USER MOD reduce.3.24.130724 H: found=0, std=0, add=1204, rem=0, adj=45 USER MOD reduce.3.24.130724 removed 1204 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 7 THR OG1 : rot -176:sc= 0.349 USER MOD Set 1.2: B 9 THR OG1 : rot 180:sc= 0.0249 USER MOD Set 2.1: A 6 LYS NZ :NH3+ 127:sc= 1.21 (180deg=0) USER MOD Set 2.2: A 46 GLN : amide:sc= 0.521 K(o=1.7,f=-14!) USER MOD Single : A 1 MET CE :methyl 159:sc= -0.159 (180deg=-0.755) USER MOD Single : A 1 MET N :NH3+ 148:sc= 1.39 (180deg=0.582) USER MOD Single : A 3 SER OG : rot 180:sc= 0.0397 USER MOD Single : A 4 LYS NZ :NH3+ -167:sc= -0.0143 (180deg=-0.191) USER MOD Single : A 5 SER OG : rot 180:sc= 0.00119 USER MOD Single : A 7 LYS NZ :NH3+ -165:sc= 0.08! (180deg=-0.55!) USER MOD Single : A 12 GLN : amide:sc= -0.0218 X(o=-0.022,f=-0.021) USER MOD Single : A 13 TYR OH : rot 180:sc= 0 USER MOD Single : A 16 MET CE :methyl 156:sc= -0.226 (180deg=-0.949) USER MOD Single : A 19 SER OG : rot 69:sc= 1.01 USER MOD Single : A 20 GLN : amide:sc= 0 X(o=0,f=-0.092) USER MOD Single : A 24 THR OG1 : rot 180:sc= 0.104 USER MOD Single : A 26 LYS NZ :NH3+ 165:sc= -0.0293 (180deg=-0.227) USER MOD Single : A 27 SER OG : rot -119:sc= 0.433 USER MOD Single : A 30 LYS NZ :NH3+ -154:sc= -0.131 (180deg=-0.63) USER MOD Single : A 32 TYR OH : rot 180:sc= 0 USER MOD Single : A 37 LYS NZ :NH3+ 168:sc= -0.0316 (180deg=-0.2) USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 40 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.00202) USER MOD Single : A 44 MET CE :methyl 133:sc= -0.236 (180deg=-0.979) USER MOD Single : A 45 CYS SG : rot -50:sc= -2.81! USER MOD Single : A 50 SER OG : rot 180:sc= -0.855 USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 SER OG : rot 180:sc= -0.637 USER MOD Single : A 59 GLN : amide:sc= -1.5! C(o=-1.5!,f=-7.8!) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 LYS NZ :NH3+ -141:sc= 1.18 (180deg=0.177!) USER MOD Single : A 69 HIS : no HD1:sc= -0.151 X(o=-0.15,f=-0.14) USER MOD Single : A 70 THR OG1 : rot 180:sc= 0 USER MOD Single : B 1 MET CE :methyl -168:sc= 0 (180deg=-0.0273) USER MOD Single : B 1 MET N :NH3+ 177:sc= 2.1 (180deg=1.85) USER MOD Single : B 2 GLN : amide:sc= 0 X(o=0,f=-0.38) USER MOD Single : B 6 LYS NZ :NH3+ 153:sc= 0.0944 (180deg=0.00138) USER MOD Single : B 11 LYS NZ :NH3+ 168:sc= -0.0117 (180deg=-0.128) USER MOD Single : B 12 THR OG1 : rot 180:sc= 0 USER MOD Single : B 14 THR OG1 : rot 180:sc= 0 USER MOD Single : B 19 SER OG : rot 180:sc= 0 USER MOD Single : B 20 SER OG : rot 180:sc= 0 USER MOD Single : B 22 THR OG1 : rot 180:sc= 0.386 USER MOD Single : B 25 ASN : amide:sc= -0.514 K(o=-0.51,f=-1.6) USER MOD Single : B 27 LYS NZ :NH3+ 154:sc= 2.03 (180deg=1.75) USER MOD Single : B 28 SER OG : rot 180:sc= 0 USER MOD Single : B 29 LYS NZ :NH3+ 171:sc= 1.18 (180deg=0.73) USER MOD Single : B 31 GLN : amide:sc= -0.152 K(o=-0.15,f=-1) USER MOD Single : B 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 40 GLN : amide:sc= -2.75! K(o=-2.7!,f=-1) USER MOD Single : B 41 GLN : amide:sc= -0.247 K(o=-0.25,f=-3.8!) USER MOD Single : B 48 LYS NZ :NH3+ -174:sc= 1.26 (180deg=1.23) USER MOD Single : B 49 GLN : amide:sc= 0.35 K(o=0.35,f=-0.49) USER MOD Single : B 55 THR OG1 : rot -59:sc= 1.25 USER MOD Single : B 57 SER OG : rot 180:sc= 0 USER MOD Single : B 59 TYR OH : rot 30:sc= -0.28 USER MOD Single : B 60 ASN : amide:sc= -1.39 K(o=-1.4,f=-0.0043) USER MOD Single : B 62 GLN : amide:sc= -0.716 K(o=-0.72,f=0) USER MOD Single : B 63 LYS NZ :NH3+ -170:sc= 0 (180deg=-0.089) USER MOD Single : B 65 SER OG : rot -105:sc= 1.26 USER MOD Single : B 66 THR OG1 : rot 180:sc= 0 USER MOD Single : B 68 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -30.094 7.254 -7.676 1.00 0.00 N ATOM 2 CA MET A 1 -30.372 5.867 -7.236 1.00 0.00 C ATOM 3 C MET A 1 -29.342 5.430 -6.208 1.00 0.00 C ATOM 4 O MET A 1 -28.236 5.020 -6.561 1.00 0.00 O ATOM 5 CB MET A 1 -30.357 4.894 -8.423 1.00 0.00 C ATOM 6 CG MET A 1 -31.470 5.124 -9.433 1.00 0.00 C ATOM 7 SD MET A 1 -31.235 6.618 -10.418 1.00 0.00 S ATOM 8 CE MET A 1 -29.739 6.201 -11.313 1.00 0.00 C ATOM 0 H1 MET A 1 -30.383 7.368 -8.669 1.00 0.00 H new ATOM 0 H2 MET A 1 -30.627 7.920 -7.082 1.00 0.00 H new ATOM 0 H3 MET A 1 -29.076 7.449 -7.587 1.00 0.00 H new ATOM 0 HA MET A 1 -31.366 5.850 -6.789 1.00 0.00 H new ATOM 0 HB2 MET A 1 -29.397 4.975 -8.933 1.00 0.00 H new ATOM 0 HB3 MET A 1 -30.431 3.875 -8.044 1.00 0.00 H new ATOM 0 HG2 MET A 1 -31.532 4.263 -10.099 1.00 0.00 H new ATOM 0 HG3 MET A 1 -32.422 5.189 -8.907 1.00 0.00 H new ATOM 0 HE1 MET A 1 -29.664 6.821 -12.206 1.00 0.00 H new ATOM 0 HE2 MET A 1 -28.873 6.377 -10.676 1.00 0.00 H new ATOM 0 HE3 MET A 1 -29.769 5.151 -11.602 1.00 0.00 H new ATOM 20 N ALA A 2 -29.700 5.538 -4.938 1.00 0.00 N ATOM 21 CA ALA A 2 -28.804 5.171 -3.857 1.00 0.00 C ATOM 22 C ALA A 2 -29.578 4.963 -2.564 1.00 0.00 C ATOM 23 O ALA A 2 -30.237 5.876 -2.067 1.00 0.00 O ATOM 24 CB ALA A 2 -27.732 6.235 -3.665 1.00 0.00 C ATOM 0 H ALA A 2 -30.611 5.879 -4.631 1.00 0.00 H new ATOM 0 HA ALA A 2 -28.318 4.232 -4.123 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -27.070 5.942 -2.850 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -27.154 6.339 -4.583 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -28.204 7.188 -3.424 1.00 0.00 H new ATOM 30 N SER A 3 -29.491 3.758 -2.025 1.00 0.00 N ATOM 31 CA SER A 3 -30.129 3.427 -0.760 1.00 0.00 C ATOM 32 C SER A 3 -29.200 3.756 0.406 1.00 0.00 C ATOM 33 O SER A 3 -29.391 3.273 1.524 1.00 0.00 O ATOM 34 CB SER A 3 -30.474 1.939 -0.755 1.00 0.00 C ATOM 35 OG SER A 3 -29.374 1.175 -1.225 1.00 0.00 O ATOM 0 H SER A 3 -28.979 2.985 -2.449 1.00 0.00 H new ATOM 0 HA SER A 3 -31.039 4.016 -0.646 1.00 0.00 H new ATOM 0 HB2 SER A 3 -30.739 1.624 0.254 1.00 0.00 H new ATOM 0 HB3 SER A 3 -31.346 1.759 -1.384 1.00 0.00 H new ATOM 0 HG SER A 3 -29.608 0.224 -1.215 1.00 0.00 H new ATOM 41 N LYS A 4 -28.217 4.613 0.128 1.00 0.00 N ATOM 42 CA LYS A 4 -27.145 4.925 1.066 1.00 0.00 C ATOM 43 C LYS A 4 -26.381 3.653 1.417 1.00 0.00 C ATOM 44 O LYS A 4 -26.635 3.011 2.438 1.00 0.00 O ATOM 45 CB LYS A 4 -27.678 5.616 2.329 1.00 0.00 C ATOM 46 CG LYS A 4 -26.588 6.079 3.288 1.00 0.00 C ATOM 47 CD LYS A 4 -25.635 7.065 2.629 1.00 0.00 C ATOM 48 CE LYS A 4 -24.577 7.565 3.604 1.00 0.00 C ATOM 49 NZ LYS A 4 -25.172 8.337 4.729 1.00 0.00 N ATOM 0 H LYS A 4 -28.144 5.111 -0.759 1.00 0.00 H new ATOM 0 HA LYS A 4 -26.463 5.627 0.585 1.00 0.00 H new ATOM 0 HB2 LYS A 4 -28.278 6.477 2.034 1.00 0.00 H new ATOM 0 HB3 LYS A 4 -28.342 4.929 2.854 1.00 0.00 H new ATOM 0 HG2 LYS A 4 -27.046 6.545 4.161 1.00 0.00 H new ATOM 0 HG3 LYS A 4 -26.027 5.215 3.645 1.00 0.00 H new ATOM 0 HD2 LYS A 4 -25.149 6.588 1.778 1.00 0.00 H new ATOM 0 HD3 LYS A 4 -26.200 7.912 2.239 1.00 0.00 H new ATOM 0 HE2 LYS A 4 -24.021 6.716 4.002 1.00 0.00 H new ATOM 0 HE3 LYS A 4 -23.862 8.193 3.072 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 -24.420 8.840 5.241 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 -25.856 9.025 4.354 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 -25.657 7.686 5.379 1.00 0.00 H new ATOM 63 N SER A 5 -25.473 3.275 0.535 1.00 0.00 N ATOM 64 CA SER A 5 -24.692 2.067 0.716 1.00 0.00 C ATOM 65 C SER A 5 -23.387 2.394 1.437 1.00 0.00 C ATOM 66 O SER A 5 -23.071 3.561 1.668 1.00 0.00 O ATOM 67 CB SER A 5 -24.420 1.406 -0.644 1.00 0.00 C ATOM 68 OG SER A 5 -23.826 0.125 -0.492 1.00 0.00 O ATOM 0 H SER A 5 -25.258 3.791 -0.318 1.00 0.00 H new ATOM 0 HA SER A 5 -25.255 1.363 1.329 1.00 0.00 H new ATOM 0 HB2 SER A 5 -25.355 1.311 -1.197 1.00 0.00 H new ATOM 0 HB3 SER A 5 -23.763 2.045 -1.235 1.00 0.00 H new ATOM 0 HG SER A 5 -23.667 -0.269 -1.375 1.00 0.00 H new ATOM 74 N LYS A 6 -22.626 1.364 1.762 1.00 0.00 N ATOM 75 CA LYS A 6 -21.412 1.516 2.555 1.00 0.00 C ATOM 76 C LYS A 6 -20.197 1.760 1.667 1.00 0.00 C ATOM 77 O LYS A 6 -19.091 1.324 1.989 1.00 0.00 O ATOM 78 CB LYS A 6 -21.205 0.270 3.413 1.00 0.00 C ATOM 79 CG LYS A 6 -22.239 0.127 4.516 1.00 0.00 C ATOM 80 CD LYS A 6 -22.170 -1.236 5.184 1.00 0.00 C ATOM 81 CE LYS A 6 -20.770 -1.550 5.686 1.00 0.00 C ATOM 82 NZ LYS A 6 -20.738 -2.800 6.485 1.00 0.00 N ATOM 0 H LYS A 6 -22.828 0.403 1.487 1.00 0.00 H new ATOM 0 HA LYS A 6 -21.526 2.386 3.201 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -21.239 -0.613 2.775 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -20.210 0.304 3.858 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -22.083 0.906 5.263 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -23.236 0.278 4.101 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -22.871 -1.267 6.018 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -22.483 -2.004 4.476 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -20.092 -1.644 4.838 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -20.407 -0.721 6.294 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -20.009 -3.437 6.104 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -20.516 -2.573 7.475 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -21.666 -3.267 6.436 1.00 0.00 H new ATOM 96 N LYS A 7 -20.419 2.494 0.572 1.00 0.00 N ATOM 97 CA LYS A 7 -19.376 2.836 -0.393 1.00 0.00 C ATOM 98 C LYS A 7 -18.819 1.598 -1.096 1.00 0.00 C ATOM 99 O LYS A 7 -18.506 0.593 -0.466 1.00 0.00 O ATOM 100 CB LYS A 7 -18.256 3.601 0.303 1.00 0.00 C ATOM 101 CG LYS A 7 -18.680 4.948 0.865 1.00 0.00 C ATOM 102 CD LYS A 7 -17.595 5.533 1.753 1.00 0.00 C ATOM 103 CE LYS A 7 -18.005 6.879 2.322 1.00 0.00 C ATOM 104 NZ LYS A 7 -16.988 7.410 3.266 1.00 0.00 N ATOM 0 H LYS A 7 -21.336 2.869 0.331 1.00 0.00 H new ATOM 0 HA LYS A 7 -19.825 3.468 -1.159 1.00 0.00 H new ATOM 0 HB2 LYS A 7 -17.862 2.989 1.114 1.00 0.00 H new ATOM 0 HB3 LYS A 7 -17.441 3.755 -0.405 1.00 0.00 H new ATOM 0 HG2 LYS A 7 -18.896 5.636 0.047 1.00 0.00 H new ATOM 0 HG3 LYS A 7 -19.601 4.834 1.437 1.00 0.00 H new ATOM 0 HD2 LYS A 7 -17.380 4.843 2.569 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -16.675 5.645 1.179 1.00 0.00 H new ATOM 0 HE2 LYS A 7 -18.151 7.589 1.508 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -18.962 6.781 2.835 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 -17.401 8.186 3.821 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 -16.680 6.651 3.907 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 -16.170 7.765 2.731 1.00 0.00 H new ATOM 118 N ARG A 8 -18.695 1.669 -2.409 1.00 0.00 N ATOM 119 CA ARG A 8 -18.183 0.542 -3.169 1.00 0.00 C ATOM 120 C ARG A 8 -16.809 0.861 -3.736 1.00 0.00 C ATOM 121 O ARG A 8 -16.566 1.966 -4.226 1.00 0.00 O ATOM 122 CB ARG A 8 -19.139 0.156 -4.298 1.00 0.00 C ATOM 123 CG ARG A 8 -20.559 -0.113 -3.826 1.00 0.00 C ATOM 124 CD ARG A 8 -21.328 -0.966 -4.821 1.00 0.00 C ATOM 125 NE ARG A 8 -21.370 -0.377 -6.158 1.00 0.00 N ATOM 126 CZ ARG A 8 -21.924 -0.980 -7.210 1.00 0.00 C ATOM 127 NH1 ARG A 8 -22.489 -2.173 -7.076 1.00 0.00 N ATOM 128 NH2 ARG A 8 -21.922 -0.388 -8.396 1.00 0.00 N ATOM 0 H ARG A 8 -18.939 2.487 -2.968 1.00 0.00 H new ATOM 0 HA ARG A 8 -18.098 -0.306 -2.489 1.00 0.00 H new ATOM 0 HB2 ARG A 8 -19.156 0.956 -5.038 1.00 0.00 H new ATOM 0 HB3 ARG A 8 -18.757 -0.733 -4.799 1.00 0.00 H new ATOM 0 HG2 ARG A 8 -20.532 -0.616 -2.859 1.00 0.00 H new ATOM 0 HG3 ARG A 8 -21.079 0.833 -3.679 1.00 0.00 H new ATOM 0 HD2 ARG A 8 -20.869 -1.953 -4.878 1.00 0.00 H new ATOM 0 HD3 ARG A 8 -22.346 -1.109 -4.460 1.00 0.00 H new ATOM 0 HE ARG A 8 -20.953 0.544 -6.293 1.00 0.00 H new ATOM 0 HH11 ARG A 8 -22.501 -2.632 -6.165 1.00 0.00 H new ATOM 0 HH12 ARG A 8 -22.912 -2.631 -7.884 1.00 0.00 H new ATOM 0 HH21 ARG A 8 -21.496 0.532 -8.506 1.00 0.00 H new ATOM 0 HH22 ARG A 8 -22.347 -0.853 -9.199 1.00 0.00 H new ATOM 142 N GLY A 9 -15.914 -0.104 -3.651 1.00 0.00 N ATOM 143 CA GLY A 9 -14.589 0.064 -4.197 1.00 0.00 C ATOM 144 C GLY A 9 -14.118 -1.174 -4.925 1.00 0.00 C ATOM 145 O GLY A 9 -14.553 -2.289 -4.619 1.00 0.00 O ATOM 0 H GLY A 9 -16.083 -1.008 -3.210 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -14.583 0.912 -4.882 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -13.892 0.299 -3.393 1.00 0.00 H new ATOM 149 N ILE A 10 -13.243 -0.978 -5.898 1.00 0.00 N ATOM 150 CA ILE A 10 -12.658 -2.083 -6.638 1.00 0.00 C ATOM 151 C ILE A 10 -11.184 -2.196 -6.287 1.00 0.00 C ATOM 152 O ILE A 10 -10.390 -1.314 -6.617 1.00 0.00 O ATOM 153 CB ILE A 10 -12.805 -1.899 -8.168 1.00 0.00 C ATOM 154 CG1 ILE A 10 -14.277 -1.732 -8.556 1.00 0.00 C ATOM 155 CG2 ILE A 10 -12.188 -3.076 -8.912 1.00 0.00 C ATOM 156 CD1 ILE A 10 -15.153 -2.897 -8.147 1.00 0.00 C ATOM 0 H ILE A 10 -12.921 -0.057 -6.195 1.00 0.00 H new ATOM 0 HA ILE A 10 -13.191 -2.992 -6.358 1.00 0.00 H new ATOM 0 HB ILE A 10 -12.271 -0.993 -8.453 1.00 0.00 H new ATOM 0 HG12 ILE A 10 -14.663 -0.821 -8.098 1.00 0.00 H new ATOM 0 HG13 ILE A 10 -14.346 -1.599 -9.636 1.00 0.00 H new ATOM 0 HG21 ILE A 10 -12.302 -2.928 -9.986 1.00 0.00 H new ATOM 0 HG22 ILE A 10 -11.129 -3.147 -8.666 1.00 0.00 H new ATOM 0 HG23 ILE A 10 -12.692 -3.997 -8.618 1.00 0.00 H new ATOM 0 HD11 ILE A 10 -16.181 -2.705 -8.456 1.00 0.00 H new ATOM 0 HD12 ILE A 10 -14.794 -3.808 -8.626 1.00 0.00 H new ATOM 0 HD13 ILE A 10 -15.116 -3.018 -7.064 1.00 0.00 H new ATOM 168 N VAL A 11 -10.825 -3.261 -5.596 1.00 0.00 N ATOM 169 CA VAL A 11 -9.449 -3.452 -5.180 1.00 0.00 C ATOM 170 C VAL A 11 -8.562 -3.829 -6.368 1.00 0.00 C ATOM 171 O VAL A 11 -8.842 -4.779 -7.099 1.00 0.00 O ATOM 172 CB VAL A 11 -9.339 -4.495 -4.049 1.00 0.00 C ATOM 173 CG1 VAL A 11 -10.101 -5.756 -4.393 1.00 0.00 C ATOM 174 CG2 VAL A 11 -7.888 -4.816 -3.749 1.00 0.00 C ATOM 0 H VAL A 11 -11.464 -4.004 -5.312 1.00 0.00 H new ATOM 0 HA VAL A 11 -9.091 -2.502 -4.783 1.00 0.00 H new ATOM 0 HB VAL A 11 -9.787 -4.062 -3.155 1.00 0.00 H new ATOM 0 HG11 VAL A 11 -10.005 -6.473 -3.577 1.00 0.00 H new ATOM 0 HG12 VAL A 11 -11.153 -5.516 -4.543 1.00 0.00 H new ATOM 0 HG13 VAL A 11 -9.694 -6.189 -5.307 1.00 0.00 H new ATOM 0 HG21 VAL A 11 -7.837 -5.554 -2.948 1.00 0.00 H new ATOM 0 HG22 VAL A 11 -7.412 -5.218 -4.643 1.00 0.00 H new ATOM 0 HG23 VAL A 11 -7.371 -3.908 -3.439 1.00 0.00 H new ATOM 184 N GLN A 12 -7.503 -3.048 -6.558 1.00 0.00 N ATOM 185 CA GLN A 12 -6.619 -3.193 -7.707 1.00 0.00 C ATOM 186 C GLN A 12 -5.526 -4.233 -7.460 1.00 0.00 C ATOM 187 O GLN A 12 -5.223 -5.045 -8.334 1.00 0.00 O ATOM 188 CB GLN A 12 -5.973 -1.844 -8.043 1.00 0.00 C ATOM 189 CG GLN A 12 -6.972 -0.741 -8.361 1.00 0.00 C ATOM 190 CD GLN A 12 -7.775 -1.031 -9.612 1.00 0.00 C ATOM 191 OE1 GLN A 12 -7.376 -0.669 -10.719 1.00 0.00 O ATOM 192 NE2 GLN A 12 -8.919 -1.671 -9.444 1.00 0.00 N ATOM 0 H GLN A 12 -7.235 -2.298 -5.920 1.00 0.00 H new ATOM 0 HA GLN A 12 -7.226 -3.536 -8.545 1.00 0.00 H new ATOM 0 HB2 GLN A 12 -5.355 -1.529 -7.202 1.00 0.00 H new ATOM 0 HB3 GLN A 12 -5.307 -1.974 -8.896 1.00 0.00 H new ATOM 0 HG2 GLN A 12 -7.651 -0.616 -7.518 1.00 0.00 H new ATOM 0 HG3 GLN A 12 -6.440 0.202 -8.485 1.00 0.00 H new ATOM 0 HE21 GLN A 12 -9.213 -1.953 -8.509 1.00 0.00 H new ATOM 0 HE22 GLN A 12 -9.508 -1.883 -10.249 1.00 0.00 H new ATOM 201 N TYR A 13 -4.932 -4.199 -6.276 1.00 0.00 N ATOM 202 CA TYR A 13 -3.817 -5.086 -5.957 1.00 0.00 C ATOM 203 C TYR A 13 -4.279 -6.244 -5.083 1.00 0.00 C ATOM 204 O TYR A 13 -5.462 -6.369 -4.776 1.00 0.00 O ATOM 205 CB TYR A 13 -2.706 -4.324 -5.229 1.00 0.00 C ATOM 206 CG TYR A 13 -2.158 -3.126 -5.972 1.00 0.00 C ATOM 207 CD1 TYR A 13 -2.715 -1.866 -5.796 1.00 0.00 C ATOM 208 CD2 TYR A 13 -1.074 -3.249 -6.831 1.00 0.00 C ATOM 209 CE1 TYR A 13 -2.209 -0.765 -6.455 1.00 0.00 C ATOM 210 CE2 TYR A 13 -0.558 -2.150 -7.490 1.00 0.00 C ATOM 211 CZ TYR A 13 -1.132 -0.911 -7.300 1.00 0.00 C ATOM 212 OH TYR A 13 -0.620 0.187 -7.948 1.00 0.00 O ATOM 0 H TYR A 13 -5.201 -3.569 -5.520 1.00 0.00 H new ATOM 0 HA TYR A 13 -3.430 -5.476 -6.898 1.00 0.00 H new ATOM 0 HB2 TYR A 13 -3.087 -3.990 -4.264 1.00 0.00 H new ATOM 0 HB3 TYR A 13 -1.886 -5.013 -5.027 1.00 0.00 H new ATOM 0 HD1 TYR A 13 -3.558 -1.746 -5.132 1.00 0.00 H new ATOM 0 HD2 TYR A 13 -0.627 -4.220 -6.986 1.00 0.00 H new ATOM 0 HE1 TYR A 13 -2.656 0.207 -6.309 1.00 0.00 H new ATOM 0 HE2 TYR A 13 0.290 -2.261 -8.150 1.00 0.00 H new ATOM 0 HH TYR A 13 0.138 -0.086 -8.505 1.00 0.00 H new ATOM 222 N ASP A 14 -3.336 -7.085 -4.689 1.00 0.00 N ATOM 223 CA ASP A 14 -3.612 -8.189 -3.780 1.00 0.00 C ATOM 224 C ASP A 14 -2.843 -7.972 -2.485 1.00 0.00 C ATOM 225 O ASP A 14 -1.636 -7.741 -2.512 1.00 0.00 O ATOM 226 CB ASP A 14 -3.209 -9.528 -4.411 1.00 0.00 C ATOM 227 CG ASP A 14 -3.901 -9.784 -5.737 1.00 0.00 C ATOM 228 OD1 ASP A 14 -3.387 -9.318 -6.780 1.00 0.00 O ATOM 229 OD2 ASP A 14 -4.961 -10.450 -5.751 1.00 0.00 O ATOM 0 H ASP A 14 -2.363 -7.023 -4.988 1.00 0.00 H new ATOM 0 HA ASP A 14 -4.682 -8.220 -3.574 1.00 0.00 H new ATOM 0 HB2 ASP A 14 -2.129 -9.544 -4.561 1.00 0.00 H new ATOM 0 HB3 ASP A 14 -3.447 -10.337 -3.720 1.00 0.00 H new ATOM 234 N PHE A 15 -3.533 -8.037 -1.358 1.00 0.00 N ATOM 235 CA PHE A 15 -2.908 -7.745 -0.074 1.00 0.00 C ATOM 236 C PHE A 15 -3.152 -8.876 0.911 1.00 0.00 C ATOM 237 O PHE A 15 -4.262 -9.399 1.003 1.00 0.00 O ATOM 238 CB PHE A 15 -3.442 -6.423 0.495 1.00 0.00 C ATOM 239 CG PHE A 15 -2.747 -5.964 1.746 1.00 0.00 C ATOM 240 CD1 PHE A 15 -1.439 -5.507 1.698 1.00 0.00 C ATOM 241 CD2 PHE A 15 -3.401 -5.981 2.968 1.00 0.00 C ATOM 242 CE1 PHE A 15 -0.798 -5.077 2.843 1.00 0.00 C ATOM 243 CE2 PHE A 15 -2.763 -5.553 4.118 1.00 0.00 C ATOM 244 CZ PHE A 15 -1.460 -5.101 4.055 1.00 0.00 C ATOM 0 H PHE A 15 -4.520 -8.288 -1.304 1.00 0.00 H new ATOM 0 HA PHE A 15 -1.834 -7.649 -0.232 1.00 0.00 H new ATOM 0 HB2 PHE A 15 -3.346 -5.648 -0.266 1.00 0.00 H new ATOM 0 HB3 PHE A 15 -4.506 -6.534 0.704 1.00 0.00 H new ATOM 0 HD1 PHE A 15 -0.915 -5.487 0.754 1.00 0.00 H new ATOM 0 HD2 PHE A 15 -4.421 -6.333 3.023 1.00 0.00 H new ATOM 0 HE1 PHE A 15 0.221 -4.722 2.791 1.00 0.00 H new ATOM 0 HE2 PHE A 15 -3.283 -5.572 5.064 1.00 0.00 H new ATOM 0 HZ PHE A 15 -0.959 -4.767 4.952 1.00 0.00 H new ATOM 254 N MET A 16 -2.109 -9.253 1.636 1.00 0.00 N ATOM 255 CA MET A 16 -2.216 -10.288 2.652 1.00 0.00 C ATOM 256 C MET A 16 -2.244 -9.659 4.034 1.00 0.00 C ATOM 257 O MET A 16 -1.547 -8.681 4.294 1.00 0.00 O ATOM 258 CB MET A 16 -1.051 -11.273 2.550 1.00 0.00 C ATOM 259 CG MET A 16 -1.028 -12.059 1.250 1.00 0.00 C ATOM 260 SD MET A 16 0.319 -13.255 1.189 1.00 0.00 S ATOM 261 CE MET A 16 -0.089 -14.289 2.594 1.00 0.00 C ATOM 0 H MET A 16 -1.175 -8.855 1.538 1.00 0.00 H new ATOM 0 HA MET A 16 -3.144 -10.835 2.488 1.00 0.00 H new ATOM 0 HB2 MET A 16 -0.114 -10.725 2.650 1.00 0.00 H new ATOM 0 HB3 MET A 16 -1.103 -11.971 3.386 1.00 0.00 H new ATOM 0 HG2 MET A 16 -1.978 -12.580 1.127 1.00 0.00 H new ATOM 0 HG3 MET A 16 -0.933 -11.367 0.413 1.00 0.00 H new ATOM 0 HE1 MET A 16 0.353 -15.276 2.460 1.00 0.00 H new ATOM 0 HE2 MET A 16 0.303 -13.837 3.505 1.00 0.00 H new ATOM 0 HE3 MET A 16 -1.172 -14.384 2.673 1.00 0.00 H new ATOM 271 N ALA A 17 -3.053 -10.220 4.916 1.00 0.00 N ATOM 272 CA ALA A 17 -3.194 -9.680 6.256 1.00 0.00 C ATOM 273 C ALA A 17 -2.338 -10.446 7.251 1.00 0.00 C ATOM 274 O ALA A 17 -2.598 -11.617 7.528 1.00 0.00 O ATOM 275 CB ALA A 17 -4.651 -9.717 6.688 1.00 0.00 C ATOM 0 H ALA A 17 -3.620 -11.047 4.729 1.00 0.00 H new ATOM 0 HA ALA A 17 -2.852 -8.645 6.238 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -4.742 -9.309 7.695 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -5.250 -9.121 5.999 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -5.007 -10.747 6.680 1.00 0.00 H new ATOM 281 N GLU A 18 -1.315 -9.789 7.779 1.00 0.00 N ATOM 282 CA GLU A 18 -0.485 -10.394 8.807 1.00 0.00 C ATOM 283 C GLU A 18 -0.971 -9.957 10.186 1.00 0.00 C ATOM 284 O GLU A 18 -0.892 -10.708 11.157 1.00 0.00 O ATOM 285 CB GLU A 18 0.985 -10.017 8.618 1.00 0.00 C ATOM 286 CG GLU A 18 1.923 -10.765 9.553 1.00 0.00 C ATOM 287 CD GLU A 18 3.381 -10.432 9.316 1.00 0.00 C ATOM 288 OE1 GLU A 18 3.924 -10.842 8.273 1.00 0.00 O ATOM 289 OE2 GLU A 18 3.994 -9.775 10.184 1.00 0.00 O ATOM 0 H GLU A 18 -1.042 -8.843 7.514 1.00 0.00 H new ATOM 0 HA GLU A 18 -0.567 -11.478 8.724 1.00 0.00 H new ATOM 0 HB2 GLU A 18 1.275 -10.218 7.587 1.00 0.00 H new ATOM 0 HB3 GLU A 18 1.102 -8.945 8.779 1.00 0.00 H new ATOM 0 HG2 GLU A 18 1.665 -10.528 10.585 1.00 0.00 H new ATOM 0 HG3 GLU A 18 1.775 -11.837 9.426 1.00 0.00 H new ATOM 296 N SER A 19 -1.483 -8.737 10.267 1.00 0.00 N ATOM 297 CA SER A 19 -2.021 -8.230 11.517 1.00 0.00 C ATOM 298 C SER A 19 -3.482 -8.641 11.658 1.00 0.00 C ATOM 299 O SER A 19 -4.111 -9.072 10.689 1.00 0.00 O ATOM 300 CB SER A 19 -1.894 -6.707 11.576 1.00 0.00 C ATOM 301 OG SER A 19 -0.626 -6.283 11.101 1.00 0.00 O ATOM 0 H SER A 19 -1.536 -8.084 9.485 1.00 0.00 H new ATOM 0 HA SER A 19 -1.450 -8.656 12.342 1.00 0.00 H new ATOM 0 HB2 SER A 19 -2.682 -6.250 10.978 1.00 0.00 H new ATOM 0 HB3 SER A 19 -2.034 -6.366 12.602 1.00 0.00 H new ATOM 0 HG SER A 19 -0.567 -6.444 10.136 1.00 0.00 H new ATOM 307 N GLN A 20 -4.021 -8.492 12.858 1.00 0.00 N ATOM 308 CA GLN A 20 -5.395 -8.887 13.136 1.00 0.00 C ATOM 309 C GLN A 20 -6.357 -7.841 12.576 1.00 0.00 C ATOM 310 O GLN A 20 -7.498 -8.141 12.235 1.00 0.00 O ATOM 311 CB GLN A 20 -5.581 -9.037 14.651 1.00 0.00 C ATOM 312 CG GLN A 20 -6.457 -10.210 15.075 1.00 0.00 C ATOM 313 CD GLN A 20 -7.916 -10.045 14.694 1.00 0.00 C ATOM 314 OE1 GLN A 20 -8.350 -10.487 13.630 1.00 0.00 O ATOM 315 NE2 GLN A 20 -8.678 -9.399 15.562 1.00 0.00 N ATOM 0 H GLN A 20 -3.526 -8.099 13.659 1.00 0.00 H new ATOM 0 HA GLN A 20 -5.609 -9.842 12.657 1.00 0.00 H new ATOM 0 HB2 GLN A 20 -4.600 -9.148 15.114 1.00 0.00 H new ATOM 0 HB3 GLN A 20 -6.016 -8.117 15.042 1.00 0.00 H new ATOM 0 HG2 GLN A 20 -6.072 -11.123 14.621 1.00 0.00 H new ATOM 0 HG3 GLN A 20 -6.384 -10.336 16.155 1.00 0.00 H new ATOM 0 HE21 GLN A 20 -8.276 -9.050 16.432 1.00 0.00 H new ATOM 0 HE22 GLN A 20 -9.667 -9.251 15.361 1.00 0.00 H new ATOM 324 N ASP A 21 -5.868 -6.612 12.467 1.00 0.00 N ATOM 325 CA ASP A 21 -6.689 -5.487 12.027 1.00 0.00 C ATOM 326 C ASP A 21 -6.672 -5.341 10.509 1.00 0.00 C ATOM 327 O ASP A 21 -7.472 -4.601 9.941 1.00 0.00 O ATOM 328 CB ASP A 21 -6.192 -4.187 12.668 1.00 0.00 C ATOM 329 CG ASP A 21 -6.160 -4.250 14.181 1.00 0.00 C ATOM 330 OD1 ASP A 21 -5.142 -4.706 14.737 1.00 0.00 O ATOM 331 OD2 ASP A 21 -7.149 -3.842 14.824 1.00 0.00 O ATOM 0 H ASP A 21 -4.901 -6.366 12.678 1.00 0.00 H new ATOM 0 HA ASP A 21 -7.714 -5.685 12.342 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -5.191 -3.965 12.298 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -6.837 -3.365 12.357 1.00 0.00 H new ATOM 336 N GLU A 22 -5.759 -6.043 9.852 1.00 0.00 N ATOM 337 CA GLU A 22 -5.616 -5.939 8.404 1.00 0.00 C ATOM 338 C GLU A 22 -6.485 -6.980 7.704 1.00 0.00 C ATOM 339 O GLU A 22 -6.928 -7.946 8.326 1.00 0.00 O ATOM 340 CB GLU A 22 -4.152 -6.108 8.003 1.00 0.00 C ATOM 341 CG GLU A 22 -3.245 -5.032 8.582 1.00 0.00 C ATOM 342 CD GLU A 22 -1.769 -5.290 8.331 1.00 0.00 C ATOM 343 OE1 GLU A 22 -1.317 -6.445 8.509 1.00 0.00 O ATOM 344 OE2 GLU A 22 -1.043 -4.331 8.003 1.00 0.00 O ATOM 0 H GLU A 22 -5.107 -6.690 10.296 1.00 0.00 H new ATOM 0 HA GLU A 22 -5.950 -4.949 8.093 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -3.802 -7.086 8.333 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -4.075 -6.093 6.916 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -3.516 -4.068 8.152 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -3.417 -4.961 9.656 1.00 0.00 H new ATOM 351 N LEU A 23 -6.716 -6.785 6.413 1.00 0.00 N ATOM 352 CA LEU A 23 -7.583 -7.678 5.652 1.00 0.00 C ATOM 353 C LEU A 23 -6.855 -8.251 4.442 1.00 0.00 C ATOM 354 O LEU A 23 -6.020 -7.586 3.834 1.00 0.00 O ATOM 355 CB LEU A 23 -8.838 -6.930 5.194 1.00 0.00 C ATOM 356 CG LEU A 23 -9.871 -7.767 4.434 1.00 0.00 C ATOM 357 CD1 LEU A 23 -10.386 -8.908 5.298 1.00 0.00 C ATOM 358 CD2 LEU A 23 -11.016 -6.882 3.975 1.00 0.00 C ATOM 0 H LEU A 23 -6.317 -6.019 5.871 1.00 0.00 H new ATOM 0 HA LEU A 23 -7.870 -8.504 6.303 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -9.321 -6.499 6.071 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -8.532 -6.100 4.558 1.00 0.00 H new ATOM 0 HG LEU A 23 -9.390 -8.203 3.558 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -11.118 -9.488 4.736 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -9.554 -9.552 5.583 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -10.855 -8.502 6.195 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -11.747 -7.484 3.435 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -11.492 -6.424 4.842 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -10.632 -6.102 3.318 1.00 0.00 H new ATOM 370 N THR A 24 -7.173 -9.494 4.107 1.00 0.00 N ATOM 371 CA THR A 24 -6.632 -10.123 2.918 1.00 0.00 C ATOM 372 C THR A 24 -7.582 -9.894 1.744 1.00 0.00 C ATOM 373 O THR A 24 -8.729 -10.340 1.771 1.00 0.00 O ATOM 374 CB THR A 24 -6.420 -11.634 3.139 1.00 0.00 C ATOM 375 OG1 THR A 24 -5.659 -11.841 4.340 1.00 0.00 O ATOM 376 CG2 THR A 24 -5.691 -12.263 1.960 1.00 0.00 C ATOM 0 H THR A 24 -7.805 -10.085 4.646 1.00 0.00 H new ATOM 0 HA THR A 24 -5.663 -9.675 2.698 1.00 0.00 H new ATOM 0 HB THR A 24 -7.397 -12.108 3.231 1.00 0.00 H new ATOM 0 HG1 THR A 24 -5.526 -12.802 4.481 1.00 0.00 H new ATOM 0 HG21 THR A 24 -5.555 -13.329 2.143 1.00 0.00 H new ATOM 0 HG22 THR A 24 -6.278 -12.123 1.052 1.00 0.00 H new ATOM 0 HG23 THR A 24 -4.717 -11.789 1.839 1.00 0.00 H new ATOM 384 N ILE A 25 -7.109 -9.189 0.730 1.00 0.00 N ATOM 385 CA ILE A 25 -7.953 -8.809 -0.396 1.00 0.00 C ATOM 386 C ILE A 25 -7.382 -9.324 -1.712 1.00 0.00 C ATOM 387 O ILE A 25 -6.163 -9.396 -1.886 1.00 0.00 O ATOM 388 CB ILE A 25 -8.131 -7.276 -0.471 1.00 0.00 C ATOM 389 CG1 ILE A 25 -6.766 -6.582 -0.485 1.00 0.00 C ATOM 390 CG2 ILE A 25 -8.979 -6.785 0.696 1.00 0.00 C ATOM 391 CD1 ILE A 25 -6.846 -5.072 -0.495 1.00 0.00 C ATOM 0 H ILE A 25 -6.144 -8.867 0.661 1.00 0.00 H new ATOM 0 HA ILE A 25 -8.929 -9.267 -0.234 1.00 0.00 H new ATOM 0 HB ILE A 25 -8.649 -7.027 -1.397 1.00 0.00 H new ATOM 0 HG12 ILE A 25 -6.199 -6.900 0.390 1.00 0.00 H new ATOM 0 HG13 ILE A 25 -6.210 -6.912 -1.363 1.00 0.00 H new ATOM 0 HG21 ILE A 25 -9.096 -5.703 0.631 1.00 0.00 H new ATOM 0 HG22 ILE A 25 -9.960 -7.259 0.658 1.00 0.00 H new ATOM 0 HG23 ILE A 25 -8.488 -7.041 1.635 1.00 0.00 H new ATOM 0 HD11 ILE A 25 -5.839 -4.654 -0.505 1.00 0.00 H new ATOM 0 HD12 ILE A 25 -7.384 -4.742 -1.384 1.00 0.00 H new ATOM 0 HD13 ILE A 25 -7.372 -4.730 0.396 1.00 0.00 H new ATOM 403 N LYS A 26 -8.271 -9.693 -2.623 1.00 0.00 N ATOM 404 CA LYS A 26 -7.875 -10.199 -3.932 1.00 0.00 C ATOM 405 C LYS A 26 -8.171 -9.151 -4.993 1.00 0.00 C ATOM 406 O LYS A 26 -9.217 -8.507 -4.944 1.00 0.00 O ATOM 407 CB LYS A 26 -8.648 -11.476 -4.272 1.00 0.00 C ATOM 408 CG LYS A 26 -8.679 -12.509 -3.159 1.00 0.00 C ATOM 409 CD LYS A 26 -9.429 -13.755 -3.601 1.00 0.00 C ATOM 410 CE LYS A 26 -9.676 -14.717 -2.453 1.00 0.00 C ATOM 411 NZ LYS A 26 -10.594 -14.146 -1.434 1.00 0.00 N ATOM 0 H LYS A 26 -9.280 -9.651 -2.479 1.00 0.00 H new ATOM 0 HA LYS A 26 -6.808 -10.421 -3.908 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -9.672 -11.208 -4.530 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -8.204 -11.929 -5.159 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -7.661 -12.774 -2.874 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -9.157 -12.085 -2.276 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -10.383 -13.465 -4.041 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -8.860 -14.262 -4.380 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -10.098 -15.644 -2.842 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -8.726 -14.971 -1.983 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -10.936 -14.905 -0.811 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -10.086 -13.436 -0.868 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -11.403 -13.697 -1.909 1.00 0.00 H new ATOM 425 N SER A 27 -7.271 -8.986 -5.949 1.00 0.00 N ATOM 426 CA SER A 27 -7.463 -8.012 -7.016 1.00 0.00 C ATOM 427 C SER A 27 -8.732 -8.304 -7.817 1.00 0.00 C ATOM 428 O SER A 27 -8.929 -9.416 -8.314 1.00 0.00 O ATOM 429 CB SER A 27 -6.238 -7.997 -7.934 1.00 0.00 C ATOM 430 OG SER A 27 -5.817 -9.314 -8.253 1.00 0.00 O ATOM 0 H SER A 27 -6.400 -9.513 -6.010 1.00 0.00 H new ATOM 0 HA SER A 27 -7.581 -7.028 -6.562 1.00 0.00 H new ATOM 0 HB2 SER A 27 -6.474 -7.456 -8.851 1.00 0.00 H new ATOM 0 HB3 SER A 27 -5.423 -7.460 -7.448 1.00 0.00 H new ATOM 0 HG SER A 27 -4.899 -9.450 -7.937 1.00 0.00 H new ATOM 436 N GLY A 28 -9.601 -7.309 -7.915 1.00 0.00 N ATOM 437 CA GLY A 28 -10.827 -7.468 -8.667 1.00 0.00 C ATOM 438 C GLY A 28 -11.999 -7.869 -7.795 1.00 0.00 C ATOM 439 O GLY A 28 -13.107 -8.075 -8.294 1.00 0.00 O ATOM 0 H GLY A 28 -9.478 -6.392 -7.486 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -11.061 -6.533 -9.175 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -10.679 -8.222 -9.440 1.00 0.00 H new ATOM 443 N ASP A 29 -11.769 -7.989 -6.493 1.00 0.00 N ATOM 444 CA ASP A 29 -12.845 -8.336 -5.572 1.00 0.00 C ATOM 445 C ASP A 29 -13.651 -7.088 -5.222 1.00 0.00 C ATOM 446 O ASP A 29 -13.133 -5.969 -5.270 1.00 0.00 O ATOM 447 CB ASP A 29 -12.296 -8.989 -4.296 1.00 0.00 C ATOM 448 CG ASP A 29 -13.281 -9.957 -3.667 1.00 0.00 C ATOM 449 OD1 ASP A 29 -14.157 -9.518 -2.894 1.00 0.00 O ATOM 450 OD2 ASP A 29 -13.191 -11.172 -3.959 1.00 0.00 O ATOM 0 H ASP A 29 -10.858 -7.853 -6.055 1.00 0.00 H new ATOM 0 HA ASP A 29 -13.496 -9.059 -6.064 1.00 0.00 H new ATOM 0 HB2 ASP A 29 -11.372 -9.518 -4.531 1.00 0.00 H new ATOM 0 HB3 ASP A 29 -12.044 -8.212 -3.574 1.00 0.00 H new ATOM 455 N LYS A 30 -14.915 -7.282 -4.892 1.00 0.00 N ATOM 456 CA LYS A 30 -15.803 -6.176 -4.570 1.00 0.00 C ATOM 457 C LYS A 30 -15.724 -5.867 -3.084 1.00 0.00 C ATOM 458 O LYS A 30 -15.999 -6.731 -2.249 1.00 0.00 O ATOM 459 CB LYS A 30 -17.244 -6.532 -4.960 1.00 0.00 C ATOM 460 CG LYS A 30 -17.379 -7.004 -6.398 1.00 0.00 C ATOM 461 CD LYS A 30 -17.222 -5.861 -7.389 1.00 0.00 C ATOM 462 CE LYS A 30 -18.523 -5.096 -7.562 1.00 0.00 C ATOM 463 NZ LYS A 30 -19.583 -5.946 -8.167 1.00 0.00 N ATOM 0 H LYS A 30 -15.353 -8.201 -4.839 1.00 0.00 H new ATOM 0 HA LYS A 30 -15.494 -5.294 -5.131 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -17.611 -7.312 -4.293 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -17.880 -5.659 -4.810 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -16.627 -7.766 -6.602 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -18.353 -7.472 -6.536 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -16.442 -5.182 -7.044 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -16.898 -6.255 -8.353 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -18.860 -4.728 -6.593 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -18.351 -4.224 -8.193 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -20.268 -5.344 -8.666 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -19.152 -6.612 -8.840 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -20.071 -6.478 -7.418 1.00 0.00 H new ATOM 477 N VAL A 31 -15.340 -4.646 -2.745 1.00 0.00 N ATOM 478 CA VAL A 31 -15.206 -4.272 -1.348 1.00 0.00 C ATOM 479 C VAL A 31 -16.028 -3.034 -1.018 1.00 0.00 C ATOM 480 O VAL A 31 -16.262 -2.180 -1.876 1.00 0.00 O ATOM 481 CB VAL A 31 -13.733 -4.017 -0.952 1.00 0.00 C ATOM 482 CG1 VAL A 31 -12.906 -5.282 -1.109 1.00 0.00 C ATOM 483 CG2 VAL A 31 -13.135 -2.881 -1.770 1.00 0.00 C ATOM 0 H VAL A 31 -15.118 -3.905 -3.410 1.00 0.00 H new ATOM 0 HA VAL A 31 -15.582 -5.119 -0.774 1.00 0.00 H new ATOM 0 HB VAL A 31 -13.715 -3.723 0.097 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -11.873 -5.079 -0.825 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -13.312 -6.064 -0.467 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -12.939 -5.611 -2.148 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -12.099 -2.723 -1.471 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -13.172 -3.137 -2.829 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -13.705 -1.968 -1.597 1.00 0.00 H new ATOM 493 N TYR A 32 -16.484 -2.967 0.221 1.00 0.00 N ATOM 494 CA TYR A 32 -17.100 -1.764 0.752 1.00 0.00 C ATOM 495 C TYR A 32 -16.030 -0.889 1.378 1.00 0.00 C ATOM 496 O TYR A 32 -15.013 -1.395 1.854 1.00 0.00 O ATOM 497 CB TYR A 32 -18.156 -2.095 1.813 1.00 0.00 C ATOM 498 CG TYR A 32 -19.417 -2.736 1.276 1.00 0.00 C ATOM 499 CD1 TYR A 32 -20.221 -2.074 0.354 1.00 0.00 C ATOM 500 CD2 TYR A 32 -19.816 -3.996 1.707 1.00 0.00 C ATOM 501 CE1 TYR A 32 -21.382 -2.649 -0.124 1.00 0.00 C ATOM 502 CE2 TYR A 32 -20.978 -4.577 1.236 1.00 0.00 C ATOM 503 CZ TYR A 32 -21.757 -3.900 0.320 1.00 0.00 C ATOM 504 OH TYR A 32 -22.921 -4.471 -0.143 1.00 0.00 O ATOM 0 H TYR A 32 -16.438 -3.741 0.884 1.00 0.00 H new ATOM 0 HA TYR A 32 -17.590 -1.243 -0.071 1.00 0.00 H new ATOM 0 HB2 TYR A 32 -17.712 -2.763 2.551 1.00 0.00 H new ATOM 0 HB3 TYR A 32 -18.426 -1.177 2.335 1.00 0.00 H new ATOM 0 HD1 TYR A 32 -19.932 -1.093 0.006 1.00 0.00 H new ATOM 0 HD2 TYR A 32 -19.208 -4.530 2.422 1.00 0.00 H new ATOM 0 HE1 TYR A 32 -21.993 -2.122 -0.842 1.00 0.00 H new ATOM 0 HE2 TYR A 32 -21.275 -5.556 1.583 1.00 0.00 H new ATOM 0 HH TYR A 32 -23.038 -5.353 0.267 1.00 0.00 H new ATOM 514 N ILE A 33 -16.251 0.411 1.381 1.00 0.00 N ATOM 515 CA ILE A 33 -15.320 1.330 2.011 1.00 0.00 C ATOM 516 C ILE A 33 -15.866 1.762 3.365 1.00 0.00 C ATOM 517 O ILE A 33 -16.686 2.679 3.456 1.00 0.00 O ATOM 518 CB ILE A 33 -15.046 2.571 1.132 1.00 0.00 C ATOM 519 CG1 ILE A 33 -14.538 2.141 -0.249 1.00 0.00 C ATOM 520 CG2 ILE A 33 -14.038 3.491 1.811 1.00 0.00 C ATOM 521 CD1 ILE A 33 -14.261 3.295 -1.188 1.00 0.00 C ATOM 0 H ILE A 33 -17.065 0.855 0.956 1.00 0.00 H new ATOM 0 HA ILE A 33 -14.373 0.807 2.142 1.00 0.00 H new ATOM 0 HB ILE A 33 -15.979 3.120 1.002 1.00 0.00 H new ATOM 0 HG12 ILE A 33 -13.624 1.560 -0.124 1.00 0.00 H new ATOM 0 HG13 ILE A 33 -15.275 1.482 -0.707 1.00 0.00 H new ATOM 0 HG21 ILE A 33 -13.856 4.360 1.179 1.00 0.00 H new ATOM 0 HG22 ILE A 33 -14.434 3.818 2.773 1.00 0.00 H new ATOM 0 HG23 ILE A 33 -13.103 2.954 1.967 1.00 0.00 H new ATOM 0 HD11 ILE A 33 -13.905 2.909 -2.143 1.00 0.00 H new ATOM 0 HD12 ILE A 33 -15.177 3.864 -1.345 1.00 0.00 H new ATOM 0 HD13 ILE A 33 -13.501 3.944 -0.753 1.00 0.00 H new ATOM 533 N LEU A 34 -15.423 1.074 4.409 1.00 0.00 N ATOM 534 CA LEU A 34 -15.893 1.338 5.760 1.00 0.00 C ATOM 535 C LEU A 34 -15.501 2.739 6.201 1.00 0.00 C ATOM 536 O LEU A 34 -16.349 3.516 6.643 1.00 0.00 O ATOM 537 CB LEU A 34 -15.337 0.303 6.740 1.00 0.00 C ATOM 538 CG LEU A 34 -15.806 -1.131 6.506 1.00 0.00 C ATOM 539 CD1 LEU A 34 -15.154 -2.070 7.506 1.00 0.00 C ATOM 540 CD2 LEU A 34 -17.323 -1.218 6.603 1.00 0.00 C ATOM 0 H LEU A 34 -14.734 0.324 4.344 1.00 0.00 H new ATOM 0 HA LEU A 34 -16.981 1.265 5.758 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -14.248 0.325 6.688 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -15.614 0.599 7.752 1.00 0.00 H new ATOM 0 HG LEU A 34 -15.508 -1.434 5.502 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -15.498 -3.089 7.327 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -14.071 -2.028 7.392 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -15.425 -1.769 8.518 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -17.640 -2.247 6.434 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -17.643 -0.898 7.595 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -17.773 -0.571 5.850 1.00 0.00 H new ATOM 552 N ASP A 35 -14.220 3.062 6.082 1.00 0.00 N ATOM 553 CA ASP A 35 -13.758 4.400 6.398 1.00 0.00 C ATOM 554 C ASP A 35 -12.690 4.862 5.422 1.00 0.00 C ATOM 555 O ASP A 35 -11.810 4.091 5.023 1.00 0.00 O ATOM 556 CB ASP A 35 -13.218 4.485 7.824 1.00 0.00 C ATOM 557 CG ASP A 35 -12.808 5.899 8.178 1.00 0.00 C ATOM 558 OD1 ASP A 35 -11.653 6.276 7.894 1.00 0.00 O ATOM 559 OD2 ASP A 35 -13.646 6.648 8.724 1.00 0.00 O ATOM 0 H ASP A 35 -13.491 2.420 5.772 1.00 0.00 H new ATOM 0 HA ASP A 35 -14.622 5.059 6.312 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -13.979 4.140 8.524 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -12.362 3.819 7.930 1.00 0.00 H new ATOM 564 N ASP A 36 -12.793 6.129 5.054 1.00 0.00 N ATOM 565 CA ASP A 36 -11.857 6.788 4.153 1.00 0.00 C ATOM 566 C ASP A 36 -11.466 8.154 4.719 1.00 0.00 C ATOM 567 O ASP A 36 -11.041 9.048 3.988 1.00 0.00 O ATOM 568 CB ASP A 36 -12.487 6.955 2.758 1.00 0.00 C ATOM 569 CG ASP A 36 -13.905 7.523 2.789 1.00 0.00 C ATOM 570 OD1 ASP A 36 -14.270 8.216 3.765 1.00 0.00 O ATOM 571 OD2 ASP A 36 -14.679 7.263 1.840 1.00 0.00 O ATOM 0 H ASP A 36 -13.542 6.740 5.378 1.00 0.00 H new ATOM 0 HA ASP A 36 -10.963 6.171 4.060 1.00 0.00 H new ATOM 0 HB2 ASP A 36 -11.855 7.611 2.160 1.00 0.00 H new ATOM 0 HB3 ASP A 36 -12.504 5.986 2.258 1.00 0.00 H new ATOM 576 N LYS A 37 -11.585 8.298 6.039 1.00 0.00 N ATOM 577 CA LYS A 37 -11.434 9.602 6.683 1.00 0.00 C ATOM 578 C LYS A 37 -10.408 9.596 7.816 1.00 0.00 C ATOM 579 O LYS A 37 -9.650 10.554 7.964 1.00 0.00 O ATOM 580 CB LYS A 37 -12.785 10.078 7.220 1.00 0.00 C ATOM 581 CG LYS A 37 -13.756 10.491 6.129 1.00 0.00 C ATOM 582 CD LYS A 37 -15.134 10.806 6.686 1.00 0.00 C ATOM 583 CE LYS A 37 -15.087 11.904 7.737 1.00 0.00 C ATOM 584 NZ LYS A 37 -14.411 13.125 7.229 1.00 0.00 N ATOM 0 H LYS A 37 -11.785 7.531 6.681 1.00 0.00 H new ATOM 0 HA LYS A 37 -11.065 10.287 5.919 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -13.234 9.280 7.812 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -12.624 10.922 7.891 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -13.366 11.366 5.608 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -13.836 9.691 5.393 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -15.793 11.111 5.873 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -15.563 9.904 7.123 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -16.102 12.153 8.048 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -14.563 11.539 8.621 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -14.575 13.912 7.889 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -13.389 12.948 7.148 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -14.795 13.371 6.294 1.00 0.00 H new ATOM 598 N LYS A 38 -10.389 8.527 8.614 1.00 0.00 N ATOM 599 CA LYS A 38 -9.500 8.454 9.778 1.00 0.00 C ATOM 600 C LYS A 38 -8.046 8.592 9.339 1.00 0.00 C ATOM 601 O LYS A 38 -7.238 9.259 9.990 1.00 0.00 O ATOM 602 CB LYS A 38 -9.676 7.125 10.523 1.00 0.00 C ATOM 603 CG LYS A 38 -11.116 6.795 10.888 1.00 0.00 C ATOM 604 CD LYS A 38 -11.696 7.757 11.909 1.00 0.00 C ATOM 605 CE LYS A 38 -13.179 7.488 12.120 1.00 0.00 C ATOM 606 NZ LYS A 38 -13.729 8.218 13.290 1.00 0.00 N ATOM 0 H LYS A 38 -10.975 7.703 8.478 1.00 0.00 H new ATOM 0 HA LYS A 38 -9.762 9.272 10.449 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -9.277 6.321 9.905 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -9.080 7.152 11.435 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -11.729 6.815 9.987 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -11.163 5.780 11.283 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -11.165 7.655 12.855 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -11.552 8.783 11.572 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -13.728 7.778 11.224 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -13.335 6.418 12.258 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -14.741 8.001 13.390 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -13.225 7.924 14.151 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -13.607 9.241 13.150 1.00 0.00 H new ATOM 620 N SER A 39 -7.728 7.944 8.232 1.00 0.00 N ATOM 621 CA SER A 39 -6.402 8.004 7.648 1.00 0.00 C ATOM 622 C SER A 39 -6.515 7.938 6.131 1.00 0.00 C ATOM 623 O SER A 39 -7.436 7.322 5.605 1.00 0.00 O ATOM 624 CB SER A 39 -5.545 6.850 8.174 1.00 0.00 C ATOM 625 OG SER A 39 -5.458 6.891 9.589 1.00 0.00 O ATOM 0 H SER A 39 -8.384 7.361 7.713 1.00 0.00 H new ATOM 0 HA SER A 39 -5.922 8.942 7.928 1.00 0.00 H new ATOM 0 HB2 SER A 39 -5.975 5.899 7.859 1.00 0.00 H new ATOM 0 HB3 SER A 39 -4.546 6.907 7.742 1.00 0.00 H new ATOM 0 HG SER A 39 -4.907 6.144 9.905 1.00 0.00 H new ATOM 631 N LYS A 40 -5.600 8.593 5.434 1.00 0.00 N ATOM 632 CA LYS A 40 -5.616 8.588 3.977 1.00 0.00 C ATOM 633 C LYS A 40 -4.728 7.472 3.447 1.00 0.00 C ATOM 634 O LYS A 40 -4.921 6.989 2.336 1.00 0.00 O ATOM 635 CB LYS A 40 -5.125 9.925 3.420 1.00 0.00 C ATOM 636 CG LYS A 40 -5.836 11.142 3.993 1.00 0.00 C ATOM 637 CD LYS A 40 -5.355 12.424 3.325 1.00 0.00 C ATOM 638 CE LYS A 40 -3.837 12.537 3.351 1.00 0.00 C ATOM 639 NZ LYS A 40 -3.302 12.629 4.735 1.00 0.00 N ATOM 0 H LYS A 40 -4.840 9.132 5.849 1.00 0.00 H new ATOM 0 HA LYS A 40 -6.644 8.426 3.654 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -4.057 10.017 3.617 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -5.250 9.922 2.337 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -6.912 11.037 3.854 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -5.658 11.199 5.067 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -5.704 12.450 2.293 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -5.793 13.284 3.831 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -3.402 11.671 2.852 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -3.531 13.417 2.786 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -2.267 12.721 4.702 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -3.709 13.460 5.210 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -3.556 11.770 5.263 1.00 0.00 H new ATOM 653 N ASP A 41 -3.752 7.080 4.255 1.00 0.00 N ATOM 654 CA ASP A 41 -2.782 6.067 3.855 1.00 0.00 C ATOM 655 C ASP A 41 -3.381 4.668 3.976 1.00 0.00 C ATOM 656 O ASP A 41 -3.122 3.790 3.148 1.00 0.00 O ATOM 657 CB ASP A 41 -1.509 6.180 4.705 1.00 0.00 C ATOM 658 CG ASP A 41 -0.821 7.527 4.553 1.00 0.00 C ATOM 659 OD1 ASP A 41 -1.274 8.505 5.195 1.00 0.00 O ATOM 660 OD2 ASP A 41 0.171 7.618 3.797 1.00 0.00 O ATOM 0 H ASP A 41 -3.610 7.449 5.195 1.00 0.00 H new ATOM 0 HA ASP A 41 -2.520 6.238 2.811 1.00 0.00 H new ATOM 0 HB2 ASP A 41 -1.762 6.022 5.753 1.00 0.00 H new ATOM 0 HB3 ASP A 41 -0.816 5.388 4.421 1.00 0.00 H new ATOM 665 N TRP A 42 -4.192 4.469 5.002 1.00 0.00 N ATOM 666 CA TRP A 42 -4.838 3.186 5.227 1.00 0.00 C ATOM 667 C TRP A 42 -6.349 3.361 5.305 1.00 0.00 C ATOM 668 O TRP A 42 -6.852 4.173 6.085 1.00 0.00 O ATOM 669 CB TRP A 42 -4.317 2.530 6.510 1.00 0.00 C ATOM 670 CG TRP A 42 -2.910 2.027 6.399 1.00 0.00 C ATOM 671 CD1 TRP A 42 -1.767 2.762 6.497 1.00 0.00 C ATOM 672 CD2 TRP A 42 -2.496 0.673 6.176 1.00 0.00 C ATOM 673 NE1 TRP A 42 -0.669 1.953 6.339 1.00 0.00 N ATOM 674 CE2 TRP A 42 -1.090 0.667 6.141 1.00 0.00 C ATOM 675 CE3 TRP A 42 -3.178 -0.534 5.998 1.00 0.00 C ATOM 676 CZ2 TRP A 42 -0.355 -0.497 5.938 1.00 0.00 C ATOM 677 CZ3 TRP A 42 -2.447 -1.689 5.797 1.00 0.00 C ATOM 678 CH2 TRP A 42 -1.049 -1.663 5.768 1.00 0.00 C ATOM 0 H TRP A 42 -4.419 5.182 5.695 1.00 0.00 H new ATOM 0 HA TRP A 42 -4.600 2.534 4.387 1.00 0.00 H new ATOM 0 HB2 TRP A 42 -4.373 3.251 7.325 1.00 0.00 H new ATOM 0 HB3 TRP A 42 -4.971 1.699 6.775 1.00 0.00 H new ATOM 0 HD1 TRP A 42 -1.730 3.827 6.673 1.00 0.00 H new ATOM 0 HE1 TRP A 42 0.303 2.261 6.365 1.00 0.00 H new ATOM 0 HE3 TRP A 42 -4.257 -0.563 6.017 1.00 0.00 H new ATOM 0 HZ2 TRP A 42 0.725 -0.480 5.916 1.00 0.00 H new ATOM 0 HZ3 TRP A 42 -2.964 -2.627 5.660 1.00 0.00 H new ATOM 0 HH2 TRP A 42 -0.506 -2.583 5.608 1.00 0.00 H new ATOM 689 N TRP A 43 -7.062 2.599 4.492 1.00 0.00 N ATOM 690 CA TRP A 43 -8.514 2.645 4.466 1.00 0.00 C ATOM 691 C TRP A 43 -9.092 1.337 4.977 1.00 0.00 C ATOM 692 O TRP A 43 -8.420 0.306 4.977 1.00 0.00 O ATOM 693 CB TRP A 43 -9.024 2.916 3.049 1.00 0.00 C ATOM 694 CG TRP A 43 -8.906 4.350 2.635 1.00 0.00 C ATOM 695 CD1 TRP A 43 -8.538 5.402 3.421 1.00 0.00 C ATOM 696 CD2 TRP A 43 -9.177 4.892 1.339 1.00 0.00 C ATOM 697 NE1 TRP A 43 -8.560 6.565 2.694 1.00 0.00 N ATOM 698 CE2 TRP A 43 -8.948 6.280 1.413 1.00 0.00 C ATOM 699 CE3 TRP A 43 -9.586 4.339 0.123 1.00 0.00 C ATOM 700 CZ2 TRP A 43 -9.119 7.120 0.316 1.00 0.00 C ATOM 701 CZ3 TRP A 43 -9.758 5.176 -0.963 1.00 0.00 C ATOM 702 CH2 TRP A 43 -9.524 6.552 -0.861 1.00 0.00 C ATOM 0 H TRP A 43 -6.653 1.935 3.835 1.00 0.00 H new ATOM 0 HA TRP A 43 -8.838 3.458 5.115 1.00 0.00 H new ATOM 0 HB2 TRP A 43 -8.467 2.296 2.346 1.00 0.00 H new ATOM 0 HB3 TRP A 43 -10.069 2.612 2.983 1.00 0.00 H new ATOM 0 HD1 TRP A 43 -8.268 5.330 4.464 1.00 0.00 H new ATOM 0 HE1 TRP A 43 -8.325 7.492 3.050 1.00 0.00 H new ATOM 0 HE3 TRP A 43 -9.764 3.278 0.033 1.00 0.00 H new ATOM 0 HZ2 TRP A 43 -8.938 8.182 0.391 1.00 0.00 H new ATOM 0 HZ3 TRP A 43 -10.079 4.761 -1.907 1.00 0.00 H new ATOM 0 HH2 TRP A 43 -9.666 7.178 -1.729 1.00 0.00 H new ATOM 713 N MET A 44 -10.337 1.379 5.418 1.00 0.00 N ATOM 714 CA MET A 44 -10.992 0.183 5.919 1.00 0.00 C ATOM 715 C MET A 44 -11.933 -0.365 4.863 1.00 0.00 C ATOM 716 O MET A 44 -12.797 0.354 4.366 1.00 0.00 O ATOM 717 CB MET A 44 -11.769 0.478 7.203 1.00 0.00 C ATOM 718 CG MET A 44 -10.983 1.269 8.230 1.00 0.00 C ATOM 719 SD MET A 44 -11.735 1.213 9.867 1.00 0.00 S ATOM 720 CE MET A 44 -11.546 -0.526 10.257 1.00 0.00 C ATOM 0 H MET A 44 -10.911 2.222 5.440 1.00 0.00 H new ATOM 0 HA MET A 44 -10.226 -0.558 6.147 1.00 0.00 H new ATOM 0 HB2 MET A 44 -12.674 1.030 6.949 1.00 0.00 H new ATOM 0 HB3 MET A 44 -12.085 -0.465 7.649 1.00 0.00 H new ATOM 0 HG2 MET A 44 -9.968 0.877 8.287 1.00 0.00 H new ATOM 0 HG3 MET A 44 -10.906 2.306 7.904 1.00 0.00 H new ATOM 0 HE1 MET A 44 -11.150 -0.631 11.267 1.00 0.00 H new ATOM 0 HE2 MET A 44 -12.515 -1.021 10.193 1.00 0.00 H new ATOM 0 HE3 MET A 44 -10.857 -0.985 9.548 1.00 0.00 H new ATOM 730 N CYS A 45 -11.765 -1.625 4.514 1.00 0.00 N ATOM 731 CA CYS A 45 -12.587 -2.229 3.481 1.00 0.00 C ATOM 732 C CYS A 45 -13.301 -3.464 4.007 1.00 0.00 C ATOM 733 O CYS A 45 -12.885 -4.057 5.007 1.00 0.00 O ATOM 734 CB CYS A 45 -11.736 -2.594 2.264 1.00 0.00 C ATOM 735 SG CYS A 45 -10.421 -3.780 2.616 1.00 0.00 S ATOM 0 H CYS A 45 -11.071 -2.249 4.927 1.00 0.00 H new ATOM 0 HA CYS A 45 -13.338 -1.499 3.180 1.00 0.00 H new ATOM 0 HB2 CYS A 45 -12.384 -3.005 1.490 1.00 0.00 H new ATOM 0 HB3 CYS A 45 -11.292 -1.685 1.858 1.00 0.00 H new ATOM 0 HG CYS A 45 -9.743 -3.381 3.651 1.00 0.00 H new ATOM 741 N GLN A 46 -14.385 -3.830 3.347 1.00 0.00 N ATOM 742 CA GLN A 46 -15.135 -5.022 3.695 1.00 0.00 C ATOM 743 C GLN A 46 -15.447 -5.825 2.439 1.00 0.00 C ATOM 744 O GLN A 46 -16.046 -5.302 1.500 1.00 0.00 O ATOM 745 CB GLN A 46 -16.427 -4.639 4.414 1.00 0.00 C ATOM 746 CG GLN A 46 -17.247 -5.830 4.875 1.00 0.00 C ATOM 747 CD GLN A 46 -18.509 -5.416 5.601 1.00 0.00 C ATOM 748 OE1 GLN A 46 -18.562 -4.358 6.226 1.00 0.00 O ATOM 749 NE2 GLN A 46 -19.534 -6.249 5.529 1.00 0.00 N ATOM 0 H GLN A 46 -14.769 -3.311 2.557 1.00 0.00 H new ATOM 0 HA GLN A 46 -14.533 -5.637 4.364 1.00 0.00 H new ATOM 0 HB2 GLN A 46 -16.182 -4.022 5.278 1.00 0.00 H new ATOM 0 HB3 GLN A 46 -17.035 -4.027 3.748 1.00 0.00 H new ATOM 0 HG2 GLN A 46 -17.511 -6.441 4.012 1.00 0.00 H new ATOM 0 HG3 GLN A 46 -16.640 -6.452 5.533 1.00 0.00 H new ATOM 0 HE21 GLN A 46 -19.450 -7.117 5.000 1.00 0.00 H new ATOM 0 HE22 GLN A 46 -20.409 -6.023 6.002 1.00 0.00 H new ATOM 758 N LEU A 47 -15.040 -7.084 2.421 1.00 0.00 N ATOM 759 CA LEU A 47 -15.272 -7.944 1.267 1.00 0.00 C ATOM 760 C LEU A 47 -16.760 -8.207 1.100 1.00 0.00 C ATOM 761 O LEU A 47 -17.422 -8.646 2.037 1.00 0.00 O ATOM 762 CB LEU A 47 -14.536 -9.280 1.429 1.00 0.00 C ATOM 763 CG LEU A 47 -13.014 -9.195 1.506 1.00 0.00 C ATOM 764 CD1 LEU A 47 -12.419 -10.567 1.780 1.00 0.00 C ATOM 765 CD2 LEU A 47 -12.435 -8.611 0.226 1.00 0.00 C ATOM 0 H LEU A 47 -14.547 -7.535 3.192 1.00 0.00 H new ATOM 0 HA LEU A 47 -14.890 -7.434 0.383 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -14.900 -9.766 2.334 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -14.803 -9.924 0.591 1.00 0.00 H new ATOM 0 HG LEU A 47 -12.753 -8.530 2.330 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -11.333 -10.489 1.832 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -12.801 -10.947 2.728 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -12.696 -11.250 0.977 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -11.349 -8.561 0.307 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -12.707 -9.244 -0.618 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -12.833 -7.608 0.071 1.00 0.00 H new ATOM 777 N VAL A 48 -17.286 -7.932 -0.083 1.00 0.00 N ATOM 778 CA VAL A 48 -18.681 -8.235 -0.380 1.00 0.00 C ATOM 779 C VAL A 48 -18.836 -9.734 -0.623 1.00 0.00 C ATOM 780 O VAL A 48 -19.916 -10.306 -0.456 1.00 0.00 O ATOM 781 CB VAL A 48 -19.183 -7.448 -1.615 1.00 0.00 C ATOM 782 CG1 VAL A 48 -20.653 -7.732 -1.892 1.00 0.00 C ATOM 783 CG2 VAL A 48 -18.960 -5.956 -1.423 1.00 0.00 C ATOM 0 H VAL A 48 -16.772 -7.501 -0.852 1.00 0.00 H new ATOM 0 HA VAL A 48 -19.284 -7.933 0.476 1.00 0.00 H new ATOM 0 HB VAL A 48 -18.607 -7.781 -2.479 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -20.975 -7.164 -2.765 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -20.788 -8.797 -2.081 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -21.249 -7.438 -1.028 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -19.319 -5.419 -2.301 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -19.505 -5.617 -0.542 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -17.896 -5.762 -1.288 1.00 0.00 H new ATOM 793 N ASP A 49 -17.732 -10.364 -1.001 1.00 0.00 N ATOM 794 CA ASP A 49 -17.715 -11.794 -1.274 1.00 0.00 C ATOM 795 C ASP A 49 -17.707 -12.602 0.025 1.00 0.00 C ATOM 796 O ASP A 49 -18.598 -13.418 0.265 1.00 0.00 O ATOM 797 CB ASP A 49 -16.496 -12.150 -2.127 1.00 0.00 C ATOM 798 CG ASP A 49 -16.430 -13.624 -2.462 1.00 0.00 C ATOM 799 OD1 ASP A 49 -17.390 -14.140 -3.074 1.00 0.00 O ATOM 800 OD2 ASP A 49 -15.419 -14.269 -2.116 1.00 0.00 O ATOM 0 H ASP A 49 -16.831 -9.903 -1.126 1.00 0.00 H new ATOM 0 HA ASP A 49 -18.622 -12.048 -1.823 1.00 0.00 H new ATOM 0 HB2 ASP A 49 -16.523 -11.572 -3.051 1.00 0.00 H new ATOM 0 HB3 ASP A 49 -15.589 -11.861 -1.596 1.00 0.00 H new ATOM 805 N SER A 50 -16.702 -12.365 0.859 1.00 0.00 N ATOM 806 CA SER A 50 -16.565 -13.095 2.114 1.00 0.00 C ATOM 807 C SER A 50 -17.381 -12.445 3.235 1.00 0.00 C ATOM 808 O SER A 50 -18.088 -13.128 3.976 1.00 0.00 O ATOM 809 CB SER A 50 -15.086 -13.179 2.509 1.00 0.00 C ATOM 810 OG SER A 50 -14.922 -13.790 3.778 1.00 0.00 O ATOM 0 H SER A 50 -15.971 -11.674 0.690 1.00 0.00 H new ATOM 0 HA SER A 50 -16.956 -14.102 1.965 1.00 0.00 H new ATOM 0 HB2 SER A 50 -14.539 -13.747 1.757 1.00 0.00 H new ATOM 0 HB3 SER A 50 -14.656 -12.178 2.528 1.00 0.00 H new ATOM 0 HG SER A 50 -13.969 -13.830 4.001 1.00 0.00 H new ATOM 816 N GLY A 51 -17.290 -11.126 3.350 1.00 0.00 N ATOM 817 CA GLY A 51 -17.976 -10.428 4.423 1.00 0.00 C ATOM 818 C GLY A 51 -17.013 -9.892 5.465 1.00 0.00 C ATOM 819 O GLY A 51 -17.366 -9.023 6.265 1.00 0.00 O ATOM 0 H GLY A 51 -16.755 -10.527 2.721 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -18.554 -9.603 4.006 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -18.685 -11.105 4.900 1.00 0.00 H new ATOM 823 N LYS A 52 -15.791 -10.409 5.450 1.00 0.00 N ATOM 824 CA LYS A 52 -14.773 -10.002 6.409 1.00 0.00 C ATOM 825 C LYS A 52 -14.298 -8.578 6.125 1.00 0.00 C ATOM 826 O LYS A 52 -14.402 -8.092 4.996 1.00 0.00 O ATOM 827 CB LYS A 52 -13.595 -10.981 6.375 1.00 0.00 C ATOM 828 CG LYS A 52 -14.017 -12.429 6.588 1.00 0.00 C ATOM 829 CD LYS A 52 -12.824 -13.366 6.688 1.00 0.00 C ATOM 830 CE LYS A 52 -12.025 -13.120 7.956 1.00 0.00 C ATOM 831 NZ LYS A 52 -10.976 -14.153 8.158 1.00 0.00 N ATOM 0 H LYS A 52 -15.480 -11.114 4.781 1.00 0.00 H new ATOM 0 HA LYS A 52 -15.212 -10.018 7.407 1.00 0.00 H new ATOM 0 HB2 LYS A 52 -13.086 -10.894 5.415 1.00 0.00 H new ATOM 0 HB3 LYS A 52 -12.875 -10.701 7.144 1.00 0.00 H new ATOM 0 HG2 LYS A 52 -14.612 -12.502 7.499 1.00 0.00 H new ATOM 0 HG3 LYS A 52 -14.656 -12.744 5.764 1.00 0.00 H new ATOM 0 HD2 LYS A 52 -13.170 -14.400 6.670 1.00 0.00 H new ATOM 0 HD3 LYS A 52 -12.180 -13.230 5.819 1.00 0.00 H new ATOM 0 HE2 LYS A 52 -11.560 -12.135 7.907 1.00 0.00 H new ATOM 0 HE3 LYS A 52 -12.698 -13.113 8.814 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 -10.453 -13.950 9.034 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 -11.421 -15.090 8.230 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 -10.319 -14.143 7.352 1.00 0.00 H new ATOM 845 N SER A 53 -13.789 -7.913 7.152 1.00 0.00 N ATOM 846 CA SER A 53 -13.386 -6.518 7.048 1.00 0.00 C ATOM 847 C SER A 53 -11.965 -6.335 7.565 1.00 0.00 C ATOM 848 O SER A 53 -11.441 -7.208 8.259 1.00 0.00 O ATOM 849 CB SER A 53 -14.348 -5.651 7.858 1.00 0.00 C ATOM 850 OG SER A 53 -15.693 -5.995 7.577 1.00 0.00 O ATOM 0 H SER A 53 -13.644 -8.322 8.075 1.00 0.00 H new ATOM 0 HA SER A 53 -13.415 -6.217 6.001 1.00 0.00 H new ATOM 0 HB2 SER A 53 -14.150 -5.777 8.922 1.00 0.00 H new ATOM 0 HB3 SER A 53 -14.181 -4.599 7.625 1.00 0.00 H new ATOM 0 HG SER A 53 -16.293 -5.430 8.107 1.00 0.00 H new ATOM 856 N GLY A 54 -11.341 -5.215 7.221 1.00 0.00 N ATOM 857 CA GLY A 54 -10.018 -4.927 7.736 1.00 0.00 C ATOM 858 C GLY A 54 -9.390 -3.699 7.110 1.00 0.00 C ATOM 859 O GLY A 54 -9.977 -3.068 6.225 1.00 0.00 O ATOM 0 H GLY A 54 -11.726 -4.505 6.598 1.00 0.00 H new ATOM 0 HA2 GLY A 54 -10.078 -4.787 8.815 1.00 0.00 H new ATOM 0 HA3 GLY A 54 -9.372 -5.787 7.561 1.00 0.00 H new ATOM 863 N LEU A 55 -8.195 -3.372 7.576 1.00 0.00 N ATOM 864 CA LEU A 55 -7.466 -2.193 7.127 1.00 0.00 C ATOM 865 C LEU A 55 -6.534 -2.545 5.966 1.00 0.00 C ATOM 866 O LEU A 55 -5.812 -3.544 6.025 1.00 0.00 O ATOM 867 CB LEU A 55 -6.655 -1.637 8.303 1.00 0.00 C ATOM 868 CG LEU A 55 -6.038 -0.257 8.094 1.00 0.00 C ATOM 869 CD1 LEU A 55 -7.125 0.794 7.960 1.00 0.00 C ATOM 870 CD2 LEU A 55 -5.109 0.083 9.247 1.00 0.00 C ATOM 0 H LEU A 55 -7.700 -3.919 8.280 1.00 0.00 H new ATOM 0 HA LEU A 55 -8.174 -1.442 6.776 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -7.303 -1.595 9.178 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -5.855 -2.341 8.532 1.00 0.00 H new ATOM 0 HG LEU A 55 -5.457 -0.271 7.172 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -6.669 1.773 7.812 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -7.758 0.556 7.106 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -7.730 0.810 8.867 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -4.675 1.070 9.086 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -5.672 0.082 10.180 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -4.312 -0.659 9.303 1.00 0.00 H new ATOM 882 N VAL A 56 -6.560 -1.728 4.915 1.00 0.00 N ATOM 883 CA VAL A 56 -5.716 -1.937 3.737 1.00 0.00 C ATOM 884 C VAL A 56 -5.195 -0.599 3.207 1.00 0.00 C ATOM 885 O VAL A 56 -5.755 0.452 3.513 1.00 0.00 O ATOM 886 CB VAL A 56 -6.480 -2.663 2.604 1.00 0.00 C ATOM 887 CG1 VAL A 56 -6.904 -4.061 3.032 1.00 0.00 C ATOM 888 CG2 VAL A 56 -7.684 -1.846 2.159 1.00 0.00 C ATOM 0 H VAL A 56 -7.162 -0.907 4.854 1.00 0.00 H new ATOM 0 HA VAL A 56 -4.881 -2.564 4.050 1.00 0.00 H new ATOM 0 HB VAL A 56 -5.803 -2.766 1.756 1.00 0.00 H new ATOM 0 HG11 VAL A 56 -7.438 -4.545 2.215 1.00 0.00 H new ATOM 0 HG12 VAL A 56 -6.021 -4.647 3.286 1.00 0.00 H new ATOM 0 HG13 VAL A 56 -7.557 -3.993 3.902 1.00 0.00 H new ATOM 0 HG21 VAL A 56 -8.207 -2.374 1.362 1.00 0.00 H new ATOM 0 HG22 VAL A 56 -8.359 -1.703 3.003 1.00 0.00 H new ATOM 0 HG23 VAL A 56 -7.350 -0.875 1.793 1.00 0.00 H new ATOM 898 N PRO A 57 -4.104 -0.613 2.420 1.00 0.00 N ATOM 899 CA PRO A 57 -3.544 0.603 1.813 1.00 0.00 C ATOM 900 C PRO A 57 -4.501 1.238 0.803 1.00 0.00 C ATOM 901 O PRO A 57 -5.220 0.534 0.089 1.00 0.00 O ATOM 902 CB PRO A 57 -2.273 0.109 1.111 1.00 0.00 C ATOM 903 CG PRO A 57 -1.985 -1.222 1.717 1.00 0.00 C ATOM 904 CD PRO A 57 -3.318 -1.805 2.074 1.00 0.00 C ATOM 0 HA PRO A 57 -3.356 1.377 2.557 1.00 0.00 H new ATOM 0 HB2 PRO A 57 -2.424 0.027 0.035 1.00 0.00 H new ATOM 0 HB3 PRO A 57 -1.444 0.800 1.265 1.00 0.00 H new ATOM 0 HG2 PRO A 57 -1.453 -1.864 1.015 1.00 0.00 H new ATOM 0 HG3 PRO A 57 -1.353 -1.121 2.599 1.00 0.00 H new ATOM 0 HD2 PRO A 57 -3.758 -2.353 1.241 1.00 0.00 H new ATOM 0 HD3 PRO A 57 -3.246 -2.500 2.910 1.00 0.00 H new ATOM 912 N ALA A 58 -4.489 2.565 0.737 1.00 0.00 N ATOM 913 CA ALA A 58 -5.435 3.313 -0.091 1.00 0.00 C ATOM 914 C ALA A 58 -5.291 3.006 -1.584 1.00 0.00 C ATOM 915 O ALA A 58 -6.289 2.954 -2.299 1.00 0.00 O ATOM 916 CB ALA A 58 -5.283 4.803 0.151 1.00 0.00 C ATOM 0 H ALA A 58 -3.830 3.151 1.250 1.00 0.00 H new ATOM 0 HA ALA A 58 -6.434 2.992 0.205 1.00 0.00 H new ATOM 0 HB1 ALA A 58 -5.993 5.347 -0.472 1.00 0.00 H new ATOM 0 HB2 ALA A 58 -5.478 5.023 1.201 1.00 0.00 H new ATOM 0 HB3 ALA A 58 -4.268 5.111 -0.102 1.00 0.00 H new ATOM 922 N GLN A 59 -4.060 2.789 -2.052 1.00 0.00 N ATOM 923 CA GLN A 59 -3.817 2.530 -3.476 1.00 0.00 C ATOM 924 C GLN A 59 -4.507 1.250 -3.926 1.00 0.00 C ATOM 925 O GLN A 59 -4.717 1.028 -5.118 1.00 0.00 O ATOM 926 CB GLN A 59 -2.321 2.401 -3.785 1.00 0.00 C ATOM 927 CG GLN A 59 -1.481 3.602 -3.389 1.00 0.00 C ATOM 928 CD GLN A 59 -0.885 3.462 -2.006 1.00 0.00 C ATOM 929 OE1 GLN A 59 -1.475 2.851 -1.115 1.00 0.00 O ATOM 930 NE2 GLN A 59 0.305 4.011 -1.824 1.00 0.00 N ATOM 0 H GLN A 59 -3.221 2.787 -1.472 1.00 0.00 H new ATOM 0 HA GLN A 59 -4.225 3.385 -4.016 1.00 0.00 H new ATOM 0 HB2 GLN A 59 -1.934 1.520 -3.273 1.00 0.00 H new ATOM 0 HB3 GLN A 59 -2.199 2.227 -4.854 1.00 0.00 H new ATOM 0 HG2 GLN A 59 -0.679 3.735 -4.115 1.00 0.00 H new ATOM 0 HG3 GLN A 59 -2.097 4.500 -3.426 1.00 0.00 H new ATOM 0 HE21 GLN A 59 0.759 4.509 -2.590 1.00 0.00 H new ATOM 0 HE22 GLN A 59 0.768 3.936 -0.918 1.00 0.00 H new ATOM 939 N PHE A 60 -4.851 0.411 -2.964 1.00 0.00 N ATOM 940 CA PHE A 60 -5.445 -0.876 -3.261 1.00 0.00 C ATOM 941 C PHE A 60 -6.922 -0.731 -3.569 1.00 0.00 C ATOM 942 O PHE A 60 -7.479 -1.517 -4.324 1.00 0.00 O ATOM 943 CB PHE A 60 -5.231 -1.848 -2.097 1.00 0.00 C ATOM 944 CG PHE A 60 -3.830 -2.385 -2.010 1.00 0.00 C ATOM 945 CD1 PHE A 60 -2.736 -1.535 -2.046 1.00 0.00 C ATOM 946 CD2 PHE A 60 -3.608 -3.748 -1.902 1.00 0.00 C ATOM 947 CE1 PHE A 60 -1.451 -2.032 -1.972 1.00 0.00 C ATOM 948 CE2 PHE A 60 -2.324 -4.250 -1.827 1.00 0.00 C ATOM 949 CZ PHE A 60 -1.246 -3.391 -1.862 1.00 0.00 C ATOM 0 H PHE A 60 -4.728 0.601 -1.969 1.00 0.00 H new ATOM 0 HA PHE A 60 -4.953 -1.282 -4.145 1.00 0.00 H new ATOM 0 HB2 PHE A 60 -5.476 -1.342 -1.163 1.00 0.00 H new ATOM 0 HB3 PHE A 60 -5.925 -2.682 -2.199 1.00 0.00 H new ATOM 0 HD1 PHE A 60 -2.891 -0.470 -2.133 1.00 0.00 H new ATOM 0 HD2 PHE A 60 -4.449 -4.426 -1.876 1.00 0.00 H new ATOM 0 HE1 PHE A 60 -0.608 -1.358 -2.000 1.00 0.00 H new ATOM 0 HE2 PHE A 60 -2.164 -5.315 -1.741 1.00 0.00 H new ATOM 0 HZ PHE A 60 -0.241 -3.783 -1.803 1.00 0.00 H new ATOM 959 N ILE A 61 -7.550 0.293 -3.013 1.00 0.00 N ATOM 960 CA ILE A 61 -8.983 0.471 -3.179 1.00 0.00 C ATOM 961 C ILE A 61 -9.284 1.619 -4.134 1.00 0.00 C ATOM 962 O ILE A 61 -9.085 2.784 -3.799 1.00 0.00 O ATOM 963 CB ILE A 61 -9.689 0.740 -1.833 1.00 0.00 C ATOM 964 CG1 ILE A 61 -9.346 -0.353 -0.814 1.00 0.00 C ATOM 965 CG2 ILE A 61 -11.198 0.828 -2.031 1.00 0.00 C ATOM 966 CD1 ILE A 61 -9.714 -1.755 -1.262 1.00 0.00 C ATOM 0 H ILE A 61 -7.094 1.008 -2.447 1.00 0.00 H new ATOM 0 HA ILE A 61 -9.366 -0.461 -3.595 1.00 0.00 H new ATOM 0 HB ILE A 61 -9.334 1.695 -1.445 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -8.277 -0.318 -0.606 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -9.860 -0.136 0.123 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -11.680 1.018 -1.072 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -11.428 1.641 -2.720 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -11.566 -0.112 -2.443 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -9.439 -2.469 -0.486 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -10.788 -1.810 -1.441 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -9.180 -1.995 -2.181 1.00 0.00 H new ATOM 978 N GLU A 62 -9.743 1.277 -5.329 1.00 0.00 N ATOM 979 CA GLU A 62 -10.206 2.273 -6.281 1.00 0.00 C ATOM 980 C GLU A 62 -11.714 2.450 -6.112 1.00 0.00 C ATOM 981 O GLU A 62 -12.495 1.589 -6.521 1.00 0.00 O ATOM 982 CB GLU A 62 -9.870 1.844 -7.715 1.00 0.00 C ATOM 983 CG GLU A 62 -10.259 2.866 -8.775 1.00 0.00 C ATOM 984 CD GLU A 62 -9.400 4.117 -8.738 1.00 0.00 C ATOM 985 OE1 GLU A 62 -9.701 5.035 -7.947 1.00 0.00 O ATOM 986 OE2 GLU A 62 -8.429 4.200 -9.520 1.00 0.00 O ATOM 0 H GLU A 62 -9.804 0.315 -5.662 1.00 0.00 H new ATOM 0 HA GLU A 62 -9.704 3.222 -6.092 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -8.799 1.653 -7.785 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -10.376 0.903 -7.930 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -10.180 2.407 -9.760 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -11.303 3.145 -8.636 1.00 0.00 H new ATOM 993 N PRO A 63 -12.141 3.546 -5.469 1.00 0.00 N ATOM 994 CA PRO A 63 -13.556 3.786 -5.178 1.00 0.00 C ATOM 995 C PRO A 63 -14.397 3.902 -6.445 1.00 0.00 C ATOM 996 O PRO A 63 -14.208 4.820 -7.250 1.00 0.00 O ATOM 997 CB PRO A 63 -13.556 5.112 -4.406 1.00 0.00 C ATOM 998 CG PRO A 63 -12.250 5.755 -4.727 1.00 0.00 C ATOM 999 CD PRO A 63 -11.282 4.633 -4.972 1.00 0.00 C ATOM 0 HA PRO A 63 -13.997 2.961 -4.619 1.00 0.00 H new ATOM 0 HB2 PRO A 63 -14.391 5.744 -4.710 1.00 0.00 H new ATOM 0 HB3 PRO A 63 -13.658 4.943 -3.334 1.00 0.00 H new ATOM 0 HG2 PRO A 63 -12.336 6.394 -5.606 1.00 0.00 H new ATOM 0 HG3 PRO A 63 -11.914 6.387 -3.905 1.00 0.00 H new ATOM 0 HD2 PRO A 63 -10.521 4.910 -5.702 1.00 0.00 H new ATOM 0 HD3 PRO A 63 -10.759 4.347 -4.060 1.00 0.00 H new ATOM 1007 N VAL A 64 -15.323 2.968 -6.620 1.00 0.00 N ATOM 1008 CA VAL A 64 -16.196 2.976 -7.778 1.00 0.00 C ATOM 1009 C VAL A 64 -17.535 3.625 -7.422 1.00 0.00 C ATOM 1010 O VAL A 64 -18.453 2.994 -6.895 1.00 0.00 O ATOM 1011 CB VAL A 64 -16.393 1.561 -8.378 1.00 0.00 C ATOM 1012 CG1 VAL A 64 -16.906 0.573 -7.340 1.00 0.00 C ATOM 1013 CG2 VAL A 64 -17.320 1.617 -9.586 1.00 0.00 C ATOM 0 H VAL A 64 -15.486 2.197 -5.973 1.00 0.00 H new ATOM 0 HA VAL A 64 -15.714 3.571 -8.553 1.00 0.00 H new ATOM 0 HB VAL A 64 -15.418 1.202 -8.707 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -17.031 -0.407 -7.801 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -16.190 0.501 -6.521 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -17.865 0.917 -6.953 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -17.447 0.614 -9.994 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -18.290 2.010 -9.282 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -16.887 2.266 -10.347 1.00 0.00 H new ATOM 1023 N ARG A 65 -17.598 4.918 -7.667 1.00 0.00 N ATOM 1024 CA ARG A 65 -18.784 5.715 -7.396 1.00 0.00 C ATOM 1025 C ARG A 65 -18.675 7.036 -8.140 1.00 0.00 C ATOM 1026 O ARG A 65 -19.582 7.440 -8.869 1.00 0.00 O ATOM 1027 CB ARG A 65 -18.944 5.969 -5.887 1.00 0.00 C ATOM 1028 CG ARG A 65 -17.703 6.533 -5.213 1.00 0.00 C ATOM 1029 CD ARG A 65 -18.013 7.114 -3.843 1.00 0.00 C ATOM 1030 NE ARG A 65 -18.863 8.302 -3.935 1.00 0.00 N ATOM 1031 CZ ARG A 65 -19.121 9.121 -2.914 1.00 0.00 C ATOM 1032 NH1 ARG A 65 -18.546 8.926 -1.730 1.00 0.00 N ATOM 1033 NH2 ARG A 65 -19.940 10.153 -3.087 1.00 0.00 N ATOM 0 H ARG A 65 -16.824 5.452 -8.062 1.00 0.00 H new ATOM 0 HA ARG A 65 -19.663 5.169 -7.738 1.00 0.00 H new ATOM 0 HB2 ARG A 65 -19.773 6.660 -5.732 1.00 0.00 H new ATOM 0 HB3 ARG A 65 -19.214 5.032 -5.399 1.00 0.00 H new ATOM 0 HG2 ARG A 65 -16.956 5.746 -5.112 1.00 0.00 H new ATOM 0 HG3 ARG A 65 -17.267 7.307 -5.845 1.00 0.00 H new ATOM 0 HD2 ARG A 65 -18.508 6.359 -3.232 1.00 0.00 H new ATOM 0 HD3 ARG A 65 -17.082 7.372 -3.339 1.00 0.00 H new ATOM 0 HE ARG A 65 -19.285 8.518 -4.838 1.00 0.00 H new ATOM 0 HH11 ARG A 65 -17.903 8.146 -1.598 1.00 0.00 H new ATOM 0 HH12 ARG A 65 -18.749 9.557 -0.955 1.00 0.00 H new ATOM 0 HH21 ARG A 65 -20.369 10.317 -3.998 1.00 0.00 H new ATOM 0 HH22 ARG A 65 -20.140 10.782 -2.309 1.00 0.00 H new ATOM 1047 N ASP A 66 -17.532 7.679 -7.957 1.00 0.00 N ATOM 1048 CA ASP A 66 -17.232 8.961 -8.570 1.00 0.00 C ATOM 1049 C ASP A 66 -15.734 9.015 -8.813 1.00 0.00 C ATOM 1050 O ASP A 66 -15.043 8.013 -8.618 1.00 0.00 O ATOM 1051 CB ASP A 66 -17.638 10.125 -7.649 1.00 0.00 C ATOM 1052 CG ASP A 66 -19.120 10.157 -7.318 1.00 0.00 C ATOM 1053 OD1 ASP A 66 -19.547 9.425 -6.397 1.00 0.00 O ATOM 1054 OD2 ASP A 66 -19.861 10.934 -7.956 1.00 0.00 O ATOM 0 H ASP A 66 -16.778 7.320 -7.371 1.00 0.00 H new ATOM 0 HA ASP A 66 -17.790 9.059 -9.501 1.00 0.00 H new ATOM 0 HB2 ASP A 66 -17.070 10.057 -6.721 1.00 0.00 H new ATOM 0 HB3 ASP A 66 -17.361 11.066 -8.125 1.00 0.00 H new ATOM 1059 N LYS A 67 -15.225 10.160 -9.232 1.00 0.00 N ATOM 1060 CA LYS A 67 -13.786 10.345 -9.321 1.00 0.00 C ATOM 1061 C LYS A 67 -13.241 10.644 -7.933 1.00 0.00 C ATOM 1062 O LYS A 67 -13.711 11.573 -7.275 1.00 0.00 O ATOM 1063 CB LYS A 67 -13.433 11.502 -10.260 1.00 0.00 C ATOM 1064 CG LYS A 67 -14.030 11.382 -11.652 1.00 0.00 C ATOM 1065 CD LYS A 67 -13.666 12.581 -12.516 1.00 0.00 C ATOM 1066 CE LYS A 67 -14.024 13.891 -11.830 1.00 0.00 C ATOM 1067 NZ LYS A 67 -15.490 14.042 -11.613 1.00 0.00 N ATOM 0 H LYS A 67 -15.779 10.969 -9.514 1.00 0.00 H new ATOM 0 HA LYS A 67 -13.342 9.433 -9.720 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -13.773 12.435 -9.811 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -12.348 11.566 -10.347 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -13.672 10.468 -12.126 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -15.114 11.300 -11.579 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -12.598 12.563 -12.734 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -14.187 12.515 -13.471 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -13.511 13.946 -10.870 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -13.662 14.724 -12.433 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -15.680 14.950 -11.143 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -15.981 14.017 -12.529 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -15.834 13.264 -11.015 1.00 0.00 H new ATOM 1081 N LYS A 68 -12.282 9.853 -7.465 1.00 0.00 N ATOM 1082 CA LYS A 68 -11.670 10.133 -6.177 1.00 0.00 C ATOM 1083 C LYS A 68 -10.924 11.459 -6.250 1.00 0.00 C ATOM 1084 O LYS A 68 -9.994 11.629 -7.039 1.00 0.00 O ATOM 1085 CB LYS A 68 -10.749 8.993 -5.716 1.00 0.00 C ATOM 1086 CG LYS A 68 -9.559 8.723 -6.622 1.00 0.00 C ATOM 1087 CD LYS A 68 -8.627 7.700 -5.997 1.00 0.00 C ATOM 1088 CE LYS A 68 -7.405 7.451 -6.861 1.00 0.00 C ATOM 1089 NZ LYS A 68 -7.770 6.899 -8.191 1.00 0.00 N ATOM 0 H LYS A 68 -11.919 9.031 -7.948 1.00 0.00 H new ATOM 0 HA LYS A 68 -12.459 10.209 -5.428 1.00 0.00 H new ATOM 0 HB2 LYS A 68 -10.381 9.225 -4.717 1.00 0.00 H new ATOM 0 HB3 LYS A 68 -11.339 8.080 -5.634 1.00 0.00 H new ATOM 0 HG2 LYS A 68 -9.907 8.361 -7.589 1.00 0.00 H new ATOM 0 HG3 LYS A 68 -9.017 9.651 -6.805 1.00 0.00 H new ATOM 0 HD2 LYS A 68 -8.312 8.048 -5.013 1.00 0.00 H new ATOM 0 HD3 LYS A 68 -9.163 6.763 -5.847 1.00 0.00 H new ATOM 0 HE2 LYS A 68 -6.858 8.384 -6.993 1.00 0.00 H new ATOM 0 HE3 LYS A 68 -6.735 6.758 -6.352 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 -7.076 6.176 -8.469 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 -8.716 6.469 -8.141 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 -7.774 7.664 -8.895 1.00 0.00 H new ATOM 1103 N HIS A 69 -11.357 12.403 -5.433 1.00 0.00 N ATOM 1104 CA HIS A 69 -10.860 13.770 -5.498 1.00 0.00 C ATOM 1105 C HIS A 69 -9.585 13.921 -4.666 1.00 0.00 C ATOM 1106 O HIS A 69 -9.319 14.978 -4.094 1.00 0.00 O ATOM 1107 CB HIS A 69 -11.955 14.720 -5.003 1.00 0.00 C ATOM 1108 CG HIS A 69 -11.726 16.164 -5.336 1.00 0.00 C ATOM 1109 ND1 HIS A 69 -11.999 17.185 -4.456 1.00 0.00 N ATOM 1110 CD2 HIS A 69 -11.280 16.757 -6.468 1.00 0.00 C ATOM 1111 CE1 HIS A 69 -11.738 18.342 -5.031 1.00 0.00 C ATOM 1112 NE2 HIS A 69 -11.299 18.113 -6.256 1.00 0.00 N ATOM 0 H HIS A 69 -12.059 12.247 -4.709 1.00 0.00 H new ATOM 0 HA HIS A 69 -10.608 14.019 -6.529 1.00 0.00 H new ATOM 0 HB2 HIS A 69 -12.908 14.409 -5.431 1.00 0.00 H new ATOM 0 HB3 HIS A 69 -12.043 14.620 -3.921 1.00 0.00 H new ATOM 0 HD2 HIS A 69 -10.967 16.256 -7.372 1.00 0.00 H new ATOM 0 HE1 HIS A 69 -11.862 19.314 -4.577 1.00 0.00 H new ATOM 0 HE2 HIS A 69 -11.021 18.825 -6.931 1.00 0.00 H new ATOM 1121 N THR A 70 -8.794 12.861 -4.621 1.00 0.00 N ATOM 1122 CA THR A 70 -7.543 12.871 -3.892 1.00 0.00 C ATOM 1123 C THR A 70 -6.521 11.952 -4.562 1.00 0.00 C ATOM 1124 O THR A 70 -6.787 10.773 -4.802 1.00 0.00 O ATOM 1125 CB THR A 70 -7.743 12.471 -2.406 1.00 0.00 C ATOM 1126 OG1 THR A 70 -6.484 12.439 -1.717 1.00 0.00 O ATOM 1127 CG2 THR A 70 -8.433 11.120 -2.276 1.00 0.00 C ATOM 0 H THR A 70 -9.002 11.977 -5.086 1.00 0.00 H new ATOM 0 HA THR A 70 -7.161 13.892 -3.911 1.00 0.00 H new ATOM 0 HB THR A 70 -8.384 13.227 -1.951 1.00 0.00 H new ATOM 0 HG1 THR A 70 -6.629 12.187 -0.781 1.00 0.00 H new ATOM 0 HG21 THR A 70 -8.556 10.874 -1.221 1.00 0.00 H new ATOM 0 HG22 THR A 70 -9.411 11.164 -2.754 1.00 0.00 H new ATOM 0 HG23 THR A 70 -7.827 10.354 -2.759 1.00 0.00 H new ATOM 1135 N GLU A 71 -5.374 12.526 -4.880 1.00 0.00 N ATOM 1136 CA GLU A 71 -4.258 11.809 -5.481 1.00 0.00 C ATOM 1137 C GLU A 71 -3.075 12.767 -5.531 1.00 0.00 C ATOM 1138 O GLU A 71 -2.552 13.102 -4.452 1.00 0.00 O ATOM 1139 CB GLU A 71 -4.618 11.298 -6.893 1.00 0.00 C ATOM 1140 CG GLU A 71 -3.519 10.487 -7.581 1.00 0.00 C ATOM 1141 CD GLU A 71 -3.320 9.095 -7.000 1.00 0.00 C ATOM 1142 OE1 GLU A 71 -4.186 8.220 -7.228 1.00 0.00 O ATOM 1143 OE2 GLU A 71 -2.272 8.851 -6.362 1.00 0.00 O ATOM 1144 OXT GLU A 71 -2.714 13.240 -6.631 1.00 0.00 O ATOM 0 H GLU A 71 -5.187 13.517 -4.727 1.00 0.00 H new ATOM 0 HA GLU A 71 -4.010 10.930 -4.886 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -5.515 10.682 -6.824 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -4.866 12.153 -7.521 1.00 0.00 H new ATOM 0 HG2 GLU A 71 -3.758 10.396 -8.641 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -2.580 11.036 -7.512 1.00 0.00 H new TER 1151 GLU A 71 ATOM 1152 N MET B 1 20.504 -0.295 -8.855 1.00 0.00 N ATOM 1153 CA MET B 1 19.329 0.065 -9.681 1.00 0.00 C ATOM 1154 C MET B 1 18.584 1.226 -9.065 1.00 0.00 C ATOM 1155 O MET B 1 18.414 1.300 -7.848 1.00 0.00 O ATOM 1156 CB MET B 1 18.354 -1.113 -9.827 1.00 0.00 C ATOM 1157 CG MET B 1 17.935 -1.736 -8.505 1.00 0.00 C ATOM 1158 SD MET B 1 16.879 -3.179 -8.718 1.00 0.00 S ATOM 1159 CE MET B 1 16.597 -3.643 -7.012 1.00 0.00 C ATOM 0 H1 MET B 1 20.975 -1.126 -9.265 1.00 0.00 H new ATOM 0 H2 MET B 1 21.170 0.504 -8.832 1.00 0.00 H new ATOM 0 H3 MET B 1 20.194 -0.515 -7.887 1.00 0.00 H new ATOM 0 HA MET B 1 19.707 0.338 -10.666 1.00 0.00 H new ATOM 0 HB2 MET B 1 17.463 -0.771 -10.354 1.00 0.00 H new ATOM 0 HB3 MET B 1 18.817 -1.880 -10.448 1.00 0.00 H new ATOM 0 HG2 MET B 1 18.825 -2.022 -7.945 1.00 0.00 H new ATOM 0 HG3 MET B 1 17.409 -0.991 -7.908 1.00 0.00 H new ATOM 0 HE1 MET B 1 16.143 -4.633 -6.975 1.00 0.00 H new ATOM 0 HE2 MET B 1 17.547 -3.659 -6.478 1.00 0.00 H new ATOM 0 HE3 MET B 1 15.929 -2.920 -6.544 1.00 0.00 H new ATOM 1171 N GLN B 2 18.147 2.133 -9.907 1.00 0.00 N ATOM 1172 CA GLN B 2 17.259 3.186 -9.478 1.00 0.00 C ATOM 1173 C GLN B 2 15.864 2.611 -9.314 1.00 0.00 C ATOM 1174 O GLN B 2 15.394 1.864 -10.173 1.00 0.00 O ATOM 1175 CB GLN B 2 17.245 4.331 -10.491 1.00 0.00 C ATOM 1176 CG GLN B 2 18.512 5.170 -10.490 1.00 0.00 C ATOM 1177 CD GLN B 2 18.544 6.177 -11.622 1.00 0.00 C ATOM 1178 OE1 GLN B 2 17.504 6.631 -12.098 1.00 0.00 O ATOM 1179 NE2 GLN B 2 19.739 6.541 -12.054 1.00 0.00 N ATOM 0 H GLN B 2 18.393 2.162 -10.896 1.00 0.00 H new ATOM 0 HA GLN B 2 17.608 3.588 -8.527 1.00 0.00 H new ATOM 0 HB2 GLN B 2 17.095 3.918 -11.489 1.00 0.00 H new ATOM 0 HB3 GLN B 2 16.393 4.978 -10.282 1.00 0.00 H new ATOM 0 HG2 GLN B 2 18.595 5.695 -9.539 1.00 0.00 H new ATOM 0 HG3 GLN B 2 19.378 4.513 -10.568 1.00 0.00 H new ATOM 0 HE21 GLN B 2 20.577 6.141 -11.633 1.00 0.00 H new ATOM 0 HE22 GLN B 2 19.823 7.222 -12.809 1.00 0.00 H new ATOM 1188 N ILE B 3 15.236 2.905 -8.193 1.00 0.00 N ATOM 1189 CA ILE B 3 13.857 2.519 -7.972 1.00 0.00 C ATOM 1190 C ILE B 3 13.021 3.758 -7.714 1.00 0.00 C ATOM 1191 O ILE B 3 13.504 4.731 -7.133 1.00 0.00 O ATOM 1192 CB ILE B 3 13.697 1.531 -6.793 1.00 0.00 C ATOM 1193 CG1 ILE B 3 14.315 2.105 -5.511 1.00 0.00 C ATOM 1194 CG2 ILE B 3 14.321 0.186 -7.141 1.00 0.00 C ATOM 1195 CD1 ILE B 3 14.032 1.283 -4.269 1.00 0.00 C ATOM 0 H ILE B 3 15.662 3.413 -7.417 1.00 0.00 H new ATOM 0 HA ILE B 3 13.515 2.007 -8.871 1.00 0.00 H new ATOM 0 HB ILE B 3 12.633 1.380 -6.612 1.00 0.00 H new ATOM 0 HG12 ILE B 3 15.394 2.184 -5.644 1.00 0.00 H new ATOM 0 HG13 ILE B 3 13.937 3.116 -5.359 1.00 0.00 H new ATOM 0 HG21 ILE B 3 14.201 -0.499 -6.302 1.00 0.00 H new ATOM 0 HG22 ILE B 3 13.827 -0.227 -8.020 1.00 0.00 H new ATOM 0 HG23 ILE B 3 15.382 0.320 -7.350 1.00 0.00 H new ATOM 0 HD11 ILE B 3 14.502 1.754 -3.406 1.00 0.00 H new ATOM 0 HD12 ILE B 3 12.955 1.225 -4.109 1.00 0.00 H new ATOM 0 HD13 ILE B 3 14.435 0.278 -4.398 1.00 0.00 H new ATOM 1207 N PHE B 4 11.784 3.732 -8.165 1.00 0.00 N ATOM 1208 CA PHE B 4 10.894 4.861 -7.983 1.00 0.00 C ATOM 1209 C PHE B 4 10.041 4.649 -6.746 1.00 0.00 C ATOM 1210 O PHE B 4 9.021 3.962 -6.797 1.00 0.00 O ATOM 1211 CB PHE B 4 10.007 5.054 -9.215 1.00 0.00 C ATOM 1212 CG PHE B 4 10.780 5.292 -10.483 1.00 0.00 C ATOM 1213 CD1 PHE B 4 11.298 6.545 -10.771 1.00 0.00 C ATOM 1214 CD2 PHE B 4 10.989 4.260 -11.385 1.00 0.00 C ATOM 1215 CE1 PHE B 4 12.011 6.765 -11.936 1.00 0.00 C ATOM 1216 CE2 PHE B 4 11.700 4.474 -12.551 1.00 0.00 C ATOM 1217 CZ PHE B 4 12.211 5.728 -12.827 1.00 0.00 C ATOM 0 H PHE B 4 11.371 2.942 -8.660 1.00 0.00 H new ATOM 0 HA PHE B 4 11.494 5.762 -7.852 1.00 0.00 H new ATOM 0 HB2 PHE B 4 9.380 4.172 -9.342 1.00 0.00 H new ATOM 0 HB3 PHE B 4 9.339 5.898 -9.043 1.00 0.00 H new ATOM 0 HD1 PHE B 4 11.143 7.359 -10.078 1.00 0.00 H new ATOM 0 HD2 PHE B 4 10.592 3.278 -11.174 1.00 0.00 H new ATOM 0 HE1 PHE B 4 12.411 7.746 -12.149 1.00 0.00 H new ATOM 0 HE2 PHE B 4 11.856 3.662 -13.246 1.00 0.00 H new ATOM 0 HZ PHE B 4 12.766 5.897 -13.738 1.00 0.00 H new ATOM 1227 N VAL B 5 10.481 5.207 -5.630 1.00 0.00 N ATOM 1228 CA VAL B 5 9.728 5.116 -4.395 1.00 0.00 C ATOM 1229 C VAL B 5 8.607 6.138 -4.420 1.00 0.00 C ATOM 1230 O VAL B 5 8.803 7.304 -4.084 1.00 0.00 O ATOM 1231 CB VAL B 5 10.611 5.345 -3.152 1.00 0.00 C ATOM 1232 CG1 VAL B 5 9.801 5.156 -1.879 1.00 0.00 C ATOM 1233 CG2 VAL B 5 11.816 4.413 -3.168 1.00 0.00 C ATOM 0 H VAL B 5 11.355 5.727 -5.556 1.00 0.00 H new ATOM 0 HA VAL B 5 9.325 4.106 -4.324 1.00 0.00 H new ATOM 0 HB VAL B 5 10.976 6.372 -3.176 1.00 0.00 H new ATOM 0 HG11 VAL B 5 10.441 5.322 -1.012 1.00 0.00 H new ATOM 0 HG12 VAL B 5 8.977 5.869 -1.863 1.00 0.00 H new ATOM 0 HG13 VAL B 5 9.404 4.141 -1.848 1.00 0.00 H new ATOM 0 HG21 VAL B 5 12.426 4.591 -2.282 1.00 0.00 H new ATOM 0 HG22 VAL B 5 11.475 3.378 -3.172 1.00 0.00 H new ATOM 0 HG23 VAL B 5 12.411 4.602 -4.062 1.00 0.00 H new ATOM 1243 N LYS B 6 7.447 5.694 -4.860 1.00 0.00 N ATOM 1244 CA LYS B 6 6.305 6.562 -5.042 1.00 0.00 C ATOM 1245 C LYS B 6 5.381 6.434 -3.839 1.00 0.00 C ATOM 1246 O LYS B 6 4.692 5.425 -3.681 1.00 0.00 O ATOM 1247 CB LYS B 6 5.588 6.181 -6.348 1.00 0.00 C ATOM 1248 CG LYS B 6 4.675 7.257 -6.921 1.00 0.00 C ATOM 1249 CD LYS B 6 3.355 7.347 -6.181 1.00 0.00 C ATOM 1250 CE LYS B 6 2.486 8.463 -6.741 1.00 0.00 C ATOM 1251 NZ LYS B 6 1.235 8.660 -5.957 1.00 0.00 N ATOM 0 H LYS B 6 7.271 4.719 -5.101 1.00 0.00 H new ATOM 0 HA LYS B 6 6.621 7.602 -5.117 1.00 0.00 H new ATOM 0 HB2 LYS B 6 6.339 5.927 -7.096 1.00 0.00 H new ATOM 0 HB3 LYS B 6 4.998 5.282 -6.171 1.00 0.00 H new ATOM 0 HG2 LYS B 6 5.181 8.221 -6.875 1.00 0.00 H new ATOM 0 HG3 LYS B 6 4.485 7.046 -7.973 1.00 0.00 H new ATOM 0 HD2 LYS B 6 2.826 6.397 -6.258 1.00 0.00 H new ATOM 0 HD3 LYS B 6 3.540 7.523 -5.121 1.00 0.00 H new ATOM 0 HE2 LYS B 6 3.055 9.392 -6.750 1.00 0.00 H new ATOM 0 HE3 LYS B 6 2.230 8.235 -7.776 1.00 0.00 H new ATOM 0 HZ1 LYS B 6 0.917 9.646 -6.053 1.00 0.00 H new ATOM 0 HZ2 LYS B 6 0.496 8.022 -6.316 1.00 0.00 H new ATOM 0 HZ3 LYS B 6 1.417 8.451 -4.955 1.00 0.00 H new ATOM 1265 N THR B 7 5.394 7.442 -2.978 1.00 0.00 N ATOM 1266 CA THR B 7 4.573 7.422 -1.778 1.00 0.00 C ATOM 1267 C THR B 7 3.095 7.485 -2.139 1.00 0.00 C ATOM 1268 O THR B 7 2.735 7.793 -3.279 1.00 0.00 O ATOM 1269 CB THR B 7 4.914 8.588 -0.825 1.00 0.00 C ATOM 1270 OG1 THR B 7 4.609 9.841 -1.448 1.00 0.00 O ATOM 1271 CG2 THR B 7 6.383 8.561 -0.432 1.00 0.00 C ATOM 0 H THR B 7 5.963 8.281 -3.089 1.00 0.00 H new ATOM 0 HA THR B 7 4.787 6.485 -1.263 1.00 0.00 H new ATOM 0 HB THR B 7 4.311 8.472 0.075 1.00 0.00 H new ATOM 0 HG1 THR B 7 4.886 10.575 -0.860 1.00 0.00 H new ATOM 0 HG21 THR B 7 6.595 9.393 0.239 1.00 0.00 H new ATOM 0 HG22 THR B 7 6.607 7.621 0.073 1.00 0.00 H new ATOM 0 HG23 THR B 7 7.000 8.649 -1.326 1.00 0.00 H new ATOM 1279 N LEU B 8 2.247 7.186 -1.172 1.00 0.00 N ATOM 1280 CA LEU B 8 0.810 7.188 -1.385 1.00 0.00 C ATOM 1281 C LEU B 8 0.333 8.552 -1.876 1.00 0.00 C ATOM 1282 O LEU B 8 -0.305 8.654 -2.923 1.00 0.00 O ATOM 1283 CB LEU B 8 0.098 6.793 -0.086 1.00 0.00 C ATOM 1284 CG LEU B 8 -1.390 6.468 -0.219 1.00 0.00 C ATOM 1285 CD1 LEU B 8 -1.791 5.476 0.847 1.00 0.00 C ATOM 1286 CD2 LEU B 8 -2.244 7.726 -0.108 1.00 0.00 C ATOM 0 H LEU B 8 2.531 6.937 -0.224 1.00 0.00 H new ATOM 0 HA LEU B 8 0.566 6.459 -2.157 1.00 0.00 H new ATOM 0 HB2 LEU B 8 0.605 5.925 0.335 1.00 0.00 H new ATOM 0 HB3 LEU B 8 0.211 7.606 0.631 1.00 0.00 H new ATOM 0 HG LEU B 8 -1.558 6.034 -1.205 1.00 0.00 H new ATOM 0 HD11 LEU B 8 -2.852 5.246 0.750 1.00 0.00 H new ATOM 0 HD12 LEU B 8 -1.210 4.561 0.730 1.00 0.00 H new ATOM 0 HD13 LEU B 8 -1.601 5.903 1.832 1.00 0.00 H new ATOM 0 HD21 LEU B 8 -3.297 7.461 -0.207 1.00 0.00 H new ATOM 0 HD22 LEU B 8 -2.077 8.195 0.862 1.00 0.00 H new ATOM 0 HD23 LEU B 8 -1.970 8.423 -0.900 1.00 0.00 H new ATOM 1298 N THR B 9 0.686 9.594 -1.138 1.00 0.00 N ATOM 1299 CA THR B 9 0.207 10.937 -1.426 1.00 0.00 C ATOM 1300 C THR B 9 0.789 11.506 -2.723 1.00 0.00 C ATOM 1301 O THR B 9 0.061 12.075 -3.532 1.00 0.00 O ATOM 1302 CB THR B 9 0.509 11.882 -0.254 1.00 0.00 C ATOM 1303 OG1 THR B 9 1.846 11.657 0.215 1.00 0.00 O ATOM 1304 CG2 THR B 9 -0.478 11.663 0.883 1.00 0.00 C ATOM 0 H THR B 9 1.306 9.534 -0.331 1.00 0.00 H new ATOM 0 HA THR B 9 -0.872 10.861 -1.562 1.00 0.00 H new ATOM 0 HB THR B 9 0.412 12.910 -0.603 1.00 0.00 H new ATOM 0 HG1 THR B 9 2.037 12.262 0.962 1.00 0.00 H new ATOM 0 HG21 THR B 9 -0.245 12.343 1.703 1.00 0.00 H new ATOM 0 HG22 THR B 9 -1.490 11.855 0.528 1.00 0.00 H new ATOM 0 HG23 THR B 9 -0.406 10.634 1.234 1.00 0.00 H new ATOM 1312 N GLY B 10 2.093 11.368 -2.932 1.00 0.00 N ATOM 1313 CA GLY B 10 2.662 11.827 -4.188 1.00 0.00 C ATOM 1314 C GLY B 10 4.095 12.313 -4.088 1.00 0.00 C ATOM 1315 O GLY B 10 4.388 13.463 -4.405 1.00 0.00 O ATOM 0 H GLY B 10 2.754 10.957 -2.273 1.00 0.00 H new ATOM 0 HA2 GLY B 10 2.617 11.013 -4.912 1.00 0.00 H new ATOM 0 HA3 GLY B 10 2.044 12.635 -4.579 1.00 0.00 H new ATOM 1319 N LYS B 11 4.984 11.444 -3.637 1.00 0.00 N ATOM 1320 CA LYS B 11 6.417 11.702 -3.702 1.00 0.00 C ATOM 1321 C LYS B 11 7.082 10.594 -4.501 1.00 0.00 C ATOM 1322 O LYS B 11 7.052 9.438 -4.088 1.00 0.00 O ATOM 1323 CB LYS B 11 7.055 11.756 -2.305 1.00 0.00 C ATOM 1324 CG LYS B 11 6.650 12.952 -1.460 1.00 0.00 C ATOM 1325 CD LYS B 11 7.367 12.930 -0.117 1.00 0.00 C ATOM 1326 CE LYS B 11 6.941 14.083 0.779 1.00 0.00 C ATOM 1327 NZ LYS B 11 5.506 13.999 1.157 1.00 0.00 N ATOM 0 H LYS B 11 4.738 10.547 -3.219 1.00 0.00 H new ATOM 0 HA LYS B 11 6.562 12.672 -4.178 1.00 0.00 H new ATOM 0 HB2 LYS B 11 6.793 10.845 -1.767 1.00 0.00 H new ATOM 0 HB3 LYS B 11 8.139 11.760 -2.417 1.00 0.00 H new ATOM 0 HG2 LYS B 11 6.887 13.875 -1.989 1.00 0.00 H new ATOM 0 HG3 LYS B 11 5.572 12.944 -1.302 1.00 0.00 H new ATOM 0 HD2 LYS B 11 7.163 11.985 0.387 1.00 0.00 H new ATOM 0 HD3 LYS B 11 8.444 12.977 -0.281 1.00 0.00 H new ATOM 0 HE2 LYS B 11 7.553 14.085 1.681 1.00 0.00 H new ATOM 0 HE3 LYS B 11 7.125 15.027 0.266 1.00 0.00 H new ATOM 0 HZ1 LYS B 11 5.308 14.677 1.920 1.00 0.00 H new ATOM 0 HZ2 LYS B 11 4.916 14.225 0.331 1.00 0.00 H new ATOM 0 HZ3 LYS B 11 5.289 13.036 1.484 1.00 0.00 H new ATOM 1341 N THR B 12 7.643 10.933 -5.651 1.00 0.00 N ATOM 1342 CA THR B 12 8.370 9.960 -6.449 1.00 0.00 C ATOM 1343 C THR B 12 9.864 10.070 -6.163 1.00 0.00 C ATOM 1344 O THR B 12 10.567 10.892 -6.754 1.00 0.00 O ATOM 1345 CB THR B 12 8.109 10.159 -7.952 1.00 0.00 C ATOM 1346 OG1 THR B 12 6.717 10.419 -8.165 1.00 0.00 O ATOM 1347 CG2 THR B 12 8.526 8.927 -8.745 1.00 0.00 C ATOM 0 H THR B 12 7.609 11.871 -6.051 1.00 0.00 H new ATOM 0 HA THR B 12 8.017 8.966 -6.175 1.00 0.00 H new ATOM 0 HB THR B 12 8.701 11.007 -8.297 1.00 0.00 H new ATOM 0 HG1 THR B 12 6.551 10.547 -9.122 1.00 0.00 H new ATOM 0 HG21 THR B 12 8.331 9.093 -9.805 1.00 0.00 H new ATOM 0 HG22 THR B 12 9.590 8.741 -8.596 1.00 0.00 H new ATOM 0 HG23 THR B 12 7.956 8.064 -8.402 1.00 0.00 H new ATOM 1355 N ILE B 13 10.334 9.263 -5.229 1.00 0.00 N ATOM 1356 CA ILE B 13 11.715 9.324 -4.790 1.00 0.00 C ATOM 1357 C ILE B 13 12.570 8.324 -5.556 1.00 0.00 C ATOM 1358 O ILE B 13 12.456 7.116 -5.352 1.00 0.00 O ATOM 1359 CB ILE B 13 11.833 9.036 -3.279 1.00 0.00 C ATOM 1360 CG1 ILE B 13 10.848 9.905 -2.493 1.00 0.00 C ATOM 1361 CG2 ILE B 13 13.261 9.284 -2.805 1.00 0.00 C ATOM 1362 CD1 ILE B 13 10.763 9.549 -1.025 1.00 0.00 C ATOM 0 H ILE B 13 9.774 8.553 -4.757 1.00 0.00 H new ATOM 0 HA ILE B 13 12.073 10.334 -4.988 1.00 0.00 H new ATOM 0 HB ILE B 13 11.586 7.989 -3.102 1.00 0.00 H new ATOM 0 HG12 ILE B 13 11.143 10.950 -2.588 1.00 0.00 H new ATOM 0 HG13 ILE B 13 9.858 9.811 -2.939 1.00 0.00 H new ATOM 0 HG21 ILE B 13 13.331 9.077 -1.737 1.00 0.00 H new ATOM 0 HG22 ILE B 13 13.943 8.629 -3.347 1.00 0.00 H new ATOM 0 HG23 ILE B 13 13.531 10.323 -2.992 1.00 0.00 H new ATOM 0 HD11 ILE B 13 10.046 10.206 -0.532 1.00 0.00 H new ATOM 0 HD12 ILE B 13 10.438 8.514 -0.920 1.00 0.00 H new ATOM 0 HD13 ILE B 13 11.743 9.671 -0.564 1.00 0.00 H new ATOM 1374 N THR B 14 13.404 8.829 -6.453 1.00 0.00 N ATOM 1375 CA THR B 14 14.340 7.985 -7.176 1.00 0.00 C ATOM 1376 C THR B 14 15.483 7.575 -6.251 1.00 0.00 C ATOM 1377 O THR B 14 16.289 8.411 -5.841 1.00 0.00 O ATOM 1378 CB THR B 14 14.911 8.714 -8.407 1.00 0.00 C ATOM 1379 OG1 THR B 14 13.842 9.302 -9.162 1.00 0.00 O ATOM 1380 CG2 THR B 14 15.688 7.751 -9.292 1.00 0.00 C ATOM 0 H THR B 14 13.451 9.818 -6.697 1.00 0.00 H new ATOM 0 HA THR B 14 13.804 7.100 -7.519 1.00 0.00 H new ATOM 0 HB THR B 14 15.589 9.494 -8.061 1.00 0.00 H new ATOM 0 HG1 THR B 14 14.210 9.766 -9.943 1.00 0.00 H new ATOM 0 HG21 THR B 14 16.082 8.287 -10.155 1.00 0.00 H new ATOM 0 HG22 THR B 14 16.513 7.320 -8.725 1.00 0.00 H new ATOM 0 HG23 THR B 14 15.026 6.954 -9.631 1.00 0.00 H new ATOM 1388 N LEU B 15 15.539 6.298 -5.915 1.00 0.00 N ATOM 1389 CA LEU B 15 16.534 5.804 -4.976 1.00 0.00 C ATOM 1390 C LEU B 15 17.458 4.795 -5.651 1.00 0.00 C ATOM 1391 O LEU B 15 16.996 3.880 -6.329 1.00 0.00 O ATOM 1392 CB LEU B 15 15.835 5.159 -3.773 1.00 0.00 C ATOM 1393 CG LEU B 15 16.342 5.601 -2.398 1.00 0.00 C ATOM 1394 CD1 LEU B 15 17.808 5.255 -2.227 1.00 0.00 C ATOM 1395 CD2 LEU B 15 16.127 7.094 -2.202 1.00 0.00 C ATOM 0 H LEU B 15 14.908 5.584 -6.278 1.00 0.00 H new ATOM 0 HA LEU B 15 17.138 6.644 -4.633 1.00 0.00 H new ATOM 0 HB2 LEU B 15 14.769 5.378 -3.835 1.00 0.00 H new ATOM 0 HB3 LEU B 15 15.943 4.077 -3.850 1.00 0.00 H new ATOM 0 HG LEU B 15 15.771 5.065 -1.640 1.00 0.00 H new ATOM 0 HD11 LEU B 15 18.146 5.579 -1.243 1.00 0.00 H new ATOM 0 HD12 LEU B 15 17.941 4.177 -2.320 1.00 0.00 H new ATOM 0 HD13 LEU B 15 18.393 5.760 -2.996 1.00 0.00 H new ATOM 0 HD21 LEU B 15 16.494 7.388 -1.219 1.00 0.00 H new ATOM 0 HD22 LEU B 15 16.669 7.644 -2.971 1.00 0.00 H new ATOM 0 HD23 LEU B 15 15.063 7.321 -2.275 1.00 0.00 H new ATOM 1407 N GLU B 16 18.761 4.973 -5.474 1.00 0.00 N ATOM 1408 CA GLU B 16 19.746 4.046 -6.016 1.00 0.00 C ATOM 1409 C GLU B 16 20.029 2.938 -5.000 1.00 0.00 C ATOM 1410 O GLU B 16 20.669 3.169 -3.970 1.00 0.00 O ATOM 1411 CB GLU B 16 21.036 4.798 -6.370 1.00 0.00 C ATOM 1412 CG GLU B 16 22.136 3.924 -6.955 1.00 0.00 C ATOM 1413 CD GLU B 16 21.796 3.365 -8.321 1.00 0.00 C ATOM 1414 OE1 GLU B 16 21.894 4.111 -9.317 1.00 0.00 O ATOM 1415 OE2 GLU B 16 21.467 2.166 -8.413 1.00 0.00 O ATOM 0 H GLU B 16 19.162 5.755 -4.956 1.00 0.00 H new ATOM 0 HA GLU B 16 19.351 3.592 -6.925 1.00 0.00 H new ATOM 0 HB2 GLU B 16 20.798 5.586 -7.084 1.00 0.00 H new ATOM 0 HB3 GLU B 16 21.416 5.285 -5.472 1.00 0.00 H new ATOM 0 HG2 GLU B 16 23.054 4.507 -7.027 1.00 0.00 H new ATOM 0 HG3 GLU B 16 22.336 3.098 -6.272 1.00 0.00 H new ATOM 1422 N VAL B 17 19.525 1.745 -5.274 1.00 0.00 N ATOM 1423 CA VAL B 17 19.696 0.614 -4.368 1.00 0.00 C ATOM 1424 C VAL B 17 20.092 -0.637 -5.148 1.00 0.00 C ATOM 1425 O VAL B 17 19.813 -0.743 -6.339 1.00 0.00 O ATOM 1426 CB VAL B 17 18.403 0.332 -3.565 1.00 0.00 C ATOM 1427 CG1 VAL B 17 18.002 1.543 -2.736 1.00 0.00 C ATOM 1428 CG2 VAL B 17 17.273 -0.085 -4.496 1.00 0.00 C ATOM 0 H VAL B 17 18.993 1.532 -6.118 1.00 0.00 H new ATOM 0 HA VAL B 17 20.489 0.873 -3.667 1.00 0.00 H new ATOM 0 HB VAL B 17 18.603 -0.492 -2.880 1.00 0.00 H new ATOM 0 HG11 VAL B 17 17.091 1.319 -2.182 1.00 0.00 H new ATOM 0 HG12 VAL B 17 18.802 1.786 -2.037 1.00 0.00 H new ATOM 0 HG13 VAL B 17 17.826 2.393 -3.395 1.00 0.00 H new ATOM 0 HG21 VAL B 17 16.373 -0.279 -3.912 1.00 0.00 H new ATOM 0 HG22 VAL B 17 17.077 0.714 -5.211 1.00 0.00 H new ATOM 0 HG23 VAL B 17 17.559 -0.990 -5.033 1.00 0.00 H new ATOM 1438 N GLU B 18 20.753 -1.574 -4.487 1.00 0.00 N ATOM 1439 CA GLU B 18 21.152 -2.818 -5.127 1.00 0.00 C ATOM 1440 C GLU B 18 20.099 -3.895 -4.883 1.00 0.00 C ATOM 1441 O GLU B 18 19.167 -3.695 -4.105 1.00 0.00 O ATOM 1442 CB GLU B 18 22.502 -3.285 -4.575 1.00 0.00 C ATOM 1443 CG GLU B 18 23.593 -2.231 -4.637 1.00 0.00 C ATOM 1444 CD GLU B 18 24.916 -2.736 -4.096 1.00 0.00 C ATOM 1445 OE1 GLU B 18 24.976 -3.106 -2.906 1.00 0.00 O ATOM 1446 OE2 GLU B 18 25.902 -2.773 -4.859 1.00 0.00 O ATOM 0 H GLU B 18 21.025 -1.497 -3.507 1.00 0.00 H new ATOM 0 HA GLU B 18 21.244 -2.644 -6.199 1.00 0.00 H new ATOM 0 HB2 GLU B 18 22.371 -3.597 -3.539 1.00 0.00 H new ATOM 0 HB3 GLU B 18 22.827 -4.163 -5.133 1.00 0.00 H new ATOM 0 HG2 GLU B 18 23.725 -1.909 -5.670 1.00 0.00 H new ATOM 0 HG3 GLU B 18 23.281 -1.355 -4.068 1.00 0.00 H new ATOM 1453 N SER B 19 20.248 -5.036 -5.540 1.00 0.00 N ATOM 1454 CA SER B 19 19.388 -6.178 -5.265 1.00 0.00 C ATOM 1455 C SER B 19 19.748 -6.757 -3.903 1.00 0.00 C ATOM 1456 O SER B 19 18.918 -7.365 -3.224 1.00 0.00 O ATOM 1457 CB SER B 19 19.540 -7.244 -6.353 1.00 0.00 C ATOM 1458 OG SER B 19 19.272 -6.707 -7.638 1.00 0.00 O ATOM 0 H SER B 19 20.951 -5.196 -6.262 1.00 0.00 H new ATOM 0 HA SER B 19 18.348 -5.850 -5.259 1.00 0.00 H new ATOM 0 HB2 SER B 19 20.551 -7.650 -6.329 1.00 0.00 H new ATOM 0 HB3 SER B 19 18.860 -8.072 -6.153 1.00 0.00 H new ATOM 0 HG SER B 19 19.378 -7.408 -8.314 1.00 0.00 H new ATOM 1464 N SER B 20 20.998 -6.539 -3.505 1.00 0.00 N ATOM 1465 CA SER B 20 21.492 -6.996 -2.220 1.00 0.00 C ATOM 1466 C SER B 20 21.202 -5.968 -1.127 1.00 0.00 C ATOM 1467 O SER B 20 21.583 -6.151 0.031 1.00 0.00 O ATOM 1468 CB SER B 20 22.994 -7.257 -2.312 1.00 0.00 C ATOM 1469 OG SER B 20 23.293 -8.126 -3.396 1.00 0.00 O ATOM 0 H SER B 20 21.691 -6.042 -4.065 1.00 0.00 H new ATOM 0 HA SER B 20 20.979 -7.921 -1.958 1.00 0.00 H new ATOM 0 HB2 SER B 20 23.524 -6.313 -2.441 1.00 0.00 H new ATOM 0 HB3 SER B 20 23.348 -7.697 -1.380 1.00 0.00 H new ATOM 0 HG SER B 20 24.260 -8.278 -3.437 1.00 0.00 H new ATOM 1475 N ASP B 21 20.535 -4.879 -1.498 1.00 0.00 N ATOM 1476 CA ASP B 21 20.099 -3.887 -0.524 1.00 0.00 C ATOM 1477 C ASP B 21 18.968 -4.466 0.305 1.00 0.00 C ATOM 1478 O ASP B 21 18.142 -5.225 -0.204 1.00 0.00 O ATOM 1479 CB ASP B 21 19.625 -2.599 -1.213 1.00 0.00 C ATOM 1480 CG ASP B 21 20.590 -1.439 -1.051 1.00 0.00 C ATOM 1481 OD1 ASP B 21 21.527 -1.318 -1.867 1.00 0.00 O ATOM 1482 OD2 ASP B 21 20.408 -0.629 -0.119 1.00 0.00 O ATOM 0 H ASP B 21 20.286 -4.663 -2.463 1.00 0.00 H new ATOM 0 HA ASP B 21 20.945 -3.636 0.116 1.00 0.00 H new ATOM 0 HB2 ASP B 21 19.480 -2.796 -2.275 1.00 0.00 H new ATOM 0 HB3 ASP B 21 18.655 -2.314 -0.807 1.00 0.00 H new ATOM 1487 N THR B 22 18.941 -4.135 1.577 1.00 0.00 N ATOM 1488 CA THR B 22 17.865 -4.570 2.439 1.00 0.00 C ATOM 1489 C THR B 22 16.751 -3.533 2.416 1.00 0.00 C ATOM 1490 O THR B 22 17.008 -2.351 2.182 1.00 0.00 O ATOM 1491 CB THR B 22 18.350 -4.759 3.888 1.00 0.00 C ATOM 1492 OG1 THR B 22 18.821 -3.507 4.398 1.00 0.00 O ATOM 1493 CG2 THR B 22 19.461 -5.796 3.964 1.00 0.00 C ATOM 0 H THR B 22 19.652 -3.566 2.037 1.00 0.00 H new ATOM 0 HA THR B 22 17.500 -5.529 2.071 1.00 0.00 H new ATOM 0 HB THR B 22 17.513 -5.114 4.490 1.00 0.00 H new ATOM 0 HG1 THR B 22 19.129 -3.625 5.321 1.00 0.00 H new ATOM 0 HG21 THR B 22 19.784 -5.908 4.999 1.00 0.00 H new ATOM 0 HG22 THR B 22 19.092 -6.752 3.593 1.00 0.00 H new ATOM 0 HG23 THR B 22 20.304 -5.471 3.354 1.00 0.00 H new ATOM 1501 N ILE B 23 15.522 -3.967 2.659 1.00 0.00 N ATOM 1502 CA ILE B 23 14.403 -3.041 2.763 1.00 0.00 C ATOM 1503 C ILE B 23 14.666 -2.063 3.905 1.00 0.00 C ATOM 1504 O ILE B 23 14.253 -0.906 3.865 1.00 0.00 O ATOM 1505 CB ILE B 23 13.073 -3.786 3.006 1.00 0.00 C ATOM 1506 CG1 ILE B 23 12.852 -4.857 1.929 1.00 0.00 C ATOM 1507 CG2 ILE B 23 11.902 -2.809 3.034 1.00 0.00 C ATOM 1508 CD1 ILE B 23 12.761 -4.303 0.521 1.00 0.00 C ATOM 0 H ILE B 23 15.275 -4.948 2.787 1.00 0.00 H new ATOM 0 HA ILE B 23 14.314 -2.501 1.820 1.00 0.00 H new ATOM 0 HB ILE B 23 13.131 -4.277 3.977 1.00 0.00 H new ATOM 0 HG12 ILE B 23 13.669 -5.577 1.973 1.00 0.00 H new ATOM 0 HG13 ILE B 23 11.935 -5.401 2.155 1.00 0.00 H new ATOM 0 HG21 ILE B 23 10.975 -3.356 3.207 1.00 0.00 H new ATOM 0 HG22 ILE B 23 12.051 -2.086 3.836 1.00 0.00 H new ATOM 0 HG23 ILE B 23 11.842 -2.286 2.080 1.00 0.00 H new ATOM 0 HD11 ILE B 23 12.605 -5.121 -0.182 1.00 0.00 H new ATOM 0 HD12 ILE B 23 11.926 -3.605 0.458 1.00 0.00 H new ATOM 0 HD13 ILE B 23 13.687 -3.784 0.274 1.00 0.00 H new ATOM 1520 N ASP B 24 15.395 -2.545 4.907 1.00 0.00 N ATOM 1521 CA ASP B 24 15.807 -1.723 6.039 1.00 0.00 C ATOM 1522 C ASP B 24 16.707 -0.579 5.583 1.00 0.00 C ATOM 1523 O ASP B 24 16.492 0.579 5.947 1.00 0.00 O ATOM 1524 CB ASP B 24 16.546 -2.585 7.066 1.00 0.00 C ATOM 1525 CG ASP B 24 17.315 -1.759 8.077 1.00 0.00 C ATOM 1526 OD1 ASP B 24 16.704 -1.263 9.040 1.00 0.00 O ATOM 1527 OD2 ASP B 24 18.541 -1.603 7.912 1.00 0.00 O ATOM 0 H ASP B 24 15.715 -3.512 4.957 1.00 0.00 H new ATOM 0 HA ASP B 24 14.914 -1.297 6.496 1.00 0.00 H new ATOM 0 HB2 ASP B 24 15.827 -3.216 7.589 1.00 0.00 H new ATOM 0 HB3 ASP B 24 17.236 -3.251 6.547 1.00 0.00 H new ATOM 1532 N ASN B 25 17.702 -0.912 4.769 1.00 0.00 N ATOM 1533 CA ASN B 25 18.664 0.068 4.288 1.00 0.00 C ATOM 1534 C ASN B 25 17.980 1.098 3.398 1.00 0.00 C ATOM 1535 O ASN B 25 18.267 2.290 3.484 1.00 0.00 O ATOM 1536 CB ASN B 25 19.787 -0.614 3.509 1.00 0.00 C ATOM 1537 CG ASN B 25 20.991 0.287 3.340 1.00 0.00 C ATOM 1538 OD1 ASN B 25 21.306 1.094 4.212 1.00 0.00 O ATOM 1539 ND2 ASN B 25 21.660 0.178 2.208 1.00 0.00 N ATOM 0 H ASN B 25 17.863 -1.860 4.428 1.00 0.00 H new ATOM 0 HA ASN B 25 19.090 0.572 5.155 1.00 0.00 H new ATOM 0 HB2 ASN B 25 20.086 -1.525 4.028 1.00 0.00 H new ATOM 0 HB3 ASN B 25 19.418 -0.913 2.528 1.00 0.00 H new ATOM 0 HD21 ASN B 25 22.468 0.775 2.034 1.00 0.00 H new ATOM 0 HD22 ASN B 25 21.369 -0.504 1.507 1.00 0.00 H new ATOM 1546 N VAL B 26 17.068 0.634 2.546 1.00 0.00 N ATOM 1547 CA VAL B 26 16.324 1.525 1.672 1.00 0.00 C ATOM 1548 C VAL B 26 15.470 2.480 2.500 1.00 0.00 C ATOM 1549 O VAL B 26 15.405 3.675 2.210 1.00 0.00 O ATOM 1550 CB VAL B 26 15.429 0.744 0.685 1.00 0.00 C ATOM 1551 CG1 VAL B 26 14.808 1.684 -0.327 1.00 0.00 C ATOM 1552 CG2 VAL B 26 16.225 -0.335 -0.029 1.00 0.00 C ATOM 0 H VAL B 26 16.830 -0.353 2.446 1.00 0.00 H new ATOM 0 HA VAL B 26 17.048 2.094 1.089 1.00 0.00 H new ATOM 0 HB VAL B 26 14.634 0.267 1.258 1.00 0.00 H new ATOM 0 HG11 VAL B 26 14.181 1.116 -1.014 1.00 0.00 H new ATOM 0 HG12 VAL B 26 14.200 2.426 0.191 1.00 0.00 H new ATOM 0 HG13 VAL B 26 15.596 2.188 -0.887 1.00 0.00 H new ATOM 0 HG21 VAL B 26 15.573 -0.872 -0.719 1.00 0.00 H new ATOM 0 HG22 VAL B 26 17.043 0.124 -0.585 1.00 0.00 H new ATOM 0 HG23 VAL B 26 16.631 -1.033 0.704 1.00 0.00 H new ATOM 1562 N LYS B 27 14.844 1.950 3.553 1.00 0.00 N ATOM 1563 CA LYS B 27 14.078 2.775 4.486 1.00 0.00 C ATOM 1564 C LYS B 27 14.963 3.857 5.089 1.00 0.00 C ATOM 1565 O LYS B 27 14.557 5.014 5.200 1.00 0.00 O ATOM 1566 CB LYS B 27 13.479 1.933 5.619 1.00 0.00 C ATOM 1567 CG LYS B 27 12.347 1.010 5.193 1.00 0.00 C ATOM 1568 CD LYS B 27 11.751 0.303 6.401 1.00 0.00 C ATOM 1569 CE LYS B 27 10.546 -0.550 6.038 1.00 0.00 C ATOM 1570 NZ LYS B 27 9.792 -0.977 7.250 1.00 0.00 N ATOM 0 H LYS B 27 14.853 0.956 3.780 1.00 0.00 H new ATOM 0 HA LYS B 27 13.266 3.233 3.921 1.00 0.00 H new ATOM 0 HB2 LYS B 27 14.271 1.332 6.065 1.00 0.00 H new ATOM 0 HB3 LYS B 27 13.111 2.603 6.396 1.00 0.00 H new ATOM 0 HG2 LYS B 27 11.574 1.585 4.683 1.00 0.00 H new ATOM 0 HG3 LYS B 27 12.719 0.274 4.481 1.00 0.00 H new ATOM 0 HD2 LYS B 27 12.512 -0.326 6.862 1.00 0.00 H new ATOM 0 HD3 LYS B 27 11.457 1.044 7.144 1.00 0.00 H new ATOM 0 HE2 LYS B 27 9.886 0.013 5.378 1.00 0.00 H new ATOM 0 HE3 LYS B 27 10.875 -1.430 5.485 1.00 0.00 H new ATOM 0 HZ1 LYS B 27 8.799 -1.154 6.997 1.00 0.00 H new ATOM 0 HZ2 LYS B 27 10.213 -1.848 7.632 1.00 0.00 H new ATOM 0 HZ3 LYS B 27 9.837 -0.227 7.969 1.00 0.00 H new ATOM 1584 N SER B 28 16.174 3.470 5.476 1.00 0.00 N ATOM 1585 CA SER B 28 17.138 4.396 6.059 1.00 0.00 C ATOM 1586 C SER B 28 17.534 5.473 5.049 1.00 0.00 C ATOM 1587 O SER B 28 17.678 6.647 5.395 1.00 0.00 O ATOM 1588 CB SER B 28 18.373 3.630 6.539 1.00 0.00 C ATOM 1589 OG SER B 28 19.357 4.502 7.068 1.00 0.00 O ATOM 0 H SER B 28 16.513 2.512 5.395 1.00 0.00 H new ATOM 0 HA SER B 28 16.675 4.889 6.914 1.00 0.00 H new ATOM 0 HB2 SER B 28 18.080 2.907 7.300 1.00 0.00 H new ATOM 0 HB3 SER B 28 18.796 3.065 5.709 1.00 0.00 H new ATOM 0 HG SER B 28 20.131 3.980 7.366 1.00 0.00 H new ATOM 1595 N LYS B 29 17.695 5.070 3.796 1.00 0.00 N ATOM 1596 CA LYS B 29 18.047 6.002 2.733 1.00 0.00 C ATOM 1597 C LYS B 29 16.928 7.021 2.517 1.00 0.00 C ATOM 1598 O LYS B 29 17.188 8.207 2.322 1.00 0.00 O ATOM 1599 CB LYS B 29 18.348 5.244 1.438 1.00 0.00 C ATOM 1600 CG LYS B 29 19.620 4.407 1.509 1.00 0.00 C ATOM 1601 CD LYS B 29 19.802 3.542 0.269 1.00 0.00 C ATOM 1602 CE LYS B 29 21.127 2.795 0.297 1.00 0.00 C ATOM 1603 NZ LYS B 29 21.250 1.831 -0.830 1.00 0.00 N ATOM 0 H LYS B 29 17.587 4.103 3.490 1.00 0.00 H new ATOM 0 HA LYS B 29 18.945 6.543 3.031 1.00 0.00 H new ATOM 0 HB2 LYS B 29 17.506 4.593 1.203 1.00 0.00 H new ATOM 0 HB3 LYS B 29 18.437 5.958 0.620 1.00 0.00 H new ATOM 0 HG2 LYS B 29 20.482 5.065 1.622 1.00 0.00 H new ATOM 0 HG3 LYS B 29 19.587 3.771 2.393 1.00 0.00 H new ATOM 0 HD2 LYS B 29 18.982 2.827 0.200 1.00 0.00 H new ATOM 0 HD3 LYS B 29 19.755 4.168 -0.622 1.00 0.00 H new ATOM 0 HE2 LYS B 29 21.947 3.511 0.252 1.00 0.00 H new ATOM 0 HE3 LYS B 29 21.222 2.261 1.242 1.00 0.00 H new ATOM 0 HZ1 LYS B 29 22.220 1.457 -0.863 1.00 0.00 H new ATOM 0 HZ2 LYS B 29 20.581 1.047 -0.691 1.00 0.00 H new ATOM 0 HZ3 LYS B 29 21.035 2.314 -1.725 1.00 0.00 H new ATOM 1617 N ILE B 30 15.683 6.561 2.572 1.00 0.00 N ATOM 1618 CA ILE B 30 14.533 7.451 2.435 1.00 0.00 C ATOM 1619 C ILE B 30 14.380 8.317 3.688 1.00 0.00 C ATOM 1620 O ILE B 30 13.935 9.468 3.621 1.00 0.00 O ATOM 1621 CB ILE B 30 13.234 6.656 2.183 1.00 0.00 C ATOM 1622 CG1 ILE B 30 13.396 5.777 0.940 1.00 0.00 C ATOM 1623 CG2 ILE B 30 12.047 7.600 2.016 1.00 0.00 C ATOM 1624 CD1 ILE B 30 12.241 4.829 0.710 1.00 0.00 C ATOM 0 H ILE B 30 15.443 5.579 2.710 1.00 0.00 H new ATOM 0 HA ILE B 30 14.710 8.094 1.573 1.00 0.00 H new ATOM 0 HB ILE B 30 13.041 6.019 3.046 1.00 0.00 H new ATOM 0 HG12 ILE B 30 13.508 6.418 0.065 1.00 0.00 H new ATOM 0 HG13 ILE B 30 14.316 5.199 1.032 1.00 0.00 H new ATOM 0 HG21 ILE B 30 11.142 7.019 1.839 1.00 0.00 H new ATOM 0 HG22 ILE B 30 11.925 8.195 2.921 1.00 0.00 H new ATOM 0 HG23 ILE B 30 12.225 8.261 1.168 1.00 0.00 H new ATOM 0 HD11 ILE B 30 12.427 4.240 -0.188 1.00 0.00 H new ATOM 0 HD12 ILE B 30 12.141 4.163 1.567 1.00 0.00 H new ATOM 0 HD13 ILE B 30 11.321 5.400 0.585 1.00 0.00 H new ATOM 1636 N GLN B 31 14.775 7.760 4.828 1.00 0.00 N ATOM 1637 CA GLN B 31 14.781 8.491 6.091 1.00 0.00 C ATOM 1638 C GLN B 31 15.776 9.647 6.022 1.00 0.00 C ATOM 1639 O GLN B 31 15.581 10.692 6.642 1.00 0.00 O ATOM 1640 CB GLN B 31 15.142 7.546 7.237 1.00 0.00 C ATOM 1641 CG GLN B 31 15.151 8.200 8.611 1.00 0.00 C ATOM 1642 CD GLN B 31 15.590 7.239 9.697 1.00 0.00 C ATOM 1643 OE1 GLN B 31 16.375 6.325 9.451 1.00 0.00 O ATOM 1644 NE2 GLN B 31 15.087 7.436 10.905 1.00 0.00 N ATOM 0 H GLN B 31 15.098 6.795 4.903 1.00 0.00 H new ATOM 0 HA GLN B 31 13.786 8.898 6.272 1.00 0.00 H new ATOM 0 HB2 GLN B 31 14.433 6.718 7.247 1.00 0.00 H new ATOM 0 HB3 GLN B 31 16.127 7.120 7.044 1.00 0.00 H new ATOM 0 HG2 GLN B 31 15.819 9.061 8.598 1.00 0.00 H new ATOM 0 HG3 GLN B 31 14.153 8.574 8.840 1.00 0.00 H new ATOM 0 HE21 GLN B 31 14.438 8.206 11.068 1.00 0.00 H new ATOM 0 HE22 GLN B 31 15.348 6.818 11.673 1.00 0.00 H new ATOM 1653 N ASP B 32 16.842 9.450 5.262 1.00 0.00 N ATOM 1654 CA ASP B 32 17.821 10.502 5.030 1.00 0.00 C ATOM 1655 C ASP B 32 17.272 11.525 4.037 1.00 0.00 C ATOM 1656 O ASP B 32 17.482 12.727 4.185 1.00 0.00 O ATOM 1657 CB ASP B 32 19.128 9.910 4.498 1.00 0.00 C ATOM 1658 CG ASP B 32 20.200 10.960 4.276 1.00 0.00 C ATOM 1659 OD1 ASP B 32 20.945 11.268 5.231 1.00 0.00 O ATOM 1660 OD2 ASP B 32 20.310 11.480 3.146 1.00 0.00 O ATOM 0 H ASP B 32 17.052 8.569 4.794 1.00 0.00 H new ATOM 0 HA ASP B 32 18.022 11.000 5.979 1.00 0.00 H new ATOM 0 HB2 ASP B 32 19.497 9.164 5.202 1.00 0.00 H new ATOM 0 HB3 ASP B 32 18.932 9.393 3.559 1.00 0.00 H new ATOM 1665 N LYS B 33 16.554 11.029 3.033 1.00 0.00 N ATOM 1666 CA LYS B 33 15.999 11.880 1.983 1.00 0.00 C ATOM 1667 C LYS B 33 14.897 12.795 2.513 1.00 0.00 C ATOM 1668 O LYS B 33 15.079 14.010 2.589 1.00 0.00 O ATOM 1669 CB LYS B 33 15.448 11.031 0.831 1.00 0.00 C ATOM 1670 CG LYS B 33 16.513 10.272 0.058 1.00 0.00 C ATOM 1671 CD LYS B 33 17.460 11.213 -0.668 1.00 0.00 C ATOM 1672 CE LYS B 33 18.534 10.443 -1.420 1.00 0.00 C ATOM 1673 NZ LYS B 33 19.427 11.339 -2.199 1.00 0.00 N ATOM 0 H LYS B 33 16.342 10.037 2.924 1.00 0.00 H new ATOM 0 HA LYS B 33 16.814 12.504 1.617 1.00 0.00 H new ATOM 0 HB2 LYS B 33 14.727 10.318 1.231 1.00 0.00 H new ATOM 0 HB3 LYS B 33 14.907 11.679 0.142 1.00 0.00 H new ATOM 0 HG2 LYS B 33 17.080 9.642 0.743 1.00 0.00 H new ATOM 0 HG3 LYS B 33 16.036 9.609 -0.663 1.00 0.00 H new ATOM 0 HD2 LYS B 33 16.897 11.832 -1.366 1.00 0.00 H new ATOM 0 HD3 LYS B 33 17.928 11.887 0.050 1.00 0.00 H new ATOM 0 HE2 LYS B 33 19.129 9.867 -0.711 1.00 0.00 H new ATOM 0 HE3 LYS B 33 18.061 9.729 -2.094 1.00 0.00 H new ATOM 0 HZ1 LYS B 33 20.143 10.770 -2.695 1.00 0.00 H new ATOM 0 HZ2 LYS B 33 18.865 11.870 -2.894 1.00 0.00 H new ATOM 0 HZ3 LYS B 33 19.899 12.004 -1.554 1.00 0.00 H new ATOM 1687 N GLU B 34 13.761 12.212 2.878 1.00 0.00 N ATOM 1688 CA GLU B 34 12.594 13.002 3.261 1.00 0.00 C ATOM 1689 C GLU B 34 12.406 13.029 4.775 1.00 0.00 C ATOM 1690 O GLU B 34 11.617 13.821 5.296 1.00 0.00 O ATOM 1691 CB GLU B 34 11.332 12.448 2.597 1.00 0.00 C ATOM 1692 CG GLU B 34 11.428 12.322 1.084 1.00 0.00 C ATOM 1693 CD GLU B 34 11.815 13.618 0.399 1.00 0.00 C ATOM 1694 OE1 GLU B 34 11.080 14.616 0.537 1.00 0.00 O ATOM 1695 OE2 GLU B 34 12.863 13.645 -0.279 1.00 0.00 O ATOM 0 H GLU B 34 13.622 11.202 2.917 1.00 0.00 H new ATOM 0 HA GLU B 34 12.766 14.023 2.920 1.00 0.00 H new ATOM 0 HB2 GLU B 34 11.114 11.467 3.019 1.00 0.00 H new ATOM 0 HB3 GLU B 34 10.491 13.096 2.844 1.00 0.00 H new ATOM 0 HG2 GLU B 34 12.161 11.555 0.836 1.00 0.00 H new ATOM 0 HG3 GLU B 34 10.468 11.984 0.693 1.00 0.00 H new ATOM 1702 N GLY B 35 13.127 12.168 5.474 1.00 0.00 N ATOM 1703 CA GLY B 35 13.019 12.119 6.919 1.00 0.00 C ATOM 1704 C GLY B 35 11.869 11.251 7.391 1.00 0.00 C ATOM 1705 O GLY B 35 11.325 11.465 8.473 1.00 0.00 O ATOM 0 H GLY B 35 13.785 11.502 5.069 1.00 0.00 H new ATOM 0 HA2 GLY B 35 13.951 11.738 7.336 1.00 0.00 H new ATOM 0 HA3 GLY B 35 12.887 13.130 7.304 1.00 0.00 H new ATOM 1709 N ILE B 36 11.493 10.270 6.583 1.00 0.00 N ATOM 1710 CA ILE B 36 10.384 9.389 6.927 1.00 0.00 C ATOM 1711 C ILE B 36 10.886 8.209 7.760 1.00 0.00 C ATOM 1712 O ILE B 36 11.835 7.532 7.373 1.00 0.00 O ATOM 1713 CB ILE B 36 9.663 8.868 5.661 1.00 0.00 C ATOM 1714 CG1 ILE B 36 9.303 10.039 4.739 1.00 0.00 C ATOM 1715 CG2 ILE B 36 8.409 8.092 6.045 1.00 0.00 C ATOM 1716 CD1 ILE B 36 8.636 9.616 3.447 1.00 0.00 C ATOM 0 H ILE B 36 11.937 10.064 5.688 1.00 0.00 H new ATOM 0 HA ILE B 36 9.669 9.967 7.512 1.00 0.00 H new ATOM 0 HB ILE B 36 10.336 8.196 5.128 1.00 0.00 H new ATOM 0 HG12 ILE B 36 8.640 10.720 5.273 1.00 0.00 H new ATOM 0 HG13 ILE B 36 10.210 10.596 4.504 1.00 0.00 H new ATOM 0 HG21 ILE B 36 7.913 7.732 5.143 1.00 0.00 H new ATOM 0 HG22 ILE B 36 8.684 7.243 6.671 1.00 0.00 H new ATOM 0 HG23 ILE B 36 7.732 8.745 6.596 1.00 0.00 H new ATOM 0 HD11 ILE B 36 8.411 10.498 2.848 1.00 0.00 H new ATOM 0 HD12 ILE B 36 9.305 8.960 2.890 1.00 0.00 H new ATOM 0 HD13 ILE B 36 7.711 9.085 3.672 1.00 0.00 H new ATOM 1728 N PRO B 37 10.271 7.973 8.931 1.00 0.00 N ATOM 1729 CA PRO B 37 10.653 6.876 9.832 1.00 0.00 C ATOM 1730 C PRO B 37 10.520 5.500 9.176 1.00 0.00 C ATOM 1731 O PRO B 37 9.500 5.191 8.561 1.00 0.00 O ATOM 1732 CB PRO B 37 9.665 7.005 10.995 1.00 0.00 C ATOM 1733 CG PRO B 37 9.177 8.410 10.933 1.00 0.00 C ATOM 1734 CD PRO B 37 9.161 8.769 9.478 1.00 0.00 C ATOM 0 HA PRO B 37 11.699 6.949 10.130 1.00 0.00 H new ATOM 0 HB2 PRO B 37 8.842 6.297 10.894 1.00 0.00 H new ATOM 0 HB3 PRO B 37 10.149 6.797 11.949 1.00 0.00 H new ATOM 0 HG2 PRO B 37 8.182 8.499 11.369 1.00 0.00 H new ATOM 0 HG3 PRO B 37 9.832 9.077 11.494 1.00 0.00 H new ATOM 0 HD2 PRO B 37 8.211 8.513 9.009 1.00 0.00 H new ATOM 0 HD3 PRO B 37 9.315 9.837 9.324 1.00 0.00 H new ATOM 1742 N PRO B 38 11.561 4.657 9.299 1.00 0.00 N ATOM 1743 CA PRO B 38 11.590 3.315 8.698 1.00 0.00 C ATOM 1744 C PRO B 38 10.487 2.400 9.227 1.00 0.00 C ATOM 1745 O PRO B 38 9.941 1.581 8.488 1.00 0.00 O ATOM 1746 CB PRO B 38 12.969 2.769 9.089 1.00 0.00 C ATOM 1747 CG PRO B 38 13.775 3.975 9.420 1.00 0.00 C ATOM 1748 CD PRO B 38 12.808 4.951 10.022 1.00 0.00 C ATOM 0 HA PRO B 38 11.422 3.360 7.622 1.00 0.00 H new ATOM 0 HB2 PRO B 38 12.900 2.093 9.941 1.00 0.00 H new ATOM 0 HB3 PRO B 38 13.418 2.205 8.271 1.00 0.00 H new ATOM 0 HG2 PRO B 38 14.575 3.733 10.120 1.00 0.00 H new ATOM 0 HG3 PRO B 38 14.246 4.389 8.529 1.00 0.00 H new ATOM 0 HD2 PRO B 38 12.698 4.802 11.096 1.00 0.00 H new ATOM 0 HD3 PRO B 38 13.128 5.982 9.874 1.00 0.00 H new ATOM 1756 N ASP B 39 10.152 2.549 10.498 1.00 0.00 N ATOM 1757 CA ASP B 39 9.097 1.742 11.109 1.00 0.00 C ATOM 1758 C ASP B 39 7.728 2.139 10.568 1.00 0.00 C ATOM 1759 O ASP B 39 6.823 1.313 10.454 1.00 0.00 O ATOM 1760 CB ASP B 39 9.122 1.861 12.640 1.00 0.00 C ATOM 1761 CG ASP B 39 9.390 3.267 13.145 1.00 0.00 C ATOM 1762 OD1 ASP B 39 8.946 4.241 12.510 1.00 0.00 O ATOM 1763 OD2 ASP B 39 10.054 3.401 14.198 1.00 0.00 O ATOM 0 H ASP B 39 10.592 3.219 11.130 1.00 0.00 H new ATOM 0 HA ASP B 39 9.284 0.701 10.847 1.00 0.00 H new ATOM 0 HB2 ASP B 39 8.166 1.520 13.036 1.00 0.00 H new ATOM 0 HB3 ASP B 39 9.887 1.192 13.034 1.00 0.00 H new ATOM 1768 N GLN B 40 7.589 3.409 10.227 1.00 0.00 N ATOM 1769 CA GLN B 40 6.360 3.919 9.642 1.00 0.00 C ATOM 1770 C GLN B 40 6.289 3.581 8.153 1.00 0.00 C ATOM 1771 O GLN B 40 5.206 3.441 7.586 1.00 0.00 O ATOM 1772 CB GLN B 40 6.282 5.432 9.851 1.00 0.00 C ATOM 1773 CG GLN B 40 5.110 6.090 9.153 1.00 0.00 C ATOM 1774 CD GLN B 40 5.100 7.585 9.351 1.00 0.00 C ATOM 1775 OE1 GLN B 40 4.464 8.098 10.268 1.00 0.00 O ATOM 1776 NE2 GLN B 40 5.832 8.286 8.505 1.00 0.00 N ATOM 0 H GLN B 40 8.319 4.111 10.347 1.00 0.00 H new ATOM 0 HA GLN B 40 5.511 3.446 10.136 1.00 0.00 H new ATOM 0 HB2 GLN B 40 6.218 5.638 10.919 1.00 0.00 H new ATOM 0 HB3 GLN B 40 7.206 5.886 9.494 1.00 0.00 H new ATOM 0 HG2 GLN B 40 5.151 5.866 8.087 1.00 0.00 H new ATOM 0 HG3 GLN B 40 4.179 5.668 9.532 1.00 0.00 H new ATOM 0 HE21 GLN B 40 6.342 7.813 7.759 1.00 0.00 H new ATOM 0 HE22 GLN B 40 5.887 9.300 8.597 1.00 0.00 H new ATOM 1785 N GLN B 41 7.450 3.456 7.531 1.00 0.00 N ATOM 1786 CA GLN B 41 7.541 3.134 6.112 1.00 0.00 C ATOM 1787 C GLN B 41 7.154 1.684 5.838 1.00 0.00 C ATOM 1788 O GLN B 41 7.724 0.760 6.413 1.00 0.00 O ATOM 1789 CB GLN B 41 8.963 3.367 5.607 1.00 0.00 C ATOM 1790 CG GLN B 41 9.321 4.822 5.384 1.00 0.00 C ATOM 1791 CD GLN B 41 10.741 4.984 4.888 1.00 0.00 C ATOM 1792 OE1 GLN B 41 10.995 4.944 3.691 1.00 0.00 O ATOM 1793 NE2 GLN B 41 11.674 5.173 5.804 1.00 0.00 N ATOM 0 H GLN B 41 8.353 3.574 7.991 1.00 0.00 H new ATOM 0 HA GLN B 41 6.844 3.788 5.588 1.00 0.00 H new ATOM 0 HB2 GLN B 41 9.664 2.939 6.324 1.00 0.00 H new ATOM 0 HB3 GLN B 41 9.095 2.826 4.670 1.00 0.00 H new ATOM 0 HG2 GLN B 41 8.632 5.259 4.661 1.00 0.00 H new ATOM 0 HG3 GLN B 41 9.197 5.373 6.316 1.00 0.00 H new ATOM 0 HE21 GLN B 41 11.421 5.200 6.792 1.00 0.00 H new ATOM 0 HE22 GLN B 41 12.647 5.292 5.523 1.00 0.00 H new ATOM 1802 N ARG B 42 6.183 1.497 4.957 1.00 0.00 N ATOM 1803 CA ARG B 42 5.843 0.174 4.457 1.00 0.00 C ATOM 1804 C ARG B 42 5.739 0.206 2.940 1.00 0.00 C ATOM 1805 O ARG B 42 4.801 0.775 2.380 1.00 0.00 O ATOM 1806 CB ARG B 42 4.542 -0.336 5.082 1.00 0.00 C ATOM 1807 CG ARG B 42 4.725 -0.852 6.500 1.00 0.00 C ATOM 1808 CD ARG B 42 3.416 -1.322 7.108 1.00 0.00 C ATOM 1809 NE ARG B 42 2.741 -2.325 6.283 1.00 0.00 N ATOM 1810 CZ ARG B 42 2.235 -3.464 6.760 1.00 0.00 C ATOM 1811 NH1 ARG B 42 2.430 -3.798 8.027 1.00 0.00 N ATOM 1812 NH2 ARG B 42 1.548 -4.278 5.967 1.00 0.00 N ATOM 0 H ARG B 42 5.613 2.250 4.572 1.00 0.00 H new ATOM 0 HA ARG B 42 6.636 -0.518 4.741 1.00 0.00 H new ATOM 0 HB2 ARG B 42 3.808 0.470 5.087 1.00 0.00 H new ATOM 0 HB3 ARG B 42 4.136 -1.134 4.461 1.00 0.00 H new ATOM 0 HG2 ARG B 42 5.439 -1.675 6.497 1.00 0.00 H new ATOM 0 HG3 ARG B 42 5.150 -0.063 7.121 1.00 0.00 H new ATOM 0 HD2 ARG B 42 3.608 -1.739 8.097 1.00 0.00 H new ATOM 0 HD3 ARG B 42 2.756 -0.466 7.246 1.00 0.00 H new ATOM 0 HE ARG B 42 2.652 -2.142 5.283 1.00 0.00 H new ATOM 0 HH11 ARG B 42 2.967 -3.184 8.639 1.00 0.00 H new ATOM 0 HH12 ARG B 42 2.043 -4.669 8.390 1.00 0.00 H new ATOM 0 HH21 ARG B 42 1.404 -4.034 4.987 1.00 0.00 H new ATOM 0 HH22 ARG B 42 1.164 -5.147 6.338 1.00 0.00 H new ATOM 1826 N LEU B 43 6.720 -0.392 2.282 1.00 0.00 N ATOM 1827 CA LEU B 43 6.793 -0.369 0.830 1.00 0.00 C ATOM 1828 C LEU B 43 6.017 -1.540 0.243 1.00 0.00 C ATOM 1829 O LEU B 43 5.973 -2.622 0.832 1.00 0.00 O ATOM 1830 CB LEU B 43 8.251 -0.423 0.344 1.00 0.00 C ATOM 1831 CG LEU B 43 9.148 0.758 0.743 1.00 0.00 C ATOM 1832 CD1 LEU B 43 9.602 0.644 2.195 1.00 0.00 C ATOM 1833 CD2 LEU B 43 10.350 0.846 -0.188 1.00 0.00 C ATOM 0 H LEU B 43 7.480 -0.901 2.733 1.00 0.00 H new ATOM 0 HA LEU B 43 6.350 0.567 0.491 1.00 0.00 H new ATOM 0 HB2 LEU B 43 8.704 -1.339 0.723 1.00 0.00 H new ATOM 0 HB3 LEU B 43 8.246 -0.496 -0.744 1.00 0.00 H new ATOM 0 HG LEU B 43 8.563 1.673 0.649 1.00 0.00 H new ATOM 0 HD11 LEU B 43 10.235 1.495 2.446 1.00 0.00 H new ATOM 0 HD12 LEU B 43 8.730 0.635 2.849 1.00 0.00 H new ATOM 0 HD13 LEU B 43 10.166 -0.279 2.329 1.00 0.00 H new ATOM 0 HD21 LEU B 43 10.977 1.687 0.106 1.00 0.00 H new ATOM 0 HD22 LEU B 43 10.927 -0.076 -0.125 1.00 0.00 H new ATOM 0 HD23 LEU B 43 10.007 0.990 -1.213 1.00 0.00 H new ATOM 1845 N ILE B 44 5.396 -1.317 -0.901 1.00 0.00 N ATOM 1846 CA ILE B 44 4.642 -2.364 -1.571 1.00 0.00 C ATOM 1847 C ILE B 44 5.040 -2.461 -3.040 1.00 0.00 C ATOM 1848 O ILE B 44 4.962 -1.477 -3.786 1.00 0.00 O ATOM 1849 CB ILE B 44 3.121 -2.116 -1.460 1.00 0.00 C ATOM 1850 CG1 ILE B 44 2.705 -2.052 0.014 1.00 0.00 C ATOM 1851 CG2 ILE B 44 2.345 -3.206 -2.190 1.00 0.00 C ATOM 1852 CD1 ILE B 44 1.249 -1.705 0.229 1.00 0.00 C ATOM 0 H ILE B 44 5.398 -0.420 -1.387 1.00 0.00 H new ATOM 0 HA ILE B 44 4.878 -3.305 -1.075 1.00 0.00 H new ATOM 0 HB ILE B 44 2.887 -1.161 -1.930 1.00 0.00 H new ATOM 0 HG12 ILE B 44 2.911 -3.015 0.481 1.00 0.00 H new ATOM 0 HG13 ILE B 44 3.323 -1.312 0.523 1.00 0.00 H new ATOM 0 HG21 ILE B 44 1.276 -3.014 -2.100 1.00 0.00 H new ATOM 0 HG22 ILE B 44 2.626 -3.209 -3.243 1.00 0.00 H new ATOM 0 HG23 ILE B 44 2.577 -4.175 -1.749 1.00 0.00 H new ATOM 0 HD11 ILE B 44 1.035 -1.680 1.297 1.00 0.00 H new ATOM 0 HD12 ILE B 44 1.040 -0.728 -0.206 1.00 0.00 H new ATOM 0 HD13 ILE B 44 0.621 -2.457 -0.249 1.00 0.00 H new ATOM 1864 N PHE B 45 5.475 -3.646 -3.443 1.00 0.00 N ATOM 1865 CA PHE B 45 5.878 -3.895 -4.819 1.00 0.00 C ATOM 1866 C PHE B 45 4.925 -4.883 -5.481 1.00 0.00 C ATOM 1867 O PHE B 45 5.068 -6.091 -5.314 1.00 0.00 O ATOM 1868 CB PHE B 45 7.312 -4.437 -4.863 1.00 0.00 C ATOM 1869 CG PHE B 45 7.782 -4.833 -6.238 1.00 0.00 C ATOM 1870 CD1 PHE B 45 7.926 -3.887 -7.240 1.00 0.00 C ATOM 1871 CD2 PHE B 45 8.083 -6.157 -6.526 1.00 0.00 C ATOM 1872 CE1 PHE B 45 8.358 -4.253 -8.502 1.00 0.00 C ATOM 1873 CE2 PHE B 45 8.518 -6.528 -7.785 1.00 0.00 C ATOM 1874 CZ PHE B 45 8.655 -5.575 -8.774 1.00 0.00 C ATOM 0 H PHE B 45 5.558 -4.457 -2.830 1.00 0.00 H new ATOM 0 HA PHE B 45 5.841 -2.953 -5.366 1.00 0.00 H new ATOM 0 HB2 PHE B 45 7.987 -3.679 -4.465 1.00 0.00 H new ATOM 0 HB3 PHE B 45 7.381 -5.303 -4.205 1.00 0.00 H new ATOM 0 HD1 PHE B 45 7.698 -2.852 -7.033 1.00 0.00 H new ATOM 0 HD2 PHE B 45 7.976 -6.907 -5.757 1.00 0.00 H new ATOM 0 HE1 PHE B 45 8.463 -3.506 -9.275 1.00 0.00 H new ATOM 0 HE2 PHE B 45 8.750 -7.562 -7.994 1.00 0.00 H new ATOM 0 HZ PHE B 45 8.994 -5.862 -9.759 1.00 0.00 H new ATOM 1884 N ALA B 46 3.935 -4.357 -6.201 1.00 0.00 N ATOM 1885 CA ALA B 46 2.970 -5.184 -6.932 1.00 0.00 C ATOM 1886 C ALA B 46 2.368 -6.281 -6.050 1.00 0.00 C ATOM 1887 O ALA B 46 2.265 -7.440 -6.460 1.00 0.00 O ATOM 1888 CB ALA B 46 3.625 -5.787 -8.167 1.00 0.00 C ATOM 0 H ALA B 46 3.778 -3.354 -6.295 1.00 0.00 H new ATOM 0 HA ALA B 46 2.150 -4.537 -7.243 1.00 0.00 H new ATOM 0 HB1 ALA B 46 2.899 -6.399 -8.702 1.00 0.00 H new ATOM 0 HB2 ALA B 46 3.976 -4.988 -8.819 1.00 0.00 H new ATOM 0 HB3 ALA B 46 4.469 -6.407 -7.865 1.00 0.00 H new ATOM 1894 N GLY B 47 1.983 -5.914 -4.835 1.00 0.00 N ATOM 1895 CA GLY B 47 1.365 -6.867 -3.933 1.00 0.00 C ATOM 1896 C GLY B 47 2.351 -7.442 -2.936 1.00 0.00 C ATOM 1897 O GLY B 47 1.956 -7.981 -1.905 1.00 0.00 O ATOM 0 H GLY B 47 2.088 -4.972 -4.457 1.00 0.00 H new ATOM 0 HA2 GLY B 47 0.552 -6.380 -3.396 1.00 0.00 H new ATOM 0 HA3 GLY B 47 0.924 -7.678 -4.512 1.00 0.00 H new ATOM 1901 N LYS B 48 3.638 -7.332 -3.244 1.00 0.00 N ATOM 1902 CA LYS B 48 4.681 -7.814 -2.346 1.00 0.00 C ATOM 1903 C LYS B 48 4.863 -6.843 -1.187 1.00 0.00 C ATOM 1904 O LYS B 48 5.294 -5.705 -1.387 1.00 0.00 O ATOM 1905 CB LYS B 48 6.021 -7.989 -3.079 1.00 0.00 C ATOM 1906 CG LYS B 48 6.147 -9.262 -3.918 1.00 0.00 C ATOM 1907 CD LYS B 48 5.176 -9.302 -5.092 1.00 0.00 C ATOM 1908 CE LYS B 48 3.951 -10.142 -4.772 1.00 0.00 C ATOM 1909 NZ LYS B 48 2.933 -10.087 -5.854 1.00 0.00 N ATOM 0 H LYS B 48 3.984 -6.914 -4.108 1.00 0.00 H new ATOM 0 HA LYS B 48 4.367 -8.787 -1.968 1.00 0.00 H new ATOM 0 HB2 LYS B 48 6.175 -7.128 -3.730 1.00 0.00 H new ATOM 0 HB3 LYS B 48 6.824 -7.979 -2.341 1.00 0.00 H new ATOM 0 HG2 LYS B 48 7.167 -9.343 -4.295 1.00 0.00 H new ATOM 0 HG3 LYS B 48 5.973 -10.129 -3.281 1.00 0.00 H new ATOM 0 HD2 LYS B 48 4.867 -8.288 -5.345 1.00 0.00 H new ATOM 0 HD3 LYS B 48 5.680 -9.710 -5.968 1.00 0.00 H new ATOM 0 HE2 LYS B 48 4.254 -11.177 -4.613 1.00 0.00 H new ATOM 0 HE3 LYS B 48 3.507 -9.793 -3.840 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 2.075 -10.590 -5.550 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 2.698 -9.095 -6.059 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 3.313 -10.537 -6.711 1.00 0.00 H new ATOM 1923 N GLN B 49 4.510 -7.288 0.011 1.00 0.00 N ATOM 1924 CA GLN B 49 4.691 -6.485 1.211 1.00 0.00 C ATOM 1925 C GLN B 49 6.168 -6.448 1.581 1.00 0.00 C ATOM 1926 O GLN B 49 6.751 -7.474 1.935 1.00 0.00 O ATOM 1927 CB GLN B 49 3.873 -7.062 2.369 1.00 0.00 C ATOM 1928 CG GLN B 49 3.933 -6.226 3.641 1.00 0.00 C ATOM 1929 CD GLN B 49 3.189 -6.867 4.797 1.00 0.00 C ATOM 1930 OE1 GLN B 49 2.223 -7.601 4.601 1.00 0.00 O ATOM 1931 NE2 GLN B 49 3.622 -6.578 6.015 1.00 0.00 N ATOM 0 H GLN B 49 4.095 -8.205 0.177 1.00 0.00 H new ATOM 0 HA GLN B 49 4.342 -5.471 1.015 1.00 0.00 H new ATOM 0 HB2 GLN B 49 2.833 -7.156 2.056 1.00 0.00 H new ATOM 0 HB3 GLN B 49 4.231 -8.068 2.589 1.00 0.00 H new ATOM 0 HG2 GLN B 49 4.975 -6.075 3.923 1.00 0.00 H new ATOM 0 HG3 GLN B 49 3.511 -5.241 3.444 1.00 0.00 H new ATOM 0 HE21 GLN B 49 4.428 -5.964 6.138 1.00 0.00 H new ATOM 0 HE22 GLN B 49 3.150 -6.969 6.830 1.00 0.00 H new ATOM 1940 N LEU B 50 6.773 -5.274 1.486 1.00 0.00 N ATOM 1941 CA LEU B 50 8.197 -5.140 1.734 1.00 0.00 C ATOM 1942 C LEU B 50 8.464 -4.746 3.180 1.00 0.00 C ATOM 1943 O LEU B 50 8.481 -3.561 3.524 1.00 0.00 O ATOM 1944 CB LEU B 50 8.813 -4.105 0.787 1.00 0.00 C ATOM 1945 CG LEU B 50 8.545 -4.336 -0.704 1.00 0.00 C ATOM 1946 CD1 LEU B 50 9.211 -3.253 -1.535 1.00 0.00 C ATOM 1947 CD2 LEU B 50 9.035 -5.710 -1.128 1.00 0.00 C ATOM 0 H LEU B 50 6.301 -4.404 1.240 1.00 0.00 H new ATOM 0 HA LEU B 50 8.661 -6.109 1.549 1.00 0.00 H new ATOM 0 HB2 LEU B 50 8.435 -3.119 1.058 1.00 0.00 H new ATOM 0 HB3 LEU B 50 9.891 -4.088 0.947 1.00 0.00 H new ATOM 0 HG LEU B 50 7.469 -4.289 -0.873 1.00 0.00 H new ATOM 0 HD11 LEU B 50 9.012 -3.431 -2.592 1.00 0.00 H new ATOM 0 HD12 LEU B 50 8.813 -2.279 -1.250 1.00 0.00 H new ATOM 0 HD13 LEU B 50 10.287 -3.271 -1.361 1.00 0.00 H new ATOM 0 HD21 LEU B 50 8.836 -5.856 -2.190 1.00 0.00 H new ATOM 0 HD22 LEU B 50 10.107 -5.786 -0.946 1.00 0.00 H new ATOM 0 HD23 LEU B 50 8.514 -6.476 -0.553 1.00 0.00 H new ATOM 1959 N GLU B 51 8.637 -5.746 4.030 1.00 0.00 N ATOM 1960 CA GLU B 51 9.033 -5.514 5.408 1.00 0.00 C ATOM 1961 C GLU B 51 10.548 -5.374 5.491 1.00 0.00 C ATOM 1962 O GLU B 51 11.273 -5.972 4.695 1.00 0.00 O ATOM 1963 CB GLU B 51 8.562 -6.659 6.304 1.00 0.00 C ATOM 1964 CG GLU B 51 7.053 -6.726 6.467 1.00 0.00 C ATOM 1965 CD GLU B 51 6.474 -5.452 7.053 1.00 0.00 C ATOM 1966 OE1 GLU B 51 6.827 -5.105 8.202 1.00 0.00 O ATOM 1967 OE2 GLU B 51 5.681 -4.784 6.362 1.00 0.00 O ATOM 0 H GLU B 51 8.509 -6.728 3.788 1.00 0.00 H new ATOM 0 HA GLU B 51 8.567 -4.592 5.756 1.00 0.00 H new ATOM 0 HB2 GLU B 51 8.916 -7.603 5.889 1.00 0.00 H new ATOM 0 HB3 GLU B 51 9.020 -6.551 7.287 1.00 0.00 H new ATOM 0 HG2 GLU B 51 6.594 -6.917 5.497 1.00 0.00 H new ATOM 0 HG3 GLU B 51 6.798 -7.567 7.111 1.00 0.00 H new ATOM 1974 N ASP B 52 11.023 -4.586 6.450 1.00 0.00 N ATOM 1975 CA ASP B 52 12.455 -4.354 6.607 1.00 0.00 C ATOM 1976 C ASP B 52 13.160 -5.611 7.101 1.00 0.00 C ATOM 1977 O ASP B 52 12.518 -6.581 7.501 1.00 0.00 O ATOM 1978 CB ASP B 52 12.726 -3.182 7.559 1.00 0.00 C ATOM 1979 CG ASP B 52 11.999 -3.317 8.882 1.00 0.00 C ATOM 1980 OD1 ASP B 52 12.528 -3.975 9.800 1.00 0.00 O ATOM 1981 OD2 ASP B 52 10.890 -2.751 9.005 1.00 0.00 O ATOM 0 H ASP B 52 10.439 -4.098 7.129 1.00 0.00 H new ATOM 0 HA ASP B 52 12.856 -4.096 5.627 1.00 0.00 H new ATOM 0 HB2 ASP B 52 13.798 -3.112 7.745 1.00 0.00 H new ATOM 0 HB3 ASP B 52 12.424 -2.252 7.077 1.00 0.00 H new ATOM 1986 N GLY B 53 14.483 -5.585 7.059 1.00 0.00 N ATOM 1987 CA GLY B 53 15.262 -6.752 7.415 1.00 0.00 C ATOM 1988 C GLY B 53 15.744 -7.496 6.187 1.00 0.00 C ATOM 1989 O GLY B 53 16.945 -7.588 5.941 1.00 0.00 O ATOM 0 H GLY B 53 15.034 -4.772 6.783 1.00 0.00 H new ATOM 0 HA2 GLY B 53 16.119 -6.449 8.017 1.00 0.00 H new ATOM 0 HA3 GLY B 53 14.659 -7.419 8.032 1.00 0.00 H new ATOM 1993 N ARG B 54 14.803 -8.006 5.400 1.00 0.00 N ATOM 1994 CA ARG B 54 15.136 -8.778 4.204 1.00 0.00 C ATOM 1995 C ARG B 54 15.589 -7.859 3.075 1.00 0.00 C ATOM 1996 O ARG B 54 15.494 -6.634 3.185 1.00 0.00 O ATOM 1997 CB ARG B 54 13.931 -9.604 3.751 1.00 0.00 C ATOM 1998 CG ARG B 54 13.369 -10.508 4.836 1.00 0.00 C ATOM 1999 CD ARG B 54 12.186 -11.314 4.329 1.00 0.00 C ATOM 2000 NE ARG B 54 11.498 -12.019 5.409 1.00 0.00 N ATOM 2001 CZ ARG B 54 10.393 -12.742 5.237 1.00 0.00 C ATOM 2002 NH1 ARG B 54 9.896 -12.923 4.019 1.00 0.00 N ATOM 2003 NH2 ARG B 54 9.796 -13.302 6.282 1.00 0.00 N ATOM 0 H ARG B 54 13.802 -7.900 5.567 1.00 0.00 H new ATOM 0 HA ARG B 54 15.956 -9.452 4.453 1.00 0.00 H new ATOM 0 HB2 ARG B 54 13.146 -8.929 3.410 1.00 0.00 H new ATOM 0 HB3 ARG B 54 14.221 -10.214 2.896 1.00 0.00 H new ATOM 0 HG2 ARG B 54 14.148 -11.184 5.187 1.00 0.00 H new ATOM 0 HG3 ARG B 54 13.061 -9.905 5.690 1.00 0.00 H new ATOM 0 HD2 ARG B 54 11.484 -10.649 3.826 1.00 0.00 H new ATOM 0 HD3 ARG B 54 12.530 -12.035 3.587 1.00 0.00 H new ATOM 0 HE ARG B 54 11.887 -11.953 6.350 1.00 0.00 H new ATOM 0 HH11 ARG B 54 10.361 -12.508 3.212 1.00 0.00 H new ATOM 0 HH12 ARG B 54 9.049 -13.477 3.891 1.00 0.00 H new ATOM 0 HH21 ARG B 54 10.184 -13.179 7.217 1.00 0.00 H new ATOM 0 HH22 ARG B 54 8.950 -13.856 6.150 1.00 0.00 H new ATOM 2017 N THR B 55 16.068 -8.448 1.990 1.00 0.00 N ATOM 2018 CA THR B 55 16.573 -7.677 0.865 1.00 0.00 C ATOM 2019 C THR B 55 15.506 -7.529 -0.214 1.00 0.00 C ATOM 2020 O THR B 55 14.452 -8.165 -0.151 1.00 0.00 O ATOM 2021 CB THR B 55 17.822 -8.336 0.242 1.00 0.00 C ATOM 2022 OG1 THR B 55 17.481 -9.611 -0.319 1.00 0.00 O ATOM 2023 CG2 THR B 55 18.920 -8.514 1.281 1.00 0.00 C ATOM 0 H THR B 55 16.118 -9.459 1.865 1.00 0.00 H new ATOM 0 HA THR B 55 16.845 -6.694 1.251 1.00 0.00 H new ATOM 0 HB THR B 55 18.191 -7.680 -0.546 1.00 0.00 H new ATOM 0 HG1 THR B 55 17.118 -10.191 0.383 1.00 0.00 H new ATOM 0 HG21 THR B 55 19.789 -8.980 0.816 1.00 0.00 H new ATOM 0 HG22 THR B 55 19.202 -7.541 1.683 1.00 0.00 H new ATOM 0 HG23 THR B 55 18.557 -9.149 2.089 1.00 0.00 H new ATOM 2031 N LEU B 56 15.784 -6.690 -1.209 1.00 0.00 N ATOM 2032 CA LEU B 56 14.897 -6.551 -2.357 1.00 0.00 C ATOM 2033 C LEU B 56 14.919 -7.829 -3.188 1.00 0.00 C ATOM 2034 O LEU B 56 13.951 -8.156 -3.880 1.00 0.00 O ATOM 2035 CB LEU B 56 15.296 -5.356 -3.236 1.00 0.00 C ATOM 2036 CG LEU B 56 14.981 -3.966 -2.662 1.00 0.00 C ATOM 2037 CD1 LEU B 56 15.937 -3.606 -1.538 1.00 0.00 C ATOM 2038 CD2 LEU B 56 15.027 -2.913 -3.762 1.00 0.00 C ATOM 0 H LEU B 56 16.614 -6.099 -1.242 1.00 0.00 H new ATOM 0 HA LEU B 56 13.890 -6.373 -1.981 1.00 0.00 H new ATOM 0 HB2 LEU B 56 16.367 -5.414 -3.429 1.00 0.00 H new ATOM 0 HB3 LEU B 56 14.793 -5.453 -4.198 1.00 0.00 H new ATOM 0 HG LEU B 56 13.973 -3.993 -2.248 1.00 0.00 H new ATOM 0 HD11 LEU B 56 15.689 -2.617 -1.152 1.00 0.00 H new ATOM 0 HD12 LEU B 56 15.850 -4.340 -0.737 1.00 0.00 H new ATOM 0 HD13 LEU B 56 16.959 -3.602 -1.917 1.00 0.00 H new ATOM 0 HD21 LEU B 56 14.802 -1.934 -3.338 1.00 0.00 H new ATOM 0 HD22 LEU B 56 16.022 -2.895 -4.207 1.00 0.00 H new ATOM 0 HD23 LEU B 56 14.291 -3.155 -4.528 1.00 0.00 H new ATOM 2050 N SER B 57 16.027 -8.553 -3.099 1.00 0.00 N ATOM 2051 CA SER B 57 16.181 -9.811 -3.809 1.00 0.00 C ATOM 2052 C SER B 57 15.219 -10.856 -3.246 1.00 0.00 C ATOM 2053 O SER B 57 14.656 -11.660 -3.992 1.00 0.00 O ATOM 2054 CB SER B 57 17.629 -10.303 -3.705 1.00 0.00 C ATOM 2055 OG SER B 57 17.831 -11.479 -4.473 1.00 0.00 O ATOM 0 H SER B 57 16.836 -8.286 -2.538 1.00 0.00 H new ATOM 0 HA SER B 57 15.943 -9.653 -4.861 1.00 0.00 H new ATOM 0 HB2 SER B 57 18.306 -9.521 -4.048 1.00 0.00 H new ATOM 0 HB3 SER B 57 17.874 -10.501 -2.662 1.00 0.00 H new ATOM 0 HG SER B 57 18.763 -11.769 -4.389 1.00 0.00 H new ATOM 2061 N ASP B 58 15.001 -10.812 -1.931 1.00 0.00 N ATOM 2062 CA ASP B 58 14.106 -11.761 -1.262 1.00 0.00 C ATOM 2063 C ASP B 58 12.672 -11.604 -1.757 1.00 0.00 C ATOM 2064 O ASP B 58 11.854 -12.513 -1.615 1.00 0.00 O ATOM 2065 CB ASP B 58 14.137 -11.581 0.262 1.00 0.00 C ATOM 2066 CG ASP B 58 15.448 -12.006 0.896 1.00 0.00 C ATOM 2067 OD1 ASP B 58 15.730 -13.223 0.944 1.00 0.00 O ATOM 2068 OD2 ASP B 58 16.200 -11.125 1.362 1.00 0.00 O ATOM 0 H ASP B 58 15.431 -10.130 -1.307 1.00 0.00 H new ATOM 0 HA ASP B 58 14.463 -12.761 -1.506 1.00 0.00 H new ATOM 0 HB2 ASP B 58 13.950 -10.534 0.500 1.00 0.00 H new ATOM 0 HB3 ASP B 58 13.325 -12.158 0.704 1.00 0.00 H new ATOM 2073 N TYR B 59 12.370 -10.446 -2.331 1.00 0.00 N ATOM 2074 CA TYR B 59 11.032 -10.173 -2.839 1.00 0.00 C ATOM 2075 C TYR B 59 11.024 -10.073 -4.362 1.00 0.00 C ATOM 2076 O TYR B 59 10.004 -9.736 -4.965 1.00 0.00 O ATOM 2077 CB TYR B 59 10.475 -8.896 -2.211 1.00 0.00 C ATOM 2078 CG TYR B 59 10.209 -9.035 -0.730 1.00 0.00 C ATOM 2079 CD1 TYR B 59 9.041 -9.634 -0.275 1.00 0.00 C ATOM 2080 CD2 TYR B 59 11.124 -8.581 0.211 1.00 0.00 C ATOM 2081 CE1 TYR B 59 8.792 -9.775 1.073 1.00 0.00 C ATOM 2082 CE2 TYR B 59 10.881 -8.718 1.564 1.00 0.00 C ATOM 2083 CZ TYR B 59 9.713 -9.317 1.990 1.00 0.00 C ATOM 2084 OH TYR B 59 9.464 -9.464 3.337 1.00 0.00 O ATOM 0 H TYR B 59 13.033 -9.681 -2.456 1.00 0.00 H new ATOM 0 HA TYR B 59 10.390 -11.008 -2.560 1.00 0.00 H new ATOM 0 HB2 TYR B 59 11.180 -8.080 -2.373 1.00 0.00 H new ATOM 0 HB3 TYR B 59 9.549 -8.623 -2.717 1.00 0.00 H new ATOM 0 HD1 TYR B 59 8.316 -9.995 -0.990 1.00 0.00 H new ATOM 0 HD2 TYR B 59 12.040 -8.114 -0.120 1.00 0.00 H new ATOM 0 HE1 TYR B 59 7.879 -10.243 1.409 1.00 0.00 H new ATOM 0 HE2 TYR B 59 11.601 -8.358 2.284 1.00 0.00 H new ATOM 0 HH TYR B 59 8.917 -10.264 3.483 1.00 0.00 H new ATOM 2094 N ASN B 60 12.174 -10.365 -4.971 1.00 0.00 N ATOM 2095 CA ASN B 60 12.289 -10.452 -6.432 1.00 0.00 C ATOM 2096 C ASN B 60 11.971 -9.114 -7.105 1.00 0.00 C ATOM 2097 O ASN B 60 11.334 -9.073 -8.163 1.00 0.00 O ATOM 2098 CB ASN B 60 11.361 -11.553 -6.976 1.00 0.00 C ATOM 2099 CG ASN B 60 11.891 -12.961 -6.744 1.00 0.00 C ATOM 2100 OD1 ASN B 60 11.553 -13.888 -7.479 1.00 0.00 O ATOM 2101 ND2 ASN B 60 12.726 -13.139 -5.730 1.00 0.00 N ATOM 0 H ASN B 60 13.046 -10.547 -4.473 1.00 0.00 H new ATOM 0 HA ASN B 60 13.323 -10.705 -6.667 1.00 0.00 H new ATOM 0 HB2 ASN B 60 10.383 -11.459 -6.504 1.00 0.00 H new ATOM 0 HB3 ASN B 60 11.215 -11.399 -8.045 1.00 0.00 H new ATOM 0 HD21 ASN B 60 13.108 -14.066 -5.541 1.00 0.00 H new ATOM 0 HD22 ASN B 60 12.986 -12.349 -5.139 1.00 0.00 H new ATOM 2108 N ILE B 61 12.441 -8.029 -6.506 1.00 0.00 N ATOM 2109 CA ILE B 61 12.202 -6.692 -7.036 1.00 0.00 C ATOM 2110 C ILE B 61 13.129 -6.402 -8.220 1.00 0.00 C ATOM 2111 O ILE B 61 14.331 -6.661 -8.154 1.00 0.00 O ATOM 2112 CB ILE B 61 12.397 -5.630 -5.934 1.00 0.00 C ATOM 2113 CG1 ILE B 61 11.420 -5.893 -4.786 1.00 0.00 C ATOM 2114 CG2 ILE B 61 12.204 -4.227 -6.490 1.00 0.00 C ATOM 2115 CD1 ILE B 61 11.587 -4.958 -3.610 1.00 0.00 C ATOM 0 H ILE B 61 12.993 -8.048 -5.648 1.00 0.00 H new ATOM 0 HA ILE B 61 11.171 -6.647 -7.387 1.00 0.00 H new ATOM 0 HB ILE B 61 13.417 -5.701 -5.557 1.00 0.00 H new ATOM 0 HG12 ILE B 61 10.401 -5.808 -5.163 1.00 0.00 H new ATOM 0 HG13 ILE B 61 11.548 -6.919 -4.442 1.00 0.00 H new ATOM 0 HG21 ILE B 61 12.347 -3.497 -5.693 1.00 0.00 H new ATOM 0 HG22 ILE B 61 12.931 -4.046 -7.282 1.00 0.00 H new ATOM 0 HG23 ILE B 61 11.196 -4.131 -6.894 1.00 0.00 H new ATOM 0 HD11 ILE B 61 10.859 -5.209 -2.839 1.00 0.00 H new ATOM 0 HD12 ILE B 61 12.594 -5.059 -3.205 1.00 0.00 H new ATOM 0 HD13 ILE B 61 11.429 -3.930 -3.937 1.00 0.00 H new ATOM 2127 N GLN B 62 12.560 -5.865 -9.298 1.00 0.00 N ATOM 2128 CA GLN B 62 13.310 -5.636 -10.533 1.00 0.00 C ATOM 2129 C GLN B 62 13.902 -4.227 -10.578 1.00 0.00 C ATOM 2130 O GLN B 62 13.606 -3.390 -9.722 1.00 0.00 O ATOM 2131 CB GLN B 62 12.410 -5.857 -11.755 1.00 0.00 C ATOM 2132 CG GLN B 62 11.240 -4.889 -11.850 1.00 0.00 C ATOM 2133 CD GLN B 62 10.471 -5.022 -13.154 1.00 0.00 C ATOM 2134 OE1 GLN B 62 9.915 -4.050 -13.662 1.00 0.00 O ATOM 2135 NE2 GLN B 62 10.419 -6.224 -13.701 1.00 0.00 N ATOM 0 H GLN B 62 11.582 -5.580 -9.342 1.00 0.00 H new ATOM 0 HA GLN B 62 14.132 -6.352 -10.554 1.00 0.00 H new ATOM 0 HB2 GLN B 62 13.014 -5.769 -12.658 1.00 0.00 H new ATOM 0 HB3 GLN B 62 12.023 -6.876 -11.728 1.00 0.00 H new ATOM 0 HG2 GLN B 62 10.562 -5.062 -11.014 1.00 0.00 H new ATOM 0 HG3 GLN B 62 11.610 -3.868 -11.754 1.00 0.00 H new ATOM 0 HE21 GLN B 62 10.892 -7.009 -13.253 1.00 0.00 H new ATOM 0 HE22 GLN B 62 9.906 -6.367 -14.571 1.00 0.00 H new ATOM 2144 N LYS B 63 14.731 -3.974 -11.591 1.00 0.00 N ATOM 2145 CA LYS B 63 15.380 -2.673 -11.752 1.00 0.00 C ATOM 2146 C LYS B 63 14.361 -1.627 -12.194 1.00 0.00 C ATOM 2147 O LYS B 63 13.443 -1.945 -12.955 1.00 0.00 O ATOM 2148 CB LYS B 63 16.502 -2.722 -12.803 1.00 0.00 C ATOM 2149 CG LYS B 63 17.202 -4.067 -12.968 1.00 0.00 C ATOM 2150 CD LYS B 63 17.927 -4.514 -11.709 1.00 0.00 C ATOM 2151 CE LYS B 63 18.820 -5.714 -11.990 1.00 0.00 C ATOM 2152 NZ LYS B 63 18.074 -6.850 -12.603 1.00 0.00 N ATOM 0 H LYS B 63 14.969 -4.654 -12.313 1.00 0.00 H new ATOM 0 HA LYS B 63 15.808 -2.409 -10.785 1.00 0.00 H new ATOM 0 HB2 LYS B 63 16.084 -2.431 -13.767 1.00 0.00 H new ATOM 0 HB3 LYS B 63 17.251 -1.974 -12.542 1.00 0.00 H new ATOM 0 HG2 LYS B 63 16.467 -4.822 -13.245 1.00 0.00 H new ATOM 0 HG3 LYS B 63 17.916 -4.001 -13.789 1.00 0.00 H new ATOM 0 HD2 LYS B 63 18.528 -3.692 -11.320 1.00 0.00 H new ATOM 0 HD3 LYS B 63 17.200 -4.770 -10.938 1.00 0.00 H new ATOM 0 HE2 LYS B 63 19.629 -5.413 -12.656 1.00 0.00 H new ATOM 0 HE3 LYS B 63 19.280 -6.046 -11.059 1.00 0.00 H new ATOM 0 HZ1 LYS B 63 18.680 -7.695 -12.619 1.00 0.00 H new ATOM 0 HZ2 LYS B 63 17.220 -7.047 -12.043 1.00 0.00 H new ATOM 0 HZ3 LYS B 63 17.801 -6.602 -13.575 1.00 0.00 H new ATOM 2166 N GLU B 64 14.527 -0.389 -11.714 1.00 0.00 N ATOM 2167 CA GLU B 64 13.691 0.735 -12.135 1.00 0.00 C ATOM 2168 C GLU B 64 12.220 0.457 -11.862 1.00 0.00 C ATOM 2169 O GLU B 64 11.333 0.922 -12.579 1.00 0.00 O ATOM 2170 CB GLU B 64 13.939 1.049 -13.611 1.00 0.00 C ATOM 2171 CG GLU B 64 15.406 1.310 -13.910 1.00 0.00 C ATOM 2172 CD GLU B 64 15.645 1.831 -15.306 1.00 0.00 C ATOM 2173 OE1 GLU B 64 15.593 1.034 -16.263 1.00 0.00 O ATOM 2174 OE2 GLU B 64 15.915 3.044 -15.454 1.00 0.00 O ATOM 0 H GLU B 64 15.240 -0.142 -11.028 1.00 0.00 H new ATOM 0 HA GLU B 64 13.965 1.612 -11.549 1.00 0.00 H new ATOM 0 HB2 GLU B 64 13.590 0.216 -14.220 1.00 0.00 H new ATOM 0 HB3 GLU B 64 13.352 1.922 -13.898 1.00 0.00 H new ATOM 0 HG2 GLU B 64 15.795 2.029 -13.189 1.00 0.00 H new ATOM 0 HG3 GLU B 64 15.968 0.386 -13.773 1.00 0.00 H new ATOM 2181 N SER B 65 11.980 -0.285 -10.795 1.00 0.00 N ATOM 2182 CA SER B 65 10.629 -0.622 -10.378 1.00 0.00 C ATOM 2183 C SER B 65 10.005 0.521 -9.575 1.00 0.00 C ATOM 2184 O SER B 65 10.714 1.389 -9.062 1.00 0.00 O ATOM 2185 CB SER B 65 10.664 -1.906 -9.552 1.00 0.00 C ATOM 2186 OG SER B 65 11.697 -1.856 -8.580 1.00 0.00 O ATOM 0 H SER B 65 12.711 -0.669 -10.196 1.00 0.00 H new ATOM 0 HA SER B 65 10.011 -0.779 -11.262 1.00 0.00 H new ATOM 0 HB2 SER B 65 9.703 -2.052 -9.059 1.00 0.00 H new ATOM 0 HB3 SER B 65 10.819 -2.762 -10.209 1.00 0.00 H new ATOM 0 HG SER B 65 12.441 -2.427 -8.864 1.00 0.00 H new ATOM 2192 N THR B 66 8.681 0.533 -9.487 1.00 0.00 N ATOM 2193 CA THR B 66 7.981 1.543 -8.714 1.00 0.00 C ATOM 2194 C THR B 66 7.470 0.967 -7.397 1.00 0.00 C ATOM 2195 O THR B 66 6.559 0.134 -7.372 1.00 0.00 O ATOM 2196 CB THR B 66 6.804 2.133 -9.511 1.00 0.00 C ATOM 2197 OG1 THR B 66 7.274 2.613 -10.779 1.00 0.00 O ATOM 2198 CG2 THR B 66 6.136 3.273 -8.751 1.00 0.00 C ATOM 0 H THR B 66 8.073 -0.147 -9.943 1.00 0.00 H new ATOM 0 HA THR B 66 8.694 2.339 -8.498 1.00 0.00 H new ATOM 0 HB THR B 66 6.066 1.345 -9.661 1.00 0.00 H new ATOM 0 HG1 THR B 66 6.523 2.987 -11.286 1.00 0.00 H new ATOM 0 HG21 THR B 66 5.309 3.668 -9.341 1.00 0.00 H new ATOM 0 HG22 THR B 66 5.758 2.903 -7.798 1.00 0.00 H new ATOM 0 HG23 THR B 66 6.863 4.065 -8.570 1.00 0.00 H new ATOM 2206 N LEU B 67 8.067 1.414 -6.306 1.00 0.00 N ATOM 2207 CA LEU B 67 7.691 0.961 -4.978 1.00 0.00 C ATOM 2208 C LEU B 67 6.717 1.948 -4.359 1.00 0.00 C ATOM 2209 O LEU B 67 7.066 3.101 -4.124 1.00 0.00 O ATOM 2210 CB LEU B 67 8.924 0.819 -4.066 1.00 0.00 C ATOM 2211 CG LEU B 67 9.950 -0.252 -4.463 1.00 0.00 C ATOM 2212 CD1 LEU B 67 9.270 -1.583 -4.717 1.00 0.00 C ATOM 2213 CD2 LEU B 67 10.756 0.178 -5.677 1.00 0.00 C ATOM 0 H LEU B 67 8.823 2.099 -6.315 1.00 0.00 H new ATOM 0 HA LEU B 67 7.221 -0.018 -5.074 1.00 0.00 H new ATOM 0 HB2 LEU B 67 9.433 1.782 -4.028 1.00 0.00 H new ATOM 0 HB3 LEU B 67 8.578 0.602 -3.056 1.00 0.00 H new ATOM 0 HG LEU B 67 10.641 -0.373 -3.629 1.00 0.00 H new ATOM 0 HD11 LEU B 67 10.017 -2.326 -4.997 1.00 0.00 H new ATOM 0 HD12 LEU B 67 8.756 -1.908 -3.812 1.00 0.00 H new ATOM 0 HD13 LEU B 67 8.547 -1.474 -5.525 1.00 0.00 H new ATOM 0 HD21 LEU B 67 11.473 -0.602 -5.932 1.00 0.00 H new ATOM 0 HD22 LEU B 67 10.085 0.343 -6.520 1.00 0.00 H new ATOM 0 HD23 LEU B 67 11.289 1.101 -5.451 1.00 0.00 H new ATOM 2225 N HIS B 68 5.494 1.508 -4.114 1.00 0.00 N ATOM 2226 CA HIS B 68 4.493 2.370 -3.507 1.00 0.00 C ATOM 2227 C HIS B 68 4.676 2.398 -1.998 1.00 0.00 C ATOM 2228 O HIS B 68 4.473 1.391 -1.321 1.00 0.00 O ATOM 2229 CB HIS B 68 3.077 1.916 -3.874 1.00 0.00 C ATOM 2230 CG HIS B 68 2.763 2.084 -5.330 1.00 0.00 C ATOM 2231 ND1 HIS B 68 2.186 3.222 -5.850 1.00 0.00 N ATOM 2232 CD2 HIS B 68 2.961 1.252 -6.379 1.00 0.00 C ATOM 2233 CE1 HIS B 68 2.047 3.080 -7.157 1.00 0.00 C ATOM 2234 NE2 HIS B 68 2.508 1.895 -7.502 1.00 0.00 N ATOM 0 H HIS B 68 5.171 0.564 -4.325 1.00 0.00 H new ATOM 0 HA HIS B 68 4.627 3.379 -3.896 1.00 0.00 H new ATOM 0 HB2 HIS B 68 2.956 0.868 -3.601 1.00 0.00 H new ATOM 0 HB3 HIS B 68 2.356 2.484 -3.285 1.00 0.00 H new ATOM 0 HD2 HIS B 68 3.396 0.264 -6.339 1.00 0.00 H new ATOM 0 HE1 HIS B 68 1.626 3.813 -7.829 1.00 0.00 H new ATOM 0 HE2 HIS B 68 2.525 1.518 -8.449 1.00 0.00 H new ATOM 2243 N LEU B 69 5.089 3.545 -1.486 1.00 0.00 N ATOM 2244 CA LEU B 69 5.360 3.695 -0.067 1.00 0.00 C ATOM 2245 C LEU B 69 4.103 4.118 0.683 1.00 0.00 C ATOM 2246 O LEU B 69 3.592 5.225 0.492 1.00 0.00 O ATOM 2247 CB LEU B 69 6.479 4.717 0.158 1.00 0.00 C ATOM 2248 CG LEU B 69 6.881 4.934 1.619 1.00 0.00 C ATOM 2249 CD1 LEU B 69 7.364 3.630 2.238 1.00 0.00 C ATOM 2250 CD2 LEU B 69 7.958 6.004 1.726 1.00 0.00 C ATOM 0 H LEU B 69 5.245 4.390 -2.036 1.00 0.00 H new ATOM 0 HA LEU B 69 5.683 2.729 0.321 1.00 0.00 H new ATOM 0 HB2 LEU B 69 7.359 4.397 -0.400 1.00 0.00 H new ATOM 0 HB3 LEU B 69 6.166 5.673 -0.261 1.00 0.00 H new ATOM 0 HG LEU B 69 6.003 5.274 2.169 1.00 0.00 H new ATOM 0 HD11 LEU B 69 7.646 3.803 3.277 1.00 0.00 H new ATOM 0 HD12 LEU B 69 6.565 2.890 2.197 1.00 0.00 H new ATOM 0 HD13 LEU B 69 8.228 3.262 1.684 1.00 0.00 H new ATOM 0 HD21 LEU B 69 8.230 6.143 2.772 1.00 0.00 H new ATOM 0 HD22 LEU B 69 8.837 5.693 1.161 1.00 0.00 H new ATOM 0 HD23 LEU B 69 7.580 6.943 1.321 1.00 0.00 H new ATOM 2262 N VAL B 70 3.600 3.222 1.514 1.00 0.00 N ATOM 2263 CA VAL B 70 2.446 3.510 2.346 1.00 0.00 C ATOM 2264 C VAL B 70 2.902 3.744 3.779 1.00 0.00 C ATOM 2265 O VAL B 70 3.717 2.987 4.311 1.00 0.00 O ATOM 2266 CB VAL B 70 1.420 2.357 2.309 1.00 0.00 C ATOM 2267 CG1 VAL B 70 0.175 2.709 3.109 1.00 0.00 C ATOM 2268 CG2 VAL B 70 1.055 2.014 0.872 1.00 0.00 C ATOM 0 H VAL B 70 3.977 2.281 1.630 1.00 0.00 H new ATOM 0 HA VAL B 70 1.960 4.405 1.957 1.00 0.00 H new ATOM 0 HB VAL B 70 1.878 1.481 2.768 1.00 0.00 H new ATOM 0 HG11 VAL B 70 -0.531 1.880 3.066 1.00 0.00 H new ATOM 0 HG12 VAL B 70 0.451 2.898 4.147 1.00 0.00 H new ATOM 0 HG13 VAL B 70 -0.288 3.602 2.688 1.00 0.00 H new ATOM 0 HG21 VAL B 70 0.331 1.199 0.865 1.00 0.00 H new ATOM 0 HG22 VAL B 70 0.621 2.889 0.388 1.00 0.00 H new ATOM 0 HG23 VAL B 70 1.951 1.708 0.332 1.00 0.00 H new ATOM 2278 N LEU B 71 2.398 4.800 4.394 1.00 0.00 N ATOM 2279 CA LEU B 71 2.798 5.149 5.745 1.00 0.00 C ATOM 2280 C LEU B 71 1.909 4.469 6.770 1.00 0.00 C ATOM 2281 O LEU B 71 0.691 4.467 6.645 1.00 0.00 O ATOM 2282 CB LEU B 71 2.773 6.660 5.943 1.00 0.00 C ATOM 2283 CG LEU B 71 3.918 7.419 5.273 1.00 0.00 C ATOM 2284 CD1 LEU B 71 3.723 7.511 3.769 1.00 0.00 C ATOM 2285 CD2 LEU B 71 4.048 8.791 5.886 1.00 0.00 C ATOM 0 H LEU B 71 1.711 5.430 3.979 1.00 0.00 H new ATOM 0 HA LEU B 71 3.819 4.797 5.891 1.00 0.00 H new ATOM 0 HB2 LEU B 71 1.828 7.046 5.560 1.00 0.00 H new ATOM 0 HB3 LEU B 71 2.794 6.871 7.012 1.00 0.00 H new ATOM 0 HG LEU B 71 4.842 6.866 5.442 1.00 0.00 H new ATOM 0 HD11 LEU B 71 4.556 8.057 3.327 1.00 0.00 H new ATOM 0 HD12 LEU B 71 3.681 6.508 3.345 1.00 0.00 H new ATOM 0 HD13 LEU B 71 2.791 8.034 3.554 1.00 0.00 H new ATOM 0 HD21 LEU B 71 4.865 9.328 5.405 1.00 0.00 H new ATOM 0 HD22 LEU B 71 3.118 9.342 5.744 1.00 0.00 H new ATOM 0 HD23 LEU B 71 4.254 8.695 6.952 1.00 0.00 H new ATOM 2297 N ARG B 72 2.532 3.891 7.786 1.00 0.00 N ATOM 2298 CA ARG B 72 1.812 3.150 8.817 1.00 0.00 C ATOM 2299 C ARG B 72 1.101 4.113 9.765 1.00 0.00 C ATOM 2300 O ARG B 72 0.121 3.745 10.414 1.00 0.00 O ATOM 2301 CB ARG B 72 2.787 2.257 9.596 1.00 0.00 C ATOM 2302 CG ARG B 72 2.120 1.285 10.565 1.00 0.00 C ATOM 2303 CD ARG B 72 1.239 0.273 9.842 1.00 0.00 C ATOM 2304 NE ARG B 72 0.977 -0.910 10.664 1.00 0.00 N ATOM 2305 CZ ARG B 72 0.365 -2.013 10.226 1.00 0.00 C ATOM 2306 NH1 ARG B 72 -0.161 -2.050 9.005 1.00 0.00 N ATOM 2307 NH2 ARG B 72 0.264 -3.076 11.015 1.00 0.00 N ATOM 0 H ARG B 72 3.543 3.920 7.921 1.00 0.00 H new ATOM 0 HA ARG B 72 1.062 2.520 8.339 1.00 0.00 H new ATOM 0 HB2 ARG B 72 3.385 1.688 8.885 1.00 0.00 H new ATOM 0 HB3 ARG B 72 3.474 2.892 10.154 1.00 0.00 H new ATOM 0 HG2 ARG B 72 2.886 0.758 11.134 1.00 0.00 H new ATOM 0 HG3 ARG B 72 1.518 1.843 11.282 1.00 0.00 H new ATOM 0 HD2 ARG B 72 0.294 0.743 9.571 1.00 0.00 H new ATOM 0 HD3 ARG B 72 1.722 -0.030 8.913 1.00 0.00 H new ATOM 0 HE ARG B 72 1.283 -0.890 11.637 1.00 0.00 H new ATOM 0 HH11 ARG B 72 -0.098 -1.233 8.398 1.00 0.00 H new ATOM 0 HH12 ARG B 72 -0.627 -2.895 8.676 1.00 0.00 H new ATOM 0 HH21 ARG B 72 0.654 -3.051 11.957 1.00 0.00 H new ATOM 0 HH22 ARG B 72 -0.204 -3.918 10.679 1.00 0.00 H new ATOM 2321 N LEU B 73 1.612 5.346 9.831 1.00 0.00 N ATOM 2322 CA LEU B 73 1.030 6.402 10.664 1.00 0.00 C ATOM 2323 C LEU B 73 1.055 6.021 12.140 1.00 0.00 C ATOM 2324 O LEU B 73 0.188 6.438 12.914 1.00 0.00 O ATOM 2325 CB LEU B 73 -0.402 6.711 10.212 1.00 0.00 C ATOM 2326 CG LEU B 73 -0.528 7.256 8.789 1.00 0.00 C ATOM 2327 CD1 LEU B 73 -1.987 7.489 8.444 1.00 0.00 C ATOM 2328 CD2 LEU B 73 0.268 8.545 8.639 1.00 0.00 C ATOM 0 H LEU B 73 2.438 5.639 9.310 1.00 0.00 H new ATOM 0 HA LEU B 73 1.637 7.299 10.542 1.00 0.00 H new ATOM 0 HB2 LEU B 73 -0.996 5.800 10.290 1.00 0.00 H new ATOM 0 HB3 LEU B 73 -0.836 7.435 10.902 1.00 0.00 H new ATOM 0 HG LEU B 73 -0.120 6.519 8.097 1.00 0.00 H new ATOM 0 HD11 LEU B 73 -2.063 7.877 7.428 1.00 0.00 H new ATOM 0 HD12 LEU B 73 -2.532 6.548 8.515 1.00 0.00 H new ATOM 0 HD13 LEU B 73 -2.415 8.210 9.141 1.00 0.00 H new ATOM 0 HD21 LEU B 73 0.167 8.919 7.620 1.00 0.00 H new ATOM 0 HD22 LEU B 73 -0.111 9.290 9.338 1.00 0.00 H new ATOM 0 HD23 LEU B 73 1.319 8.350 8.851 1.00 0.00 H new ATOM 2340 N ARG B 74 2.077 5.247 12.516 1.00 0.00 N ATOM 2341 CA ARG B 74 2.282 4.797 13.896 1.00 0.00 C ATOM 2342 C ARG B 74 1.251 3.750 14.308 1.00 0.00 C ATOM 2343 O ARG B 74 1.591 2.581 14.490 1.00 0.00 O ATOM 2344 CB ARG B 74 2.264 5.977 14.879 1.00 0.00 C ATOM 2345 CG ARG B 74 3.353 7.002 14.617 1.00 0.00 C ATOM 2346 CD ARG B 74 4.734 6.382 14.733 1.00 0.00 C ATOM 2347 NE ARG B 74 5.792 7.340 14.424 1.00 0.00 N ATOM 2348 CZ ARG B 74 7.060 7.000 14.212 1.00 0.00 C ATOM 2349 NH1 ARG B 74 7.413 5.721 14.230 1.00 0.00 N ATOM 2350 NH2 ARG B 74 7.965 7.938 13.959 1.00 0.00 N ATOM 0 H ARG B 74 2.790 4.913 11.868 1.00 0.00 H new ATOM 0 HA ARG B 74 3.268 4.333 13.933 1.00 0.00 H new ATOM 0 HB2 ARG B 74 1.293 6.469 14.825 1.00 0.00 H new ATOM 0 HB3 ARG B 74 2.372 5.595 15.894 1.00 0.00 H new ATOM 0 HG2 ARG B 74 3.225 7.425 13.621 1.00 0.00 H new ATOM 0 HG3 ARG B 74 3.260 7.824 15.327 1.00 0.00 H new ATOM 0 HD2 ARG B 74 4.876 5.999 15.744 1.00 0.00 H new ATOM 0 HD3 ARG B 74 4.807 5.531 14.056 1.00 0.00 H new ATOM 0 HE ARG B 74 5.544 8.328 14.367 1.00 0.00 H new ATOM 0 HH11 ARG B 74 6.712 5.001 14.406 1.00 0.00 H new ATOM 0 HH12 ARG B 74 8.385 5.458 14.068 1.00 0.00 H new ATOM 0 HH21 ARG B 74 7.688 8.919 13.927 1.00 0.00 H new ATOM 0 HH22 ARG B 74 8.938 7.678 13.796 1.00 0.00 H new ATOM 2364 N GLY B 75 -0.001 4.165 14.450 1.00 0.00 N ATOM 2365 CA GLY B 75 -1.033 3.257 14.912 1.00 0.00 C ATOM 2366 C GLY B 75 -1.071 3.171 16.425 1.00 0.00 C ATOM 2367 O GLY B 75 -2.101 3.432 17.046 1.00 0.00 O ATOM 0 H GLY B 75 -0.320 5.114 14.254 1.00 0.00 H new ATOM 0 HA2 GLY B 75 -2.003 3.591 14.542 1.00 0.00 H new ATOM 0 HA3 GLY B 75 -0.857 2.265 14.496 1.00 0.00 H new ATOM 2371 N GLY B 76 0.059 2.813 17.015 1.00 0.00 N ATOM 2372 CA GLY B 76 0.167 2.741 18.454 1.00 0.00 C ATOM 2373 C GLY B 76 1.478 3.324 18.934 1.00 0.00 C ATOM 2374 O GLY B 76 1.528 3.844 20.067 1.00 0.00 O ATOM 2375 OXT GLY B 76 2.467 3.276 18.167 1.00 0.00 O ATOM 0 H GLY B 76 0.913 2.568 16.514 1.00 0.00 H new ATOM 0 HA2 GLY B 76 -0.663 3.280 18.911 1.00 0.00 H new ATOM 0 HA3 GLY B 76 0.088 1.703 18.776 1.00 0.00 H new TER 2379 GLY B 76