USER MOD reduce.3.24.130724 H: found=0, std=0, add=938, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 940 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: B 23 LYS NZ :NH3+ -107:sc= 0.509 (180deg=-2.69!) USER MOD Set 1.2: B 51 TYR OH : rot -149:sc= 0.0287 USER MOD Set 2.1: B 16 ASN : amide:sc= -0.309 K(o=1,f=-0.93!) USER MOD Set 2.2: B 20 THR OG1 : rot 86:sc= 1.34 USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 ASN : amide:sc= 0 X(o=0,f=-0.0074) USER MOD Single : A 18 GLN : amide:sc= -0.512 K(o=-0.51,f=-2.6) USER MOD Single : A 20 THR OG1 : rot 77:sc= 1.27 USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 MET CE :methyl 159:sc= -0.176 (180deg=-0.673) USER MOD Single : A 27 HIS : no HD1:sc= -0.14 X(o=-0.14,f=-0.0044) USER MOD Single : A 35 THR OG1 : rot 151:sc= 1.24 USER MOD Single : A 38 ASN : amide:sc= -0.0153 K(o=-0.015,f=-1.1) USER MOD Single : A 41 MET CE :methyl -122:sc= -0.251 (180deg=-0.532) USER MOD Single : A 46 LYS NZ :NH3+ 158:sc= 1.07 (180deg=0.637) USER MOD Single : A 47 THR OG1 : rot 87:sc= 1.28 USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 51 TYR OH : rot 40:sc= -0.703 USER MOD Single : A 53 GLN : amide:sc= -1.42! C(o=-1.4!,f=-6.5!) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 SER OG : rot 77:sc= 1.05 USER MOD Single : A 61 THR OG1 : rot 180:sc= 0 USER MOD Single : B 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 18 GLN : amide:sc= -1.26! K(o=-1.3!,f=-0.04) USER MOD Single : B 24 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 27 HIS : no HD1:sc= -0.452 K(o=-0.45,f=-6.2!) USER MOD Single : B 35 THR OG1 : rot 180:sc= 0 USER MOD Single : B 38 ASN : amide:sc= -0.195 X(o=-0.19,f=-0.024) USER MOD Single : B 41 MET CE :methyl -171:sc= -0.45 (180deg=-0.569) USER MOD Single : B 46 LYS NZ :NH3+ 138:sc= 2.45 (180deg=1.87) USER MOD Single : B 47 THR OG1 : rot 86:sc= 1.28 USER MOD Single : B 48 TYR OH : rot 180:sc= 0 USER MOD Single : B 53 GLN : amide:sc= -0.137 K(o=-0.14,f=-2.8!) USER MOD Single : B 59 LYS NZ :NH3+ -168:sc= 1.21 (180deg=0.584) USER MOD Single : B 60 SER OG : rot 61:sc= 1.21 USER MOD Single : B 61 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 53 N ALA A 5 29.133 -9.719 -14.109 1.00 0.00 N ATOM 54 CA ALA A 5 28.360 -10.537 -13.188 1.00 0.00 C ATOM 55 C ALA A 5 28.654 -10.137 -11.751 1.00 0.00 C ATOM 56 O ALA A 5 27.877 -10.428 -10.847 1.00 0.00 O ATOM 57 CB ALA A 5 28.653 -12.017 -13.403 1.00 0.00 C ATOM 0 HA ALA A 5 27.301 -10.369 -13.385 1.00 0.00 H new ATOM 0 HB1 ALA A 5 28.064 -12.610 -12.703 1.00 0.00 H new ATOM 0 HB2 ALA A 5 28.392 -12.295 -14.424 1.00 0.00 H new ATOM 0 HB3 ALA A 5 29.713 -12.206 -13.236 1.00 0.00 H new ATOM 63 N GLU A 6 29.778 -9.461 -11.552 1.00 0.00 N ATOM 64 CA GLU A 6 30.151 -8.959 -10.236 1.00 0.00 C ATOM 65 C GLU A 6 29.191 -7.859 -9.800 1.00 0.00 C ATOM 66 O GLU A 6 28.699 -7.843 -8.670 1.00 0.00 O ATOM 67 CB GLU A 6 31.577 -8.406 -10.261 1.00 0.00 C ATOM 68 CG GLU A 6 32.578 -9.294 -10.983 1.00 0.00 C ATOM 69 CD GLU A 6 32.659 -10.692 -10.411 1.00 0.00 C ATOM 70 OE1 GLU A 6 32.885 -10.826 -9.191 1.00 0.00 O ATOM 71 OE2 GLU A 6 32.509 -11.663 -11.187 1.00 0.00 O ATOM 0 H GLU A 6 30.450 -9.247 -12.289 1.00 0.00 H new ATOM 0 HA GLU A 6 30.099 -9.786 -9.527 1.00 0.00 H new ATOM 0 HB2 GLU A 6 31.566 -7.427 -10.739 1.00 0.00 H new ATOM 0 HB3 GLU A 6 31.915 -8.256 -9.235 1.00 0.00 H new ATOM 0 HG2 GLU A 6 32.305 -9.355 -12.037 1.00 0.00 H new ATOM 0 HG3 GLU A 6 33.564 -8.832 -10.935 1.00 0.00 H new ATOM 78 N GLU A 7 28.934 -6.944 -10.719 1.00 0.00 N ATOM 79 CA GLU A 7 28.023 -5.834 -10.486 1.00 0.00 C ATOM 80 C GLU A 7 26.604 -6.351 -10.344 1.00 0.00 C ATOM 81 O GLU A 7 25.826 -5.866 -9.520 1.00 0.00 O ATOM 82 CB GLU A 7 28.120 -4.863 -11.661 1.00 0.00 C ATOM 83 CG GLU A 7 27.411 -3.539 -11.445 1.00 0.00 C ATOM 84 CD GLU A 7 27.720 -2.544 -12.542 1.00 0.00 C ATOM 85 OE1 GLU A 7 27.081 -2.609 -13.614 1.00 0.00 O ATOM 86 OE2 GLU A 7 28.620 -1.699 -12.342 1.00 0.00 O ATOM 0 H GLU A 7 29.351 -6.949 -11.650 1.00 0.00 H new ATOM 0 HA GLU A 7 28.294 -5.318 -9.565 1.00 0.00 H new ATOM 0 HB2 GLU A 7 29.172 -4.667 -11.868 1.00 0.00 H new ATOM 0 HB3 GLU A 7 27.704 -5.343 -12.547 1.00 0.00 H new ATOM 0 HG2 GLU A 7 26.335 -3.707 -11.401 1.00 0.00 H new ATOM 0 HG3 GLU A 7 27.708 -3.122 -10.483 1.00 0.00 H new ATOM 93 N LEU A 8 26.288 -7.354 -11.143 1.00 0.00 N ATOM 94 CA LEU A 8 24.992 -7.996 -11.101 1.00 0.00 C ATOM 95 C LEU A 8 24.817 -8.767 -9.797 1.00 0.00 C ATOM 96 O LEU A 8 23.733 -8.786 -9.219 1.00 0.00 O ATOM 97 CB LEU A 8 24.842 -8.922 -12.308 1.00 0.00 C ATOM 98 CG LEU A 8 24.187 -8.289 -13.542 1.00 0.00 C ATOM 99 CD1 LEU A 8 25.007 -7.118 -14.062 1.00 0.00 C ATOM 100 CD2 LEU A 8 23.997 -9.328 -14.634 1.00 0.00 C ATOM 0 H LEU A 8 26.924 -7.744 -11.838 1.00 0.00 H new ATOM 0 HA LEU A 8 24.213 -7.235 -11.143 1.00 0.00 H new ATOM 0 HB2 LEU A 8 25.829 -9.289 -12.589 1.00 0.00 H new ATOM 0 HB3 LEU A 8 24.253 -9.789 -12.009 1.00 0.00 H new ATOM 0 HG LEU A 8 23.210 -7.909 -13.244 1.00 0.00 H new ATOM 0 HD11 LEU A 8 24.517 -6.691 -14.937 1.00 0.00 H new ATOM 0 HD12 LEU A 8 25.090 -6.358 -13.285 1.00 0.00 H new ATOM 0 HD13 LEU A 8 26.003 -7.465 -14.337 1.00 0.00 H new ATOM 0 HD21 LEU A 8 23.531 -8.862 -15.502 1.00 0.00 H new ATOM 0 HD22 LEU A 8 24.966 -9.738 -14.918 1.00 0.00 H new ATOM 0 HD23 LEU A 8 23.357 -10.130 -14.266 1.00 0.00 H new ATOM 112 N LYS A 9 25.899 -9.381 -9.330 1.00 0.00 N ATOM 113 CA LYS A 9 25.888 -10.112 -8.072 1.00 0.00 C ATOM 114 C LYS A 9 25.628 -9.167 -6.916 1.00 0.00 C ATOM 115 O LYS A 9 24.739 -9.405 -6.107 1.00 0.00 O ATOM 116 CB LYS A 9 27.219 -10.829 -7.861 1.00 0.00 C ATOM 117 CG LYS A 9 27.259 -11.702 -6.615 1.00 0.00 C ATOM 118 CD LYS A 9 26.335 -12.904 -6.739 1.00 0.00 C ATOM 119 CE LYS A 9 26.344 -13.745 -5.472 1.00 0.00 C ATOM 120 NZ LYS A 9 25.597 -15.020 -5.639 1.00 0.00 N ATOM 0 H LYS A 9 26.799 -9.385 -9.809 1.00 0.00 H new ATOM 0 HA LYS A 9 25.089 -10.852 -8.113 1.00 0.00 H new ATOM 0 HB2 LYS A 9 27.429 -11.448 -8.733 1.00 0.00 H new ATOM 0 HB3 LYS A 9 28.014 -10.086 -7.798 1.00 0.00 H new ATOM 0 HG2 LYS A 9 28.280 -12.044 -6.443 1.00 0.00 H new ATOM 0 HG3 LYS A 9 26.971 -11.110 -5.747 1.00 0.00 H new ATOM 0 HD2 LYS A 9 25.320 -12.565 -6.945 1.00 0.00 H new ATOM 0 HD3 LYS A 9 26.644 -13.516 -7.586 1.00 0.00 H new ATOM 0 HE2 LYS A 9 27.374 -13.964 -5.190 1.00 0.00 H new ATOM 0 HE3 LYS A 9 25.905 -13.173 -4.655 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 25.630 -15.560 -4.751 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 24.607 -14.813 -5.882 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 26.031 -15.579 -6.401 1.00 0.00 H new ATOM 134 N ALA A 10 26.409 -8.096 -6.849 1.00 0.00 N ATOM 135 CA ALA A 10 26.251 -7.101 -5.797 1.00 0.00 C ATOM 136 C ALA A 10 24.852 -6.500 -5.821 1.00 0.00 C ATOM 137 O ALA A 10 24.243 -6.270 -4.775 1.00 0.00 O ATOM 138 CB ALA A 10 27.294 -6.009 -5.941 1.00 0.00 C ATOM 0 H ALA A 10 27.158 -7.895 -7.511 1.00 0.00 H new ATOM 0 HA ALA A 10 26.392 -7.598 -4.837 1.00 0.00 H new ATOM 0 HB1 ALA A 10 27.162 -5.273 -5.148 1.00 0.00 H new ATOM 0 HB2 ALA A 10 28.290 -6.446 -5.870 1.00 0.00 H new ATOM 0 HB3 ALA A 10 27.180 -5.522 -6.910 1.00 0.00 H new ATOM 144 N LYS A 11 24.350 -6.250 -7.024 1.00 0.00 N ATOM 145 CA LYS A 11 23.002 -5.717 -7.196 1.00 0.00 C ATOM 146 C LYS A 11 21.964 -6.700 -6.664 1.00 0.00 C ATOM 147 O LYS A 11 21.136 -6.344 -5.826 1.00 0.00 O ATOM 148 CB LYS A 11 22.731 -5.429 -8.675 1.00 0.00 C ATOM 149 CG LYS A 11 21.407 -4.721 -8.958 1.00 0.00 C ATOM 150 CD LYS A 11 21.458 -3.232 -8.631 1.00 0.00 C ATOM 151 CE LYS A 11 21.287 -2.957 -7.143 1.00 0.00 C ATOM 152 NZ LYS A 11 21.351 -1.501 -6.837 1.00 0.00 N ATOM 0 H LYS A 11 24.855 -6.407 -7.896 1.00 0.00 H new ATOM 0 HA LYS A 11 22.927 -4.788 -6.631 1.00 0.00 H new ATOM 0 HB2 LYS A 11 23.544 -4.818 -9.067 1.00 0.00 H new ATOM 0 HB3 LYS A 11 22.747 -6.371 -9.223 1.00 0.00 H new ATOM 0 HG2 LYS A 11 21.147 -4.850 -10.009 1.00 0.00 H new ATOM 0 HG3 LYS A 11 20.616 -5.191 -8.374 1.00 0.00 H new ATOM 0 HD2 LYS A 11 22.411 -2.822 -8.966 1.00 0.00 H new ATOM 0 HD3 LYS A 11 20.675 -2.714 -9.185 1.00 0.00 H new ATOM 0 HE2 LYS A 11 20.330 -3.357 -6.807 1.00 0.00 H new ATOM 0 HE3 LYS A 11 22.064 -3.480 -6.585 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 21.230 -1.356 -5.814 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 22.274 -1.124 -7.134 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 20.594 -1.005 -7.349 1.00 0.00 H new ATOM 166 N LEU A 12 22.026 -7.939 -7.138 1.00 0.00 N ATOM 167 CA LEU A 12 21.078 -8.971 -6.724 1.00 0.00 C ATOM 168 C LEU A 12 21.225 -9.273 -5.236 1.00 0.00 C ATOM 169 O LEU A 12 20.250 -9.585 -4.557 1.00 0.00 O ATOM 170 CB LEU A 12 21.290 -10.249 -7.541 1.00 0.00 C ATOM 171 CG LEU A 12 20.319 -11.394 -7.233 1.00 0.00 C ATOM 172 CD1 LEU A 12 18.887 -10.981 -7.547 1.00 0.00 C ATOM 173 CD2 LEU A 12 20.707 -12.636 -8.023 1.00 0.00 C ATOM 0 H LEU A 12 22.724 -8.256 -7.811 1.00 0.00 H new ATOM 0 HA LEU A 12 20.070 -8.599 -6.905 1.00 0.00 H new ATOM 0 HB2 LEU A 12 21.209 -10.001 -8.599 1.00 0.00 H new ATOM 0 HB3 LEU A 12 22.307 -10.603 -7.373 1.00 0.00 H new ATOM 0 HG LEU A 12 20.378 -11.626 -6.170 1.00 0.00 H new ATOM 0 HD11 LEU A 12 18.212 -11.807 -7.322 1.00 0.00 H new ATOM 0 HD12 LEU A 12 18.617 -10.116 -6.941 1.00 0.00 H new ATOM 0 HD13 LEU A 12 18.806 -10.724 -8.603 1.00 0.00 H new ATOM 0 HD21 LEU A 12 20.011 -13.443 -7.797 1.00 0.00 H new ATOM 0 HD22 LEU A 12 20.672 -12.415 -9.090 1.00 0.00 H new ATOM 0 HD23 LEU A 12 21.717 -12.941 -7.749 1.00 0.00 H new ATOM 185 N LYS A 13 22.454 -9.198 -4.749 1.00 0.00 N ATOM 186 CA LYS A 13 22.743 -9.392 -3.333 1.00 0.00 C ATOM 187 C LYS A 13 22.023 -8.335 -2.506 1.00 0.00 C ATOM 188 O LYS A 13 21.361 -8.644 -1.512 1.00 0.00 O ATOM 189 CB LYS A 13 24.254 -9.305 -3.105 1.00 0.00 C ATOM 190 CG LYS A 13 24.705 -9.677 -1.705 1.00 0.00 C ATOM 191 CD LYS A 13 26.221 -9.661 -1.607 1.00 0.00 C ATOM 192 CE LYS A 13 26.700 -9.995 -0.206 1.00 0.00 C ATOM 193 NZ LYS A 13 28.183 -10.007 -0.119 1.00 0.00 N ATOM 0 H LYS A 13 23.277 -9.002 -5.319 1.00 0.00 H new ATOM 0 HA LYS A 13 22.391 -10.376 -3.022 1.00 0.00 H new ATOM 0 HB2 LYS A 13 24.754 -9.959 -3.819 1.00 0.00 H new ATOM 0 HB3 LYS A 13 24.582 -8.288 -3.320 1.00 0.00 H new ATOM 0 HG2 LYS A 13 24.282 -8.978 -0.984 1.00 0.00 H new ATOM 0 HG3 LYS A 13 24.329 -10.667 -1.448 1.00 0.00 H new ATOM 0 HD2 LYS A 13 26.638 -10.378 -2.314 1.00 0.00 H new ATOM 0 HD3 LYS A 13 26.593 -8.677 -1.893 1.00 0.00 H new ATOM 0 HE2 LYS A 13 26.300 -9.266 0.498 1.00 0.00 H new ATOM 0 HE3 LYS A 13 26.311 -10.969 0.089 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 28.472 -10.239 0.853 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 28.563 -10.721 -0.773 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 28.553 -9.070 -0.376 1.00 0.00 H new ATOM 207 N LYS A 14 22.152 -7.090 -2.941 1.00 0.00 N ATOM 208 CA LYS A 14 21.508 -5.965 -2.276 1.00 0.00 C ATOM 209 C LYS A 14 19.989 -6.095 -2.365 1.00 0.00 C ATOM 210 O LYS A 14 19.282 -5.972 -1.364 1.00 0.00 O ATOM 211 CB LYS A 14 21.961 -4.655 -2.924 1.00 0.00 C ATOM 212 CG LYS A 14 21.703 -3.425 -2.074 1.00 0.00 C ATOM 213 CD LYS A 14 22.269 -2.180 -2.733 1.00 0.00 C ATOM 214 CE LYS A 14 22.176 -0.971 -1.817 1.00 0.00 C ATOM 215 NZ LYS A 14 22.723 0.258 -2.453 1.00 0.00 N ATOM 0 H LYS A 14 22.702 -6.831 -3.760 1.00 0.00 H new ATOM 0 HA LYS A 14 21.796 -5.964 -1.225 1.00 0.00 H new ATOM 0 HB2 LYS A 14 23.028 -4.718 -3.140 1.00 0.00 H new ATOM 0 HB3 LYS A 14 21.449 -4.538 -3.879 1.00 0.00 H new ATOM 0 HG2 LYS A 14 20.631 -3.304 -1.920 1.00 0.00 H new ATOM 0 HG3 LYS A 14 22.154 -3.557 -1.090 1.00 0.00 H new ATOM 0 HD2 LYS A 14 23.311 -2.353 -3.004 1.00 0.00 H new ATOM 0 HD3 LYS A 14 21.728 -1.979 -3.658 1.00 0.00 H new ATOM 0 HE2 LYS A 14 21.134 -0.804 -1.543 1.00 0.00 H new ATOM 0 HE3 LYS A 14 22.720 -1.174 -0.894 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 22.639 1.057 -1.793 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 23.724 0.109 -2.691 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 22.188 0.468 -3.320 1.00 0.00 H new ATOM 229 N LEU A 15 19.506 -6.365 -3.574 1.00 0.00 N ATOM 230 CA LEU A 15 18.076 -6.514 -3.831 1.00 0.00 C ATOM 231 C LEU A 15 17.474 -7.654 -3.019 1.00 0.00 C ATOM 232 O LEU A 15 16.334 -7.561 -2.564 1.00 0.00 O ATOM 233 CB LEU A 15 17.836 -6.766 -5.321 1.00 0.00 C ATOM 234 CG LEU A 15 18.132 -5.582 -6.240 1.00 0.00 C ATOM 235 CD1 LEU A 15 17.955 -5.984 -7.696 1.00 0.00 C ATOM 236 CD2 LEU A 15 17.230 -4.409 -5.898 1.00 0.00 C ATOM 0 H LEU A 15 20.091 -6.486 -4.400 1.00 0.00 H new ATOM 0 HA LEU A 15 17.588 -5.588 -3.528 1.00 0.00 H new ATOM 0 HB2 LEU A 15 18.451 -7.610 -5.633 1.00 0.00 H new ATOM 0 HB3 LEU A 15 16.796 -7.061 -5.460 1.00 0.00 H new ATOM 0 HG LEU A 15 19.167 -5.276 -6.090 1.00 0.00 H new ATOM 0 HD11 LEU A 15 18.169 -5.130 -8.338 1.00 0.00 H new ATOM 0 HD12 LEU A 15 18.640 -6.798 -7.935 1.00 0.00 H new ATOM 0 HD13 LEU A 15 16.929 -6.313 -7.860 1.00 0.00 H new ATOM 0 HD21 LEU A 15 17.453 -3.573 -6.561 1.00 0.00 H new ATOM 0 HD22 LEU A 15 16.188 -4.703 -6.022 1.00 0.00 H new ATOM 0 HD23 LEU A 15 17.401 -4.108 -4.865 1.00 0.00 H new ATOM 248 N ASN A 16 18.237 -8.725 -2.838 1.00 0.00 N ATOM 249 CA ASN A 16 17.764 -9.881 -2.085 1.00 0.00 C ATOM 250 C ASN A 16 17.439 -9.481 -0.650 1.00 0.00 C ATOM 251 O ASN A 16 16.407 -9.875 -0.100 1.00 0.00 O ATOM 252 CB ASN A 16 18.818 -10.988 -2.094 1.00 0.00 C ATOM 253 CG ASN A 16 18.289 -12.300 -1.552 1.00 0.00 C ATOM 254 OD1 ASN A 16 18.347 -12.558 -0.351 1.00 0.00 O ATOM 255 ND2 ASN A 16 17.786 -13.146 -2.436 1.00 0.00 N ATOM 0 H ASN A 16 19.185 -8.818 -3.202 1.00 0.00 H new ATOM 0 HA ASN A 16 16.857 -10.256 -2.560 1.00 0.00 H new ATOM 0 HB2 ASN A 16 19.174 -11.137 -3.113 1.00 0.00 H new ATOM 0 HB3 ASN A 16 19.676 -10.673 -1.500 1.00 0.00 H new ATOM 0 HD21 ASN A 16 17.428 -14.051 -2.130 1.00 0.00 H new ATOM 0 HD22 ASN A 16 17.756 -12.894 -3.424 1.00 0.00 H new ATOM 262 N ALA A 17 18.317 -8.678 -0.055 1.00 0.00 N ATOM 263 CA ALA A 17 18.107 -8.186 1.299 1.00 0.00 C ATOM 264 C ALA A 17 16.937 -7.215 1.333 1.00 0.00 C ATOM 265 O ALA A 17 16.083 -7.284 2.215 1.00 0.00 O ATOM 266 CB ALA A 17 19.371 -7.519 1.826 1.00 0.00 C ATOM 0 H ALA A 17 19.181 -8.355 -0.491 1.00 0.00 H new ATOM 0 HA ALA A 17 17.872 -9.033 1.943 1.00 0.00 H new ATOM 0 HB1 ALA A 17 19.196 -7.157 2.839 1.00 0.00 H new ATOM 0 HB2 ALA A 17 20.187 -8.241 1.835 1.00 0.00 H new ATOM 0 HB3 ALA A 17 19.636 -6.680 1.182 1.00 0.00 H new ATOM 272 N GLN A 18 16.901 -6.325 0.349 1.00 0.00 N ATOM 273 CA GLN A 18 15.838 -5.335 0.235 1.00 0.00 C ATOM 274 C GLN A 18 14.462 -5.996 0.137 1.00 0.00 C ATOM 275 O GLN A 18 13.549 -5.666 0.896 1.00 0.00 O ATOM 276 CB GLN A 18 16.087 -4.446 -0.986 1.00 0.00 C ATOM 277 CG GLN A 18 17.276 -3.514 -0.826 1.00 0.00 C ATOM 278 CD GLN A 18 17.566 -2.718 -2.084 1.00 0.00 C ATOM 279 OE1 GLN A 18 18.331 -3.154 -2.940 1.00 0.00 O ATOM 280 NE2 GLN A 18 16.958 -1.546 -2.212 1.00 0.00 N ATOM 0 H GLN A 18 17.604 -6.269 -0.388 1.00 0.00 H new ATOM 0 HA GLN A 18 15.846 -4.724 1.137 1.00 0.00 H new ATOM 0 HB2 GLN A 18 16.246 -5.078 -1.859 1.00 0.00 H new ATOM 0 HB3 GLN A 18 15.194 -3.852 -1.181 1.00 0.00 H new ATOM 0 HG2 GLN A 18 17.086 -2.827 -0.001 1.00 0.00 H new ATOM 0 HG3 GLN A 18 18.157 -4.097 -0.558 1.00 0.00 H new ATOM 0 HE21 GLN A 18 16.329 -1.215 -1.481 1.00 0.00 H new ATOM 0 HE22 GLN A 18 17.120 -0.976 -3.042 1.00 0.00 H new ATOM 289 N ALA A 19 14.326 -6.939 -0.788 1.00 0.00 N ATOM 290 CA ALA A 19 13.060 -7.630 -1.014 1.00 0.00 C ATOM 291 C ALA A 19 12.622 -8.415 0.220 1.00 0.00 C ATOM 292 O ALA A 19 11.429 -8.540 0.497 1.00 0.00 O ATOM 293 CB ALA A 19 13.182 -8.554 -2.212 1.00 0.00 C ATOM 0 H ALA A 19 15.083 -7.245 -1.399 1.00 0.00 H new ATOM 0 HA ALA A 19 12.296 -6.879 -1.215 1.00 0.00 H new ATOM 0 HB1 ALA A 19 12.234 -9.066 -2.375 1.00 0.00 H new ATOM 0 HB2 ALA A 19 13.436 -7.971 -3.097 1.00 0.00 H new ATOM 0 HB3 ALA A 19 13.964 -9.290 -2.026 1.00 0.00 H new ATOM 299 N THR A 20 13.591 -8.939 0.958 1.00 0.00 N ATOM 300 CA THR A 20 13.305 -9.710 2.161 1.00 0.00 C ATOM 301 C THR A 20 12.888 -8.795 3.310 1.00 0.00 C ATOM 302 O THR A 20 11.884 -9.047 3.982 1.00 0.00 O ATOM 303 CB THR A 20 14.525 -10.553 2.583 1.00 0.00 C ATOM 304 OG1 THR A 20 14.923 -11.406 1.497 1.00 0.00 O ATOM 305 CG2 THR A 20 14.203 -11.401 3.808 1.00 0.00 C ATOM 0 H THR A 20 14.584 -8.844 0.745 1.00 0.00 H new ATOM 0 HA THR A 20 12.479 -10.382 1.929 1.00 0.00 H new ATOM 0 HB THR A 20 15.340 -9.875 2.837 1.00 0.00 H new ATOM 0 HG1 THR A 20 15.408 -10.879 0.828 1.00 0.00 H new ATOM 0 HG21 THR A 20 15.079 -11.986 4.086 1.00 0.00 H new ATOM 0 HG22 THR A 20 13.923 -10.751 4.637 1.00 0.00 H new ATOM 0 HG23 THR A 20 13.376 -12.073 3.578 1.00 0.00 H new ATOM 313 N ALA A 21 13.644 -7.722 3.513 1.00 0.00 N ATOM 314 CA ALA A 21 13.382 -6.783 4.597 1.00 0.00 C ATOM 315 C ALA A 21 12.002 -6.153 4.456 1.00 0.00 C ATOM 316 O ALA A 21 11.241 -6.089 5.423 1.00 0.00 O ATOM 317 CB ALA A 21 14.454 -5.706 4.638 1.00 0.00 C ATOM 0 H ALA A 21 14.449 -7.480 2.936 1.00 0.00 H new ATOM 0 HA ALA A 21 13.406 -7.337 5.535 1.00 0.00 H new ATOM 0 HB1 ALA A 21 14.243 -5.014 5.453 1.00 0.00 H new ATOM 0 HB2 ALA A 21 15.428 -6.168 4.798 1.00 0.00 H new ATOM 0 HB3 ALA A 21 14.460 -5.163 3.693 1.00 0.00 H new ATOM 323 N LEU A 22 11.673 -5.710 3.245 1.00 0.00 N ATOM 324 CA LEU A 22 10.371 -5.102 2.984 1.00 0.00 C ATOM 325 C LEU A 22 9.248 -6.117 3.164 1.00 0.00 C ATOM 326 O LEU A 22 8.188 -5.787 3.691 1.00 0.00 O ATOM 327 CB LEU A 22 10.315 -4.493 1.576 1.00 0.00 C ATOM 328 CG LEU A 22 10.783 -3.036 1.463 1.00 0.00 C ATOM 329 CD1 LEU A 22 9.951 -2.135 2.363 1.00 0.00 C ATOM 330 CD2 LEU A 22 12.262 -2.904 1.795 1.00 0.00 C ATOM 0 H LEU A 22 12.287 -5.760 2.432 1.00 0.00 H new ATOM 0 HA LEU A 22 10.233 -4.300 3.710 1.00 0.00 H new ATOM 0 HB2 LEU A 22 10.925 -5.104 0.911 1.00 0.00 H new ATOM 0 HB3 LEU A 22 9.289 -4.555 1.214 1.00 0.00 H new ATOM 0 HG LEU A 22 10.642 -2.720 0.429 1.00 0.00 H new ATOM 0 HD11 LEU A 22 10.298 -1.106 2.269 1.00 0.00 H new ATOM 0 HD12 LEU A 22 8.903 -2.193 2.068 1.00 0.00 H new ATOM 0 HD13 LEU A 22 10.054 -2.459 3.398 1.00 0.00 H new ATOM 0 HD21 LEU A 22 12.563 -1.860 1.706 1.00 0.00 H new ATOM 0 HD22 LEU A 22 12.438 -3.247 2.815 1.00 0.00 H new ATOM 0 HD23 LEU A 22 12.846 -3.510 1.103 1.00 0.00 H new ATOM 342 N LYS A 23 9.494 -7.351 2.743 1.00 0.00 N ATOM 343 CA LYS A 23 8.512 -8.420 2.896 1.00 0.00 C ATOM 344 C LYS A 23 8.165 -8.619 4.369 1.00 0.00 C ATOM 345 O LYS A 23 6.994 -8.727 4.736 1.00 0.00 O ATOM 346 CB LYS A 23 9.054 -9.726 2.313 1.00 0.00 C ATOM 347 CG LYS A 23 8.061 -10.875 2.362 1.00 0.00 C ATOM 348 CD LYS A 23 8.692 -12.180 1.915 1.00 0.00 C ATOM 349 CE LYS A 23 7.671 -13.305 1.858 1.00 0.00 C ATOM 350 NZ LYS A 23 8.313 -14.614 1.571 1.00 0.00 N ATOM 0 H LYS A 23 10.364 -7.638 2.293 1.00 0.00 H new ATOM 0 HA LYS A 23 7.609 -8.136 2.355 1.00 0.00 H new ATOM 0 HB2 LYS A 23 9.349 -9.556 1.278 1.00 0.00 H new ATOM 0 HB3 LYS A 23 9.954 -10.011 2.858 1.00 0.00 H new ATOM 0 HG2 LYS A 23 7.680 -10.984 3.377 1.00 0.00 H new ATOM 0 HG3 LYS A 23 7.207 -10.646 1.724 1.00 0.00 H new ATOM 0 HD2 LYS A 23 9.144 -12.048 0.932 1.00 0.00 H new ATOM 0 HD3 LYS A 23 9.494 -12.451 2.601 1.00 0.00 H new ATOM 0 HE2 LYS A 23 7.138 -13.361 2.807 1.00 0.00 H new ATOM 0 HE3 LYS A 23 6.930 -13.086 1.089 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 7.586 -15.358 1.540 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 8.801 -14.568 0.654 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 9.002 -14.834 2.319 1.00 0.00 H new ATOM 364 N MET A 24 9.196 -8.648 5.207 1.00 0.00 N ATOM 365 CA MET A 24 9.013 -8.845 6.639 1.00 0.00 C ATOM 366 C MET A 24 8.281 -7.662 7.260 1.00 0.00 C ATOM 367 O MET A 24 7.313 -7.840 7.999 1.00 0.00 O ATOM 368 CB MET A 24 10.365 -9.039 7.333 1.00 0.00 C ATOM 369 CG MET A 24 11.115 -10.285 6.886 1.00 0.00 C ATOM 370 SD MET A 24 12.701 -10.478 7.720 1.00 0.00 S ATOM 371 CE MET A 24 12.174 -10.646 9.425 1.00 0.00 C ATOM 0 H MET A 24 10.168 -8.537 4.918 1.00 0.00 H new ATOM 0 HA MET A 24 8.410 -9.742 6.779 1.00 0.00 H new ATOM 0 HB2 MET A 24 10.988 -8.165 7.144 1.00 0.00 H new ATOM 0 HB3 MET A 24 10.205 -9.090 8.410 1.00 0.00 H new ATOM 0 HG2 MET A 24 10.499 -11.163 7.078 1.00 0.00 H new ATOM 0 HG3 MET A 24 11.278 -10.239 5.809 1.00 0.00 H new ATOM 0 HE1 MET A 24 12.960 -11.132 10.003 1.00 0.00 H new ATOM 0 HE2 MET A 24 11.974 -9.659 9.843 1.00 0.00 H new ATOM 0 HE3 MET A 24 11.267 -11.249 9.468 1.00 0.00 H new ATOM 381 N ASP A 25 8.739 -6.457 6.937 1.00 0.00 N ATOM 382 CA ASP A 25 8.172 -5.241 7.515 1.00 0.00 C ATOM 383 C ASP A 25 6.722 -5.057 7.083 1.00 0.00 C ATOM 384 O ASP A 25 5.860 -4.738 7.902 1.00 0.00 O ATOM 385 CB ASP A 25 9.002 -4.021 7.113 1.00 0.00 C ATOM 386 CG ASP A 25 8.610 -2.764 7.875 1.00 0.00 C ATOM 387 OD1 ASP A 25 8.968 -2.654 9.069 1.00 0.00 O ATOM 388 OD2 ASP A 25 7.965 -1.877 7.286 1.00 0.00 O ATOM 0 H ASP A 25 9.501 -6.295 6.278 1.00 0.00 H new ATOM 0 HA ASP A 25 8.196 -5.340 8.600 1.00 0.00 H new ATOM 0 HB2 ASP A 25 10.057 -4.232 7.287 1.00 0.00 H new ATOM 0 HB3 ASP A 25 8.885 -3.844 6.044 1.00 0.00 H new ATOM 393 N LEU A 26 6.453 -5.281 5.798 1.00 0.00 N ATOM 394 CA LEU A 26 5.098 -5.168 5.266 1.00 0.00 C ATOM 395 C LEU A 26 4.165 -6.161 5.949 1.00 0.00 C ATOM 396 O LEU A 26 3.080 -5.793 6.399 1.00 0.00 O ATOM 397 CB LEU A 26 5.088 -5.405 3.750 1.00 0.00 C ATOM 398 CG LEU A 26 3.705 -5.396 3.092 1.00 0.00 C ATOM 399 CD1 LEU A 26 3.038 -4.039 3.252 1.00 0.00 C ATOM 400 CD2 LEU A 26 3.815 -5.763 1.622 1.00 0.00 C ATOM 0 H LEU A 26 7.156 -5.542 5.107 1.00 0.00 H new ATOM 0 HA LEU A 26 4.744 -4.157 5.467 1.00 0.00 H new ATOM 0 HB2 LEU A 26 5.702 -4.639 3.276 1.00 0.00 H new ATOM 0 HB3 LEU A 26 5.562 -6.365 3.546 1.00 0.00 H new ATOM 0 HG LEU A 26 3.085 -6.141 3.592 1.00 0.00 H new ATOM 0 HD11 LEU A 26 2.057 -4.057 2.777 1.00 0.00 H new ATOM 0 HD12 LEU A 26 2.923 -3.813 4.312 1.00 0.00 H new ATOM 0 HD13 LEU A 26 3.655 -3.273 2.782 1.00 0.00 H new ATOM 0 HD21 LEU A 26 2.824 -5.752 1.169 1.00 0.00 H new ATOM 0 HD22 LEU A 26 4.454 -5.041 1.114 1.00 0.00 H new ATOM 0 HD23 LEU A 26 4.246 -6.760 1.527 1.00 0.00 H new ATOM 412 N HIS A 27 4.595 -7.416 6.036 1.00 0.00 N ATOM 413 CA HIS A 27 3.785 -8.456 6.658 1.00 0.00 C ATOM 414 C HIS A 27 3.545 -8.125 8.126 1.00 0.00 C ATOM 415 O HIS A 27 2.429 -8.263 8.620 1.00 0.00 O ATOM 416 CB HIS A 27 4.464 -9.824 6.526 1.00 0.00 C ATOM 417 CG HIS A 27 3.566 -10.990 6.835 1.00 0.00 C ATOM 418 ND1 HIS A 27 3.245 -11.961 5.908 1.00 0.00 N ATOM 419 CD2 HIS A 27 2.928 -11.347 7.978 1.00 0.00 C ATOM 420 CE1 HIS A 27 2.450 -12.856 6.466 1.00 0.00 C ATOM 421 NE2 HIS A 27 2.242 -12.508 7.720 1.00 0.00 N ATOM 0 H HIS A 27 5.497 -7.736 5.684 1.00 0.00 H new ATOM 0 HA HIS A 27 2.825 -8.500 6.144 1.00 0.00 H new ATOM 0 HB2 HIS A 27 4.844 -9.932 5.510 1.00 0.00 H new ATOM 0 HB3 HIS A 27 5.325 -9.856 7.194 1.00 0.00 H new ATOM 0 HD2 HIS A 27 2.955 -10.816 8.918 1.00 0.00 H new ATOM 0 HE1 HIS A 27 2.039 -13.727 5.977 1.00 0.00 H new ATOM 0 HE2 HIS A 27 1.666 -13.018 8.389 1.00 0.00 H new ATOM 430 N ASP A 28 4.593 -7.679 8.806 1.00 0.00 N ATOM 431 CA ASP A 28 4.505 -7.335 10.222 1.00 0.00 C ATOM 432 C ASP A 28 3.565 -6.153 10.443 1.00 0.00 C ATOM 433 O ASP A 28 2.736 -6.175 11.354 1.00 0.00 O ATOM 434 CB ASP A 28 5.893 -7.010 10.779 1.00 0.00 C ATOM 435 CG ASP A 28 5.858 -6.624 12.241 1.00 0.00 C ATOM 436 OD1 ASP A 28 5.722 -7.526 13.096 1.00 0.00 O ATOM 437 OD2 ASP A 28 5.977 -5.421 12.544 1.00 0.00 O ATOM 0 H ASP A 28 5.519 -7.546 8.399 1.00 0.00 H new ATOM 0 HA ASP A 28 4.101 -8.198 10.752 1.00 0.00 H new ATOM 0 HB2 ASP A 28 6.543 -7.875 10.651 1.00 0.00 H new ATOM 0 HB3 ASP A 28 6.330 -6.195 10.202 1.00 0.00 H new ATOM 442 N LEU A 29 3.690 -5.133 9.599 1.00 0.00 N ATOM 443 CA LEU A 29 2.826 -3.957 9.680 1.00 0.00 C ATOM 444 C LEU A 29 1.378 -4.331 9.380 1.00 0.00 C ATOM 445 O LEU A 29 0.451 -3.807 9.995 1.00 0.00 O ATOM 446 CB LEU A 29 3.300 -2.878 8.702 1.00 0.00 C ATOM 447 CG LEU A 29 2.465 -1.593 8.686 1.00 0.00 C ATOM 448 CD1 LEU A 29 2.565 -0.868 10.019 1.00 0.00 C ATOM 449 CD2 LEU A 29 2.903 -0.684 7.550 1.00 0.00 C ATOM 0 H LEU A 29 4.382 -5.096 8.850 1.00 0.00 H new ATOM 0 HA LEU A 29 2.881 -3.564 10.695 1.00 0.00 H new ATOM 0 HB2 LEU A 29 4.330 -2.619 8.945 1.00 0.00 H new ATOM 0 HB3 LEU A 29 3.306 -3.300 7.697 1.00 0.00 H new ATOM 0 HG LEU A 29 1.423 -1.867 8.524 1.00 0.00 H new ATOM 0 HD11 LEU A 29 1.965 0.041 9.985 1.00 0.00 H new ATOM 0 HD12 LEU A 29 2.197 -1.516 10.814 1.00 0.00 H new ATOM 0 HD13 LEU A 29 3.605 -0.608 10.215 1.00 0.00 H new ATOM 0 HD21 LEU A 29 2.298 0.223 7.556 1.00 0.00 H new ATOM 0 HD22 LEU A 29 3.953 -0.421 7.679 1.00 0.00 H new ATOM 0 HD23 LEU A 29 2.773 -1.201 6.599 1.00 0.00 H new ATOM 461 N ALA A 30 1.196 -5.249 8.441 1.00 0.00 N ATOM 462 CA ALA A 30 -0.135 -5.713 8.070 1.00 0.00 C ATOM 463 C ALA A 30 -0.794 -6.466 9.223 1.00 0.00 C ATOM 464 O ALA A 30 -2.022 -6.516 9.320 1.00 0.00 O ATOM 465 CB ALA A 30 -0.066 -6.592 6.831 1.00 0.00 C ATOM 0 H ALA A 30 1.955 -5.689 7.921 1.00 0.00 H new ATOM 0 HA ALA A 30 -0.746 -4.839 7.844 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -1.069 -6.930 6.568 1.00 0.00 H new ATOM 0 HB2 ALA A 30 0.353 -6.021 6.003 1.00 0.00 H new ATOM 0 HB3 ALA A 30 0.567 -7.456 7.033 1.00 0.00 H new ATOM 471 N GLU A 31 0.030 -7.058 10.085 1.00 0.00 N ATOM 472 CA GLU A 31 -0.456 -7.746 11.269 1.00 0.00 C ATOM 473 C GLU A 31 -0.989 -6.740 12.281 1.00 0.00 C ATOM 474 O GLU A 31 -1.973 -7.001 12.976 1.00 0.00 O ATOM 475 CB GLU A 31 0.672 -8.559 11.907 1.00 0.00 C ATOM 476 CG GLU A 31 1.206 -9.683 11.036 1.00 0.00 C ATOM 477 CD GLU A 31 0.182 -10.767 10.782 1.00 0.00 C ATOM 478 OE1 GLU A 31 -0.109 -11.545 11.713 1.00 0.00 O ATOM 479 OE2 GLU A 31 -0.321 -10.863 9.645 1.00 0.00 O ATOM 0 H GLU A 31 1.044 -7.072 9.980 1.00 0.00 H new ATOM 0 HA GLU A 31 -1.261 -8.418 10.972 1.00 0.00 H new ATOM 0 HB2 GLU A 31 1.493 -7.886 12.155 1.00 0.00 H new ATOM 0 HB3 GLU A 31 0.313 -8.982 12.845 1.00 0.00 H new ATOM 0 HG2 GLU A 31 1.536 -9.271 10.082 1.00 0.00 H new ATOM 0 HG3 GLU A 31 2.082 -10.122 11.514 1.00 0.00 H new ATOM 486 N ASP A 32 -0.340 -5.581 12.348 1.00 0.00 N ATOM 487 CA ASP A 32 -0.708 -4.549 13.310 1.00 0.00 C ATOM 488 C ASP A 32 -1.281 -3.331 12.589 1.00 0.00 C ATOM 489 O ASP A 32 -0.704 -2.243 12.595 1.00 0.00 O ATOM 490 CB ASP A 32 0.498 -4.156 14.164 1.00 0.00 C ATOM 491 CG ASP A 32 0.092 -3.451 15.440 1.00 0.00 C ATOM 492 OD1 ASP A 32 -0.444 -4.125 16.350 1.00 0.00 O ATOM 493 OD2 ASP A 32 0.307 -2.227 15.550 1.00 0.00 O ATOM 0 H ASP A 32 0.445 -5.333 11.746 1.00 0.00 H new ATOM 0 HA ASP A 32 -1.476 -4.949 13.972 1.00 0.00 H new ATOM 0 HB2 ASP A 32 1.072 -5.049 14.412 1.00 0.00 H new ATOM 0 HB3 ASP A 32 1.154 -3.506 13.585 1.00 0.00 H new ATOM 498 N LEU A 33 -2.424 -3.552 11.964 1.00 0.00 N ATOM 499 CA LEU A 33 -3.124 -2.542 11.175 1.00 0.00 C ATOM 500 C LEU A 33 -3.747 -1.436 12.048 1.00 0.00 C ATOM 501 O LEU A 33 -3.727 -1.541 13.276 1.00 0.00 O ATOM 502 CB LEU A 33 -4.125 -3.207 10.231 1.00 0.00 C ATOM 503 CG LEU A 33 -3.561 -3.470 8.831 1.00 0.00 C ATOM 504 CD1 LEU A 33 -4.615 -4.100 7.936 1.00 0.00 C ATOM 505 CD2 LEU A 33 -3.039 -2.171 8.214 1.00 0.00 C ATOM 0 H LEU A 33 -2.903 -4.452 11.988 1.00 0.00 H new ATOM 0 HA LEU A 33 -2.390 -2.025 10.556 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -4.451 -4.152 10.666 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -5.008 -2.574 10.146 1.00 0.00 H new ATOM 0 HG LEU A 33 -2.730 -4.169 8.922 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -4.193 -4.278 6.947 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -4.940 -5.047 8.368 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -5.469 -3.428 7.851 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -2.642 -2.374 7.220 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -3.854 -1.451 8.139 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -2.249 -1.761 8.843 1.00 0.00 H new ATOM 517 N PRO A 34 -4.365 -0.386 11.427 1.00 0.00 N ATOM 518 CA PRO A 34 -4.471 0.985 11.905 1.00 0.00 C ATOM 519 C PRO A 34 -3.518 1.473 13.002 1.00 0.00 C ATOM 520 O PRO A 34 -3.792 2.476 13.659 1.00 0.00 O ATOM 521 CB PRO A 34 -5.942 0.995 12.250 1.00 0.00 C ATOM 522 CG PRO A 34 -6.536 0.236 11.077 1.00 0.00 C ATOM 523 CD PRO A 34 -5.365 -0.465 10.377 1.00 0.00 C ATOM 0 HA PRO A 34 -4.139 1.720 11.172 1.00 0.00 H new ATOM 0 HB2 PRO A 34 -6.143 0.502 13.201 1.00 0.00 H new ATOM 0 HB3 PRO A 34 -6.338 2.008 12.326 1.00 0.00 H new ATOM 0 HG2 PRO A 34 -7.275 -0.489 11.418 1.00 0.00 H new ATOM 0 HG3 PRO A 34 -7.047 0.915 10.394 1.00 0.00 H new ATOM 0 HD2 PRO A 34 -5.599 -1.493 10.100 1.00 0.00 H new ATOM 0 HD3 PRO A 34 -5.056 0.048 9.466 1.00 0.00 H new ATOM 531 N THR A 35 -2.410 0.784 13.195 1.00 0.00 N ATOM 532 CA THR A 35 -1.246 1.400 13.792 1.00 0.00 C ATOM 533 C THR A 35 -0.181 1.503 12.716 1.00 0.00 C ATOM 534 O THR A 35 0.053 0.549 11.974 1.00 0.00 O ATOM 535 CB THR A 35 -0.688 0.606 14.977 1.00 0.00 C ATOM 536 OG1 THR A 35 -1.610 -0.417 15.367 1.00 0.00 O ATOM 537 CG2 THR A 35 -0.409 1.521 16.158 1.00 0.00 C ATOM 0 H THR A 35 -2.293 -0.199 12.947 1.00 0.00 H new ATOM 0 HA THR A 35 -1.537 2.376 14.180 1.00 0.00 H new ATOM 0 HB THR A 35 0.249 0.145 14.664 1.00 0.00 H new ATOM 0 HG1 THR A 35 -1.117 -1.172 15.751 1.00 0.00 H new ATOM 0 HG21 THR A 35 -0.014 0.934 16.987 1.00 0.00 H new ATOM 0 HG22 THR A 35 0.320 2.277 15.868 1.00 0.00 H new ATOM 0 HG23 THR A 35 -1.334 2.009 16.467 1.00 0.00 H new ATOM 545 N GLY A 36 0.444 2.655 12.612 1.00 0.00 N ATOM 546 CA GLY A 36 1.399 2.882 11.543 1.00 0.00 C ATOM 547 C GLY A 36 0.753 2.909 10.160 1.00 0.00 C ATOM 548 O GLY A 36 1.452 2.951 9.149 1.00 0.00 O ATOM 0 H GLY A 36 0.312 3.443 13.246 1.00 0.00 H new ATOM 0 HA2 GLY A 36 1.912 3.828 11.717 1.00 0.00 H new ATOM 0 HA3 GLY A 36 2.157 2.099 11.568 1.00 0.00 H new ATOM 552 N TRP A 37 -0.586 2.882 10.118 1.00 0.00 N ATOM 553 CA TRP A 37 -1.337 2.946 8.864 1.00 0.00 C ATOM 554 C TRP A 37 -0.972 4.198 8.060 1.00 0.00 C ATOM 555 O TRP A 37 -1.139 4.241 6.844 1.00 0.00 O ATOM 556 CB TRP A 37 -2.850 2.923 9.150 1.00 0.00 C ATOM 557 CG TRP A 37 -3.433 4.263 9.506 1.00 0.00 C ATOM 558 CD1 TRP A 37 -4.275 5.009 8.731 1.00 0.00 C ATOM 559 CD2 TRP A 37 -3.216 5.025 10.704 1.00 0.00 C ATOM 560 NE1 TRP A 37 -4.600 6.178 9.372 1.00 0.00 N ATOM 561 CE2 TRP A 37 -3.966 6.213 10.584 1.00 0.00 C ATOM 562 CE3 TRP A 37 -2.473 4.819 11.868 1.00 0.00 C ATOM 563 CZ2 TRP A 37 -3.984 7.190 11.574 1.00 0.00 C ATOM 564 CZ3 TRP A 37 -2.491 5.791 12.850 1.00 0.00 C ATOM 565 CH2 TRP A 37 -3.246 6.961 12.699 1.00 0.00 C ATOM 0 H TRP A 37 -1.173 2.816 10.949 1.00 0.00 H new ATOM 0 HA TRP A 37 -1.071 2.073 8.268 1.00 0.00 H new ATOM 0 HB2 TRP A 37 -3.368 2.536 8.272 1.00 0.00 H new ATOM 0 HB3 TRP A 37 -3.043 2.227 9.967 1.00 0.00 H new ATOM 0 HD1 TRP A 37 -4.633 4.720 7.754 1.00 0.00 H new ATOM 0 HE1 TRP A 37 -5.215 6.904 9.004 1.00 0.00 H new ATOM 0 HE3 TRP A 37 -1.895 3.916 11.999 1.00 0.00 H new ATOM 0 HZ2 TRP A 37 -4.560 8.096 11.457 1.00 0.00 H new ATOM 0 HZ3 TRP A 37 -1.912 5.646 13.750 1.00 0.00 H new ATOM 0 HH2 TRP A 37 -3.244 7.697 13.489 1.00 0.00 H new ATOM 576 N ASN A 38 -0.458 5.208 8.745 1.00 0.00 N ATOM 577 CA ASN A 38 -0.051 6.446 8.114 1.00 0.00 C ATOM 578 C ASN A 38 1.218 6.248 7.285 1.00 0.00 C ATOM 579 O ASN A 38 1.543 7.058 6.420 1.00 0.00 O ATOM 580 CB ASN A 38 0.167 7.496 9.199 1.00 0.00 C ATOM 581 CG ASN A 38 1.179 7.058 10.241 1.00 0.00 C ATOM 582 OD1 ASN A 38 0.846 6.335 11.181 1.00 0.00 O ATOM 583 ND2 ASN A 38 2.417 7.503 10.093 1.00 0.00 N ATOM 0 H ASN A 38 -0.313 5.189 9.754 1.00 0.00 H new ATOM 0 HA ASN A 38 -0.832 6.780 7.431 1.00 0.00 H new ATOM 0 HB2 ASN A 38 0.504 8.424 8.738 1.00 0.00 H new ATOM 0 HB3 ASN A 38 -0.783 7.710 9.688 1.00 0.00 H new ATOM 0 HD21 ASN A 38 3.135 7.249 10.772 1.00 0.00 H new ATOM 0 HD22 ASN A 38 2.653 8.100 9.300 1.00 0.00 H new ATOM 590 N ARG A 39 1.917 5.148 7.538 1.00 0.00 N ATOM 591 CA ARG A 39 3.142 4.828 6.816 1.00 0.00 C ATOM 592 C ARG A 39 2.853 3.821 5.699 1.00 0.00 C ATOM 593 O ARG A 39 3.750 3.423 4.957 1.00 0.00 O ATOM 594 CB ARG A 39 4.193 4.276 7.792 1.00 0.00 C ATOM 595 CG ARG A 39 5.533 3.960 7.146 1.00 0.00 C ATOM 596 CD ARG A 39 6.484 3.293 8.125 1.00 0.00 C ATOM 597 NE ARG A 39 7.594 2.635 7.440 1.00 0.00 N ATOM 598 CZ ARG A 39 7.823 1.322 7.501 1.00 0.00 C ATOM 599 NH1 ARG A 39 7.052 0.542 8.252 1.00 0.00 N ATOM 600 NH2 ARG A 39 8.828 0.782 6.827 1.00 0.00 N ATOM 0 H ARG A 39 1.654 4.459 8.242 1.00 0.00 H new ATOM 0 HA ARG A 39 3.535 5.736 6.359 1.00 0.00 H new ATOM 0 HB2 ARG A 39 4.349 5.001 8.590 1.00 0.00 H new ATOM 0 HB3 ARG A 39 3.803 3.370 8.256 1.00 0.00 H new ATOM 0 HG2 ARG A 39 5.378 3.307 6.287 1.00 0.00 H new ATOM 0 HG3 ARG A 39 5.982 4.880 6.771 1.00 0.00 H new ATOM 0 HD2 ARG A 39 6.875 4.039 8.817 1.00 0.00 H new ATOM 0 HD3 ARG A 39 5.938 2.561 8.720 1.00 0.00 H new ATOM 0 HE ARG A 39 8.228 3.210 6.885 1.00 0.00 H new ATOM 0 HH11 ARG A 39 6.282 0.947 8.784 1.00 0.00 H new ATOM 0 HH12 ARG A 39 7.230 -0.461 8.296 1.00 0.00 H new ATOM 0 HH21 ARG A 39 9.434 1.371 6.256 1.00 0.00 H new ATOM 0 HH22 ARG A 39 8.996 -0.223 6.879 1.00 0.00 H new ATOM 614 N ILE A 40 1.582 3.441 5.566 1.00 0.00 N ATOM 615 CA ILE A 40 1.163 2.460 4.559 1.00 0.00 C ATOM 616 C ILE A 40 1.663 2.831 3.161 1.00 0.00 C ATOM 617 O ILE A 40 2.159 1.972 2.433 1.00 0.00 O ATOM 618 CB ILE A 40 -0.379 2.298 4.543 1.00 0.00 C ATOM 619 CG1 ILE A 40 -0.823 1.386 5.692 1.00 0.00 C ATOM 620 CG2 ILE A 40 -0.881 1.760 3.207 1.00 0.00 C ATOM 621 CD1 ILE A 40 -2.322 1.176 5.763 1.00 0.00 C ATOM 0 H ILE A 40 0.821 3.798 6.144 1.00 0.00 H new ATOM 0 HA ILE A 40 1.614 1.508 4.839 1.00 0.00 H new ATOM 0 HB ILE A 40 -0.819 3.286 4.679 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -0.335 0.417 5.584 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -0.480 1.812 6.635 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -1.966 1.662 3.239 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -0.602 2.449 2.410 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -0.434 0.784 3.016 1.00 0.00 H new ATOM 0 HD11 ILE A 40 -2.558 0.520 6.601 1.00 0.00 H new ATOM 0 HD12 ILE A 40 -2.818 2.137 5.903 1.00 0.00 H new ATOM 0 HD13 ILE A 40 -2.670 0.720 4.836 1.00 0.00 H new ATOM 633 N MET A 41 1.557 4.110 2.805 1.00 0.00 N ATOM 634 CA MET A 41 1.975 4.572 1.482 1.00 0.00 C ATOM 635 C MET A 41 3.472 4.367 1.282 1.00 0.00 C ATOM 636 O MET A 41 3.902 3.886 0.237 1.00 0.00 O ATOM 637 CB MET A 41 1.613 6.044 1.275 1.00 0.00 C ATOM 638 CG MET A 41 0.123 6.318 1.377 1.00 0.00 C ATOM 639 SD MET A 41 -0.854 5.342 0.214 1.00 0.00 S ATOM 640 CE MET A 41 -0.353 6.046 -1.354 1.00 0.00 C ATOM 0 H MET A 41 1.187 4.842 3.411 1.00 0.00 H new ATOM 0 HA MET A 41 1.441 3.978 0.741 1.00 0.00 H new ATOM 0 HB2 MET A 41 2.138 6.647 2.016 1.00 0.00 H new ATOM 0 HB3 MET A 41 1.968 6.363 0.295 1.00 0.00 H new ATOM 0 HG2 MET A 41 -0.211 6.105 2.392 1.00 0.00 H new ATOM 0 HG3 MET A 41 -0.059 7.377 1.197 1.00 0.00 H new ATOM 0 HE1 MET A 41 -1.229 6.427 -1.878 1.00 0.00 H new ATOM 0 HE2 MET A 41 0.348 6.862 -1.179 1.00 0.00 H new ATOM 0 HE3 MET A 41 0.128 5.278 -1.961 1.00 0.00 H new ATOM 650 N GLU A 42 4.256 4.711 2.303 1.00 0.00 N ATOM 651 CA GLU A 42 5.708 4.550 2.256 1.00 0.00 C ATOM 652 C GLU A 42 6.071 3.092 2.025 1.00 0.00 C ATOM 653 O GLU A 42 6.856 2.764 1.132 1.00 0.00 O ATOM 654 CB GLU A 42 6.335 5.011 3.573 1.00 0.00 C ATOM 655 CG GLU A 42 7.856 4.999 3.560 1.00 0.00 C ATOM 656 CD GLU A 42 8.457 5.121 4.946 1.00 0.00 C ATOM 657 OE1 GLU A 42 8.389 6.218 5.533 1.00 0.00 O ATOM 658 OE2 GLU A 42 9.016 4.121 5.448 1.00 0.00 O ATOM 0 H GLU A 42 3.907 5.105 3.177 1.00 0.00 H new ATOM 0 HA GLU A 42 6.090 5.157 1.435 1.00 0.00 H new ATOM 0 HB2 GLU A 42 5.990 6.020 3.796 1.00 0.00 H new ATOM 0 HB3 GLU A 42 5.982 4.368 4.379 1.00 0.00 H new ATOM 0 HG2 GLU A 42 8.203 4.075 3.099 1.00 0.00 H new ATOM 0 HG3 GLU A 42 8.216 5.820 2.940 1.00 0.00 H new ATOM 665 N VAL A 43 5.495 2.228 2.846 1.00 0.00 N ATOM 666 CA VAL A 43 5.741 0.797 2.752 1.00 0.00 C ATOM 667 C VAL A 43 5.318 0.265 1.389 1.00 0.00 C ATOM 668 O VAL A 43 6.063 -0.478 0.754 1.00 0.00 O ATOM 669 CB VAL A 43 5.004 0.017 3.861 1.00 0.00 C ATOM 670 CG1 VAL A 43 5.390 -1.450 3.833 1.00 0.00 C ATOM 671 CG2 VAL A 43 5.293 0.620 5.227 1.00 0.00 C ATOM 0 H VAL A 43 4.850 2.495 3.590 1.00 0.00 H new ATOM 0 HA VAL A 43 6.813 0.648 2.881 1.00 0.00 H new ATOM 0 HB VAL A 43 3.933 0.093 3.674 1.00 0.00 H new ATOM 0 HG11 VAL A 43 4.859 -1.981 4.623 1.00 0.00 H new ATOM 0 HG12 VAL A 43 5.124 -1.878 2.866 1.00 0.00 H new ATOM 0 HG13 VAL A 43 6.464 -1.547 3.990 1.00 0.00 H new ATOM 0 HG21 VAL A 43 4.763 0.055 5.994 1.00 0.00 H new ATOM 0 HG22 VAL A 43 6.365 0.581 5.423 1.00 0.00 H new ATOM 0 HG23 VAL A 43 4.958 1.657 5.245 1.00 0.00 H new ATOM 681 N ALA A 44 4.133 0.659 0.938 1.00 0.00 N ATOM 682 CA ALA A 44 3.636 0.248 -0.367 1.00 0.00 C ATOM 683 C ALA A 44 4.598 0.669 -1.469 1.00 0.00 C ATOM 684 O ALA A 44 4.911 -0.115 -2.365 1.00 0.00 O ATOM 685 CB ALA A 44 2.263 0.840 -0.619 1.00 0.00 C ATOM 0 H ALA A 44 3.498 1.264 1.459 1.00 0.00 H new ATOM 0 HA ALA A 44 3.558 -0.839 -0.374 1.00 0.00 H new ATOM 0 HB1 ALA A 44 1.905 0.524 -1.599 1.00 0.00 H new ATOM 0 HB2 ALA A 44 1.571 0.495 0.149 1.00 0.00 H new ATOM 0 HB3 ALA A 44 2.325 1.928 -0.589 1.00 0.00 H new ATOM 691 N GLU A 45 5.064 1.910 -1.385 1.00 0.00 N ATOM 692 CA GLU A 45 6.026 2.443 -2.327 1.00 0.00 C ATOM 693 C GLU A 45 7.310 1.618 -2.330 1.00 0.00 C ATOM 694 O GLU A 45 7.657 1.012 -3.341 1.00 0.00 O ATOM 695 CB GLU A 45 6.327 3.900 -1.985 1.00 0.00 C ATOM 696 CG GLU A 45 5.255 4.872 -2.456 1.00 0.00 C ATOM 697 CD GLU A 45 5.595 6.311 -2.125 1.00 0.00 C ATOM 698 OE1 GLU A 45 6.568 6.844 -2.705 1.00 0.00 O ATOM 699 OE2 GLU A 45 4.897 6.919 -1.287 1.00 0.00 O ATOM 0 H GLU A 45 4.782 2.570 -0.660 1.00 0.00 H new ATOM 0 HA GLU A 45 5.597 2.390 -3.328 1.00 0.00 H new ATOM 0 HB2 GLU A 45 6.442 3.994 -0.905 1.00 0.00 H new ATOM 0 HB3 GLU A 45 7.281 4.180 -2.433 1.00 0.00 H new ATOM 0 HG2 GLU A 45 5.125 4.771 -3.533 1.00 0.00 H new ATOM 0 HG3 GLU A 45 4.303 4.611 -1.994 1.00 0.00 H new ATOM 706 N LYS A 46 7.980 1.566 -1.183 1.00 0.00 N ATOM 707 CA LYS A 46 9.264 0.872 -1.062 1.00 0.00 C ATOM 708 C LYS A 46 9.161 -0.594 -1.469 1.00 0.00 C ATOM 709 O LYS A 46 10.021 -1.106 -2.187 1.00 0.00 O ATOM 710 CB LYS A 46 9.790 0.966 0.367 1.00 0.00 C ATOM 711 CG LYS A 46 10.201 2.369 0.773 1.00 0.00 C ATOM 712 CD LYS A 46 10.673 2.396 2.212 1.00 0.00 C ATOM 713 CE LYS A 46 11.074 3.795 2.652 1.00 0.00 C ATOM 714 NZ LYS A 46 11.500 3.829 4.076 1.00 0.00 N ATOM 0 H LYS A 46 7.655 1.998 -0.318 1.00 0.00 H new ATOM 0 HA LYS A 46 9.958 1.365 -1.742 1.00 0.00 H new ATOM 0 HB2 LYS A 46 9.021 0.609 1.052 1.00 0.00 H new ATOM 0 HB3 LYS A 46 10.646 0.300 0.474 1.00 0.00 H new ATOM 0 HG2 LYS A 46 10.997 2.724 0.118 1.00 0.00 H new ATOM 0 HG3 LYS A 46 9.359 3.050 0.649 1.00 0.00 H new ATOM 0 HD2 LYS A 46 9.880 2.025 2.861 1.00 0.00 H new ATOM 0 HD3 LYS A 46 11.522 1.722 2.328 1.00 0.00 H new ATOM 0 HE2 LYS A 46 11.887 4.154 2.021 1.00 0.00 H new ATOM 0 HE3 LYS A 46 10.234 4.475 2.508 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 12.099 4.663 4.239 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 10.661 3.880 4.688 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 12.038 2.967 4.298 1.00 0.00 H new ATOM 728 N THR A 47 8.111 -1.263 -1.011 1.00 0.00 N ATOM 729 CA THR A 47 7.919 -2.675 -1.309 1.00 0.00 C ATOM 730 C THR A 47 7.720 -2.896 -2.808 1.00 0.00 C ATOM 731 O THR A 47 8.351 -3.774 -3.404 1.00 0.00 O ATOM 732 CB THR A 47 6.716 -3.258 -0.533 1.00 0.00 C ATOM 733 OG1 THR A 47 6.875 -3.003 0.870 1.00 0.00 O ATOM 734 CG2 THR A 47 6.592 -4.758 -0.760 1.00 0.00 C ATOM 0 H THR A 47 7.380 -0.850 -0.432 1.00 0.00 H new ATOM 0 HA THR A 47 8.822 -3.196 -0.990 1.00 0.00 H new ATOM 0 HB THR A 47 5.810 -2.775 -0.899 1.00 0.00 H new ATOM 0 HG1 THR A 47 6.501 -2.123 1.087 1.00 0.00 H new ATOM 0 HG21 THR A 47 5.737 -5.141 -0.202 1.00 0.00 H new ATOM 0 HG22 THR A 47 6.449 -4.955 -1.823 1.00 0.00 H new ATOM 0 HG23 THR A 47 7.500 -5.254 -0.418 1.00 0.00 H new ATOM 742 N TYR A 48 6.858 -2.082 -3.417 1.00 0.00 N ATOM 743 CA TYR A 48 6.607 -2.173 -4.848 1.00 0.00 C ATOM 744 C TYR A 48 7.884 -1.867 -5.623 1.00 0.00 C ATOM 745 O TYR A 48 8.253 -2.600 -6.541 1.00 0.00 O ATOM 746 CB TYR A 48 5.488 -1.214 -5.279 1.00 0.00 C ATOM 747 CG TYR A 48 5.333 -1.112 -6.782 1.00 0.00 C ATOM 748 CD1 TYR A 48 4.615 -2.060 -7.500 1.00 0.00 C ATOM 749 CD2 TYR A 48 5.919 -0.069 -7.483 1.00 0.00 C ATOM 750 CE1 TYR A 48 4.487 -1.968 -8.875 1.00 0.00 C ATOM 751 CE2 TYR A 48 5.797 0.031 -8.854 1.00 0.00 C ATOM 752 CZ TYR A 48 5.080 -0.920 -9.548 1.00 0.00 C ATOM 753 OH TYR A 48 4.962 -0.821 -10.919 1.00 0.00 O ATOM 0 H TYR A 48 6.325 -1.355 -2.940 1.00 0.00 H new ATOM 0 HA TYR A 48 6.285 -3.190 -5.070 1.00 0.00 H new ATOM 0 HB2 TYR A 48 4.545 -1.548 -4.845 1.00 0.00 H new ATOM 0 HB3 TYR A 48 5.692 -0.223 -4.874 1.00 0.00 H new ATOM 0 HD1 TYR A 48 4.149 -2.882 -6.977 1.00 0.00 H new ATOM 0 HD2 TYR A 48 6.482 0.680 -6.946 1.00 0.00 H new ATOM 0 HE1 TYR A 48 3.925 -2.713 -9.419 1.00 0.00 H new ATOM 0 HE2 TYR A 48 6.262 0.851 -9.381 1.00 0.00 H new ATOM 0 HH TYR A 48 5.438 -0.024 -11.232 1.00 0.00 H new ATOM 763 N GLU A 49 8.556 -0.788 -5.234 1.00 0.00 N ATOM 764 CA GLU A 49 9.779 -0.356 -5.887 1.00 0.00 C ATOM 765 C GLU A 49 10.845 -1.440 -5.833 1.00 0.00 C ATOM 766 O GLU A 49 11.538 -1.685 -6.821 1.00 0.00 O ATOM 767 CB GLU A 49 10.291 0.924 -5.233 1.00 0.00 C ATOM 768 CG GLU A 49 9.429 2.140 -5.529 1.00 0.00 C ATOM 769 CD GLU A 49 10.019 3.416 -4.976 1.00 0.00 C ATOM 770 OE1 GLU A 49 9.741 3.755 -3.808 1.00 0.00 O ATOM 771 OE2 GLU A 49 10.775 4.088 -5.708 1.00 0.00 O ATOM 0 H GLU A 49 8.266 -0.192 -4.459 1.00 0.00 H new ATOM 0 HA GLU A 49 9.556 -0.160 -6.936 1.00 0.00 H new ATOM 0 HB2 GLU A 49 10.341 0.777 -4.154 1.00 0.00 H new ATOM 0 HB3 GLU A 49 11.308 1.117 -5.576 1.00 0.00 H new ATOM 0 HG2 GLU A 49 9.304 2.239 -6.607 1.00 0.00 H new ATOM 0 HG3 GLU A 49 8.436 1.989 -5.105 1.00 0.00 H new ATOM 778 N ALA A 50 10.963 -2.097 -4.683 1.00 0.00 N ATOM 779 CA ALA A 50 11.942 -3.162 -4.509 1.00 0.00 C ATOM 780 C ALA A 50 11.670 -4.313 -5.464 1.00 0.00 C ATOM 781 O ALA A 50 12.531 -4.680 -6.259 1.00 0.00 O ATOM 782 CB ALA A 50 11.946 -3.660 -3.070 1.00 0.00 C ATOM 0 H ALA A 50 10.392 -1.910 -3.859 1.00 0.00 H new ATOM 0 HA ALA A 50 12.926 -2.752 -4.738 1.00 0.00 H new ATOM 0 HB1 ALA A 50 12.684 -4.455 -2.962 1.00 0.00 H new ATOM 0 HB2 ALA A 50 12.198 -2.837 -2.401 1.00 0.00 H new ATOM 0 HB3 ALA A 50 10.958 -4.045 -2.815 1.00 0.00 H new ATOM 788 N TYR A 51 10.462 -4.860 -5.414 1.00 0.00 N ATOM 789 CA TYR A 51 10.112 -5.990 -6.260 1.00 0.00 C ATOM 790 C TYR A 51 10.127 -5.600 -7.735 1.00 0.00 C ATOM 791 O TYR A 51 10.389 -6.434 -8.601 1.00 0.00 O ATOM 792 CB TYR A 51 8.751 -6.553 -5.862 1.00 0.00 C ATOM 793 CG TYR A 51 8.783 -7.306 -4.551 1.00 0.00 C ATOM 794 CD1 TYR A 51 9.634 -8.390 -4.381 1.00 0.00 C ATOM 795 CD2 TYR A 51 7.972 -6.938 -3.486 1.00 0.00 C ATOM 796 CE1 TYR A 51 9.678 -9.083 -3.188 1.00 0.00 C ATOM 797 CE2 TYR A 51 8.009 -7.630 -2.289 1.00 0.00 C ATOM 798 CZ TYR A 51 8.866 -8.699 -2.146 1.00 0.00 C ATOM 799 OH TYR A 51 8.909 -9.389 -0.957 1.00 0.00 O ATOM 0 H TYR A 51 9.713 -4.541 -4.800 1.00 0.00 H new ATOM 0 HA TYR A 51 10.863 -6.767 -6.115 1.00 0.00 H new ATOM 0 HB2 TYR A 51 8.034 -5.736 -5.788 1.00 0.00 H new ATOM 0 HB3 TYR A 51 8.395 -7.219 -6.648 1.00 0.00 H new ATOM 0 HD1 TYR A 51 10.273 -8.696 -5.196 1.00 0.00 H new ATOM 0 HD2 TYR A 51 7.302 -6.098 -3.594 1.00 0.00 H new ATOM 0 HE1 TYR A 51 10.347 -9.923 -3.073 1.00 0.00 H new ATOM 0 HE2 TYR A 51 7.369 -7.334 -1.471 1.00 0.00 H new ATOM 0 HH TYR A 51 9.838 -9.619 -0.746 1.00 0.00 H new ATOM 809 N ARG A 52 9.852 -4.333 -8.019 1.00 0.00 N ATOM 810 CA ARG A 52 9.950 -3.826 -9.380 1.00 0.00 C ATOM 811 C ARG A 52 11.405 -3.794 -9.830 1.00 0.00 C ATOM 812 O ARG A 52 11.736 -4.261 -10.914 1.00 0.00 O ATOM 813 CB ARG A 52 9.347 -2.424 -9.490 1.00 0.00 C ATOM 814 CG ARG A 52 9.542 -1.795 -10.859 1.00 0.00 C ATOM 815 CD ARG A 52 8.837 -2.595 -11.939 1.00 0.00 C ATOM 816 NE ARG A 52 9.257 -2.193 -13.279 1.00 0.00 N ATOM 817 CZ ARG A 52 8.569 -1.380 -14.076 1.00 0.00 C ATOM 818 NH1 ARG A 52 7.401 -0.876 -13.691 1.00 0.00 N ATOM 819 NH2 ARG A 52 9.058 -1.074 -15.267 1.00 0.00 N ATOM 0 H ARG A 52 9.561 -3.641 -7.328 1.00 0.00 H new ATOM 0 HA ARG A 52 9.387 -4.498 -10.028 1.00 0.00 H new ATOM 0 HB2 ARG A 52 8.281 -2.476 -9.269 1.00 0.00 H new ATOM 0 HB3 ARG A 52 9.798 -1.781 -8.734 1.00 0.00 H new ATOM 0 HG2 ARG A 52 9.159 -0.775 -10.851 1.00 0.00 H new ATOM 0 HG3 ARG A 52 10.607 -1.734 -11.085 1.00 0.00 H new ATOM 0 HD2 ARG A 52 9.043 -3.656 -11.797 1.00 0.00 H new ATOM 0 HD3 ARG A 52 7.759 -2.464 -11.842 1.00 0.00 H new ATOM 0 HE ARG A 52 10.141 -2.562 -13.629 1.00 0.00 H new ATOM 0 HH11 ARG A 52 7.021 -1.111 -12.774 1.00 0.00 H new ATOM 0 HH12 ARG A 52 6.884 -0.254 -14.313 1.00 0.00 H new ATOM 0 HH21 ARG A 52 9.954 -1.461 -15.565 1.00 0.00 H new ATOM 0 HH22 ARG A 52 8.539 -0.452 -15.887 1.00 0.00 H new ATOM 833 N GLN A 53 12.264 -3.237 -8.989 1.00 0.00 N ATOM 834 CA GLN A 53 13.691 -3.137 -9.291 1.00 0.00 C ATOM 835 C GLN A 53 14.304 -4.529 -9.463 1.00 0.00 C ATOM 836 O GLN A 53 15.180 -4.728 -10.303 1.00 0.00 O ATOM 837 CB GLN A 53 14.408 -2.361 -8.185 1.00 0.00 C ATOM 838 CG GLN A 53 15.772 -1.829 -8.589 1.00 0.00 C ATOM 839 CD GLN A 53 16.403 -0.956 -7.519 1.00 0.00 C ATOM 840 OE1 GLN A 53 17.152 -1.434 -6.669 1.00 0.00 O ATOM 841 NE2 GLN A 53 16.090 0.330 -7.539 1.00 0.00 N ATOM 0 H GLN A 53 11.999 -2.844 -8.086 1.00 0.00 H new ATOM 0 HA GLN A 53 13.814 -2.597 -10.230 1.00 0.00 H new ATOM 0 HB2 GLN A 53 13.780 -1.525 -7.876 1.00 0.00 H new ATOM 0 HB3 GLN A 53 14.525 -3.010 -7.317 1.00 0.00 H new ATOM 0 HG2 GLN A 53 16.435 -2.667 -8.805 1.00 0.00 H new ATOM 0 HG3 GLN A 53 15.675 -1.254 -9.510 1.00 0.00 H new ATOM 0 HE21 GLN A 53 15.465 0.692 -8.260 1.00 0.00 H new ATOM 0 HE22 GLN A 53 16.474 0.959 -6.834 1.00 0.00 H new ATOM 850 N LEU A 54 13.829 -5.489 -8.669 1.00 0.00 N ATOM 851 CA LEU A 54 14.220 -6.887 -8.837 1.00 0.00 C ATOM 852 C LEU A 54 13.857 -7.378 -10.236 1.00 0.00 C ATOM 853 O LEU A 54 14.649 -8.052 -10.899 1.00 0.00 O ATOM 854 CB LEU A 54 13.529 -7.782 -7.802 1.00 0.00 C ATOM 855 CG LEU A 54 14.340 -8.105 -6.545 1.00 0.00 C ATOM 856 CD1 LEU A 54 14.440 -6.896 -5.635 1.00 0.00 C ATOM 857 CD2 LEU A 54 13.719 -9.280 -5.805 1.00 0.00 C ATOM 0 H LEU A 54 13.174 -5.324 -7.905 1.00 0.00 H new ATOM 0 HA LEU A 54 15.299 -6.945 -8.694 1.00 0.00 H new ATOM 0 HB2 LEU A 54 12.600 -7.300 -7.497 1.00 0.00 H new ATOM 0 HB3 LEU A 54 13.257 -8.720 -8.286 1.00 0.00 H new ATOM 0 HG LEU A 54 15.350 -8.378 -6.852 1.00 0.00 H new ATOM 0 HD11 LEU A 54 15.021 -7.154 -4.750 1.00 0.00 H new ATOM 0 HD12 LEU A 54 14.930 -6.080 -6.166 1.00 0.00 H new ATOM 0 HD13 LEU A 54 13.440 -6.584 -5.334 1.00 0.00 H new ATOM 0 HD21 LEU A 54 14.306 -9.499 -4.913 1.00 0.00 H new ATOM 0 HD22 LEU A 54 12.698 -9.029 -5.516 1.00 0.00 H new ATOM 0 HD23 LEU A 54 13.707 -10.155 -6.456 1.00 0.00 H new ATOM 869 N ASP A 55 12.658 -7.029 -10.682 1.00 0.00 N ATOM 870 CA ASP A 55 12.167 -7.459 -11.986 1.00 0.00 C ATOM 871 C ASP A 55 12.896 -6.716 -13.101 1.00 0.00 C ATOM 872 O ASP A 55 13.224 -7.297 -14.134 1.00 0.00 O ATOM 873 CB ASP A 55 10.658 -7.234 -12.083 1.00 0.00 C ATOM 874 CG ASP A 55 10.054 -7.898 -13.301 1.00 0.00 C ATOM 875 OD1 ASP A 55 10.108 -9.144 -13.390 1.00 0.00 O ATOM 876 OD2 ASP A 55 9.519 -7.184 -14.167 1.00 0.00 O ATOM 0 H ASP A 55 12.004 -6.447 -10.158 1.00 0.00 H new ATOM 0 HA ASP A 55 12.365 -8.525 -12.100 1.00 0.00 H new ATOM 0 HB2 ASP A 55 10.177 -7.622 -11.185 1.00 0.00 H new ATOM 0 HB3 ASP A 55 10.454 -6.164 -12.117 1.00 0.00 H new ATOM 881 N GLU A 56 13.165 -5.434 -12.868 1.00 0.00 N ATOM 882 CA GLU A 56 13.974 -4.624 -13.777 1.00 0.00 C ATOM 883 C GLU A 56 15.344 -5.260 -13.975 1.00 0.00 C ATOM 884 O GLU A 56 15.882 -5.288 -15.086 1.00 0.00 O ATOM 885 CB GLU A 56 14.134 -3.208 -13.217 1.00 0.00 C ATOM 886 CG GLU A 56 12.855 -2.384 -13.234 1.00 0.00 C ATOM 887 CD GLU A 56 12.419 -2.000 -14.632 1.00 0.00 C ATOM 888 OE1 GLU A 56 13.045 -1.093 -15.225 1.00 0.00 O ATOM 889 OE2 GLU A 56 11.438 -2.582 -15.136 1.00 0.00 O ATOM 0 H GLU A 56 12.830 -4.928 -12.048 1.00 0.00 H new ATOM 0 HA GLU A 56 13.468 -4.571 -14.741 1.00 0.00 H new ATOM 0 HB2 GLU A 56 14.497 -3.274 -12.191 1.00 0.00 H new ATOM 0 HB3 GLU A 56 14.898 -2.685 -13.793 1.00 0.00 H new ATOM 0 HG2 GLU A 56 12.058 -2.951 -12.753 1.00 0.00 H new ATOM 0 HG3 GLU A 56 13.004 -1.480 -12.644 1.00 0.00 H new ATOM 896 N PHE A 57 15.903 -5.774 -12.884 1.00 0.00 N ATOM 897 CA PHE A 57 17.160 -6.500 -12.933 1.00 0.00 C ATOM 898 C PHE A 57 17.018 -7.734 -13.814 1.00 0.00 C ATOM 899 O PHE A 57 17.881 -8.017 -14.644 1.00 0.00 O ATOM 900 CB PHE A 57 17.595 -6.899 -11.517 1.00 0.00 C ATOM 901 CG PHE A 57 18.847 -7.728 -11.472 1.00 0.00 C ATOM 902 CD1 PHE A 57 20.090 -7.137 -11.627 1.00 0.00 C ATOM 903 CD2 PHE A 57 18.781 -9.099 -11.277 1.00 0.00 C ATOM 904 CE1 PHE A 57 21.243 -7.897 -11.587 1.00 0.00 C ATOM 905 CE2 PHE A 57 19.930 -9.863 -11.236 1.00 0.00 C ATOM 906 CZ PHE A 57 21.162 -9.262 -11.391 1.00 0.00 C ATOM 0 H PHE A 57 15.499 -5.698 -11.950 1.00 0.00 H new ATOM 0 HA PHE A 57 17.925 -5.853 -13.362 1.00 0.00 H new ATOM 0 HB2 PHE A 57 17.749 -5.995 -10.927 1.00 0.00 H new ATOM 0 HB3 PHE A 57 16.786 -7.455 -11.043 1.00 0.00 H new ATOM 0 HD1 PHE A 57 20.159 -6.070 -11.781 1.00 0.00 H new ATOM 0 HD2 PHE A 57 17.819 -9.575 -11.156 1.00 0.00 H new ATOM 0 HE1 PHE A 57 22.206 -7.425 -11.709 1.00 0.00 H new ATOM 0 HE2 PHE A 57 19.864 -10.930 -11.083 1.00 0.00 H new ATOM 0 HZ PHE A 57 22.062 -9.858 -11.359 1.00 0.00 H new ATOM 916 N ARG A 58 15.909 -8.450 -13.641 1.00 0.00 N ATOM 917 CA ARG A 58 15.627 -9.646 -14.416 1.00 0.00 C ATOM 918 C ARG A 58 15.547 -9.334 -15.909 1.00 0.00 C ATOM 919 O ARG A 58 16.107 -10.066 -16.725 1.00 0.00 O ATOM 920 CB ARG A 58 14.321 -10.275 -13.936 1.00 0.00 C ATOM 921 CG ARG A 58 14.405 -10.917 -12.556 1.00 0.00 C ATOM 922 CD ARG A 58 14.974 -12.330 -12.606 1.00 0.00 C ATOM 923 NE ARG A 58 16.386 -12.375 -12.996 1.00 0.00 N ATOM 924 CZ ARG A 58 17.271 -13.230 -12.476 1.00 0.00 C ATOM 925 NH1 ARG A 58 16.888 -14.107 -11.555 1.00 0.00 N ATOM 926 NH2 ARG A 58 18.531 -13.229 -12.898 1.00 0.00 N ATOM 0 H ARG A 58 15.186 -8.215 -12.961 1.00 0.00 H new ATOM 0 HA ARG A 58 16.445 -10.351 -14.267 1.00 0.00 H new ATOM 0 HB2 ARG A 58 13.546 -9.509 -13.921 1.00 0.00 H new ATOM 0 HB3 ARG A 58 14.008 -11.030 -14.657 1.00 0.00 H new ATOM 0 HG2 ARG A 58 15.028 -10.300 -11.909 1.00 0.00 H new ATOM 0 HG3 ARG A 58 13.411 -10.944 -12.110 1.00 0.00 H new ATOM 0 HD2 ARG A 58 14.860 -12.794 -11.626 1.00 0.00 H new ATOM 0 HD3 ARG A 58 14.391 -12.924 -13.310 1.00 0.00 H new ATOM 0 HE ARG A 58 16.711 -11.717 -13.704 1.00 0.00 H new ATOM 0 HH11 ARG A 58 15.917 -14.128 -11.244 1.00 0.00 H new ATOM 0 HH12 ARG A 58 17.565 -14.759 -11.159 1.00 0.00 H new ATOM 0 HH21 ARG A 58 18.826 -12.574 -13.622 1.00 0.00 H new ATOM 0 HH22 ARG A 58 19.203 -13.884 -12.498 1.00 0.00 H new ATOM 940 N LYS A 59 14.863 -8.243 -16.257 1.00 0.00 N ATOM 941 CA LYS A 59 14.755 -7.817 -17.654 1.00 0.00 C ATOM 942 C LYS A 59 16.146 -7.599 -18.236 1.00 0.00 C ATOM 943 O LYS A 59 16.464 -8.066 -19.333 1.00 0.00 O ATOM 944 CB LYS A 59 13.970 -6.502 -17.781 1.00 0.00 C ATOM 945 CG LYS A 59 12.646 -6.449 -17.031 1.00 0.00 C ATOM 946 CD LYS A 59 11.630 -7.452 -17.550 1.00 0.00 C ATOM 947 CE LYS A 59 10.244 -7.129 -17.013 1.00 0.00 C ATOM 948 NZ LYS A 59 9.249 -8.193 -17.314 1.00 0.00 N ATOM 0 H LYS A 59 14.377 -7.640 -15.594 1.00 0.00 H new ATOM 0 HA LYS A 59 14.227 -8.602 -18.196 1.00 0.00 H new ATOM 0 HB2 LYS A 59 14.601 -5.688 -17.425 1.00 0.00 H new ATOM 0 HB3 LYS A 59 13.776 -6.317 -18.837 1.00 0.00 H new ATOM 0 HG2 LYS A 59 12.826 -6.637 -15.973 1.00 0.00 H new ATOM 0 HG3 LYS A 59 12.230 -5.445 -17.110 1.00 0.00 H new ATOM 0 HD2 LYS A 59 11.618 -7.436 -18.640 1.00 0.00 H new ATOM 0 HD3 LYS A 59 11.918 -8.459 -17.249 1.00 0.00 H new ATOM 0 HE2 LYS A 59 10.301 -6.986 -15.934 1.00 0.00 H new ATOM 0 HE3 LYS A 59 9.903 -6.187 -17.442 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 8.323 -7.922 -16.926 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 9.171 -8.314 -18.344 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 9.557 -9.088 -16.883 1.00 0.00 H new ATOM 962 N SER A 60 16.970 -6.897 -17.472 1.00 0.00 N ATOM 963 CA SER A 60 18.313 -6.540 -17.904 1.00 0.00 C ATOM 964 C SER A 60 19.200 -7.773 -18.067 1.00 0.00 C ATOM 965 O SER A 60 19.769 -8.001 -19.134 1.00 0.00 O ATOM 966 CB SER A 60 18.936 -5.568 -16.899 1.00 0.00 C ATOM 967 OG SER A 60 18.066 -4.475 -16.645 1.00 0.00 O ATOM 0 H SER A 60 16.728 -6.560 -16.540 1.00 0.00 H new ATOM 0 HA SER A 60 18.238 -6.059 -18.879 1.00 0.00 H new ATOM 0 HB2 SER A 60 19.151 -6.091 -15.967 1.00 0.00 H new ATOM 0 HB3 SER A 60 19.886 -5.199 -17.285 1.00 0.00 H new ATOM 0 HG SER A 60 17.344 -4.764 -16.049 1.00 0.00 H new ATOM 973 N THR A 61 19.297 -8.571 -17.016 1.00 0.00 N ATOM 974 CA THR A 61 20.203 -9.718 -17.010 1.00 0.00 C ATOM 975 C THR A 61 19.835 -10.738 -18.091 1.00 0.00 C ATOM 976 O THR A 61 20.716 -11.273 -18.756 1.00 0.00 O ATOM 977 CB THR A 61 20.255 -10.405 -15.622 1.00 0.00 C ATOM 978 OG1 THR A 61 21.130 -11.541 -15.649 1.00 0.00 O ATOM 979 CG2 THR A 61 18.877 -10.854 -15.169 1.00 0.00 C ATOM 0 H THR A 61 18.763 -8.450 -16.156 1.00 0.00 H new ATOM 0 HA THR A 61 21.196 -9.328 -17.233 1.00 0.00 H new ATOM 0 HB THR A 61 20.634 -9.666 -14.916 1.00 0.00 H new ATOM 0 HG1 THR A 61 21.150 -11.960 -14.763 1.00 0.00 H new ATOM 0 HG21 THR A 61 18.953 -11.331 -14.192 1.00 0.00 H new ATOM 0 HG22 THR A 61 18.217 -9.989 -15.100 1.00 0.00 H new ATOM 0 HG23 THR A 61 18.471 -11.564 -15.889 1.00 0.00 H new ATOM 1204 N ALA B 5 -29.039 13.791 10.193 1.00 0.00 N ATOM 1205 CA ALA B 5 -28.215 12.631 10.505 1.00 0.00 C ATOM 1206 C ALA B 5 -28.262 11.610 9.378 1.00 0.00 C ATOM 1207 O ALA B 5 -27.409 10.737 9.293 1.00 0.00 O ATOM 1208 CB ALA B 5 -28.669 12.001 11.814 1.00 0.00 C ATOM 0 HA ALA B 5 -27.183 12.964 10.614 1.00 0.00 H new ATOM 0 HB1 ALA B 5 -28.046 11.135 12.036 1.00 0.00 H new ATOM 0 HB2 ALA B 5 -28.578 12.730 12.619 1.00 0.00 H new ATOM 0 HB3 ALA B 5 -29.709 11.686 11.725 1.00 0.00 H new ATOM 1214 N GLU B 6 -29.262 11.733 8.519 1.00 0.00 N ATOM 1215 CA GLU B 6 -29.472 10.779 7.438 1.00 0.00 C ATOM 1216 C GLU B 6 -28.276 10.730 6.488 1.00 0.00 C ATOM 1217 O GLU B 6 -27.730 9.659 6.222 1.00 0.00 O ATOM 1218 CB GLU B 6 -30.738 11.130 6.658 1.00 0.00 C ATOM 1219 CG GLU B 6 -31.948 11.371 7.541 1.00 0.00 C ATOM 1220 CD GLU B 6 -32.195 10.238 8.512 1.00 0.00 C ATOM 1221 OE1 GLU B 6 -32.591 9.144 8.070 1.00 0.00 O ATOM 1222 OE2 GLU B 6 -31.979 10.434 9.728 1.00 0.00 O ATOM 0 H GLU B 6 -29.946 12.489 8.549 1.00 0.00 H new ATOM 0 HA GLU B 6 -29.586 9.793 7.889 1.00 0.00 H new ATOM 0 HB2 GLU B 6 -30.551 12.022 6.061 1.00 0.00 H new ATOM 0 HB3 GLU B 6 -30.962 10.322 5.962 1.00 0.00 H new ATOM 0 HG2 GLU B 6 -31.808 12.298 8.098 1.00 0.00 H new ATOM 0 HG3 GLU B 6 -32.829 11.506 6.914 1.00 0.00 H new ATOM 1229 N GLU B 7 -27.873 11.889 5.973 1.00 0.00 N ATOM 1230 CA GLU B 7 -26.730 11.964 5.078 1.00 0.00 C ATOM 1231 C GLU B 7 -25.442 11.657 5.823 1.00 0.00 C ATOM 1232 O GLU B 7 -24.520 11.060 5.268 1.00 0.00 O ATOM 1233 CB GLU B 7 -26.637 13.346 4.428 1.00 0.00 C ATOM 1234 CG GLU B 7 -27.211 13.408 3.020 1.00 0.00 C ATOM 1235 CD GLU B 7 -28.719 13.514 2.996 1.00 0.00 C ATOM 1236 OE1 GLU B 7 -29.399 12.615 3.527 1.00 0.00 O ATOM 1237 OE2 GLU B 7 -29.234 14.512 2.448 1.00 0.00 O ATOM 0 H GLU B 7 -28.322 12.785 6.162 1.00 0.00 H new ATOM 0 HA GLU B 7 -26.870 11.218 4.296 1.00 0.00 H new ATOM 0 HB2 GLU B 7 -27.161 14.067 5.055 1.00 0.00 H new ATOM 0 HB3 GLU B 7 -25.591 13.652 4.397 1.00 0.00 H new ATOM 0 HG2 GLU B 7 -26.785 14.265 2.498 1.00 0.00 H new ATOM 0 HG3 GLU B 7 -26.907 12.517 2.471 1.00 0.00 H new ATOM 1244 N LEU B 8 -25.394 12.052 7.088 1.00 0.00 N ATOM 1245 CA LEU B 8 -24.235 11.819 7.927 1.00 0.00 C ATOM 1246 C LEU B 8 -24.038 10.324 8.156 1.00 0.00 C ATOM 1247 O LEU B 8 -22.930 9.800 8.036 1.00 0.00 O ATOM 1248 CB LEU B 8 -24.421 12.553 9.256 1.00 0.00 C ATOM 1249 CG LEU B 8 -23.847 13.971 9.313 1.00 0.00 C ATOM 1250 CD1 LEU B 8 -24.492 14.867 8.268 1.00 0.00 C ATOM 1251 CD2 LEU B 8 -24.030 14.554 10.704 1.00 0.00 C ATOM 0 H LEU B 8 -26.157 12.541 7.557 1.00 0.00 H new ATOM 0 HA LEU B 8 -23.343 12.202 7.431 1.00 0.00 H new ATOM 0 HB2 LEU B 8 -25.487 12.602 9.477 1.00 0.00 H new ATOM 0 HB3 LEU B 8 -23.959 11.961 10.046 1.00 0.00 H new ATOM 0 HG LEU B 8 -22.781 13.917 9.092 1.00 0.00 H new ATOM 0 HD11 LEU B 8 -24.064 15.868 8.333 1.00 0.00 H new ATOM 0 HD12 LEU B 8 -24.309 14.458 7.275 1.00 0.00 H new ATOM 0 HD13 LEU B 8 -25.566 14.919 8.446 1.00 0.00 H new ATOM 0 HD21 LEU B 8 -23.618 15.563 10.733 1.00 0.00 H new ATOM 0 HD22 LEU B 8 -25.092 14.589 10.947 1.00 0.00 H new ATOM 0 HD23 LEU B 8 -23.511 13.929 11.431 1.00 0.00 H new ATOM 1263 N LYS B 9 -25.138 9.649 8.458 1.00 0.00 N ATOM 1264 CA LYS B 9 -25.135 8.215 8.691 1.00 0.00 C ATOM 1265 C LYS B 9 -24.741 7.472 7.423 1.00 0.00 C ATOM 1266 O LYS B 9 -23.826 6.658 7.442 1.00 0.00 O ATOM 1267 CB LYS B 9 -26.529 7.763 9.136 1.00 0.00 C ATOM 1268 CG LYS B 9 -26.578 6.359 9.714 1.00 0.00 C ATOM 1269 CD LYS B 9 -26.152 6.345 11.171 1.00 0.00 C ATOM 1270 CE LYS B 9 -26.390 4.985 11.806 1.00 0.00 C ATOM 1271 NZ LYS B 9 -26.200 5.017 13.281 1.00 0.00 N ATOM 0 H LYS B 9 -26.057 10.082 8.548 1.00 0.00 H new ATOM 0 HA LYS B 9 -24.409 7.989 9.472 1.00 0.00 H new ATOM 0 HB2 LYS B 9 -26.904 8.463 9.882 1.00 0.00 H new ATOM 0 HB3 LYS B 9 -27.205 7.815 8.282 1.00 0.00 H new ATOM 0 HG2 LYS B 9 -27.589 5.962 9.625 1.00 0.00 H new ATOM 0 HG3 LYS B 9 -25.927 5.703 9.136 1.00 0.00 H new ATOM 0 HD2 LYS B 9 -25.096 6.603 11.245 1.00 0.00 H new ATOM 0 HD3 LYS B 9 -26.705 7.107 11.721 1.00 0.00 H new ATOM 0 HE2 LYS B 9 -27.402 4.651 11.578 1.00 0.00 H new ATOM 0 HE3 LYS B 9 -25.708 4.256 11.368 1.00 0.00 H new ATOM 0 HZ1 LYS B 9 -26.372 4.070 13.674 1.00 0.00 H new ATOM 0 HZ2 LYS B 9 -25.227 5.311 13.499 1.00 0.00 H new ATOM 0 HZ3 LYS B 9 -26.868 5.693 13.703 1.00 0.00 H new ATOM 1285 N ALA B 10 -25.431 7.774 6.326 1.00 0.00 N ATOM 1286 CA ALA B 10 -25.184 7.109 5.050 1.00 0.00 C ATOM 1287 C ALA B 10 -23.728 7.271 4.618 1.00 0.00 C ATOM 1288 O ALA B 10 -23.107 6.327 4.127 1.00 0.00 O ATOM 1289 CB ALA B 10 -26.121 7.657 3.980 1.00 0.00 C ATOM 0 H ALA B 10 -26.168 8.478 6.296 1.00 0.00 H new ATOM 0 HA ALA B 10 -25.380 6.044 5.178 1.00 0.00 H new ATOM 0 HB1 ALA B 10 -25.927 7.153 3.033 1.00 0.00 H new ATOM 0 HB2 ALA B 10 -27.155 7.483 4.278 1.00 0.00 H new ATOM 0 HB3 ALA B 10 -25.952 8.727 3.862 1.00 0.00 H new ATOM 1295 N LYS B 11 -23.186 8.466 4.827 1.00 0.00 N ATOM 1296 CA LYS B 11 -21.812 8.761 4.448 1.00 0.00 C ATOM 1297 C LYS B 11 -20.838 7.958 5.304 1.00 0.00 C ATOM 1298 O LYS B 11 -19.969 7.258 4.780 1.00 0.00 O ATOM 1299 CB LYS B 11 -21.533 10.258 4.608 1.00 0.00 C ATOM 1300 CG LYS B 11 -20.204 10.713 4.027 1.00 0.00 C ATOM 1301 CD LYS B 11 -20.229 10.729 2.506 1.00 0.00 C ATOM 1302 CE LYS B 11 -18.948 11.326 1.944 1.00 0.00 C ATOM 1303 NZ LYS B 11 -18.993 11.489 0.466 1.00 0.00 N ATOM 0 H LYS B 11 -23.680 9.247 5.258 1.00 0.00 H new ATOM 0 HA LYS B 11 -21.673 8.481 3.404 1.00 0.00 H new ATOM 0 HB2 LYS B 11 -22.336 10.818 4.129 1.00 0.00 H new ATOM 0 HB3 LYS B 11 -21.557 10.509 5.668 1.00 0.00 H new ATOM 0 HG2 LYS B 11 -19.968 11.711 4.397 1.00 0.00 H new ATOM 0 HG3 LYS B 11 -19.411 10.049 4.371 1.00 0.00 H new ATOM 0 HD2 LYS B 11 -20.356 9.714 2.131 1.00 0.00 H new ATOM 0 HD3 LYS B 11 -21.086 11.307 2.159 1.00 0.00 H new ATOM 0 HE2 LYS B 11 -18.770 12.296 2.408 1.00 0.00 H new ATOM 0 HE3 LYS B 11 -18.106 10.686 2.210 1.00 0.00 H new ATOM 0 HZ1 LYS B 11 -18.097 11.899 0.135 1.00 0.00 H new ATOM 0 HZ2 LYS B 11 -19.136 10.561 0.019 1.00 0.00 H new ATOM 0 HZ3 LYS B 11 -19.778 12.121 0.210 1.00 0.00 H new ATOM 1317 N LEU B 12 -20.997 8.053 6.620 1.00 0.00 N ATOM 1318 CA LEU B 12 -20.121 7.351 7.551 1.00 0.00 C ATOM 1319 C LEU B 12 -20.250 5.842 7.370 1.00 0.00 C ATOM 1320 O LEU B 12 -19.265 5.109 7.438 1.00 0.00 O ATOM 1321 CB LEU B 12 -20.461 7.733 8.994 1.00 0.00 C ATOM 1322 CG LEU B 12 -19.539 7.143 10.065 1.00 0.00 C ATOM 1323 CD1 LEU B 12 -18.105 7.607 9.852 1.00 0.00 C ATOM 1324 CD2 LEU B 12 -20.026 7.534 11.451 1.00 0.00 C ATOM 0 H LEU B 12 -21.726 8.610 7.066 1.00 0.00 H new ATOM 0 HA LEU B 12 -19.092 7.644 7.341 1.00 0.00 H new ATOM 0 HB2 LEU B 12 -20.439 8.819 9.079 1.00 0.00 H new ATOM 0 HB3 LEU B 12 -21.483 7.417 9.204 1.00 0.00 H new ATOM 0 HG LEU B 12 -19.562 6.056 9.982 1.00 0.00 H new ATOM 0 HD11 LEU B 12 -17.465 7.177 10.623 1.00 0.00 H new ATOM 0 HD12 LEU B 12 -17.759 7.282 8.871 1.00 0.00 H new ATOM 0 HD13 LEU B 12 -18.062 8.695 9.910 1.00 0.00 H new ATOM 0 HD21 LEU B 12 -19.362 7.108 12.203 1.00 0.00 H new ATOM 0 HD22 LEU B 12 -20.029 8.620 11.543 1.00 0.00 H new ATOM 0 HD23 LEU B 12 -21.036 7.154 11.602 1.00 0.00 H new ATOM 1336 N LYS B 13 -21.474 5.398 7.122 1.00 0.00 N ATOM 1337 CA LYS B 13 -21.768 3.988 6.906 1.00 0.00 C ATOM 1338 C LYS B 13 -21.028 3.471 5.678 1.00 0.00 C ATOM 1339 O LYS B 13 -20.391 2.415 5.715 1.00 0.00 O ATOM 1340 CB LYS B 13 -23.276 3.820 6.721 1.00 0.00 C ATOM 1341 CG LYS B 13 -23.766 2.383 6.687 1.00 0.00 C ATOM 1342 CD LYS B 13 -25.277 2.345 6.519 1.00 0.00 C ATOM 1343 CE LYS B 13 -25.809 0.927 6.483 1.00 0.00 C ATOM 1344 NZ LYS B 13 -27.288 0.904 6.332 1.00 0.00 N ATOM 0 H LYS B 13 -22.292 6.005 7.065 1.00 0.00 H new ATOM 0 HA LYS B 13 -21.436 3.412 7.770 1.00 0.00 H new ATOM 0 HB2 LYS B 13 -23.786 4.342 7.531 1.00 0.00 H new ATOM 0 HB3 LYS B 13 -23.569 4.309 5.792 1.00 0.00 H new ATOM 0 HG2 LYS B 13 -23.288 1.848 5.866 1.00 0.00 H new ATOM 0 HG3 LYS B 13 -23.483 1.873 7.608 1.00 0.00 H new ATOM 0 HD2 LYS B 13 -25.747 2.888 7.339 1.00 0.00 H new ATOM 0 HD3 LYS B 13 -25.552 2.859 5.598 1.00 0.00 H new ATOM 0 HE2 LYS B 13 -25.349 0.386 5.656 1.00 0.00 H new ATOM 0 HE3 LYS B 13 -25.528 0.408 7.399 1.00 0.00 H new ATOM 0 HZ1 LYS B 13 -27.620 -0.082 6.311 1.00 0.00 H new ATOM 0 HZ2 LYS B 13 -27.727 1.400 7.134 1.00 0.00 H new ATOM 0 HZ3 LYS B 13 -27.554 1.378 5.445 1.00 0.00 H new ATOM 1358 N LYS B 14 -21.117 4.233 4.593 1.00 0.00 N ATOM 1359 CA LYS B 14 -20.466 3.872 3.340 1.00 0.00 C ATOM 1360 C LYS B 14 -18.954 3.807 3.528 1.00 0.00 C ATOM 1361 O LYS B 14 -18.293 2.875 3.066 1.00 0.00 O ATOM 1362 CB LYS B 14 -20.802 4.900 2.257 1.00 0.00 C ATOM 1363 CG LYS B 14 -20.862 4.319 0.853 1.00 0.00 C ATOM 1364 CD LYS B 14 -22.104 3.462 0.675 1.00 0.00 C ATOM 1365 CE LYS B 14 -22.211 2.913 -0.735 1.00 0.00 C ATOM 1366 NZ LYS B 14 -23.517 2.245 -0.970 1.00 0.00 N ATOM 0 H LYS B 14 -21.637 5.110 4.557 1.00 0.00 H new ATOM 0 HA LYS B 14 -20.830 2.892 3.032 1.00 0.00 H new ATOM 0 HB2 LYS B 14 -21.763 5.359 2.491 1.00 0.00 H new ATOM 0 HB3 LYS B 14 -20.056 5.694 2.279 1.00 0.00 H new ATOM 0 HG2 LYS B 14 -20.864 5.126 0.121 1.00 0.00 H new ATOM 0 HG3 LYS B 14 -19.971 3.720 0.664 1.00 0.00 H new ATOM 0 HD2 LYS B 14 -22.081 2.636 1.386 1.00 0.00 H new ATOM 0 HD3 LYS B 14 -22.990 4.054 0.903 1.00 0.00 H new ATOM 0 HE2 LYS B 14 -22.084 3.725 -1.452 1.00 0.00 H new ATOM 0 HE3 LYS B 14 -21.403 2.203 -0.911 1.00 0.00 H new ATOM 0 HZ1 LYS B 14 -23.552 1.883 -1.944 1.00 0.00 H new ATOM 0 HZ2 LYS B 14 -23.628 1.455 -0.303 1.00 0.00 H new ATOM 0 HZ3 LYS B 14 -24.287 2.929 -0.827 1.00 0.00 H new ATOM 1380 N LEU B 15 -18.420 4.807 4.219 1.00 0.00 N ATOM 1381 CA LEU B 15 -16.989 4.906 4.466 1.00 0.00 C ATOM 1382 C LEU B 15 -16.505 3.801 5.404 1.00 0.00 C ATOM 1383 O LEU B 15 -15.458 3.192 5.173 1.00 0.00 O ATOM 1384 CB LEU B 15 -16.661 6.279 5.060 1.00 0.00 C ATOM 1385 CG LEU B 15 -16.928 7.474 4.143 1.00 0.00 C ATOM 1386 CD1 LEU B 15 -16.544 8.773 4.837 1.00 0.00 C ATOM 1387 CD2 LEU B 15 -16.164 7.319 2.838 1.00 0.00 C ATOM 0 H LEU B 15 -18.965 5.569 4.622 1.00 0.00 H new ATOM 0 HA LEU B 15 -16.472 4.785 3.514 1.00 0.00 H new ATOM 0 HB2 LEU B 15 -17.241 6.408 5.974 1.00 0.00 H new ATOM 0 HB3 LEU B 15 -15.609 6.290 5.345 1.00 0.00 H new ATOM 0 HG LEU B 15 -17.994 7.508 3.917 1.00 0.00 H new ATOM 0 HD11 LEU B 15 -16.740 9.613 4.171 1.00 0.00 H new ATOM 0 HD12 LEU B 15 -17.132 8.887 5.748 1.00 0.00 H new ATOM 0 HD13 LEU B 15 -15.484 8.751 5.090 1.00 0.00 H new ATOM 0 HD21 LEU B 15 -16.364 8.177 2.195 1.00 0.00 H new ATOM 0 HD22 LEU B 15 -15.096 7.263 3.046 1.00 0.00 H new ATOM 0 HD23 LEU B 15 -16.484 6.407 2.335 1.00 0.00 H new ATOM 1399 N ASN B 16 -17.279 3.542 6.454 1.00 0.00 N ATOM 1400 CA ASN B 16 -16.931 2.526 7.448 1.00 0.00 C ATOM 1401 C ASN B 16 -16.787 1.161 6.781 1.00 0.00 C ATOM 1402 O ASN B 16 -15.769 0.484 6.943 1.00 0.00 O ATOM 1403 CB ASN B 16 -18.007 2.467 8.542 1.00 0.00 C ATOM 1404 CG ASN B 16 -17.610 1.629 9.749 1.00 0.00 C ATOM 1405 OD1 ASN B 16 -16.841 0.670 9.650 1.00 0.00 O ATOM 1406 ND2 ASN B 16 -18.146 1.983 10.904 1.00 0.00 N ATOM 0 H ASN B 16 -18.158 4.025 6.641 1.00 0.00 H new ATOM 0 HA ASN B 16 -15.978 2.795 7.904 1.00 0.00 H new ATOM 0 HB2 ASN B 16 -18.231 3.481 8.873 1.00 0.00 H new ATOM 0 HB3 ASN B 16 -18.924 2.061 8.115 1.00 0.00 H new ATOM 0 HD21 ASN B 16 -17.927 1.457 11.750 1.00 0.00 H new ATOM 0 HD22 ASN B 16 -18.778 2.782 10.949 1.00 0.00 H new ATOM 1413 N ALA B 17 -17.804 0.775 6.013 1.00 0.00 N ATOM 1414 CA ALA B 17 -17.793 -0.509 5.316 1.00 0.00 C ATOM 1415 C ALA B 17 -16.601 -0.609 4.367 1.00 0.00 C ATOM 1416 O ALA B 17 -15.929 -1.642 4.307 1.00 0.00 O ATOM 1417 CB ALA B 17 -19.089 -0.710 4.546 1.00 0.00 C ATOM 0 H ALA B 17 -18.644 1.332 5.858 1.00 0.00 H new ATOM 0 HA ALA B 17 -17.702 -1.294 6.066 1.00 0.00 H new ATOM 0 HB1 ALA B 17 -19.062 -1.672 4.033 1.00 0.00 H new ATOM 0 HB2 ALA B 17 -19.930 -0.691 5.239 1.00 0.00 H new ATOM 0 HB3 ALA B 17 -19.204 0.089 3.813 1.00 0.00 H new ATOM 1423 N GLN B 18 -16.345 0.474 3.636 1.00 0.00 N ATOM 1424 CA GLN B 18 -15.247 0.520 2.674 1.00 0.00 C ATOM 1425 C GLN B 18 -13.897 0.318 3.365 1.00 0.00 C ATOM 1426 O GLN B 18 -13.104 -0.535 2.961 1.00 0.00 O ATOM 1427 CB GLN B 18 -15.268 1.855 1.923 1.00 0.00 C ATOM 1428 CG GLN B 18 -14.182 1.996 0.868 1.00 0.00 C ATOM 1429 CD GLN B 18 -14.316 3.275 0.056 1.00 0.00 C ATOM 1430 OE1 GLN B 18 -13.325 3.838 -0.407 1.00 0.00 O ATOM 1431 NE2 GLN B 18 -15.543 3.737 -0.131 1.00 0.00 N ATOM 0 H GLN B 18 -16.887 1.336 3.693 1.00 0.00 H new ATOM 0 HA GLN B 18 -15.381 -0.294 1.961 1.00 0.00 H new ATOM 0 HB2 GLN B 18 -16.240 1.975 1.445 1.00 0.00 H new ATOM 0 HB3 GLN B 18 -15.165 2.666 2.644 1.00 0.00 H new ATOM 0 HG2 GLN B 18 -13.206 1.979 1.353 1.00 0.00 H new ATOM 0 HG3 GLN B 18 -14.220 1.138 0.196 1.00 0.00 H new ATOM 0 HE21 GLN B 18 -16.341 3.243 0.269 1.00 0.00 H new ATOM 0 HE22 GLN B 18 -15.690 4.587 -0.675 1.00 0.00 H new ATOM 1440 N ALA B 19 -13.653 1.087 4.421 1.00 0.00 N ATOM 1441 CA ALA B 19 -12.383 1.028 5.139 1.00 0.00 C ATOM 1442 C ALA B 19 -12.207 -0.307 5.861 1.00 0.00 C ATOM 1443 O ALA B 19 -11.089 -0.802 6.019 1.00 0.00 O ATOM 1444 CB ALA B 19 -12.279 2.182 6.126 1.00 0.00 C ATOM 0 H ALA B 19 -14.319 1.760 4.800 1.00 0.00 H new ATOM 0 HA ALA B 19 -11.582 1.116 4.405 1.00 0.00 H new ATOM 0 HB1 ALA B 19 -11.327 2.125 6.654 1.00 0.00 H new ATOM 0 HB2 ALA B 19 -12.339 3.128 5.588 1.00 0.00 H new ATOM 0 HB3 ALA B 19 -13.096 2.121 6.845 1.00 0.00 H new ATOM 1450 N THR B 20 -13.314 -0.889 6.293 1.00 0.00 N ATOM 1451 CA THR B 20 -13.275 -2.180 6.962 1.00 0.00 C ATOM 1452 C THR B 20 -12.885 -3.283 5.980 1.00 0.00 C ATOM 1453 O THR B 20 -12.035 -4.124 6.284 1.00 0.00 O ATOM 1454 CB THR B 20 -14.634 -2.511 7.613 1.00 0.00 C ATOM 1455 OG1 THR B 20 -14.972 -1.490 8.561 1.00 0.00 O ATOM 1456 CG2 THR B 20 -14.602 -3.866 8.311 1.00 0.00 C ATOM 0 H THR B 20 -14.247 -0.490 6.193 1.00 0.00 H new ATOM 0 HA THR B 20 -12.522 -2.123 7.748 1.00 0.00 H new ATOM 0 HB THR B 20 -15.386 -2.554 6.826 1.00 0.00 H new ATOM 0 HG1 THR B 20 -15.432 -0.756 8.102 1.00 0.00 H new ATOM 0 HG21 THR B 20 -15.575 -4.068 8.759 1.00 0.00 H new ATOM 0 HG22 THR B 20 -14.369 -4.644 7.584 1.00 0.00 H new ATOM 0 HG23 THR B 20 -13.839 -3.856 9.090 1.00 0.00 H new ATOM 1464 N ALA B 21 -13.487 -3.262 4.797 1.00 0.00 N ATOM 1465 CA ALA B 21 -13.197 -4.260 3.778 1.00 0.00 C ATOM 1466 C ALA B 21 -11.757 -4.149 3.291 1.00 0.00 C ATOM 1467 O ALA B 21 -11.054 -5.155 3.175 1.00 0.00 O ATOM 1468 CB ALA B 21 -14.163 -4.121 2.614 1.00 0.00 C ATOM 0 H ALA B 21 -14.178 -2.565 4.521 1.00 0.00 H new ATOM 0 HA ALA B 21 -13.324 -5.246 4.225 1.00 0.00 H new ATOM 0 HB1 ALA B 21 -13.934 -4.874 1.860 1.00 0.00 H new ATOM 0 HB2 ALA B 21 -15.184 -4.262 2.969 1.00 0.00 H new ATOM 0 HB3 ALA B 21 -14.065 -3.127 2.177 1.00 0.00 H new ATOM 1474 N LEU B 22 -11.319 -2.921 3.022 1.00 0.00 N ATOM 1475 CA LEU B 22 -9.966 -2.679 2.531 1.00 0.00 C ATOM 1476 C LEU B 22 -8.919 -3.128 3.546 1.00 0.00 C ATOM 1477 O LEU B 22 -7.855 -3.616 3.170 1.00 0.00 O ATOM 1478 CB LEU B 22 -9.772 -1.198 2.191 1.00 0.00 C ATOM 1479 CG LEU B 22 -10.601 -0.682 1.011 1.00 0.00 C ATOM 1480 CD1 LEU B 22 -10.343 0.799 0.790 1.00 0.00 C ATOM 1481 CD2 LEU B 22 -10.279 -1.471 -0.248 1.00 0.00 C ATOM 0 H LEU B 22 -11.882 -2.078 3.136 1.00 0.00 H new ATOM 0 HA LEU B 22 -9.833 -3.269 1.624 1.00 0.00 H new ATOM 0 HB2 LEU B 22 -10.017 -0.605 3.072 1.00 0.00 H new ATOM 0 HB3 LEU B 22 -8.717 -1.027 1.975 1.00 0.00 H new ATOM 0 HG LEU B 22 -11.657 -0.818 1.244 1.00 0.00 H new ATOM 0 HD11 LEU B 22 -10.939 1.151 -0.052 1.00 0.00 H new ATOM 0 HD12 LEU B 22 -10.618 1.354 1.687 1.00 0.00 H new ATOM 0 HD13 LEU B 22 -9.286 0.956 0.576 1.00 0.00 H new ATOM 0 HD21 LEU B 22 -10.876 -1.092 -1.077 1.00 0.00 H new ATOM 0 HD22 LEU B 22 -9.220 -1.363 -0.484 1.00 0.00 H new ATOM 0 HD23 LEU B 22 -10.509 -2.524 -0.086 1.00 0.00 H new ATOM 1493 N LYS B 23 -9.229 -2.964 4.827 1.00 0.00 N ATOM 1494 CA LYS B 23 -8.342 -3.404 5.900 1.00 0.00 C ATOM 1495 C LYS B 23 -7.975 -4.879 5.735 1.00 0.00 C ATOM 1496 O LYS B 23 -6.797 -5.242 5.699 1.00 0.00 O ATOM 1497 CB LYS B 23 -9.013 -3.188 7.262 1.00 0.00 C ATOM 1498 CG LYS B 23 -8.197 -3.711 8.435 1.00 0.00 C ATOM 1499 CD LYS B 23 -9.001 -3.763 9.729 1.00 0.00 C ATOM 1500 CE LYS B 23 -9.178 -2.391 10.368 1.00 0.00 C ATOM 1501 NZ LYS B 23 -10.135 -1.529 9.623 1.00 0.00 N ATOM 0 H LYS B 23 -10.092 -2.527 5.150 1.00 0.00 H new ATOM 0 HA LYS B 23 -7.429 -2.811 5.849 1.00 0.00 H new ATOM 0 HB2 LYS B 23 -9.194 -2.122 7.403 1.00 0.00 H new ATOM 0 HB3 LYS B 23 -9.986 -3.679 7.260 1.00 0.00 H new ATOM 0 HG2 LYS B 23 -7.828 -4.709 8.200 1.00 0.00 H new ATOM 0 HG3 LYS B 23 -7.324 -3.074 8.579 1.00 0.00 H new ATOM 0 HD2 LYS B 23 -9.981 -4.193 9.525 1.00 0.00 H new ATOM 0 HD3 LYS B 23 -8.502 -4.426 10.435 1.00 0.00 H new ATOM 0 HE2 LYS B 23 -9.529 -2.515 11.393 1.00 0.00 H new ATOM 0 HE3 LYS B 23 -8.211 -1.892 10.420 1.00 0.00 H new ATOM 0 HZ1 LYS B 23 -9.612 -0.784 9.119 1.00 0.00 H new ATOM 0 HZ2 LYS B 23 -10.661 -2.107 8.937 1.00 0.00 H new ATOM 0 HZ3 LYS B 23 -10.802 -1.092 10.291 1.00 0.00 H new ATOM 1515 N MET B 24 -8.997 -5.717 5.609 1.00 0.00 N ATOM 1516 CA MET B 24 -8.804 -7.158 5.520 1.00 0.00 C ATOM 1517 C MET B 24 -8.193 -7.540 4.180 1.00 0.00 C ATOM 1518 O MET B 24 -7.318 -8.404 4.106 1.00 0.00 O ATOM 1519 CB MET B 24 -10.140 -7.883 5.711 1.00 0.00 C ATOM 1520 CG MET B 24 -10.786 -7.625 7.060 1.00 0.00 C ATOM 1521 SD MET B 24 -12.381 -8.450 7.239 1.00 0.00 S ATOM 1522 CE MET B 24 -12.809 -7.993 8.916 1.00 0.00 C ATOM 0 H MET B 24 -9.972 -5.421 5.566 1.00 0.00 H new ATOM 0 HA MET B 24 -8.118 -7.460 6.311 1.00 0.00 H new ATOM 0 HB2 MET B 24 -10.827 -7.573 4.924 1.00 0.00 H new ATOM 0 HB3 MET B 24 -9.982 -8.955 5.593 1.00 0.00 H new ATOM 0 HG2 MET B 24 -10.116 -7.964 7.850 1.00 0.00 H new ATOM 0 HG3 MET B 24 -10.920 -6.552 7.195 1.00 0.00 H new ATOM 0 HE1 MET B 24 -13.774 -8.428 9.177 1.00 0.00 H new ATOM 0 HE2 MET B 24 -12.046 -8.365 9.600 1.00 0.00 H new ATOM 0 HE3 MET B 24 -12.868 -6.907 8.993 1.00 0.00 H new ATOM 1532 N ASP B 25 -8.647 -6.876 3.125 1.00 0.00 N ATOM 1533 CA ASP B 25 -8.211 -7.195 1.768 1.00 0.00 C ATOM 1534 C ASP B 25 -6.746 -6.821 1.561 1.00 0.00 C ATOM 1535 O ASP B 25 -6.009 -7.524 0.864 1.00 0.00 O ATOM 1536 CB ASP B 25 -9.090 -6.472 0.748 1.00 0.00 C ATOM 1537 CG ASP B 25 -8.957 -7.053 -0.644 1.00 0.00 C ATOM 1538 OD1 ASP B 25 -9.625 -8.074 -0.931 1.00 0.00 O ATOM 1539 OD2 ASP B 25 -8.204 -6.490 -1.461 1.00 0.00 O ATOM 0 H ASP B 25 -9.319 -6.111 3.181 1.00 0.00 H new ATOM 0 HA ASP B 25 -8.310 -8.271 1.623 1.00 0.00 H new ATOM 0 HB2 ASP B 25 -10.131 -6.529 1.065 1.00 0.00 H new ATOM 0 HB3 ASP B 25 -8.822 -5.416 0.725 1.00 0.00 H new ATOM 1544 N LEU B 26 -6.322 -5.726 2.183 1.00 0.00 N ATOM 1545 CA LEU B 26 -4.933 -5.292 2.109 1.00 0.00 C ATOM 1546 C LEU B 26 -4.030 -6.281 2.841 1.00 0.00 C ATOM 1547 O LEU B 26 -2.946 -6.618 2.363 1.00 0.00 O ATOM 1548 CB LEU B 26 -4.775 -3.888 2.703 1.00 0.00 C ATOM 1549 CG LEU B 26 -3.357 -3.311 2.658 1.00 0.00 C ATOM 1550 CD1 LEU B 26 -2.869 -3.178 1.220 1.00 0.00 C ATOM 1551 CD2 LEU B 26 -3.309 -1.964 3.361 1.00 0.00 C ATOM 0 H LEU B 26 -6.922 -5.122 2.745 1.00 0.00 H new ATOM 0 HA LEU B 26 -4.638 -5.258 1.060 1.00 0.00 H new ATOM 0 HB2 LEU B 26 -5.442 -3.210 2.171 1.00 0.00 H new ATOM 0 HB3 LEU B 26 -5.106 -3.912 3.741 1.00 0.00 H new ATOM 0 HG LEU B 26 -2.693 -4.001 3.180 1.00 0.00 H new ATOM 0 HD11 LEU B 26 -1.860 -2.766 1.215 1.00 0.00 H new ATOM 0 HD12 LEU B 26 -2.863 -4.159 0.746 1.00 0.00 H new ATOM 0 HD13 LEU B 26 -3.535 -2.513 0.670 1.00 0.00 H new ATOM 0 HD21 LEU B 26 -2.294 -1.568 3.320 1.00 0.00 H new ATOM 0 HD22 LEU B 26 -3.989 -1.271 2.866 1.00 0.00 H new ATOM 0 HD23 LEU B 26 -3.609 -2.086 4.402 1.00 0.00 H new ATOM 1563 N HIS B 27 -4.484 -6.752 4.000 1.00 0.00 N ATOM 1564 CA HIS B 27 -3.743 -7.760 4.753 1.00 0.00 C ATOM 1565 C HIS B 27 -3.631 -9.037 3.932 1.00 0.00 C ATOM 1566 O HIS B 27 -2.594 -9.696 3.922 1.00 0.00 O ATOM 1567 CB HIS B 27 -4.420 -8.053 6.097 1.00 0.00 C ATOM 1568 CG HIS B 27 -3.704 -9.089 6.915 1.00 0.00 C ATOM 1569 ND1 HIS B 27 -4.242 -10.322 7.209 1.00 0.00 N ATOM 1570 CD2 HIS B 27 -2.484 -9.070 7.494 1.00 0.00 C ATOM 1571 CE1 HIS B 27 -3.385 -11.012 7.935 1.00 0.00 C ATOM 1572 NE2 HIS B 27 -2.310 -10.275 8.120 1.00 0.00 N ATOM 0 H HIS B 27 -5.357 -6.454 4.436 1.00 0.00 H new ATOM 0 HA HIS B 27 -2.745 -7.373 4.956 1.00 0.00 H new ATOM 0 HB2 HIS B 27 -4.485 -7.129 6.671 1.00 0.00 H new ATOM 0 HB3 HIS B 27 -5.441 -8.387 5.915 1.00 0.00 H new ATOM 0 HD2 HIS B 27 -1.776 -8.255 7.468 1.00 0.00 H new ATOM 0 HE1 HIS B 27 -3.539 -12.012 8.314 1.00 0.00 H new ATOM 0 HE2 HIS B 27 -1.482 -10.556 8.645 1.00 0.00 H new ATOM 1581 N ASP B 28 -4.710 -9.363 3.240 1.00 0.00 N ATOM 1582 CA ASP B 28 -4.753 -10.523 2.361 1.00 0.00 C ATOM 1583 C ASP B 28 -3.723 -10.390 1.245 1.00 0.00 C ATOM 1584 O ASP B 28 -3.023 -11.346 0.913 1.00 0.00 O ATOM 1585 CB ASP B 28 -6.152 -10.662 1.760 1.00 0.00 C ATOM 1586 CG ASP B 28 -6.278 -11.855 0.838 1.00 0.00 C ATOM 1587 OD1 ASP B 28 -6.638 -12.949 1.326 1.00 0.00 O ATOM 1588 OD2 ASP B 28 -6.050 -11.700 -0.381 1.00 0.00 O ATOM 0 H ASP B 28 -5.581 -8.833 3.271 1.00 0.00 H new ATOM 0 HA ASP B 28 -4.518 -11.412 2.946 1.00 0.00 H new ATOM 0 HB2 ASP B 28 -6.881 -10.752 2.565 1.00 0.00 H new ATOM 0 HB3 ASP B 28 -6.397 -9.755 1.208 1.00 0.00 H new ATOM 1593 N LEU B 29 -3.631 -9.187 0.689 1.00 0.00 N ATOM 1594 CA LEU B 29 -2.713 -8.905 -0.408 1.00 0.00 C ATOM 1595 C LEU B 29 -1.262 -9.041 0.043 1.00 0.00 C ATOM 1596 O LEU B 29 -0.430 -9.597 -0.675 1.00 0.00 O ATOM 1597 CB LEU B 29 -2.968 -7.498 -0.949 1.00 0.00 C ATOM 1598 CG LEU B 29 -2.109 -7.090 -2.143 1.00 0.00 C ATOM 1599 CD1 LEU B 29 -2.393 -7.985 -3.340 1.00 0.00 C ATOM 1600 CD2 LEU B 29 -2.361 -5.632 -2.490 1.00 0.00 C ATOM 0 H LEU B 29 -4.187 -8.384 0.984 1.00 0.00 H new ATOM 0 HA LEU B 29 -2.890 -9.633 -1.200 1.00 0.00 H new ATOM 0 HB2 LEU B 29 -4.017 -7.422 -1.235 1.00 0.00 H new ATOM 0 HB3 LEU B 29 -2.804 -6.782 -0.144 1.00 0.00 H new ATOM 0 HG LEU B 29 -1.059 -7.209 -1.876 1.00 0.00 H new ATOM 0 HD11 LEU B 29 -1.770 -7.677 -4.180 1.00 0.00 H new ATOM 0 HD12 LEU B 29 -2.168 -9.020 -3.082 1.00 0.00 H new ATOM 0 HD13 LEU B 29 -3.444 -7.900 -3.617 1.00 0.00 H new ATOM 0 HD21 LEU B 29 -1.744 -5.349 -3.343 1.00 0.00 H new ATOM 0 HD22 LEU B 29 -3.413 -5.494 -2.741 1.00 0.00 H new ATOM 0 HD23 LEU B 29 -2.107 -5.005 -1.635 1.00 0.00 H new ATOM 1612 N ALA B 30 -0.971 -8.544 1.241 1.00 0.00 N ATOM 1613 CA ALA B 30 0.376 -8.613 1.800 1.00 0.00 C ATOM 1614 C ALA B 30 0.833 -10.062 1.957 1.00 0.00 C ATOM 1615 O ALA B 30 2.028 -10.355 1.959 1.00 0.00 O ATOM 1616 CB ALA B 30 0.430 -7.897 3.141 1.00 0.00 C ATOM 0 H ALA B 30 -1.653 -8.087 1.846 1.00 0.00 H new ATOM 0 HA ALA B 30 1.054 -8.116 1.106 1.00 0.00 H new ATOM 0 HB1 ALA B 30 1.441 -7.957 3.545 1.00 0.00 H new ATOM 0 HB2 ALA B 30 0.155 -6.851 3.006 1.00 0.00 H new ATOM 0 HB3 ALA B 30 -0.266 -8.369 3.834 1.00 0.00 H new ATOM 1622 N GLU B 31 -0.127 -10.967 2.105 1.00 0.00 N ATOM 1623 CA GLU B 31 0.169 -12.376 2.260 1.00 0.00 C ATOM 1624 C GLU B 31 0.502 -13.025 0.916 1.00 0.00 C ATOM 1625 O GLU B 31 1.168 -14.060 0.867 1.00 0.00 O ATOM 1626 CB GLU B 31 -1.019 -13.089 2.895 1.00 0.00 C ATOM 1627 CG GLU B 31 -1.351 -12.602 4.293 1.00 0.00 C ATOM 1628 CD GLU B 31 -2.369 -13.488 4.976 1.00 0.00 C ATOM 1629 OE1 GLU B 31 -3.586 -13.267 4.795 1.00 0.00 O ATOM 1630 OE2 GLU B 31 -1.957 -14.422 5.694 1.00 0.00 O ATOM 0 H GLU B 31 -1.122 -10.743 2.120 1.00 0.00 H new ATOM 0 HA GLU B 31 1.041 -12.468 2.908 1.00 0.00 H new ATOM 0 HB2 GLU B 31 -1.893 -12.957 2.257 1.00 0.00 H new ATOM 0 HB3 GLU B 31 -0.811 -14.158 2.933 1.00 0.00 H new ATOM 0 HG2 GLU B 31 -0.440 -12.569 4.891 1.00 0.00 H new ATOM 0 HG3 GLU B 31 -1.735 -11.583 4.240 1.00 0.00 H new ATOM 1637 N ASP B 32 0.047 -12.408 -0.169 1.00 0.00 N ATOM 1638 CA ASP B 32 0.195 -12.994 -1.499 1.00 0.00 C ATOM 1639 C ASP B 32 1.395 -12.393 -2.237 1.00 0.00 C ATOM 1640 O ASP B 32 1.457 -12.395 -3.466 1.00 0.00 O ATOM 1641 CB ASP B 32 -1.092 -12.812 -2.310 1.00 0.00 C ATOM 1642 CG ASP B 32 -1.128 -13.712 -3.533 1.00 0.00 C ATOM 1643 OD1 ASP B 32 -0.764 -14.905 -3.413 1.00 0.00 O ATOM 1644 OD2 ASP B 32 -1.530 -13.239 -4.620 1.00 0.00 O ATOM 0 H ASP B 32 -0.426 -11.505 -0.156 1.00 0.00 H new ATOM 0 HA ASP B 32 0.380 -14.062 -1.381 1.00 0.00 H new ATOM 0 HB2 ASP B 32 -1.953 -13.027 -1.677 1.00 0.00 H new ATOM 0 HB3 ASP B 32 -1.179 -11.772 -2.623 1.00 0.00 H new ATOM 1649 N LEU B 33 2.348 -11.883 -1.459 1.00 0.00 N ATOM 1650 CA LEU B 33 3.633 -11.395 -1.976 1.00 0.00 C ATOM 1651 C LEU B 33 4.282 -12.382 -2.940 1.00 0.00 C ATOM 1652 O LEU B 33 3.921 -13.559 -2.966 1.00 0.00 O ATOM 1653 CB LEU B 33 4.555 -11.024 -0.813 1.00 0.00 C ATOM 1654 CG LEU B 33 4.343 -9.611 -0.276 1.00 0.00 C ATOM 1655 CD1 LEU B 33 5.282 -9.330 0.885 1.00 0.00 C ATOM 1656 CD2 LEU B 33 4.550 -8.593 -1.389 1.00 0.00 C ATOM 0 H LEU B 33 2.254 -11.795 -0.447 1.00 0.00 H new ATOM 0 HA LEU B 33 3.446 -10.495 -2.562 1.00 0.00 H new ATOM 0 HB2 LEU B 33 4.403 -11.736 -0.002 1.00 0.00 H new ATOM 0 HB3 LEU B 33 5.591 -11.126 -1.137 1.00 0.00 H new ATOM 0 HG LEU B 33 3.319 -9.528 0.089 1.00 0.00 H new ATOM 0 HD11 LEU B 33 5.114 -8.318 1.252 1.00 0.00 H new ATOM 0 HD12 LEU B 33 5.092 -10.043 1.687 1.00 0.00 H new ATOM 0 HD13 LEU B 33 6.315 -9.427 0.550 1.00 0.00 H new ATOM 0 HD21 LEU B 33 4.397 -7.588 -0.996 1.00 0.00 H new ATOM 0 HD22 LEU B 33 5.565 -8.680 -1.777 1.00 0.00 H new ATOM 0 HD23 LEU B 33 3.837 -8.781 -2.192 1.00 0.00 H new ATOM 1668 N PRO B 34 5.350 -11.937 -3.635 1.00 0.00 N ATOM 1669 CA PRO B 34 5.584 -12.161 -5.035 1.00 0.00 C ATOM 1670 C PRO B 34 4.456 -12.852 -5.798 1.00 0.00 C ATOM 1671 O PRO B 34 3.990 -13.939 -5.459 1.00 0.00 O ATOM 1672 CB PRO B 34 6.873 -12.959 -4.946 1.00 0.00 C ATOM 1673 CG PRO B 34 7.619 -12.270 -3.823 1.00 0.00 C ATOM 1674 CD PRO B 34 6.594 -11.410 -3.085 1.00 0.00 C ATOM 0 HA PRO B 34 5.643 -11.248 -5.627 1.00 0.00 H new ATOM 0 HB2 PRO B 34 6.684 -14.009 -4.721 1.00 0.00 H new ATOM 0 HB3 PRO B 34 7.432 -12.929 -5.881 1.00 0.00 H new ATOM 0 HG2 PRO B 34 8.069 -13.000 -3.150 1.00 0.00 H new ATOM 0 HG3 PRO B 34 8.430 -11.656 -4.215 1.00 0.00 H new ATOM 0 HD2 PRO B 34 6.653 -11.533 -2.004 1.00 0.00 H new ATOM 0 HD3 PRO B 34 6.720 -10.347 -3.292 1.00 0.00 H new ATOM 1682 N THR B 35 4.097 -12.167 -6.879 1.00 0.00 N ATOM 1683 CA THR B 35 3.034 -12.542 -7.820 1.00 0.00 C ATOM 1684 C THR B 35 1.740 -11.804 -7.452 1.00 0.00 C ATOM 1685 O THR B 35 0.804 -11.706 -8.248 1.00 0.00 O ATOM 1686 CB THR B 35 2.812 -14.076 -7.918 1.00 0.00 C ATOM 1687 OG1 THR B 35 4.063 -14.731 -8.197 1.00 0.00 O ATOM 1688 CG2 THR B 35 1.813 -14.430 -9.016 1.00 0.00 C ATOM 0 H THR B 35 4.557 -11.295 -7.139 1.00 0.00 H new ATOM 0 HA THR B 35 3.354 -12.236 -8.816 1.00 0.00 H new ATOM 0 HB THR B 35 2.410 -14.414 -6.963 1.00 0.00 H new ATOM 0 HG1 THR B 35 3.920 -15.699 -8.256 1.00 0.00 H new ATOM 0 HG21 THR B 35 1.683 -15.512 -9.055 1.00 0.00 H new ATOM 0 HG22 THR B 35 0.855 -13.957 -8.802 1.00 0.00 H new ATOM 0 HG23 THR B 35 2.187 -14.075 -9.976 1.00 0.00 H new ATOM 1696 N GLY B 36 1.728 -11.245 -6.249 1.00 0.00 N ATOM 1697 CA GLY B 36 0.661 -10.351 -5.840 1.00 0.00 C ATOM 1698 C GLY B 36 1.224 -9.063 -5.270 1.00 0.00 C ATOM 1699 O GLY B 36 0.808 -8.601 -4.212 1.00 0.00 O ATOM 0 H GLY B 36 2.447 -11.397 -5.542 1.00 0.00 H new ATOM 0 HA2 GLY B 36 0.021 -10.127 -6.694 1.00 0.00 H new ATOM 0 HA3 GLY B 36 0.036 -10.841 -5.094 1.00 0.00 H new ATOM 1703 N TRP B 37 2.188 -8.486 -5.982 1.00 0.00 N ATOM 1704 CA TRP B 37 2.935 -7.331 -5.489 1.00 0.00 C ATOM 1705 C TRP B 37 2.563 -6.044 -6.227 1.00 0.00 C ATOM 1706 O TRP B 37 2.673 -4.949 -5.673 1.00 0.00 O ATOM 1707 CB TRP B 37 4.441 -7.590 -5.627 1.00 0.00 C ATOM 1708 CG TRP B 37 4.865 -7.926 -7.031 1.00 0.00 C ATOM 1709 CD1 TRP B 37 4.733 -9.131 -7.659 1.00 0.00 C ATOM 1710 CD2 TRP B 37 5.486 -7.048 -7.979 1.00 0.00 C ATOM 1711 NE1 TRP B 37 5.221 -9.055 -8.939 1.00 0.00 N ATOM 1712 CE2 TRP B 37 5.697 -7.789 -9.158 1.00 0.00 C ATOM 1713 CE3 TRP B 37 5.889 -5.710 -7.945 1.00 0.00 C ATOM 1714 CZ2 TRP B 37 6.280 -7.233 -10.296 1.00 0.00 C ATOM 1715 CZ3 TRP B 37 6.469 -5.160 -9.073 1.00 0.00 C ATOM 1716 CH2 TRP B 37 6.664 -5.921 -10.232 1.00 0.00 C ATOM 0 H TRP B 37 2.472 -8.802 -6.909 1.00 0.00 H new ATOM 0 HA TRP B 37 2.673 -7.195 -4.440 1.00 0.00 H new ATOM 0 HB2 TRP B 37 4.986 -6.707 -5.293 1.00 0.00 H new ATOM 0 HB3 TRP B 37 4.723 -8.408 -4.965 1.00 0.00 H new ATOM 0 HD1 TRP B 37 4.306 -10.017 -7.212 1.00 0.00 H new ATOM 0 HE1 TRP B 37 5.228 -9.817 -9.617 1.00 0.00 H new ATOM 0 HE3 TRP B 37 5.750 -5.116 -7.054 1.00 0.00 H new ATOM 0 HZ2 TRP B 37 6.423 -7.816 -11.194 1.00 0.00 H new ATOM 0 HZ3 TRP B 37 6.777 -4.125 -9.060 1.00 0.00 H new ATOM 0 HH2 TRP B 37 7.127 -5.463 -11.093 1.00 0.00 H new ATOM 1727 N ASN B 38 2.118 -6.171 -7.468 1.00 0.00 N ATOM 1728 CA ASN B 38 1.820 -4.999 -8.290 1.00 0.00 C ATOM 1729 C ASN B 38 0.540 -4.318 -7.809 1.00 0.00 C ATOM 1730 O ASN B 38 0.330 -3.125 -8.028 1.00 0.00 O ATOM 1731 CB ASN B 38 1.697 -5.396 -9.768 1.00 0.00 C ATOM 1732 CG ASN B 38 1.490 -4.199 -10.678 1.00 0.00 C ATOM 1733 OD1 ASN B 38 0.360 -3.798 -10.944 1.00 0.00 O ATOM 1734 ND2 ASN B 38 2.578 -3.632 -11.174 1.00 0.00 N ATOM 0 H ASN B 38 1.955 -7.066 -7.929 1.00 0.00 H new ATOM 0 HA ASN B 38 2.643 -4.291 -8.191 1.00 0.00 H new ATOM 0 HB2 ASN B 38 2.598 -5.929 -10.074 1.00 0.00 H new ATOM 0 HB3 ASN B 38 0.862 -6.087 -9.887 1.00 0.00 H new ATOM 0 HD21 ASN B 38 2.495 -2.832 -11.801 1.00 0.00 H new ATOM 0 HD22 ASN B 38 3.499 -3.995 -10.929 1.00 0.00 H new ATOM 1741 N ARG B 39 -0.295 -5.077 -7.113 1.00 0.00 N ATOM 1742 CA ARG B 39 -1.571 -4.568 -6.624 1.00 0.00 C ATOM 1743 C ARG B 39 -1.380 -3.788 -5.319 1.00 0.00 C ATOM 1744 O ARG B 39 -2.280 -3.074 -4.870 1.00 0.00 O ATOM 1745 CB ARG B 39 -2.540 -5.738 -6.408 1.00 0.00 C ATOM 1746 CG ARG B 39 -3.975 -5.321 -6.121 1.00 0.00 C ATOM 1747 CD ARG B 39 -4.654 -4.739 -7.352 1.00 0.00 C ATOM 1748 NE ARG B 39 -4.819 -5.735 -8.414 1.00 0.00 N ATOM 1749 CZ ARG B 39 -5.365 -5.475 -9.604 1.00 0.00 C ATOM 1750 NH1 ARG B 39 -5.813 -4.258 -9.892 1.00 0.00 N ATOM 1751 NH2 ARG B 39 -5.469 -6.439 -10.513 1.00 0.00 N ATOM 0 H ARG B 39 -0.112 -6.051 -6.873 1.00 0.00 H new ATOM 0 HA ARG B 39 -1.987 -3.887 -7.367 1.00 0.00 H new ATOM 0 HB2 ARG B 39 -2.529 -6.371 -7.295 1.00 0.00 H new ATOM 0 HB3 ARG B 39 -2.178 -6.345 -5.578 1.00 0.00 H new ATOM 0 HG2 ARG B 39 -4.540 -6.184 -5.769 1.00 0.00 H new ATOM 0 HG3 ARG B 39 -3.985 -4.584 -5.318 1.00 0.00 H new ATOM 0 HD2 ARG B 39 -5.630 -4.342 -7.073 1.00 0.00 H new ATOM 0 HD3 ARG B 39 -4.065 -3.902 -7.729 1.00 0.00 H new ATOM 0 HE ARG B 39 -4.497 -6.686 -8.233 1.00 0.00 H new ATOM 0 HH11 ARG B 39 -5.741 -3.511 -9.201 1.00 0.00 H new ATOM 0 HH12 ARG B 39 -6.228 -4.070 -10.804 1.00 0.00 H new ATOM 0 HH21 ARG B 39 -5.132 -7.378 -10.301 1.00 0.00 H new ATOM 0 HH22 ARG B 39 -5.886 -6.240 -11.422 1.00 0.00 H new ATOM 1765 N ILE B 40 -0.188 -3.907 -4.734 1.00 0.00 N ATOM 1766 CA ILE B 40 0.104 -3.332 -3.420 1.00 0.00 C ATOM 1767 C ILE B 40 -0.110 -1.822 -3.392 1.00 0.00 C ATOM 1768 O ILE B 40 -0.849 -1.315 -2.549 1.00 0.00 O ATOM 1769 CB ILE B 40 1.552 -3.655 -2.988 1.00 0.00 C ATOM 1770 CG1 ILE B 40 1.695 -5.150 -2.696 1.00 0.00 C ATOM 1771 CG2 ILE B 40 1.969 -2.836 -1.772 1.00 0.00 C ATOM 1772 CD1 ILE B 40 3.100 -5.562 -2.315 1.00 0.00 C ATOM 0 H ILE B 40 0.599 -4.402 -5.154 1.00 0.00 H new ATOM 0 HA ILE B 40 -0.595 -3.786 -2.718 1.00 0.00 H new ATOM 0 HB ILE B 40 2.214 -3.387 -3.811 1.00 0.00 H new ATOM 0 HG12 ILE B 40 1.015 -5.420 -1.888 1.00 0.00 H new ATOM 0 HG13 ILE B 40 1.386 -5.715 -3.576 1.00 0.00 H new ATOM 0 HG21 ILE B 40 2.993 -3.089 -1.496 1.00 0.00 H new ATOM 0 HG22 ILE B 40 1.910 -1.774 -2.011 1.00 0.00 H new ATOM 0 HG23 ILE B 40 1.303 -3.058 -0.938 1.00 0.00 H new ATOM 0 HD11 ILE B 40 3.125 -6.635 -2.123 1.00 0.00 H new ATOM 0 HD12 ILE B 40 3.783 -5.324 -3.130 1.00 0.00 H new ATOM 0 HD13 ILE B 40 3.406 -5.025 -1.417 1.00 0.00 H new ATOM 1784 N MET B 41 0.504 -1.113 -4.330 1.00 0.00 N ATOM 1785 CA MET B 41 0.425 0.344 -4.353 1.00 0.00 C ATOM 1786 C MET B 41 -1.003 0.807 -4.620 1.00 0.00 C ATOM 1787 O MET B 41 -1.449 1.829 -4.102 1.00 0.00 O ATOM 1788 CB MET B 41 1.372 0.905 -5.415 1.00 0.00 C ATOM 1789 CG MET B 41 1.310 2.419 -5.554 1.00 0.00 C ATOM 1790 SD MET B 41 2.447 3.051 -6.802 1.00 0.00 S ATOM 1791 CE MET B 41 4.026 2.633 -6.063 1.00 0.00 C ATOM 0 H MET B 41 1.060 -1.519 -5.082 1.00 0.00 H new ATOM 0 HA MET B 41 0.727 0.720 -3.375 1.00 0.00 H new ATOM 0 HB2 MET B 41 2.393 0.613 -5.169 1.00 0.00 H new ATOM 0 HB3 MET B 41 1.134 0.451 -6.377 1.00 0.00 H new ATOM 0 HG2 MET B 41 0.293 2.715 -5.812 1.00 0.00 H new ATOM 0 HG3 MET B 41 1.541 2.878 -4.593 1.00 0.00 H new ATOM 0 HE1 MET B 41 4.830 3.098 -6.634 1.00 0.00 H new ATOM 0 HE2 MET B 41 4.054 2.995 -5.035 1.00 0.00 H new ATOM 0 HE3 MET B 41 4.156 1.551 -6.070 1.00 0.00 H new ATOM 1801 N GLU B 42 -1.718 0.022 -5.410 1.00 0.00 N ATOM 1802 CA GLU B 42 -3.081 0.346 -5.802 1.00 0.00 C ATOM 1803 C GLU B 42 -4.016 0.318 -4.600 1.00 0.00 C ATOM 1804 O GLU B 42 -4.670 1.316 -4.285 1.00 0.00 O ATOM 1805 CB GLU B 42 -3.558 -0.654 -6.850 1.00 0.00 C ATOM 1806 CG GLU B 42 -4.912 -0.329 -7.457 1.00 0.00 C ATOM 1807 CD GLU B 42 -5.371 -1.401 -8.418 1.00 0.00 C ATOM 1808 OE1 GLU B 42 -4.728 -1.572 -9.470 1.00 0.00 O ATOM 1809 OE2 GLU B 42 -6.360 -2.098 -8.112 1.00 0.00 O ATOM 0 H GLU B 42 -1.371 -0.856 -5.797 1.00 0.00 H new ATOM 0 HA GLU B 42 -3.093 1.353 -6.219 1.00 0.00 H new ATOM 0 HB2 GLU B 42 -2.818 -0.705 -7.649 1.00 0.00 H new ATOM 0 HB3 GLU B 42 -3.605 -1.644 -6.395 1.00 0.00 H new ATOM 0 HG2 GLU B 42 -5.648 -0.215 -6.662 1.00 0.00 H new ATOM 0 HG3 GLU B 42 -4.856 0.626 -7.979 1.00 0.00 H new ATOM 1816 N VAL B 43 -4.067 -0.827 -3.935 1.00 0.00 N ATOM 1817 CA VAL B 43 -4.941 -1.004 -2.781 1.00 0.00 C ATOM 1818 C VAL B 43 -4.544 -0.063 -1.647 1.00 0.00 C ATOM 1819 O VAL B 43 -5.404 0.542 -1.006 1.00 0.00 O ATOM 1820 CB VAL B 43 -4.920 -2.462 -2.273 1.00 0.00 C ATOM 1821 CG1 VAL B 43 -5.850 -2.634 -1.083 1.00 0.00 C ATOM 1822 CG2 VAL B 43 -5.305 -3.418 -3.388 1.00 0.00 C ATOM 0 H VAL B 43 -3.513 -1.649 -4.174 1.00 0.00 H new ATOM 0 HA VAL B 43 -5.953 -0.765 -3.107 1.00 0.00 H new ATOM 0 HB VAL B 43 -3.905 -2.695 -1.949 1.00 0.00 H new ATOM 0 HG11 VAL B 43 -5.818 -3.669 -0.743 1.00 0.00 H new ATOM 0 HG12 VAL B 43 -5.531 -1.976 -0.274 1.00 0.00 H new ATOM 0 HG13 VAL B 43 -6.868 -2.380 -1.377 1.00 0.00 H new ATOM 0 HG21 VAL B 43 -5.285 -4.441 -3.013 1.00 0.00 H new ATOM 0 HG22 VAL B 43 -6.309 -3.180 -3.741 1.00 0.00 H new ATOM 0 HG23 VAL B 43 -4.598 -3.320 -4.212 1.00 0.00 H new ATOM 1832 N ALA B 44 -3.242 0.071 -1.416 1.00 0.00 N ATOM 1833 CA ALA B 44 -2.737 0.935 -0.354 1.00 0.00 C ATOM 1834 C ALA B 44 -3.175 2.380 -0.563 1.00 0.00 C ATOM 1835 O ALA B 44 -3.611 3.047 0.376 1.00 0.00 O ATOM 1836 CB ALA B 44 -1.221 0.850 -0.279 1.00 0.00 C ATOM 0 H ALA B 44 -2.517 -0.408 -1.950 1.00 0.00 H new ATOM 0 HA ALA B 44 -3.158 0.588 0.590 1.00 0.00 H new ATOM 0 HB1 ALA B 44 -0.859 1.500 0.518 1.00 0.00 H new ATOM 0 HB2 ALA B 44 -0.924 -0.178 -0.072 1.00 0.00 H new ATOM 0 HB3 ALA B 44 -0.791 1.167 -1.229 1.00 0.00 H new ATOM 1842 N GLU B 45 -3.075 2.848 -1.803 1.00 0.00 N ATOM 1843 CA GLU B 45 -3.458 4.212 -2.144 1.00 0.00 C ATOM 1844 C GLU B 45 -4.917 4.463 -1.793 1.00 0.00 C ATOM 1845 O GLU B 45 -5.254 5.436 -1.118 1.00 0.00 O ATOM 1846 CB GLU B 45 -3.241 4.453 -3.637 1.00 0.00 C ATOM 1847 CG GLU B 45 -3.596 5.857 -4.087 1.00 0.00 C ATOM 1848 CD GLU B 45 -3.609 5.997 -5.595 1.00 0.00 C ATOM 1849 OE1 GLU B 45 -4.528 5.447 -6.245 1.00 0.00 O ATOM 1850 OE2 GLU B 45 -2.695 6.646 -6.144 1.00 0.00 O ATOM 0 H GLU B 45 -2.730 2.299 -2.591 1.00 0.00 H new ATOM 0 HA GLU B 45 -2.837 4.899 -1.570 1.00 0.00 H new ATOM 0 HB2 GLU B 45 -2.197 4.257 -3.879 1.00 0.00 H new ATOM 0 HB3 GLU B 45 -3.839 3.738 -4.202 1.00 0.00 H new ATOM 0 HG2 GLU B 45 -4.576 6.125 -3.692 1.00 0.00 H new ATOM 0 HG3 GLU B 45 -2.879 6.562 -3.666 1.00 0.00 H new ATOM 1857 N LYS B 46 -5.776 3.562 -2.244 1.00 0.00 N ATOM 1858 CA LYS B 46 -7.209 3.704 -2.042 1.00 0.00 C ATOM 1859 C LYS B 46 -7.569 3.547 -0.568 1.00 0.00 C ATOM 1860 O LYS B 46 -8.485 4.204 -0.072 1.00 0.00 O ATOM 1861 CB LYS B 46 -7.958 2.680 -2.897 1.00 0.00 C ATOM 1862 CG LYS B 46 -9.187 3.251 -3.594 1.00 0.00 C ATOM 1863 CD LYS B 46 -8.850 4.525 -4.362 1.00 0.00 C ATOM 1864 CE LYS B 46 -7.699 4.313 -5.336 1.00 0.00 C ATOM 1865 NZ LYS B 46 -7.192 5.601 -5.881 1.00 0.00 N ATOM 0 H LYS B 46 -5.504 2.722 -2.754 1.00 0.00 H new ATOM 0 HA LYS B 46 -7.508 4.705 -2.351 1.00 0.00 H new ATOM 0 HB2 LYS B 46 -7.278 2.279 -3.648 1.00 0.00 H new ATOM 0 HB3 LYS B 46 -8.263 1.845 -2.266 1.00 0.00 H new ATOM 0 HG2 LYS B 46 -9.596 2.509 -4.279 1.00 0.00 H new ATOM 0 HG3 LYS B 46 -9.960 3.463 -2.856 1.00 0.00 H new ATOM 0 HD2 LYS B 46 -9.730 4.863 -4.908 1.00 0.00 H new ATOM 0 HD3 LYS B 46 -8.589 5.315 -3.658 1.00 0.00 H new ATOM 0 HE2 LYS B 46 -6.888 3.787 -4.832 1.00 0.00 H new ATOM 0 HE3 LYS B 46 -8.030 3.676 -6.156 1.00 0.00 H new ATOM 0 HZ1 LYS B 46 -6.153 5.582 -5.907 1.00 0.00 H new ATOM 0 HZ2 LYS B 46 -7.560 5.740 -6.844 1.00 0.00 H new ATOM 0 HZ3 LYS B 46 -7.508 6.384 -5.273 1.00 0.00 H new ATOM 1879 N THR B 47 -6.831 2.693 0.133 1.00 0.00 N ATOM 1880 CA THR B 47 -7.040 2.503 1.560 1.00 0.00 C ATOM 1881 C THR B 47 -6.654 3.766 2.331 1.00 0.00 C ATOM 1882 O THR B 47 -7.376 4.199 3.233 1.00 0.00 O ATOM 1883 CB THR B 47 -6.232 1.301 2.089 1.00 0.00 C ATOM 1884 OG1 THR B 47 -6.579 0.122 1.353 1.00 0.00 O ATOM 1885 CG2 THR B 47 -6.500 1.065 3.569 1.00 0.00 C ATOM 0 H THR B 47 -6.084 2.123 -0.265 1.00 0.00 H new ATOM 0 HA THR B 47 -8.100 2.299 1.714 1.00 0.00 H new ATOM 0 HB THR B 47 -5.173 1.524 1.959 1.00 0.00 H new ATOM 0 HG1 THR B 47 -6.033 0.071 0.541 1.00 0.00 H new ATOM 0 HG21 THR B 47 -5.916 0.211 3.913 1.00 0.00 H new ATOM 0 HG22 THR B 47 -6.215 1.951 4.136 1.00 0.00 H new ATOM 0 HG23 THR B 47 -7.561 0.863 3.719 1.00 0.00 H new ATOM 1893 N TYR B 48 -5.523 4.366 1.960 1.00 0.00 N ATOM 1894 CA TYR B 48 -5.078 5.598 2.594 1.00 0.00 C ATOM 1895 C TYR B 48 -6.074 6.721 2.323 1.00 0.00 C ATOM 1896 O TYR B 48 -6.455 7.454 3.239 1.00 0.00 O ATOM 1897 CB TYR B 48 -3.684 6.005 2.107 1.00 0.00 C ATOM 1898 CG TYR B 48 -3.197 7.304 2.711 1.00 0.00 C ATOM 1899 CD1 TYR B 48 -2.846 7.378 4.052 1.00 0.00 C ATOM 1900 CD2 TYR B 48 -3.097 8.458 1.942 1.00 0.00 C ATOM 1901 CE1 TYR B 48 -2.411 8.563 4.614 1.00 0.00 C ATOM 1902 CE2 TYR B 48 -2.664 9.648 2.495 1.00 0.00 C ATOM 1903 CZ TYR B 48 -2.322 9.696 3.831 1.00 0.00 C ATOM 1904 OH TYR B 48 -1.898 10.883 4.389 1.00 0.00 O ATOM 0 H TYR B 48 -4.904 4.018 1.228 1.00 0.00 H new ATOM 0 HA TYR B 48 -5.022 5.419 3.668 1.00 0.00 H new ATOM 0 HB2 TYR B 48 -2.976 5.212 2.348 1.00 0.00 H new ATOM 0 HB3 TYR B 48 -3.699 6.100 1.021 1.00 0.00 H new ATOM 0 HD1 TYR B 48 -2.914 6.493 4.667 1.00 0.00 H new ATOM 0 HD2 TYR B 48 -3.362 8.424 0.896 1.00 0.00 H new ATOM 0 HE1 TYR B 48 -2.142 8.602 5.659 1.00 0.00 H new ATOM 0 HE2 TYR B 48 -2.594 10.536 1.885 1.00 0.00 H new ATOM 0 HH TYR B 48 -1.890 11.583 3.703 1.00 0.00 H new ATOM 1914 N GLU B 49 -6.497 6.846 1.063 1.00 0.00 N ATOM 1915 CA GLU B 49 -7.501 7.828 0.684 1.00 0.00 C ATOM 1916 C GLU B 49 -8.750 7.684 1.543 1.00 0.00 C ATOM 1917 O GLU B 49 -9.263 8.668 2.077 1.00 0.00 O ATOM 1918 CB GLU B 49 -7.878 7.677 -0.788 1.00 0.00 C ATOM 1919 CG GLU B 49 -6.830 8.183 -1.760 1.00 0.00 C ATOM 1920 CD GLU B 49 -7.363 8.258 -3.174 1.00 0.00 C ATOM 1921 OE1 GLU B 49 -8.202 9.143 -3.448 1.00 0.00 O ATOM 1922 OE2 GLU B 49 -6.957 7.441 -4.022 1.00 0.00 O ATOM 0 H GLU B 49 -6.155 6.275 0.290 1.00 0.00 H new ATOM 0 HA GLU B 49 -7.072 8.817 0.843 1.00 0.00 H new ATOM 0 HB2 GLU B 49 -8.069 6.624 -0.995 1.00 0.00 H new ATOM 0 HB3 GLU B 49 -8.811 8.212 -0.968 1.00 0.00 H new ATOM 0 HG2 GLU B 49 -6.491 9.170 -1.447 1.00 0.00 H new ATOM 0 HG3 GLU B 49 -5.962 7.524 -1.733 1.00 0.00 H new ATOM 1929 N ALA B 50 -9.217 6.450 1.683 1.00 0.00 N ATOM 1930 CA ALA B 50 -10.403 6.167 2.479 1.00 0.00 C ATOM 1931 C ALA B 50 -10.203 6.589 3.928 1.00 0.00 C ATOM 1932 O ALA B 50 -10.978 7.375 4.460 1.00 0.00 O ATOM 1933 CB ALA B 50 -10.759 4.689 2.396 1.00 0.00 C ATOM 0 H ALA B 50 -8.791 5.628 1.255 1.00 0.00 H new ATOM 0 HA ALA B 50 -11.231 6.747 2.071 1.00 0.00 H new ATOM 0 HB1 ALA B 50 -11.648 4.495 2.997 1.00 0.00 H new ATOM 0 HB2 ALA B 50 -10.956 4.420 1.358 1.00 0.00 H new ATOM 0 HB3 ALA B 50 -9.928 4.093 2.774 1.00 0.00 H new ATOM 1939 N TYR B 51 -9.139 6.096 4.549 1.00 0.00 N ATOM 1940 CA TYR B 51 -8.858 6.399 5.949 1.00 0.00 C ATOM 1941 C TYR B 51 -8.717 7.895 6.190 1.00 0.00 C ATOM 1942 O TYR B 51 -9.155 8.407 7.219 1.00 0.00 O ATOM 1943 CB TYR B 51 -7.601 5.666 6.408 1.00 0.00 C ATOM 1944 CG TYR B 51 -7.909 4.362 7.101 1.00 0.00 C ATOM 1945 CD1 TYR B 51 -8.210 3.215 6.377 1.00 0.00 C ATOM 1946 CD2 TYR B 51 -7.916 4.286 8.486 1.00 0.00 C ATOM 1947 CE1 TYR B 51 -8.505 2.028 7.018 1.00 0.00 C ATOM 1948 CE2 TYR B 51 -8.213 3.106 9.132 1.00 0.00 C ATOM 1949 CZ TYR B 51 -8.506 1.980 8.395 1.00 0.00 C ATOM 1950 OH TYR B 51 -8.814 0.809 9.040 1.00 0.00 O ATOM 0 H TYR B 51 -8.455 5.483 4.106 1.00 0.00 H new ATOM 0 HA TYR B 51 -9.708 6.052 6.536 1.00 0.00 H new ATOM 0 HB2 TYR B 51 -6.963 5.473 5.546 1.00 0.00 H new ATOM 0 HB3 TYR B 51 -7.037 6.308 7.085 1.00 0.00 H new ATOM 0 HD1 TYR B 51 -8.213 3.252 5.298 1.00 0.00 H new ATOM 0 HD2 TYR B 51 -7.685 5.166 9.067 1.00 0.00 H new ATOM 0 HE1 TYR B 51 -8.734 1.143 6.443 1.00 0.00 H new ATOM 0 HE2 TYR B 51 -8.216 3.064 10.211 1.00 0.00 H new ATOM 0 HH TYR B 51 -9.240 1.011 9.899 1.00 0.00 H new ATOM 1960 N ARG B 52 -8.120 8.593 5.239 1.00 0.00 N ATOM 1961 CA ARG B 52 -7.969 10.032 5.349 1.00 0.00 C ATOM 1962 C ARG B 52 -9.329 10.717 5.264 1.00 0.00 C ATOM 1963 O ARG B 52 -9.650 11.588 6.070 1.00 0.00 O ATOM 1964 CB ARG B 52 -7.043 10.554 4.254 1.00 0.00 C ATOM 1965 CG ARG B 52 -6.829 12.049 4.321 1.00 0.00 C ATOM 1966 CD ARG B 52 -5.718 12.493 3.390 1.00 0.00 C ATOM 1967 NE ARG B 52 -5.406 13.909 3.545 1.00 0.00 N ATOM 1968 CZ ARG B 52 -4.795 14.639 2.617 1.00 0.00 C ATOM 1969 NH1 ARG B 52 -4.463 14.094 1.452 1.00 0.00 N ATOM 1970 NH2 ARG B 52 -4.521 15.916 2.850 1.00 0.00 N ATOM 0 H ARG B 52 -7.734 8.188 4.386 1.00 0.00 H new ATOM 0 HA ARG B 52 -7.525 10.261 6.318 1.00 0.00 H new ATOM 0 HB2 ARG B 52 -6.079 10.051 4.331 1.00 0.00 H new ATOM 0 HB3 ARG B 52 -7.460 10.296 3.280 1.00 0.00 H new ATOM 0 HG2 ARG B 52 -7.754 12.562 4.057 1.00 0.00 H new ATOM 0 HG3 ARG B 52 -6.585 12.337 5.344 1.00 0.00 H new ATOM 0 HD2 ARG B 52 -4.824 11.902 3.586 1.00 0.00 H new ATOM 0 HD3 ARG B 52 -6.010 12.297 2.358 1.00 0.00 H new ATOM 0 HE ARG B 52 -5.672 14.366 4.417 1.00 0.00 H new ATOM 0 HH11 ARG B 52 -4.677 13.114 1.268 1.00 0.00 H new ATOM 0 HH12 ARG B 52 -3.994 14.656 0.741 1.00 0.00 H new ATOM 0 HH21 ARG B 52 -4.779 16.339 3.742 1.00 0.00 H new ATOM 0 HH22 ARG B 52 -4.052 16.475 2.137 1.00 0.00 H new ATOM 1984 N GLN B 53 -10.123 10.307 4.285 1.00 0.00 N ATOM 1985 CA GLN B 53 -11.471 10.839 4.104 1.00 0.00 C ATOM 1986 C GLN B 53 -12.347 10.532 5.319 1.00 0.00 C ATOM 1987 O GLN B 53 -13.214 11.328 5.681 1.00 0.00 O ATOM 1988 CB GLN B 53 -12.097 10.269 2.826 1.00 0.00 C ATOM 1989 CG GLN B 53 -13.445 10.879 2.473 1.00 0.00 C ATOM 1990 CD GLN B 53 -13.946 10.430 1.113 1.00 0.00 C ATOM 1991 OE1 GLN B 53 -14.636 9.421 0.995 1.00 0.00 O ATOM 1992 NE2 GLN B 53 -13.603 11.175 0.074 1.00 0.00 N ATOM 0 H GLN B 53 -9.856 9.602 3.598 1.00 0.00 H new ATOM 0 HA GLN B 53 -11.404 11.922 4.006 1.00 0.00 H new ATOM 0 HB2 GLN B 53 -11.409 10.427 1.995 1.00 0.00 H new ATOM 0 HB3 GLN B 53 -12.216 9.192 2.941 1.00 0.00 H new ATOM 0 HG2 GLN B 53 -14.175 10.605 3.235 1.00 0.00 H new ATOM 0 HG3 GLN B 53 -13.363 11.966 2.486 1.00 0.00 H new ATOM 0 HE21 GLN B 53 -13.028 12.007 0.210 1.00 0.00 H new ATOM 0 HE22 GLN B 53 -13.913 10.917 -0.863 1.00 0.00 H new ATOM 2001 N LEU B 54 -12.118 9.381 5.948 1.00 0.00 N ATOM 2002 CA LEU B 54 -12.802 9.039 7.191 1.00 0.00 C ATOM 2003 C LEU B 54 -12.482 10.063 8.272 1.00 0.00 C ATOM 2004 O LEU B 54 -13.383 10.608 8.911 1.00 0.00 O ATOM 2005 CB LEU B 54 -12.399 7.641 7.678 1.00 0.00 C ATOM 2006 CG LEU B 54 -13.372 6.508 7.332 1.00 0.00 C ATOM 2007 CD1 LEU B 54 -13.380 6.227 5.840 1.00 0.00 C ATOM 2008 CD2 LEU B 54 -13.016 5.248 8.107 1.00 0.00 C ATOM 0 H LEU B 54 -11.465 8.671 5.617 1.00 0.00 H new ATOM 0 HA LEU B 54 -13.874 9.044 6.991 1.00 0.00 H new ATOM 0 HB2 LEU B 54 -11.423 7.398 7.258 1.00 0.00 H new ATOM 0 HB3 LEU B 54 -12.280 7.674 8.761 1.00 0.00 H new ATOM 0 HG LEU B 54 -14.374 6.826 7.619 1.00 0.00 H new ATOM 0 HD11 LEU B 54 -14.079 5.419 5.626 1.00 0.00 H new ATOM 0 HD12 LEU B 54 -13.687 7.124 5.302 1.00 0.00 H new ATOM 0 HD13 LEU B 54 -12.380 5.936 5.519 1.00 0.00 H new ATOM 0 HD21 LEU B 54 -13.716 4.453 7.850 1.00 0.00 H new ATOM 0 HD22 LEU B 54 -12.003 4.937 7.850 1.00 0.00 H new ATOM 0 HD23 LEU B 54 -13.073 5.450 9.177 1.00 0.00 H new ATOM 2020 N ASP B 55 -11.193 10.326 8.464 1.00 0.00 N ATOM 2021 CA ASP B 55 -10.744 11.298 9.456 1.00 0.00 C ATOM 2022 C ASP B 55 -11.271 12.688 9.127 1.00 0.00 C ATOM 2023 O ASP B 55 -11.746 13.408 10.011 1.00 0.00 O ATOM 2024 CB ASP B 55 -9.216 11.325 9.536 1.00 0.00 C ATOM 2025 CG ASP B 55 -8.703 12.424 10.444 1.00 0.00 C ATOM 2026 OD1 ASP B 55 -8.754 12.253 11.683 1.00 0.00 O ATOM 2027 OD2 ASP B 55 -8.241 13.465 9.925 1.00 0.00 O ATOM 0 H ASP B 55 -10.439 9.878 7.944 1.00 0.00 H new ATOM 0 HA ASP B 55 -11.140 10.994 10.425 1.00 0.00 H new ATOM 0 HB2 ASP B 55 -8.857 10.362 9.898 1.00 0.00 H new ATOM 0 HB3 ASP B 55 -8.805 11.463 8.536 1.00 0.00 H new ATOM 2032 N GLU B 56 -11.197 13.056 7.852 1.00 0.00 N ATOM 2033 CA GLU B 56 -11.712 14.305 7.383 1.00 0.00 C ATOM 2034 C GLU B 56 -13.196 14.426 7.696 1.00 0.00 C ATOM 2035 O GLU B 56 -13.639 15.443 8.223 1.00 0.00 O ATOM 2036 CB GLU B 56 -11.470 14.405 5.882 1.00 0.00 C ATOM 2037 CG GLU B 56 -12.004 15.678 5.303 1.00 0.00 C ATOM 2038 CD GLU B 56 -11.886 15.754 3.793 1.00 0.00 C ATOM 2039 OE1 GLU B 56 -12.697 15.105 3.094 1.00 0.00 O ATOM 2040 OE2 GLU B 56 -10.993 16.476 3.294 1.00 0.00 O ATOM 0 H GLU B 56 -10.773 12.482 7.123 1.00 0.00 H new ATOM 0 HA GLU B 56 -11.200 15.123 7.890 1.00 0.00 H new ATOM 0 HB2 GLU B 56 -10.400 14.339 5.684 1.00 0.00 H new ATOM 0 HB3 GLU B 56 -11.939 13.557 5.383 1.00 0.00 H new ATOM 0 HG2 GLU B 56 -13.052 15.783 5.583 1.00 0.00 H new ATOM 0 HG3 GLU B 56 -11.470 16.520 5.744 1.00 0.00 H new ATOM 2047 N PHE B 57 -13.959 13.386 7.385 1.00 0.00 N ATOM 2048 CA PHE B 57 -15.383 13.383 7.674 1.00 0.00 C ATOM 2049 C PHE B 57 -15.618 13.531 9.173 1.00 0.00 C ATOM 2050 O PHE B 57 -16.485 14.291 9.594 1.00 0.00 O ATOM 2051 CB PHE B 57 -16.050 12.102 7.162 1.00 0.00 C ATOM 2052 CG PHE B 57 -17.532 12.070 7.406 1.00 0.00 C ATOM 2053 CD1 PHE B 57 -18.385 12.886 6.679 1.00 0.00 C ATOM 2054 CD2 PHE B 57 -18.072 11.236 8.372 1.00 0.00 C ATOM 2055 CE1 PHE B 57 -19.747 12.868 6.909 1.00 0.00 C ATOM 2056 CE2 PHE B 57 -19.435 11.214 8.605 1.00 0.00 C ATOM 2057 CZ PHE B 57 -20.273 12.031 7.872 1.00 0.00 C ATOM 0 H PHE B 57 -13.615 12.538 6.934 1.00 0.00 H new ATOM 0 HA PHE B 57 -15.832 14.230 7.156 1.00 0.00 H new ATOM 0 HB2 PHE B 57 -15.862 12.004 6.093 1.00 0.00 H new ATOM 0 HB3 PHE B 57 -15.590 11.241 7.647 1.00 0.00 H new ATOM 0 HD1 PHE B 57 -17.980 13.543 5.924 1.00 0.00 H new ATOM 0 HD2 PHE B 57 -17.421 10.596 8.949 1.00 0.00 H new ATOM 0 HE1 PHE B 57 -20.400 13.509 6.335 1.00 0.00 H new ATOM 0 HE2 PHE B 57 -19.844 10.558 9.360 1.00 0.00 H new ATOM 0 HZ PHE B 57 -21.338 12.015 8.052 1.00 0.00 H new ATOM 2067 N ARG B 58 -14.818 12.828 9.969 1.00 0.00 N ATOM 2068 CA ARG B 58 -14.944 12.862 11.418 1.00 0.00 C ATOM 2069 C ARG B 58 -14.753 14.274 11.961 1.00 0.00 C ATOM 2070 O ARG B 58 -15.492 14.708 12.845 1.00 0.00 O ATOM 2071 CB ARG B 58 -13.930 11.907 12.050 1.00 0.00 C ATOM 2072 CG ARG B 58 -14.371 10.448 12.040 1.00 0.00 C ATOM 2073 CD ARG B 58 -15.164 10.078 13.290 1.00 0.00 C ATOM 2074 NE ARG B 58 -16.288 10.985 13.545 1.00 0.00 N ATOM 2075 CZ ARG B 58 -17.298 10.706 14.377 1.00 0.00 C ATOM 2076 NH1 ARG B 58 -17.369 9.518 14.966 1.00 0.00 N ATOM 2077 NH2 ARG B 58 -18.244 11.610 14.603 1.00 0.00 N ATOM 0 H ARG B 58 -14.070 12.224 9.629 1.00 0.00 H new ATOM 0 HA ARG B 58 -15.952 12.541 11.679 1.00 0.00 H new ATOM 0 HB2 ARG B 58 -12.982 11.994 11.519 1.00 0.00 H new ATOM 0 HB3 ARG B 58 -13.748 12.215 13.080 1.00 0.00 H new ATOM 0 HG2 ARG B 58 -14.981 10.260 11.156 1.00 0.00 H new ATOM 0 HG3 ARG B 58 -13.494 9.805 11.965 1.00 0.00 H new ATOM 0 HD2 ARG B 58 -15.542 9.061 13.186 1.00 0.00 H new ATOM 0 HD3 ARG B 58 -14.497 10.084 14.152 1.00 0.00 H new ATOM 0 HE ARG B 58 -16.300 11.882 13.059 1.00 0.00 H new ATOM 0 HH11 ARG B 58 -16.652 8.815 14.785 1.00 0.00 H new ATOM 0 HH12 ARG B 58 -18.140 9.308 15.600 1.00 0.00 H new ATOM 0 HH21 ARG B 58 -18.201 12.519 14.142 1.00 0.00 H new ATOM 0 HH22 ARG B 58 -19.013 11.396 15.238 1.00 0.00 H new ATOM 2091 N LYS B 59 -13.769 14.988 11.432 1.00 0.00 N ATOM 2092 CA LYS B 59 -13.504 16.354 11.867 1.00 0.00 C ATOM 2093 C LYS B 59 -14.497 17.332 11.254 1.00 0.00 C ATOM 2094 O LYS B 59 -14.926 18.280 11.910 1.00 0.00 O ATOM 2095 CB LYS B 59 -12.061 16.732 11.526 1.00 0.00 C ATOM 2096 CG LYS B 59 -11.044 15.966 12.355 1.00 0.00 C ATOM 2097 CD LYS B 59 -9.664 15.994 11.729 1.00 0.00 C ATOM 2098 CE LYS B 59 -8.638 15.306 12.619 1.00 0.00 C ATOM 2099 NZ LYS B 59 -7.375 15.008 11.890 1.00 0.00 N ATOM 0 H LYS B 59 -13.142 14.646 10.703 1.00 0.00 H new ATOM 0 HA LYS B 59 -13.632 16.410 12.948 1.00 0.00 H new ATOM 0 HB2 LYS B 59 -11.880 16.541 10.468 1.00 0.00 H new ATOM 0 HB3 LYS B 59 -11.922 17.801 11.685 1.00 0.00 H new ATOM 0 HG2 LYS B 59 -10.997 16.394 13.356 1.00 0.00 H new ATOM 0 HG3 LYS B 59 -11.371 14.932 12.465 1.00 0.00 H new ATOM 0 HD2 LYS B 59 -9.693 15.502 10.757 1.00 0.00 H new ATOM 0 HD3 LYS B 59 -9.363 17.027 11.554 1.00 0.00 H new ATOM 0 HE2 LYS B 59 -8.419 15.941 13.477 1.00 0.00 H new ATOM 0 HE3 LYS B 59 -9.059 14.379 13.007 1.00 0.00 H new ATOM 0 HZ1 LYS B 59 -6.788 14.367 12.461 1.00 0.00 H new ATOM 0 HZ2 LYS B 59 -7.598 14.556 10.980 1.00 0.00 H new ATOM 0 HZ3 LYS B 59 -6.856 15.893 11.719 1.00 0.00 H new ATOM 2113 N SER B 60 -14.877 17.092 10.010 1.00 0.00 N ATOM 2114 CA SER B 60 -15.862 17.931 9.345 1.00 0.00 C ATOM 2115 C SER B 60 -17.222 17.825 10.037 1.00 0.00 C ATOM 2116 O SER B 60 -17.886 18.831 10.274 1.00 0.00 O ATOM 2117 CB SER B 60 -15.984 17.548 7.869 1.00 0.00 C ATOM 2118 OG SER B 60 -14.728 17.635 7.213 1.00 0.00 O ATOM 0 H SER B 60 -14.520 16.325 9.441 1.00 0.00 H new ATOM 0 HA SER B 60 -15.525 18.966 9.409 1.00 0.00 H new ATOM 0 HB2 SER B 60 -16.372 16.533 7.784 1.00 0.00 H new ATOM 0 HB3 SER B 60 -16.701 18.206 7.377 1.00 0.00 H new ATOM 0 HG SER B 60 -14.094 17.019 7.636 1.00 0.00 H new ATOM 2124 N THR B 61 -17.620 16.608 10.387 1.00 0.00 N ATOM 2125 CA THR B 61 -18.900 16.397 11.051 1.00 0.00 C ATOM 2126 C THR B 61 -18.842 16.868 12.503 1.00 0.00 C ATOM 2127 O THR B 61 -19.869 17.199 13.087 1.00 0.00 O ATOM 2128 CB THR B 61 -19.366 14.921 10.989 1.00 0.00 C ATOM 2129 OG1 THR B 61 -20.718 14.819 11.438 1.00 0.00 O ATOM 2130 CG2 THR B 61 -18.491 14.017 11.842 1.00 0.00 C ATOM 0 H THR B 61 -17.080 15.758 10.224 1.00 0.00 H new ATOM 0 HA THR B 61 -19.634 16.993 10.509 1.00 0.00 H new ATOM 0 HB THR B 61 -19.287 14.596 9.952 1.00 0.00 H new ATOM 0 HG1 THR B 61 -21.007 13.884 11.395 1.00 0.00 H new ATOM 0 HG21 THR B 61 -18.851 12.990 11.772 1.00 0.00 H new ATOM 0 HG22 THR B 61 -17.462 14.066 11.487 1.00 0.00 H new ATOM 0 HG23 THR B 61 -18.532 14.345 12.881 1.00 0.00 H new