USER MOD reduce.3.24.130724 H: found=0, std=0, add=899, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 899 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 18 THR OG1 : rot -22:sc= 0.566 USER MOD Set 1.2: A 21 SER OG : rot -11:sc= 1.62 USER MOD Single : A 1 MET CE :methyl 169:sc= 0 (180deg=-0.148) USER MOD Single : A 1 MET N :NH3+ 175:sc= -0.294 (180deg=-0.357) USER MOD Single : A 6 LYS NZ :NH3+ -153:sc= -0.0798 (180deg=-0.392) USER MOD Single : A 7 THR OG1 : rot 180:sc= 0.0502 USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 TYR OH : rot 158:sc= 0.493 USER MOD Single : A 17 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 20 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 THR OG1 : rot 86:sc= 1.25 USER MOD Single : A 30 ASN : amide:sc= -0.0728 X(o=-0.073,f=0) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 TYR OH : rot -162:sc= -0.396 USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 52 GLN : amide:sc= 0.765 K(o=0.77,f=-5.6!) USER MOD Single : A 58 LYS NZ :NH3+ 168:sc= -0.0128 (180deg=-0.153) USER MOD Single : A 62 THR OG1 : rot -120:sc= 0 USER MOD Single : A 64 THR OG1 : rot 97:sc= 1.27 USER MOD Single : A 67 LYS NZ :NH3+ -115:sc=-0.00439 (180deg=-1.35) USER MOD Single : A 81 SER OG : rot 180:sc= 0 USER MOD Single : A 82 ASN : amide:sc= -0.0155 K(o=-0.015,f=-3.9) USER MOD Single : A 85 LYS NZ :NH3+ -172:sc= -0.0021 (180deg=-0.0907) USER MOD Single : A 100 TYR OH : rot 150:sc= 0 USER MOD Single : A 101 LYS NZ :NH3+ 164:sc= -0.0399 (180deg=-0.263) USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -13.035 -7.481 -20.996 1.00 0.00 N ATOM 2 CA MET A 1 -13.662 -7.259 -19.667 1.00 0.00 C ATOM 3 C MET A 1 -13.508 -8.490 -18.783 1.00 0.00 C ATOM 4 O MET A 1 -14.302 -8.718 -17.868 1.00 0.00 O ATOM 5 CB MET A 1 -15.145 -6.917 -19.832 1.00 0.00 C ATOM 6 CG MET A 1 -15.394 -5.549 -20.443 1.00 0.00 C ATOM 7 SD MET A 1 -17.142 -5.238 -20.766 1.00 0.00 S ATOM 8 CE MET A 1 -17.770 -5.068 -19.096 1.00 0.00 C ATOM 0 H1 MET A 1 -13.225 -6.664 -21.610 1.00 0.00 H new ATOM 0 H2 MET A 1 -12.008 -7.596 -20.880 1.00 0.00 H new ATOM 0 H3 MET A 1 -13.433 -8.339 -21.429 1.00 0.00 H new ATOM 0 HA MET A 1 -13.154 -6.423 -19.187 1.00 0.00 H new ATOM 0 HB2 MET A 1 -15.616 -7.675 -20.458 1.00 0.00 H new ATOM 0 HB3 MET A 1 -15.630 -6.963 -18.857 1.00 0.00 H new ATOM 0 HG2 MET A 1 -15.010 -4.781 -19.772 1.00 0.00 H new ATOM 0 HG3 MET A 1 -14.836 -5.465 -21.376 1.00 0.00 H new ATOM 0 HE1 MET A 1 -18.789 -4.682 -19.128 1.00 0.00 H new ATOM 0 HE2 MET A 1 -17.766 -6.041 -18.605 1.00 0.00 H new ATOM 0 HE3 MET A 1 -17.138 -4.377 -18.538 1.00 0.00 H new ATOM 20 N ALA A 2 -12.485 -9.286 -19.069 1.00 0.00 N ATOM 21 CA ALA A 2 -12.217 -10.497 -18.302 1.00 0.00 C ATOM 22 C ALA A 2 -11.552 -10.162 -16.967 1.00 0.00 C ATOM 23 O ALA A 2 -10.502 -9.518 -16.939 1.00 0.00 O ATOM 24 CB ALA A 2 -11.338 -11.447 -19.105 1.00 0.00 C ATOM 0 H ALA A 2 -11.826 -9.114 -19.828 1.00 0.00 H new ATOM 0 HA ALA A 2 -13.169 -10.986 -18.095 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -11.146 -12.347 -18.520 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -11.846 -11.717 -20.031 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -10.393 -10.958 -19.339 1.00 0.00 H new ATOM 30 N PRO A 3 -12.170 -10.575 -15.840 1.00 0.00 N ATOM 31 CA PRO A 3 -11.628 -10.323 -14.495 1.00 0.00 C ATOM 32 C PRO A 3 -10.242 -10.926 -14.297 1.00 0.00 C ATOM 33 O PRO A 3 -9.960 -12.033 -14.757 1.00 0.00 O ATOM 34 CB PRO A 3 -12.641 -11.003 -13.568 1.00 0.00 C ATOM 35 CG PRO A 3 -13.897 -11.065 -14.365 1.00 0.00 C ATOM 36 CD PRO A 3 -13.455 -11.297 -15.782 1.00 0.00 C ATOM 0 HA PRO A 3 -11.501 -9.257 -14.306 1.00 0.00 H new ATOM 0 HB2 PRO A 3 -12.306 -11.999 -13.278 1.00 0.00 H new ATOM 0 HB3 PRO A 3 -12.782 -10.434 -12.649 1.00 0.00 H new ATOM 0 HG2 PRO A 3 -14.544 -11.871 -14.018 1.00 0.00 H new ATOM 0 HG3 PRO A 3 -14.465 -10.139 -14.277 1.00 0.00 H new ATOM 0 HD2 PRO A 3 -13.334 -12.358 -16.000 1.00 0.00 H new ATOM 0 HD3 PRO A 3 -14.174 -10.904 -16.501 1.00 0.00 H new ATOM 44 N LEU A 4 -9.388 -10.197 -13.588 1.00 0.00 N ATOM 45 CA LEU A 4 -8.032 -10.651 -13.328 1.00 0.00 C ATOM 46 C LEU A 4 -7.872 -11.035 -11.863 1.00 0.00 C ATOM 47 O LEU A 4 -8.444 -10.398 -10.979 1.00 0.00 O ATOM 48 CB LEU A 4 -7.026 -9.557 -13.696 1.00 0.00 C ATOM 49 CG LEU A 4 -7.133 -9.026 -15.128 1.00 0.00 C ATOM 50 CD1 LEU A 4 -6.085 -7.955 -15.379 1.00 0.00 C ATOM 51 CD2 LEU A 4 -7.000 -10.159 -16.134 1.00 0.00 C ATOM 0 H LEU A 4 -9.613 -9.288 -13.184 1.00 0.00 H new ATOM 0 HA LEU A 4 -7.838 -11.530 -13.943 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -7.153 -8.723 -13.006 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -6.019 -9.946 -13.544 1.00 0.00 H new ATOM 0 HG LEU A 4 -8.118 -8.576 -15.254 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -6.176 -7.589 -16.402 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -6.235 -7.129 -14.684 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -5.091 -8.377 -15.232 1.00 0.00 H new ATOM 0 HD21 LEU A 4 -7.079 -9.759 -17.145 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -6.032 -10.644 -16.010 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -7.794 -10.887 -15.969 1.00 0.00 H new ATOM 63 N ARG A 5 -7.094 -12.082 -11.612 1.00 0.00 N ATOM 64 CA ARG A 5 -6.865 -12.551 -10.252 1.00 0.00 C ATOM 65 C ARG A 5 -5.569 -11.970 -9.695 1.00 0.00 C ATOM 66 O ARG A 5 -4.565 -11.897 -10.407 1.00 0.00 O ATOM 67 CB ARG A 5 -6.812 -14.084 -10.212 1.00 0.00 C ATOM 68 CG ARG A 5 -8.177 -14.749 -10.080 1.00 0.00 C ATOM 69 CD ARG A 5 -9.006 -14.588 -11.346 1.00 0.00 C ATOM 70 NE ARG A 5 -10.182 -15.454 -11.350 1.00 0.00 N ATOM 71 CZ ARG A 5 -11.106 -15.436 -12.306 1.00 0.00 C ATOM 72 NH1 ARG A 5 -10.994 -14.592 -13.327 1.00 0.00 N ATOM 73 NH2 ARG A 5 -12.141 -16.264 -12.245 1.00 0.00 N ATOM 0 H ARG A 5 -6.612 -12.621 -12.332 1.00 0.00 H new ATOM 0 HA ARG A 5 -7.695 -12.213 -9.632 1.00 0.00 H new ATOM 0 HB2 ARG A 5 -6.330 -14.444 -11.121 1.00 0.00 H new ATOM 0 HB3 ARG A 5 -6.186 -14.394 -9.375 1.00 0.00 H new ATOM 0 HG2 ARG A 5 -8.046 -15.809 -9.863 1.00 0.00 H new ATOM 0 HG3 ARG A 5 -8.713 -14.315 -9.236 1.00 0.00 H new ATOM 0 HD2 ARG A 5 -9.322 -13.549 -11.442 1.00 0.00 H new ATOM 0 HD3 ARG A 5 -8.387 -14.814 -12.214 1.00 0.00 H new ATOM 0 HE ARG A 5 -10.301 -16.109 -10.577 1.00 0.00 H new ATOM 0 HH11 ARG A 5 -10.198 -13.956 -13.378 1.00 0.00 H new ATOM 0 HH12 ARG A 5 -11.704 -14.580 -14.059 1.00 0.00 H new ATOM 0 HH21 ARG A 5 -12.228 -16.915 -11.464 1.00 0.00 H new ATOM 0 HH22 ARG A 5 -12.849 -16.250 -12.979 1.00 0.00 H new ATOM 87 N LYS A 6 -5.612 -11.560 -8.422 1.00 0.00 N ATOM 88 CA LYS A 6 -4.460 -10.976 -7.724 1.00 0.00 C ATOM 89 C LYS A 6 -4.127 -9.584 -8.247 1.00 0.00 C ATOM 90 O LYS A 6 -4.337 -8.589 -7.556 1.00 0.00 O ATOM 91 CB LYS A 6 -3.229 -11.888 -7.812 1.00 0.00 C ATOM 92 CG LYS A 6 -3.061 -12.804 -6.608 1.00 0.00 C ATOM 93 CD LYS A 6 -2.663 -12.025 -5.361 1.00 0.00 C ATOM 94 CE LYS A 6 -1.228 -12.319 -4.955 1.00 0.00 C ATOM 95 NZ LYS A 6 -1.038 -13.746 -4.578 1.00 0.00 N ATOM 0 H LYS A 6 -6.450 -11.624 -7.844 1.00 0.00 H new ATOM 0 HA LYS A 6 -4.743 -10.882 -6.675 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -3.302 -12.497 -8.713 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -2.337 -11.271 -7.915 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -3.994 -13.337 -6.423 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -2.302 -13.556 -6.825 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -2.778 -10.957 -5.546 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -3.334 -12.281 -4.541 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -0.559 -12.069 -5.779 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -0.951 -11.682 -4.115 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -0.249 -13.825 -3.905 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -1.907 -14.107 -4.136 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -0.825 -14.304 -5.429 1.00 0.00 H new ATOM 109 N THR A 7 -3.608 -9.520 -9.458 1.00 0.00 N ATOM 110 CA THR A 7 -3.247 -8.246 -10.056 1.00 0.00 C ATOM 111 C THR A 7 -4.466 -7.525 -10.610 1.00 0.00 C ATOM 112 O THR A 7 -5.231 -8.075 -11.402 1.00 0.00 O ATOM 113 CB THR A 7 -2.208 -8.408 -11.178 1.00 0.00 C ATOM 114 OG1 THR A 7 -2.365 -9.680 -11.817 1.00 0.00 O ATOM 115 CG2 THR A 7 -0.791 -8.266 -10.640 1.00 0.00 C ATOM 0 H THR A 7 -3.427 -10.333 -10.047 1.00 0.00 H new ATOM 0 HA THR A 7 -2.808 -7.650 -9.256 1.00 0.00 H new ATOM 0 HB THR A 7 -2.375 -7.617 -11.909 1.00 0.00 H new ATOM 0 HG1 THR A 7 -1.700 -9.772 -12.531 1.00 0.00 H new ATOM 0 HG21 THR A 7 -0.078 -8.385 -11.456 1.00 0.00 H new ATOM 0 HG22 THR A 7 -0.669 -7.280 -10.193 1.00 0.00 H new ATOM 0 HG23 THR A 7 -0.610 -9.031 -9.885 1.00 0.00 H new ATOM 123 N ALA A 8 -4.627 -6.285 -10.183 1.00 0.00 N ATOM 124 CA ALA A 8 -5.734 -5.448 -10.617 1.00 0.00 C ATOM 125 C ALA A 8 -5.223 -4.246 -11.393 1.00 0.00 C ATOM 126 O ALA A 8 -4.092 -3.805 -11.197 1.00 0.00 O ATOM 127 CB ALA A 8 -6.553 -5.000 -9.425 1.00 0.00 C ATOM 0 H ALA A 8 -3.994 -5.829 -9.526 1.00 0.00 H new ATOM 0 HA ALA A 8 -6.373 -6.035 -11.277 1.00 0.00 H new ATOM 0 HB1 ALA A 8 -7.378 -4.374 -9.765 1.00 0.00 H new ATOM 0 HB2 ALA A 8 -6.949 -5.873 -8.907 1.00 0.00 H new ATOM 0 HB3 ALA A 8 -5.922 -4.429 -8.744 1.00 0.00 H new ATOM 133 N VAL A 9 -6.061 -3.717 -12.271 1.00 0.00 N ATOM 134 CA VAL A 9 -5.679 -2.575 -13.081 1.00 0.00 C ATOM 135 C VAL A 9 -6.404 -1.323 -12.605 1.00 0.00 C ATOM 136 O VAL A 9 -7.637 -1.279 -12.550 1.00 0.00 O ATOM 137 CB VAL A 9 -5.982 -2.811 -14.576 1.00 0.00 C ATOM 138 CG1 VAL A 9 -5.585 -1.598 -15.413 1.00 0.00 C ATOM 139 CG2 VAL A 9 -5.267 -4.059 -15.074 1.00 0.00 C ATOM 0 H VAL A 9 -7.007 -4.060 -12.439 1.00 0.00 H new ATOM 0 HA VAL A 9 -4.603 -2.440 -12.968 1.00 0.00 H new ATOM 0 HB VAL A 9 -7.056 -2.959 -14.684 1.00 0.00 H new ATOM 0 HG11 VAL A 9 -5.809 -1.791 -16.462 1.00 0.00 H new ATOM 0 HG12 VAL A 9 -6.145 -0.725 -15.077 1.00 0.00 H new ATOM 0 HG13 VAL A 9 -4.517 -1.411 -15.299 1.00 0.00 H new ATOM 0 HG21 VAL A 9 -5.492 -4.210 -16.130 1.00 0.00 H new ATOM 0 HG22 VAL A 9 -4.191 -3.938 -14.946 1.00 0.00 H new ATOM 0 HG23 VAL A 9 -5.605 -4.924 -14.504 1.00 0.00 H new ATOM 149 N LEU A 10 -5.629 -0.308 -12.272 1.00 0.00 N ATOM 150 CA LEU A 10 -6.168 0.955 -11.799 1.00 0.00 C ATOM 151 C LEU A 10 -5.881 2.020 -12.847 1.00 0.00 C ATOM 152 O LEU A 10 -4.738 2.157 -13.289 1.00 0.00 O ATOM 153 CB LEU A 10 -5.521 1.323 -10.455 1.00 0.00 C ATOM 154 CG LEU A 10 -6.462 1.815 -9.341 1.00 0.00 C ATOM 155 CD1 LEU A 10 -7.232 3.048 -9.776 1.00 0.00 C ATOM 156 CD2 LEU A 10 -7.420 0.717 -8.903 1.00 0.00 C ATOM 0 H LEU A 10 -4.611 -0.335 -12.321 1.00 0.00 H new ATOM 0 HA LEU A 10 -7.244 0.878 -11.646 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -4.986 0.448 -10.085 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -4.777 2.098 -10.638 1.00 0.00 H new ATOM 0 HG LEU A 10 -5.841 2.085 -8.487 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -7.888 3.371 -8.968 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -6.532 3.848 -10.017 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -7.830 2.812 -10.656 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -8.071 1.095 -8.115 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -8.024 0.401 -9.753 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -6.851 -0.133 -8.526 1.00 0.00 H new ATOM 168 N LYS A 11 -6.893 2.781 -13.246 1.00 0.00 N ATOM 169 CA LYS A 11 -6.690 3.808 -14.257 1.00 0.00 C ATOM 170 C LYS A 11 -6.946 5.190 -13.679 1.00 0.00 C ATOM 171 O LYS A 11 -7.941 5.417 -12.988 1.00 0.00 O ATOM 172 CB LYS A 11 -7.597 3.598 -15.478 1.00 0.00 C ATOM 173 CG LYS A 11 -7.240 2.388 -16.325 1.00 0.00 C ATOM 174 CD LYS A 11 -8.149 2.281 -17.539 1.00 0.00 C ATOM 175 CE LYS A 11 -7.760 1.111 -18.425 1.00 0.00 C ATOM 176 NZ LYS A 11 -8.649 0.993 -19.615 1.00 0.00 N ATOM 0 H LYS A 11 -7.847 2.708 -12.891 1.00 0.00 H new ATOM 0 HA LYS A 11 -5.652 3.731 -14.580 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -8.627 3.496 -15.137 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -7.555 4.489 -16.104 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -6.202 2.461 -16.650 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -7.323 1.482 -15.724 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -9.182 2.163 -17.212 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -8.100 3.206 -18.114 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -6.728 1.233 -18.754 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -7.804 0.188 -17.847 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -8.349 0.182 -20.193 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -9.631 0.851 -19.302 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -8.588 1.863 -20.181 1.00 0.00 H new ATOM 190 N LEU A 12 -6.035 6.106 -13.957 1.00 0.00 N ATOM 191 CA LEU A 12 -6.176 7.472 -13.490 1.00 0.00 C ATOM 192 C LEU A 12 -6.411 8.388 -14.677 1.00 0.00 C ATOM 193 O LEU A 12 -5.639 8.370 -15.638 1.00 0.00 O ATOM 194 CB LEU A 12 -4.925 7.929 -12.729 1.00 0.00 C ATOM 195 CG LEU A 12 -5.183 8.593 -11.368 1.00 0.00 C ATOM 196 CD1 LEU A 12 -3.898 9.177 -10.806 1.00 0.00 C ATOM 197 CD2 LEU A 12 -6.245 9.676 -11.476 1.00 0.00 C ATOM 0 H LEU A 12 -5.192 5.928 -14.503 1.00 0.00 H new ATOM 0 HA LEU A 12 -7.026 7.517 -12.809 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -4.279 7.065 -12.575 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -4.375 8.630 -13.357 1.00 0.00 H new ATOM 0 HG LEU A 12 -5.548 7.823 -10.688 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -4.101 9.643 -9.842 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -3.163 8.382 -10.677 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -3.507 9.925 -11.495 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -6.405 10.127 -10.497 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -5.914 10.441 -12.178 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -7.178 9.237 -11.830 1.00 0.00 H new ATOM 209 N TYR A 13 -7.465 9.182 -14.630 1.00 0.00 N ATOM 210 CA TYR A 13 -7.760 10.100 -15.711 1.00 0.00 C ATOM 211 C TYR A 13 -7.276 11.483 -15.312 1.00 0.00 C ATOM 212 O TYR A 13 -7.748 12.045 -14.325 1.00 0.00 O ATOM 213 CB TYR A 13 -9.267 10.120 -15.978 1.00 0.00 C ATOM 214 CG TYR A 13 -9.814 8.781 -16.428 1.00 0.00 C ATOM 215 CD1 TYR A 13 -10.313 7.865 -15.509 1.00 0.00 C ATOM 216 CD2 TYR A 13 -9.827 8.429 -17.772 1.00 0.00 C ATOM 217 CE1 TYR A 13 -10.808 6.641 -15.915 1.00 0.00 C ATOM 218 CE2 TYR A 13 -10.322 7.207 -18.187 1.00 0.00 C ATOM 219 CZ TYR A 13 -10.811 6.315 -17.255 1.00 0.00 C ATOM 220 OH TYR A 13 -11.303 5.097 -17.662 1.00 0.00 O ATOM 0 H TYR A 13 -8.129 9.209 -13.856 1.00 0.00 H new ATOM 0 HA TYR A 13 -7.255 9.783 -16.623 1.00 0.00 H new ATOM 0 HB2 TYR A 13 -9.786 10.430 -15.071 1.00 0.00 H new ATOM 0 HB3 TYR A 13 -9.484 10.868 -16.741 1.00 0.00 H new ATOM 0 HD1 TYR A 13 -10.314 8.115 -14.458 1.00 0.00 H new ATOM 0 HD2 TYR A 13 -9.443 9.123 -18.506 1.00 0.00 H new ATOM 0 HE1 TYR A 13 -11.191 5.942 -15.186 1.00 0.00 H new ATOM 0 HE2 TYR A 13 -10.326 6.952 -19.236 1.00 0.00 H new ATOM 0 HH TYR A 13 -11.561 5.147 -18.606 1.00 0.00 H new ATOM 230 N VAL A 14 -6.345 12.037 -16.072 1.00 0.00 N ATOM 231 CA VAL A 14 -5.791 13.343 -15.757 1.00 0.00 C ATOM 232 C VAL A 14 -5.900 14.294 -16.938 1.00 0.00 C ATOM 233 O VAL A 14 -6.061 13.867 -18.084 1.00 0.00 O ATOM 234 CB VAL A 14 -4.308 13.242 -15.320 1.00 0.00 C ATOM 235 CG1 VAL A 14 -4.182 12.526 -13.977 1.00 0.00 C ATOM 236 CG2 VAL A 14 -3.474 12.535 -16.379 1.00 0.00 C ATOM 0 H VAL A 14 -5.958 11.603 -16.910 1.00 0.00 H new ATOM 0 HA VAL A 14 -6.379 13.737 -14.928 1.00 0.00 H new ATOM 0 HB VAL A 14 -3.926 14.256 -15.205 1.00 0.00 H new ATOM 0 HG11 VAL A 14 -3.131 12.468 -13.693 1.00 0.00 H new ATOM 0 HG12 VAL A 14 -4.734 13.079 -13.217 1.00 0.00 H new ATOM 0 HG13 VAL A 14 -4.591 11.519 -14.062 1.00 0.00 H new ATOM 0 HG21 VAL A 14 -2.437 12.478 -16.047 1.00 0.00 H new ATOM 0 HG22 VAL A 14 -3.861 11.528 -16.535 1.00 0.00 H new ATOM 0 HG23 VAL A 14 -3.525 13.092 -17.314 1.00 0.00 H new ATOM 246 N ALA A 15 -5.809 15.585 -16.651 1.00 0.00 N ATOM 247 CA ALA A 15 -5.900 16.598 -17.685 1.00 0.00 C ATOM 248 C ALA A 15 -4.604 17.395 -17.751 1.00 0.00 C ATOM 249 O ALA A 15 -4.359 18.269 -16.918 1.00 0.00 O ATOM 250 CB ALA A 15 -7.083 17.521 -17.436 1.00 0.00 C ATOM 0 H ALA A 15 -5.672 15.953 -15.709 1.00 0.00 H new ATOM 0 HA ALA A 15 -6.056 16.102 -18.643 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -7.131 18.272 -18.224 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -8.004 16.939 -17.433 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -6.963 18.014 -16.471 1.00 0.00 H new ATOM 256 N GLY A 16 -3.785 17.087 -18.755 1.00 0.00 N ATOM 257 CA GLY A 16 -2.518 17.776 -18.924 1.00 0.00 C ATOM 258 C GLY A 16 -1.588 17.590 -17.740 1.00 0.00 C ATOM 259 O GLY A 16 -1.401 16.472 -17.261 1.00 0.00 O ATOM 0 H GLY A 16 -3.978 16.371 -19.455 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -2.028 17.411 -19.827 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -2.704 18.840 -19.071 1.00 0.00 H new ATOM 263 N ASN A 17 -1.007 18.687 -17.267 1.00 0.00 N ATOM 264 CA ASN A 17 -0.089 18.634 -16.133 1.00 0.00 C ATOM 265 C ASN A 17 -0.456 19.662 -15.073 1.00 0.00 C ATOM 266 O ASN A 17 0.407 20.384 -14.572 1.00 0.00 O ATOM 267 CB ASN A 17 1.361 18.849 -16.589 1.00 0.00 C ATOM 268 CG ASN A 17 1.818 17.838 -17.622 1.00 0.00 C ATOM 269 OD1 ASN A 17 2.167 18.197 -18.744 1.00 0.00 O ATOM 270 ND2 ASN A 17 1.822 16.565 -17.248 1.00 0.00 N ATOM 0 H ASN A 17 -1.154 19.621 -17.649 1.00 0.00 H new ATOM 0 HA ASN A 17 -0.176 17.640 -15.693 1.00 0.00 H new ATOM 0 HB2 ASN A 17 1.460 19.852 -17.003 1.00 0.00 H new ATOM 0 HB3 ASN A 17 2.019 18.796 -15.722 1.00 0.00 H new ATOM 0 HD21 ASN A 17 2.123 15.842 -17.902 1.00 0.00 H new ATOM 0 HD22 ASN A 17 1.524 16.309 -16.307 1.00 0.00 H new ATOM 277 N THR A 18 -1.739 19.739 -14.746 1.00 0.00 N ATOM 278 CA THR A 18 -2.200 20.664 -13.721 1.00 0.00 C ATOM 279 C THR A 18 -1.744 20.174 -12.354 1.00 0.00 C ATOM 280 O THR A 18 -1.498 18.979 -12.178 1.00 0.00 O ATOM 281 CB THR A 18 -3.736 20.805 -13.724 1.00 0.00 C ATOM 282 OG1 THR A 18 -4.349 19.545 -13.413 1.00 0.00 O ATOM 283 CG2 THR A 18 -4.234 21.302 -15.069 1.00 0.00 C ATOM 0 H THR A 18 -2.475 19.176 -15.173 1.00 0.00 H new ATOM 0 HA THR A 18 -1.771 21.642 -13.938 1.00 0.00 H new ATOM 0 HB THR A 18 -4.010 21.536 -12.964 1.00 0.00 H new ATOM 0 HG1 THR A 18 -3.724 18.818 -13.617 1.00 0.00 H new ATOM 0 HG21 THR A 18 -5.320 21.393 -15.044 1.00 0.00 H new ATOM 0 HG22 THR A 18 -3.793 22.276 -15.283 1.00 0.00 H new ATOM 0 HG23 THR A 18 -3.947 20.595 -15.847 1.00 0.00 H new ATOM 291 N PRO A 19 -1.622 21.073 -11.366 1.00 0.00 N ATOM 292 CA PRO A 19 -1.185 20.692 -10.017 1.00 0.00 C ATOM 293 C PRO A 19 -2.036 19.576 -9.415 1.00 0.00 C ATOM 294 O PRO A 19 -1.513 18.706 -8.727 1.00 0.00 O ATOM 295 CB PRO A 19 -1.327 21.997 -9.225 1.00 0.00 C ATOM 296 CG PRO A 19 -1.161 23.061 -10.254 1.00 0.00 C ATOM 297 CD PRO A 19 -1.842 22.531 -11.483 1.00 0.00 C ATOM 0 HA PRO A 19 -0.173 20.286 -10.009 1.00 0.00 H new ATOM 0 HB2 PRO A 19 -2.298 22.063 -8.735 1.00 0.00 H new ATOM 0 HB3 PRO A 19 -0.570 22.075 -8.444 1.00 0.00 H new ATOM 0 HG2 PRO A 19 -1.612 23.998 -9.927 1.00 0.00 H new ATOM 0 HG3 PRO A 19 -0.107 23.264 -10.444 1.00 0.00 H new ATOM 0 HD2 PRO A 19 -2.903 22.782 -11.499 1.00 0.00 H new ATOM 0 HD3 PRO A 19 -1.405 22.936 -12.396 1.00 0.00 H new ATOM 305 N ASN A 20 -3.341 19.600 -9.680 1.00 0.00 N ATOM 306 CA ASN A 20 -4.235 18.565 -9.156 1.00 0.00 C ATOM 307 C ASN A 20 -3.890 17.202 -9.757 1.00 0.00 C ATOM 308 O ASN A 20 -3.823 16.200 -9.046 1.00 0.00 O ATOM 309 CB ASN A 20 -5.709 18.889 -9.452 1.00 0.00 C ATOM 310 CG ASN A 20 -6.186 20.138 -8.734 1.00 0.00 C ATOM 311 OD1 ASN A 20 -6.503 21.144 -9.365 1.00 0.00 O ATOM 312 ND2 ASN A 20 -6.243 20.076 -7.410 1.00 0.00 N ATOM 0 H ASN A 20 -3.800 20.314 -10.246 1.00 0.00 H new ATOM 0 HA ASN A 20 -4.095 18.535 -8.075 1.00 0.00 H new ATOM 0 HB2 ASN A 20 -5.840 19.019 -10.526 1.00 0.00 H new ATOM 0 HB3 ASN A 20 -6.330 18.044 -9.155 1.00 0.00 H new ATOM 0 HD21 ASN A 20 -6.560 20.884 -6.875 1.00 0.00 H new ATOM 0 HD22 ASN A 20 -5.970 19.220 -6.927 1.00 0.00 H new ATOM 319 N SER A 21 -3.671 17.175 -11.077 1.00 0.00 N ATOM 320 CA SER A 21 -3.315 15.945 -11.777 1.00 0.00 C ATOM 321 C SER A 21 -1.906 15.493 -11.428 1.00 0.00 C ATOM 322 O SER A 21 -1.671 14.299 -11.245 1.00 0.00 O ATOM 323 CB SER A 21 -3.473 16.120 -13.289 1.00 0.00 C ATOM 324 OG SER A 21 -2.655 17.163 -13.790 1.00 0.00 O ATOM 0 H SER A 21 -3.735 17.996 -11.679 1.00 0.00 H new ATOM 0 HA SER A 21 -4.001 15.164 -11.447 1.00 0.00 H new ATOM 0 HB2 SER A 21 -3.218 15.186 -13.791 1.00 0.00 H new ATOM 0 HB3 SER A 21 -4.516 16.333 -13.522 1.00 0.00 H new ATOM 0 HG SER A 21 -2.282 17.674 -13.042 1.00 0.00 H new ATOM 330 N VAL A 22 -0.970 16.431 -11.327 1.00 0.00 N ATOM 331 CA VAL A 22 0.399 16.083 -10.970 1.00 0.00 C ATOM 332 C VAL A 22 0.442 15.515 -9.558 1.00 0.00 C ATOM 333 O VAL A 22 1.078 14.492 -9.304 1.00 0.00 O ATOM 334 CB VAL A 22 1.354 17.292 -11.088 1.00 0.00 C ATOM 335 CG1 VAL A 22 2.706 16.984 -10.463 1.00 0.00 C ATOM 336 CG2 VAL A 22 1.518 17.705 -12.542 1.00 0.00 C ATOM 0 H VAL A 22 -1.132 17.426 -11.485 1.00 0.00 H new ATOM 0 HA VAL A 22 0.741 15.327 -11.677 1.00 0.00 H new ATOM 0 HB VAL A 22 0.912 18.124 -10.541 1.00 0.00 H new ATOM 0 HG11 VAL A 22 3.358 17.852 -10.560 1.00 0.00 H new ATOM 0 HG12 VAL A 22 2.573 16.746 -9.408 1.00 0.00 H new ATOM 0 HG13 VAL A 22 3.157 16.133 -10.973 1.00 0.00 H new ATOM 0 HG21 VAL A 22 2.194 18.558 -12.604 1.00 0.00 H new ATOM 0 HG22 VAL A 22 1.930 16.873 -13.112 1.00 0.00 H new ATOM 0 HG23 VAL A 22 0.547 17.981 -12.954 1.00 0.00 H new ATOM 346 N ARG A 23 -0.270 16.175 -8.655 1.00 0.00 N ATOM 347 CA ARG A 23 -0.338 15.759 -7.262 1.00 0.00 C ATOM 348 C ARG A 23 -0.953 14.374 -7.152 1.00 0.00 C ATOM 349 O ARG A 23 -0.434 13.501 -6.454 1.00 0.00 O ATOM 350 CB ARG A 23 -1.214 16.739 -6.493 1.00 0.00 C ATOM 351 CG ARG A 23 -0.870 16.878 -5.023 1.00 0.00 C ATOM 352 CD ARG A 23 -0.081 18.148 -4.769 1.00 0.00 C ATOM 353 NE ARG A 23 0.206 18.342 -3.351 1.00 0.00 N ATOM 354 CZ ARG A 23 0.912 19.363 -2.873 1.00 0.00 C ATOM 355 NH1 ARG A 23 1.400 20.279 -3.699 1.00 0.00 N ATOM 356 NH2 ARG A 23 1.129 19.466 -1.568 1.00 0.00 N ATOM 0 H ARG A 23 -0.815 17.011 -8.867 1.00 0.00 H new ATOM 0 HA ARG A 23 0.671 15.740 -6.851 1.00 0.00 H new ATOM 0 HB2 ARG A 23 -1.139 17.719 -6.964 1.00 0.00 H new ATOM 0 HB3 ARG A 23 -2.253 16.422 -6.581 1.00 0.00 H new ATOM 0 HG2 ARG A 23 -1.785 16.889 -4.431 1.00 0.00 H new ATOM 0 HG3 ARG A 23 -0.290 16.014 -4.698 1.00 0.00 H new ATOM 0 HD2 ARG A 23 0.855 18.110 -5.326 1.00 0.00 H new ATOM 0 HD3 ARG A 23 -0.641 19.004 -5.145 1.00 0.00 H new ATOM 0 HE ARG A 23 -0.155 17.655 -2.689 1.00 0.00 H new ATOM 0 HH11 ARG A 23 1.234 20.201 -4.702 1.00 0.00 H new ATOM 0 HH12 ARG A 23 1.941 21.061 -3.331 1.00 0.00 H new ATOM 0 HH21 ARG A 23 0.754 18.762 -0.932 1.00 0.00 H new ATOM 0 HH22 ARG A 23 1.670 20.249 -1.201 1.00 0.00 H new ATOM 370 N ALA A 24 -2.069 14.186 -7.854 1.00 0.00 N ATOM 371 CA ALA A 24 -2.779 12.913 -7.835 1.00 0.00 C ATOM 372 C ALA A 24 -1.927 11.778 -8.399 1.00 0.00 C ATOM 373 O ALA A 24 -1.874 10.689 -7.826 1.00 0.00 O ATOM 374 CB ALA A 24 -4.081 13.021 -8.611 1.00 0.00 C ATOM 0 H ALA A 24 -2.499 14.900 -8.442 1.00 0.00 H new ATOM 0 HA ALA A 24 -2.998 12.678 -6.793 1.00 0.00 H new ATOM 0 HB1 ALA A 24 -4.599 12.062 -8.587 1.00 0.00 H new ATOM 0 HB2 ALA A 24 -4.712 13.786 -8.158 1.00 0.00 H new ATOM 0 HB3 ALA A 24 -3.867 13.292 -9.645 1.00 0.00 H new ATOM 380 N LEU A 25 -1.261 12.041 -9.526 1.00 0.00 N ATOM 381 CA LEU A 25 -0.407 11.039 -10.159 1.00 0.00 C ATOM 382 C LEU A 25 0.769 10.650 -9.276 1.00 0.00 C ATOM 383 O LEU A 25 1.090 9.469 -9.161 1.00 0.00 O ATOM 384 CB LEU A 25 0.095 11.527 -11.520 1.00 0.00 C ATOM 385 CG LEU A 25 -0.944 11.524 -12.631 1.00 0.00 C ATOM 386 CD1 LEU A 25 -0.414 12.256 -13.853 1.00 0.00 C ATOM 387 CD2 LEU A 25 -1.319 10.096 -12.980 1.00 0.00 C ATOM 0 H LEU A 25 -1.298 12.935 -10.015 1.00 0.00 H new ATOM 0 HA LEU A 25 -1.020 10.150 -10.307 1.00 0.00 H new ATOM 0 HB2 LEU A 25 0.479 12.541 -11.406 1.00 0.00 H new ATOM 0 HB3 LEU A 25 0.933 10.901 -11.826 1.00 0.00 H new ATOM 0 HG LEU A 25 -1.837 12.045 -12.285 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -1.169 12.245 -14.639 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -0.182 13.287 -13.587 1.00 0.00 H new ATOM 0 HD13 LEU A 25 0.489 11.761 -14.210 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -2.063 10.100 -13.776 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -0.432 9.558 -13.315 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -1.731 9.603 -12.100 1.00 0.00 H new ATOM 399 N LYS A 26 1.404 11.635 -8.647 1.00 0.00 N ATOM 400 CA LYS A 26 2.536 11.353 -7.770 1.00 0.00 C ATOM 401 C LYS A 26 2.080 10.537 -6.566 1.00 0.00 C ATOM 402 O LYS A 26 2.759 9.602 -6.144 1.00 0.00 O ATOM 403 CB LYS A 26 3.189 12.654 -7.290 1.00 0.00 C ATOM 404 CG LYS A 26 3.816 13.483 -8.402 1.00 0.00 C ATOM 405 CD LYS A 26 4.977 12.763 -9.065 1.00 0.00 C ATOM 406 CE LYS A 26 5.611 13.627 -10.144 1.00 0.00 C ATOM 407 NZ LYS A 26 6.747 12.939 -10.814 1.00 0.00 N ATOM 0 H LYS A 26 1.159 12.622 -8.726 1.00 0.00 H new ATOM 0 HA LYS A 26 3.269 10.780 -8.338 1.00 0.00 H new ATOM 0 HB2 LYS A 26 2.438 13.258 -6.781 1.00 0.00 H new ATOM 0 HB3 LYS A 26 3.957 12.413 -6.555 1.00 0.00 H new ATOM 0 HG2 LYS A 26 3.059 13.716 -9.151 1.00 0.00 H new ATOM 0 HG3 LYS A 26 4.164 14.432 -7.994 1.00 0.00 H new ATOM 0 HD2 LYS A 26 5.725 12.505 -8.315 1.00 0.00 H new ATOM 0 HD3 LYS A 26 4.627 11.828 -9.502 1.00 0.00 H new ATOM 0 HE2 LYS A 26 4.858 13.890 -10.887 1.00 0.00 H new ATOM 0 HE3 LYS A 26 5.962 14.559 -9.702 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 7.150 13.563 -11.542 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 7.478 12.710 -10.111 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 6.408 12.062 -11.259 1.00 0.00 H new ATOM 421 N THR A 27 0.917 10.897 -6.029 1.00 0.00 N ATOM 422 CA THR A 27 0.351 10.216 -4.872 1.00 0.00 C ATOM 423 C THR A 27 -0.036 8.766 -5.182 1.00 0.00 C ATOM 424 O THR A 27 0.350 7.852 -4.456 1.00 0.00 O ATOM 425 CB THR A 27 -0.889 10.987 -4.372 1.00 0.00 C ATOM 426 OG1 THR A 27 -0.514 12.321 -4.013 1.00 0.00 O ATOM 427 CG2 THR A 27 -1.523 10.312 -3.172 1.00 0.00 C ATOM 0 H THR A 27 0.345 11.664 -6.382 1.00 0.00 H new ATOM 0 HA THR A 27 1.119 10.192 -4.099 1.00 0.00 H new ATOM 0 HB THR A 27 -1.618 11.002 -5.182 1.00 0.00 H new ATOM 0 HG1 THR A 27 -0.538 12.893 -4.808 1.00 0.00 H new ATOM 0 HG21 THR A 27 -2.393 10.885 -2.850 1.00 0.00 H new ATOM 0 HG22 THR A 27 -1.833 9.303 -3.444 1.00 0.00 H new ATOM 0 HG23 THR A 27 -0.800 10.262 -2.358 1.00 0.00 H new ATOM 435 N LEU A 28 -0.774 8.554 -6.272 1.00 0.00 N ATOM 436 CA LEU A 28 -1.221 7.207 -6.630 1.00 0.00 C ATOM 437 C LEU A 28 -0.069 6.308 -7.073 1.00 0.00 C ATOM 438 O LEU A 28 0.044 5.167 -6.622 1.00 0.00 O ATOM 439 CB LEU A 28 -2.279 7.270 -7.739 1.00 0.00 C ATOM 440 CG LEU A 28 -2.866 5.917 -8.166 1.00 0.00 C ATOM 441 CD1 LEU A 28 -3.603 5.258 -7.013 1.00 0.00 C ATOM 442 CD2 LEU A 28 -3.794 6.087 -9.352 1.00 0.00 C ATOM 0 H LEU A 28 -1.072 9.287 -6.915 1.00 0.00 H new ATOM 0 HA LEU A 28 -1.654 6.771 -5.730 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -3.094 7.911 -7.404 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -1.837 7.747 -8.613 1.00 0.00 H new ATOM 0 HG LEU A 28 -2.039 5.270 -8.460 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -4.010 4.301 -7.341 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -2.912 5.095 -6.186 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -4.417 5.905 -6.684 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -4.199 5.117 -9.639 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -4.611 6.756 -9.082 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -3.240 6.511 -10.190 1.00 0.00 H new ATOM 454 N ALA A 29 0.795 6.830 -7.950 1.00 0.00 N ATOM 455 CA ALA A 29 1.918 6.058 -8.477 1.00 0.00 C ATOM 456 C ALA A 29 2.903 5.642 -7.395 1.00 0.00 C ATOM 457 O ALA A 29 3.333 4.496 -7.363 1.00 0.00 O ATOM 458 CB ALA A 29 2.645 6.849 -9.555 1.00 0.00 C ATOM 0 H ALA A 29 0.736 7.783 -8.308 1.00 0.00 H new ATOM 0 HA ALA A 29 1.499 5.147 -8.905 1.00 0.00 H new ATOM 0 HB1 ALA A 29 3.479 6.261 -9.938 1.00 0.00 H new ATOM 0 HB2 ALA A 29 1.956 7.074 -10.369 1.00 0.00 H new ATOM 0 HB3 ALA A 29 3.022 7.780 -9.131 1.00 0.00 H new ATOM 464 N ASN A 30 3.233 6.562 -6.497 1.00 0.00 N ATOM 465 CA ASN A 30 4.191 6.263 -5.426 1.00 0.00 C ATOM 466 C ASN A 30 3.631 5.213 -4.474 1.00 0.00 C ATOM 467 O ASN A 30 4.355 4.316 -4.037 1.00 0.00 O ATOM 468 CB ASN A 30 4.566 7.532 -4.656 1.00 0.00 C ATOM 469 CG ASN A 30 6.002 7.518 -4.159 1.00 0.00 C ATOM 470 OD1 ASN A 30 6.705 8.523 -4.240 1.00 0.00 O ATOM 471 ND2 ASN A 30 6.447 6.380 -3.639 1.00 0.00 N ATOM 0 H ASN A 30 2.860 7.511 -6.483 1.00 0.00 H new ATOM 0 HA ASN A 30 5.093 5.863 -5.889 1.00 0.00 H new ATOM 0 HB2 ASN A 30 4.418 8.399 -5.300 1.00 0.00 H new ATOM 0 HB3 ASN A 30 3.894 7.648 -3.806 1.00 0.00 H new ATOM 0 HD21 ASN A 30 7.403 6.319 -3.289 1.00 0.00 H new ATOM 0 HD22 ASN A 30 5.833 5.567 -3.589 1.00 0.00 H new ATOM 478 N ILE A 31 2.354 5.331 -4.141 1.00 0.00 N ATOM 479 CA ILE A 31 1.717 4.367 -3.262 1.00 0.00 C ATOM 480 C ILE A 31 1.689 2.982 -3.907 1.00 0.00 C ATOM 481 O ILE A 31 2.006 1.986 -3.270 1.00 0.00 O ATOM 482 CB ILE A 31 0.315 4.827 -2.834 1.00 0.00 C ATOM 483 CG1 ILE A 31 0.465 5.998 -1.869 1.00 0.00 C ATOM 484 CG2 ILE A 31 -0.480 3.700 -2.197 1.00 0.00 C ATOM 485 CD1 ILE A 31 -0.827 6.699 -1.558 1.00 0.00 C ATOM 0 H ILE A 31 1.743 6.081 -4.465 1.00 0.00 H new ATOM 0 HA ILE A 31 2.314 4.298 -2.353 1.00 0.00 H new ATOM 0 HB ILE A 31 -0.242 5.139 -3.717 1.00 0.00 H new ATOM 0 HG12 ILE A 31 0.904 5.636 -0.939 1.00 0.00 H new ATOM 0 HG13 ILE A 31 1.165 6.718 -2.293 1.00 0.00 H new ATOM 0 HG21 ILE A 31 -1.465 4.067 -1.909 1.00 0.00 H new ATOM 0 HG22 ILE A 31 -0.592 2.884 -2.911 1.00 0.00 H new ATOM 0 HG23 ILE A 31 0.045 3.339 -1.313 1.00 0.00 H new ATOM 0 HD11 ILE A 31 -0.638 7.519 -0.866 1.00 0.00 H new ATOM 0 HD12 ILE A 31 -1.258 7.093 -2.478 1.00 0.00 H new ATOM 0 HD13 ILE A 31 -1.523 5.994 -1.104 1.00 0.00 H new ATOM 497 N LEU A 32 1.323 2.927 -5.179 1.00 0.00 N ATOM 498 CA LEU A 32 1.278 1.661 -5.903 1.00 0.00 C ATOM 499 C LEU A 32 2.680 1.071 -6.118 1.00 0.00 C ATOM 500 O LEU A 32 2.852 -0.140 -6.100 1.00 0.00 O ATOM 501 CB LEU A 32 0.547 1.826 -7.235 1.00 0.00 C ATOM 502 CG LEU A 32 -0.965 2.050 -7.109 1.00 0.00 C ATOM 503 CD1 LEU A 32 -1.565 2.421 -8.454 1.00 0.00 C ATOM 504 CD2 LEU A 32 -1.637 0.805 -6.551 1.00 0.00 C ATOM 0 H LEU A 32 1.053 3.741 -5.732 1.00 0.00 H new ATOM 0 HA LEU A 32 0.722 0.954 -5.287 1.00 0.00 H new ATOM 0 HB2 LEU A 32 0.983 2.669 -7.772 1.00 0.00 H new ATOM 0 HB3 LEU A 32 0.720 0.938 -7.842 1.00 0.00 H new ATOM 0 HG LEU A 32 -1.136 2.877 -6.419 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -2.638 2.576 -8.343 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -1.102 3.338 -8.819 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -1.386 1.616 -9.167 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -2.710 0.977 -6.467 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -1.456 -0.037 -7.220 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -1.227 0.581 -5.566 1.00 0.00 H new ATOM 516 N GLU A 33 3.670 1.931 -6.348 1.00 0.00 N ATOM 517 CA GLU A 33 5.051 1.487 -6.574 1.00 0.00 C ATOM 518 C GLU A 33 5.716 0.927 -5.316 1.00 0.00 C ATOM 519 O GLU A 33 6.638 0.123 -5.413 1.00 0.00 O ATOM 520 CB GLU A 33 5.912 2.624 -7.131 1.00 0.00 C ATOM 521 CG GLU A 33 5.562 3.018 -8.556 1.00 0.00 C ATOM 522 CD GLU A 33 6.355 4.213 -9.047 1.00 0.00 C ATOM 523 OE1 GLU A 33 7.036 4.858 -8.222 1.00 0.00 O ATOM 524 OE2 GLU A 33 6.294 4.506 -10.260 1.00 0.00 O ATOM 0 H GLU A 33 3.545 2.943 -6.384 1.00 0.00 H new ATOM 0 HA GLU A 33 4.984 0.679 -7.303 1.00 0.00 H new ATOM 0 HB2 GLU A 33 5.806 3.497 -6.486 1.00 0.00 H new ATOM 0 HB3 GLU A 33 6.960 2.326 -7.094 1.00 0.00 H new ATOM 0 HG2 GLU A 33 5.744 2.171 -9.217 1.00 0.00 H new ATOM 0 HG3 GLU A 33 4.498 3.245 -8.614 1.00 0.00 H new ATOM 531 N LYS A 34 5.292 1.374 -4.138 1.00 0.00 N ATOM 532 CA LYS A 34 5.905 0.889 -2.901 1.00 0.00 C ATOM 533 C LYS A 34 4.924 0.103 -2.029 1.00 0.00 C ATOM 534 O LYS A 34 5.180 -1.047 -1.677 1.00 0.00 O ATOM 535 CB LYS A 34 6.480 2.060 -2.096 1.00 0.00 C ATOM 536 CG LYS A 34 7.498 2.896 -2.861 1.00 0.00 C ATOM 537 CD LYS A 34 8.727 2.084 -3.238 1.00 0.00 C ATOM 538 CE LYS A 34 9.757 2.937 -3.962 1.00 0.00 C ATOM 539 NZ LYS A 34 10.960 2.149 -4.349 1.00 0.00 N ATOM 0 H LYS A 34 4.544 2.056 -4.011 1.00 0.00 H new ATOM 0 HA LYS A 34 6.706 0.209 -3.193 1.00 0.00 H new ATOM 0 HB2 LYS A 34 5.661 2.705 -1.777 1.00 0.00 H new ATOM 0 HB3 LYS A 34 6.950 1.671 -1.193 1.00 0.00 H new ATOM 0 HG2 LYS A 34 7.035 3.295 -3.764 1.00 0.00 H new ATOM 0 HG3 LYS A 34 7.799 3.749 -2.253 1.00 0.00 H new ATOM 0 HD2 LYS A 34 9.173 1.658 -2.339 1.00 0.00 H new ATOM 0 HD3 LYS A 34 8.432 1.249 -3.874 1.00 0.00 H new ATOM 0 HE2 LYS A 34 9.306 3.372 -4.854 1.00 0.00 H new ATOM 0 HE3 LYS A 34 10.057 3.766 -3.321 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 11.637 2.767 -4.840 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 11.406 1.755 -3.496 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 10.678 1.373 -4.982 1.00 0.00 H new ATOM 553 N GLU A 35 3.805 0.732 -1.688 1.00 0.00 N ATOM 554 CA GLU A 35 2.791 0.114 -0.833 1.00 0.00 C ATOM 555 C GLU A 35 2.117 -1.099 -1.483 1.00 0.00 C ATOM 556 O GLU A 35 1.874 -2.105 -0.818 1.00 0.00 O ATOM 557 CB GLU A 35 1.736 1.157 -0.441 1.00 0.00 C ATOM 558 CG GLU A 35 2.248 2.217 0.526 1.00 0.00 C ATOM 559 CD GLU A 35 2.738 1.631 1.837 1.00 0.00 C ATOM 560 OE1 GLU A 35 1.993 0.833 2.445 1.00 0.00 O ATOM 561 OE2 GLU A 35 3.863 1.970 2.253 1.00 0.00 O ATOM 0 H GLU A 35 3.573 1.678 -1.992 1.00 0.00 H new ATOM 0 HA GLU A 35 3.304 -0.253 0.056 1.00 0.00 H new ATOM 0 HB2 GLU A 35 1.371 1.648 -1.343 1.00 0.00 H new ATOM 0 HB3 GLU A 35 0.885 0.647 0.011 1.00 0.00 H new ATOM 0 HG2 GLU A 35 3.060 2.770 0.055 1.00 0.00 H new ATOM 0 HG3 GLU A 35 1.451 2.932 0.729 1.00 0.00 H new ATOM 568 N PHE A 36 1.815 -1.010 -2.777 1.00 0.00 N ATOM 569 CA PHE A 36 1.148 -2.117 -3.473 1.00 0.00 C ATOM 570 C PHE A 36 1.950 -2.634 -4.665 1.00 0.00 C ATOM 571 O PHE A 36 1.367 -3.115 -5.645 1.00 0.00 O ATOM 572 CB PHE A 36 -0.251 -1.694 -3.929 1.00 0.00 C ATOM 573 CG PHE A 36 -1.167 -1.347 -2.792 1.00 0.00 C ATOM 574 CD1 PHE A 36 -1.319 -0.033 -2.384 1.00 0.00 C ATOM 575 CD2 PHE A 36 -1.868 -2.338 -2.124 1.00 0.00 C ATOM 576 CE1 PHE A 36 -2.151 0.288 -1.332 1.00 0.00 C ATOM 577 CE2 PHE A 36 -2.703 -2.023 -1.071 1.00 0.00 C ATOM 578 CZ PHE A 36 -2.845 -0.708 -0.674 1.00 0.00 C ATOM 0 H PHE A 36 2.016 -0.198 -3.360 1.00 0.00 H new ATOM 0 HA PHE A 36 1.070 -2.936 -2.758 1.00 0.00 H new ATOM 0 HB2 PHE A 36 -0.164 -0.833 -4.592 1.00 0.00 H new ATOM 0 HB3 PHE A 36 -0.695 -2.501 -4.511 1.00 0.00 H new ATOM 0 HD1 PHE A 36 -0.780 0.750 -2.896 1.00 0.00 H new ATOM 0 HD2 PHE A 36 -1.760 -3.368 -2.430 1.00 0.00 H new ATOM 0 HE1 PHE A 36 -2.260 1.317 -1.023 1.00 0.00 H new ATOM 0 HE2 PHE A 36 -3.245 -2.804 -0.558 1.00 0.00 H new ATOM 0 HZ PHE A 36 -3.498 -0.459 0.150 1.00 0.00 H new ATOM 588 N LYS A 37 3.275 -2.530 -4.590 1.00 0.00 N ATOM 589 CA LYS A 37 4.142 -2.993 -5.674 1.00 0.00 C ATOM 590 C LYS A 37 3.917 -4.473 -5.977 1.00 0.00 C ATOM 591 O LYS A 37 3.996 -5.321 -5.089 1.00 0.00 O ATOM 592 CB LYS A 37 5.612 -2.763 -5.316 1.00 0.00 C ATOM 593 CG LYS A 37 6.543 -2.723 -6.523 1.00 0.00 C ATOM 594 CD LYS A 37 7.146 -4.085 -6.826 1.00 0.00 C ATOM 595 CE LYS A 37 8.119 -4.011 -7.990 1.00 0.00 C ATOM 596 NZ LYS A 37 8.729 -5.335 -8.293 1.00 0.00 N ATOM 0 H LYS A 37 3.772 -2.131 -3.793 1.00 0.00 H new ATOM 0 HA LYS A 37 3.889 -2.417 -6.564 1.00 0.00 H new ATOM 0 HB2 LYS A 37 5.700 -1.824 -4.770 1.00 0.00 H new ATOM 0 HB3 LYS A 37 5.940 -3.555 -4.643 1.00 0.00 H new ATOM 0 HG2 LYS A 37 5.991 -2.369 -7.394 1.00 0.00 H new ATOM 0 HG3 LYS A 37 7.343 -2.006 -6.340 1.00 0.00 H new ATOM 0 HD2 LYS A 37 7.661 -4.462 -5.942 1.00 0.00 H new ATOM 0 HD3 LYS A 37 6.351 -4.794 -7.058 1.00 0.00 H new ATOM 0 HE2 LYS A 37 7.599 -3.641 -8.874 1.00 0.00 H new ATOM 0 HE3 LYS A 37 8.906 -3.294 -7.759 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 9.386 -5.239 -9.093 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 9.247 -5.678 -7.459 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 7.981 -6.014 -8.539 1.00 0.00 H new ATOM 610 N GLY A 38 3.638 -4.768 -7.243 1.00 0.00 N ATOM 611 CA GLY A 38 3.421 -6.141 -7.657 1.00 0.00 C ATOM 612 C GLY A 38 1.975 -6.583 -7.546 1.00 0.00 C ATOM 613 O GLY A 38 1.628 -7.676 -7.991 1.00 0.00 O ATOM 0 H GLY A 38 3.558 -4.079 -7.990 1.00 0.00 H new ATOM 0 HA2 GLY A 38 3.750 -6.258 -8.689 1.00 0.00 H new ATOM 0 HA3 GLY A 38 4.042 -6.798 -7.048 1.00 0.00 H new ATOM 617 N VAL A 39 1.122 -5.745 -6.961 1.00 0.00 N ATOM 618 CA VAL A 39 -0.283 -6.106 -6.809 1.00 0.00 C ATOM 619 C VAL A 39 -1.170 -5.334 -7.787 1.00 0.00 C ATOM 620 O VAL A 39 -2.083 -5.908 -8.385 1.00 0.00 O ATOM 621 CB VAL A 39 -0.784 -5.898 -5.361 1.00 0.00 C ATOM 622 CG1 VAL A 39 -2.227 -6.362 -5.208 1.00 0.00 C ATOM 623 CG2 VAL A 39 0.121 -6.619 -4.371 1.00 0.00 C ATOM 0 H VAL A 39 1.373 -4.828 -6.591 1.00 0.00 H new ATOM 0 HA VAL A 39 -0.354 -7.169 -7.040 1.00 0.00 H new ATOM 0 HB VAL A 39 -0.750 -4.830 -5.144 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -2.553 -6.204 -4.180 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -2.866 -5.792 -5.883 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -2.296 -7.422 -5.452 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -0.249 -6.460 -3.358 1.00 0.00 H new ATOM 0 HG22 VAL A 39 0.125 -7.686 -4.593 1.00 0.00 H new ATOM 0 HG23 VAL A 39 1.135 -6.227 -4.453 1.00 0.00 H new ATOM 633 N TYR A 40 -0.915 -4.042 -7.965 1.00 0.00 N ATOM 634 CA TYR A 40 -1.740 -3.260 -8.883 1.00 0.00 C ATOM 635 C TYR A 40 -0.944 -2.728 -10.068 1.00 0.00 C ATOM 636 O TYR A 40 0.225 -2.362 -9.940 1.00 0.00 O ATOM 637 CB TYR A 40 -2.402 -2.075 -8.181 1.00 0.00 C ATOM 638 CG TYR A 40 -3.636 -2.384 -7.380 1.00 0.00 C ATOM 639 CD1 TYR A 40 -3.553 -2.892 -6.092 1.00 0.00 C ATOM 640 CD2 TYR A 40 -4.893 -2.121 -7.904 1.00 0.00 C ATOM 641 CE1 TYR A 40 -4.690 -3.134 -5.351 1.00 0.00 C ATOM 642 CE2 TYR A 40 -6.033 -2.364 -7.172 1.00 0.00 C ATOM 643 CZ TYR A 40 -5.927 -2.867 -5.898 1.00 0.00 C ATOM 644 OH TYR A 40 -7.060 -3.097 -5.168 1.00 0.00 O ATOM 0 H TYR A 40 -0.167 -3.525 -7.502 1.00 0.00 H new ATOM 0 HA TYR A 40 -2.504 -3.948 -9.245 1.00 0.00 H new ATOM 0 HB2 TYR A 40 -1.669 -1.616 -7.518 1.00 0.00 H new ATOM 0 HB3 TYR A 40 -2.660 -1.331 -8.934 1.00 0.00 H new ATOM 0 HD1 TYR A 40 -2.584 -3.101 -5.664 1.00 0.00 H new ATOM 0 HD2 TYR A 40 -4.979 -1.719 -8.903 1.00 0.00 H new ATOM 0 HE1 TYR A 40 -4.612 -3.530 -4.349 1.00 0.00 H new ATOM 0 HE2 TYR A 40 -7.005 -2.160 -7.597 1.00 0.00 H new ATOM 0 HH TYR A 40 -7.834 -3.136 -5.768 1.00 0.00 H new ATOM 654 N ALA A 41 -1.601 -2.690 -11.220 1.00 0.00 N ATOM 655 CA ALA A 41 -1.011 -2.147 -12.430 1.00 0.00 C ATOM 656 C ALA A 41 -1.618 -0.767 -12.674 1.00 0.00 C ATOM 657 O ALA A 41 -2.842 -0.632 -12.736 1.00 0.00 O ATOM 658 CB ALA A 41 -1.261 -3.070 -13.613 1.00 0.00 C ATOM 0 H ALA A 41 -2.554 -3.034 -11.339 1.00 0.00 H new ATOM 0 HA ALA A 41 0.069 -2.061 -12.314 1.00 0.00 H new ATOM 0 HB1 ALA A 41 -0.810 -2.643 -14.509 1.00 0.00 H new ATOM 0 HB2 ALA A 41 -0.818 -4.046 -13.413 1.00 0.00 H new ATOM 0 HB3 ALA A 41 -2.334 -3.183 -13.766 1.00 0.00 H new ATOM 664 N LEU A 42 -0.780 0.254 -12.805 1.00 0.00 N ATOM 665 CA LEU A 42 -1.284 1.611 -12.993 1.00 0.00 C ATOM 666 C LEU A 42 -1.327 2.034 -14.458 1.00 0.00 C ATOM 667 O LEU A 42 -0.356 1.889 -15.202 1.00 0.00 O ATOM 668 CB LEU A 42 -0.451 2.613 -12.185 1.00 0.00 C ATOM 669 CG LEU A 42 -0.872 4.081 -12.334 1.00 0.00 C ATOM 670 CD1 LEU A 42 -2.305 4.283 -11.862 1.00 0.00 C ATOM 671 CD2 LEU A 42 0.073 4.987 -11.561 1.00 0.00 C ATOM 0 H LEU A 42 0.237 0.173 -12.785 1.00 0.00 H new ATOM 0 HA LEU A 42 -2.312 1.610 -12.629 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -0.506 2.341 -11.131 1.00 0.00 H new ATOM 0 HB3 LEU A 42 0.593 2.519 -12.484 1.00 0.00 H new ATOM 0 HG LEU A 42 -0.820 4.344 -13.390 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -2.582 5.331 -11.977 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -2.975 3.663 -12.458 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -2.386 3.999 -10.813 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -0.241 6.024 -11.678 1.00 0.00 H new ATOM 0 HD22 LEU A 42 0.052 4.718 -10.505 1.00 0.00 H new ATOM 0 HD23 LEU A 42 1.086 4.869 -11.945 1.00 0.00 H new ATOM 683 N LYS A 43 -2.482 2.562 -14.845 1.00 0.00 N ATOM 684 CA LYS A 43 -2.723 3.057 -16.185 1.00 0.00 C ATOM 685 C LYS A 43 -3.224 4.488 -16.080 1.00 0.00 C ATOM 686 O LYS A 43 -4.097 4.794 -15.276 1.00 0.00 O ATOM 687 CB LYS A 43 -3.751 2.196 -16.920 1.00 0.00 C ATOM 688 CG LYS A 43 -3.167 1.343 -18.032 1.00 0.00 C ATOM 689 CD LYS A 43 -2.313 0.210 -17.489 1.00 0.00 C ATOM 690 CE LYS A 43 -1.862 -0.718 -18.604 1.00 0.00 C ATOM 691 NZ LYS A 43 -1.015 -1.832 -18.094 1.00 0.00 N ATOM 0 H LYS A 43 -3.286 2.657 -14.224 1.00 0.00 H new ATOM 0 HA LYS A 43 -1.795 3.016 -16.755 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -4.245 1.545 -16.199 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -4.518 2.846 -17.341 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -3.975 0.931 -18.636 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -2.564 1.968 -18.691 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -1.442 0.620 -16.978 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -2.880 -0.355 -16.749 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -2.736 -1.129 -19.109 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -1.303 -0.148 -19.346 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -0.729 -2.441 -18.887 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -0.168 -1.442 -17.634 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -1.556 -2.392 -17.405 1.00 0.00 H new ATOM 705 N VAL A 44 -2.655 5.359 -16.883 1.00 0.00 N ATOM 706 CA VAL A 44 -3.016 6.769 -16.877 1.00 0.00 C ATOM 707 C VAL A 44 -3.539 7.193 -18.235 1.00 0.00 C ATOM 708 O VAL A 44 -2.915 6.949 -19.268 1.00 0.00 O ATOM 709 CB VAL A 44 -1.805 7.627 -16.465 1.00 0.00 C ATOM 710 CG1 VAL A 44 -2.126 9.114 -16.538 1.00 0.00 C ATOM 711 CG2 VAL A 44 -1.338 7.249 -15.067 1.00 0.00 C ATOM 0 H VAL A 44 -1.930 5.116 -17.559 1.00 0.00 H new ATOM 0 HA VAL A 44 -3.811 6.921 -16.147 1.00 0.00 H new ATOM 0 HB VAL A 44 -0.998 7.427 -17.170 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -1.250 9.690 -16.241 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -2.404 9.377 -17.559 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -2.954 9.341 -15.867 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -0.482 7.864 -14.791 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -2.148 7.414 -14.356 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -1.050 6.198 -15.051 1.00 0.00 H new ATOM 721 N ILE A 45 -4.704 7.830 -18.215 1.00 0.00 N ATOM 722 CA ILE A 45 -5.370 8.274 -19.420 1.00 0.00 C ATOM 723 C ILE A 45 -5.359 9.799 -19.488 1.00 0.00 C ATOM 724 O ILE A 45 -5.964 10.466 -18.643 1.00 0.00 O ATOM 725 CB ILE A 45 -6.835 7.779 -19.400 1.00 0.00 C ATOM 726 CG1 ILE A 45 -6.896 6.274 -19.099 1.00 0.00 C ATOM 727 CG2 ILE A 45 -7.560 8.097 -20.706 1.00 0.00 C ATOM 728 CD1 ILE A 45 -6.170 5.402 -20.099 1.00 0.00 C ATOM 0 H ILE A 45 -5.210 8.051 -17.357 1.00 0.00 H new ATOM 0 HA ILE A 45 -4.850 7.871 -20.289 1.00 0.00 H new ATOM 0 HB ILE A 45 -7.349 8.315 -18.602 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -6.475 6.097 -18.109 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -7.941 5.967 -19.060 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -8.586 7.733 -20.651 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -7.566 9.175 -20.866 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -7.046 7.610 -21.535 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -6.266 4.356 -19.807 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -6.605 5.544 -21.089 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -5.115 5.677 -20.123 1.00 0.00 H new ATOM 740 N ASP A 46 -4.664 10.356 -20.475 1.00 0.00 N ATOM 741 CA ASP A 46 -4.612 11.805 -20.636 1.00 0.00 C ATOM 742 C ASP A 46 -5.815 12.253 -21.460 1.00 0.00 C ATOM 743 O ASP A 46 -5.815 12.129 -22.686 1.00 0.00 O ATOM 744 CB ASP A 46 -3.306 12.217 -21.328 1.00 0.00 C ATOM 745 CG ASP A 46 -3.083 13.722 -21.334 1.00 0.00 C ATOM 746 OD1 ASP A 46 -4.022 14.477 -20.994 1.00 0.00 O ATOM 747 OD2 ASP A 46 -1.961 14.148 -21.679 1.00 0.00 O ATOM 0 H ASP A 46 -4.133 9.831 -21.170 1.00 0.00 H new ATOM 0 HA ASP A 46 -4.642 12.284 -19.657 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -2.468 11.733 -20.826 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -3.316 11.853 -22.355 1.00 0.00 H new ATOM 752 N VAL A 47 -6.824 12.781 -20.782 1.00 0.00 N ATOM 753 CA VAL A 47 -8.056 13.207 -21.447 1.00 0.00 C ATOM 754 C VAL A 47 -7.849 14.368 -22.432 1.00 0.00 C ATOM 755 O VAL A 47 -8.531 14.438 -23.447 1.00 0.00 O ATOM 756 CB VAL A 47 -9.147 13.577 -20.416 1.00 0.00 C ATOM 757 CG1 VAL A 47 -9.434 12.394 -19.498 1.00 0.00 C ATOM 758 CG2 VAL A 47 -8.750 14.800 -19.602 1.00 0.00 C ATOM 0 H VAL A 47 -6.818 12.926 -19.772 1.00 0.00 H new ATOM 0 HA VAL A 47 -8.386 12.349 -22.032 1.00 0.00 H new ATOM 0 HB VAL A 47 -10.056 13.824 -20.965 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -10.204 12.671 -18.778 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -9.780 11.548 -20.092 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -8.524 12.116 -18.967 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -9.539 15.033 -18.887 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -7.823 14.595 -19.066 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -8.603 15.649 -20.269 1.00 0.00 H new ATOM 768 N LEU A 48 -6.936 15.290 -22.128 1.00 0.00 N ATOM 769 CA LEU A 48 -6.675 16.420 -23.025 1.00 0.00 C ATOM 770 C LEU A 48 -5.948 15.980 -24.295 1.00 0.00 C ATOM 771 O LEU A 48 -6.230 16.475 -25.384 1.00 0.00 O ATOM 772 CB LEU A 48 -5.880 17.524 -22.323 1.00 0.00 C ATOM 773 CG LEU A 48 -6.651 18.296 -21.248 1.00 0.00 C ATOM 774 CD1 LEU A 48 -5.728 19.261 -20.522 1.00 0.00 C ATOM 775 CD2 LEU A 48 -7.825 19.043 -21.863 1.00 0.00 C ATOM 0 H LEU A 48 -6.370 15.280 -21.279 1.00 0.00 H new ATOM 0 HA LEU A 48 -7.647 16.822 -23.310 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -4.996 17.079 -21.866 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -5.528 18.231 -23.074 1.00 0.00 H new ATOM 0 HG LEU A 48 -7.041 17.580 -20.525 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -6.292 19.801 -19.762 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -4.920 18.704 -20.047 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -5.309 19.970 -21.236 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -8.360 19.585 -21.083 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -7.457 19.748 -22.608 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -8.500 18.332 -22.339 1.00 0.00 H new ATOM 787 N LYS A 49 -5.002 15.054 -24.143 1.00 0.00 N ATOM 788 CA LYS A 49 -4.233 14.548 -25.279 1.00 0.00 C ATOM 789 C LYS A 49 -5.103 13.674 -26.173 1.00 0.00 C ATOM 790 O LYS A 49 -5.029 13.749 -27.400 1.00 0.00 O ATOM 791 CB LYS A 49 -3.019 13.761 -24.793 1.00 0.00 C ATOM 792 CG LYS A 49 -2.124 13.262 -25.915 1.00 0.00 C ATOM 793 CD LYS A 49 -0.917 12.532 -25.366 1.00 0.00 C ATOM 794 CE LYS A 49 -0.017 12.026 -26.481 1.00 0.00 C ATOM 795 NZ LYS A 49 1.180 11.314 -25.955 1.00 0.00 N ATOM 0 H LYS A 49 -4.750 14.640 -23.246 1.00 0.00 H new ATOM 0 HA LYS A 49 -3.887 15.401 -25.862 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -2.432 14.392 -24.125 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -3.361 12.908 -24.207 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -2.690 12.596 -26.567 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -1.797 14.104 -26.525 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -0.352 13.199 -24.715 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -1.246 11.693 -24.753 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -0.583 11.355 -27.127 1.00 0.00 H new ATOM 0 HE3 LYS A 49 0.303 12.866 -27.097 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 1.766 10.986 -26.749 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 1.735 11.961 -25.360 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 0.876 10.497 -25.388 1.00 0.00 H new ATOM 809 N ASN A 50 -5.936 12.849 -25.547 1.00 0.00 N ATOM 810 CA ASN A 50 -6.832 11.965 -26.282 1.00 0.00 C ATOM 811 C ASN A 50 -8.261 12.114 -25.783 1.00 0.00 C ATOM 812 O ASN A 50 -8.783 11.236 -25.091 1.00 0.00 O ATOM 813 CB ASN A 50 -6.394 10.505 -26.143 1.00 0.00 C ATOM 814 CG ASN A 50 -5.002 10.247 -26.685 1.00 0.00 C ATOM 815 OD1 ASN A 50 -4.100 9.855 -25.946 1.00 0.00 O ATOM 816 ND2 ASN A 50 -4.819 10.461 -27.981 1.00 0.00 N ATOM 0 H ASN A 50 -6.009 12.775 -24.532 1.00 0.00 H new ATOM 0 HA ASN A 50 -6.788 12.249 -27.333 1.00 0.00 H new ATOM 0 HB2 ASN A 50 -6.426 10.221 -25.091 1.00 0.00 H new ATOM 0 HB3 ASN A 50 -7.105 9.867 -26.667 1.00 0.00 H new ATOM 0 HD21 ASN A 50 -3.903 10.300 -28.400 1.00 0.00 H new ATOM 0 HD22 ASN A 50 -5.594 10.786 -28.559 1.00 0.00 H new ATOM 823 N PRO A 51 -8.915 13.234 -26.133 1.00 0.00 N ATOM 824 CA PRO A 51 -10.297 13.505 -25.726 1.00 0.00 C ATOM 825 C PRO A 51 -11.281 12.468 -26.257 1.00 0.00 C ATOM 826 O PRO A 51 -12.365 12.292 -25.700 1.00 0.00 O ATOM 827 CB PRO A 51 -10.586 14.893 -26.309 1.00 0.00 C ATOM 828 CG PRO A 51 -9.556 15.096 -27.366 1.00 0.00 C ATOM 829 CD PRO A 51 -8.347 14.339 -26.921 1.00 0.00 C ATOM 0 HA PRO A 51 -10.414 13.461 -24.643 1.00 0.00 H new ATOM 0 HB2 PRO A 51 -11.592 14.943 -26.725 1.00 0.00 H new ATOM 0 HB3 PRO A 51 -10.519 15.664 -25.541 1.00 0.00 H new ATOM 0 HG2 PRO A 51 -9.911 14.731 -28.330 1.00 0.00 H new ATOM 0 HG3 PRO A 51 -9.329 16.155 -27.490 1.00 0.00 H new ATOM 0 HD2 PRO A 51 -7.766 13.973 -27.768 1.00 0.00 H new ATOM 0 HD3 PRO A 51 -7.681 14.960 -26.322 1.00 0.00 H new ATOM 837 N GLN A 52 -10.903 11.789 -27.338 1.00 0.00 N ATOM 838 CA GLN A 52 -11.739 10.744 -27.918 1.00 0.00 C ATOM 839 C GLN A 52 -11.900 9.618 -26.917 1.00 0.00 C ATOM 840 O GLN A 52 -12.991 9.086 -26.739 1.00 0.00 O ATOM 841 CB GLN A 52 -11.109 10.201 -29.204 1.00 0.00 C ATOM 842 CG GLN A 52 -11.079 11.204 -30.349 1.00 0.00 C ATOM 843 CD GLN A 52 -9.772 11.975 -30.416 1.00 0.00 C ATOM 844 OE1 GLN A 52 -9.050 12.088 -29.424 1.00 0.00 O ATOM 845 NE2 GLN A 52 -9.460 12.512 -31.588 1.00 0.00 N ATOM 0 H GLN A 52 -10.023 11.945 -27.829 1.00 0.00 H new ATOM 0 HA GLN A 52 -12.714 11.167 -28.161 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -10.090 9.879 -28.990 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -11.662 9.317 -29.523 1.00 0.00 H new ATOM 0 HG2 GLN A 52 -11.236 10.679 -31.291 1.00 0.00 H new ATOM 0 HG3 GLN A 52 -11.905 11.906 -30.234 1.00 0.00 H new ATOM 0 HE21 GLN A 52 -10.085 12.395 -32.385 1.00 0.00 H new ATOM 0 HE22 GLN A 52 -8.595 13.042 -31.692 1.00 0.00 H new ATOM 854 N LEU A 53 -10.804 9.285 -26.241 1.00 0.00 N ATOM 855 CA LEU A 53 -10.821 8.227 -25.245 1.00 0.00 C ATOM 856 C LEU A 53 -11.595 8.688 -24.019 1.00 0.00 C ATOM 857 O LEU A 53 -12.303 7.903 -23.384 1.00 0.00 O ATOM 858 CB LEU A 53 -9.401 7.802 -24.875 1.00 0.00 C ATOM 859 CG LEU A 53 -8.627 7.115 -26.001 1.00 0.00 C ATOM 860 CD1 LEU A 53 -7.182 6.874 -25.593 1.00 0.00 C ATOM 861 CD2 LEU A 53 -9.299 5.808 -26.394 1.00 0.00 C ATOM 0 H LEU A 53 -9.897 9.733 -26.367 1.00 0.00 H new ATOM 0 HA LEU A 53 -11.322 7.355 -25.665 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -8.844 8.683 -24.554 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -9.449 7.127 -24.021 1.00 0.00 H new ATOM 0 HG LEU A 53 -8.630 7.775 -26.868 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -6.650 6.384 -26.409 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -6.704 7.827 -25.368 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -7.155 6.237 -24.709 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -8.733 5.335 -27.196 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -9.332 5.142 -25.532 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -10.314 6.009 -26.736 1.00 0.00 H new ATOM 873 N ALA A 54 -11.447 9.975 -23.690 1.00 0.00 N ATOM 874 CA ALA A 54 -12.142 10.564 -22.555 1.00 0.00 C ATOM 875 C ALA A 54 -13.646 10.525 -22.782 1.00 0.00 C ATOM 876 O ALA A 54 -14.411 10.222 -21.875 1.00 0.00 O ATOM 877 CB ALA A 54 -11.686 11.999 -22.344 1.00 0.00 C ATOM 0 H ALA A 54 -10.849 10.626 -24.199 1.00 0.00 H new ATOM 0 HA ALA A 54 -11.904 9.984 -21.663 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -12.214 12.427 -21.492 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -10.613 12.015 -22.152 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -11.903 12.585 -23.237 1.00 0.00 H new ATOM 883 N GLU A 55 -14.053 10.844 -24.009 1.00 0.00 N ATOM 884 CA GLU A 55 -15.460 10.829 -24.392 1.00 0.00 C ATOM 885 C GLU A 55 -15.995 9.403 -24.377 1.00 0.00 C ATOM 886 O GLU A 55 -17.132 9.163 -23.976 1.00 0.00 O ATOM 887 CB GLU A 55 -15.660 11.454 -25.775 1.00 0.00 C ATOM 888 CG GLU A 55 -17.122 11.542 -26.196 1.00 0.00 C ATOM 889 CD GLU A 55 -17.307 12.199 -27.551 1.00 0.00 C ATOM 890 OE1 GLU A 55 -16.293 12.584 -28.170 1.00 0.00 O ATOM 891 OE2 GLU A 55 -18.468 12.330 -27.991 1.00 0.00 O ATOM 0 H GLU A 55 -13.420 11.118 -24.760 1.00 0.00 H new ATOM 0 HA GLU A 55 -16.015 11.424 -23.667 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -15.228 12.455 -25.779 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -15.112 10.868 -26.513 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -17.548 10.539 -26.223 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -17.678 12.105 -25.446 1.00 0.00 H new ATOM 898 N GLU A 56 -15.164 8.462 -24.825 1.00 0.00 N ATOM 899 CA GLU A 56 -15.547 7.058 -24.864 1.00 0.00 C ATOM 900 C GLU A 56 -15.861 6.552 -23.456 1.00 0.00 C ATOM 901 O GLU A 56 -16.811 5.797 -23.260 1.00 0.00 O ATOM 902 CB GLU A 56 -14.429 6.218 -25.492 1.00 0.00 C ATOM 903 CG GLU A 56 -14.224 6.480 -26.981 1.00 0.00 C ATOM 904 CD GLU A 56 -15.463 6.192 -27.808 1.00 0.00 C ATOM 905 OE1 GLU A 56 -16.044 5.100 -27.646 1.00 0.00 O ATOM 906 OE2 GLU A 56 -15.850 7.061 -28.617 1.00 0.00 O ATOM 0 H GLU A 56 -14.221 8.651 -25.165 1.00 0.00 H new ATOM 0 HA GLU A 56 -16.443 6.961 -25.477 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -13.496 6.420 -24.965 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -14.655 5.162 -25.346 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -13.931 7.520 -27.125 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -13.401 5.864 -27.343 1.00 0.00 H new ATOM 913 N ASP A 57 -15.062 6.973 -22.473 1.00 0.00 N ATOM 914 CA ASP A 57 -15.301 6.573 -21.086 1.00 0.00 C ATOM 915 C ASP A 57 -16.095 7.646 -20.336 1.00 0.00 C ATOM 916 O ASP A 57 -16.254 7.568 -19.119 1.00 0.00 O ATOM 917 CB ASP A 57 -13.990 6.243 -20.353 1.00 0.00 C ATOM 918 CG ASP A 57 -13.362 4.942 -20.810 1.00 0.00 C ATOM 919 OD1 ASP A 57 -14.045 4.159 -21.502 1.00 0.00 O ATOM 920 OD2 ASP A 57 -12.183 4.706 -20.470 1.00 0.00 O ATOM 0 H ASP A 57 -14.255 7.582 -22.609 1.00 0.00 H new ATOM 0 HA ASP A 57 -15.898 5.661 -21.108 1.00 0.00 H new ATOM 0 HB2 ASP A 57 -13.280 7.056 -20.508 1.00 0.00 H new ATOM 0 HB3 ASP A 57 -14.184 6.189 -19.282 1.00 0.00 H new ATOM 925 N LYS A 58 -16.589 8.636 -21.090 1.00 0.00 N ATOM 926 CA LYS A 58 -17.402 9.736 -20.549 1.00 0.00 C ATOM 927 C LYS A 58 -16.755 10.417 -19.343 1.00 0.00 C ATOM 928 O LYS A 58 -17.382 10.580 -18.295 1.00 0.00 O ATOM 929 CB LYS A 58 -18.805 9.238 -20.201 1.00 0.00 C ATOM 930 CG LYS A 58 -19.601 8.784 -21.416 1.00 0.00 C ATOM 931 CD LYS A 58 -20.993 8.311 -21.030 1.00 0.00 C ATOM 932 CE LYS A 58 -21.797 7.888 -22.249 1.00 0.00 C ATOM 933 NZ LYS A 58 -21.177 6.729 -22.950 1.00 0.00 N ATOM 0 H LYS A 58 -16.436 8.698 -22.097 1.00 0.00 H new ATOM 0 HA LYS A 58 -17.472 10.493 -21.331 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -18.725 8.409 -19.497 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -19.351 10.034 -19.695 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -19.680 9.606 -22.127 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -19.069 7.977 -21.919 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -20.914 7.474 -20.337 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -21.518 9.110 -20.507 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -22.810 7.627 -21.943 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -21.879 8.728 -22.939 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -21.848 6.344 -23.645 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -20.313 7.040 -23.439 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -20.936 5.992 -22.257 1.00 0.00 H new ATOM 947 N ILE A 59 -15.504 10.820 -19.504 1.00 0.00 N ATOM 948 CA ILE A 59 -14.774 11.486 -18.436 1.00 0.00 C ATOM 949 C ILE A 59 -15.009 12.994 -18.486 1.00 0.00 C ATOM 950 O ILE A 59 -14.510 13.684 -19.375 1.00 0.00 O ATOM 951 CB ILE A 59 -13.261 11.194 -18.542 1.00 0.00 C ATOM 952 CG1 ILE A 59 -13.013 9.684 -18.559 1.00 0.00 C ATOM 953 CG2 ILE A 59 -12.499 11.848 -17.397 1.00 0.00 C ATOM 954 CD1 ILE A 59 -13.509 8.973 -17.320 1.00 0.00 C ATOM 0 H ILE A 59 -14.972 10.697 -20.366 1.00 0.00 H new ATOM 0 HA ILE A 59 -15.142 11.099 -17.486 1.00 0.00 H new ATOM 0 HB ILE A 59 -12.895 11.619 -19.476 1.00 0.00 H new ATOM 0 HG12 ILE A 59 -13.501 9.254 -19.434 1.00 0.00 H new ATOM 0 HG13 ILE A 59 -11.944 9.501 -18.669 1.00 0.00 H new ATOM 0 HG21 ILE A 59 -11.436 11.627 -17.494 1.00 0.00 H new ATOM 0 HG22 ILE A 59 -12.650 12.927 -17.429 1.00 0.00 H new ATOM 0 HG23 ILE A 59 -12.865 11.458 -16.447 1.00 0.00 H new ATOM 0 HD11 ILE A 59 -13.299 7.907 -17.404 1.00 0.00 H new ATOM 0 HD12 ILE A 59 -13.003 9.375 -16.443 1.00 0.00 H new ATOM 0 HD13 ILE A 59 -14.584 9.124 -17.220 1.00 0.00 H new ATOM 966 N LEU A 60 -15.780 13.498 -17.526 1.00 0.00 N ATOM 967 CA LEU A 60 -16.090 14.923 -17.459 1.00 0.00 C ATOM 968 C LEU A 60 -15.361 15.607 -16.304 1.00 0.00 C ATOM 969 O LEU A 60 -15.540 16.803 -16.071 1.00 0.00 O ATOM 970 CB LEU A 60 -17.602 15.131 -17.314 1.00 0.00 C ATOM 971 CG LEU A 60 -18.454 14.557 -18.449 1.00 0.00 C ATOM 972 CD1 LEU A 60 -19.933 14.751 -18.157 1.00 0.00 C ATOM 973 CD2 LEU A 60 -18.086 15.206 -19.776 1.00 0.00 C ATOM 0 H LEU A 60 -16.202 12.940 -16.783 1.00 0.00 H new ATOM 0 HA LEU A 60 -15.747 15.377 -18.389 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -17.926 14.681 -16.376 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -17.799 16.200 -17.239 1.00 0.00 H new ATOM 0 HG LEU A 60 -18.253 13.488 -18.520 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -20.523 14.337 -18.975 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -20.191 14.241 -17.229 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -20.148 15.815 -18.058 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -18.702 14.785 -20.570 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -18.257 16.281 -19.715 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -17.035 15.018 -19.994 1.00 0.00 H new ATOM 985 N ALA A 61 -14.539 14.852 -15.582 1.00 0.00 N ATOM 986 CA ALA A 61 -13.802 15.399 -14.449 1.00 0.00 C ATOM 987 C ALA A 61 -12.401 14.804 -14.359 1.00 0.00 C ATOM 988 O ALA A 61 -12.178 13.658 -14.748 1.00 0.00 O ATOM 989 CB ALA A 61 -14.561 15.150 -13.154 1.00 0.00 C ATOM 0 H ALA A 61 -14.367 13.863 -15.761 1.00 0.00 H new ATOM 0 HA ALA A 61 -13.703 16.474 -14.603 1.00 0.00 H new ATOM 0 HB1 ALA A 61 -13.998 15.564 -12.317 1.00 0.00 H new ATOM 0 HB2 ALA A 61 -15.538 15.630 -13.207 1.00 0.00 H new ATOM 0 HB3 ALA A 61 -14.691 14.078 -13.009 1.00 0.00 H new ATOM 995 N THR A 62 -11.464 15.594 -13.846 1.00 0.00 N ATOM 996 CA THR A 62 -10.081 15.167 -13.688 1.00 0.00 C ATOM 997 C THR A 62 -9.448 15.834 -12.470 1.00 0.00 C ATOM 998 O THR A 62 -9.683 17.015 -12.212 1.00 0.00 O ATOM 999 CB THR A 62 -9.226 15.523 -14.925 1.00 0.00 C ATOM 1000 OG1 THR A 62 -9.434 16.895 -15.282 1.00 0.00 O ATOM 1001 CG2 THR A 62 -9.543 14.629 -16.113 1.00 0.00 C ATOM 0 H THR A 62 -11.643 16.547 -13.529 1.00 0.00 H new ATOM 0 HA THR A 62 -10.102 14.084 -13.563 1.00 0.00 H new ATOM 0 HB THR A 62 -8.181 15.363 -14.660 1.00 0.00 H new ATOM 0 HG1 THR A 62 -9.787 16.946 -16.195 1.00 0.00 H new ATOM 0 HG21 THR A 62 -8.919 14.915 -16.960 1.00 0.00 H new ATOM 0 HG22 THR A 62 -9.344 13.590 -15.850 1.00 0.00 H new ATOM 0 HG23 THR A 62 -10.593 14.740 -16.382 1.00 0.00 H new ATOM 1009 N PRO A 63 -8.635 15.087 -11.706 1.00 0.00 N ATOM 1010 CA PRO A 63 -8.374 13.674 -11.971 1.00 0.00 C ATOM 1011 C PRO A 63 -9.495 12.762 -11.466 1.00 0.00 C ATOM 1012 O PRO A 63 -10.195 13.085 -10.508 1.00 0.00 O ATOM 1013 CB PRO A 63 -7.080 13.416 -11.207 1.00 0.00 C ATOM 1014 CG PRO A 63 -7.114 14.368 -10.063 1.00 0.00 C ATOM 1015 CD PRO A 63 -7.883 15.577 -10.533 1.00 0.00 C ATOM 0 HA PRO A 63 -8.308 13.461 -13.038 1.00 0.00 H new ATOM 0 HB2 PRO A 63 -7.025 12.384 -10.861 1.00 0.00 H new ATOM 0 HB3 PRO A 63 -6.208 13.588 -11.838 1.00 0.00 H new ATOM 0 HG2 PRO A 63 -7.595 13.915 -9.196 1.00 0.00 H new ATOM 0 HG3 PRO A 63 -6.105 14.645 -9.759 1.00 0.00 H new ATOM 0 HD2 PRO A 63 -8.552 15.951 -9.758 1.00 0.00 H new ATOM 0 HD3 PRO A 63 -7.215 16.396 -10.800 1.00 0.00 H new ATOM 1023 N THR A 64 -9.651 11.622 -12.123 1.00 0.00 N ATOM 1024 CA THR A 64 -10.658 10.639 -11.734 1.00 0.00 C ATOM 1025 C THR A 64 -9.988 9.289 -11.512 1.00 0.00 C ATOM 1026 O THR A 64 -9.226 8.815 -12.359 1.00 0.00 O ATOM 1027 CB THR A 64 -11.786 10.492 -12.780 1.00 0.00 C ATOM 1028 OG1 THR A 64 -12.453 11.746 -12.956 1.00 0.00 O ATOM 1029 CG2 THR A 64 -12.808 9.445 -12.350 1.00 0.00 C ATOM 0 H THR A 64 -9.091 11.352 -12.932 1.00 0.00 H new ATOM 0 HA THR A 64 -11.120 10.995 -10.813 1.00 0.00 H new ATOM 0 HB THR A 64 -11.330 10.173 -13.717 1.00 0.00 H new ATOM 0 HG1 THR A 64 -12.085 12.205 -13.740 1.00 0.00 H new ATOM 0 HG21 THR A 64 -13.588 9.366 -13.107 1.00 0.00 H new ATOM 0 HG22 THR A 64 -12.314 8.480 -12.235 1.00 0.00 H new ATOM 0 HG23 THR A 64 -13.253 9.740 -11.400 1.00 0.00 H new ATOM 1037 N LEU A 65 -10.276 8.681 -10.373 1.00 0.00 N ATOM 1038 CA LEU A 65 -9.700 7.394 -10.014 1.00 0.00 C ATOM 1039 C LEU A 65 -10.699 6.275 -10.296 1.00 0.00 C ATOM 1040 O LEU A 65 -11.796 6.277 -9.754 1.00 0.00 O ATOM 1041 CB LEU A 65 -9.338 7.407 -8.524 1.00 0.00 C ATOM 1042 CG LEU A 65 -8.503 6.226 -8.037 1.00 0.00 C ATOM 1043 CD1 LEU A 65 -7.128 6.262 -8.679 1.00 0.00 C ATOM 1044 CD2 LEU A 65 -8.382 6.241 -6.521 1.00 0.00 C ATOM 0 H LEU A 65 -10.913 9.063 -9.674 1.00 0.00 H new ATOM 0 HA LEU A 65 -8.804 7.218 -10.609 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -8.794 8.327 -8.309 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -10.261 7.440 -7.945 1.00 0.00 H new ATOM 0 HG LEU A 65 -9.004 5.303 -8.328 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -6.539 5.416 -8.326 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -7.231 6.205 -9.763 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -6.625 7.191 -8.410 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -7.783 5.391 -6.195 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -7.901 7.166 -6.204 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -9.375 6.177 -6.076 1.00 0.00 H new ATOM 1056 N ALA A 66 -10.332 5.330 -11.155 1.00 0.00 N ATOM 1057 CA ALA A 66 -11.230 4.224 -11.474 1.00 0.00 C ATOM 1058 C ALA A 66 -10.475 2.912 -11.653 1.00 0.00 C ATOM 1059 O ALA A 66 -9.449 2.849 -12.329 1.00 0.00 O ATOM 1060 CB ALA A 66 -12.040 4.520 -12.729 1.00 0.00 C ATOM 0 H ALA A 66 -9.433 5.306 -11.637 1.00 0.00 H new ATOM 0 HA ALA A 66 -11.908 4.117 -10.627 1.00 0.00 H new ATOM 0 HB1 ALA A 66 -12.700 3.679 -12.943 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -12.636 5.419 -12.574 1.00 0.00 H new ATOM 0 HB3 ALA A 66 -11.364 4.674 -13.570 1.00 0.00 H new ATOM 1066 N LYS A 67 -11.007 1.864 -11.035 1.00 0.00 N ATOM 1067 CA LYS A 67 -10.437 0.536 -11.147 1.00 0.00 C ATOM 1068 C LYS A 67 -11.185 -0.173 -12.254 1.00 0.00 C ATOM 1069 O LYS A 67 -12.319 -0.608 -12.065 1.00 0.00 O ATOM 1070 CB LYS A 67 -10.585 -0.235 -9.825 1.00 0.00 C ATOM 1071 CG LYS A 67 -10.024 -1.658 -9.861 1.00 0.00 C ATOM 1072 CD LYS A 67 -9.936 -2.283 -8.471 1.00 0.00 C ATOM 1073 CE LYS A 67 -11.187 -3.078 -8.114 1.00 0.00 C ATOM 1074 NZ LYS A 67 -10.996 -3.894 -6.884 1.00 0.00 N ATOM 0 H LYS A 67 -11.839 1.914 -10.448 1.00 0.00 H new ATOM 0 HA LYS A 67 -9.371 0.595 -11.369 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -10.082 0.322 -9.035 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -11.641 -0.280 -9.560 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -10.656 -2.279 -10.496 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -9.033 -1.644 -10.314 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -9.066 -2.938 -8.424 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -9.784 -1.497 -7.731 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -12.023 -2.393 -7.969 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -11.451 -3.732 -8.945 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -11.050 -4.904 -7.126 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -10.065 -3.686 -6.470 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -11.740 -3.663 -6.195 1.00 0.00 H new ATOM 1088 N VAL A 68 -10.557 -0.284 -13.406 1.00 0.00 N ATOM 1089 CA VAL A 68 -11.198 -0.901 -14.547 1.00 0.00 C ATOM 1090 C VAL A 68 -11.208 -2.424 -14.433 1.00 0.00 C ATOM 1091 O VAL A 68 -12.123 -3.085 -14.927 1.00 0.00 O ATOM 1092 CB VAL A 68 -10.537 -0.432 -15.862 1.00 0.00 C ATOM 1093 CG1 VAL A 68 -9.282 -1.229 -16.182 1.00 0.00 C ATOM 1094 CG2 VAL A 68 -11.535 -0.473 -17.006 1.00 0.00 C ATOM 0 H VAL A 68 -9.606 0.044 -13.576 1.00 0.00 H new ATOM 0 HA VAL A 68 -12.239 -0.579 -14.561 1.00 0.00 H new ATOM 0 HB VAL A 68 -10.222 0.603 -15.726 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -8.849 -0.867 -17.114 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -8.559 -1.109 -15.375 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -9.537 -2.284 -16.286 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -11.051 -0.139 -17.924 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -11.897 -1.493 -17.137 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -12.375 0.184 -16.780 1.00 0.00 H new ATOM 1104 N LEU A 69 -10.196 -2.977 -13.770 1.00 0.00 N ATOM 1105 CA LEU A 69 -10.111 -4.427 -13.602 1.00 0.00 C ATOM 1106 C LEU A 69 -9.687 -4.787 -12.182 1.00 0.00 C ATOM 1107 O LEU A 69 -8.806 -4.142 -11.616 1.00 0.00 O ATOM 1108 CB LEU A 69 -9.117 -5.037 -14.603 1.00 0.00 C ATOM 1109 CG LEU A 69 -9.492 -4.898 -16.084 1.00 0.00 C ATOM 1110 CD1 LEU A 69 -8.333 -5.326 -16.970 1.00 0.00 C ATOM 1111 CD2 LEU A 69 -10.730 -5.721 -16.405 1.00 0.00 C ATOM 0 H LEU A 69 -9.432 -2.452 -13.345 1.00 0.00 H new ATOM 0 HA LEU A 69 -11.103 -4.838 -13.791 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -8.143 -4.572 -14.449 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -9.004 -6.097 -14.374 1.00 0.00 H new ATOM 0 HG LEU A 69 -9.713 -3.849 -16.281 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -8.617 -5.221 -18.017 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -7.466 -4.698 -16.764 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -8.083 -6.367 -16.765 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -10.978 -5.608 -17.460 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -10.535 -6.771 -16.189 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -11.565 -5.374 -15.797 1.00 0.00 H new ATOM 1123 N PRO A 70 -10.290 -5.834 -11.587 1.00 0.00 N ATOM 1124 CA PRO A 70 -11.349 -6.633 -12.224 1.00 0.00 C ATOM 1125 C PRO A 70 -12.725 -5.954 -12.162 1.00 0.00 C ATOM 1126 O PRO A 70 -12.996 -5.185 -11.241 1.00 0.00 O ATOM 1127 CB PRO A 70 -11.348 -7.912 -11.387 1.00 0.00 C ATOM 1128 CG PRO A 70 -10.947 -7.459 -10.027 1.00 0.00 C ATOM 1129 CD PRO A 70 -9.966 -6.337 -10.235 1.00 0.00 C ATOM 0 HA PRO A 70 -11.166 -6.788 -13.287 1.00 0.00 H new ATOM 0 HB2 PRO A 70 -12.332 -8.382 -11.376 1.00 0.00 H new ATOM 0 HB3 PRO A 70 -10.648 -8.647 -11.784 1.00 0.00 H new ATOM 0 HG2 PRO A 70 -11.813 -7.120 -9.458 1.00 0.00 H new ATOM 0 HG3 PRO A 70 -10.494 -8.274 -9.462 1.00 0.00 H new ATOM 0 HD2 PRO A 70 -10.081 -5.559 -9.480 1.00 0.00 H new ATOM 0 HD3 PRO A 70 -8.936 -6.689 -10.175 1.00 0.00 H new ATOM 1137 N PRO A 71 -13.602 -6.222 -13.153 1.00 0.00 N ATOM 1138 CA PRO A 71 -14.963 -5.662 -13.192 1.00 0.00 C ATOM 1139 C PRO A 71 -15.799 -6.105 -11.987 1.00 0.00 C ATOM 1140 O PRO A 71 -15.568 -7.184 -11.438 1.00 0.00 O ATOM 1141 CB PRO A 71 -15.554 -6.235 -14.486 1.00 0.00 C ATOM 1142 CG PRO A 71 -14.371 -6.601 -15.308 1.00 0.00 C ATOM 1143 CD PRO A 71 -13.337 -7.067 -14.327 1.00 0.00 C ATOM 0 HA PRO A 71 -14.956 -4.572 -13.160 1.00 0.00 H new ATOM 0 HB2 PRO A 71 -16.181 -7.104 -14.285 1.00 0.00 H new ATOM 0 HB3 PRO A 71 -16.179 -5.502 -14.995 1.00 0.00 H new ATOM 0 HG2 PRO A 71 -14.617 -7.386 -16.023 1.00 0.00 H new ATOM 0 HG3 PRO A 71 -14.012 -5.747 -15.882 1.00 0.00 H new ATOM 0 HD2 PRO A 71 -13.446 -8.127 -14.096 1.00 0.00 H new ATOM 0 HD3 PRO A 71 -12.325 -6.926 -14.707 1.00 0.00 H new ATOM 1151 N PRO A 72 -16.796 -5.301 -11.559 1.00 0.00 N ATOM 1152 CA PRO A 72 -17.155 -4.007 -12.171 1.00 0.00 C ATOM 1153 C PRO A 72 -16.111 -2.913 -11.944 1.00 0.00 C ATOM 1154 O PRO A 72 -15.280 -3.009 -11.043 1.00 0.00 O ATOM 1155 CB PRO A 72 -18.470 -3.624 -11.471 1.00 0.00 C ATOM 1156 CG PRO A 72 -18.928 -4.867 -10.786 1.00 0.00 C ATOM 1157 CD PRO A 72 -17.676 -5.608 -10.426 1.00 0.00 C ATOM 0 HA PRO A 72 -17.231 -4.100 -13.254 1.00 0.00 H new ATOM 0 HB2 PRO A 72 -18.314 -2.816 -10.756 1.00 0.00 H new ATOM 0 HB3 PRO A 72 -19.211 -3.275 -12.190 1.00 0.00 H new ATOM 0 HG2 PRO A 72 -19.515 -4.633 -9.898 1.00 0.00 H new ATOM 0 HG3 PRO A 72 -19.564 -5.464 -11.440 1.00 0.00 H new ATOM 0 HD2 PRO A 72 -17.257 -5.264 -9.480 1.00 0.00 H new ATOM 0 HD3 PRO A 72 -17.852 -6.679 -10.326 1.00 0.00 H new ATOM 1165 N VAL A 73 -16.168 -1.876 -12.774 1.00 0.00 N ATOM 1166 CA VAL A 73 -15.242 -0.754 -12.670 1.00 0.00 C ATOM 1167 C VAL A 73 -15.566 0.085 -11.431 1.00 0.00 C ATOM 1168 O VAL A 73 -16.702 0.531 -11.252 1.00 0.00 O ATOM 1169 CB VAL A 73 -15.315 0.141 -13.930 1.00 0.00 C ATOM 1170 CG1 VAL A 73 -14.380 1.339 -13.811 1.00 0.00 C ATOM 1171 CG2 VAL A 73 -14.996 -0.669 -15.179 1.00 0.00 C ATOM 0 H VAL A 73 -16.849 -1.790 -13.529 1.00 0.00 H new ATOM 0 HA VAL A 73 -14.233 -1.157 -12.584 1.00 0.00 H new ATOM 0 HB VAL A 73 -16.333 0.521 -14.014 1.00 0.00 H new ATOM 0 HG11 VAL A 73 -14.454 1.949 -14.711 1.00 0.00 H new ATOM 0 HG12 VAL A 73 -14.662 1.936 -12.944 1.00 0.00 H new ATOM 0 HG13 VAL A 73 -13.354 0.990 -13.692 1.00 0.00 H new ATOM 0 HG21 VAL A 73 -15.052 -0.023 -16.055 1.00 0.00 H new ATOM 0 HG22 VAL A 73 -13.991 -1.083 -15.097 1.00 0.00 H new ATOM 0 HG23 VAL A 73 -15.716 -1.481 -15.280 1.00 0.00 H new ATOM 1181 N ARG A 74 -14.566 0.299 -10.581 1.00 0.00 N ATOM 1182 CA ARG A 74 -14.757 1.079 -9.360 1.00 0.00 C ATOM 1183 C ARG A 74 -14.312 2.510 -9.566 1.00 0.00 C ATOM 1184 O ARG A 74 -13.127 2.773 -9.742 1.00 0.00 O ATOM 1185 CB ARG A 74 -13.949 0.484 -8.201 1.00 0.00 C ATOM 1186 CG ARG A 74 -14.201 -0.992 -7.949 1.00 0.00 C ATOM 1187 CD ARG A 74 -15.649 -1.268 -7.564 1.00 0.00 C ATOM 1188 NE ARG A 74 -15.866 -2.671 -7.222 1.00 0.00 N ATOM 1189 CZ ARG A 74 -17.053 -3.180 -6.908 1.00 0.00 C ATOM 1190 NH1 ARG A 74 -18.128 -2.402 -6.894 1.00 0.00 N ATOM 1191 NH2 ARG A 74 -17.165 -4.468 -6.608 1.00 0.00 N ATOM 0 H ARG A 74 -13.618 -0.055 -10.713 1.00 0.00 H new ATOM 0 HA ARG A 74 -15.820 1.052 -9.119 1.00 0.00 H new ATOM 0 HB2 ARG A 74 -12.888 0.629 -8.403 1.00 0.00 H new ATOM 0 HB3 ARG A 74 -14.179 1.039 -7.292 1.00 0.00 H new ATOM 0 HG2 ARG A 74 -13.950 -1.560 -8.844 1.00 0.00 H new ATOM 0 HG3 ARG A 74 -13.542 -1.341 -7.154 1.00 0.00 H new ATOM 0 HD2 ARG A 74 -15.924 -0.641 -6.716 1.00 0.00 H new ATOM 0 HD3 ARG A 74 -16.303 -0.991 -8.391 1.00 0.00 H new ATOM 0 HE ARG A 74 -15.060 -3.296 -7.224 1.00 0.00 H new ATOM 0 HH11 ARG A 74 -18.044 -1.412 -7.124 1.00 0.00 H new ATOM 0 HH12 ARG A 74 -19.038 -2.794 -6.653 1.00 0.00 H new ATOM 0 HH21 ARG A 74 -16.340 -5.068 -6.618 1.00 0.00 H new ATOM 0 HH22 ARG A 74 -18.076 -4.858 -6.367 1.00 0.00 H new ATOM 1205 N ARG A 75 -15.247 3.441 -9.522 1.00 0.00 N ATOM 1206 CA ARG A 75 -14.899 4.837 -9.688 1.00 0.00 C ATOM 1207 C ARG A 75 -14.843 5.513 -8.328 1.00 0.00 C ATOM 1208 O ARG A 75 -15.829 5.544 -7.590 1.00 0.00 O ATOM 1209 CB ARG A 75 -15.888 5.554 -10.597 1.00 0.00 C ATOM 1210 CG ARG A 75 -15.886 5.038 -12.026 1.00 0.00 C ATOM 1211 CD ARG A 75 -16.747 5.901 -12.927 1.00 0.00 C ATOM 1212 NE ARG A 75 -18.157 5.866 -12.543 1.00 0.00 N ATOM 1213 CZ ARG A 75 -19.087 6.651 -13.078 1.00 0.00 C ATOM 1214 NH1 ARG A 75 -18.760 7.524 -14.022 1.00 0.00 N ATOM 1215 NH2 ARG A 75 -20.347 6.558 -12.671 1.00 0.00 N ATOM 0 H ARG A 75 -16.240 3.259 -9.375 1.00 0.00 H new ATOM 0 HA ARG A 75 -13.919 4.892 -10.162 1.00 0.00 H new ATOM 0 HB2 ARG A 75 -16.891 5.449 -10.183 1.00 0.00 H new ATOM 0 HB3 ARG A 75 -15.656 6.619 -10.604 1.00 0.00 H new ATOM 0 HG2 ARG A 75 -14.865 5.019 -12.406 1.00 0.00 H new ATOM 0 HG3 ARG A 75 -16.252 4.012 -12.044 1.00 0.00 H new ATOM 0 HD2 ARG A 75 -16.388 6.930 -12.893 1.00 0.00 H new ATOM 0 HD3 ARG A 75 -16.645 5.562 -13.958 1.00 0.00 H new ATOM 0 HE ARG A 75 -18.444 5.202 -11.824 1.00 0.00 H new ATOM 0 HH11 ARG A 75 -17.793 7.594 -14.339 1.00 0.00 H new ATOM 0 HH12 ARG A 75 -19.476 8.125 -14.431 1.00 0.00 H new ATOM 0 HH21 ARG A 75 -20.601 5.885 -11.948 1.00 0.00 H new ATOM 0 HH22 ARG A 75 -21.061 7.160 -13.081 1.00 0.00 H new ATOM 1229 N ILE A 76 -13.682 6.048 -8.008 1.00 0.00 N ATOM 1230 CA ILE A 76 -13.466 6.711 -6.735 1.00 0.00 C ATOM 1231 C ILE A 76 -13.303 8.217 -6.950 1.00 0.00 C ATOM 1232 O ILE A 76 -12.377 8.659 -7.634 1.00 0.00 O ATOM 1233 CB ILE A 76 -12.221 6.138 -6.029 1.00 0.00 C ATOM 1234 CG1 ILE A 76 -12.361 4.617 -5.906 1.00 0.00 C ATOM 1235 CG2 ILE A 76 -12.036 6.774 -4.654 1.00 0.00 C ATOM 1236 CD1 ILE A 76 -11.174 3.945 -5.273 1.00 0.00 C ATOM 0 H ILE A 76 -12.865 6.037 -8.618 1.00 0.00 H new ATOM 0 HA ILE A 76 -14.334 6.534 -6.100 1.00 0.00 H new ATOM 0 HB ILE A 76 -11.337 6.370 -6.624 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -13.251 4.390 -5.318 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -12.518 4.195 -6.899 1.00 0.00 H new ATOM 0 HG21 ILE A 76 -11.152 6.354 -4.175 1.00 0.00 H new ATOM 0 HG22 ILE A 76 -11.912 7.851 -4.765 1.00 0.00 H new ATOM 0 HG23 ILE A 76 -12.913 6.572 -4.039 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -11.349 2.870 -5.221 1.00 0.00 H new ATOM 0 HD12 ILE A 76 -10.284 4.139 -5.871 1.00 0.00 H new ATOM 0 HD13 ILE A 76 -11.027 4.338 -4.267 1.00 0.00 H new ATOM 1248 N ILE A 77 -14.207 9.001 -6.370 1.00 0.00 N ATOM 1249 CA ILE A 77 -14.164 10.452 -6.518 1.00 0.00 C ATOM 1250 C ILE A 77 -13.962 11.133 -5.168 1.00 0.00 C ATOM 1251 O ILE A 77 -14.702 10.879 -4.216 1.00 0.00 O ATOM 1252 CB ILE A 77 -15.452 10.991 -7.181 1.00 0.00 C ATOM 1253 CG1 ILE A 77 -15.724 10.261 -8.500 1.00 0.00 C ATOM 1254 CG2 ILE A 77 -15.348 12.492 -7.426 1.00 0.00 C ATOM 1255 CD1 ILE A 77 -16.922 9.338 -8.445 1.00 0.00 C ATOM 0 H ILE A 77 -14.976 8.657 -5.795 1.00 0.00 H new ATOM 0 HA ILE A 77 -13.317 10.683 -7.164 1.00 0.00 H new ATOM 0 HB ILE A 77 -16.283 10.808 -6.500 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -15.879 10.998 -9.288 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -14.842 9.682 -8.774 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -16.266 12.849 -7.893 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -15.201 13.006 -6.476 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -14.503 12.696 -8.084 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -17.054 8.855 -9.413 1.00 0.00 H new ATOM 0 HD12 ILE A 77 -16.761 8.578 -7.680 1.00 0.00 H new ATOM 0 HD13 ILE A 77 -17.815 9.914 -8.202 1.00 0.00 H new ATOM 1267 N GLY A 78 -12.952 11.993 -5.091 1.00 0.00 N ATOM 1268 CA GLY A 78 -12.660 12.698 -3.858 1.00 0.00 C ATOM 1269 C GLY A 78 -11.329 13.413 -3.925 1.00 0.00 C ATOM 1270 O GLY A 78 -10.787 13.615 -5.012 1.00 0.00 O ATOM 0 H GLY A 78 -12.327 12.215 -5.866 1.00 0.00 H new ATOM 0 HA2 GLY A 78 -13.451 13.420 -3.655 1.00 0.00 H new ATOM 0 HA3 GLY A 78 -12.652 11.992 -3.028 1.00 0.00 H new ATOM 1274 N ASP A 79 -10.796 13.795 -2.769 1.00 0.00 N ATOM 1275 CA ASP A 79 -9.507 14.480 -2.722 1.00 0.00 C ATOM 1276 C ASP A 79 -8.384 13.454 -2.802 1.00 0.00 C ATOM 1277 O ASP A 79 -8.027 12.828 -1.806 1.00 0.00 O ATOM 1278 CB ASP A 79 -9.382 15.300 -1.432 1.00 0.00 C ATOM 1279 CG ASP A 79 -8.098 16.106 -1.367 1.00 0.00 C ATOM 1280 OD1 ASP A 79 -7.402 16.209 -2.401 1.00 0.00 O ATOM 1281 OD2 ASP A 79 -7.785 16.633 -0.280 1.00 0.00 O ATOM 0 H ASP A 79 -11.231 13.644 -1.859 1.00 0.00 H new ATOM 0 HA ASP A 79 -9.435 15.161 -3.570 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -10.234 15.976 -1.353 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -9.427 14.628 -0.575 1.00 0.00 H new ATOM 1286 N LEU A 80 -7.818 13.299 -3.996 1.00 0.00 N ATOM 1287 CA LEU A 80 -6.754 12.328 -4.215 1.00 0.00 C ATOM 1288 C LEU A 80 -5.378 12.893 -3.871 1.00 0.00 C ATOM 1289 O LEU A 80 -4.386 12.166 -3.892 1.00 0.00 O ATOM 1290 CB LEU A 80 -6.757 11.851 -5.669 1.00 0.00 C ATOM 1291 CG LEU A 80 -8.041 11.159 -6.135 1.00 0.00 C ATOM 1292 CD1 LEU A 80 -7.948 10.818 -7.614 1.00 0.00 C ATOM 1293 CD2 LEU A 80 -8.302 9.904 -5.315 1.00 0.00 C ATOM 0 H LEU A 80 -8.079 13.833 -4.825 1.00 0.00 H new ATOM 0 HA LEU A 80 -6.950 11.488 -3.549 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -6.573 12.710 -6.315 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -5.923 11.163 -5.809 1.00 0.00 H new ATOM 0 HG LEU A 80 -8.876 11.844 -5.987 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -8.867 10.326 -7.933 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -7.807 11.733 -8.190 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -7.103 10.150 -7.781 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -9.219 9.427 -5.662 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -7.467 9.213 -5.431 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -8.407 10.172 -4.264 1.00 0.00 H new ATOM 1305 N SER A 81 -5.312 14.188 -3.575 1.00 0.00 N ATOM 1306 CA SER A 81 -4.044 14.818 -3.216 1.00 0.00 C ATOM 1307 C SER A 81 -3.563 14.299 -1.862 1.00 0.00 C ATOM 1308 O SER A 81 -2.377 14.366 -1.540 1.00 0.00 O ATOM 1309 CB SER A 81 -4.186 16.342 -3.189 1.00 0.00 C ATOM 1310 OG SER A 81 -4.519 16.844 -4.473 1.00 0.00 O ATOM 0 H SER A 81 -6.114 14.818 -3.576 1.00 0.00 H new ATOM 0 HA SER A 81 -3.302 14.560 -3.972 1.00 0.00 H new ATOM 0 HB2 SER A 81 -4.956 16.626 -2.472 1.00 0.00 H new ATOM 0 HB3 SER A 81 -3.253 16.792 -2.849 1.00 0.00 H new ATOM 0 HG SER A 81 -4.606 17.819 -4.430 1.00 0.00 H new ATOM 1316 N ASN A 82 -4.503 13.799 -1.068 1.00 0.00 N ATOM 1317 CA ASN A 82 -4.194 13.235 0.238 1.00 0.00 C ATOM 1318 C ASN A 82 -3.757 11.784 0.070 1.00 0.00 C ATOM 1319 O ASN A 82 -4.531 10.945 -0.399 1.00 0.00 O ATOM 1320 CB ASN A 82 -5.409 13.333 1.164 1.00 0.00 C ATOM 1321 CG ASN A 82 -5.132 12.832 2.573 1.00 0.00 C ATOM 1322 OD1 ASN A 82 -4.006 12.461 2.911 1.00 0.00 O ATOM 1323 ND2 ASN A 82 -6.161 12.819 3.408 1.00 0.00 N ATOM 0 H ASN A 82 -5.494 13.774 -1.310 1.00 0.00 H new ATOM 0 HA ASN A 82 -3.381 13.801 0.693 1.00 0.00 H new ATOM 0 HB2 ASN A 82 -5.737 14.371 1.213 1.00 0.00 H new ATOM 0 HB3 ASN A 82 -6.231 12.759 0.736 1.00 0.00 H new ATOM 0 HD21 ASN A 82 -6.036 12.494 4.367 1.00 0.00 H new ATOM 0 HD22 ASN A 82 -7.078 13.134 3.092 1.00 0.00 H new ATOM 1330 N ARG A 83 -2.515 11.499 0.457 1.00 0.00 N ATOM 1331 CA ARG A 83 -1.956 10.156 0.322 1.00 0.00 C ATOM 1332 C ARG A 83 -2.765 9.127 1.109 1.00 0.00 C ATOM 1333 O ARG A 83 -2.907 7.986 0.670 1.00 0.00 O ATOM 1334 CB ARG A 83 -0.486 10.122 0.744 1.00 0.00 C ATOM 1335 CG ARG A 83 0.449 10.854 -0.208 1.00 0.00 C ATOM 1336 CD ARG A 83 1.909 10.587 0.126 1.00 0.00 C ATOM 1337 NE ARG A 83 2.282 11.120 1.436 1.00 0.00 N ATOM 1338 CZ ARG A 83 2.716 12.363 1.635 1.00 0.00 C ATOM 1339 NH1 ARG A 83 2.834 13.201 0.611 1.00 0.00 N ATOM 1340 NH2 ARG A 83 3.035 12.765 2.859 1.00 0.00 N ATOM 0 H ARG A 83 -1.877 12.181 0.867 1.00 0.00 H new ATOM 0 HA ARG A 83 -2.014 9.889 -0.733 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -0.394 10.562 1.737 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -0.166 9.083 0.824 1.00 0.00 H new ATOM 0 HG2 ARG A 83 0.246 10.540 -1.232 1.00 0.00 H new ATOM 0 HG3 ARG A 83 0.254 11.925 -0.159 1.00 0.00 H new ATOM 0 HD2 ARG A 83 2.094 9.513 0.106 1.00 0.00 H new ATOM 0 HD3 ARG A 83 2.543 11.034 -0.640 1.00 0.00 H new ATOM 0 HE ARG A 83 2.205 10.503 2.245 1.00 0.00 H new ATOM 0 HH11 ARG A 83 2.592 12.893 -0.331 1.00 0.00 H new ATOM 0 HH12 ARG A 83 3.167 14.153 0.766 1.00 0.00 H new ATOM 0 HH21 ARG A 83 2.948 12.122 3.646 1.00 0.00 H new ATOM 0 HH22 ARG A 83 3.368 13.717 3.013 1.00 0.00 H new ATOM 1354 N GLU A 84 -3.292 9.521 2.266 1.00 0.00 N ATOM 1355 CA GLU A 84 -4.086 8.606 3.082 1.00 0.00 C ATOM 1356 C GLU A 84 -5.320 8.099 2.343 1.00 0.00 C ATOM 1357 O GLU A 84 -5.600 6.906 2.380 1.00 0.00 O ATOM 1358 CB GLU A 84 -4.510 9.275 4.389 1.00 0.00 C ATOM 1359 CG GLU A 84 -3.374 9.431 5.381 1.00 0.00 C ATOM 1360 CD GLU A 84 -3.746 10.299 6.568 1.00 0.00 C ATOM 1361 OE1 GLU A 84 -4.765 11.018 6.483 1.00 0.00 O ATOM 1362 OE2 GLU A 84 -3.019 10.260 7.582 1.00 0.00 O ATOM 0 H GLU A 84 -3.185 10.457 2.656 1.00 0.00 H new ATOM 0 HA GLU A 84 -3.450 7.749 3.302 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -4.927 10.258 4.167 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -5.305 8.688 4.848 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -3.071 8.446 5.737 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -2.512 9.866 4.874 1.00 0.00 H new ATOM 1369 N LYS A 85 -6.049 8.978 1.656 1.00 0.00 N ATOM 1370 CA LYS A 85 -7.241 8.537 0.929 1.00 0.00 C ATOM 1371 C LYS A 85 -6.873 7.582 -0.199 1.00 0.00 C ATOM 1372 O LYS A 85 -7.562 6.584 -0.414 1.00 0.00 O ATOM 1373 CB LYS A 85 -8.050 9.711 0.380 1.00 0.00 C ATOM 1374 CG LYS A 85 -8.788 10.520 1.429 1.00 0.00 C ATOM 1375 CD LYS A 85 -9.563 11.657 0.780 1.00 0.00 C ATOM 1376 CE LYS A 85 -10.239 12.539 1.818 1.00 0.00 C ATOM 1377 NZ LYS A 85 -11.244 11.787 2.618 1.00 0.00 N ATOM 0 H LYS A 85 -5.844 9.975 1.587 1.00 0.00 H new ATOM 0 HA LYS A 85 -7.868 8.010 1.648 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -7.378 10.375 -0.164 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -8.774 9.330 -0.341 1.00 0.00 H new ATOM 0 HG2 LYS A 85 -9.472 9.874 1.980 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -8.078 10.922 2.152 1.00 0.00 H new ATOM 0 HD2 LYS A 85 -8.886 12.260 0.175 1.00 0.00 H new ATOM 0 HD3 LYS A 85 -10.315 11.247 0.105 1.00 0.00 H new ATOM 0 HE2 LYS A 85 -9.485 12.958 2.484 1.00 0.00 H new ATOM 0 HE3 LYS A 85 -10.726 13.378 1.320 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 -11.776 12.449 3.218 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 -11.900 11.296 1.978 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 -10.759 11.090 3.218 1.00 0.00 H new ATOM 1391 N VAL A 86 -5.797 7.882 -0.916 1.00 0.00 N ATOM 1392 CA VAL A 86 -5.350 7.013 -1.997 1.00 0.00 C ATOM 1393 C VAL A 86 -4.935 5.644 -1.446 1.00 0.00 C ATOM 1394 O VAL A 86 -5.338 4.608 -1.972 1.00 0.00 O ATOM 1395 CB VAL A 86 -4.190 7.657 -2.795 1.00 0.00 C ATOM 1396 CG1 VAL A 86 -3.602 6.671 -3.792 1.00 0.00 C ATOM 1397 CG2 VAL A 86 -4.686 8.903 -3.514 1.00 0.00 C ATOM 0 H VAL A 86 -5.223 8.712 -0.771 1.00 0.00 H new ATOM 0 HA VAL A 86 -6.185 6.873 -2.683 1.00 0.00 H new ATOM 0 HB VAL A 86 -3.403 7.938 -2.095 1.00 0.00 H new ATOM 0 HG11 VAL A 86 -2.789 7.148 -4.339 1.00 0.00 H new ATOM 0 HG12 VAL A 86 -3.219 5.800 -3.260 1.00 0.00 H new ATOM 0 HG13 VAL A 86 -4.376 6.357 -4.492 1.00 0.00 H new ATOM 0 HG21 VAL A 86 -3.865 9.351 -4.074 1.00 0.00 H new ATOM 0 HG22 VAL A 86 -5.488 8.632 -4.201 1.00 0.00 H new ATOM 0 HG23 VAL A 86 -5.061 9.620 -2.783 1.00 0.00 H new ATOM 1407 N LEU A 87 -4.149 5.654 -0.368 1.00 0.00 N ATOM 1408 CA LEU A 87 -3.688 4.426 0.274 1.00 0.00 C ATOM 1409 C LEU A 87 -4.845 3.625 0.874 1.00 0.00 C ATOM 1410 O LEU A 87 -4.939 2.413 0.667 1.00 0.00 O ATOM 1411 CB LEU A 87 -2.654 4.767 1.353 1.00 0.00 C ATOM 1412 CG LEU A 87 -2.215 3.607 2.246 1.00 0.00 C ATOM 1413 CD1 LEU A 87 -1.525 2.518 1.437 1.00 0.00 C ATOM 1414 CD2 LEU A 87 -1.307 4.116 3.358 1.00 0.00 C ATOM 0 H LEU A 87 -3.817 6.508 0.080 1.00 0.00 H new ATOM 0 HA LEU A 87 -3.226 3.799 -0.489 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -1.771 5.179 0.865 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -3.064 5.553 1.987 1.00 0.00 H new ATOM 0 HG LEU A 87 -3.104 3.166 2.696 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -1.225 1.707 2.100 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -2.212 2.134 0.683 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -0.643 2.932 0.948 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -1.000 3.281 3.988 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -0.425 4.584 2.922 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -1.845 4.847 3.961 1.00 0.00 H new ATOM 1426 N ILE A 88 -5.722 4.299 1.610 1.00 0.00 N ATOM 1427 CA ILE A 88 -6.863 3.640 2.239 1.00 0.00 C ATOM 1428 C ILE A 88 -7.799 3.017 1.200 1.00 0.00 C ATOM 1429 O ILE A 88 -8.214 1.865 1.342 1.00 0.00 O ATOM 1430 CB ILE A 88 -7.631 4.616 3.155 1.00 0.00 C ATOM 1431 CG1 ILE A 88 -6.771 4.938 4.383 1.00 0.00 C ATOM 1432 CG2 ILE A 88 -8.980 4.039 3.572 1.00 0.00 C ATOM 1433 CD1 ILE A 88 -7.257 6.120 5.186 1.00 0.00 C ATOM 0 H ILE A 88 -5.665 5.302 1.786 1.00 0.00 H new ATOM 0 HA ILE A 88 -6.471 2.831 2.856 1.00 0.00 H new ATOM 0 HB ILE A 88 -7.831 5.535 2.604 1.00 0.00 H new ATOM 0 HG12 ILE A 88 -6.739 4.062 5.030 1.00 0.00 H new ATOM 0 HG13 ILE A 88 -5.749 5.130 4.057 1.00 0.00 H new ATOM 0 HG21 ILE A 88 -9.496 4.750 4.217 1.00 0.00 H new ATOM 0 HG22 ILE A 88 -9.584 3.848 2.685 1.00 0.00 H new ATOM 0 HG23 ILE A 88 -8.825 3.105 4.113 1.00 0.00 H new ATOM 0 HD11 ILE A 88 -6.594 6.280 6.036 1.00 0.00 H new ATOM 0 HD12 ILE A 88 -7.262 7.010 4.557 1.00 0.00 H new ATOM 0 HD13 ILE A 88 -8.267 5.925 5.546 1.00 0.00 H new ATOM 1445 N ALA A 89 -8.119 3.776 0.150 1.00 0.00 N ATOM 1446 CA ALA A 89 -9.000 3.278 -0.906 1.00 0.00 C ATOM 1447 C ALA A 89 -8.381 2.082 -1.628 1.00 0.00 C ATOM 1448 O ALA A 89 -9.076 1.107 -1.922 1.00 0.00 O ATOM 1449 CB ALA A 89 -9.347 4.387 -1.885 1.00 0.00 C ATOM 0 H ALA A 89 -7.784 4.729 0.009 1.00 0.00 H new ATOM 0 HA ALA A 89 -9.923 2.937 -0.438 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -10.003 3.994 -2.662 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -9.854 5.194 -1.356 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -8.433 4.769 -2.340 1.00 0.00 H new ATOM 1455 N LEU A 90 -7.078 2.151 -1.910 1.00 0.00 N ATOM 1456 CA LEU A 90 -6.384 1.053 -2.585 1.00 0.00 C ATOM 1457 C LEU A 90 -6.359 -0.194 -1.705 1.00 0.00 C ATOM 1458 O LEU A 90 -6.511 -1.313 -2.199 1.00 0.00 O ATOM 1459 CB LEU A 90 -4.954 1.452 -2.970 1.00 0.00 C ATOM 1460 CG LEU A 90 -4.835 2.483 -4.090 1.00 0.00 C ATOM 1461 CD1 LEU A 90 -3.393 2.945 -4.223 1.00 0.00 C ATOM 1462 CD2 LEU A 90 -5.336 1.906 -5.406 1.00 0.00 C ATOM 0 H LEU A 90 -6.486 2.950 -1.683 1.00 0.00 H new ATOM 0 HA LEU A 90 -6.935 0.829 -3.498 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -4.455 1.845 -2.084 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -4.413 0.554 -3.268 1.00 0.00 H new ATOM 0 HG LEU A 90 -5.456 3.343 -3.839 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -3.319 3.680 -5.024 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -3.068 3.396 -3.286 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -2.757 2.091 -4.454 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -5.243 2.656 -6.191 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -4.743 1.030 -5.669 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -6.382 1.618 -5.302 1.00 0.00 H new ATOM 1474 N ARG A 91 -6.164 0.007 -0.399 1.00 0.00 N ATOM 1475 CA ARG A 91 -6.117 -1.096 0.558 1.00 0.00 C ATOM 1476 C ARG A 91 -7.458 -1.831 0.611 1.00 0.00 C ATOM 1477 O ARG A 91 -7.501 -3.064 0.583 1.00 0.00 O ATOM 1478 CB ARG A 91 -5.754 -0.571 1.951 1.00 0.00 C ATOM 1479 CG ARG A 91 -5.632 -1.657 3.009 1.00 0.00 C ATOM 1480 CD ARG A 91 -5.215 -1.083 4.352 1.00 0.00 C ATOM 1481 NE ARG A 91 -5.122 -2.114 5.382 1.00 0.00 N ATOM 1482 CZ ARG A 91 -4.768 -1.873 6.640 1.00 0.00 C ATOM 1483 NH1 ARG A 91 -4.467 -0.638 7.022 1.00 0.00 N ATOM 1484 NH2 ARG A 91 -4.712 -2.867 7.518 1.00 0.00 N ATOM 0 H ARG A 91 -6.036 0.929 0.019 1.00 0.00 H new ATOM 0 HA ARG A 91 -5.352 -1.799 0.229 1.00 0.00 H new ATOM 0 HB2 ARG A 91 -4.810 -0.030 1.889 1.00 0.00 H new ATOM 0 HB3 ARG A 91 -6.512 0.146 2.267 1.00 0.00 H new ATOM 0 HG2 ARG A 91 -6.586 -2.173 3.114 1.00 0.00 H new ATOM 0 HG3 ARG A 91 -4.902 -2.399 2.687 1.00 0.00 H new ATOM 0 HD2 ARG A 91 -4.251 -0.585 4.250 1.00 0.00 H new ATOM 0 HD3 ARG A 91 -5.935 -0.325 4.662 1.00 0.00 H new ATOM 0 HE ARG A 91 -5.342 -3.075 5.121 1.00 0.00 H new ATOM 0 HH11 ARG A 91 -4.507 0.128 6.350 1.00 0.00 H new ATOM 0 HH12 ARG A 91 -4.196 -0.455 7.988 1.00 0.00 H new ATOM 0 HH21 ARG A 91 -4.941 -3.818 7.227 1.00 0.00 H new ATOM 0 HH22 ARG A 91 -4.440 -2.680 8.483 1.00 0.00 H new ATOM 1498 N LEU A 92 -8.547 -1.068 0.691 1.00 0.00 N ATOM 1499 CA LEU A 92 -9.888 -1.646 0.743 1.00 0.00 C ATOM 1500 C LEU A 92 -10.210 -2.405 -0.542 1.00 0.00 C ATOM 1501 O LEU A 92 -10.819 -3.476 -0.502 1.00 0.00 O ATOM 1502 CB LEU A 92 -10.935 -0.555 0.988 1.00 0.00 C ATOM 1503 CG LEU A 92 -10.904 0.075 2.383 1.00 0.00 C ATOM 1504 CD1 LEU A 92 -11.821 1.289 2.439 1.00 0.00 C ATOM 1505 CD2 LEU A 92 -11.301 -0.943 3.441 1.00 0.00 C ATOM 0 H LEU A 92 -8.527 -0.049 0.721 1.00 0.00 H new ATOM 0 HA LEU A 92 -9.915 -2.352 1.573 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -10.796 0.233 0.248 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -11.925 -0.979 0.820 1.00 0.00 H new ATOM 0 HG LEU A 92 -9.885 0.402 2.589 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -11.787 1.725 3.438 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -11.491 2.028 1.709 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -12.842 0.984 2.211 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -11.272 -0.475 4.425 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -12.310 -1.303 3.239 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -10.605 -1.782 3.418 1.00 0.00 H new ATOM 1517 N LEU A 93 -9.800 -1.848 -1.680 1.00 0.00 N ATOM 1518 CA LEU A 93 -10.035 -2.491 -2.969 1.00 0.00 C ATOM 1519 C LEU A 93 -9.254 -3.801 -3.067 1.00 0.00 C ATOM 1520 O LEU A 93 -9.758 -4.801 -3.579 1.00 0.00 O ATOM 1521 CB LEU A 93 -9.630 -1.568 -4.121 1.00 0.00 C ATOM 1522 CG LEU A 93 -10.517 -0.340 -4.328 1.00 0.00 C ATOM 1523 CD1 LEU A 93 -9.895 0.591 -5.356 1.00 0.00 C ATOM 1524 CD2 LEU A 93 -11.917 -0.754 -4.757 1.00 0.00 C ATOM 0 H LEU A 93 -9.306 -0.957 -1.735 1.00 0.00 H new ATOM 0 HA LEU A 93 -11.101 -2.703 -3.045 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -8.608 -1.231 -3.950 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -9.624 -2.149 -5.043 1.00 0.00 H new ATOM 0 HG LEU A 93 -10.597 0.193 -3.380 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -10.537 1.461 -5.494 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -8.914 0.915 -5.007 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -9.787 0.065 -6.305 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -12.532 0.135 -4.899 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -11.861 -1.310 -5.693 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -12.362 -1.384 -3.987 1.00 0.00 H new ATOM 1536 N ALA A 94 -8.017 -3.782 -2.563 1.00 0.00 N ATOM 1537 CA ALA A 94 -7.142 -4.954 -2.591 1.00 0.00 C ATOM 1538 C ALA A 94 -7.711 -6.101 -1.770 1.00 0.00 C ATOM 1539 O ALA A 94 -7.597 -7.265 -2.160 1.00 0.00 O ATOM 1540 CB ALA A 94 -5.744 -4.594 -2.116 1.00 0.00 C ATOM 0 H ALA A 94 -7.598 -2.960 -2.128 1.00 0.00 H new ATOM 0 HA ALA A 94 -7.080 -5.291 -3.626 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -5.110 -5.480 -2.145 1.00 0.00 H new ATOM 0 HB2 ALA A 94 -5.325 -3.827 -2.767 1.00 0.00 H new ATOM 0 HB3 ALA A 94 -5.793 -4.216 -1.095 1.00 0.00 H new ATOM 1546 N GLU A 95 -8.312 -5.775 -0.630 1.00 0.00 N ATOM 1547 CA GLU A 95 -8.908 -6.784 0.235 1.00 0.00 C ATOM 1548 C GLU A 95 -10.030 -7.511 -0.499 1.00 0.00 C ATOM 1549 O GLU A 95 -10.203 -8.722 -0.354 1.00 0.00 O ATOM 1550 CB GLU A 95 -9.444 -6.134 1.511 1.00 0.00 C ATOM 1551 CG GLU A 95 -8.353 -5.642 2.451 1.00 0.00 C ATOM 1552 CD GLU A 95 -8.895 -4.824 3.606 1.00 0.00 C ATOM 1553 OE1 GLU A 95 -10.059 -4.376 3.525 1.00 0.00 O ATOM 1554 OE2 GLU A 95 -8.157 -4.634 4.595 1.00 0.00 O ATOM 0 H GLU A 95 -8.399 -4.819 -0.285 1.00 0.00 H new ATOM 0 HA GLU A 95 -8.142 -7.510 0.507 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -10.083 -5.294 1.239 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -10.070 -6.853 2.040 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -7.806 -6.499 2.844 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -7.640 -5.039 1.888 1.00 0.00 H new ATOM 1561 N GLU A 96 -10.792 -6.751 -1.284 1.00 0.00 N ATOM 1562 CA GLU A 96 -11.887 -7.306 -2.072 1.00 0.00 C ATOM 1563 C GLU A 96 -11.350 -8.303 -3.096 1.00 0.00 C ATOM 1564 O GLU A 96 -11.937 -9.363 -3.323 1.00 0.00 O ATOM 1565 CB GLU A 96 -12.626 -6.177 -2.795 1.00 0.00 C ATOM 1566 CG GLU A 96 -13.431 -5.278 -1.867 1.00 0.00 C ATOM 1567 CD GLU A 96 -13.982 -4.052 -2.570 1.00 0.00 C ATOM 1568 OE1 GLU A 96 -13.500 -3.737 -3.680 1.00 0.00 O ATOM 1569 OE2 GLU A 96 -14.896 -3.411 -2.013 1.00 0.00 O ATOM 0 H GLU A 96 -10.669 -5.744 -1.390 1.00 0.00 H new ATOM 0 HA GLU A 96 -12.575 -7.822 -1.403 1.00 0.00 H new ATOM 0 HB2 GLU A 96 -11.901 -5.569 -3.336 1.00 0.00 H new ATOM 0 HB3 GLU A 96 -13.296 -6.611 -3.537 1.00 0.00 H new ATOM 0 HG2 GLU A 96 -14.256 -5.849 -1.441 1.00 0.00 H new ATOM 0 HG3 GLU A 96 -12.800 -4.962 -1.036 1.00 0.00 H new ATOM 1576 N ILE A 97 -10.224 -7.941 -3.705 1.00 0.00 N ATOM 1577 CA ILE A 97 -9.569 -8.772 -4.710 1.00 0.00 C ATOM 1578 C ILE A 97 -9.050 -10.069 -4.089 1.00 0.00 C ATOM 1579 O ILE A 97 -9.233 -11.151 -4.647 1.00 0.00 O ATOM 1580 CB ILE A 97 -8.407 -7.992 -5.359 1.00 0.00 C ATOM 1581 CG1 ILE A 97 -8.978 -6.786 -6.092 1.00 0.00 C ATOM 1582 CG2 ILE A 97 -7.613 -8.875 -6.319 1.00 0.00 C ATOM 1583 CD1 ILE A 97 -7.939 -5.784 -6.502 1.00 0.00 C ATOM 0 H ILE A 97 -9.740 -7.063 -3.515 1.00 0.00 H new ATOM 0 HA ILE A 97 -10.301 -9.030 -5.476 1.00 0.00 H new ATOM 0 HB ILE A 97 -7.720 -7.662 -4.580 1.00 0.00 H new ATOM 0 HG12 ILE A 97 -9.510 -7.129 -6.979 1.00 0.00 H new ATOM 0 HG13 ILE A 97 -9.711 -6.295 -5.451 1.00 0.00 H new ATOM 0 HG21 ILE A 97 -6.802 -8.296 -6.760 1.00 0.00 H new ATOM 0 HG22 ILE A 97 -7.199 -9.724 -5.775 1.00 0.00 H new ATOM 0 HG23 ILE A 97 -8.271 -9.237 -7.109 1.00 0.00 H new ATOM 0 HD11 ILE A 97 -8.419 -4.953 -7.019 1.00 0.00 H new ATOM 0 HD12 ILE A 97 -7.423 -5.412 -5.617 1.00 0.00 H new ATOM 0 HD13 ILE A 97 -7.219 -6.258 -7.169 1.00 0.00 H new ATOM 1595 N GLY A 98 -8.402 -9.944 -2.930 1.00 0.00 N ATOM 1596 CA GLY A 98 -7.873 -11.105 -2.229 1.00 0.00 C ATOM 1597 C GLY A 98 -8.960 -12.069 -1.796 1.00 0.00 C ATOM 1598 O GLY A 98 -8.758 -13.283 -1.788 1.00 0.00 O ATOM 0 H GLY A 98 -8.234 -9.053 -2.462 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -7.167 -11.626 -2.877 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -7.316 -10.773 -1.353 1.00 0.00 H new ATOM 1602 N ASP A 99 -10.110 -11.516 -1.414 1.00 0.00 N ATOM 1603 CA ASP A 99 -11.255 -12.312 -0.974 1.00 0.00 C ATOM 1604 C ASP A 99 -11.764 -13.225 -2.088 1.00 0.00 C ATOM 1605 O ASP A 99 -12.147 -14.368 -1.839 1.00 0.00 O ATOM 1606 CB ASP A 99 -12.387 -11.398 -0.497 1.00 0.00 C ATOM 1607 CG ASP A 99 -13.544 -12.171 0.101 1.00 0.00 C ATOM 1608 OD1 ASP A 99 -13.350 -12.805 1.162 1.00 0.00 O ATOM 1609 OD2 ASP A 99 -14.645 -12.137 -0.483 1.00 0.00 O ATOM 0 H ASP A 99 -10.274 -10.509 -1.401 1.00 0.00 H new ATOM 0 HA ASP A 99 -10.922 -12.938 -0.146 1.00 0.00 H new ATOM 0 HB2 ASP A 99 -11.998 -10.701 0.245 1.00 0.00 H new ATOM 0 HB3 ASP A 99 -12.747 -10.803 -1.336 1.00 0.00 H new ATOM 1614 N TYR A 100 -11.779 -12.710 -3.316 1.00 0.00 N ATOM 1615 CA TYR A 100 -12.250 -13.481 -4.458 1.00 0.00 C ATOM 1616 C TYR A 100 -11.176 -14.455 -4.932 1.00 0.00 C ATOM 1617 O TYR A 100 -10.123 -14.050 -5.429 1.00 0.00 O ATOM 1618 CB TYR A 100 -12.654 -12.543 -5.602 1.00 0.00 C ATOM 1619 CG TYR A 100 -13.166 -13.263 -6.833 1.00 0.00 C ATOM 1620 CD1 TYR A 100 -14.453 -13.787 -6.869 1.00 0.00 C ATOM 1621 CD2 TYR A 100 -12.363 -13.420 -7.957 1.00 0.00 C ATOM 1622 CE1 TYR A 100 -14.924 -14.446 -7.990 1.00 0.00 C ATOM 1623 CE2 TYR A 100 -12.828 -14.077 -9.081 1.00 0.00 C ATOM 1624 CZ TYR A 100 -14.108 -14.587 -9.092 1.00 0.00 C ATOM 1625 OH TYR A 100 -14.572 -15.244 -10.208 1.00 0.00 O ATOM 0 H TYR A 100 -11.471 -11.764 -3.542 1.00 0.00 H new ATOM 0 HA TYR A 100 -13.123 -14.055 -4.147 1.00 0.00 H new ATOM 0 HB2 TYR A 100 -13.425 -11.861 -5.245 1.00 0.00 H new ATOM 0 HB3 TYR A 100 -11.794 -11.934 -5.880 1.00 0.00 H new ATOM 0 HD1 TYR A 100 -15.095 -13.678 -6.008 1.00 0.00 H new ATOM 0 HD2 TYR A 100 -11.359 -13.022 -7.952 1.00 0.00 H new ATOM 0 HE1 TYR A 100 -15.926 -14.848 -8.002 1.00 0.00 H new ATOM 0 HE2 TYR A 100 -12.191 -14.190 -9.946 1.00 0.00 H new ATOM 0 HH TYR A 100 -14.139 -14.877 -11.007 1.00 0.00 H new ATOM 1635 N LYS A 101 -11.457 -15.737 -4.778 1.00 0.00 N ATOM 1636 CA LYS A 101 -10.528 -16.782 -5.195 1.00 0.00 C ATOM 1637 C LYS A 101 -11.097 -17.556 -6.381 1.00 0.00 C ATOM 1638 O LYS A 101 -12.299 -17.809 -6.442 1.00 0.00 O ATOM 1639 CB LYS A 101 -10.245 -17.738 -4.033 1.00 0.00 C ATOM 1640 CG LYS A 101 -9.595 -17.063 -2.832 1.00 0.00 C ATOM 1641 CD LYS A 101 -9.410 -18.032 -1.673 1.00 0.00 C ATOM 1642 CE LYS A 101 -8.326 -19.060 -1.965 1.00 0.00 C ATOM 1643 NZ LYS A 101 -6.980 -18.431 -2.072 1.00 0.00 N ATOM 0 H LYS A 101 -12.323 -16.084 -4.366 1.00 0.00 H new ATOM 0 HA LYS A 101 -9.593 -16.311 -5.498 1.00 0.00 H new ATOM 0 HB2 LYS A 101 -11.181 -18.200 -3.717 1.00 0.00 H new ATOM 0 HB3 LYS A 101 -9.596 -18.540 -4.384 1.00 0.00 H new ATOM 0 HG2 LYS A 101 -8.627 -16.655 -3.124 1.00 0.00 H new ATOM 0 HG3 LYS A 101 -10.210 -16.223 -2.509 1.00 0.00 H new ATOM 0 HD2 LYS A 101 -9.151 -17.476 -0.772 1.00 0.00 H new ATOM 0 HD3 LYS A 101 -10.352 -18.543 -1.472 1.00 0.00 H new ATOM 0 HE2 LYS A 101 -8.315 -19.810 -1.174 1.00 0.00 H new ATOM 0 HE3 LYS A 101 -8.559 -19.580 -2.894 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 -6.247 -19.165 -1.999 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 -6.895 -17.946 -2.988 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 -6.857 -17.742 -1.303 1.00 0.00 H new ATOM 1657 N ASP A 102 -10.227 -17.917 -7.322 1.00 0.00 N ATOM 1658 CA ASP A 102 -10.642 -18.669 -8.509 1.00 0.00 C ATOM 1659 C ASP A 102 -11.191 -20.044 -8.132 1.00 0.00 C ATOM 1660 O ASP A 102 -12.200 -20.491 -8.677 1.00 0.00 O ATOM 1661 CB ASP A 102 -9.473 -18.825 -9.485 1.00 0.00 C ATOM 1662 CG ASP A 102 -9.883 -19.525 -10.765 1.00 0.00 C ATOM 1663 OD1 ASP A 102 -10.697 -18.954 -11.519 1.00 0.00 O ATOM 1664 OD2 ASP A 102 -9.388 -20.645 -11.012 1.00 0.00 O ATOM 0 H ASP A 102 -9.230 -17.702 -7.288 1.00 0.00 H new ATOM 0 HA ASP A 102 -11.438 -18.104 -8.994 1.00 0.00 H new ATOM 0 HB2 ASP A 102 -9.069 -17.842 -9.725 1.00 0.00 H new ATOM 0 HB3 ASP A 102 -8.674 -19.390 -9.004 1.00 0.00 H new ATOM 1669 N ASP A 103 -10.515 -20.713 -7.204 1.00 0.00 N ATOM 1670 CA ASP A 103 -10.930 -22.037 -6.753 1.00 0.00 C ATOM 1671 C ASP A 103 -10.380 -22.317 -5.358 1.00 0.00 C ATOM 1672 O ASP A 103 -9.375 -21.732 -4.956 1.00 0.00 O ATOM 1673 CB ASP A 103 -10.445 -23.110 -7.736 1.00 0.00 C ATOM 1674 CG ASP A 103 -11.267 -24.383 -7.666 1.00 0.00 C ATOM 1675 OD1 ASP A 103 -12.266 -24.407 -6.914 1.00 0.00 O ATOM 1676 OD2 ASP A 103 -10.908 -25.358 -8.356 1.00 0.00 O ATOM 0 H ASP A 103 -9.674 -20.359 -6.748 1.00 0.00 H new ATOM 0 HA ASP A 103 -12.019 -22.065 -6.713 1.00 0.00 H new ATOM 0 HB2 ASP A 103 -10.484 -22.712 -8.750 1.00 0.00 H new ATOM 0 HB3 ASP A 103 -9.401 -23.344 -7.526 1.00 0.00 H new ATOM 1681 N ASP A 104 -11.045 -23.210 -4.625 1.00 0.00 N ATOM 1682 CA ASP A 104 -10.625 -23.567 -3.269 1.00 0.00 C ATOM 1683 C ASP A 104 -9.312 -24.351 -3.286 1.00 0.00 C ATOM 1684 O ASP A 104 -8.529 -24.285 -2.341 1.00 0.00 O ATOM 1685 CB ASP A 104 -11.717 -24.388 -2.575 1.00 0.00 C ATOM 1686 CG ASP A 104 -11.536 -24.447 -1.071 1.00 0.00 C ATOM 1687 OD1 ASP A 104 -10.998 -23.477 -0.498 1.00 0.00 O ATOM 1688 OD2 ASP A 104 -11.936 -25.464 -0.467 1.00 0.00 O ATOM 0 H ASP A 104 -11.879 -23.701 -4.948 1.00 0.00 H new ATOM 0 HA ASP A 104 -10.463 -22.644 -2.713 1.00 0.00 H new ATOM 0 HB2 ASP A 104 -12.691 -23.956 -2.803 1.00 0.00 H new ATOM 0 HB3 ASP A 104 -11.716 -25.401 -2.977 1.00 0.00 H new ATOM 1693 N ASP A 105 -9.090 -25.095 -4.377 1.00 0.00 N ATOM 1694 CA ASP A 105 -7.878 -25.905 -4.561 1.00 0.00 C ATOM 1695 C ASP A 105 -7.691 -26.921 -3.428 1.00 0.00 C ATOM 1696 O ASP A 105 -6.584 -27.110 -2.926 1.00 0.00 O ATOM 1697 CB ASP A 105 -6.640 -25.004 -4.665 1.00 0.00 C ATOM 1698 CG ASP A 105 -5.466 -25.700 -5.328 1.00 0.00 C ATOM 1699 OD1 ASP A 105 -5.697 -26.680 -6.067 1.00 0.00 O ATOM 1700 OD2 ASP A 105 -4.317 -25.263 -5.109 1.00 0.00 O ATOM 0 H ASP A 105 -9.745 -25.153 -5.157 1.00 0.00 H new ATOM 0 HA ASP A 105 -7.999 -26.461 -5.491 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -6.894 -24.108 -5.232 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -6.348 -24.678 -3.667 1.00 0.00 H new ATOM 1705 N LYS A 106 -8.779 -27.574 -3.037 1.00 0.00 N ATOM 1706 CA LYS A 106 -8.733 -28.575 -1.973 1.00 0.00 C ATOM 1707 C LYS A 106 -9.393 -29.871 -2.428 1.00 0.00 C ATOM 1708 O LYS A 106 -9.057 -30.936 -1.870 1.00 0.00 O ATOM 1709 CB LYS A 106 -9.422 -28.060 -0.702 1.00 0.00 C ATOM 1710 CG LYS A 106 -8.808 -26.789 -0.129 1.00 0.00 C ATOM 1711 CD LYS A 106 -7.383 -27.018 0.351 1.00 0.00 C ATOM 1712 CE LYS A 106 -6.796 -25.760 0.970 1.00 0.00 C ATOM 1713 NZ LYS A 106 -5.397 -25.968 1.435 1.00 0.00 N ATOM 1714 OXT LYS A 106 -10.244 -29.808 -3.342 1.00 0.00 O ATOM 0 H LYS A 106 -9.705 -27.430 -3.440 1.00 0.00 H new ATOM 0 HA LYS A 106 -7.685 -28.770 -1.745 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -10.473 -27.875 -0.922 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -9.388 -28.841 0.058 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -8.815 -26.007 -0.889 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -9.418 -26.432 0.701 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -7.370 -27.826 1.083 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -6.762 -27.337 -0.486 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -6.819 -24.952 0.239 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -7.415 -25.447 1.811 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -5.034 -25.086 1.850 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -5.378 -26.722 2.151 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -4.800 -26.242 0.628 1.00 0.00 H new TER 1728 LYS A 106