -19.736 -33.073 -14.775 1.00 3.25 C ATOM 1000 CD1 PHE A 62 -19.142 -32.075 -15.531 1.00 72.11 C ATOM 1001 CD2 PHE A 62 -21.115 -33.202 -14.807 1.00 22.03 C ATOM 1002 CE1 PHE A 62 -19.909 -31.223 -16.303 1.00 13.02 C ATOM 1003 CE2 PHE A 62 -21.887 -32.353 -15.577 1.00 11.00 C ATOM 1004 CZ PHE A 62 -21.283 -31.363 -16.327 1.00 12.22 C ATOM 0 H PHE A 62 -16.800 -34.916 -13.025 1.00 1.32 H new ATOM 0 HA PHE A 62 -17.737 -32.328 -13.242 1.00 42.02 H new ATOM 0 HB2 PHE A 62 -18.212 -34.541 -14.584 1.00 2.10 H new ATOM 0 HB3 PHE A 62 -19.549 -34.737 -13.468 1.00 2.10 H new ATOM 0 HD1 PHE A 62 -18.068 -31.962 -15.517 1.00 72.11 H new ATOM 0 HD2 PHE A 62 -21.592 -33.975 -14.223 1.00 22.03 H new ATOM 0 HE1 PHE A 62 -19.434 -30.448 -16.887 1.00 13.02 H new ATOM 0 HE2 PHE A 62 -22.961 -32.464 -15.592 1.00 11.00 H new ATOM 0 HZ PHE A 62 -21.884 -30.699 -16.931 1.00 12.22 H new ATOM 1014 N ASP A 63 -18.997 -33.919 -10.691 1.00 33.33 N ATOM 1015 CA ASP A 63 -19.808 -33.771 -9.487 1.00 42.44 C ATOM 1016 C ASP A 63 -18.925 -33.576 -8.258 1.00 52.15 C ATOM 1017 O ASP A 63 -17.711 -33.407 -8.374 1.00 55.21 O ATOM 1018 CB ASP A 63 -20.706 -34.994 -9.297 1.00 42.02 C ATOM 1019 CG ASP A 63 -21.551 -35.288 -10.521 1.00 43.12 C ATOM 1020 OD1 ASP A 63 -21.052 -35.978 -11.435 1.00 50.01 O ATOM 1021 OD2 ASP A 63 -22.711 -34.829 -10.565 1.00 0.42 O ATOM 0 H ASP A 63 -18.450 -34.779 -10.727 1.00 33.33 H new ATOM 0 HA ASP A 63 -20.434 -32.887 -9.607 1.00 42.44 H new ATOM 0 HB2 ASP A 63 -20.088 -35.863 -9.068 1.00 42.02 H new ATOM 0 HB3 ASP A 63 -21.359 -34.832 -8.439 1.00 42.02 H new ATOM 1026 N SER A 64 -19.544 -33.600 -7.082 1.00 43.12 N ATOM 1027 CA SER A 64 -18.815 -33.421 -5.832 1.00 33.23 C ATOM 1028 C SER A 64 -18.440 -34.769 -5.224 1.00 62.42 C ATOM 1029 O SER A 64 -19.300 -35.619 -4.992 1.00 22.10 O ATOM 1030 CB SER A 64 -19.656 -32.617 -4.838 1.00 22.43 C ATOM 1031 OG SER A 64 -20.858 -33.297 -4.520 1.00 10.11 O ATOM 0 H SER A 64 -20.548 -33.742 -6.969 1.00 43.12 H new ATOM 0 HA SER A 64 -17.898 -32.873 -6.050 1.00 33.23 H new ATOM 0 HB2 SER A 64 -19.081 -32.443 -3.928 1.00 22.43 H new ATOM 0 HB3 SER A 64 -19.888 -31.639 -5.261 1.00 22.43 H new ATOM 0 HG SER A 64 -20.893 -33.465 -3.555 1.00 10.11 H new ATOM 1037 N ASP A 65 -17.150 -34.957 -4.970 1.00 23.55 N ATOM 1038 CA ASP A 65 -16.659 -36.201 -4.388 1.00 65.40 C ATOM 1039 C ASP A 65 -17.189 -36.385 -2.970 1.00 12.14 C ATOM 1040 O ASP A 65 -16.583 -35.922 -2.003 1.00 1.31 O ATOM 1041 CB ASP A 65 -15.129 -36.216 -4.380 1.00 32.44 C ATOM 1042 CG ASP A 65 -14.542 -36.174 -5.777 1.00 10.43 C ATOM 1043 OD1 ASP A 65 -14.816 -35.197 -6.505 1.00 60.32 O ATOM 1044 OD2 ASP A 65 -13.809 -37.117 -6.142 1.00 13.11 O ATOM 0 H ASP A 65 -16.425 -34.264 -5.158 1.00 23.55 H new ATOM 0 HA ASP A 65 -17.020 -37.027 -5.001 1.00 65.40 H new ATOM 0 HB2 ASP A 65 -14.763 -35.362 -3.810 1.00 32.44 H new ATOM 0 HB3 ASP A 65 -14.780 -37.114 -3.869 1.00 32.44 H new ATOM 1049 N THR A 66 -18.327 -37.063 -2.852 1.00 24.22 N ATOM 1050 CA THR A 66 -18.940 -37.306 -1.552 1.00 75.15 C ATOM 1051 C THR A 66 -18.862 -36.068 -0.667 1.00 54.53 C ATOM 1052 O THR A 66 -18.696 -36.171 0.547 1.00 2.31 O ATOM 1053 CB THR A 66 -18.268 -38.486 -0.825 1.00 74.13 C ATOM 1054 OG1 THR A 66 -18.978 -38.786 0.381 1.00 34.43 O ATOM 1055 CG2 THR A 66 -16.817 -38.165 -0.500 1.00 35.24 C ATOM 0 H THR A 66 -18.842 -37.453 -3.641 1.00 24.22 H new ATOM 0 HA THR A 66 -19.986 -37.551 -1.737 1.00 75.15 H new ATOM 0 HB THR A 66 -18.292 -39.353 -1.485 1.00 74.13 H new ATOM 0 HG1 THR A 66 -19.038 -37.980 0.935 1.00 34.43 H new ATOM 0 HG21 THR A 66 -16.363 -39.013 0.013 1.00 35.24 H new ATOM 0 HG22 THR A 66 -16.273 -37.966 -1.423 1.00 35.24 H new ATOM 0 HG23 THR A 66 -16.774 -37.286 0.143 1.00 35.24 H new ATOM 1063 N ASN A 67 -18.985 -34.897 -1.284 1.00 3.50 N ATOM 1064 CA ASN A 67 -18.928 -33.637 -0.551 1.00 20.12 C ATOM 1065 C ASN A 67 -17.775 -33.641 0.448 1.00 11.34 C ATOM 1066 O ASN A 67 -17.921 -33.185 1.583 1.00 60.32 O ATOM 1067 CB ASN A 67 -20.249 -33.388 0.179 1.00 54.10 C ATOM 1068 CG ASN A 67 -21.426 -33.288 -0.773 1.00 3.41 C ATOM 1069 OD1 ASN A 67 -21.255 -33.021 -1.963 1.00 2.24 O ATOM 1070 ND2 ASN A 67 -22.628 -33.501 -0.252 1.00 32.42 N ATOM 0 H ASN A 67 -19.125 -34.794 -2.289 1.00 3.50 H new ATOM 0 HA ASN A 67 -18.760 -32.834 -1.269 1.00 20.12 H new ATOM 0 HB2 ASN A 67 -20.427 -34.196 0.889 1.00 54.10 H new ATOM 0 HB3 ASN A 67 -20.174 -32.467 0.757 1.00 54.10 H new ATOM 0 HD21 ASN A 67 -23.457 -33.446 -0.843 1.00 32.42 H new ATOM 0 HD22 ASN A 67 -22.723 -33.719 0.740 1.00 32.42 H new ATOM 1077 N VAL A 68 -16.628 -34.157 0.019 1.00 72.44 N ATOM 1078 CA VAL A 68 -15.449 -34.219 0.874 1.00 32.12 C ATOM 1079 C VAL A 68 -14.892 -32.826 1.144 1.00 53.34 C ATOM 1080 O VAL A 68 -14.202 -32.604 2.139 1.00 62.22 O ATOM 1081 CB VAL A 68 -14.344 -35.089 0.246 1.00 54.15 C ATOM 1082 CG1 VAL A 68 -13.911 -34.516 -1.095 1.00 53.41 C ATOM 1083 CG2 VAL A 68 -13.159 -35.209 1.191 1.00 30.42 C ATOM 0 H VAL A 68 -16.490 -34.539 -0.917 1.00 72.44 H new ATOM 0 HA VAL A 68 -15.765 -34.670 1.815 1.00 32.12 H new ATOM 0 HB VAL A 68 -14.745 -36.088 0.075 1.00 54.15 H new ATOM 0 HG11 VAL A 68 -13.130 -35.144 -1.524 1.00 53.41 H new ATOM 0 HG12 VAL A 68 -14.765 -34.487 -1.771 1.00 53.41 H new ATOM 0 HG13 VAL A 68 -13.527 -33.506 -0.952 1.00 53.41 H new ATOM 0 HG21 VAL A 68 -12.388 -35.827 0.731 1.00 30.42 H new ATOM 0 HG22 VAL A 68 -12.755 -34.218 1.396 1.00 30.42 H new ATOM 0 HG23 VAL A 68 -13.483 -35.669 2.125 1.00 30.42 H new ATOM 1093 N ILE A 69 -15.197 -31.890 0.251 1.00 14.10 N ATOM 1094 CA ILE A 69 -14.728 -30.517 0.394 1.00 75.24 C ATOM 1095 C ILE A 69 -15.452 -29.804 1.531 1.00 74.33 C ATOM 1096 O ILE A 69 -14.822 -29.228 2.417 1.00 23.22 O ATOM 1097 CB ILE A 69 -14.926 -29.717 -0.907 1.00 41.13 C ATOM 1098 CG1 ILE A 69 -14.370 -30.496 -2.101 1.00 20.52 C ATOM 1099 CG2 ILE A 69 -14.256 -28.355 -0.798 1.00 63.45 C ATOM 1100 CD1 ILE A 69 -12.911 -30.869 -1.953 1.00 35.24 C ATOM 0 H ILE A 69 -15.766 -32.057 -0.579 1.00 14.10 H new ATOM 0 HA ILE A 69 -13.663 -30.569 0.621 1.00 75.24 H new ATOM 0 HB ILE A 69 -15.994 -29.564 -1.063 1.00 41.13 H new ATOM 0 HG12 ILE A 69 -14.957 -31.404 -2.237 1.00 20.52 H new ATOM 0 HG13 ILE A 69 -14.494 -29.898 -3.004 1.00 20.52 H new ATOM 0 HG21 ILE A 69 -14.404 -27.801 -1.725 1.00 63.45 H new ATOM 0 HG22 ILE A 69 -14.694 -27.799 0.031 1.00 63.45 H new ATOM 0 HG23 ILE A 69 -13.189 -28.488 -0.622 1.00 63.45 H new ATOM 0 HD11 ILE A 69 -12.585 -31.419 -2.836 1.00 35.24 H new ATOM 0 HD12 ILE A 69 -12.313 -29.964 -1.848 1.00 35.24 H new ATOM 0 HD13 ILE A 69 -12.783 -31.493 -1.069 1.00 35.24 H new ATOM 1112 N ASP A 70 -16.780 -29.849 1.499 1.00 3.23 N ATOM 1113 CA ASP A 70 -17.591 -29.210 2.529 1.00 3.41 C ATOM 1114 C ASP A 70 -17.390 -29.891 3.879 1.00 14.33 C ATOM 1115 O ASP A 70 -17.417 -29.241 4.924 1.00 5.34 O ATOM 1116 CB ASP A 70 -19.069 -29.246 2.140 1.00 73.33 C ATOM 1117 CG ASP A 70 -19.986 -29.027 3.327 1.00 53.21 C ATOM 1118 OD1 ASP A 70 -19.661 -28.172 4.177 1.00 32.00 O ATOM 1119 OD2 ASP A 70 -21.029 -29.710 3.406 1.00 24.55 O ATOM 0 H ASP A 70 -17.317 -30.321 0.771 1.00 3.23 H new ATOM 0 HA ASP A 70 -17.272 -28.171 2.616 1.00 3.41 H new ATOM 0 HB2 ASP A 70 -19.263 -28.480 1.389 1.00 73.33 H new ATOM 0 HB3 ASP A 70 -19.297 -30.208 1.681 1.00 73.33 H new ATOM 1124 N VAL A 71 -17.191 -31.205 3.850 1.00 53.32 N ATOM 1125 CA VAL A 71 -16.987 -31.975 5.071 1.00 45.51 C ATOM 1126 C VAL A 71 -15.585 -31.757 5.629 1.00 24.11 C ATOM 1127 O VAL A 71 -15.370 -31.825 6.839 1.00 64.32 O ATOM 1128 CB VAL A 71 -17.203 -33.480 4.828 1.00 22.13 C ATOM 1129 CG1 VAL A 71 -16.915 -34.272 6.095 1.00 54.03 C ATOM 1130 CG2 VAL A 71 -18.618 -33.742 4.336 1.00 40.15 C ATOM 0 H VAL A 71 -17.167 -31.759 2.994 1.00 53.32 H new ATOM 0 HA VAL A 71 -17.722 -31.623 5.795 1.00 45.51 H new ATOM 0 HB VAL A 71 -16.508 -33.810 4.056 1.00 22.13 H new ATOM 0 HG11 VAL A 71 -17.073 -35.334 5.904 1.00 54.03 H new ATOM 0 HG12 VAL A 71 -15.881 -34.108 6.400 1.00 54.03 H new ATOM 0 HG13 VAL A 71 -17.584 -33.943 6.890 1.00 54.03 H new ATOM 0 HG21 VAL A 71 -18.753 -34.811 4.169 1.00 40.15 H new ATOM 0 HG22 VAL A 71 -19.333 -33.398 5.084 1.00 40.15 H new ATOM 0 HG23 VAL A 71 -18.784 -33.205 3.402 1.00 40.15 H new ATOM 1140 N ALA A 72 -14.633 -31.495 4.739 1.00 54.52 N ATOM 1141 CA ALA A 72 -13.252 -31.264 5.142 1.00 22.34 C ATOM 1142 C ALA A 72 -13.103 -29.922 5.850 1.00 51.31 C ATOM 1143 O ALA A 72 -12.351 -29.798 6.817 1.00 41.14 O ATOM 1144 CB ALA A 72 -12.331 -31.331 3.933 1.00 3.13 C ATOM 0 H ALA A 72 -14.794 -31.438 3.733 1.00 54.52 H new ATOM 0 HA ALA A 72 -12.969 -32.048 5.844 1.00 22.34 H new ATOM 0 HB1 ALA A 72 -11.302 -31.157 4.249 1.00 3.13 H new ATOM 0 HB2 ALA A 72 -12.407 -32.316 3.472 1.00 3.13 H new ATOM 0 HB3 ALA A 72 -12.623 -30.569 3.211 1.00 3.13 H new ATOM 1150 N VAL A 73 -13.824 -28.917 5.362 1.00 73.55 N ATOM 1151 CA VAL A 73 -13.773 -27.583 5.948 1.00 64.45 C ATOM 1152 C VAL A 73 -14.580 -27.519 7.239 1.00 54.32 C ATOM 1153 O VAL A 73 -14.213 -26.813 8.178 1.00 11.31 O ATOM 1154 CB VAL A 73 -14.304 -26.519 4.969 1.00 61.53 C ATOM 1155 CG1 VAL A 73 -15.745 -26.819 4.584 1.00 22.34 C ATOM 1156 CG2 VAL A 73 -14.183 -25.130 5.576 1.00 55.11 C ATOM 0 H VAL A 73 -14.451 -29.002 4.562 1.00 73.55 H new ATOM 0 HA VAL A 73 -12.726 -27.373 6.167 1.00 64.45 H new ATOM 0 HB VAL A 73 -13.698 -26.548 4.063 1.00 61.53 H new ATOM 0 HG11 VAL A 73 -16.103 -26.057 3.892 1.00 22.34 H new ATOM 0 HG12 VAL A 73 -15.798 -27.797 4.106 1.00 22.34 H new ATOM 0 HG13 VAL A 73 -16.368 -26.819 5.478 1.00 22.34 H new ATOM 0 HG21 VAL A 73 -14.563 -24.390 4.871 1.00 55.11 H new ATOM 0 HG22 VAL A 73 -14.763 -25.084 6.498 1.00 55.11 H new ATOM 0 HG23 VAL A 73 -13.136 -24.919 5.795 1.00 55.11 H new ATOM 1166 N ARG A 74 -15.682 -28.261 7.279 1.00 54.43 N ATOM 1167 CA ARG A 74 -16.543 -28.287 8.455 1.00 73.20 C ATOM 1168 C ARG A 74 -15.913 -29.114 9.572 1.00 62.24 C ATOM 1169 O ARG A 74 -15.976 -28.743 10.744 1.00 44.13 O ATOM 1170 CB ARG A 74 -17.916 -28.858 8.096 1.00 72.43 C ATOM 1171 CG ARG A 74 -18.800 -27.886 7.332 1.00 43.41 C ATOM 1172 CD ARG A 74 -19.444 -26.870 8.262 1.00 4.43 C ATOM 1173 NE ARG A 74 -20.713 -27.350 8.803 1.00 45.41 N ATOM 1174 CZ ARG A 74 -21.525 -26.604 9.544 1.00 41.15 C ATOM 1175 NH1 ARG A 74 -21.203 -25.350 9.830 1.00 65.14 N ATOM 1176 NH2 ARG A 74 -22.663 -27.112 9.999 1.00 22.11 N ATOM 0 H ARG A 74 -15.999 -28.852 6.511 1.00 54.43 H new ATOM 0 HA ARG A 74 -16.664 -27.263 8.808 1.00 73.20 H new ATOM 0 HB2 ARG A 74 -17.780 -29.759 7.498 1.00 72.43 H new ATOM 0 HB3 ARG A 74 -18.426 -29.157 9.012 1.00 72.43 H new ATOM 0 HG2 ARG A 74 -18.206 -27.367 6.579 1.00 43.41 H new ATOM 0 HG3 ARG A 74 -19.576 -28.438 6.801 1.00 43.41 H new ATOM 0 HD2 ARG A 74 -18.762 -26.646 9.082 1.00 4.43 H new ATOM 0 HD3 ARG A 74 -19.610 -25.938 7.722 1.00 4.43 H new ATOM 0 HE ARG A 74 -20.991 -28.310 8.601 1.00 45.41 H new ATOM 0 HH11 ARG A 74 -20.330 -24.955 9.481 1.00 65.14 H new ATOM 0 HH12 ARG A 74 -21.829 -24.780 10.399 1.00 65.14 H new ATOM 0 HH21 ARG A 74 -22.915 -28.076 9.780 1.00 22.11 H new ATOM 0 HH22 ARG A 74 -23.286 -26.539 10.568 1.00 22.11 H new ATOM 1190 N ARG A 75 -15.306 -30.237 9.199 1.00 12.44 N ATOM 1191 CA ARG A 75 -14.666 -31.117 10.169 1.00 10.13 C ATOM 1192 C ARG A 75 -13.432 -30.453 10.774 1.00 33.53 C ATOM 1193 O ARG A 75 -13.191 -30.548 11.978 1.00 24.44 O ATOM 1194 CB ARG A 75 -14.275 -32.440 9.509 1.00 45.14 C ATOM 1195 CG ARG A 75 -13.096 -32.320 8.556 1.00 1.24 C ATOM 1196 CD ARG A 75 -12.808 -33.639 7.857 1.00 73.03 C ATOM 1197 NE ARG A 75 -12.342 -34.662 8.788 1.00 20.53 N ATOM 1198 CZ ARG A 75 -12.017 -35.897 8.421 1.00 22.03 C ATOM 1199 NH1 ARG A 75 -12.106 -36.259 7.149 1.00 34.31 N ATOM 1200 NH2 ARG A 75 -11.600 -36.772 9.328 1.00 75.01 N ATOM 0 H ARG A 75 -15.244 -30.558 8.233 1.00 12.44 H new ATOM 0 HA ARG A 75 -15.380 -31.315 10.969 1.00 10.13 H new ATOM 0 HB2 ARG A 75 -14.032 -33.166 10.285 1.00 45.14 H new ATOM 0 HB3 ARG A 75 -15.134 -32.832 8.964 1.00 45.14 H new ATOM 0 HG2 ARG A 75 -13.305 -31.551 7.812 1.00 1.24 H new ATOM 0 HG3 ARG A 75 -12.212 -31.999 9.107 1.00 1.24 H new ATOM 0 HD2 ARG A 75 -13.711 -33.989 7.357 1.00 73.03 H new ATOM 0 HD3 ARG A 75 -12.056 -33.483 7.084 1.00 73.03 H new ATOM 0 HE ARG A 75 -12.261 -34.415 9.774 1.00 20.53 H new ATOM 0 HH11 ARG A 75 -12.425 -35.589 6.449 1.00 34.31 H new ATOM 0 HH12 ARG A 75 -11.856 -37.208 6.870 1.00 34.31 H new ATOM 0 HH21 ARG A 75 -11.529 -36.496 10.308 1.00 75.01 H new ATOM 0 HH22 ARG A 75 -11.351 -37.720 9.045 1.00 75.01 H new ATOM 1214 N LEU A 76 -12.655 -29.783 9.932 1.00 43.43 N ATOM 1215 CA LEU A 76 -11.445 -29.103 10.383 1.00 70.33 C ATOM 1216 C LEU A 76 -11.790 -27.847 11.177 1.00 64.42 C ATOM 1217 O LEU A 76 -11.080 -27.479 12.113 1.00 13.02 O ATOM 1218 CB LEU A 76 -10.565 -28.738 9.186 1.00 71.31 C ATOM 1219 CG LEU A 76 -10.795 -27.353 8.581 1.00 14.22 C ATOM 1220 CD1 LEU A 76 -10.028 -26.296 9.360 1.00 32.04 C ATOM 1221 CD2 LEU A 76 -10.389 -27.337 7.115 1.00 51.32 C ATOM 0 H LEU A 76 -12.840 -29.695 8.933 1.00 43.43 H new ATOM 0 HA LEU A 76 -10.897 -29.783 11.035 1.00 70.33 H new ATOM 0 HB2 LEU A 76 -9.521 -28.810 9.493 1.00 71.31 H new ATOM 0 HB3 LEU A 76 -10.720 -29.483 8.406 1.00 71.31 H new ATOM 0 HG LEU A 76 -11.858 -27.122 8.645 1.00 14.22 H new ATOM 0 HD11 LEU A 76 -10.204 -25.317 8.915 1.00 32.04 H new ATOM 0 HD12 LEU A 76 -10.367 -26.290 10.396 1.00 32.04 H new ATOM 0 HD13 LEU A 76 -8.962 -26.523 9.329 1.00 32.04 H new ATOM 0 HD21 LEU A 76 -10.560 -26.343 6.701 1.00 51.32 H new ATOM 0 HD22 LEU A 76 -9.332 -27.590 7.027 1.00 51.32 H new ATOM 0 HD23 LEU A 76 -10.984 -28.066 6.565 1.00 51.32 H new ATOM 1233 N ARG A 77 -12.884 -27.196 10.798 1.00 40.53 N ATOM 1234 CA ARG A 77 -13.323 -25.982 11.475 1.00 13.40 C ATOM 1235 C ARG A 77 -13.690 -26.272 12.928 1.00 50.25 C ATOM 1236 O ARG A 77 -13.275 -25.555 13.838 1.00 0.01 O ATOM 1237 CB ARG A 77 -14.523 -25.372 10.747 1.00 3.42 C ATOM 1238 CG ARG A 77 -15.129 -24.178 11.467 1.00 72.02 C ATOM 1239 CD ARG A 77 -16.262 -24.600 12.390 1.00 65.43 C ATOM 1240 NE ARG A 77 -17.105 -23.472 12.773 1.00 12.41 N ATOM 1241 CZ ARG A 77 -18.220 -23.596 13.485 1.00 5.44 C ATOM 1242 NH1 ARG A 77 -18.622 -24.792 13.890 1.00 60.40 N ATOM 1243 NH2 ARG A 77 -18.934 -22.521 13.795 1.00 44.12 N ATOM 0 H ARG A 77 -13.483 -27.489 10.026 1.00 40.53 H new ATOM 0 HA ARG A 77 -12.498 -25.270 11.462 1.00 13.40 H new ATOM 0 HB2 ARG A 77 -14.213 -25.065 9.748 1.00 3.42 H new ATOM 0 HB3 ARG A 77 -15.289 -26.137 10.622 1.00 3.42 H new ATOM 0 HG2 ARG A 77 -14.357 -23.670 12.045 1.00 72.02 H new ATOM 0 HG3 ARG A 77 -15.502 -23.461 10.735 1.00 72.02 H new ATOM 0 HD2 ARG A 77 -16.871 -25.356 11.894 1.00 65.43 H new ATOM 0 HD3 ARG A 77 -15.847 -25.063 13.285 1.00 65.43 H new ATOM 0 HE ARG A 77 -16.823 -22.537 12.478 1.00 12.41 H new ATOM 0 HH11 ARG A 77 -18.075 -25.620 13.655 1.00 60.40 H new ATOM 0 HH12 ARG A 77 -19.478 -24.884 14.436 1.00 60.40 H new ATOM 0 HH21 ARG A 77 -18.627 -21.598 13.487 1.00 44.12 H new ATOM 0 HH22 ARG A 77 -19.790 -22.617 14.342 1.00 44.12 H new ATOM 1257 N SER A 78 -14.471 -27.327 13.136 1.00 63.21 N ATOM 1258 CA SER A 78 -14.897 -27.710 14.477 1.00 50.22 C ATOM 1259 C SER A 78 -13.804 -28.500 15.190 1.00 61.34 C ATOM 1260 O SER A 78 -13.996 -28.980 16.307 1.00 72.41 O ATOM 1261 CB SER A 78 -16.181 -28.539 14.410 1.00 63.55 C ATOM 1262 OG SER A 78 -16.632 -28.888 15.707 1.00 4.51 O ATOM 0 H SER A 78 -14.822 -27.932 12.393 1.00 63.21 H new ATOM 0 HA SER A 78 -15.090 -26.799 15.044 1.00 50.22 H new ATOM 0 HB2 SER A 78 -16.956 -27.974 13.892 1.00 63.55 H new ATOM 0 HB3 SER A 78 -16.004 -29.443 13.828 1.00 63.55 H new ATOM 0 HG SER A 78 -15.861 -29.009 16.300 1.00 4.51 H new ATOM 1268 N LYS A 79 -12.655 -28.632 14.535 1.00 52.41 N ATOM 1269 CA LYS A 79 -11.529 -29.362 15.104 1.00 61.21 C ATOM 1270 C LYS A 79 -10.668 -28.447 15.969 1.00 61.12 C ATOM 1271 O LYS A 79 -10.007 -28.902 16.903 1.00 15.02 O ATOM 1272 CB LYS A 79 -10.679 -29.977 13.990 1.00 24.52 C ATOM 1273 CG LYS A 79 -10.762 -31.493 13.927 1.00 14.35 C ATOM 1274 CD LYS A 79 -9.933 -32.050 12.783 1.00 24.32 C ATOM 1275 CE LYS A 79 -8.448 -32.043 13.116 1.00 54.53 C ATOM 1276 NZ LYS A 79 -7.651 -32.798 12.110 1.00 2.41 N ATOM 0 H LYS A 79 -12.480 -28.242 13.609 1.00 52.41 H new ATOM 0 HA LYS A 79 -11.925 -30.159 15.733 1.00 61.21 H new ATOM 0 HB2 LYS A 79 -10.996 -29.564 13.032 1.00 24.52 H new ATOM 0 HB3 LYS A 79 -9.639 -29.684 14.134 1.00 24.52 H new ATOM 0 HG2 LYS A 79 -10.414 -31.917 14.869 1.00 14.35 H new ATOM 0 HG3 LYS A 79 -11.802 -31.797 13.805 1.00 14.35 H new ATOM 0 HD2 LYS A 79 -10.253 -33.068 12.563 1.00 24.32 H new ATOM 0 HD3 LYS A 79 -10.108 -31.459 11.884 1.00 24.32 H new ATOM 0 HE2 LYS A 79 -8.091 -31.014 13.164 1.00 54.53 H new ATOM 0 HE3 LYS A 79 -8.295 -32.480 14.103 1.00 54.53 H new ATOM 0 HZ1 LYS A 79 -6.747 -33.092 12.533 1.00 2.41 H new ATOM 0 HZ2 LYS A 79 -8.182 -33.640 11.807 1.00 2.41 H new ATOM 0 HZ3 LYS A 79 -7.466 -32.190 11.286 1.00 2.41 H new ATOM 1290 N ILE A 80 -10.681 -27.157 15.652 1.00 12.21 N ATOM 1291 CA ILE A 80 -9.903 -26.179 16.402 1.00 14.44 C ATOM 1292 C ILE A 80 -10.539 -24.795 16.325 1.00 14.24 C ATOM 1293 O ILE A 80 -10.673 -24.105 17.336 1.00 13.31 O ATOM 1294 CB ILE A 80 -8.455 -26.095 15.886 1.00 60.13 C ATOM 1295 CG1 ILE A 80 -7.718 -24.933 16.554 1.00 12.42 C ATOM 1296 CG2 ILE A 80 -8.441 -25.938 14.373 1.00 64.35 C ATOM 1297 CD1 ILE A 80 -7.714 -25.009 18.065 1.00 53.50 C ATOM 0 H ILE A 80 -11.222 -26.765 14.881 1.00 12.21 H new ATOM 0 HA ILE A 80 -9.891 -26.514 17.439 1.00 14.44 H new ATOM 0 HB ILE A 80 -7.940 -27.021 16.141 1.00 60.13 H new ATOM 0 HG12 ILE A 80 -6.688 -24.913 16.197 1.00 12.42 H new ATOM 0 HG13 ILE A 80 -8.181 -23.995 16.247 1.00 12.42 H new ATOM 0 HG21 ILE A 80 -7.410 -25.880 14.023 1.00 64.35 H new ATOM 0 HG22 ILE A 80 -8.933 -26.796 13.914 1.00 64.35 H new ATOM 0 HG23 ILE A 80 -8.970 -25.026 14.097 1.00 64.35 H new ATOM 0 HD11 ILE A 80 -7.174 -24.153 18.471 1.00 53.50 H new ATOM 0 HD12 ILE A 80 -8.740 -24.998 18.433 1.00 53.50 H new ATOM 0 HD13 ILE A 80 -7.225 -25.930 18.382 1.00 53.50 H new ATOM 1309 N ASP A 81 -10.931 -24.396 15.120 1.00 30.12 N ATOM 1310 CA ASP A 81 -11.556 -23.095 14.911 1.00 72.31 C ATOM 1311 C ASP A 81 -12.844 -22.975 15.720 1.00 41.20 C ATOM 1312 O ASP A 81 -13.327 -21.872 15.976 1.00 1.30 O ATOM 1313 CB ASP A 81 -11.851 -22.880 13.425 1.00 25.25 C ATOM 1314 CG ASP A 81 -10.669 -23.234 12.544 1.00 1.10 C ATOM 1315 OD1 ASP A 81 -9.519 -23.095 13.010 1.00 1.22 O ATOM 1316 OD2 ASP A 81 -10.894 -23.649 11.388 1.00 40.13 O ATOM 0 H ASP A 81 -10.827 -24.955 14.273 1.00 30.12 H new ATOM 0 HA ASP A 81 -10.861 -22.327 15.251 1.00 72.31 H new ATOM 0 HB2 ASP A 81 -12.710 -23.486 13.137 1.00 25.25 H new ATOM 0 HB3 ASP A 81 -12.125 -21.838 13.259 1.00 25.25 H new ATOM 1321 N ASP A 82 -13.395 -24.116 16.118 1.00 10.04 N ATOM 1322 CA ASP A 82 -14.627 -24.139 16.898 1.00 0.34 C ATOM 1323 C ASP A 82 -14.509 -23.241 18.126 1.00 15.31 C ATOM 1324 O ASP A 82 -15.501 -22.683 18.596 1.00 1.34 O ATOM 1325 CB ASP A 82 -14.958 -25.569 17.327 1.00 20.02 C ATOM 1326 CG ASP A 82 -16.400 -25.940 17.042 1.00 11.23 C ATOM 1327 OD1 ASP A 82 -16.876 -25.656 15.923 1.00 70.01 O ATOM 1328 OD2 ASP A 82 -17.053 -26.514 17.938 1.00 24.44 O ATOM 0 H ASP A 82 -13.008 -25.037 15.913 1.00 10.04 H new ATOM 0 HA ASP A 82 -15.433 -23.761 16.269 1.00 0.34 H new ATOM 0 HB2 ASP A 82 -14.298 -26.263 16.807 1.00 20.02 H new ATOM 0 HB3 ASP A 82 -14.761 -25.680 18.393 1.00 20.02 H new ATOM 1333 N ASP A 83 -13.292 -23.107 18.640 1.00 30.15 N ATOM 1334 CA ASP A 83 -13.045 -22.277 19.814 1.00 64.13 C ATOM 1335 C ASP A 83 -11.819 -21.392 19.605 1.00 75.42 C ATOM 1336 O ASP A 83 -11.052 -21.147 20.536 1.00 50.13 O ATOM 1337 CB ASP A 83 -12.851 -23.153 21.053 1.00 55.42 C ATOM 1338 CG ASP A 83 -12.951 -22.361 22.342 1.00 25.21 C ATOM 1339 OD1 ASP A 83 -14.005 -21.734 22.574 1.00 53.41 O ATOM 1340 OD2 ASP A 83 -11.974 -22.370 23.120 1.00 63.23 O ATOM 0 H ASP A 83 -12.461 -23.562 18.263 1.00 30.15 H new ATOM 0 HA ASP A 83 -13.913 -21.636 19.964 1.00 64.13 H new ATOM 0 HB2 ASP A 83 -13.601 -23.944 21.057 1.00 55.42 H new ATOM 0 HB3 ASP A 83 -11.876 -23.638 21.003 1.00 55.42 H new ATOM 1345 N PHE A 84 -11.642 -20.917 18.377 1.00 63.04 N ATOM 1346 CA PHE A 84 -10.509 -20.061 18.045 1.00 64.23 C ATOM 1347 C PHE A 84 -10.943 -18.910 17.143 1.00 43.44 C ATOM 1348 O PHE A 84 -10.511 -17.771 17.321 1.00 23.44 O ATOM 1349 CB PHE A 84 -9.411 -20.876 17.358 1.00 62.12 C ATOM 1350 CG PHE A 84 -8.022 -20.423 17.705 1.00 5.10 C ATOM 1351 CD1 PHE A 84 -7.624 -19.118 17.463 1.00 45.01 C ATOM 1352 CD2 PHE A 84 -7.114 -21.302 18.274 1.00 1.51 C ATOM 1353 CE1 PHE A 84 -6.346 -18.699 17.781 1.00 45.32 C ATOM 1354 CE2 PHE A 84 -5.835 -20.888 18.595 1.00 45.25 C ATOM 1355 CZ PHE A 84 -5.450 -19.584 18.348 1.00 33.34 C ATOM 0 H PHE A 84 -12.268 -21.110 17.595 1.00 63.04 H new ATOM 0 HA PHE A 84 -10.116 -19.644 18.973 1.00 64.23 H new ATOM 0 HB2 PHE A 84 -9.522 -21.925 17.633 1.00 62.12 H new ATOM 0 HB3 PHE A 84 -9.546 -20.814 16.278 1.00 62.12 H new ATOM 0 HD1 PHE A 84 -8.320 -18.421 17.021 1.00 45.01 H new ATOM 0 HD2 PHE A 84 -7.409 -22.322 18.469 1.00 1.51 H new ATOM 0 HE1 PHE A 84 -6.048 -17.679 17.586 1.00 45.32 H new ATOM 0 HE2 PHE A 84 -5.137 -21.583 19.038 1.00 45.25 H new ATOM 0 HZ PHE A 84 -4.451 -19.258 18.598 1.00 33.34 H new ATOM 1365 N GLU A 85 -11.799 -19.216 16.173 1.00 13.42 N ATOM 1366 CA GLU A 85 -12.291 -18.207 15.242 1.00 4.52 C ATOM 1367 C GLU A 85 -13.770 -18.423 14.936 1.00 63.33 C ATOM 1368 O GLU A 85 -14.318 -19.508 15.132 1.00 63.34 O ATOM 1369 CB GLU A 85 -11.480 -18.239 13.945 1.00 24.22 C ATOM 1370 CG GLU A 85 -10.210 -17.406 14.000 1.00 52.11 C ATOM 1371 CD GLU A 85 -10.492 -15.916 14.039 1.00 25.31 C ATOM 1372 OE1 GLU A 85 -10.679 -15.378 15.150 1.00 14.22 O ATOM 1373 OE2 GLU A 85 -10.524 -15.289 12.960 1.00 71.53 O ATOM 0 H GLU A 85 -12.166 -20.154 16.011 1.00 13.42 H new ATOM 0 HA GLU A 85 -12.174 -17.230 15.711 1.00 4.52 H new ATOM 0 HB2 GLU A 85 -11.217 -19.272 13.716 1.00 24.22 H new ATOM 0 HB3 GLU A 85 -12.105 -17.880 13.127 1.00 24.22 H new ATOM 0 HG2 GLU A 85 -9.634 -17.686 14.882 1.00 52.11 H new ATOM 0 HG3 GLU A 85 -9.593 -17.633 13.131 1.00 52.11 H new ATOM 1380 N PRO A 86 -14.433 -17.366 14.443 1.00 24.24 N ATOM 1381 CA PRO A 86 -15.857 -17.415 14.099 1.00 23.12 C ATOM 1382 C PRO A 86 -16.127 -18.280 12.873 1.00 53.23 C ATOM 1383 O PRO A 86 -15.239 -18.978 12.384 1.00 43.11 O ATOM 1384 CB PRO A 86 -16.202 -15.952 13.809 1.00 61.41 C ATOM 1385 CG PRO A 86 -14.911 -15.333 13.399 1.00 43.34 C ATOM 1386 CD PRO A 86 -13.843 -16.042 14.184 1.00 22.14 C ATOM 0 HA PRO A 86 -16.454 -17.858 14.896 1.00 23.12 H new ATOM 0 HB2 PRO A 86 -16.949 -15.870 13.019 1.00 61.41 H new ATOM 0 HB3 PRO A 86 -16.615 -15.460 14.690 1.00 61.41 H new ATOM 0 HG2 PRO A 86 -14.747 -15.446 12.327 1.00 43.34 H new ATOM 0 HG3 PRO A 86 -14.906 -14.264 13.611 1.00 43.34 H new ATOM 0 HD2 PRO A 86 -12.914 -16.120 13.619 1.00 22.14 H new ATOM 0 HD3 PRO A 86 -13.610 -15.517 15.111 1.00 22.14 H new ATOM 1394 N LYS A 87 -17.360 -18.229 12.379 1.00 43.21 N ATOM 1395 CA LYS A 87 -17.748 -19.006 11.208 1.00 40.12 C ATOM 1396 C LYS A 87 -17.663 -18.160 9.941 1.00 23.41 C ATOM 1397 O LYS A 87 -18.624 -17.487 9.566 1.00 63.43 O ATOM 1398 CB LYS A 87 -19.169 -19.547 11.378 1.00 73.23 C ATOM 1399 CG LYS A 87 -20.178 -18.489 11.789 1.00 11.21 C ATOM 1400 CD LYS A 87 -21.504 -18.672 11.069 1.00 24.22 C ATOM 1401 CE LYS A 87 -21.478 -18.042 9.685 1.00 12.33 C ATOM 1402 NZ LYS A 87 -21.308 -16.564 9.752 1.00 2.21 N ATOM 0 H LYS A 87 -18.108 -17.657 12.772 1.00 43.21 H new ATOM 0 HA LYS A 87 -17.056 -19.843 11.112 1.00 40.12 H new ATOM 0 HB2 LYS A 87 -19.491 -19.999 10.440 1.00 73.23 H new ATOM 0 HB3 LYS A 87 -19.160 -20.339 12.127 1.00 73.23 H new ATOM 0 HG2 LYS A 87 -20.338 -18.537 12.866 1.00 11.21 H new ATOM 0 HG3 LYS A 87 -19.778 -17.499 11.570 1.00 11.21 H new ATOM 0 HD2 LYS A 87 -21.728 -19.735 10.982 1.00 24.22 H new ATOM 0 HD3 LYS A 87 -22.304 -18.225 11.659 1.00 24.22 H new ATOM 0 HE2 LYS A 87 -20.664 -18.475 9.104 1.00 12.33 H new ATOM 0 HE3 LYS A 87 -22.404 -18.278 9.161 1.00 12.33 H new ATOM 0 HZ1 LYS A 87 -21.807 -16.121 8.955 1.00 2.21 H new ATOM 0 HZ2 LYS A 87 -21.702 -16.210 10.647 1.00 2.21 H new ATOM 0 HZ3 LYS A 87 -20.296 -16.328 9.701 1.00 2.21 H new ATOM 1416 N LEU A 88 -16.508 -18.200 9.285 1.00 31.34 N ATOM 1417 CA LEU A 88 -16.298 -17.439 8.059 1.00 0.30 C ATOM 1418 C LEU A 88 -16.711 -18.251 6.836 1.00 74.00 C ATOM 1419 O LEU A 88 -16.832 -17.715 5.734 1.00 4.52 O ATOM 1420 CB LEU A 88 -14.831 -17.024 7.938 1.00 65.11 C ATOM 1421 CG LEU A 88 -14.312 -16.069 9.014 1.00 62.42 C ATOM 1422 CD1 LEU A 88 -13.952 -16.834 10.278 1.00 34.50 C ATOM 1423 CD2 LEU A 88 -13.110 -15.290 8.500 1.00 11.44 C ATOM 0 H LEU A 88 -15.703 -18.751 9.582 1.00 31.34 H new ATOM 0 HA LEU A 88 -16.920 -16.545 8.105 1.00 0.30 H new ATOM 0 HB2 LEU A 88 -14.217 -17.925 7.953 1.00 65.11 H new ATOM 0 HB3 LEU A 88 -14.686 -16.556 6.964 1.00 65.11 H new ATOM 0 HG LEU A 88 -15.104 -15.360 9.256 1.00 62.42 H new ATOM 0 HD11 LEU A 88 -13.585 -16.138 11.032 1.00 34.50 H new ATOM 0 HD12 LEU A 88 -14.836 -17.347 10.657 1.00 34.50 H new ATOM 0 HD13 LEU A 88 -13.177 -17.566 10.052 1.00 34.50 H new ATOM 0 HD21 LEU A 88 -12.754 -14.615 9.278 1.00 11.44 H new ATOM 0 HD22 LEU A 88 -12.315 -15.985 8.230 1.00 11.44 H new ATOM 0 HD23 LEU A 88 -13.400 -14.711 7.623 1.00 11.44 H new ATOM 1435 N ILE A 89 -16.929 -19.546 7.038 1.00 33.04 N ATOM 1436 CA ILE A 89 -17.333 -20.431 5.953 1.00 64.12 C ATOM 1437 C ILE A 89 -18.687 -20.021 5.384 1.00 62.51 C ATOM 1438 O ILE A 89 -19.715 -20.144 6.050 1.00 11.55 O ATOM 1439 CB ILE A 89 -17.407 -21.897 6.419 1.00 4.15 C ATOM 1440 CG1 ILE A 89 -16.074 -22.326 7.038 1.00 74.04 C ATOM 1441 CG2 ILE A 89 -17.774 -22.805 5.256 1.00 62.43 C ATOM 1442 CD1 ILE A 89 -16.146 -23.648 7.770 1.00 0.52 C ATOM 0 H ILE A 89 -16.833 -20.006 7.943 1.00 33.04 H new ATOM 0 HA ILE A 89 -16.574 -20.344 5.176 1.00 64.12 H new ATOM 0 HB ILE A 89 -18.183 -21.982 7.179 1.00 4.15 H new ATOM 0 HG12 ILE A 89 -15.323 -22.396 6.251 1.00 74.04 H new ATOM 0 HG13 ILE A 89 -15.739 -21.554 7.731 1.00 74.04 H new ATOM 0 HG21 ILE A 89 -17.822 -23.838 5.602 1.00 62.43 H new ATOM 0 HG22 ILE A 89 -18.744 -22.510 4.857 1.00 62.43 H new ATOM 0 HG23 ILE A 89 -17.019 -22.719 4.475 1.00 62.43 H new ATOM 0 HD11 ILE A 89 -15.166 -23.889 8.183 1.00 0.52 H new ATOM 0 HD12 ILE A 89 -16.873 -23.577 8.579 1.00 0.52 H new ATOM 0 HD13 ILE A 89 -16.450 -24.432 7.076 1.00 0.52 H new ATOM 1454 N HIS A 90 -18.680 -19.536 4.146 1.00 35.43 N ATOM 1455 CA HIS A 90 -19.909 -19.111 3.486 1.00 53.24 C ATOM 1456 C HIS A 90 -20.016 -19.721 2.091 1.00 2.13 C ATOM 1457 O HIS A 90 -19.027 -19.807 1.362 1.00 72.10 O ATOM 1458 CB HIS A 90 -19.961 -17.586 3.393 1.00 55.51 C ATOM 1459 CG HIS A 90 -20.487 -16.928 4.632 1.00 51.24 C ATOM 1460 ND1 HIS A 90 -21.778 -17.099 5.084 1.00 13.34 N ATOM 1461 CD2 HIS A 90 -19.887 -16.096 5.515 1.00 31.11 C ATOM 1462 CE1 HIS A 90 -21.950 -16.399 6.192 1.00 74.22 C ATOM 1463 NE2 HIS A 90 -20.818 -15.782 6.475 1.00 45.10 N ATOM 0 H HIS A 90 -17.838 -19.428 3.581 1.00 35.43 H new ATOM 0 HA HIS A 90 -20.752 -19.461 4.082 1.00 53.24 H new ATOM 0 HB2 HIS A 90 -18.959 -17.208 3.188 1.00 55.51 H new ATOM 0 HB3 HIS A 90 -20.588 -17.303 2.547 1.00 55.51 H new ATOM 0 HD2 HIS A 90 -18.867 -15.745 5.473 1.00 31.11 H new ATOM 0 HE1 HIS A 90 -22.862 -16.342 6.768 1.00 74.22 H new ATOM 0 HE2 HIS A 90 -20.660 -15.171 7.276 1.00 45.10 H new ATOM 1471 N THR A 91 -21.222 -20.144 1.726 1.00 31.33 N ATOM 1472 CA THR A 91 -21.458 -20.748 0.421 1.00 64.11 C ATOM 1473 C THR A 91 -22.606 -20.057 -0.305 1.00 60.14 C ATOM 1474 O THR A 91 -23.706 -19.928 0.232 1.00 2.14 O ATOM 1475 CB THR A 91 -21.774 -22.250 0.546 1.00 70.43 C ATOM 1476 OG1 THR A 91 -20.600 -22.967 0.945 1.00 12.22 O ATOM 1477 CG2 THR A 91 -22.289 -22.806 -0.773 1.00 72.33 C ATOM 0 H THR A 91 -22.051 -20.079 2.317 1.00 31.33 H new ATOM 0 HA THR A 91 -20.541 -20.624 -0.155 1.00 64.11 H new ATOM 0 HB THR A 91 -22.549 -22.373 1.302 1.00 70.43 H new ATOM 0 HG1 THR A 91 -20.706 -23.916 0.725 1.00 12.22 H new ATOM 0 HG21 THR A 91 -22.505 -23.868 -0.660 1.00 72.33 H new ATOM 0 HG22 THR A 91 -23.199 -22.279 -1.060 1.00 72.33 H new ATOM 0 HG23 THR A 91 -21.532 -22.670 -1.546 1.00 72.33 H new ATOM 1485 N VAL A 92 -22.344 -19.615 -1.531 1.00 50.32 N ATOM 1486 CA VAL A 92 -23.357 -18.938 -2.332 1.00 61.15 C ATOM 1487 C VAL A 92 -24.091 -19.923 -3.236 1.00 0.32 C ATOM 1488 O VAL A 92 -23.490 -20.541 -4.115 1.00 33.14 O ATOM 1489 CB VAL A 92 -22.736 -17.827 -3.200 1.00 13.10 C ATOM 1490 CG1 VAL A 92 -23.820 -17.063 -3.945 1.00 12.43 C ATOM 1491 CG2 VAL A 92 -21.902 -16.887 -2.344 1.00 2.54 C ATOM 0 H VAL A 92 -21.439 -19.714 -1.991 1.00 50.32 H new ATOM 0 HA VAL A 92 -24.066 -18.491 -1.635 1.00 61.15 H new ATOM 0 HB VAL A 92 -22.079 -18.289 -3.937 1.00 13.10 H new ATOM 0 HG11 VAL A 92 -23.363 -16.282 -4.553 1.00 12.43 H new ATOM 0 HG12 VAL A 92 -24.371 -17.748 -4.589 1.00 12.43 H new ATOM 0 HG13 VAL A 92 -24.504 -16.610 -3.228 1.00 12.43 H new ATOM 0 HG21 VAL A 92 -21.471 -16.108 -2.973 1.00 2.54 H new ATOM 0 HG22 VAL A 92 -22.535 -16.430 -1.583 1.00 2.54 H new ATOM 0 HG23 VAL A 92 -21.102 -17.448 -1.861 1.00 2.54 H new ATOM 1501 N ARG A 93 -25.394 -20.063 -3.014 1.00 2.23 N ATOM 1502 CA ARG A 93 -26.211 -20.973 -3.807 1.00 65.13 C ATOM 1503 C ARG A 93 -26.032 -20.704 -5.299 1.00 12.44 C ATOM 1504 O ARG A 93 -26.585 -19.746 -5.837 1.00 51.32 O ATOM 1505 CB ARG A 93 -27.685 -20.833 -3.426 1.00 34.33 C ATOM 1506 CG ARG A 93 -28.149 -19.391 -3.305 1.00 11.14 C ATOM 1507 CD ARG A 93 -29.632 -19.255 -3.613 1.00 1.30 C ATOM 1508 NE ARG A 93 -29.923 -19.505 -5.022 1.00 32.30 N ATOM 1509 CZ ARG A 93 -31.147 -19.717 -5.493 1.00 51.31 C ATOM 1510 NH1 ARG A 93 -32.188 -19.707 -4.672 1.00 21.41 N ATOM 1511 NH2 ARG A 93 -31.332 -19.938 -6.788 1.00 43.44 N ATOM 0 H ARG A 93 -25.906 -19.558 -2.291 1.00 2.23 H new ATOM 0 HA ARG A 93 -25.884 -21.991 -3.597 1.00 65.13 H new ATOM 0 HB2 ARG A 93 -28.294 -21.340 -4.174 1.00 34.33 H new ATOM 0 HB3 ARG A 93 -27.856 -21.342 -2.477 1.00 34.33 H new ATOM 0 HG2 ARG A 93 -27.951 -19.027 -2.297 1.00 11.14 H new ATOM 0 HG3 ARG A 93 -27.575 -18.765 -3.988 1.00 11.14 H new ATOM 0 HD2 ARG A 93 -30.196 -19.955 -2.997 1.00 1.30 H new ATOM 0 HD3 ARG A 93 -29.967 -18.253 -3.346 1.00 1.30 H new ATOM 0 HE ARG A 93 -29.144 -19.518 -5.680 1.00 32.30 H new ATOM 0 HH11 ARG A 93 -32.050 -19.536 -3.676 1.00 21.41 H new ATOM 0 HH12 ARG A 93 -33.127 -19.870 -5.037 1.00 21.41 H new ATOM 0 HH21 ARG A 93 -30.534 -19.945 -7.423 1.00 43.44 H new ATOM 0 HH22 ARG A 93 -32.272 -20.101 -7.148 1.00 43.44 H new ATOM 1525 N GLY A 94 -25.255 -21.556 -5.960 1.00 72.02 N ATOM 1526 CA GLY A 94 -25.017 -21.392 -7.382 1.00 72.44 C ATOM 1527 C GLY A 94 -23.618 -20.892 -7.682 1.00 53.33 C ATOM 1528 O GLY A 94 -23.395 -20.218 -8.687 1.00 53.44 O ATOM 0 H GLY A 94 -24.786 -22.357 -5.536 1.00 72.02 H new ATOM 0 HA2 GLY A 94 -25.174 -22.346 -7.886 1.00 72.44 H new ATOM 0 HA3 GLY A 94 -25.745 -20.691 -7.791 1.00 72.44 H new ATOM 1532 N ALA A 95 -22.674 -21.220 -6.807 1.00 64.43 N ATOM 1533 CA ALA A 95 -21.289 -20.800 -6.984 1.00 12.23 C ATOM 1534 C ALA A 95 -20.323 -21.878 -6.506 1.00 64.45 C ATOM 1535 O ALA A 95 -19.719 -22.585 -7.312 1.00 45.03 O ATOM 1536 CB ALA A 95 -21.035 -19.496 -6.243 1.00 13.55 C ATOM 0 H ALA A 95 -22.843 -21.775 -5.968 1.00 64.43 H new ATOM 0 HA ALA A 95 -21.117 -20.641 -8.048 1.00 12.23 H new ATOM 0 HB1 ALA A 95 -19.997 -19.194 -6.384 1.00 13.55 H new ATOM 0 HB2 ALA A 95 -21.695 -18.721 -6.634 1.00 13.55 H new ATOM 0 HB3 ALA A 95 -21.231 -19.637 -5.180 1.00 13.55 H new ATOM 1542 N GLY A 96 -20.181 -21.999 -5.190 1.00 24.21 N ATOM 1543 CA GLY A 96 -19.285 -22.994 -4.628 1.00 51.45 C ATOM 1544 C GLY A 96 -19.040 -22.783 -3.147 1.00 74.24 C ATOM 1545 O GLY A 96 -19.875 -23.141 -2.316 1.00 54.22 O ATOM 0 H GLY A 96 -20.670 -21.426 -4.502 1.00 24.21 H new ATOM 0 HA2 GLY A 96 -19.705 -23.987 -4.786 1.00 51.45 H new ATOM 0 HA3 GLY A 96 -18.333 -22.963 -5.159 1.00 51.45 H new ATOM 1549 N TYR A 97 -17.892 -22.203 -2.816 1.00 34.02 N ATOM 1550 CA TYR A 97 -17.538 -21.949 -1.424 1.00 72.44 C ATOM 1551 C TYR A 97 -16.625 -20.733 -1.308 1.00 1.22 C ATOM 1552 O TYR A 97 -15.764 -20.504 -2.158 1.00 30.34 O ATOM 1553 CB TYR A 97 -16.853 -23.176 -0.819 1.00 43.51 C ATOM 1554 CG TYR A 97 -17.755 -23.993 0.077 1.00 33.10 C ATOM 1555 CD1 TYR A 97 -18.608 -24.953 -0.453 1.00 34.24 C ATOM 1556 CD2 TYR A 97 -17.754 -23.806 1.454 1.00 40.01 C ATOM 1557 CE1 TYR A 97 -19.435 -25.702 0.362 1.00 12.25 C ATOM 1558 CE2 TYR A 97 -18.576 -24.551 2.277 1.00 73.01 C ATOM 1559 CZ TYR A 97 -19.415 -25.497 1.726 1.00 34.24 C ATOM 1560 OH TYR A 97 -20.236 -26.242 2.542 1.00 54.12 O ATOM 0 H TYR A 97 -17.191 -21.900 -3.492 1.00 34.02 H new ATOM 0 HA TYR A 97 -18.456 -21.745 -0.873 1.00 72.44 H new ATOM 0 HB2 TYR A 97 -16.485 -23.810 -1.625 1.00 43.51 H new ATOM 0 HB3 TYR A 97 -15.984 -22.851 -0.247 1.00 43.51 H new ATOM 0 HD1 TYR A 97 -18.625 -25.117 -1.520 1.00 34.24 H new ATOM 0 HD2 TYR A 97 -17.099 -23.065 1.888 1.00 40.01 H new ATOM 0 HE1 TYR A 97 -20.093 -26.444 -0.066 1.00 12.25 H new ATOM 0 HE2 TYR A 97 -18.562 -24.394 3.345 1.00 73.01 H new ATOM 0 HH TYR A 97 -19.717 -26.594 3.295 1.00 54.12 H new ATOM 1570 N VAL A 98 -16.819 -19.955 -0.248 1.00 11.34 N ATOM 1571 CA VAL A 98 -16.013 -18.762 -0.017 1.00 20.02 C ATOM 1572 C VAL A 98 -15.979 -18.399 1.464 1.00 74.54 C ATOM 1573 O VAL A 98 -16.831 -18.834 2.240 1.00 21.32 O ATOM 1574 CB VAL A 98 -16.548 -17.559 -0.817 1.00 32.45 C ATOM 1575 CG1 VAL A 98 -17.816 -17.015 -0.177 1.00 54.43 C ATOM 1576 CG2 VAL A 98 -15.486 -16.475 -0.922 1.00 73.21 C ATOM 0 H VAL A 98 -17.528 -20.130 0.465 1.00 11.34 H new ATOM 0 HA VAL A 98 -15.003 -18.993 -0.355 1.00 20.02 H new ATOM 0 HB VAL A 98 -16.793 -17.894 -1.825 1.00 32.45 H new ATOM 0 HG11 VAL A 98 -18.180 -16.166 -0.755 1.00 54.43 H new ATOM 0 HG12 VAL A 98 -18.578 -17.795 -0.159 1.00 54.43 H new ATOM 0 HG13 VAL A 98 -17.600 -16.694 0.842 1.00 54.43 H new ATOM 0 HG21 VAL A 98 -15.881 -15.633 -1.490 1.00 73.21 H new ATOM 0 HG22 VAL A 98 -15.208 -16.140 0.077 1.00 73.21 H new ATOM 0 HG23 VAL A 98 -14.607 -16.874 -1.428 1.00 73.21 H new ATOM 1586 N LEU A 99 -14.991 -17.600 1.849 1.00 62.12 N ATOM 1587 CA LEU A 99 -14.846 -17.177 3.238 1.00 64.45 C ATOM 1588 C LEU A 99 -15.165 -15.694 3.391 1.00 12.14 C ATOM 1589 O LEU A 99 -14.978 -14.910 2.462 1.00 51.31 O ATOM 1590 CB LEU A 99 -13.425 -17.459 3.731 1.00 13.30 C ATOM 1591 CG LEU A 99 -12.312 -17.309 2.693 1.00 12.34 C ATOM 1592 CD1 LEU A 99 -12.282 -15.891 2.144 1.00 71.01 C ATOM 1593 CD2 LEU A 99 -10.966 -17.677 3.299 1.00 45.30 C ATOM 0 H LEU A 99 -14.278 -17.232 1.219 1.00 62.12 H new ATOM 0 HA LEU A 99 -15.553 -17.746 3.842 1.00 64.45 H new ATOM 0 HB2 LEU A 99 -13.211 -16.788 4.563 1.00 13.30 H new ATOM 0 HB3 LEU A 99 -13.393 -18.475 4.124 1.00 13.30 H new ATOM 0 HG LEU A 99 -12.516 -17.992 1.868 1.00 12.34 H new ATOM 0 HD11 LEU A 99 -11.484 -15.803 1.407 1.00 71.01 H new ATOM 0 HD12 LEU A 99 -13.238 -15.663 1.673 1.00 71.01 H new ATOM 0 HD13 LEU A 99 -12.103 -15.189 2.958 1.00 71.01 H new ATOM 0 HD21 LEU A 99 -10.185 -17.565 2.547 1.00 45.30 H new ATOM 0 HD22 LEU A 99 -10.755 -17.019 4.142 1.00 45.30 H new ATOM 0 HD23 LEU A 99 -10.992 -18.711 3.643 1.00 45.30 H new ATOM 1605 N GLU A 100 -15.646 -15.317 4.572 1.00 52.30 N ATOM 1606 CA GLU A 100 -15.990 -13.927 4.847 1.00 11.42 C ATOM 1607 C GLU A 100 -16.390 -13.744 6.308 1.00 30.15 C ATOM 1608 O GLU A 100 -17.206 -14.499 6.838 1.00 13.32 O ATOM 1609 CB GLU A 100 -17.130 -13.470 3.934 1.00 3.52 C ATOM 1610 CG GLU A 100 -17.381 -11.972 3.978 1.00 14.31 C ATOM 1611 CD GLU A 100 -18.636 -11.569 3.228 1.00 40.32 C ATOM 1612 OE1 GLU A 100 -18.608 -11.570 1.980 1.00 63.15 O ATOM 1613 OE2 GLU A 100 -19.646 -11.252 3.890 1.00 35.10 O ATOM 0 H GLU A 100 -15.806 -15.954 5.352 1.00 52.30 H new ATOM 0 HA GLU A 100 -15.109 -13.316 4.650 1.00 11.42 H new ATOM 0 HB2 GLU A 100 -16.903 -13.762 2.909 1.00 3.52 H new ATOM 0 HB3 GLU A 100 -18.044 -13.992 4.219 1.00 3.52 H new ATOM 0 HG2 GLU A 100 -17.464 -11.652 5.017 1.00 14.31 H new ATOM 0 HG3 GLU A 100 -16.524 -11.451 3.551 1.00 14.31 H new ATOM 1620 N ILE A 101 -15.809 -12.738 6.954 1.00 61.35 N ATOM 1621 CA ILE A 101 -16.105 -12.456 8.353 1.00 63.33 C ATOM 1622 C ILE A 101 -17.530 -11.942 8.520 1.00 13.52 C ATOM 1623 O ILE A 101 -18.289 -11.859 7.554 1.00 21.01 O ATOM 1624 CB ILE A 101 -15.125 -11.422 8.938 1.00 53.33 C ATOM 1625 CG1 ILE A 101 -15.515 -10.010 8.495 1.00 75.25 C ATOM 1626 CG2 ILE A 101 -13.700 -11.742 8.512 1.00 52.53 C ATOM 1627 CD1 ILE A 101 -15.458 -9.810 6.996 1.00 3.43 C ATOM 0 H ILE A 101 -15.131 -12.105 6.530 1.00 61.35 H new ATOM 0 HA ILE A 101 -15.995 -13.395 8.895 1.00 63.33 H new ATOM 0 HB ILE A 101 -15.177 -11.469 10.026 1.00 53.33 H new ATOM 0 HG12 ILE A 101 -16.525 -9.794 8.844 1.00 75.25 H new ATOM 0 HG13 ILE A 101 -14.851 -9.291 8.975 1.00 75.25 H new ATOM 0 HG21 ILE A 101 -13.019 -11.002 8.933 1.00 52.53 H new ATOM 0 HG22 ILE A 101 -13.426 -12.734 8.872 1.00 52.53 H new ATOM 0 HG23 ILE A 101 -13.632 -11.720 7.424 1.00 52.53 H new ATOM 0 HD11 ILE A 101 -15.747 -8.787 6.754 1.00 3.43 H new ATOM 0 HD12 ILE A 101 -14.443 -9.994 6.643 1.00 3.43 H new ATOM 0 HD13 ILE A 101 -16.143 -10.505 6.510 1.00 3.43 H new ATOM 1639 N ARG A 102 -17.887 -11.595 9.753 1.00 54.15 N ATOM 1640 CA ARG A 102 -19.222 -11.087 10.047 1.00 61.10 C ATOM 1641 C ARG A 102 -19.206 -9.568 10.191 1.00 31.11 C ATOM 1642 O ARG A 102 -20.219 -8.905 9.974 1.00 13.52 O ATOM 1643 CB ARG A 102 -19.763 -11.726 11.327 1.00 22.04 C ATOM 1644 CG ARG A 102 -20.215 -13.166 11.146 1.00 52.34 C ATOM 1645 CD ARG A 102 -20.096 -13.955 12.440 1.00 11.31 C ATOM 1646 NE ARG A 102 -21.008 -13.461 13.468 1.00 13.31 N ATOM 1647 CZ ARG A 102 -21.011 -13.901 14.721 1.00 34.32 C ATOM 1648 NH1 ARG A 102 -20.155 -14.840 15.099 1.00 3.05 N ATOM 1649 NH2 ARG A 102 -21.872 -13.402 15.599 1.00 32.41 N ATOM 0 H ARG A 102 -17.271 -11.656 10.564 1.00 54.15 H new ATOM 0 HA ARG A 102 -19.875 -11.349 9.214 1.00 61.10 H new ATOM 0 HB2 ARG A 102 -18.990 -11.691 12.095 1.00 22.04 H new ATOM 0 HB3 ARG A 102 -20.602 -11.134 11.692 1.00 22.04 H new ATOM 0 HG2 ARG A 102 -21.249 -13.183 10.802 1.00 52.34 H new ATOM 0 HG3 ARG A 102 -19.614 -13.642 10.372 1.00 52.34 H new ATOM 0 HD2 ARG A 102 -20.306 -15.006 12.244 1.00 11.31 H new ATOM 0 HD3 ARG A 102 -19.071 -13.898 12.807 1.00 11.31 H new ATOM 0 HE ARG A 102 -21.680 -12.738 13.209 1.00 13.31 H new ATOM 0 HH11 ARG A 102 -19.492 -15.226 14.427 1.00 3.05 H new ATOM 0 HH12 ARG A 102 -20.159 -15.176 16.062 1.00 3.05 H new ATOM 0 HH21 ARG A 102 -22.532 -12.680 15.312 1.00 32.41 H new ATOM 0 HH22 ARG A 102 -21.873 -13.741 16.561 1.00 32.41 H new ATOM 1663 N GLU A 103 -18.050 -9.026 10.559 1.00 4.30 N ATOM 1664 CA GLU A 103 -17.903 -7.585 10.733 1.00 33.33 C ATOM 1665 C GLU A 103 -18.207 -6.846 9.433 1.00 35.43 C ATOM 1666 O GLU A 103 -18.488 -5.648 9.440 1.00 63.20 O ATOM 1667 CB GLU A 103 -16.488 -7.248 11.206 1.00 43.54 C ATOM 1668 CG GLU A 103 -15.497 -7.054 10.070 1.00 51.12 C ATOM 1669 CD GLU A 103 -15.289 -5.593 9.720 1.00 70.22 C ATOM 1670 OE1 GLU A 103 -15.047 -4.791 10.646 1.00 44.34 O ATOM 1671 OE2 GLU A 103 -15.369 -5.253 8.521 1.00 3.42 O ATOM 0 H GLU A 103 -17.202 -9.562 10.742 1.00 4.30 H new ATOM 0 HA GLU A 103 -18.618 -7.261 11.490 1.00 33.33 H new ATOM 0 HB2 GLU A 103 -16.522 -6.339 11.807 1.00 43.54 H new ATOM 0 HB3 GLU A 103 -16.131 -8.047 11.856 1.00 43.54 H new ATOM 0 HG2 GLU A 103 -14.541 -7.497 10.348 1.00 51.12 H new ATOM 0 HG3 GLU A 103 -15.852 -7.588 9.188 1.00 51.12 H new ATOM 1678 N GLU A 104 -18.149 -7.571 8.320 1.00 12.31 N ATOM 1679 CA GLU A 104 -18.417 -6.983 7.013 1.00 61.45 C ATOM 1680 C GLU A 104 -19.808 -6.358 6.971 1.00 35.44 C ATOM 1681 O GLU A 104 -20.043 -5.389 6.251 1.00 2.32 O ATOM 1682 CB GLU A 104 -18.290 -8.044 5.917 1.00 44.33 C ATOM 1683 CG GLU A 104 -18.842 -7.600 4.573 1.00 40.52 C ATOM 1684 CD GLU A 104 -18.158 -8.284 3.406 1.00 65.14 C ATOM 1685 OE1 GLU A 104 -16.914 -8.401 3.433 1.00 34.45 O ATOM 1686 OE2 GLU A 104 -18.864 -8.702 2.465 1.00 71.11 O ATOM 0 H GLU A 104 -17.919 -8.565 8.297 1.00 12.31 H new ATOM 0 HA GLU A 104 -17.680 -6.199 6.838 1.00 61.45 H new ATOM 0 HB2 GLU A 104 -17.239 -8.309 5.799 1.00 44.33 H new ATOM 0 HB3 GLU A 104 -18.812 -8.947 6.235 1.00 44.33 H new ATOM 0 HG2 GLU A 104 -19.911 -7.810 4.536 1.00 40.52 H new ATOM 0 HG3 GLU A 104 -18.726 -6.521 4.475 1.00 40.52 H new TER 1693 GLU A 104