USER MOD reduce.3.24.130724 H: found=0, std=0, add=1162, rem=0, adj=46 USER MOD reduce.3.24.130724 removed 1038 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 14 MET CE :methyl -164:sc= -0.0586 (180deg=-0.382) USER MOD Single : A 15 MET CE :methyl -124:sc=-0.00262 (180deg=-0.527) USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 19 LYS NZ :NH3+ -175:sc= 1.23 (180deg=1.12) USER MOD Single : A 28 ASN : amide:sc=-0.00329 X(o=-0.0033,f=0) USER MOD Single : A 29 TYR OH : rot 180:sc= -0.201 USER MOD Single : A 31 SER OG : rot 73:sc= 1.27 USER MOD Single : A 32 SER OG : rot 68:sc= 0.891 USER MOD Single : A 36 LYS NZ :NH3+ -152:sc= 1.23 (180deg=1.15) USER MOD Single : A 37 LYS NZ :NH3+ 171:sc=-0.00268 (180deg=-0.104) USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 46 SER OG : rot -90:sc= 1.29 USER MOD Single : A 48 ASN :FLIP amide:sc= -0.623 F(o=-1.3,f=-0.62) USER MOD Single : A 51 MET CE :methyl -157:sc= -1.56 (180deg=-2.79!) USER MOD Single : A 53 CYS SG : rot 79:sc= -0.493 USER MOD Single : A 55 SER OG : rot 82:sc= 1.33 USER MOD Single : A 66 SER OG : rot 133:sc= 1.26 USER MOD Single : A 71 LYS NZ :NH3+ -168:sc= -0.0465 (180deg=-0.258) USER MOD Single : A 72 SER OG : rot 110:sc= 0.239 USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 GLN : amide:sc= 0.436 K(o=0.44,f=-0.1) USER MOD Single : A 78 HIS : no HE2:sc= 1.11 K(o=1.1,f=-3.6!) USER MOD Single : A 84 ASN : amide:sc= -1.26! X(o=-1.3!,f=-1) USER MOD Single : A 85 SER OG : rot 20:sc= 1.12 USER MOD Single : A 87 SER OG : rot 45:sc= 0.401 USER MOD Single : A 92 SER OG : rot 42:sc= 0.504 USER MOD Single : B 14 MET CE :methyl -164:sc= -0.076 (180deg=-0.445) USER MOD Single : B 15 MET CE :methyl -124:sc=-0.00253 (180deg=-0.541) USER MOD Single : B 16 SER OG : rot 180:sc= 0 USER MOD Single : B 18 SER OG : rot 180:sc= 0 USER MOD Single : B 19 LYS NZ :NH3+ -176:sc= 1.21 (180deg=1.12) USER MOD Single : B 28 ASN : amide:sc=-0.00449 X(o=-0.0045,f=0) USER MOD Single : B 29 TYR OH : rot 180:sc= -0.175 USER MOD Single : B 31 SER OG : rot 72:sc= 1.3 USER MOD Single : B 32 SER OG : rot 68:sc= 0.869 USER MOD Single : B 36 LYS NZ :NH3+ -172:sc= 1.23 (180deg=1.2) USER MOD Single : B 37 LYS NZ :NH3+ 170:sc=-0.00728 (180deg=-0.121) USER MOD Single : B 40 SER OG : rot 180:sc= 0 USER MOD Single : B 46 SER OG : rot -95:sc= 1.25 USER MOD Single : B 48 ASN :FLIP amide:sc= -0.649 F(o=-1.2,f=-0.65) USER MOD Single : B 51 MET CE :methyl -159:sc= -1.6! (180deg=-2.72!) USER MOD Single : B 53 CYS SG : rot 79:sc= -0.51 USER MOD Single : B 55 SER OG : rot 83:sc= 1.31 USER MOD Single : B 66 SER OG : rot 170:sc= 1.22 USER MOD Single : B 71 LYS NZ :NH3+ -168:sc= -0.0454 (180deg=-0.235) USER MOD Single : B 72 SER OG : rot 111:sc= 0.25 USER MOD Single : B 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 77 GLN : amide:sc= 0.413 K(o=0.41,f=-0.12) USER MOD Single : B 78 HIS : no HE2:sc= 1.16 K(o=1.2,f=-3.5!) USER MOD Single : B 84 ASN : amide:sc= -1.33! X(o=-1.3!,f=-0.95) USER MOD Single : B 85 SER OG : rot 22:sc= 1.1 USER MOD Single : B 87 SER OG : rot 43:sc= 0.413 USER MOD Single : B 92 SER OG : rot 42:sc= 0.464 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 14 -14.660 -9.426 2.724 1.00 4.47 N ATOM 2 CA MET A 14 -14.948 -10.146 3.992 1.00 3.81 C ATOM 3 C MET A 14 -13.712 -10.200 4.881 1.00 2.82 C ATOM 4 O MET A 14 -13.821 -10.385 6.092 1.00 2.99 O ATOM 5 CB MET A 14 -15.445 -11.573 3.715 1.00 4.50 C ATOM 6 CG MET A 14 -14.363 -12.521 3.218 1.00 5.02 C ATOM 7 SD MET A 14 -14.993 -14.156 2.795 1.00 5.80 S ATOM 8 CE MET A 14 -15.561 -14.732 4.394 1.00 6.45 C ATOM 0 HA MET A 14 -15.732 -9.594 4.510 1.00 3.81 H new ATOM 0 HB2 MET A 14 -15.878 -11.980 4.629 1.00 4.50 H new ATOM 0 HB3 MET A 14 -16.244 -11.531 2.975 1.00 4.50 H new ATOM 0 HG2 MET A 14 -13.882 -12.086 2.342 1.00 5.02 H new ATOM 0 HG3 MET A 14 -13.596 -12.621 3.986 1.00 5.02 H new ATOM 0 HE1 MET A 14 -15.711 -15.811 4.360 1.00 6.45 H new ATOM 0 HE2 MET A 14 -14.816 -14.493 5.153 1.00 6.45 H new ATOM 0 HE3 MET A 14 -16.502 -14.243 4.644 1.00 6.45 H new ATOM 20 N MET A 15 -12.535 -10.050 4.281 1.00 2.12 N ATOM 21 CA MET A 15 -11.293 -10.109 5.028 1.00 1.95 C ATOM 22 C MET A 15 -11.080 -8.819 5.801 1.00 1.69 C ATOM 23 O MET A 15 -11.487 -7.741 5.366 1.00 2.48 O ATOM 24 CB MET A 15 -10.110 -10.358 4.089 1.00 2.52 C ATOM 25 CG MET A 15 -10.225 -11.651 3.296 1.00 3.07 C ATOM 26 SD MET A 15 -10.464 -13.097 4.347 1.00 3.93 S ATOM 27 CE MET A 15 -10.540 -14.397 3.116 1.00 4.73 C ATOM 0 H MET A 15 -12.420 -9.887 3.281 1.00 2.12 H new ATOM 0 HA MET A 15 -11.358 -10.937 5.734 1.00 1.95 H new ATOM 0 HB2 MET A 15 -10.025 -9.522 3.395 1.00 2.52 H new ATOM 0 HB3 MET A 15 -9.191 -10.381 4.674 1.00 2.52 H new ATOM 0 HG2 MET A 15 -11.060 -11.572 2.600 1.00 3.07 H new ATOM 0 HG3 MET A 15 -9.323 -11.787 2.699 1.00 3.07 H new ATOM 0 HE1 MET A 15 -11.473 -14.950 3.228 1.00 4.73 H new ATOM 0 HE2 MET A 15 -10.496 -13.957 2.119 1.00 4.73 H new ATOM 0 HE3 MET A 15 -9.697 -15.075 3.251 1.00 4.73 H new ATOM 37 N SER A 16 -10.442 -8.939 6.951 1.00 1.19 N ATOM 38 CA SER A 16 -10.180 -7.788 7.803 1.00 1.17 C ATOM 39 C SER A 16 -8.850 -7.139 7.437 1.00 1.05 C ATOM 40 O SER A 16 -8.335 -6.293 8.171 1.00 1.91 O ATOM 41 CB SER A 16 -10.180 -8.212 9.272 1.00 1.62 C ATOM 42 OG SER A 16 -11.357 -8.938 9.587 1.00 2.01 O ATOM 0 H SER A 16 -10.094 -9.824 7.319 1.00 1.19 H new ATOM 0 HA SER A 16 -10.971 -7.054 7.648 1.00 1.17 H new ATOM 0 HB2 SER A 16 -9.303 -8.825 9.478 1.00 1.62 H new ATOM 0 HB3 SER A 16 -10.109 -7.331 9.909 1.00 1.62 H new ATOM 0 HG SER A 16 -11.336 -9.201 10.531 1.00 2.01 H new ATOM 48 N ALA A 17 -8.312 -7.557 6.289 1.00 0.93 N ATOM 49 CA ALA A 17 -7.049 -7.050 5.767 1.00 0.81 C ATOM 50 C ALA A 17 -5.889 -7.395 6.692 1.00 0.69 C ATOM 51 O ALA A 17 -5.426 -6.560 7.468 1.00 0.70 O ATOM 52 CB ALA A 17 -7.126 -5.547 5.525 1.00 1.09 C ATOM 0 H ALA A 17 -8.747 -8.262 5.694 1.00 0.93 H new ATOM 0 HA ALA A 17 -6.865 -7.538 4.810 1.00 0.81 H new ATOM 0 HB1 ALA A 17 -6.172 -5.192 5.136 1.00 1.09 H new ATOM 0 HB2 ALA A 17 -7.914 -5.335 4.803 1.00 1.09 H new ATOM 0 HB3 ALA A 17 -7.347 -5.038 6.463 1.00 1.09 H new ATOM 58 N SER A 18 -5.433 -8.635 6.611 1.00 0.64 N ATOM 59 CA SER A 18 -4.292 -9.079 7.391 1.00 0.61 C ATOM 60 C SER A 18 -3.010 -8.500 6.793 1.00 0.50 C ATOM 61 O SER A 18 -3.021 -8.005 5.665 1.00 0.45 O ATOM 62 CB SER A 18 -4.239 -10.612 7.424 1.00 0.66 C ATOM 63 OG SER A 18 -3.280 -11.082 8.355 1.00 1.32 O ATOM 0 H SER A 18 -5.838 -9.353 6.010 1.00 0.64 H new ATOM 0 HA SER A 18 -4.391 -8.723 8.417 1.00 0.61 H new ATOM 0 HB2 SER A 18 -5.222 -11.005 7.684 1.00 0.66 H new ATOM 0 HB3 SER A 18 -3.997 -10.990 6.430 1.00 0.66 H new ATOM 0 HG SER A 18 -3.274 -12.062 8.352 1.00 1.32 H new ATOM 69 N LYS A 19 -1.913 -8.575 7.539 1.00 0.50 N ATOM 70 CA LYS A 19 -0.662 -7.927 7.144 1.00 0.43 C ATOM 71 C LYS A 19 -0.230 -8.373 5.749 1.00 0.34 C ATOM 72 O LYS A 19 -0.006 -7.545 4.861 1.00 0.28 O ATOM 73 CB LYS A 19 0.443 -8.249 8.154 1.00 0.54 C ATOM 74 CG LYS A 19 -0.025 -8.233 9.598 1.00 0.84 C ATOM 75 CD LYS A 19 1.126 -8.461 10.562 1.00 1.12 C ATOM 76 CE LYS A 19 0.625 -8.814 11.952 1.00 1.73 C ATOM 77 NZ LYS A 19 -0.320 -7.799 12.487 1.00 2.10 N ATOM 0 H LYS A 19 -1.862 -9.079 8.424 1.00 0.50 H new ATOM 0 HA LYS A 19 -0.832 -6.851 7.126 1.00 0.43 H new ATOM 0 HB2 LYS A 19 0.856 -9.232 7.926 1.00 0.54 H new ATOM 0 HB3 LYS A 19 1.252 -7.528 8.036 1.00 0.54 H new ATOM 0 HG2 LYS A 19 -0.499 -7.276 9.817 1.00 0.84 H new ATOM 0 HG3 LYS A 19 -0.781 -9.004 9.744 1.00 0.84 H new ATOM 0 HD2 LYS A 19 1.762 -9.264 10.188 1.00 1.12 H new ATOM 0 HD3 LYS A 19 1.743 -7.564 10.613 1.00 1.12 H new ATOM 0 HE2 LYS A 19 0.132 -9.786 11.922 1.00 1.73 H new ATOM 0 HE3 LYS A 19 1.474 -8.908 12.629 1.00 1.73 H new ATOM 0 HZ1 LYS A 19 -0.568 -8.039 13.468 1.00 2.10 H new ATOM 0 HZ2 LYS A 19 0.128 -6.861 12.463 1.00 2.10 H new ATOM 0 HZ3 LYS A 19 -1.182 -7.786 11.905 1.00 2.10 H new ATOM 91 N GLU A 20 -0.138 -9.686 5.564 1.00 0.41 N ATOM 92 CA GLU A 20 0.282 -10.264 4.292 1.00 0.41 C ATOM 93 C GLU A 20 -0.666 -9.871 3.159 1.00 0.34 C ATOM 94 O GLU A 20 -0.234 -9.636 2.034 1.00 0.30 O ATOM 95 CB GLU A 20 0.365 -11.789 4.407 1.00 0.57 C ATOM 96 CG GLU A 20 -0.938 -12.444 4.842 1.00 0.64 C ATOM 97 CD GLU A 20 -0.826 -13.948 4.964 1.00 0.95 C ATOM 98 OE1 GLU A 20 -0.172 -14.422 5.914 1.00 1.49 O ATOM 99 OE2 GLU A 20 -1.402 -14.664 4.117 1.00 1.57 O ATOM 0 H GLU A 20 -0.351 -10.375 6.285 1.00 0.41 H new ATOM 0 HA GLU A 20 1.269 -9.868 4.054 1.00 0.41 H new ATOM 0 HB2 GLU A 20 0.664 -12.201 3.443 1.00 0.57 H new ATOM 0 HB3 GLU A 20 1.147 -12.048 5.121 1.00 0.57 H new ATOM 0 HG2 GLU A 20 -1.246 -12.028 5.801 1.00 0.64 H new ATOM 0 HG3 GLU A 20 -1.720 -12.200 4.123 1.00 0.64 H new ATOM 106 N GLU A 21 -1.954 -9.780 3.474 1.00 0.37 N ATOM 107 CA GLU A 21 -2.972 -9.466 2.478 1.00 0.39 C ATOM 108 C GLU A 21 -2.818 -8.033 1.988 1.00 0.32 C ATOM 109 O GLU A 21 -2.946 -7.752 0.795 1.00 0.34 O ATOM 110 CB GLU A 21 -4.365 -9.663 3.070 1.00 0.50 C ATOM 111 CG GLU A 21 -4.607 -11.067 3.598 1.00 0.61 C ATOM 112 CD GLU A 21 -6.018 -11.263 4.109 1.00 0.91 C ATOM 113 OE1 GLU A 21 -6.396 -10.609 5.102 1.00 1.49 O ATOM 114 OE2 GLU A 21 -6.754 -12.088 3.530 1.00 1.54 O ATOM 0 H GLU A 21 -2.319 -9.920 4.416 1.00 0.37 H new ATOM 0 HA GLU A 21 -2.844 -10.141 1.632 1.00 0.39 H new ATOM 0 HB2 GLU A 21 -4.511 -8.949 3.880 1.00 0.50 H new ATOM 0 HB3 GLU A 21 -5.110 -9.437 2.308 1.00 0.50 H new ATOM 0 HG2 GLU A 21 -4.408 -11.788 2.805 1.00 0.61 H new ATOM 0 HG3 GLU A 21 -3.901 -11.275 4.402 1.00 0.61 H new ATOM 121 N ILE A 22 -2.535 -7.133 2.918 1.00 0.30 N ATOM 122 CA ILE A 22 -2.325 -5.734 2.588 1.00 0.28 C ATOM 123 C ILE A 22 -1.059 -5.574 1.762 1.00 0.24 C ATOM 124 O ILE A 22 -1.082 -4.979 0.684 1.00 0.26 O ATOM 125 CB ILE A 22 -2.214 -4.871 3.857 1.00 0.30 C ATOM 126 CG1 ILE A 22 -3.459 -5.051 4.721 1.00 0.36 C ATOM 127 CG2 ILE A 22 -2.028 -3.405 3.486 1.00 0.31 C ATOM 128 CD1 ILE A 22 -3.345 -4.409 6.081 1.00 0.44 C ATOM 0 H ILE A 22 -2.446 -7.349 3.911 1.00 0.30 H new ATOM 0 HA ILE A 22 -3.187 -5.397 2.012 1.00 0.28 H new ATOM 0 HB ILE A 22 -1.343 -5.193 4.428 1.00 0.30 H new ATOM 0 HG12 ILE A 22 -4.318 -4.629 4.199 1.00 0.36 H new ATOM 0 HG13 ILE A 22 -3.654 -6.116 4.846 1.00 0.36 H new ATOM 0 HG21 ILE A 22 -1.951 -2.807 4.394 1.00 0.31 H new ATOM 0 HG22 ILE A 22 -1.117 -3.291 2.898 1.00 0.31 H new ATOM 0 HG23 ILE A 22 -2.883 -3.067 2.900 1.00 0.31 H new ATOM 0 HD11 ILE A 22 -4.265 -4.576 6.641 1.00 0.44 H new ATOM 0 HD12 ILE A 22 -2.507 -4.848 6.622 1.00 0.44 H new ATOM 0 HD13 ILE A 22 -3.181 -3.338 5.965 1.00 0.44 H new ATOM 135 N ALA A 23 0.038 -6.129 2.271 1.00 0.20 N ATOM 136 CA ALA A 23 1.322 -6.072 1.584 1.00 0.19 C ATOM 137 C ALA A 23 1.207 -6.643 0.179 1.00 0.20 C ATOM 138 O ALA A 23 1.825 -6.138 -0.757 1.00 0.20 O ATOM 139 CB ALA A 23 2.378 -6.826 2.376 1.00 0.20 C ATOM 0 H ALA A 23 0.061 -6.625 3.162 1.00 0.20 H new ATOM 0 HA ALA A 23 1.623 -5.027 1.505 1.00 0.19 H new ATOM 0 HB1 ALA A 23 3.332 -6.775 1.851 1.00 0.20 H new ATOM 0 HB2 ALA A 23 2.483 -6.376 3.363 1.00 0.20 H new ATOM 0 HB3 ALA A 23 2.078 -7.868 2.482 1.00 0.20 H new ATOM 145 N ALA A 24 0.397 -7.686 0.048 1.00 0.22 N ATOM 146 CA ALA A 24 0.133 -8.313 -1.237 1.00 0.25 C ATOM 147 C ALA A 24 -0.382 -7.293 -2.250 1.00 0.24 C ATOM 148 O ALA A 24 0.181 -7.145 -3.333 1.00 0.25 O ATOM 149 CB ALA A 24 -0.875 -9.437 -1.062 1.00 0.31 C ATOM 0 H ALA A 24 -0.094 -8.119 0.830 1.00 0.22 H new ATOM 0 HA ALA A 24 1.067 -8.723 -1.620 1.00 0.25 H new ATOM 0 HB1 ALA A 24 -1.070 -9.904 -2.027 1.00 0.31 H new ATOM 0 HB2 ALA A 24 -0.475 -10.181 -0.373 1.00 0.31 H new ATOM 0 HB3 ALA A 24 -1.804 -9.033 -0.660 1.00 0.31 H new ATOM 155 N LEU A 25 -1.440 -6.582 -1.887 1.00 0.23 N ATOM 156 CA LEU A 25 -2.025 -5.579 -2.771 1.00 0.23 C ATOM 157 C LEU A 25 -1.043 -4.447 -3.036 1.00 0.22 C ATOM 158 O LEU A 25 -0.974 -3.920 -4.148 1.00 0.25 O ATOM 159 CB LEU A 25 -3.311 -5.019 -2.166 1.00 0.26 C ATOM 160 CG LEU A 25 -4.487 -5.993 -2.123 1.00 0.36 C ATOM 161 CD1 LEU A 25 -5.631 -5.401 -1.325 1.00 0.46 C ATOM 162 CD2 LEU A 25 -4.946 -6.336 -3.533 1.00 0.44 C ATOM 0 H LEU A 25 -1.912 -6.679 -0.988 1.00 0.23 H new ATOM 0 HA LEU A 25 -2.259 -6.064 -3.719 1.00 0.23 H new ATOM 0 HB2 LEU A 25 -3.100 -4.684 -1.150 1.00 0.26 H new ATOM 0 HB3 LEU A 25 -3.609 -4.139 -2.736 1.00 0.26 H new ATOM 0 HG LEU A 25 -4.159 -6.910 -1.634 1.00 0.36 H new ATOM 0 HD11 LEU A 25 -6.462 -6.106 -1.303 1.00 0.46 H new ATOM 0 HD12 LEU A 25 -5.298 -5.200 -0.307 1.00 0.46 H new ATOM 0 HD13 LEU A 25 -5.957 -4.471 -1.791 1.00 0.46 H new ATOM 0 HD21 LEU A 25 -5.784 -7.031 -3.484 1.00 0.44 H new ATOM 0 HD22 LEU A 25 -5.258 -5.426 -4.045 1.00 0.44 H new ATOM 0 HD23 LEU A 25 -4.124 -6.797 -4.081 1.00 0.44 H new ATOM 174 N ILE A 26 -0.279 -4.086 -2.014 1.00 0.21 N ATOM 175 CA ILE A 26 0.697 -3.014 -2.129 1.00 0.22 C ATOM 176 C ILE A 26 1.782 -3.367 -3.149 1.00 0.20 C ATOM 177 O ILE A 26 2.042 -2.601 -4.079 1.00 0.23 O ATOM 178 CB ILE A 26 1.350 -2.692 -0.765 1.00 0.22 C ATOM 179 CG1 ILE A 26 0.283 -2.293 0.260 1.00 0.26 C ATOM 180 CG2 ILE A 26 2.368 -1.574 -0.921 1.00 0.25 C ATOM 181 CD1 ILE A 26 0.834 -2.058 1.650 1.00 0.27 C ATOM 0 H ILE A 26 -0.318 -4.523 -1.093 1.00 0.21 H new ATOM 0 HA ILE A 26 0.161 -2.129 -2.472 1.00 0.22 H new ATOM 0 HB ILE A 26 1.860 -3.586 -0.406 1.00 0.22 H new ATOM 0 HG12 ILE A 26 -0.216 -1.386 -0.082 1.00 0.26 H new ATOM 0 HG13 ILE A 26 -0.475 -3.075 0.306 1.00 0.26 H new ATOM 0 HG21 ILE A 26 2.821 -1.357 0.046 1.00 0.25 H new ATOM 0 HG22 ILE A 26 3.143 -1.883 -1.623 1.00 0.25 H new ATOM 0 HG23 ILE A 26 1.872 -0.680 -1.298 1.00 0.25 H new ATOM 0 HD11 ILE A 26 0.022 -1.779 2.321 1.00 0.27 H new ATOM 0 HD12 ILE A 26 1.308 -2.970 2.013 1.00 0.27 H new ATOM 0 HD13 ILE A 26 1.570 -1.255 1.619 1.00 0.27 H new ATOM 188 N VAL A 27 2.398 -4.537 -2.991 1.00 0.18 N ATOM 189 CA VAL A 27 3.461 -4.954 -3.898 1.00 0.20 C ATOM 190 C VAL A 27 2.903 -5.276 -5.280 1.00 0.22 C ATOM 191 O VAL A 27 3.589 -5.096 -6.288 1.00 0.24 O ATOM 192 CB VAL A 27 4.264 -6.166 -3.364 1.00 0.21 C ATOM 193 CG1 VAL A 27 4.921 -5.830 -2.036 1.00 0.21 C ATOM 194 CG2 VAL A 27 3.386 -7.402 -3.230 1.00 0.21 C ATOM 0 H VAL A 27 2.181 -5.205 -2.252 1.00 0.18 H new ATOM 0 HA VAL A 27 4.148 -4.111 -3.970 1.00 0.20 H new ATOM 0 HB VAL A 27 5.044 -6.392 -4.091 1.00 0.21 H new ATOM 0 HG11 VAL A 27 5.480 -6.694 -1.678 1.00 0.21 H new ATOM 0 HG12 VAL A 27 5.600 -4.988 -2.169 1.00 0.21 H new ATOM 0 HG13 VAL A 27 4.155 -5.566 -1.307 1.00 0.21 H new ATOM 0 HG21 VAL A 27 3.982 -8.233 -2.853 1.00 0.21 H new ATOM 0 HG22 VAL A 27 2.571 -7.196 -2.536 1.00 0.21 H new ATOM 0 HG23 VAL A 27 2.975 -7.664 -4.205 1.00 0.21 H new ATOM 198 N ASN A 28 1.656 -5.737 -5.328 1.00 0.26 N ATOM 199 CA ASN A 28 1.001 -6.028 -6.598 1.00 0.32 C ATOM 200 C ASN A 28 0.807 -4.742 -7.387 1.00 0.27 C ATOM 201 O ASN A 28 1.061 -4.696 -8.588 1.00 0.29 O ATOM 202 CB ASN A 28 -0.352 -6.713 -6.376 1.00 0.45 C ATOM 203 CG ASN A 28 -0.955 -7.252 -7.664 1.00 0.68 C ATOM 204 OD1 ASN A 28 -0.702 -8.394 -8.052 1.00 1.59 O ATOM 205 ND2 ASN A 28 -1.760 -6.443 -8.336 1.00 0.86 N ATOM 0 H ASN A 28 1.081 -5.916 -4.505 1.00 0.26 H new ATOM 0 HA ASN A 28 1.639 -6.708 -7.163 1.00 0.32 H new ATOM 0 HB2 ASN A 28 -0.228 -7.532 -5.667 1.00 0.45 H new ATOM 0 HB3 ASN A 28 -1.045 -6.003 -5.925 1.00 0.45 H new ATOM 0 HD21 ASN A 28 -2.192 -6.759 -9.204 1.00 0.86 H new ATOM 0 HD22 ASN A 28 -1.948 -5.504 -7.986 1.00 0.86 H new ATOM 212 N TYR A 29 0.374 -3.689 -6.695 1.00 0.25 N ATOM 213 CA TYR A 29 0.195 -2.385 -7.322 1.00 0.24 C ATOM 214 C TYR A 29 1.522 -1.861 -7.854 1.00 0.19 C ATOM 215 O TYR A 29 1.602 -1.394 -8.988 1.00 0.19 O ATOM 216 CB TYR A 29 -0.415 -1.386 -6.335 1.00 0.29 C ATOM 217 CG TYR A 29 -0.476 0.029 -6.872 1.00 0.32 C ATOM 218 CD1 TYR A 29 -1.215 0.331 -8.009 1.00 1.20 C ATOM 219 CD2 TYR A 29 0.214 1.060 -6.246 1.00 1.23 C ATOM 220 CE1 TYR A 29 -1.262 1.617 -8.510 1.00 1.22 C ATOM 221 CE2 TYR A 29 0.169 2.349 -6.740 1.00 1.25 C ATOM 222 CZ TYR A 29 -0.569 2.623 -7.872 1.00 0.43 C ATOM 223 OH TYR A 29 -0.609 3.906 -8.370 1.00 0.50 O ATOM 0 H TYR A 29 0.142 -3.715 -5.702 1.00 0.25 H new ATOM 0 HA TYR A 29 -0.493 -2.503 -8.159 1.00 0.24 H new ATOM 0 HB2 TYR A 29 -1.422 -1.712 -6.075 1.00 0.29 H new ATOM 0 HB3 TYR A 29 0.169 -1.393 -5.415 1.00 0.29 H new ATOM 0 HD1 TYR A 29 -1.762 -0.454 -8.510 1.00 1.20 H new ATOM 0 HD2 TYR A 29 0.794 0.850 -5.360 1.00 1.23 H new ATOM 0 HE1 TYR A 29 -1.839 1.833 -9.397 1.00 1.22 H new ATOM 0 HE2 TYR A 29 0.710 3.140 -6.241 1.00 1.25 H new ATOM 0 HH TYR A 29 -0.068 4.494 -7.803 1.00 0.50 H new ATOM 233 N PHE A 30 2.566 -1.954 -7.036 1.00 0.16 N ATOM 234 CA PHE A 30 3.897 -1.528 -7.456 1.00 0.16 C ATOM 235 C PHE A 30 4.355 -2.334 -8.667 1.00 0.18 C ATOM 236 O PHE A 30 4.974 -1.797 -9.587 1.00 0.21 O ATOM 237 CB PHE A 30 4.906 -1.677 -6.313 1.00 0.19 C ATOM 238 CG PHE A 30 4.661 -0.773 -5.133 1.00 0.19 C ATOM 239 CD1 PHE A 30 3.849 0.349 -5.240 1.00 1.18 C ATOM 240 CD2 PHE A 30 5.261 -1.042 -3.913 1.00 1.19 C ATOM 241 CE1 PHE A 30 3.643 1.178 -4.155 1.00 1.17 C ATOM 242 CE2 PHE A 30 5.057 -0.215 -2.825 1.00 1.22 C ATOM 243 CZ PHE A 30 4.247 0.895 -2.946 1.00 0.25 C ATOM 0 H PHE A 30 2.517 -2.318 -6.084 1.00 0.16 H new ATOM 0 HA PHE A 30 3.843 -0.475 -7.731 1.00 0.16 H new ATOM 0 HB2 PHE A 30 4.894 -2.711 -5.969 1.00 0.19 H new ATOM 0 HB3 PHE A 30 5.905 -1.481 -6.701 1.00 0.19 H new ATOM 0 HD1 PHE A 30 3.373 0.576 -6.183 1.00 1.18 H new ATOM 0 HD2 PHE A 30 5.896 -1.909 -3.811 1.00 1.19 H new ATOM 0 HE1 PHE A 30 3.010 2.047 -4.252 1.00 1.17 H new ATOM 0 HE2 PHE A 30 5.531 -0.437 -1.881 1.00 1.22 H new ATOM 0 HZ PHE A 30 4.085 1.542 -2.096 1.00 0.25 H new ATOM 253 N SER A 31 4.026 -3.621 -8.669 1.00 0.21 N ATOM 254 CA SER A 31 4.331 -4.486 -9.798 1.00 0.27 C ATOM 255 C SER A 31 3.579 -4.026 -11.044 1.00 0.25 C ATOM 256 O SER A 31 4.132 -4.025 -12.139 1.00 0.27 O ATOM 257 CB SER A 31 3.981 -5.940 -9.473 1.00 0.35 C ATOM 258 OG SER A 31 4.739 -6.408 -8.370 1.00 1.15 O ATOM 0 H SER A 31 3.547 -4.087 -7.899 1.00 0.21 H new ATOM 0 HA SER A 31 5.401 -4.424 -9.996 1.00 0.27 H new ATOM 0 HB2 SER A 31 2.917 -6.021 -9.249 1.00 0.35 H new ATOM 0 HB3 SER A 31 4.172 -6.568 -10.343 1.00 0.35 H new ATOM 0 HG SER A 31 4.409 -5.993 -7.546 1.00 1.15 H new ATOM 264 N SER A 32 2.328 -3.615 -10.864 1.00 0.27 N ATOM 265 CA SER A 32 1.512 -3.125 -11.969 1.00 0.30 C ATOM 266 C SER A 32 2.096 -1.838 -12.555 1.00 0.28 C ATOM 267 O SER A 32 2.075 -1.632 -13.770 1.00 0.35 O ATOM 268 CB SER A 32 0.077 -2.884 -11.496 1.00 0.40 C ATOM 269 OG SER A 32 -0.469 -4.053 -10.905 1.00 0.99 O ATOM 0 H SER A 32 1.856 -3.612 -9.960 1.00 0.27 H new ATOM 0 HA SER A 32 1.508 -3.884 -12.752 1.00 0.30 H new ATOM 0 HB2 SER A 32 0.061 -2.067 -10.775 1.00 0.40 H new ATOM 0 HB3 SER A 32 -0.541 -2.577 -12.340 1.00 0.40 H new ATOM 0 HG SER A 32 -0.003 -4.243 -10.064 1.00 0.99 H new ATOM 275 N ILE A 33 2.633 -0.986 -11.685 1.00 0.24 N ATOM 276 CA ILE A 33 3.231 0.277 -12.107 1.00 0.26 C ATOM 277 C ILE A 33 4.405 0.040 -13.059 1.00 0.26 C ATOM 278 O ILE A 33 4.488 0.653 -14.129 1.00 0.31 O ATOM 279 CB ILE A 33 3.722 1.106 -10.900 1.00 0.30 C ATOM 280 CG1 ILE A 33 2.561 1.439 -9.960 1.00 0.30 C ATOM 281 CG2 ILE A 33 4.398 2.381 -11.375 1.00 0.43 C ATOM 282 CD1 ILE A 33 2.975 2.247 -8.748 1.00 0.34 C ATOM 0 H ILE A 33 2.666 -1.149 -10.679 1.00 0.24 H new ATOM 0 HA ILE A 33 2.451 0.835 -12.625 1.00 0.26 H new ATOM 0 HB ILE A 33 4.448 0.508 -10.348 1.00 0.30 H new ATOM 0 HG12 ILE A 33 1.803 1.993 -10.514 1.00 0.30 H new ATOM 0 HG13 ILE A 33 2.097 0.511 -9.626 1.00 0.30 H new ATOM 0 HG21 ILE A 33 4.739 2.955 -10.513 1.00 0.43 H new ATOM 0 HG22 ILE A 33 5.252 2.128 -12.003 1.00 0.43 H new ATOM 0 HG23 ILE A 33 3.689 2.976 -11.950 1.00 0.43 H new ATOM 0 HD11 ILE A 33 2.101 2.446 -8.127 1.00 0.34 H new ATOM 0 HD12 ILE A 33 3.710 1.686 -8.171 1.00 0.34 H new ATOM 0 HD13 ILE A 33 3.412 3.191 -9.072 1.00 0.34 H new ATOM 289 N VAL A 34 5.305 -0.858 -12.671 1.00 0.24 N ATOM 290 CA VAL A 34 6.471 -1.165 -13.491 1.00 0.31 C ATOM 291 C VAL A 34 6.092 -2.084 -14.650 1.00 0.37 C ATOM 292 O VAL A 34 6.769 -2.113 -15.677 1.00 0.47 O ATOM 293 CB VAL A 34 7.616 -1.804 -12.666 1.00 0.34 C ATOM 294 CG1 VAL A 34 8.103 -0.840 -11.596 1.00 0.35 C ATOM 295 CG2 VAL A 34 7.177 -3.119 -12.040 1.00 0.33 C ATOM 0 H VAL A 34 5.250 -1.383 -11.798 1.00 0.24 H new ATOM 0 HA VAL A 34 6.835 -0.217 -13.887 1.00 0.31 H new ATOM 0 HB VAL A 34 8.441 -2.016 -13.346 1.00 0.34 H new ATOM 0 HG11 VAL A 34 8.907 -1.305 -11.026 1.00 0.35 H new ATOM 0 HG12 VAL A 34 8.472 0.071 -12.068 1.00 0.35 H new ATOM 0 HG13 VAL A 34 7.279 -0.593 -10.926 1.00 0.35 H new ATOM 0 HG21 VAL A 34 8.002 -3.543 -11.468 1.00 0.33 H new ATOM 0 HG22 VAL A 34 6.329 -2.942 -11.378 1.00 0.33 H new ATOM 0 HG23 VAL A 34 6.884 -3.816 -12.825 1.00 0.33 H new ATOM 299 N GLU A 35 4.997 -2.815 -14.479 1.00 0.35 N ATOM 300 CA GLU A 35 4.478 -3.703 -15.515 1.00 0.46 C ATOM 301 C GLU A 35 4.079 -2.903 -16.748 1.00 0.50 C ATOM 302 O GLU A 35 4.436 -3.252 -17.874 1.00 0.61 O ATOM 303 CB GLU A 35 3.270 -4.473 -14.975 1.00 0.50 C ATOM 304 CG GLU A 35 2.683 -5.486 -15.938 1.00 0.70 C ATOM 305 CD GLU A 35 1.486 -6.201 -15.348 1.00 1.49 C ATOM 306 OE1 GLU A 35 1.684 -7.161 -14.574 1.00 2.19 O ATOM 307 OE2 GLU A 35 0.338 -5.797 -15.640 1.00 2.22 O ATOM 0 H GLU A 35 4.445 -2.810 -13.622 1.00 0.35 H new ATOM 0 HA GLU A 35 5.258 -4.410 -15.798 1.00 0.46 H new ATOM 0 HB2 GLU A 35 3.564 -4.989 -14.061 1.00 0.50 H new ATOM 0 HB3 GLU A 35 2.493 -3.759 -14.702 1.00 0.50 H new ATOM 0 HG2 GLU A 35 2.387 -4.982 -16.858 1.00 0.70 H new ATOM 0 HG3 GLU A 35 3.446 -6.217 -16.206 1.00 0.70 H new ATOM 314 N LYS A 36 3.359 -1.810 -16.524 1.00 0.47 N ATOM 315 CA LYS A 36 2.910 -0.956 -17.616 1.00 0.54 C ATOM 316 C LYS A 36 3.940 0.131 -17.914 1.00 0.50 C ATOM 317 O LYS A 36 3.669 1.069 -18.665 1.00 0.60 O ATOM 318 CB LYS A 36 1.561 -0.313 -17.276 1.00 0.67 C ATOM 319 CG LYS A 36 1.608 0.575 -16.041 1.00 0.71 C ATOM 320 CD LYS A 36 0.299 1.323 -15.819 1.00 0.97 C ATOM 321 CE LYS A 36 -0.062 2.186 -17.018 1.00 1.42 C ATOM 322 NZ LYS A 36 -1.168 3.130 -16.714 1.00 2.08 N ATOM 0 H LYS A 36 3.074 -1.495 -15.597 1.00 0.47 H new ATOM 0 HA LYS A 36 2.793 -1.579 -18.503 1.00 0.54 H new ATOM 0 HB2 LYS A 36 1.224 0.279 -18.127 1.00 0.67 H new ATOM 0 HB3 LYS A 36 0.821 -1.099 -17.121 1.00 0.67 H new ATOM 0 HG2 LYS A 36 1.829 -0.035 -15.165 1.00 0.71 H new ATOM 0 HG3 LYS A 36 2.422 1.293 -16.143 1.00 0.71 H new ATOM 0 HD2 LYS A 36 -0.502 0.608 -15.630 1.00 0.97 H new ATOM 0 HD3 LYS A 36 0.383 1.949 -14.931 1.00 0.97 H new ATOM 0 HE2 LYS A 36 0.816 2.748 -17.337 1.00 1.42 H new ATOM 0 HE3 LYS A 36 -0.351 1.546 -17.851 1.00 1.42 H new ATOM 0 HZ1 LYS A 36 -1.693 3.342 -17.586 1.00 2.08 H new ATOM 0 HZ2 LYS A 36 -1.811 2.700 -16.019 1.00 2.08 H new ATOM 0 HZ3 LYS A 36 -0.775 4.011 -16.324 1.00 2.08 H new ATOM 336 N LYS A 37 5.124 -0.031 -17.300 1.00 0.47 N ATOM 337 CA LYS A 37 6.249 0.913 -17.398 1.00 0.54 C ATOM 338 C LYS A 37 5.788 2.371 -17.364 1.00 0.59 C ATOM 339 O LYS A 37 6.177 3.182 -18.205 1.00 0.75 O ATOM 340 CB LYS A 37 7.120 0.628 -18.637 1.00 0.71 C ATOM 341 CG LYS A 37 6.370 0.607 -19.964 1.00 1.18 C ATOM 342 CD LYS A 37 7.312 0.406 -21.143 1.00 1.41 C ATOM 343 CE LYS A 37 8.006 -0.948 -21.100 1.00 1.98 C ATOM 344 NZ LYS A 37 7.048 -2.077 -21.235 1.00 2.60 N ATOM 0 H LYS A 37 5.329 -0.838 -16.710 1.00 0.47 H new ATOM 0 HA LYS A 37 6.868 0.756 -16.514 1.00 0.54 H new ATOM 0 HB2 LYS A 37 7.904 1.383 -18.692 1.00 0.71 H new ATOM 0 HB3 LYS A 37 7.614 -0.334 -18.501 1.00 0.71 H new ATOM 0 HG2 LYS A 37 5.629 -0.193 -19.950 1.00 1.18 H new ATOM 0 HG3 LYS A 37 5.826 1.543 -20.089 1.00 1.18 H new ATOM 0 HD2 LYS A 37 6.751 0.496 -22.073 1.00 1.41 H new ATOM 0 HD3 LYS A 37 8.062 1.197 -21.146 1.00 1.41 H new ATOM 0 HE2 LYS A 37 8.743 -1.002 -21.901 1.00 1.98 H new ATOM 0 HE3 LYS A 37 8.549 -1.046 -20.160 1.00 1.98 H new ATOM 0 HZ1 LYS A 37 7.574 -2.966 -21.353 1.00 2.60 H new ATOM 0 HZ2 LYS A 37 6.457 -2.135 -20.381 1.00 2.60 H new ATOM 0 HZ3 LYS A 37 6.442 -1.920 -22.065 1.00 2.60 H new ATOM 358 N GLU A 38 4.981 2.703 -16.364 1.00 0.54 N ATOM 359 CA GLU A 38 4.421 4.042 -16.243 1.00 0.68 C ATOM 360 C GLU A 38 5.350 4.916 -15.418 1.00 0.69 C ATOM 361 O GLU A 38 5.425 6.130 -15.608 1.00 1.03 O ATOM 362 CB GLU A 38 3.041 3.976 -15.584 1.00 0.79 C ATOM 363 CG GLU A 38 2.350 5.323 -15.466 1.00 1.36 C ATOM 364 CD GLU A 38 1.057 5.244 -14.685 1.00 1.41 C ATOM 365 OE1 GLU A 38 1.101 5.373 -13.444 1.00 1.86 O ATOM 366 OE2 GLU A 38 -0.009 5.052 -15.307 1.00 2.12 O ATOM 0 H GLU A 38 4.699 2.061 -15.623 1.00 0.54 H new ATOM 0 HA GLU A 38 4.315 4.475 -17.238 1.00 0.68 H new ATOM 0 HB2 GLU A 38 2.406 3.302 -16.160 1.00 0.79 H new ATOM 0 HB3 GLU A 38 3.145 3.544 -14.589 1.00 0.79 H new ATOM 0 HG2 GLU A 38 3.022 6.031 -14.980 1.00 1.36 H new ATOM 0 HG3 GLU A 38 2.145 5.711 -16.464 1.00 1.36 H new ATOM 373 N ILE A 39 6.067 4.276 -14.514 1.00 0.42 N ATOM 374 CA ILE A 39 6.968 4.975 -13.613 1.00 0.43 C ATOM 375 C ILE A 39 8.331 5.169 -14.279 1.00 0.48 C ATOM 376 O ILE A 39 8.652 4.496 -15.261 1.00 0.51 O ATOM 377 CB ILE A 39 7.115 4.198 -12.283 1.00 0.38 C ATOM 378 CG1 ILE A 39 7.736 5.081 -11.200 1.00 0.45 C ATOM 379 CG2 ILE A 39 7.940 2.932 -12.484 1.00 0.36 C ATOM 380 CD1 ILE A 39 7.672 4.476 -9.816 1.00 0.47 C ATOM 0 H ILE A 39 6.043 3.265 -14.383 1.00 0.42 H new ATOM 0 HA ILE A 39 6.548 5.956 -13.389 1.00 0.43 H new ATOM 0 HB ILE A 39 6.118 3.907 -11.952 1.00 0.38 H new ATOM 0 HG12 ILE A 39 8.778 5.275 -11.455 1.00 0.45 H new ATOM 0 HG13 ILE A 39 7.225 6.044 -11.191 1.00 0.45 H new ATOM 0 HG21 ILE A 39 8.030 2.402 -11.536 1.00 0.36 H new ATOM 0 HG22 ILE A 39 7.448 2.289 -13.214 1.00 0.36 H new ATOM 0 HG23 ILE A 39 8.933 3.198 -12.846 1.00 0.36 H new ATOM 0 HD11 ILE A 39 8.131 5.157 -9.100 1.00 0.47 H new ATOM 0 HD12 ILE A 39 6.631 4.307 -9.541 1.00 0.47 H new ATOM 0 HD13 ILE A 39 8.208 3.527 -9.809 1.00 0.47 H new ATOM 387 N SER A 40 9.117 6.106 -13.765 1.00 0.54 N ATOM 388 CA SER A 40 10.434 6.375 -14.315 1.00 0.62 C ATOM 389 C SER A 40 11.419 5.298 -13.876 1.00 0.53 C ATOM 390 O SER A 40 11.177 4.613 -12.879 1.00 0.48 O ATOM 391 CB SER A 40 10.919 7.758 -13.871 1.00 0.76 C ATOM 392 OG SER A 40 12.146 8.102 -14.492 1.00 1.82 O ATOM 0 H SER A 40 8.863 6.691 -12.969 1.00 0.54 H new ATOM 0 HA SER A 40 10.370 6.362 -15.403 1.00 0.62 H new ATOM 0 HB2 SER A 40 10.164 8.505 -14.116 1.00 0.76 H new ATOM 0 HB3 SER A 40 11.042 7.771 -12.788 1.00 0.76 H new ATOM 0 HG SER A 40 12.428 8.990 -14.189 1.00 1.82 H new ATOM 398 N GLU A 41 12.514 5.146 -14.612 1.00 0.59 N ATOM 399 CA GLU A 41 13.496 4.103 -14.322 1.00 0.60 C ATOM 400 C GLU A 41 13.963 4.172 -12.870 1.00 0.49 C ATOM 401 O GLU A 41 14.028 3.152 -12.180 1.00 0.46 O ATOM 402 CB GLU A 41 14.689 4.225 -15.270 1.00 0.78 C ATOM 403 CG GLU A 41 14.315 4.060 -16.736 1.00 1.07 C ATOM 404 CD GLU A 41 15.508 4.179 -17.659 1.00 1.43 C ATOM 405 OE1 GLU A 41 16.155 3.149 -17.938 1.00 2.19 O ATOM 406 OE2 GLU A 41 15.807 5.305 -18.108 1.00 1.99 O ATOM 0 H GLU A 41 12.746 5.731 -15.415 1.00 0.59 H new ATOM 0 HA GLU A 41 13.018 3.135 -14.475 1.00 0.60 H new ATOM 0 HB2 GLU A 41 15.157 5.199 -15.130 1.00 0.78 H new ATOM 0 HB3 GLU A 41 15.432 3.473 -15.005 1.00 0.78 H new ATOM 0 HG2 GLU A 41 13.845 3.087 -16.880 1.00 1.07 H new ATOM 0 HG3 GLU A 41 13.576 4.814 -17.005 1.00 1.07 H new ATOM 413 N ASP A 42 14.254 5.385 -12.406 1.00 0.52 N ATOM 414 CA ASP A 42 14.691 5.605 -11.029 1.00 0.52 C ATOM 415 C ASP A 42 13.677 5.041 -10.042 1.00 0.43 C ATOM 416 O ASP A 42 14.025 4.259 -9.158 1.00 0.47 O ATOM 417 CB ASP A 42 14.883 7.098 -10.752 1.00 0.62 C ATOM 418 CG ASP A 42 15.970 7.720 -11.600 1.00 1.50 C ATOM 419 OD1 ASP A 42 17.154 7.646 -11.208 1.00 2.21 O ATOM 420 OD2 ASP A 42 15.644 8.293 -12.662 1.00 2.30 O ATOM 0 H ASP A 42 14.195 6.235 -12.967 1.00 0.52 H new ATOM 0 HA ASP A 42 15.643 5.089 -10.900 1.00 0.52 H new ATOM 0 HB2 ASP A 42 13.944 7.620 -10.935 1.00 0.62 H new ATOM 0 HB3 ASP A 42 15.126 7.238 -9.699 1.00 0.62 H new ATOM 425 N GLY A 43 12.420 5.434 -10.216 1.00 0.39 N ATOM 426 CA GLY A 43 11.364 4.988 -9.327 1.00 0.37 C ATOM 427 C GLY A 43 11.130 3.492 -9.399 1.00 0.34 C ATOM 428 O GLY A 43 10.766 2.867 -8.402 1.00 0.35 O ATOM 0 H GLY A 43 12.112 6.058 -10.962 1.00 0.39 H new ATOM 0 HA2 GLY A 43 11.617 5.263 -8.303 1.00 0.37 H new ATOM 0 HA3 GLY A 43 10.440 5.508 -9.578 1.00 0.37 H new ATOM 432 N ALA A 44 11.339 2.918 -10.578 1.00 0.33 N ATOM 433 CA ALA A 44 11.177 1.484 -10.770 1.00 0.33 C ATOM 434 C ALA A 44 12.166 0.713 -9.905 1.00 0.32 C ATOM 435 O ALA A 44 11.802 -0.266 -9.253 1.00 0.31 O ATOM 436 CB ALA A 44 11.348 1.119 -12.238 1.00 0.38 C ATOM 0 H ALA A 44 11.622 3.426 -11.416 1.00 0.33 H new ATOM 0 HA ALA A 44 10.168 1.208 -10.464 1.00 0.33 H new ATOM 0 HB1 ALA A 44 11.224 0.043 -12.362 1.00 0.38 H new ATOM 0 HB2 ALA A 44 10.599 1.642 -12.833 1.00 0.38 H new ATOM 0 HB3 ALA A 44 12.344 1.410 -12.572 1.00 0.38 H new ATOM 442 N ASP A 45 13.414 1.173 -9.888 1.00 0.36 N ATOM 443 CA ASP A 45 14.444 0.555 -9.059 1.00 0.38 C ATOM 444 C ASP A 45 14.126 0.736 -7.584 1.00 0.36 C ATOM 445 O ASP A 45 14.345 -0.168 -6.775 1.00 0.37 O ATOM 446 CB ASP A 45 15.825 1.137 -9.364 1.00 0.48 C ATOM 447 CG ASP A 45 16.378 0.672 -10.693 1.00 1.11 C ATOM 448 OD1 ASP A 45 16.576 -0.551 -10.864 1.00 1.81 O ATOM 449 OD2 ASP A 45 16.632 1.522 -11.571 1.00 1.84 O ATOM 0 H ASP A 45 13.736 1.970 -10.438 1.00 0.36 H new ATOM 0 HA ASP A 45 14.458 -0.509 -9.293 1.00 0.38 H new ATOM 0 HB2 ASP A 45 15.764 2.225 -9.362 1.00 0.48 H new ATOM 0 HB3 ASP A 45 16.516 0.855 -8.570 1.00 0.48 H new ATOM 454 N SER A 46 13.599 1.906 -7.240 1.00 0.38 N ATOM 455 CA SER A 46 13.191 2.190 -5.873 1.00 0.41 C ATOM 456 C SER A 46 12.149 1.177 -5.409 1.00 0.36 C ATOM 457 O SER A 46 12.223 0.657 -4.298 1.00 0.39 O ATOM 458 CB SER A 46 12.619 3.605 -5.781 1.00 0.51 C ATOM 459 OG SER A 46 13.477 4.542 -6.404 1.00 0.98 O ATOM 0 H SER A 46 13.445 2.674 -7.893 1.00 0.38 H new ATOM 0 HA SER A 46 14.065 2.116 -5.226 1.00 0.41 H new ATOM 0 HB2 SER A 46 11.637 3.635 -6.254 1.00 0.51 H new ATOM 0 HB3 SER A 46 12.477 3.876 -4.735 1.00 0.51 H new ATOM 0 HG SER A 46 14.115 4.889 -5.746 1.00 0.98 H new ATOM 465 N LEU A 47 11.189 0.882 -6.281 1.00 0.32 N ATOM 466 CA LEU A 47 10.135 -0.074 -5.965 1.00 0.30 C ATOM 467 C LEU A 47 10.696 -1.479 -5.791 1.00 0.27 C ATOM 468 O LEU A 47 10.135 -2.288 -5.054 1.00 0.29 O ATOM 469 CB LEU A 47 9.058 -0.071 -7.052 1.00 0.30 C ATOM 470 CG LEU A 47 8.200 1.193 -7.114 1.00 0.35 C ATOM 471 CD1 LEU A 47 7.183 1.091 -8.241 1.00 0.39 C ATOM 472 CD2 LEU A 47 7.499 1.423 -5.784 1.00 0.41 C ATOM 0 H LEU A 47 11.120 1.292 -7.212 1.00 0.32 H new ATOM 0 HA LEU A 47 9.685 0.233 -5.021 1.00 0.30 H new ATOM 0 HB2 LEU A 47 9.540 -0.211 -8.019 1.00 0.30 H new ATOM 0 HB3 LEU A 47 8.403 -0.928 -6.895 1.00 0.30 H new ATOM 0 HG LEU A 47 8.851 2.044 -7.314 1.00 0.35 H new ATOM 0 HD11 LEU A 47 6.581 1.999 -8.271 1.00 0.39 H new ATOM 0 HD12 LEU A 47 7.704 0.969 -9.191 1.00 0.39 H new ATOM 0 HD13 LEU A 47 6.535 0.231 -8.070 1.00 0.39 H new ATOM 0 HD21 LEU A 47 6.892 2.326 -5.844 1.00 0.41 H new ATOM 0 HD22 LEU A 47 6.859 0.570 -5.558 1.00 0.41 H new ATOM 0 HD23 LEU A 47 8.243 1.537 -4.996 1.00 0.41 H new ATOM 484 N ASN A 48 11.806 -1.766 -6.459 1.00 0.26 N ATOM 485 CA ASN A 48 12.427 -3.082 -6.368 1.00 0.26 C ATOM 486 C ASN A 48 13.008 -3.310 -4.980 1.00 0.28 C ATOM 487 O ASN A 48 12.637 -4.266 -4.298 1.00 0.32 O ATOM 488 CB ASN A 48 13.525 -3.252 -7.421 1.00 0.28 C ATOM 489 CG ASN A 48 13.000 -3.242 -8.845 1.00 0.33 C ATOM 490 OD1 ASN A 48 11.775 -3.710 -9.038 1.00 0.48 O flip ATOM 491 ND2 ASN A 48 13.695 -2.820 -9.768 1.00 0.40 N flip ATOM 0 H ASN A 48 12.293 -1.108 -7.068 1.00 0.26 H new ATOM 0 HA ASN A 48 11.650 -3.823 -6.555 1.00 0.26 H new ATOM 0 HB2 ASN A 48 14.256 -2.452 -7.305 1.00 0.28 H new ATOM 0 HB3 ASN A 48 14.049 -4.191 -7.241 1.00 0.28 H new ATOM 0 HD21 ASN A 48 14.633 -2.468 -9.580 1.00 0.40 H new ATOM 0 HD22 ASN A 48 13.333 -2.822 -10.722 1.00 0.40 H new ATOM 498 N VAL A 49 13.906 -2.424 -4.552 1.00 0.27 N ATOM 499 CA VAL A 49 14.520 -2.552 -3.233 1.00 0.29 C ATOM 500 C VAL A 49 13.469 -2.396 -2.137 1.00 0.30 C ATOM 501 O VAL A 49 13.530 -3.064 -1.103 1.00 0.32 O ATOM 502 CB VAL A 49 15.676 -1.539 -3.018 1.00 0.32 C ATOM 503 CG1 VAL A 49 15.195 -0.104 -3.143 1.00 0.34 C ATOM 504 CG2 VAL A 49 16.345 -1.762 -1.667 1.00 0.36 C ATOM 0 H VAL A 49 14.221 -1.619 -5.093 1.00 0.27 H new ATOM 0 HA VAL A 49 14.952 -3.551 -3.178 1.00 0.29 H new ATOM 0 HB VAL A 49 16.411 -1.711 -3.804 1.00 0.32 H new ATOM 0 HG11 VAL A 49 16.033 0.576 -2.986 1.00 0.34 H new ATOM 0 HG12 VAL A 49 14.780 0.055 -4.138 1.00 0.34 H new ATOM 0 HG13 VAL A 49 14.426 0.089 -2.394 1.00 0.34 H new ATOM 0 HG21 VAL A 49 17.152 -1.041 -1.537 1.00 0.36 H new ATOM 0 HG22 VAL A 49 15.611 -1.632 -0.872 1.00 0.36 H new ATOM 0 HG23 VAL A 49 16.751 -2.773 -1.624 1.00 0.36 H new ATOM 508 N ALA A 50 12.484 -1.536 -2.381 1.00 0.30 N ATOM 509 CA ALA A 50 11.383 -1.361 -1.450 1.00 0.34 C ATOM 510 C ALA A 50 10.617 -2.663 -1.287 1.00 0.34 C ATOM 511 O ALA A 50 10.227 -3.029 -0.183 1.00 0.37 O ATOM 512 CB ALA A 50 10.446 -0.258 -1.920 1.00 0.37 C ATOM 0 H ALA A 50 12.429 -0.952 -3.215 1.00 0.30 H new ATOM 0 HA ALA A 50 11.798 -1.072 -0.484 1.00 0.34 H new ATOM 0 HB1 ALA A 50 9.630 -0.146 -1.207 1.00 0.37 H new ATOM 0 HB2 ALA A 50 10.996 0.680 -1.993 1.00 0.37 H new ATOM 0 HB3 ALA A 50 10.040 -0.517 -2.898 1.00 0.37 H new ATOM 518 N MET A 51 10.436 -3.372 -2.393 1.00 0.34 N ATOM 519 CA MET A 51 9.673 -4.610 -2.399 1.00 0.39 C ATOM 520 C MET A 51 10.393 -5.693 -1.614 1.00 0.31 C ATOM 521 O MET A 51 9.761 -6.479 -0.905 1.00 0.30 O ATOM 522 CB MET A 51 9.428 -5.066 -3.833 1.00 0.52 C ATOM 523 CG MET A 51 8.309 -6.080 -3.969 1.00 0.62 C ATOM 524 SD MET A 51 7.525 -6.004 -5.588 1.00 0.65 S ATOM 525 CE MET A 51 7.138 -4.256 -5.669 1.00 0.41 C ATOM 0 H MET A 51 10.811 -3.107 -3.304 1.00 0.34 H new ATOM 0 HA MET A 51 8.712 -4.426 -1.918 1.00 0.39 H new ATOM 0 HB2 MET A 51 9.194 -4.196 -4.446 1.00 0.52 H new ATOM 0 HB3 MET A 51 10.347 -5.497 -4.229 1.00 0.52 H new ATOM 0 HG2 MET A 51 8.705 -7.082 -3.805 1.00 0.62 H new ATOM 0 HG3 MET A 51 7.562 -5.902 -3.195 1.00 0.62 H new ATOM 0 HE1 MET A 51 6.321 -4.097 -6.372 1.00 0.41 H new ATOM 0 HE2 MET A 51 6.841 -3.903 -4.681 1.00 0.41 H new ATOM 0 HE3 MET A 51 8.017 -3.704 -6.003 1.00 0.41 H new ATOM 535 N ASP A 52 11.716 -5.725 -1.733 1.00 0.31 N ATOM 536 CA ASP A 52 12.528 -6.641 -0.940 1.00 0.32 C ATOM 537 C ASP A 52 12.322 -6.361 0.537 1.00 0.28 C ATOM 538 O ASP A 52 12.203 -7.276 1.349 1.00 0.30 O ATOM 539 CB ASP A 52 14.016 -6.506 -1.283 1.00 0.42 C ATOM 540 CG ASP A 52 14.358 -7.036 -2.659 1.00 1.16 C ATOM 541 OD1 ASP A 52 14.065 -8.218 -2.932 1.00 1.99 O ATOM 542 OD2 ASP A 52 14.945 -6.281 -3.465 1.00 1.84 O ATOM 0 H ASP A 52 12.247 -5.130 -2.368 1.00 0.31 H new ATOM 0 HA ASP A 52 12.214 -7.658 -1.173 1.00 0.32 H new ATOM 0 HB2 ASP A 52 14.303 -5.456 -1.223 1.00 0.42 H new ATOM 0 HB3 ASP A 52 14.605 -7.041 -0.537 1.00 0.42 H new ATOM 547 N CYS A 53 12.251 -5.080 0.865 1.00 0.27 N ATOM 548 CA CYS A 53 12.052 -4.644 2.235 1.00 0.27 C ATOM 549 C CYS A 53 10.640 -4.973 2.716 1.00 0.29 C ATOM 550 O CYS A 53 10.461 -5.436 3.839 1.00 0.36 O ATOM 551 CB CYS A 53 12.320 -3.147 2.337 1.00 0.36 C ATOM 552 SG CYS A 53 13.973 -2.672 1.787 1.00 1.05 S ATOM 0 H CYS A 53 12.329 -4.318 0.191 1.00 0.27 H new ATOM 0 HA CYS A 53 12.752 -5.178 2.878 1.00 0.27 H new ATOM 0 HB2 CYS A 53 11.580 -2.612 1.742 1.00 0.36 H new ATOM 0 HB3 CYS A 53 12.185 -2.831 3.372 1.00 0.36 H new ATOM 0 HG CYS A 53 14.006 -2.642 0.488 1.00 1.05 H new ATOM 558 N ILE A 54 9.644 -4.738 1.863 1.00 0.26 N ATOM 559 CA ILE A 54 8.260 -5.086 2.183 1.00 0.29 C ATOM 560 C ILE A 54 8.155 -6.581 2.473 1.00 0.30 C ATOM 561 O ILE A 54 7.566 -6.997 3.474 1.00 0.33 O ATOM 562 CB ILE A 54 7.290 -4.731 1.027 1.00 0.29 C ATOM 563 CG1 ILE A 54 7.377 -3.241 0.679 1.00 0.31 C ATOM 564 CG2 ILE A 54 5.857 -5.098 1.402 1.00 0.33 C ATOM 565 CD1 ILE A 54 6.604 -2.856 -0.569 1.00 0.34 C ATOM 0 H ILE A 54 9.769 -4.309 0.946 1.00 0.26 H new ATOM 0 HA ILE A 54 7.975 -4.506 3.060 1.00 0.29 H new ATOM 0 HB ILE A 54 7.584 -5.308 0.150 1.00 0.29 H new ATOM 0 HG12 ILE A 54 7.002 -2.659 1.521 1.00 0.31 H new ATOM 0 HG13 ILE A 54 8.424 -2.970 0.544 1.00 0.31 H new ATOM 0 HG21 ILE A 54 5.189 -4.842 0.580 1.00 0.33 H new ATOM 0 HG22 ILE A 54 5.795 -6.168 1.600 1.00 0.33 H new ATOM 0 HG23 ILE A 54 5.562 -4.546 2.294 1.00 0.33 H new ATOM 0 HD11 ILE A 54 6.714 -1.787 -0.750 1.00 0.34 H new ATOM 0 HD12 ILE A 54 6.993 -3.410 -1.423 1.00 0.34 H new ATOM 0 HD13 ILE A 54 5.549 -3.094 -0.432 1.00 0.34 H new ATOM 572 N SER A 55 8.756 -7.376 1.597 1.00 0.30 N ATOM 573 CA SER A 55 8.747 -8.825 1.733 1.00 0.36 C ATOM 574 C SER A 55 9.452 -9.257 3.020 1.00 0.38 C ATOM 575 O SER A 55 8.965 -10.128 3.743 1.00 0.41 O ATOM 576 CB SER A 55 9.427 -9.456 0.518 1.00 0.40 C ATOM 577 OG SER A 55 8.835 -9.001 -0.690 1.00 0.80 O ATOM 0 H SER A 55 9.260 -7.037 0.778 1.00 0.30 H new ATOM 0 HA SER A 55 7.713 -9.166 1.786 1.00 0.36 H new ATOM 0 HB2 SER A 55 10.489 -9.209 0.522 1.00 0.40 H new ATOM 0 HB3 SER A 55 9.352 -10.542 0.578 1.00 0.40 H new ATOM 0 HG SER A 55 9.209 -8.127 -0.929 1.00 0.80 H new ATOM 583 N GLU A 56 10.588 -8.631 3.302 1.00 0.39 N ATOM 584 CA GLU A 56 11.359 -8.920 4.506 1.00 0.48 C ATOM 585 C GLU A 56 10.586 -8.515 5.763 1.00 0.43 C ATOM 586 O GLU A 56 10.608 -9.218 6.774 1.00 0.46 O ATOM 587 CB GLU A 56 12.700 -8.180 4.447 1.00 0.60 C ATOM 588 CG GLU A 56 13.553 -8.334 5.695 1.00 0.83 C ATOM 589 CD GLU A 56 14.880 -7.611 5.588 1.00 1.81 C ATOM 590 OE1 GLU A 56 14.884 -6.363 5.515 1.00 2.66 O ATOM 591 OE2 GLU A 56 15.928 -8.286 5.597 1.00 2.38 O ATOM 0 H GLU A 56 11.000 -7.912 2.706 1.00 0.39 H new ATOM 0 HA GLU A 56 11.539 -9.994 4.554 1.00 0.48 H new ATOM 0 HB2 GLU A 56 13.265 -8.543 3.588 1.00 0.60 H new ATOM 0 HB3 GLU A 56 12.510 -7.120 4.279 1.00 0.60 H new ATOM 0 HG2 GLU A 56 13.004 -7.952 6.555 1.00 0.83 H new ATOM 0 HG3 GLU A 56 13.734 -9.393 5.878 1.00 0.83 H new ATOM 598 N ALA A 57 9.897 -7.384 5.682 1.00 0.39 N ATOM 599 CA ALA A 57 9.160 -6.842 6.816 1.00 0.39 C ATOM 600 C ALA A 57 7.975 -7.724 7.196 1.00 0.33 C ATOM 601 O ALA A 57 7.816 -8.096 8.359 1.00 0.39 O ATOM 602 CB ALA A 57 8.685 -5.430 6.504 1.00 0.42 C ATOM 0 H ALA A 57 9.833 -6.820 4.835 1.00 0.39 H new ATOM 0 HA ALA A 57 9.838 -6.816 7.669 1.00 0.39 H new ATOM 0 HB1 ALA A 57 8.135 -5.034 7.358 1.00 0.42 H new ATOM 0 HB2 ALA A 57 9.546 -4.793 6.300 1.00 0.42 H new ATOM 0 HB3 ALA A 57 8.033 -5.450 5.631 1.00 0.42 H new ATOM 608 N PHE A 58 7.149 -8.060 6.212 1.00 0.29 N ATOM 609 CA PHE A 58 5.927 -8.816 6.471 1.00 0.28 C ATOM 610 C PHE A 58 6.186 -10.319 6.534 1.00 0.30 C ATOM 611 O PHE A 58 5.334 -11.086 6.982 1.00 0.38 O ATOM 612 CB PHE A 58 4.871 -8.511 5.408 1.00 0.26 C ATOM 613 CG PHE A 58 4.269 -7.139 5.522 1.00 0.25 C ATOM 614 CD1 PHE A 58 4.939 -6.024 5.044 1.00 1.24 C ATOM 615 CD2 PHE A 58 3.025 -6.969 6.104 1.00 1.18 C ATOM 616 CE1 PHE A 58 4.378 -4.766 5.147 1.00 1.22 C ATOM 617 CE2 PHE A 58 2.458 -5.714 6.210 1.00 1.22 C ATOM 618 CZ PHE A 58 3.136 -4.610 5.731 1.00 0.28 C ATOM 0 H PHE A 58 7.301 -7.823 5.232 1.00 0.29 H new ATOM 0 HA PHE A 58 5.556 -8.502 7.447 1.00 0.28 H new ATOM 0 HB2 PHE A 58 5.322 -8.618 4.421 1.00 0.26 H new ATOM 0 HB3 PHE A 58 4.075 -9.253 5.477 1.00 0.26 H new ATOM 0 HD1 PHE A 58 5.910 -6.140 4.586 1.00 1.24 H new ATOM 0 HD2 PHE A 58 2.491 -7.829 6.480 1.00 1.18 H new ATOM 0 HE1 PHE A 58 4.910 -3.905 4.771 1.00 1.22 H new ATOM 0 HE2 PHE A 58 1.486 -5.596 6.667 1.00 1.22 H new ATOM 0 HZ PHE A 58 2.696 -3.627 5.813 1.00 0.28 H new ATOM 628 N GLY A 59 7.366 -10.730 6.081 1.00 0.34 N ATOM 629 CA GLY A 59 7.752 -12.127 6.161 1.00 0.39 C ATOM 630 C GLY A 59 7.120 -12.976 5.077 1.00 0.38 C ATOM 631 O GLY A 59 6.503 -14.000 5.365 1.00 0.43 O ATOM 0 H GLY A 59 8.064 -10.118 5.658 1.00 0.34 H new ATOM 0 HA2 GLY A 59 8.837 -12.204 6.089 1.00 0.39 H new ATOM 0 HA3 GLY A 59 7.468 -12.522 7.137 1.00 0.39 H new ATOM 635 N PHE A 60 7.270 -12.550 3.831 1.00 0.35 N ATOM 636 CA PHE A 60 6.728 -13.293 2.700 1.00 0.39 C ATOM 637 C PHE A 60 7.595 -13.056 1.471 1.00 0.40 C ATOM 638 O PHE A 60 8.441 -12.164 1.468 1.00 0.42 O ATOM 639 CB PHE A 60 5.270 -12.883 2.424 1.00 0.40 C ATOM 640 CG PHE A 60 5.104 -11.543 1.753 1.00 0.31 C ATOM 641 CD1 PHE A 60 5.479 -10.370 2.390 1.00 1.19 C ATOM 642 CD2 PHE A 60 4.565 -11.461 0.477 1.00 1.22 C ATOM 643 CE1 PHE A 60 5.321 -9.146 1.768 1.00 1.22 C ATOM 644 CE2 PHE A 60 4.406 -10.240 -0.148 1.00 1.20 C ATOM 645 CZ PHE A 60 4.785 -9.080 0.498 1.00 0.33 C ATOM 0 H PHE A 60 7.762 -11.694 3.577 1.00 0.35 H new ATOM 0 HA PHE A 60 6.735 -14.356 2.940 1.00 0.39 H new ATOM 0 HB2 PHE A 60 4.805 -13.646 1.799 1.00 0.40 H new ATOM 0 HB3 PHE A 60 4.726 -12.870 3.369 1.00 0.40 H new ATOM 0 HD1 PHE A 60 5.899 -10.413 3.384 1.00 1.19 H new ATOM 0 HD2 PHE A 60 4.266 -12.364 -0.034 1.00 1.22 H new ATOM 0 HE1 PHE A 60 5.617 -8.240 2.276 1.00 1.22 H new ATOM 0 HE2 PHE A 60 3.985 -10.192 -1.142 1.00 1.20 H new ATOM 0 HZ PHE A 60 4.662 -8.124 0.011 1.00 0.33 H new ATOM 655 N GLU A 61 7.397 -13.867 0.441 1.00 0.48 N ATOM 656 CA GLU A 61 8.153 -13.729 -0.795 1.00 0.55 C ATOM 657 C GLU A 61 7.324 -13.000 -1.844 1.00 0.50 C ATOM 658 O GLU A 61 6.098 -12.993 -1.757 1.00 0.48 O ATOM 659 CB GLU A 61 8.569 -15.102 -1.326 1.00 0.70 C ATOM 660 CG GLU A 61 9.404 -15.912 -0.349 1.00 0.81 C ATOM 661 CD GLU A 61 10.648 -15.179 0.101 1.00 1.48 C ATOM 662 OE1 GLU A 61 11.568 -14.994 -0.724 1.00 2.05 O ATOM 663 OE2 GLU A 61 10.712 -14.783 1.281 1.00 2.33 O ATOM 0 H GLU A 61 6.718 -14.628 0.437 1.00 0.48 H new ATOM 0 HA GLU A 61 9.050 -13.147 -0.583 1.00 0.55 H new ATOM 0 HB2 GLU A 61 7.674 -15.669 -1.581 1.00 0.70 H new ATOM 0 HB3 GLU A 61 9.134 -14.968 -2.248 1.00 0.70 H new ATOM 0 HG2 GLU A 61 8.798 -16.160 0.522 1.00 0.81 H new ATOM 0 HG3 GLU A 61 9.691 -16.854 -0.816 1.00 0.81 H new ATOM 670 N ARG A 62 7.977 -12.398 -2.830 1.00 0.54 N ATOM 671 CA ARG A 62 7.269 -11.618 -3.844 1.00 0.53 C ATOM 672 C ARG A 62 6.230 -12.462 -4.567 1.00 0.53 C ATOM 673 O ARG A 62 5.052 -12.139 -4.533 1.00 0.64 O ATOM 674 CB ARG A 62 8.250 -11.008 -4.848 1.00 0.63 C ATOM 675 CG ARG A 62 7.569 -10.165 -5.915 1.00 1.40 C ATOM 676 CD ARG A 62 8.579 -9.490 -6.827 1.00 1.46 C ATOM 677 NE ARG A 62 7.926 -8.745 -7.901 1.00 2.25 N ATOM 678 CZ ARG A 62 8.542 -7.847 -8.666 1.00 2.60 C ATOM 679 NH1 ARG A 62 9.819 -7.550 -8.455 1.00 2.13 N ATOM 680 NH2 ARG A 62 7.874 -7.235 -9.637 1.00 3.67 N ATOM 0 H ARG A 62 8.989 -12.433 -2.951 1.00 0.54 H new ATOM 0 HA ARG A 62 6.750 -10.809 -3.330 1.00 0.53 H new ATOM 0 HB2 ARG A 62 8.971 -10.391 -4.312 1.00 0.63 H new ATOM 0 HB3 ARG A 62 8.811 -11.809 -5.330 1.00 0.63 H new ATOM 0 HG2 ARG A 62 6.907 -10.795 -6.509 1.00 1.40 H new ATOM 0 HG3 ARG A 62 6.946 -9.408 -5.438 1.00 1.40 H new ATOM 0 HD2 ARG A 62 9.202 -8.814 -6.242 1.00 1.46 H new ATOM 0 HD3 ARG A 62 9.241 -10.242 -7.256 1.00 1.46 H new ATOM 0 HE ARG A 62 6.937 -8.924 -8.075 1.00 2.25 H new ATOM 0 HH11 ARG A 62 10.332 -8.011 -7.704 1.00 2.13 H new ATOM 0 HH12 ARG A 62 10.286 -6.861 -9.044 1.00 2.13 H new ATOM 0 HH21 ARG A 62 6.890 -7.453 -9.795 1.00 3.67 H new ATOM 0 HH22 ARG A 62 8.345 -6.546 -10.224 1.00 3.67 H new ATOM 694 N GLU A 63 6.654 -13.565 -5.172 1.00 0.58 N ATOM 695 CA GLU A 63 5.755 -14.402 -5.968 1.00 0.64 C ATOM 696 C GLU A 63 4.616 -14.972 -5.112 1.00 0.63 C ATOM 697 O GLU A 63 3.598 -15.428 -5.636 1.00 0.75 O ATOM 698 CB GLU A 63 6.549 -15.530 -6.634 1.00 0.74 C ATOM 699 CG GLU A 63 5.741 -16.365 -7.617 1.00 1.70 C ATOM 700 CD GLU A 63 5.087 -15.530 -8.700 1.00 2.53 C ATOM 701 OE1 GLU A 63 5.812 -14.843 -9.451 1.00 3.20 O ATOM 702 OE2 GLU A 63 3.844 -15.556 -8.806 1.00 3.12 O ATOM 0 H GLU A 63 7.615 -13.904 -5.128 1.00 0.58 H new ATOM 0 HA GLU A 63 5.303 -13.781 -6.741 1.00 0.64 H new ATOM 0 HB2 GLU A 63 7.403 -15.099 -7.157 1.00 0.74 H new ATOM 0 HB3 GLU A 63 6.947 -16.185 -5.859 1.00 0.74 H new ATOM 0 HG2 GLU A 63 6.394 -17.105 -8.080 1.00 1.70 H new ATOM 0 HG3 GLU A 63 4.972 -16.914 -7.074 1.00 1.70 H new ATOM 709 N ALA A 64 4.775 -14.914 -3.794 1.00 0.55 N ATOM 710 CA ALA A 64 3.749 -15.395 -2.880 1.00 0.60 C ATOM 711 C ALA A 64 2.502 -14.515 -2.940 1.00 0.54 C ATOM 712 O ALA A 64 1.425 -14.936 -2.524 1.00 0.57 O ATOM 713 CB ALA A 64 4.286 -15.458 -1.457 1.00 0.67 C ATOM 0 H ALA A 64 5.605 -14.538 -3.336 1.00 0.55 H new ATOM 0 HA ALA A 64 3.469 -16.401 -3.191 1.00 0.60 H new ATOM 0 HB1 ALA A 64 3.504 -15.820 -0.789 1.00 0.67 H new ATOM 0 HB2 ALA A 64 5.138 -16.137 -1.419 1.00 0.67 H new ATOM 0 HB3 ALA A 64 4.600 -14.463 -1.142 1.00 0.67 H new ATOM 719 N VAL A 65 2.645 -13.300 -3.475 1.00 0.51 N ATOM 720 CA VAL A 65 1.506 -12.397 -3.631 1.00 0.47 C ATOM 721 C VAL A 65 0.426 -13.040 -4.502 1.00 0.53 C ATOM 722 O VAL A 65 -0.770 -12.851 -4.269 1.00 0.54 O ATOM 723 CB VAL A 65 1.923 -11.025 -4.231 1.00 0.47 C ATOM 724 CG1 VAL A 65 2.608 -11.178 -5.576 1.00 0.51 C ATOM 725 CG2 VAL A 65 0.727 -10.102 -4.367 1.00 0.50 C ATOM 0 H VAL A 65 3.533 -12.922 -3.805 1.00 0.51 H new ATOM 0 HA VAL A 65 1.105 -12.214 -2.634 1.00 0.47 H new ATOM 0 HB VAL A 65 2.636 -10.583 -3.535 1.00 0.47 H new ATOM 0 HG11 VAL A 65 2.882 -10.195 -5.959 1.00 0.51 H new ATOM 0 HG12 VAL A 65 3.505 -11.786 -5.460 1.00 0.51 H new ATOM 0 HG13 VAL A 65 1.929 -11.664 -6.277 1.00 0.51 H new ATOM 0 HG21 VAL A 65 1.048 -9.150 -4.789 1.00 0.50 H new ATOM 0 HG22 VAL A 65 -0.013 -10.559 -5.024 1.00 0.50 H new ATOM 0 HG23 VAL A 65 0.285 -9.933 -3.385 1.00 0.50 H new ATOM 729 N SER A 66 0.856 -13.835 -5.475 1.00 0.63 N ATOM 730 CA SER A 66 -0.060 -14.529 -6.365 1.00 0.75 C ATOM 731 C SER A 66 -0.898 -15.547 -5.592 1.00 0.76 C ATOM 732 O SER A 66 -2.044 -15.831 -5.945 1.00 0.84 O ATOM 733 CB SER A 66 0.733 -15.221 -7.472 1.00 0.89 C ATOM 734 OG SER A 66 1.626 -14.307 -8.090 1.00 1.63 O ATOM 0 H SER A 66 1.842 -14.014 -5.666 1.00 0.63 H new ATOM 0 HA SER A 66 -0.740 -13.803 -6.810 1.00 0.75 H new ATOM 0 HB2 SER A 66 1.292 -16.060 -7.057 1.00 0.89 H new ATOM 0 HB3 SER A 66 0.049 -15.630 -8.216 1.00 0.89 H new ATOM 0 HG SER A 66 2.514 -14.716 -8.163 1.00 1.63 H new ATOM 740 N GLY A 67 -0.317 -16.082 -4.525 1.00 0.73 N ATOM 741 CA GLY A 67 -1.022 -17.027 -3.687 1.00 0.75 C ATOM 742 C GLY A 67 -1.886 -16.330 -2.658 1.00 0.70 C ATOM 743 O GLY A 67 -3.032 -16.721 -2.433 1.00 0.76 O ATOM 0 H GLY A 67 0.636 -15.875 -4.226 1.00 0.73 H new ATOM 0 HA2 GLY A 67 -1.645 -17.670 -4.309 1.00 0.75 H new ATOM 0 HA3 GLY A 67 -0.303 -17.672 -3.181 1.00 0.75 H new ATOM 747 N ILE A 68 -1.338 -15.284 -2.046 1.00 0.63 N ATOM 748 CA ILE A 68 -2.062 -14.502 -1.047 1.00 0.59 C ATOM 749 C ILE A 68 -3.328 -13.896 -1.649 1.00 0.63 C ATOM 750 O ILE A 68 -4.417 -14.010 -1.083 1.00 0.71 O ATOM 751 CB ILE A 68 -1.181 -13.372 -0.466 1.00 0.51 C ATOM 752 CG1 ILE A 68 0.076 -13.958 0.183 1.00 0.50 C ATOM 753 CG2 ILE A 68 -1.967 -12.548 0.547 1.00 0.50 C ATOM 754 CD1 ILE A 68 1.062 -12.909 0.654 1.00 0.45 C ATOM 0 H ILE A 68 -0.389 -14.956 -2.226 1.00 0.63 H new ATOM 0 HA ILE A 68 -2.334 -15.183 -0.240 1.00 0.59 H new ATOM 0 HB ILE A 68 -0.878 -12.716 -1.282 1.00 0.51 H new ATOM 0 HG12 ILE A 68 -0.218 -14.575 1.032 1.00 0.50 H new ATOM 0 HG13 ILE A 68 0.571 -14.615 -0.532 1.00 0.50 H new ATOM 0 HG21 ILE A 68 -1.331 -11.758 0.945 1.00 0.50 H new ATOM 0 HG22 ILE A 68 -2.835 -12.104 0.060 1.00 0.50 H new ATOM 0 HG23 ILE A 68 -2.298 -13.192 1.362 1.00 0.50 H new ATOM 0 HD11 ILE A 68 1.927 -13.398 1.103 1.00 0.45 H new ATOM 0 HD12 ILE A 68 1.386 -12.307 -0.195 1.00 0.45 H new ATOM 0 HD13 ILE A 68 0.584 -12.267 1.394 1.00 0.45 H new ATOM 761 N LEU A 69 -3.186 -13.285 -2.822 1.00 0.62 N ATOM 762 CA LEU A 69 -4.323 -12.683 -3.511 1.00 0.67 C ATOM 763 C LEU A 69 -5.175 -13.747 -4.190 1.00 0.85 C ATOM 764 O LEU A 69 -6.125 -13.435 -4.901 1.00 1.14 O ATOM 765 CB LEU A 69 -3.855 -11.654 -4.543 1.00 0.62 C ATOM 766 CG LEU A 69 -3.145 -10.431 -3.966 1.00 0.47 C ATOM 767 CD1 LEU A 69 -2.789 -9.451 -5.072 1.00 0.50 C ATOM 768 CD2 LEU A 69 -4.011 -9.757 -2.911 1.00 0.45 C ATOM 0 H LEU A 69 -2.297 -13.194 -3.314 1.00 0.62 H new ATOM 0 HA LEU A 69 -4.930 -12.175 -2.762 1.00 0.67 H new ATOM 0 HB2 LEU A 69 -3.182 -12.147 -5.245 1.00 0.62 H new ATOM 0 HB3 LEU A 69 -4.720 -11.316 -5.114 1.00 0.62 H new ATOM 0 HG LEU A 69 -2.222 -10.762 -3.490 1.00 0.47 H new ATOM 0 HD11 LEU A 69 -2.284 -8.586 -4.643 1.00 0.50 H new ATOM 0 HD12 LEU A 69 -2.129 -9.937 -5.790 1.00 0.50 H new ATOM 0 HD13 LEU A 69 -3.699 -9.126 -5.577 1.00 0.50 H new ATOM 0 HD21 LEU A 69 -3.488 -8.888 -2.512 1.00 0.45 H new ATOM 0 HD22 LEU A 69 -4.952 -9.439 -3.361 1.00 0.45 H new ATOM 0 HD23 LEU A 69 -4.214 -10.460 -2.104 1.00 0.45 H new ATOM 780 N GLY A 70 -4.809 -15.002 -3.990 1.00 0.81 N ATOM 781 CA GLY A 70 -5.629 -16.095 -4.455 1.00 0.94 C ATOM 782 C GLY A 70 -6.490 -16.636 -3.337 1.00 0.99 C ATOM 783 O GLY A 70 -7.591 -17.134 -3.571 1.00 1.25 O ATOM 0 H GLY A 70 -3.953 -15.283 -3.511 1.00 0.81 H new ATOM 0 HA2 GLY A 70 -6.262 -15.757 -5.276 1.00 0.94 H new ATOM 0 HA3 GLY A 70 -4.995 -16.889 -4.848 1.00 0.94 H new ATOM 787 N LYS A 71 -5.983 -16.524 -2.112 1.00 0.87 N ATOM 788 CA LYS A 71 -6.708 -16.972 -0.931 1.00 0.98 C ATOM 789 C LYS A 71 -7.649 -15.879 -0.444 1.00 0.99 C ATOM 790 O LYS A 71 -8.804 -16.144 -0.098 1.00 1.26 O ATOM 791 CB LYS A 71 -5.731 -17.348 0.188 1.00 1.11 C ATOM 792 CG LYS A 71 -4.724 -18.416 -0.204 1.00 1.69 C ATOM 793 CD LYS A 71 -5.406 -19.709 -0.619 1.00 2.11 C ATOM 794 CE LYS A 71 -4.391 -20.776 -0.997 1.00 2.60 C ATOM 795 NZ LYS A 71 -3.538 -20.355 -2.140 1.00 3.16 N ATOM 0 H LYS A 71 -5.066 -16.124 -1.913 1.00 0.87 H new ATOM 0 HA LYS A 71 -7.292 -17.852 -1.201 1.00 0.98 H new ATOM 0 HB2 LYS A 71 -5.193 -16.454 0.502 1.00 1.11 H new ATOM 0 HB3 LYS A 71 -6.299 -17.698 1.050 1.00 1.11 H new ATOM 0 HG2 LYS A 71 -4.107 -18.050 -1.025 1.00 1.69 H new ATOM 0 HG3 LYS A 71 -4.055 -18.611 0.635 1.00 1.69 H new ATOM 0 HD2 LYS A 71 -6.030 -20.071 0.198 1.00 2.11 H new ATOM 0 HD3 LYS A 71 -6.067 -19.518 -1.464 1.00 2.11 H new ATOM 0 HE2 LYS A 71 -3.760 -20.997 -0.136 1.00 2.60 H new ATOM 0 HE3 LYS A 71 -4.913 -21.698 -1.255 1.00 2.60 H new ATOM 0 HZ1 LYS A 71 -3.005 -21.174 -2.496 1.00 3.16 H new ATOM 0 HZ2 LYS A 71 -4.138 -19.976 -2.900 1.00 3.16 H new ATOM 0 HZ3 LYS A 71 -2.873 -19.620 -1.825 1.00 3.16 H new ATOM 809 N SER A 72 -7.150 -14.652 -0.423 1.00 0.92 N ATOM 810 CA SER A 72 -7.939 -13.511 0.007 1.00 1.08 C ATOM 811 C SER A 72 -8.858 -13.067 -1.125 1.00 1.04 C ATOM 812 O SER A 72 -8.523 -13.226 -2.298 1.00 1.21 O ATOM 813 CB SER A 72 -7.016 -12.366 0.425 1.00 1.30 C ATOM 814 OG SER A 72 -7.716 -11.394 1.176 1.00 2.02 O ATOM 0 H SER A 72 -6.196 -14.422 -0.701 1.00 0.92 H new ATOM 0 HA SER A 72 -8.548 -13.796 0.864 1.00 1.08 H new ATOM 0 HB2 SER A 72 -6.189 -12.759 1.016 1.00 1.30 H new ATOM 0 HB3 SER A 72 -6.583 -11.902 -0.461 1.00 1.30 H new ATOM 0 HG SER A 72 -7.417 -11.423 2.109 1.00 2.02 H new ATOM 820 N GLU A 73 -10.007 -12.498 -0.782 1.00 1.13 N ATOM 821 CA GLU A 73 -10.991 -12.137 -1.792 1.00 1.31 C ATOM 822 C GLU A 73 -10.866 -10.675 -2.216 1.00 1.26 C ATOM 823 O GLU A 73 -11.833 -9.913 -2.218 1.00 1.87 O ATOM 824 CB GLU A 73 -12.421 -12.499 -1.353 1.00 1.67 C ATOM 825 CG GLU A 73 -12.703 -12.373 0.140 1.00 1.87 C ATOM 826 CD GLU A 73 -13.109 -10.979 0.570 1.00 2.12 C ATOM 827 OE1 GLU A 73 -14.132 -10.475 0.071 1.00 2.46 O ATOM 828 OE2 GLU A 73 -12.459 -10.417 1.473 1.00 2.64 O ATOM 0 H GLU A 73 -10.278 -12.279 0.177 1.00 1.13 H new ATOM 0 HA GLU A 73 -10.775 -12.735 -2.677 1.00 1.31 H new ATOM 0 HB2 GLU A 73 -13.120 -11.860 -1.892 1.00 1.67 H new ATOM 0 HB3 GLU A 73 -12.627 -13.525 -1.658 1.00 1.67 H new ATOM 0 HG2 GLU A 73 -13.495 -13.072 0.411 1.00 1.87 H new ATOM 0 HG3 GLU A 73 -11.813 -12.669 0.695 1.00 1.87 H new ATOM 835 N PHE A 74 -9.644 -10.304 -2.579 1.00 1.04 N ATOM 836 CA PHE A 74 -9.380 -9.047 -3.267 1.00 1.02 C ATOM 837 C PHE A 74 -9.209 -9.342 -4.754 1.00 1.08 C ATOM 838 O PHE A 74 -8.713 -8.517 -5.524 1.00 1.45 O ATOM 839 CB PHE A 74 -8.109 -8.372 -2.729 1.00 0.94 C ATOM 840 CG PHE A 74 -8.190 -7.917 -1.296 1.00 0.96 C ATOM 841 CD1 PHE A 74 -9.003 -6.853 -0.940 1.00 1.61 C ATOM 842 CD2 PHE A 74 -7.439 -8.537 -0.309 1.00 1.18 C ATOM 843 CE1 PHE A 74 -9.070 -6.421 0.371 1.00 1.70 C ATOM 844 CE2 PHE A 74 -7.504 -8.109 1.004 1.00 1.25 C ATOM 845 CZ PHE A 74 -8.321 -7.051 1.344 1.00 1.19 C ATOM 0 H PHE A 74 -8.810 -10.865 -2.405 1.00 1.04 H new ATOM 0 HA PHE A 74 -10.215 -8.367 -3.099 1.00 1.02 H new ATOM 0 HB2 PHE A 74 -7.276 -9.068 -2.827 1.00 0.94 H new ATOM 0 HB3 PHE A 74 -7.880 -7.510 -3.356 1.00 0.94 H new ATOM 0 HD1 PHE A 74 -9.592 -6.355 -1.696 1.00 1.61 H new ATOM 0 HD2 PHE A 74 -6.795 -9.364 -0.569 1.00 1.18 H new ATOM 0 HE1 PHE A 74 -9.708 -5.591 0.634 1.00 1.70 H new ATOM 0 HE2 PHE A 74 -6.915 -8.603 1.763 1.00 1.25 H new ATOM 0 HZ PHE A 74 -8.374 -6.716 2.369 1.00 1.19 H new ATOM 855 N LYS A 75 -9.633 -10.541 -5.138 1.00 1.12 N ATOM 856 CA LYS A 75 -9.419 -11.061 -6.483 1.00 1.23 C ATOM 857 C LYS A 75 -10.231 -10.288 -7.515 1.00 1.54 C ATOM 858 O LYS A 75 -11.380 -9.909 -7.268 1.00 2.04 O ATOM 859 CB LYS A 75 -9.793 -12.546 -6.536 1.00 1.43 C ATOM 860 CG LYS A 75 -9.119 -13.386 -5.464 1.00 1.47 C ATOM 861 CD LYS A 75 -9.521 -14.854 -5.543 1.00 1.66 C ATOM 862 CE LYS A 75 -9.019 -15.511 -6.820 1.00 2.28 C ATOM 863 NZ LYS A 75 -9.353 -16.958 -6.864 1.00 2.85 N ATOM 0 H LYS A 75 -10.136 -11.181 -4.524 1.00 1.12 H new ATOM 0 HA LYS A 75 -8.363 -10.941 -6.724 1.00 1.23 H new ATOM 0 HB2 LYS A 75 -10.874 -12.643 -6.434 1.00 1.43 H new ATOM 0 HB3 LYS A 75 -9.528 -12.943 -7.516 1.00 1.43 H new ATOM 0 HG2 LYS A 75 -8.037 -13.302 -5.566 1.00 1.47 H new ATOM 0 HG3 LYS A 75 -9.378 -12.993 -4.481 1.00 1.47 H new ATOM 0 HD2 LYS A 75 -9.122 -15.387 -4.680 1.00 1.66 H new ATOM 0 HD3 LYS A 75 -10.607 -14.936 -5.495 1.00 1.66 H new ATOM 0 HE2 LYS A 75 -9.458 -15.010 -7.683 1.00 2.28 H new ATOM 0 HE3 LYS A 75 -7.939 -15.385 -6.893 1.00 2.28 H new ATOM 0 HZ1 LYS A 75 -8.995 -17.370 -7.749 1.00 2.85 H new ATOM 0 HZ2 LYS A 75 -8.914 -17.441 -6.054 1.00 2.85 H new ATOM 0 HZ3 LYS A 75 -10.385 -17.078 -6.820 1.00 2.85 H new ATOM 877 N GLY A 76 -9.629 -10.059 -8.672 1.00 1.89 N ATOM 878 CA GLY A 76 -10.306 -9.340 -9.732 1.00 2.41 C ATOM 879 C GLY A 76 -10.224 -7.839 -9.551 1.00 1.95 C ATOM 880 O GLY A 76 -10.758 -7.077 -10.357 1.00 2.42 O ATOM 0 H GLY A 76 -8.680 -10.359 -8.897 1.00 1.89 H new ATOM 0 HA2 GLY A 76 -9.866 -9.613 -10.691 1.00 2.41 H new ATOM 0 HA3 GLY A 76 -11.352 -9.643 -9.763 1.00 2.41 H new ATOM 884 N GLN A 77 -9.557 -7.411 -8.490 1.00 1.50 N ATOM 885 CA GLN A 77 -9.415 -5.996 -8.190 1.00 1.32 C ATOM 886 C GLN A 77 -7.953 -5.608 -8.079 1.00 1.10 C ATOM 887 O GLN A 77 -7.062 -6.453 -8.149 1.00 1.51 O ATOM 888 CB GLN A 77 -10.123 -5.654 -6.880 1.00 1.56 C ATOM 889 CG GLN A 77 -11.632 -5.761 -6.952 1.00 2.02 C ATOM 890 CD GLN A 77 -12.243 -4.758 -7.910 1.00 2.54 C ATOM 891 OE1 GLN A 77 -12.575 -3.640 -7.523 1.00 2.88 O ATOM 892 NE2 GLN A 77 -12.393 -5.144 -9.165 1.00 3.28 N ATOM 0 H GLN A 77 -9.103 -8.030 -7.818 1.00 1.50 H new ATOM 0 HA GLN A 77 -9.870 -5.438 -9.008 1.00 1.32 H new ATOM 0 HB2 GLN A 77 -9.758 -6.319 -6.097 1.00 1.56 H new ATOM 0 HB3 GLN A 77 -9.854 -4.639 -6.587 1.00 1.56 H new ATOM 0 HG2 GLN A 77 -11.906 -6.769 -7.263 1.00 2.02 H new ATOM 0 HG3 GLN A 77 -12.051 -5.609 -5.957 1.00 2.02 H new ATOM 0 HE21 GLN A 77 -12.105 -6.081 -9.448 1.00 3.28 H new ATOM 0 HE22 GLN A 77 -12.797 -4.505 -9.850 1.00 3.28 H new ATOM 901 N HIS A 78 -7.716 -4.318 -7.916 1.00 0.88 N ATOM 902 CA HIS A 78 -6.381 -3.802 -7.685 1.00 0.85 C ATOM 903 C HIS A 78 -6.429 -2.862 -6.495 1.00 0.69 C ATOM 904 O HIS A 78 -7.515 -2.425 -6.113 1.00 0.68 O ATOM 905 CB HIS A 78 -5.855 -3.050 -8.909 1.00 1.02 C ATOM 906 CG HIS A 78 -5.947 -3.813 -10.192 1.00 1.16 C ATOM 907 ND1 HIS A 78 -6.828 -3.475 -11.192 1.00 1.50 N ATOM 908 CD2 HIS A 78 -5.257 -4.886 -10.644 1.00 1.41 C ATOM 909 CE1 HIS A 78 -6.679 -4.306 -12.206 1.00 1.96 C ATOM 910 NE2 HIS A 78 -5.732 -5.172 -11.899 1.00 1.85 N ATOM 0 H HIS A 78 -8.442 -3.602 -7.940 1.00 0.88 H new ATOM 0 HA HIS A 78 -5.708 -4.637 -7.491 1.00 0.85 H new ATOM 0 HB2 HIS A 78 -6.411 -2.119 -9.014 1.00 1.02 H new ATOM 0 HB3 HIS A 78 -4.813 -2.781 -8.735 1.00 1.02 H new ATOM 0 HD1 HIS A 78 -7.493 -2.702 -11.156 1.00 1.50 H new ATOM 0 HD2 HIS A 78 -4.479 -5.417 -10.116 1.00 1.41 H new ATOM 0 HE1 HIS A 78 -7.237 -4.282 -13.130 1.00 1.96 H new ATOM 919 N LEU A 79 -5.280 -2.545 -5.916 1.00 0.60 N ATOM 920 CA LEU A 79 -5.244 -1.703 -4.725 1.00 0.46 C ATOM 921 C LEU A 79 -5.951 -0.372 -4.970 1.00 0.44 C ATOM 922 O LEU A 79 -6.821 0.030 -4.198 1.00 0.42 O ATOM 923 CB LEU A 79 -3.800 -1.455 -4.279 1.00 0.44 C ATOM 924 CG LEU A 79 -3.653 -0.625 -2.999 1.00 0.37 C ATOM 925 CD1 LEU A 79 -4.255 -1.357 -1.810 1.00 0.37 C ATOM 926 CD2 LEU A 79 -2.193 -0.299 -2.739 1.00 0.41 C ATOM 0 H LEU A 79 -4.366 -2.854 -6.247 1.00 0.60 H new ATOM 0 HA LEU A 79 -5.771 -2.232 -3.931 1.00 0.46 H new ATOM 0 HB2 LEU A 79 -3.311 -2.418 -4.128 1.00 0.44 H new ATOM 0 HB3 LEU A 79 -3.268 -0.950 -5.085 1.00 0.44 H new ATOM 0 HG LEU A 79 -4.196 0.310 -3.136 1.00 0.37 H new ATOM 0 HD11 LEU A 79 -4.139 -0.750 -0.912 1.00 0.37 H new ATOM 0 HD12 LEU A 79 -5.314 -1.537 -1.992 1.00 0.37 H new ATOM 0 HD13 LEU A 79 -3.743 -2.309 -1.672 1.00 0.37 H new ATOM 0 HD21 LEU A 79 -2.109 0.291 -1.826 1.00 0.41 H new ATOM 0 HD22 LEU A 79 -1.628 -1.224 -2.627 1.00 0.41 H new ATOM 0 HD23 LEU A 79 -1.793 0.271 -3.577 1.00 0.41 H new ATOM 938 N ALA A 80 -5.609 0.290 -6.066 1.00 0.50 N ATOM 939 CA ALA A 80 -6.158 1.606 -6.361 1.00 0.54 C ATOM 940 C ALA A 80 -7.655 1.548 -6.651 1.00 0.58 C ATOM 941 O ALA A 80 -8.383 2.495 -6.361 1.00 0.61 O ATOM 942 CB ALA A 80 -5.419 2.239 -7.521 1.00 0.63 C ATOM 0 H ALA A 80 -4.955 -0.062 -6.765 1.00 0.50 H new ATOM 0 HA ALA A 80 -6.021 2.223 -5.473 1.00 0.54 H new ATOM 0 HB1 ALA A 80 -5.842 3.222 -7.729 1.00 0.63 H new ATOM 0 HB2 ALA A 80 -4.364 2.344 -7.267 1.00 0.63 H new ATOM 0 HB3 ALA A 80 -5.518 1.607 -8.404 1.00 0.63 H new ATOM 948 N ASP A 81 -8.114 0.441 -7.224 1.00 0.64 N ATOM 949 CA ASP A 81 -9.543 0.252 -7.476 1.00 0.70 C ATOM 950 C ASP A 81 -10.290 0.132 -6.157 1.00 0.60 C ATOM 951 O ASP A 81 -11.421 0.599 -6.017 1.00 0.67 O ATOM 952 CB ASP A 81 -9.797 -0.990 -8.334 1.00 0.78 C ATOM 953 CG ASP A 81 -9.331 -0.818 -9.763 1.00 1.52 C ATOM 954 OD1 ASP A 81 -9.944 -0.018 -10.499 1.00 2.06 O ATOM 955 OD2 ASP A 81 -8.352 -1.485 -10.159 1.00 2.30 O ATOM 0 H ASP A 81 -7.524 -0.336 -7.522 1.00 0.64 H new ATOM 0 HA ASP A 81 -9.908 1.121 -8.023 1.00 0.70 H new ATOM 0 HB2 ASP A 81 -9.286 -1.844 -7.890 1.00 0.78 H new ATOM 0 HB3 ASP A 81 -10.863 -1.218 -8.329 1.00 0.78 H new ATOM 960 N ILE A 82 -9.633 -0.494 -5.193 1.00 0.50 N ATOM 961 CA ILE A 82 -10.162 -0.623 -3.845 1.00 0.45 C ATOM 962 C ILE A 82 -10.237 0.741 -3.161 1.00 0.48 C ATOM 963 O ILE A 82 -11.229 1.078 -2.513 1.00 0.61 O ATOM 964 CB ILE A 82 -9.282 -1.582 -3.018 1.00 0.41 C ATOM 965 CG1 ILE A 82 -9.472 -3.017 -3.509 1.00 0.51 C ATOM 966 CG2 ILE A 82 -9.587 -1.466 -1.533 1.00 0.46 C ATOM 967 CD1 ILE A 82 -8.516 -4.004 -2.883 1.00 0.61 C ATOM 0 H ILE A 82 -8.719 -0.927 -5.323 1.00 0.50 H new ATOM 0 HA ILE A 82 -11.170 -1.032 -3.910 1.00 0.45 H new ATOM 0 HB ILE A 82 -8.238 -1.301 -3.157 1.00 0.41 H new ATOM 0 HG12 ILE A 82 -10.494 -3.331 -3.299 1.00 0.51 H new ATOM 0 HG13 ILE A 82 -9.348 -3.041 -4.592 1.00 0.51 H new ATOM 0 HG21 ILE A 82 -8.951 -2.154 -0.976 1.00 0.46 H new ATOM 0 HG22 ILE A 82 -9.396 -0.446 -1.201 1.00 0.46 H new ATOM 0 HG23 ILE A 82 -10.633 -1.715 -1.356 1.00 0.46 H new ATOM 0 HD11 ILE A 82 -8.711 -5.001 -3.279 1.00 0.61 H new ATOM 0 HD12 ILE A 82 -7.491 -3.715 -3.115 1.00 0.61 H new ATOM 0 HD13 ILE A 82 -8.655 -4.010 -1.802 1.00 0.61 H new ATOM 974 N LEU A 83 -9.187 1.527 -3.323 1.00 0.44 N ATOM 975 CA LEU A 83 -9.134 2.862 -2.745 1.00 0.52 C ATOM 976 C LEU A 83 -10.140 3.788 -3.427 1.00 0.69 C ATOM 977 O LEU A 83 -10.684 4.692 -2.801 1.00 0.83 O ATOM 978 CB LEU A 83 -7.718 3.433 -2.851 1.00 0.47 C ATOM 979 CG LEU A 83 -6.745 3.034 -1.728 1.00 0.39 C ATOM 980 CD1 LEU A 83 -6.664 1.524 -1.558 1.00 0.32 C ATOM 981 CD2 LEU A 83 -5.365 3.602 -2.010 1.00 0.42 C ATOM 0 H LEU A 83 -8.355 1.264 -3.852 1.00 0.44 H new ATOM 0 HA LEU A 83 -9.400 2.790 -1.690 1.00 0.52 H new ATOM 0 HB2 LEU A 83 -7.291 3.119 -3.803 1.00 0.47 H new ATOM 0 HB3 LEU A 83 -7.787 4.521 -2.876 1.00 0.47 H new ATOM 0 HG LEU A 83 -7.127 3.450 -0.796 1.00 0.39 H new ATOM 0 HD11 LEU A 83 -5.966 1.285 -0.755 1.00 0.32 H new ATOM 0 HD12 LEU A 83 -7.650 1.132 -1.310 1.00 0.32 H new ATOM 0 HD13 LEU A 83 -6.317 1.071 -2.487 1.00 0.32 H new ATOM 0 HD21 LEU A 83 -4.683 3.315 -1.210 1.00 0.42 H new ATOM 0 HD22 LEU A 83 -4.997 3.211 -2.959 1.00 0.42 H new ATOM 0 HD23 LEU A 83 -5.423 4.689 -2.064 1.00 0.42 H new ATOM 993 N ASN A 84 -10.399 3.537 -4.706 1.00 0.74 N ATOM 994 CA ASN A 84 -11.357 4.333 -5.473 1.00 0.94 C ATOM 995 C ASN A 84 -12.768 4.189 -4.905 1.00 0.97 C ATOM 996 O ASN A 84 -13.547 5.140 -4.907 1.00 1.15 O ATOM 997 CB ASN A 84 -11.345 3.904 -6.945 1.00 1.04 C ATOM 998 CG ASN A 84 -12.330 4.680 -7.810 1.00 1.27 C ATOM 999 OD1 ASN A 84 -12.921 4.128 -8.736 1.00 1.83 O ATOM 1000 ND2 ASN A 84 -12.501 5.964 -7.535 1.00 1.79 N ATOM 0 H ASN A 84 -9.958 2.786 -5.237 1.00 0.74 H new ATOM 0 HA ASN A 84 -11.060 5.379 -5.400 1.00 0.94 H new ATOM 0 HB2 ASN A 84 -10.340 4.035 -7.346 1.00 1.04 H new ATOM 0 HB3 ASN A 84 -11.577 2.841 -7.008 1.00 1.04 H new ATOM 0 HD21 ASN A 84 -13.139 6.526 -8.099 1.00 1.79 H new ATOM 0 HD22 ASN A 84 -11.995 6.391 -6.759 1.00 1.79 H new ATOM 1007 N SER A 85 -13.091 3.003 -4.410 1.00 0.87 N ATOM 1008 CA SER A 85 -14.414 2.742 -3.858 1.00 0.93 C ATOM 1009 C SER A 85 -14.580 3.343 -2.461 1.00 0.91 C ATOM 1010 O SER A 85 -15.672 3.322 -1.893 1.00 1.01 O ATOM 1011 CB SER A 85 -14.716 1.240 -3.855 1.00 0.98 C ATOM 1012 OG SER A 85 -13.597 0.480 -3.434 1.00 1.50 O ATOM 0 H SER A 85 -12.456 2.206 -4.379 1.00 0.87 H new ATOM 0 HA SER A 85 -15.140 3.234 -4.505 1.00 0.93 H new ATOM 0 HB2 SER A 85 -15.560 1.040 -3.195 1.00 0.98 H new ATOM 0 HB3 SER A 85 -15.013 0.927 -4.856 1.00 0.98 H new ATOM 0 HG SER A 85 -12.981 1.055 -2.934 1.00 1.50 H new ATOM 1018 N ALA A 86 -13.494 3.859 -1.897 1.00 0.88 N ATOM 1019 CA ALA A 86 -13.550 4.494 -0.589 1.00 0.95 C ATOM 1020 C ALA A 86 -14.005 5.946 -0.717 1.00 1.14 C ATOM 1021 O ALA A 86 -13.808 6.579 -1.758 1.00 1.71 O ATOM 1022 CB ALA A 86 -12.197 4.418 0.100 1.00 1.09 C ATOM 0 H ALA A 86 -12.568 3.850 -2.324 1.00 0.88 H new ATOM 0 HA ALA A 86 -14.277 3.958 0.022 1.00 0.95 H new ATOM 0 HB1 ALA A 86 -12.259 4.898 1.077 1.00 1.09 H new ATOM 0 HB2 ALA A 86 -11.911 3.374 0.226 1.00 1.09 H new ATOM 0 HB3 ALA A 86 -11.450 4.928 -0.508 1.00 1.09 H new ATOM 1028 N SER A 87 -14.617 6.464 0.337 1.00 1.41 N ATOM 1029 CA SER A 87 -15.122 7.828 0.340 1.00 1.70 C ATOM 1030 C SER A 87 -15.465 8.268 1.759 1.00 1.53 C ATOM 1031 O SER A 87 -16.501 7.876 2.301 1.00 1.80 O ATOM 1032 CB SER A 87 -16.360 7.928 -0.556 1.00 2.36 C ATOM 1033 OG SER A 87 -17.318 6.935 -0.216 1.00 3.09 O ATOM 0 H SER A 87 -14.777 5.956 1.207 1.00 1.41 H new ATOM 0 HA SER A 87 -14.346 8.488 -0.048 1.00 1.70 H new ATOM 0 HB2 SER A 87 -16.806 8.918 -0.456 1.00 2.36 H new ATOM 0 HB3 SER A 87 -16.068 7.814 -1.600 1.00 2.36 H new ATOM 0 HG SER A 87 -17.411 6.891 0.759 1.00 3.09 H new ATOM 1039 N ARG A 88 -14.596 9.065 2.365 1.00 1.60 N ATOM 1040 CA ARG A 88 -14.814 9.523 3.732 1.00 1.65 C ATOM 1041 C ARG A 88 -14.482 10.998 3.876 1.00 1.89 C ATOM 1042 O ARG A 88 -13.319 11.391 3.805 1.00 2.38 O ATOM 1043 CB ARG A 88 -13.971 8.710 4.714 1.00 2.05 C ATOM 1044 CG ARG A 88 -14.394 7.259 4.833 1.00 2.61 C ATOM 1045 CD ARG A 88 -15.799 7.127 5.392 1.00 3.30 C ATOM 1046 NE ARG A 88 -16.191 5.730 5.546 1.00 4.00 N ATOM 1047 CZ ARG A 88 -17.236 5.326 6.265 1.00 4.74 C ATOM 1048 NH1 ARG A 88 -17.995 6.213 6.895 1.00 4.99 N ATOM 1049 NH2 ARG A 88 -17.521 4.034 6.352 1.00 5.55 N ATOM 0 H ARG A 88 -13.737 9.407 1.935 1.00 1.60 H new ATOM 0 HA ARG A 88 -15.870 9.379 3.962 1.00 1.65 H new ATOM 0 HB2 ARG A 88 -12.928 8.749 4.401 1.00 2.05 H new ATOM 0 HB3 ARG A 88 -14.027 9.176 5.698 1.00 2.05 H new ATOM 0 HG2 ARG A 88 -14.346 6.785 3.853 1.00 2.61 H new ATOM 0 HG3 ARG A 88 -13.694 6.728 5.478 1.00 2.61 H new ATOM 0 HD2 ARG A 88 -15.855 7.629 6.358 1.00 3.30 H new ATOM 0 HD3 ARG A 88 -16.503 7.631 4.730 1.00 3.30 H new ATOM 0 HE ARG A 88 -15.631 5.020 5.074 1.00 4.00 H new ATOM 0 HH11 ARG A 88 -17.779 7.208 6.829 1.00 4.99 H new ATOM 0 HH12 ARG A 88 -18.795 5.900 7.445 1.00 4.99 H new ATOM 0 HH21 ARG A 88 -16.940 3.350 5.868 1.00 5.55 H new ATOM 0 HH22 ARG A 88 -18.322 3.724 6.903 1.00 5.55 H new ATOM 1063 N VAL A 89 -15.507 11.809 4.080 1.00 1.99 N ATOM 1064 CA VAL A 89 -15.311 13.232 4.300 1.00 2.41 C ATOM 1065 C VAL A 89 -15.738 13.609 5.717 1.00 2.25 C ATOM 1066 O VAL A 89 -16.896 13.965 5.951 1.00 2.30 O ATOM 1067 CB VAL A 89 -16.103 14.086 3.283 1.00 3.06 C ATOM 1068 CG1 VAL A 89 -15.762 15.563 3.436 1.00 3.58 C ATOM 1069 CG2 VAL A 89 -15.833 13.620 1.861 1.00 3.55 C ATOM 0 H VAL A 89 -16.481 11.507 4.098 1.00 1.99 H new ATOM 0 HA VAL A 89 -14.249 13.438 4.164 1.00 2.41 H new ATOM 0 HB VAL A 89 -17.166 13.957 3.489 1.00 3.06 H new ATOM 0 HG11 VAL A 89 -16.331 16.145 2.711 1.00 3.58 H new ATOM 0 HG12 VAL A 89 -16.015 15.892 4.444 1.00 3.58 H new ATOM 0 HG13 VAL A 89 -14.696 15.710 3.263 1.00 3.58 H new ATOM 0 HG21 VAL A 89 -16.401 14.235 1.163 1.00 3.55 H new ATOM 0 HG22 VAL A 89 -14.769 13.712 1.644 1.00 3.55 H new ATOM 0 HG23 VAL A 89 -16.136 12.578 1.756 1.00 3.55 H new ATOM 1073 N PRO A 90 -14.817 13.517 6.687 1.00 2.60 N ATOM 1074 CA PRO A 90 -15.091 13.904 8.066 1.00 2.83 C ATOM 1075 C PRO A 90 -15.045 15.417 8.229 1.00 2.80 C ATOM 1076 O PRO A 90 -14.104 15.972 8.802 1.00 3.31 O ATOM 1077 CB PRO A 90 -13.968 13.229 8.852 1.00 3.67 C ATOM 1078 CG PRO A 90 -12.832 13.142 7.892 1.00 3.95 C ATOM 1079 CD PRO A 90 -13.436 13.031 6.515 1.00 3.27 C ATOM 0 HA PRO A 90 -16.084 13.606 8.404 1.00 2.83 H new ATOM 0 HB2 PRO A 90 -13.697 13.810 9.734 1.00 3.67 H new ATOM 0 HB3 PRO A 90 -14.268 12.241 9.201 1.00 3.67 H new ATOM 0 HG2 PRO A 90 -12.195 14.023 7.965 1.00 3.95 H new ATOM 0 HG3 PRO A 90 -12.206 12.277 8.111 1.00 3.95 H new ATOM 0 HD2 PRO A 90 -12.889 13.634 5.790 1.00 3.27 H new ATOM 0 HD3 PRO A 90 -13.417 12.003 6.153 1.00 3.27 H new ATOM 1087 N GLU A 91 -16.058 16.078 7.691 1.00 2.59 N ATOM 1088 CA GLU A 91 -16.122 17.527 7.703 1.00 2.75 C ATOM 1089 C GLU A 91 -16.478 18.029 9.097 1.00 2.55 C ATOM 1090 O GLU A 91 -17.651 18.155 9.451 1.00 2.93 O ATOM 1091 CB GLU A 91 -17.139 18.011 6.670 1.00 3.30 C ATOM 1092 CG GLU A 91 -17.105 19.509 6.429 1.00 3.94 C ATOM 1093 CD GLU A 91 -18.066 19.935 5.343 1.00 4.58 C ATOM 1094 OE1 GLU A 91 -19.245 20.197 5.654 1.00 5.02 O ATOM 1095 OE2 GLU A 91 -17.651 19.995 4.168 1.00 5.08 O ATOM 0 H GLU A 91 -16.853 15.627 7.237 1.00 2.59 H new ATOM 0 HA GLU A 91 -15.144 17.930 7.439 1.00 2.75 H new ATOM 0 HB2 GLU A 91 -16.957 17.497 5.726 1.00 3.30 H new ATOM 0 HB3 GLU A 91 -18.139 17.728 6.999 1.00 3.30 H new ATOM 0 HG2 GLU A 91 -17.351 20.030 7.354 1.00 3.94 H new ATOM 0 HG3 GLU A 91 -16.093 19.808 6.154 1.00 3.94 H new ATOM 1102 N SER A 92 -15.452 18.291 9.887 1.00 2.55 N ATOM 1103 CA SER A 92 -15.623 18.737 11.254 1.00 2.76 C ATOM 1104 C SER A 92 -15.528 20.255 11.333 1.00 2.95 C ATOM 1105 O SER A 92 -16.575 20.915 11.495 1.00 3.07 O ATOM 1106 CB SER A 92 -14.563 18.083 12.141 1.00 3.61 C ATOM 1107 OG SER A 92 -13.264 18.272 11.597 1.00 4.12 O ATOM 1108 OXT SER A 92 -14.404 20.785 11.202 1.00 3.54 O ATOM 0 H SER A 92 -14.478 18.200 9.597 1.00 2.55 H new ATOM 0 HA SER A 92 -16.611 18.442 11.607 1.00 2.76 H new ATOM 0 HB2 SER A 92 -14.608 18.509 13.143 1.00 3.61 H new ATOM 0 HB3 SER A 92 -14.770 17.017 12.238 1.00 3.61 H new ATOM 0 HG SER A 92 -13.179 19.190 11.265 1.00 4.12 H new TER 1114 SER A 92 ATOM 1115 N MET B 14 -14.469 9.473 -3.323 1.00 4.46 N ATOM 1116 CA MET B 14 -14.706 10.195 -4.599 1.00 3.81 C ATOM 1117 C MET B 14 -13.441 10.235 -5.446 1.00 2.82 C ATOM 1118 O MET B 14 -13.507 10.421 -6.662 1.00 2.99 O ATOM 1119 CB MET B 14 -15.196 11.626 -4.339 1.00 4.49 C ATOM 1120 CG MET B 14 -14.122 12.560 -3.806 1.00 5.01 C ATOM 1121 SD MET B 14 -14.749 14.205 -3.410 1.00 5.79 S ATOM 1122 CE MET B 14 -15.261 14.778 -5.026 1.00 6.44 C ATOM 0 HA MET B 14 -15.478 9.651 -5.143 1.00 3.81 H new ATOM 0 HB2 MET B 14 -15.593 12.037 -5.267 1.00 4.49 H new ATOM 0 HB3 MET B 14 -16.020 11.593 -3.627 1.00 4.49 H new ATOM 0 HG2 MET B 14 -13.678 12.122 -2.912 1.00 5.01 H new ATOM 0 HG3 MET B 14 -13.326 12.649 -4.546 1.00 5.01 H new ATOM 0 HE1 MET B 14 -15.401 15.859 -5.001 1.00 6.44 H new ATOM 0 HE2 MET B 14 -14.495 14.528 -5.760 1.00 6.44 H new ATOM 0 HE3 MET B 14 -16.199 14.297 -5.302 1.00 6.44 H new ATOM 1134 N MET B 15 -12.287 10.071 -4.808 1.00 2.12 N ATOM 1135 CA MET B 15 -11.020 10.115 -5.511 1.00 1.95 C ATOM 1136 C MET B 15 -10.795 8.822 -6.277 1.00 1.69 C ATOM 1137 O MET B 15 -11.232 7.749 -5.862 1.00 2.48 O ATOM 1138 CB MET B 15 -9.868 10.356 -4.532 1.00 2.52 C ATOM 1139 CG MET B 15 -9.997 11.651 -3.744 1.00 3.06 C ATOM 1140 SD MET B 15 -10.182 13.101 -4.803 1.00 3.93 S ATOM 1141 CE MET B 15 -10.289 14.401 -3.575 1.00 4.73 C ATOM 0 H MET B 15 -12.208 9.907 -3.804 1.00 2.12 H new ATOM 0 HA MET B 15 -11.050 10.942 -6.220 1.00 1.95 H new ATOM 0 HB2 MET B 15 -9.815 9.520 -3.834 1.00 2.52 H new ATOM 0 HB3 MET B 15 -8.929 10.370 -5.086 1.00 2.52 H new ATOM 0 HG2 MET B 15 -10.857 11.581 -3.078 1.00 3.06 H new ATOM 0 HG3 MET B 15 -9.116 11.777 -3.115 1.00 3.06 H new ATOM 0 HE1 MET B 15 -11.211 14.964 -3.721 1.00 4.73 H new ATOM 0 HE2 MET B 15 -10.287 13.961 -2.578 1.00 4.73 H new ATOM 0 HE3 MET B 15 -9.435 15.070 -3.678 1.00 4.73 H new ATOM 1151 N SER B 16 -10.113 8.933 -7.401 1.00 1.19 N ATOM 1152 CA SER B 16 -9.835 7.782 -8.244 1.00 1.17 C ATOM 1153 C SER B 16 -8.523 7.121 -7.833 1.00 1.05 C ATOM 1154 O SER B 16 -7.994 6.269 -8.546 1.00 1.91 O ATOM 1155 CB SER B 16 -9.778 8.205 -9.712 1.00 1.62 C ATOM 1156 OG SER B 16 -10.937 8.939 -10.074 1.00 2.01 O ATOM 0 H SER B 16 -9.739 9.813 -7.754 1.00 1.19 H new ATOM 0 HA SER B 16 -10.640 7.058 -8.118 1.00 1.17 H new ATOM 0 HB2 SER B 16 -8.890 8.812 -9.885 1.00 1.62 H new ATOM 0 HB3 SER B 16 -9.689 7.322 -10.346 1.00 1.62 H new ATOM 0 HG SER B 16 -10.878 9.200 -11.017 1.00 2.01 H new ATOM 1162 N ALA B 17 -8.022 7.534 -6.667 1.00 0.94 N ATOM 1163 CA ALA B 17 -6.783 7.014 -6.101 1.00 0.81 C ATOM 1164 C ALA B 17 -5.587 7.344 -6.986 1.00 0.69 C ATOM 1165 O ALA B 17 -5.104 6.502 -7.743 1.00 0.71 O ATOM 1166 CB ALA B 17 -6.883 5.513 -5.859 1.00 1.09 C ATOM 0 H ALA B 17 -8.470 8.244 -6.088 1.00 0.94 H new ATOM 0 HA ALA B 17 -6.628 7.503 -5.139 1.00 0.81 H new ATOM 0 HB1 ALA B 17 -5.946 5.149 -5.437 1.00 1.09 H new ATOM 0 HB2 ALA B 17 -7.698 5.310 -5.164 1.00 1.09 H new ATOM 0 HB3 ALA B 17 -7.077 5.004 -6.803 1.00 1.09 H new ATOM 1172 N SER B 18 -5.120 8.581 -6.892 1.00 0.64 N ATOM 1173 CA SER B 18 -3.949 9.012 -7.632 1.00 0.61 C ATOM 1174 C SER B 18 -2.694 8.422 -6.989 1.00 0.50 C ATOM 1175 O SER B 18 -2.750 7.928 -5.861 1.00 0.45 O ATOM 1176 CB SER B 18 -3.881 10.545 -7.663 1.00 0.67 C ATOM 1177 OG SER B 18 -2.882 11.010 -8.556 1.00 1.33 O ATOM 0 H SER B 18 -5.538 9.304 -6.307 1.00 0.64 H new ATOM 0 HA SER B 18 -4.015 8.656 -8.660 1.00 0.61 H new ATOM 0 HB2 SER B 18 -4.850 10.946 -7.961 1.00 0.67 H new ATOM 0 HB3 SER B 18 -3.675 10.920 -6.660 1.00 0.67 H new ATOM 0 HG SER B 18 -2.869 11.990 -8.551 1.00 1.33 H new ATOM 1183 N LYS B 19 -1.575 8.483 -7.698 1.00 0.50 N ATOM 1184 CA LYS B 19 -0.343 7.825 -7.261 1.00 0.43 C ATOM 1185 C LYS B 19 0.047 8.270 -5.852 1.00 0.35 C ATOM 1186 O LYS B 19 0.230 7.440 -4.955 1.00 0.28 O ATOM 1187 CB LYS B 19 0.799 8.139 -8.232 1.00 0.54 C ATOM 1188 CG LYS B 19 0.380 8.127 -9.691 1.00 0.85 C ATOM 1189 CD LYS B 19 1.565 8.343 -10.616 1.00 1.13 C ATOM 1190 CE LYS B 19 1.112 8.698 -12.023 1.00 1.74 C ATOM 1191 NZ LYS B 19 0.179 7.688 -12.589 1.00 2.10 N ATOM 0 H LYS B 19 -1.491 8.983 -8.583 1.00 0.50 H new ATOM 0 HA LYS B 19 -0.524 6.750 -7.249 1.00 0.43 H new ATOM 0 HB2 LYS B 19 1.211 9.118 -7.990 1.00 0.54 H new ATOM 0 HB3 LYS B 19 1.598 7.412 -8.087 1.00 0.54 H new ATOM 0 HG2 LYS B 19 -0.096 7.175 -9.925 1.00 0.85 H new ATOM 0 HG3 LYS B 19 -0.363 8.906 -9.863 1.00 0.85 H new ATOM 0 HD2 LYS B 19 2.195 9.141 -10.223 1.00 1.13 H new ATOM 0 HD3 LYS B 19 2.175 7.440 -10.645 1.00 1.13 H new ATOM 0 HE2 LYS B 19 0.624 9.673 -12.010 1.00 1.74 H new ATOM 0 HE3 LYS B 19 1.984 8.787 -12.671 1.00 1.74 H new ATOM 0 HZ1 LYS B 19 -0.048 7.938 -13.573 1.00 2.10 H new ATOM 0 HZ2 LYS B 19 0.627 6.750 -12.565 1.00 2.10 H new ATOM 0 HZ3 LYS B 19 -0.695 7.669 -12.026 1.00 2.10 H new ATOM 1205 N GLU B 20 0.146 9.581 -5.665 1.00 0.41 N ATOM 1206 CA GLU B 20 0.527 10.157 -4.379 1.00 0.42 C ATOM 1207 C GLU B 20 -0.464 9.775 -3.280 1.00 0.34 C ATOM 1208 O GLU B 20 -0.072 9.538 -2.140 1.00 0.30 O ATOM 1209 CB GLU B 20 0.629 11.681 -4.492 1.00 0.57 C ATOM 1210 CG GLU B 20 -0.651 12.348 -4.974 1.00 0.64 C ATOM 1211 CD GLU B 20 -0.521 13.850 -5.087 1.00 0.95 C ATOM 1212 OE1 GLU B 20 0.181 14.324 -6.004 1.00 1.49 O ATOM 1213 OE2 GLU B 20 -1.130 14.567 -4.269 1.00 1.58 O ATOM 0 H GLU B 20 -0.034 10.271 -6.394 1.00 0.41 H new ATOM 0 HA GLU B 20 1.501 9.752 -4.106 1.00 0.42 H new ATOM 0 HB2 GLU B 20 0.897 12.091 -3.518 1.00 0.57 H new ATOM 0 HB3 GLU B 20 1.439 11.932 -5.177 1.00 0.57 H new ATOM 0 HG2 GLU B 20 -0.926 11.937 -5.946 1.00 0.64 H new ATOM 0 HG3 GLU B 20 -1.462 12.109 -4.286 1.00 0.64 H new ATOM 1220 N GLU B 21 -1.740 9.695 -3.639 1.00 0.37 N ATOM 1221 CA GLU B 21 -2.795 9.392 -2.678 1.00 0.39 C ATOM 1222 C GLU B 21 -2.671 7.959 -2.181 1.00 0.32 C ATOM 1223 O GLU B 21 -2.845 7.682 -0.993 1.00 0.33 O ATOM 1224 CB GLU B 21 -4.167 9.603 -3.317 1.00 0.50 C ATOM 1225 CG GLU B 21 -4.377 11.008 -3.855 1.00 0.62 C ATOM 1226 CD GLU B 21 -5.769 11.218 -4.414 1.00 0.91 C ATOM 1227 OE1 GLU B 21 -6.119 10.570 -5.419 1.00 1.49 O ATOM 1228 OE2 GLU B 21 -6.515 12.050 -3.856 1.00 1.54 O ATOM 0 H GLU B 21 -2.071 9.836 -4.594 1.00 0.37 H new ATOM 0 HA GLU B 21 -2.689 10.067 -1.828 1.00 0.39 H new ATOM 0 HB2 GLU B 21 -4.294 8.889 -4.131 1.00 0.50 H new ATOM 0 HB3 GLU B 21 -4.940 9.386 -2.579 1.00 0.50 H new ATOM 0 HG2 GLU B 21 -4.198 11.729 -3.057 1.00 0.62 H new ATOM 0 HG3 GLU B 21 -3.643 11.207 -4.635 1.00 0.62 H new ATOM 1235 N ILE B 22 -2.366 7.055 -3.099 1.00 0.30 N ATOM 1236 CA ILE B 22 -2.182 5.655 -2.760 1.00 0.29 C ATOM 1237 C ILE B 22 -0.947 5.482 -1.891 1.00 0.24 C ATOM 1238 O ILE B 22 -1.013 4.889 -0.815 1.00 0.26 O ATOM 1239 CB ILE B 22 -2.036 4.789 -4.023 1.00 0.30 C ATOM 1240 CG1 ILE B 22 -3.249 4.980 -4.928 1.00 0.36 C ATOM 1241 CG2 ILE B 22 -1.877 3.322 -3.646 1.00 0.31 C ATOM 1242 CD1 ILE B 22 -3.095 4.333 -6.282 1.00 0.44 C ATOM 0 H ILE B 22 -2.241 7.269 -4.088 1.00 0.30 H new ATOM 0 HA ILE B 22 -3.067 5.329 -2.213 1.00 0.29 H new ATOM 0 HB ILE B 22 -1.143 5.102 -4.563 1.00 0.30 H new ATOM 0 HG12 ILE B 22 -4.129 4.568 -4.435 1.00 0.36 H new ATOM 0 HG13 ILE B 22 -3.429 6.047 -5.062 1.00 0.36 H new ATOM 0 HG21 ILE B 22 -1.775 2.723 -4.551 1.00 0.31 H new ATOM 0 HG22 ILE B 22 -0.988 3.200 -3.027 1.00 0.31 H new ATOM 0 HG23 ILE B 22 -2.754 2.992 -3.090 1.00 0.31 H new ATOM 0 HD11 ILE B 22 -3.994 4.508 -6.873 1.00 0.44 H new ATOM 0 HD12 ILE B 22 -2.234 4.762 -6.795 1.00 0.44 H new ATOM 0 HD13 ILE B 22 -2.946 3.260 -6.158 1.00 0.44 H new ATOM 1249 N ALA B 23 0.173 6.027 -2.363 1.00 0.20 N ATOM 1250 CA ALA B 23 1.432 5.958 -1.634 1.00 0.19 C ATOM 1251 C ALA B 23 1.275 6.532 -0.234 1.00 0.20 C ATOM 1252 O ALA B 23 1.857 6.024 0.723 1.00 0.20 O ATOM 1253 CB ALA B 23 2.521 6.701 -2.390 1.00 0.20 C ATOM 0 H ALA B 23 0.231 6.523 -3.252 1.00 0.20 H new ATOM 0 HA ALA B 23 1.720 4.910 -1.545 1.00 0.19 H new ATOM 0 HB1 ALA B 23 3.456 6.641 -1.833 1.00 0.20 H new ATOM 0 HB2 ALA B 23 2.654 6.250 -3.373 1.00 0.20 H new ATOM 0 HB3 ALA B 23 2.235 7.746 -2.507 1.00 0.20 H new ATOM 1259 N ALA B 24 0.471 7.584 -0.131 1.00 0.22 N ATOM 1260 CA ALA B 24 0.168 8.215 1.143 1.00 0.25 C ATOM 1261 C ALA B 24 -0.390 7.202 2.138 1.00 0.23 C ATOM 1262 O ALA B 24 0.135 7.047 3.239 1.00 0.25 O ATOM 1263 CB ALA B 24 -0.820 9.349 0.933 1.00 0.31 C ATOM 0 H ALA B 24 0.012 8.022 -0.930 1.00 0.22 H new ATOM 0 HA ALA B 24 1.092 8.617 1.558 1.00 0.25 H new ATOM 0 HB1 ALA B 24 -1.044 9.819 1.891 1.00 0.31 H new ATOM 0 HB2 ALA B 24 -0.388 10.088 0.259 1.00 0.31 H new ATOM 0 HB3 ALA B 24 -1.739 8.955 0.498 1.00 0.31 H new ATOM 1269 N LEU B 25 -1.442 6.500 1.740 1.00 0.23 N ATOM 1270 CA LEU B 25 -2.065 5.505 2.603 1.00 0.23 C ATOM 1271 C LEU B 25 -1.104 4.362 2.904 1.00 0.22 C ATOM 1272 O LEU B 25 -1.079 3.836 4.019 1.00 0.25 O ATOM 1273 CB LEU B 25 -3.335 4.957 1.957 1.00 0.26 C ATOM 1274 CG LEU B 25 -4.499 5.943 1.874 1.00 0.36 C ATOM 1275 CD1 LEU B 25 -5.620 5.359 1.037 1.00 0.46 C ATOM 1276 CD2 LEU B 25 -5.002 6.290 3.266 1.00 0.43 C ATOM 0 H LEU B 25 -1.882 6.601 0.825 1.00 0.23 H new ATOM 0 HA LEU B 25 -2.325 5.994 3.542 1.00 0.23 H new ATOM 0 HB2 LEU B 25 -3.094 4.618 0.949 1.00 0.26 H new ATOM 0 HB3 LEU B 25 -3.661 4.081 2.519 1.00 0.26 H new ATOM 0 HG LEU B 25 -4.147 6.858 1.397 1.00 0.36 H new ATOM 0 HD11 LEU B 25 -6.444 6.071 0.985 1.00 0.46 H new ATOM 0 HD12 LEU B 25 -5.254 5.154 0.031 1.00 0.46 H new ATOM 0 HD13 LEU B 25 -5.969 4.432 1.492 1.00 0.46 H new ATOM 0 HD21 LEU B 25 -5.831 6.993 3.188 1.00 0.43 H new ATOM 0 HD22 LEU B 25 -5.341 5.383 3.767 1.00 0.43 H new ATOM 0 HD23 LEU B 25 -4.195 6.743 3.842 1.00 0.43 H new ATOM 1288 N ILE B 26 -0.311 3.992 1.908 1.00 0.20 N ATOM 1289 CA ILE B 26 0.651 2.910 2.058 1.00 0.21 C ATOM 1290 C ILE B 26 1.703 3.254 3.114 1.00 0.20 C ATOM 1291 O ILE B 26 1.923 2.486 4.054 1.00 0.22 O ATOM 1292 CB ILE B 26 1.346 2.581 0.718 1.00 0.22 C ATOM 1293 CG1 ILE B 26 0.312 2.191 -0.343 1.00 0.26 C ATOM 1294 CG2 ILE B 26 2.347 1.454 0.908 1.00 0.24 C ATOM 1295 CD1 ILE B 26 0.909 1.949 -1.714 1.00 0.27 C ATOM 0 H ILE B 26 -0.315 4.427 0.985 1.00 0.20 H new ATOM 0 HA ILE B 26 0.096 2.030 2.384 1.00 0.21 H new ATOM 0 HB ILE B 26 1.875 3.471 0.377 1.00 0.22 H new ATOM 0 HG12 ILE B 26 -0.207 1.289 -0.018 1.00 0.26 H new ATOM 0 HG13 ILE B 26 -0.436 2.980 -0.416 1.00 0.26 H new ATOM 0 HG21 ILE B 26 2.830 1.232 -0.044 1.00 0.24 H new ATOM 0 HG22 ILE B 26 3.101 1.756 1.636 1.00 0.24 H new ATOM 0 HG23 ILE B 26 1.830 0.565 1.269 1.00 0.24 H new ATOM 0 HD11 ILE B 26 0.118 1.677 -2.413 1.00 0.27 H new ATOM 0 HD12 ILE B 26 1.403 2.856 -2.061 1.00 0.27 H new ATOM 0 HD13 ILE B 26 1.636 1.139 -1.656 1.00 0.27 H new ATOM 1302 N VAL B 27 2.335 4.417 2.976 1.00 0.18 N ATOM 1303 CA VAL B 27 3.373 4.826 3.919 1.00 0.20 C ATOM 1304 C VAL B 27 2.772 5.157 5.282 1.00 0.22 C ATOM 1305 O VAL B 27 3.422 4.975 6.311 1.00 0.23 O ATOM 1306 CB VAL B 27 4.205 6.031 3.411 1.00 0.21 C ATOM 1307 CG1 VAL B 27 4.903 5.687 2.106 1.00 0.21 C ATOM 1308 CG2 VAL B 27 3.345 7.276 3.244 1.00 0.21 C ATOM 0 H VAL B 27 2.150 5.086 2.229 1.00 0.18 H new ATOM 0 HA VAL B 27 4.048 3.976 4.014 1.00 0.20 H new ATOM 0 HB VAL B 27 4.961 6.250 4.165 1.00 0.21 H new ATOM 0 HG11 VAL B 27 5.482 6.546 1.766 1.00 0.21 H new ATOM 0 HG12 VAL B 27 5.570 4.839 2.262 1.00 0.21 H new ATOM 0 HG13 VAL B 27 4.159 5.429 1.352 1.00 0.21 H new ATOM 0 HG21 VAL B 27 3.963 8.100 2.887 1.00 0.21 H new ATOM 0 HG22 VAL B 27 2.553 7.077 2.522 1.00 0.21 H new ATOM 0 HG23 VAL B 27 2.903 7.544 4.203 1.00 0.21 H new ATOM 1312 N ASN B 28 1.528 5.629 5.286 1.00 0.25 N ATOM 1313 CA ASN B 28 0.832 5.929 6.533 1.00 0.32 C ATOM 1314 C ASN B 28 0.602 4.644 7.314 1.00 0.27 C ATOM 1315 O ASN B 28 0.820 4.597 8.522 1.00 0.28 O ATOM 1316 CB ASN B 28 -0.507 6.625 6.264 1.00 0.44 C ATOM 1317 CG ASN B 28 -1.148 7.171 7.528 1.00 0.67 C ATOM 1318 OD1 ASN B 28 -0.905 8.314 7.916 1.00 1.58 O ATOM 1319 ND2 ASN B 28 -1.979 6.369 8.176 1.00 0.86 N ATOM 0 H ASN B 28 0.983 5.811 4.443 1.00 0.25 H new ATOM 0 HA ASN B 28 1.454 6.606 7.119 1.00 0.32 H new ATOM 0 HB2 ASN B 28 -0.352 7.441 5.558 1.00 0.44 H new ATOM 0 HB3 ASN B 28 -1.190 5.920 5.791 1.00 0.44 H new ATOM 0 HD21 ASN B 28 -2.441 6.692 9.026 1.00 0.86 H new ATOM 0 HD22 ASN B 28 -2.157 5.428 7.825 1.00 0.86 H new ATOM 1326 N TYR B 29 0.180 3.596 6.611 1.00 0.25 N ATOM 1327 CA TYR B 29 -0.033 2.295 7.231 1.00 0.24 C ATOM 1328 C TYR B 29 1.271 1.758 7.808 1.00 0.18 C ATOM 1329 O TYR B 29 1.308 1.292 8.944 1.00 0.19 O ATOM 1330 CB TYR B 29 -0.619 1.299 6.225 1.00 0.28 C ATOM 1331 CG TYR B 29 -0.714 -0.113 6.760 1.00 0.31 C ATOM 1332 CD1 TYR B 29 -1.495 -0.406 7.873 1.00 1.20 C ATOM 1333 CD2 TYR B 29 -0.011 -1.150 6.161 1.00 1.23 C ATOM 1334 CE1 TYR B 29 -1.570 -1.692 8.371 1.00 1.22 C ATOM 1335 CE2 TYR B 29 -0.085 -2.439 6.652 1.00 1.25 C ATOM 1336 CZ TYR B 29 -0.864 -2.705 7.759 1.00 0.42 C ATOM 1337 OH TYR B 29 -0.933 -3.986 8.255 1.00 0.49 O ATOM 0 H TYR B 29 -0.021 3.624 5.611 1.00 0.25 H new ATOM 0 HA TYR B 29 -0.749 2.421 8.043 1.00 0.24 H new ATOM 0 HB2 TYR B 29 -1.613 1.635 5.930 1.00 0.28 H new ATOM 0 HB3 TYR B 29 -0.003 1.298 5.326 1.00 0.28 H new ATOM 0 HD1 TYR B 29 -2.051 0.384 8.355 1.00 1.20 H new ATOM 0 HD2 TYR B 29 0.604 -0.945 5.297 1.00 1.23 H new ATOM 0 HE1 TYR B 29 -2.180 -1.903 9.237 1.00 1.22 H new ATOM 0 HE2 TYR B 29 0.465 -3.235 6.171 1.00 1.25 H new ATOM 0 HH TYR B 29 -0.378 -4.579 7.707 1.00 0.49 H new ATOM 1347 N PHE B 30 2.342 1.839 7.027 1.00 0.16 N ATOM 1348 CA PHE B 30 3.654 1.402 7.492 1.00 0.16 C ATOM 1349 C PHE B 30 4.077 2.205 8.718 1.00 0.18 C ATOM 1350 O PHE B 30 4.659 1.661 9.659 1.00 0.21 O ATOM 1351 CB PHE B 30 4.701 1.540 6.384 1.00 0.19 C ATOM 1352 CG PHE B 30 4.490 0.634 5.198 1.00 0.19 C ATOM 1353 CD1 PHE B 30 3.663 -0.479 5.278 1.00 1.17 C ATOM 1354 CD2 PHE B 30 5.133 0.897 3.999 1.00 1.20 C ATOM 1355 CE1 PHE B 30 3.485 -1.307 4.186 1.00 1.16 C ATOM 1356 CE2 PHE B 30 4.958 0.071 2.905 1.00 1.22 C ATOM 1357 CZ PHE B 30 4.133 -1.032 2.999 1.00 0.25 C ATOM 0 H PHE B 30 2.329 2.201 6.074 1.00 0.16 H new ATOM 0 HA PHE B 30 3.583 0.350 7.766 1.00 0.16 H new ATOM 0 HB2 PHE B 30 4.708 2.573 6.037 1.00 0.19 H new ATOM 0 HB3 PHE B 30 5.685 1.339 6.807 1.00 0.19 H new ATOM 0 HD1 PHE B 30 3.153 -0.700 6.204 1.00 1.17 H new ATOM 0 HD2 PHE B 30 5.779 1.759 3.918 1.00 1.20 H new ATOM 0 HE1 PHE B 30 2.839 -2.169 4.262 1.00 1.16 H new ATOM 0 HE2 PHE B 30 5.466 0.288 1.977 1.00 1.22 H new ATOM 0 HZ PHE B 30 3.995 -1.679 2.145 1.00 0.25 H new ATOM 1367 N SER B 31 3.762 3.496 8.707 1.00 0.21 N ATOM 1368 CA SER B 31 4.037 4.359 9.845 1.00 0.26 C ATOM 1369 C SER B 31 3.240 3.902 11.065 1.00 0.25 C ATOM 1370 O SER B 31 3.758 3.885 12.175 1.00 0.27 O ATOM 1371 CB SER B 31 3.708 5.815 9.508 1.00 0.35 C ATOM 1372 OG SER B 31 4.498 6.282 8.425 1.00 1.15 O ATOM 0 H SER B 31 3.315 3.966 7.920 1.00 0.21 H new ATOM 0 HA SER B 31 5.099 4.291 10.079 1.00 0.26 H new ATOM 0 HB2 SER B 31 2.651 5.903 9.255 1.00 0.35 H new ATOM 0 HB3 SER B 31 3.879 6.441 10.383 1.00 0.35 H new ATOM 0 HG SER B 31 4.192 5.865 7.593 1.00 1.15 H new ATOM 1378 N SER B 32 1.990 3.507 10.844 1.00 0.27 N ATOM 1379 CA SER B 32 1.132 3.028 11.920 1.00 0.30 C ATOM 1380 C SER B 32 1.683 1.736 12.526 1.00 0.28 C ATOM 1381 O SER B 32 1.613 1.533 13.742 1.00 0.36 O ATOM 1382 CB SER B 32 -0.288 2.803 11.398 1.00 0.40 C ATOM 1383 OG SER B 32 -0.800 3.978 10.792 1.00 0.99 O ATOM 0 H SER B 32 1.548 3.510 9.925 1.00 0.27 H new ATOM 0 HA SER B 32 1.108 3.787 12.702 1.00 0.30 H new ATOM 0 HB2 SER B 32 -0.288 1.987 10.675 1.00 0.40 H new ATOM 0 HB3 SER B 32 -0.937 2.501 12.220 1.00 0.40 H new ATOM 0 HG SER B 32 -0.305 4.163 9.966 1.00 0.99 H new ATOM 1389 N ILE B 33 2.241 0.877 11.676 1.00 0.24 N ATOM 1390 CA ILE B 33 2.812 -0.391 12.119 1.00 0.27 C ATOM 1391 C ILE B 33 3.956 -0.164 13.108 1.00 0.26 C ATOM 1392 O ILE B 33 3.997 -0.779 14.178 1.00 0.32 O ATOM 1393 CB ILE B 33 3.335 -1.228 10.931 1.00 0.30 C ATOM 1394 CG1 ILE B 33 2.204 -1.550 9.952 1.00 0.30 C ATOM 1395 CG2 ILE B 33 3.981 -2.510 11.429 1.00 0.44 C ATOM 1396 CD1 ILE B 33 2.651 -2.365 8.756 1.00 0.34 C ATOM 0 H ILE B 33 2.310 1.038 10.671 1.00 0.24 H new ATOM 0 HA ILE B 33 2.009 -0.940 12.611 1.00 0.27 H new ATOM 0 HB ILE B 33 4.086 -0.639 10.405 1.00 0.30 H new ATOM 0 HG12 ILE B 33 1.421 -2.095 10.480 1.00 0.30 H new ATOM 0 HG13 ILE B 33 1.762 -0.618 9.601 1.00 0.30 H new ATOM 0 HG21 ILE B 33 4.344 -3.088 10.579 1.00 0.44 H new ATOM 0 HG22 ILE B 33 4.816 -2.265 12.085 1.00 0.44 H new ATOM 0 HG23 ILE B 33 3.247 -3.097 11.980 1.00 0.44 H new ATOM 0 HD11 ILE B 33 1.797 -2.555 8.106 1.00 0.34 H new ATOM 0 HD12 ILE B 33 3.412 -1.814 8.204 1.00 0.34 H new ATOM 0 HD13 ILE B 33 3.066 -3.314 9.097 1.00 0.34 H new ATOM 1403 N VAL B 34 4.878 0.723 12.751 1.00 0.25 N ATOM 1404 CA VAL B 34 6.017 1.020 13.611 1.00 0.31 C ATOM 1405 C VAL B 34 5.607 1.942 14.757 1.00 0.37 C ATOM 1406 O VAL B 34 6.244 1.961 15.808 1.00 0.47 O ATOM 1407 CB VAL B 34 7.194 1.648 12.826 1.00 0.34 C ATOM 1408 CG1 VAL B 34 7.711 0.679 11.773 1.00 0.35 C ATOM 1409 CG2 VAL B 34 6.790 2.966 12.183 1.00 0.33 C ATOM 0 H VAL B 34 4.859 1.247 11.876 1.00 0.25 H new ATOM 0 HA VAL B 34 6.359 0.069 14.020 1.00 0.31 H new ATOM 0 HB VAL B 34 7.995 1.854 13.536 1.00 0.34 H new ATOM 0 HG11 VAL B 34 8.538 1.138 11.231 1.00 0.35 H new ATOM 0 HG12 VAL B 34 8.057 -0.234 12.257 1.00 0.35 H new ATOM 0 HG13 VAL B 34 6.909 0.438 11.075 1.00 0.35 H new ATOM 0 HG21 VAL B 34 7.639 3.381 11.639 1.00 0.33 H new ATOM 0 HG22 VAL B 34 5.965 2.796 11.492 1.00 0.33 H new ATOM 0 HG23 VAL B 34 6.477 3.667 12.956 1.00 0.33 H new ATOM 1413 N GLU B 35 4.528 2.687 14.547 1.00 0.35 N ATOM 1414 CA GLU B 35 3.984 3.580 15.565 1.00 0.46 C ATOM 1415 C GLU B 35 3.534 2.786 16.785 1.00 0.51 C ATOM 1416 O GLU B 35 3.854 3.132 17.919 1.00 0.62 O ATOM 1417 CB GLU B 35 2.803 4.361 14.981 1.00 0.51 C ATOM 1418 CG GLU B 35 2.193 5.381 15.923 1.00 0.70 C ATOM 1419 CD GLU B 35 1.024 6.104 15.292 1.00 1.49 C ATOM 1420 OE1 GLU B 35 1.254 7.064 14.528 1.00 2.19 O ATOM 1421 OE2 GLU B 35 -0.135 5.706 15.545 1.00 2.22 O ATOM 0 H GLU B 35 4.007 2.690 13.670 1.00 0.35 H new ATOM 0 HA GLU B 35 4.761 4.278 15.877 1.00 0.46 H new ATOM 0 HB2 GLU B 35 3.134 4.873 14.077 1.00 0.51 H new ATOM 0 HB3 GLU B 35 2.029 3.654 14.682 1.00 0.51 H new ATOM 0 HG2 GLU B 35 1.862 4.882 16.834 1.00 0.70 H new ATOM 0 HG3 GLU B 35 2.953 6.106 16.215 1.00 0.70 H new ATOM 1428 N LYS B 36 2.810 1.700 16.537 1.00 0.47 N ATOM 1429 CA LYS B 36 2.316 0.851 17.613 1.00 0.55 C ATOM 1430 C LYS B 36 3.325 -0.247 17.948 1.00 0.51 C ATOM 1431 O LYS B 36 3.022 -1.182 18.689 1.00 0.61 O ATOM 1432 CB LYS B 36 0.974 0.221 17.229 1.00 0.67 C ATOM 1433 CG LYS B 36 1.054 -0.669 15.997 1.00 0.71 C ATOM 1434 CD LYS B 36 -0.251 -1.405 15.733 1.00 0.98 C ATOM 1435 CE LYS B 36 -0.664 -2.262 16.921 1.00 1.42 C ATOM 1436 NZ LYS B 36 -1.768 -3.192 16.577 1.00 2.08 N ATOM 0 H LYS B 36 2.553 1.388 15.601 1.00 0.47 H new ATOM 0 HA LYS B 36 2.175 1.477 18.494 1.00 0.55 H new ATOM 0 HB2 LYS B 36 0.603 -0.367 18.069 1.00 0.67 H new ATOM 0 HB3 LYS B 36 0.247 1.013 17.049 1.00 0.67 H new ATOM 0 HG2 LYS B 36 1.309 -0.062 15.128 1.00 0.71 H new ATOM 0 HG3 LYS B 36 1.858 -1.394 16.126 1.00 0.71 H new ATOM 0 HD2 LYS B 36 -1.038 -0.683 15.514 1.00 0.98 H new ATOM 0 HD3 LYS B 36 -0.141 -2.035 14.850 1.00 0.98 H new ATOM 0 HE2 LYS B 36 0.195 -2.833 17.272 1.00 1.42 H new ATOM 0 HE3 LYS B 36 -0.976 -1.617 17.743 1.00 1.42 H new ATOM 0 HZ1 LYS B 36 -2.110 -3.659 17.441 1.00 2.08 H new ATOM 0 HZ2 LYS B 36 -2.547 -2.660 16.139 1.00 2.08 H new ATOM 0 HZ3 LYS B 36 -1.422 -3.910 15.909 1.00 2.08 H new ATOM 1450 N LYS B 37 4.530 -0.096 17.373 1.00 0.48 N ATOM 1451 CA LYS B 37 5.641 -1.050 17.511 1.00 0.55 C ATOM 1452 C LYS B 37 5.167 -2.504 17.463 1.00 0.59 C ATOM 1453 O LYS B 37 5.517 -3.318 18.319 1.00 0.76 O ATOM 1454 CB LYS B 37 6.472 -0.771 18.779 1.00 0.72 C ATOM 1455 CG LYS B 37 5.678 -0.740 20.079 1.00 1.19 C ATOM 1456 CD LYS B 37 6.584 -0.550 21.287 1.00 1.42 C ATOM 1457 CE LYS B 37 7.289 0.799 21.267 1.00 1.99 C ATOM 1458 NZ LYS B 37 6.336 1.934 21.372 1.00 2.60 N ATOM 0 H LYS B 37 4.762 0.707 16.789 1.00 0.48 H new ATOM 0 HA LYS B 37 6.291 -0.901 16.649 1.00 0.55 H new ATOM 0 HB2 LYS B 37 7.246 -1.534 18.862 1.00 0.72 H new ATOM 0 HB3 LYS B 37 6.980 0.186 18.659 1.00 0.72 H new ATOM 0 HG2 LYS B 37 4.948 0.069 20.041 1.00 1.19 H new ATOM 0 HG3 LYS B 37 5.119 -1.669 20.186 1.00 1.19 H new ATOM 0 HD2 LYS B 37 5.994 -0.637 22.199 1.00 1.42 H new ATOM 0 HD3 LYS B 37 7.327 -1.347 21.311 1.00 1.42 H new ATOM 0 HE2 LYS B 37 8.000 0.847 22.091 1.00 1.99 H new ATOM 0 HE3 LYS B 37 7.863 0.893 20.345 1.00 1.99 H new ATOM 0 HZ1 LYS B 37 6.863 2.817 21.525 1.00 2.60 H new ATOM 0 HZ2 LYS B 37 5.785 2.007 20.493 1.00 2.60 H new ATOM 0 HZ3 LYS B 37 5.691 1.773 22.172 1.00 2.60 H new ATOM 1472 N GLU B 38 4.392 -2.828 16.435 1.00 0.54 N ATOM 1473 CA GLU B 38 3.822 -4.161 16.295 1.00 0.69 C ATOM 1474 C GLU B 38 4.769 -5.045 15.502 1.00 0.69 C ATOM 1475 O GLU B 38 4.821 -6.260 15.691 1.00 1.03 O ATOM 1476 CB GLU B 38 2.467 -4.084 15.589 1.00 0.79 C ATOM 1477 CG GLU B 38 1.769 -5.426 15.448 1.00 1.35 C ATOM 1478 CD GLU B 38 0.505 -5.339 14.620 1.00 1.41 C ATOM 1479 OE1 GLU B 38 0.590 -5.478 13.383 1.00 1.86 O ATOM 1480 OE2 GLU B 38 -0.582 -5.138 15.200 1.00 2.11 O ATOM 0 H GLU B 38 4.144 -2.183 15.685 1.00 0.54 H new ATOM 0 HA GLU B 38 3.678 -4.590 17.287 1.00 0.69 H new ATOM 0 HB2 GLU B 38 1.818 -3.405 16.142 1.00 0.79 H new ATOM 0 HB3 GLU B 38 2.609 -3.653 14.598 1.00 0.79 H new ATOM 0 HG2 GLU B 38 2.452 -6.140 14.988 1.00 1.35 H new ATOM 0 HG3 GLU B 38 1.525 -5.810 16.438 1.00 1.35 H new ATOM 1487 N ILE B 39 5.526 -4.412 14.626 1.00 0.42 N ATOM 1488 CA ILE B 39 6.449 -5.122 13.757 1.00 0.43 C ATOM 1489 C ILE B 39 7.787 -5.328 14.468 1.00 0.48 C ATOM 1490 O ILE B 39 8.080 -4.659 15.464 1.00 0.52 O ATOM 1491 CB ILE B 39 6.649 -4.349 12.432 1.00 0.38 C ATOM 1492 CG1 ILE B 39 7.297 -5.239 11.371 1.00 0.46 C ATOM 1493 CG2 ILE B 39 7.480 -3.092 12.659 1.00 0.36 C ATOM 1494 CD1 ILE B 39 7.287 -4.636 9.985 1.00 0.47 C ATOM 0 H ILE B 39 5.520 -3.400 14.496 1.00 0.42 H new ATOM 0 HA ILE B 39 6.027 -6.099 13.521 1.00 0.43 H new ATOM 0 HB ILE B 39 5.667 -4.049 12.068 1.00 0.38 H new ATOM 0 HG12 ILE B 39 8.327 -5.444 11.661 1.00 0.46 H new ATOM 0 HG13 ILE B 39 6.777 -6.196 11.345 1.00 0.46 H new ATOM 0 HG21 ILE B 39 7.608 -2.565 11.714 1.00 0.36 H new ATOM 0 HG22 ILE B 39 6.970 -2.443 13.371 1.00 0.36 H new ATOM 0 HG23 ILE B 39 8.457 -3.368 13.055 1.00 0.36 H new ATOM 0 HD11 ILE B 39 7.763 -5.323 9.286 1.00 0.47 H new ATOM 0 HD12 ILE B 39 6.258 -4.457 9.674 1.00 0.47 H new ATOM 0 HD13 ILE B 39 7.833 -3.693 9.995 1.00 0.47 H new ATOM 1501 N SER B 40 8.579 -6.272 13.982 1.00 0.55 N ATOM 1502 CA SER B 40 9.873 -6.558 14.576 1.00 0.62 C ATOM 1503 C SER B 40 10.884 -5.490 14.170 1.00 0.53 C ATOM 1504 O SER B 40 10.681 -4.802 13.167 1.00 0.48 O ATOM 1505 CB SER B 40 10.358 -7.948 14.152 1.00 0.77 C ATOM 1506 OG SER B 40 11.549 -8.310 14.828 1.00 1.82 O ATOM 0 H SER B 40 8.346 -6.853 13.177 1.00 0.55 H new ATOM 0 HA SER B 40 9.772 -6.546 15.661 1.00 0.62 H new ATOM 0 HB2 SER B 40 9.582 -8.685 14.360 1.00 0.77 H new ATOM 0 HB3 SER B 40 10.530 -7.962 13.076 1.00 0.77 H new ATOM 0 HG SER B 40 11.832 -9.202 14.537 1.00 1.82 H new ATOM 1512 N GLU B 41 11.957 -5.349 14.943 1.00 0.59 N ATOM 1513 CA GLU B 41 12.958 -4.315 14.687 1.00 0.60 C ATOM 1514 C GLU B 41 13.472 -4.390 13.251 1.00 0.49 C ATOM 1515 O GLU B 41 13.567 -3.372 12.563 1.00 0.46 O ATOM 1516 CB GLU B 41 14.116 -4.449 15.674 1.00 0.78 C ATOM 1517 CG GLU B 41 13.695 -4.280 17.125 1.00 1.08 C ATOM 1518 CD GLU B 41 14.859 -4.402 18.083 1.00 1.44 C ATOM 1519 OE1 GLU B 41 15.503 -3.374 18.374 1.00 2.19 O ATOM 1520 OE2 GLU B 41 15.138 -5.526 18.549 1.00 1.99 O ATOM 0 H GLU B 41 12.157 -5.937 15.752 1.00 0.59 H new ATOM 0 HA GLU B 41 12.486 -3.342 14.824 1.00 0.60 H new ATOM 0 HB2 GLU B 41 14.579 -5.428 15.549 1.00 0.78 H new ATOM 0 HB3 GLU B 41 14.876 -3.705 15.435 1.00 0.78 H new ATOM 0 HG2 GLU B 41 13.224 -3.305 17.252 1.00 1.08 H new ATOM 0 HG3 GLU B 41 12.945 -5.031 17.372 1.00 1.08 H new ATOM 1527 N ASP B 42 13.768 -5.606 12.799 1.00 0.52 N ATOM 1528 CA ASP B 42 14.248 -5.831 11.438 1.00 0.51 C ATOM 1529 C ASP B 42 13.272 -5.259 10.419 1.00 0.43 C ATOM 1530 O ASP B 42 13.655 -4.480 9.547 1.00 0.47 O ATOM 1531 CB ASP B 42 14.435 -7.327 11.169 1.00 0.61 C ATOM 1532 CG ASP B 42 15.486 -7.959 12.054 1.00 1.49 C ATOM 1533 OD1 ASP B 42 16.682 -7.890 11.709 1.00 2.20 O ATOM 1534 OD2 ASP B 42 15.119 -8.540 13.100 1.00 2.29 O ATOM 0 H ASP B 42 13.683 -6.455 13.359 1.00 0.52 H new ATOM 0 HA ASP B 42 15.208 -5.324 11.340 1.00 0.51 H new ATOM 0 HB2 ASP B 42 13.485 -7.839 11.320 1.00 0.61 H new ATOM 0 HB3 ASP B 42 14.713 -7.471 10.125 1.00 0.61 H new ATOM 1539 N GLY B 43 12.006 -5.641 10.548 1.00 0.39 N ATOM 1540 CA GLY B 43 10.987 -5.186 9.622 1.00 0.37 C ATOM 1541 C GLY B 43 10.767 -3.687 9.685 1.00 0.34 C ATOM 1542 O GLY B 43 10.447 -3.059 8.674 1.00 0.34 O ATOM 0 H GLY B 43 11.666 -6.262 11.283 1.00 0.39 H new ATOM 0 HA2 GLY B 43 11.273 -5.465 8.608 1.00 0.37 H new ATOM 0 HA3 GLY B 43 10.049 -5.696 9.841 1.00 0.37 H new ATOM 1546 N ALA B 44 10.940 -3.114 10.869 1.00 0.33 N ATOM 1547 CA ALA B 44 10.785 -1.678 11.053 1.00 0.33 C ATOM 1548 C ALA B 44 11.811 -0.917 10.223 1.00 0.32 C ATOM 1549 O ALA B 44 11.479 0.064 9.555 1.00 0.31 O ATOM 1550 CB ALA B 44 10.910 -1.314 12.525 1.00 0.38 C ATOM 0 H ALA B 44 11.188 -3.623 11.717 1.00 0.33 H new ATOM 0 HA ALA B 44 9.790 -1.392 10.711 1.00 0.33 H new ATOM 0 HB1 ALA B 44 10.792 -0.237 12.645 1.00 0.38 H new ATOM 0 HB2 ALA B 44 10.137 -1.830 13.094 1.00 0.38 H new ATOM 0 HB3 ALA B 44 11.891 -1.614 12.892 1.00 0.38 H new ATOM 1556 N ASP B 45 13.054 -1.389 10.248 1.00 0.36 N ATOM 1557 CA ASP B 45 14.119 -0.782 9.454 1.00 0.38 C ATOM 1558 C ASP B 45 13.850 -0.964 7.969 1.00 0.36 C ATOM 1559 O ASP B 45 14.109 -0.065 7.166 1.00 0.37 O ATOM 1560 CB ASP B 45 15.483 -1.377 9.808 1.00 0.48 C ATOM 1561 CG ASP B 45 15.992 -0.915 11.155 1.00 1.11 C ATOM 1562 OD1 ASP B 45 16.204 0.306 11.332 1.00 1.81 O ATOM 1563 OD2 ASP B 45 16.208 -1.766 12.039 1.00 1.84 O ATOM 0 H ASP B 45 13.349 -2.189 10.808 1.00 0.36 H new ATOM 0 HA ASP B 45 14.136 0.283 9.687 1.00 0.38 H new ATOM 0 HB2 ASP B 45 15.412 -2.465 9.805 1.00 0.48 H new ATOM 0 HB3 ASP B 45 16.205 -1.103 9.038 1.00 0.48 H new ATOM 1568 N SER B 46 13.323 -2.128 7.609 1.00 0.37 N ATOM 1569 CA SER B 46 12.960 -2.411 6.228 1.00 0.40 C ATOM 1570 C SER B 46 11.943 -1.388 5.729 1.00 0.36 C ATOM 1571 O SER B 46 12.063 -0.870 4.621 1.00 0.38 O ATOM 1572 CB SER B 46 12.379 -3.821 6.120 1.00 0.50 C ATOM 1573 OG SER B 46 13.212 -4.765 6.767 1.00 0.98 O ATOM 0 H SER B 46 13.137 -2.893 8.258 1.00 0.37 H new ATOM 0 HA SER B 46 13.855 -2.346 5.609 1.00 0.40 H new ATOM 0 HB2 SER B 46 11.384 -3.843 6.565 1.00 0.50 H new ATOM 0 HB3 SER B 46 12.264 -4.091 5.070 1.00 0.50 H new ATOM 0 HG SER B 46 13.812 -5.176 6.110 1.00 0.98 H new ATOM 1579 N LEU B 47 10.958 -1.083 6.567 1.00 0.32 N ATOM 1580 CA LEU B 47 9.925 -0.117 6.214 1.00 0.30 C ATOM 1581 C LEU B 47 10.504 1.283 6.059 1.00 0.27 C ATOM 1582 O LEU B 47 9.978 2.096 5.304 1.00 0.28 O ATOM 1583 CB LEU B 47 8.811 -0.107 7.265 1.00 0.30 C ATOM 1584 CG LEU B 47 7.938 -1.363 7.300 1.00 0.35 C ATOM 1585 CD1 LEU B 47 6.884 -1.250 8.392 1.00 0.39 C ATOM 1586 CD2 LEU B 47 7.280 -1.589 5.946 1.00 0.41 C ATOM 0 H LEU B 47 10.854 -1.491 7.496 1.00 0.32 H new ATOM 0 HA LEU B 47 9.506 -0.422 5.255 1.00 0.30 H new ATOM 0 HB2 LEU B 47 9.262 0.030 8.248 1.00 0.30 H new ATOM 0 HB3 LEU B 47 8.171 0.756 7.084 1.00 0.30 H new ATOM 0 HG LEU B 47 8.574 -2.220 7.523 1.00 0.35 H new ATOM 0 HD11 LEU B 47 6.272 -2.152 8.402 1.00 0.39 H new ATOM 0 HD12 LEU B 47 7.373 -1.132 9.359 1.00 0.39 H new ATOM 0 HD13 LEU B 47 6.251 -0.384 8.198 1.00 0.39 H new ATOM 0 HD21 LEU B 47 6.662 -2.486 5.987 1.00 0.41 H new ATOM 0 HD22 LEU B 47 6.657 -0.730 5.697 1.00 0.41 H new ATOM 0 HD23 LEU B 47 8.049 -1.713 5.184 1.00 0.41 H new ATOM 1598 N ASN B 48 11.592 1.558 6.765 1.00 0.26 N ATOM 1599 CA ASN B 48 12.230 2.868 6.695 1.00 0.26 C ATOM 1600 C ASN B 48 12.859 3.089 5.326 1.00 0.27 C ATOM 1601 O ASN B 48 12.517 4.047 4.630 1.00 0.32 O ATOM 1602 CB ASN B 48 13.295 3.028 7.785 1.00 0.28 C ATOM 1603 CG ASN B 48 12.721 3.026 9.191 1.00 0.33 C ATOM 1604 OD1 ASN B 48 11.496 3.506 9.344 1.00 0.48 O flip ATOM 1605 ND2 ASN B 48 13.381 2.602 10.138 1.00 0.40 N flip ATOM 0 H ASN B 48 12.051 0.896 7.391 1.00 0.26 H new ATOM 0 HA ASN B 48 11.455 3.617 6.856 1.00 0.26 H new ATOM 0 HB2 ASN B 48 14.021 2.220 7.695 1.00 0.28 H new ATOM 0 HB3 ASN B 48 13.835 3.961 7.622 1.00 0.28 H new ATOM 0 HD21 ASN B 48 14.322 2.240 9.982 1.00 0.40 H new ATOM 0 HD22 ASN B 48 12.988 2.613 11.079 1.00 0.40 H new ATOM 1612 N VAL B 49 13.763 2.195 4.930 1.00 0.27 N ATOM 1613 CA VAL B 49 14.423 2.315 3.633 1.00 0.29 C ATOM 1614 C VAL B 49 13.409 2.167 2.501 1.00 0.29 C ATOM 1615 O VAL B 49 13.513 2.831 1.467 1.00 0.32 O ATOM 1616 CB VAL B 49 15.576 1.292 3.459 1.00 0.32 C ATOM 1617 CG1 VAL B 49 15.077 -0.138 3.567 1.00 0.34 C ATOM 1618 CG2 VAL B 49 16.293 1.506 2.131 1.00 0.36 C ATOM 0 H VAL B 49 14.053 1.388 5.482 1.00 0.27 H new ATOM 0 HA VAL B 49 14.865 3.310 3.592 1.00 0.29 H new ATOM 0 HB VAL B 49 16.285 1.459 4.270 1.00 0.32 H new ATOM 0 HG11 VAL B 49 15.913 -0.826 3.440 1.00 0.34 H new ATOM 0 HG12 VAL B 49 14.626 -0.293 4.547 1.00 0.34 H new ATOM 0 HG13 VAL B 49 14.334 -0.323 2.792 1.00 0.34 H new ATOM 0 HG21 VAL B 49 17.098 0.778 2.030 1.00 0.36 H new ATOM 0 HG22 VAL B 49 15.586 1.381 1.311 1.00 0.36 H new ATOM 0 HG23 VAL B 49 16.709 2.513 2.100 1.00 0.36 H new ATOM 1622 N ALA B 50 12.409 1.318 2.712 1.00 0.30 N ATOM 1623 CA ALA B 50 11.337 1.151 1.742 1.00 0.34 C ATOM 1624 C ALA B 50 10.590 2.461 1.553 1.00 0.33 C ATOM 1625 O ALA B 50 10.240 2.829 0.437 1.00 0.37 O ATOM 1626 CB ALA B 50 10.374 0.059 2.182 1.00 0.37 C ATOM 0 H ALA B 50 12.320 0.736 3.545 1.00 0.30 H new ATOM 0 HA ALA B 50 11.781 0.855 0.791 1.00 0.34 H new ATOM 0 HB1 ALA B 50 9.582 -0.047 1.441 1.00 0.37 H new ATOM 0 HB2 ALA B 50 10.912 -0.884 2.276 1.00 0.37 H new ATOM 0 HB3 ALA B 50 9.937 0.325 3.145 1.00 0.37 H new ATOM 1632 N MET B 51 10.380 3.175 2.653 1.00 0.34 N ATOM 1633 CA MET B 51 9.628 4.420 2.632 1.00 0.39 C ATOM 1634 C MET B 51 10.386 5.495 1.870 1.00 0.31 C ATOM 1635 O MET B 51 9.786 6.287 1.142 1.00 0.30 O ATOM 1636 CB MET B 51 9.340 4.880 4.055 1.00 0.52 C ATOM 1637 CG MET B 51 8.225 5.905 4.154 1.00 0.62 C ATOM 1638 SD MET B 51 7.388 5.838 5.746 1.00 0.65 S ATOM 1639 CE MET B 51 6.980 4.093 5.813 1.00 0.41 C ATOM 0 H MET B 51 10.724 2.909 3.576 1.00 0.34 H new ATOM 0 HA MET B 51 8.682 4.245 2.120 1.00 0.39 H new ATOM 0 HB2 MET B 51 9.078 4.013 4.661 1.00 0.52 H new ATOM 0 HB3 MET B 51 10.249 5.304 4.481 1.00 0.52 H new ATOM 0 HG2 MET B 51 8.635 6.903 4.002 1.00 0.62 H new ATOM 0 HG3 MET B 51 7.502 5.733 3.357 1.00 0.62 H new ATOM 0 HE1 MET B 51 6.162 3.937 6.516 1.00 0.41 H new ATOM 0 HE2 MET B 51 6.678 3.752 4.823 1.00 0.41 H new ATOM 0 HE3 MET B 51 7.852 3.528 6.141 1.00 0.41 H new ATOM 1649 N ASP B 52 11.704 5.516 2.035 1.00 0.31 N ATOM 1650 CA ASP B 52 12.549 6.425 1.269 1.00 0.32 C ATOM 1651 C ASP B 52 12.393 6.143 -0.215 1.00 0.28 C ATOM 1652 O ASP B 52 12.319 7.059 -1.034 1.00 0.30 O ATOM 1653 CB ASP B 52 14.023 6.279 1.661 1.00 0.42 C ATOM 1654 CG ASP B 52 14.326 6.812 3.046 1.00 1.16 C ATOM 1655 OD1 ASP B 52 14.048 8.002 3.305 1.00 1.99 O ATOM 1656 OD2 ASP B 52 14.873 6.054 3.873 1.00 1.84 O ATOM 0 H ASP B 52 12.209 4.917 2.689 1.00 0.31 H new ATOM 0 HA ASP B 52 12.233 7.445 1.490 1.00 0.32 H new ATOM 0 HB2 ASP B 52 14.302 5.226 1.614 1.00 0.42 H new ATOM 0 HB3 ASP B 52 14.640 6.805 0.933 1.00 0.42 H new ATOM 1661 N CYS B 53 12.320 4.863 -0.542 1.00 0.27 N ATOM 1662 CA CYS B 53 12.164 4.426 -1.918 1.00 0.27 C ATOM 1663 C CYS B 53 10.773 4.767 -2.448 1.00 0.28 C ATOM 1664 O CYS B 53 10.635 5.229 -3.576 1.00 0.36 O ATOM 1665 CB CYS B 53 12.421 2.927 -2.010 1.00 0.36 C ATOM 1666 SG CYS B 53 14.050 2.436 -1.403 1.00 1.05 S ATOM 0 H CYS B 53 12.367 4.102 0.136 1.00 0.27 H new ATOM 0 HA CYS B 53 12.891 4.952 -2.537 1.00 0.27 H new ATOM 0 HB2 CYS B 53 11.656 2.400 -1.440 1.00 0.36 H new ATOM 0 HB3 CYS B 53 12.319 2.612 -3.049 1.00 0.36 H new ATOM 0 HG CYS B 53 14.038 2.406 -0.103 1.00 1.05 H new ATOM 1672 N ILE B 54 9.746 4.543 -1.628 1.00 0.26 N ATOM 1673 CA ILE B 54 8.377 4.904 -1.996 1.00 0.29 C ATOM 1674 C ILE B 54 8.295 6.399 -2.293 1.00 0.30 C ATOM 1675 O ILE B 54 7.746 6.819 -3.314 1.00 0.33 O ATOM 1676 CB ILE B 54 7.365 4.561 -0.872 1.00 0.29 C ATOM 1677 CG1 ILE B 54 7.426 3.070 -0.520 1.00 0.31 C ATOM 1678 CG2 ILE B 54 5.950 4.941 -1.296 1.00 0.33 C ATOM 1679 CD1 ILE B 54 6.605 2.694 0.700 1.00 0.33 C ATOM 0 H ILE B 54 9.836 4.114 -0.707 1.00 0.26 H new ATOM 0 HA ILE B 54 8.117 4.324 -2.882 1.00 0.29 H new ATOM 0 HB ILE B 54 7.635 5.136 0.014 1.00 0.29 H new ATOM 0 HG12 ILE B 54 7.077 2.490 -1.374 1.00 0.31 H new ATOM 0 HG13 ILE B 54 8.465 2.789 -0.348 1.00 0.31 H new ATOM 0 HG21 ILE B 54 5.252 4.694 -0.496 1.00 0.33 H new ATOM 0 HG22 ILE B 54 5.906 6.011 -1.498 1.00 0.33 H new ATOM 0 HG23 ILE B 54 5.680 4.390 -2.197 1.00 0.33 H new ATOM 0 HD11 ILE B 54 6.698 1.624 0.886 1.00 0.33 H new ATOM 0 HD12 ILE B 54 6.968 3.246 1.567 1.00 0.33 H new ATOM 0 HD13 ILE B 54 5.558 2.942 0.525 1.00 0.33 H new ATOM 1686 N SER B 55 8.873 7.190 -1.398 1.00 0.30 N ATOM 1687 CA SER B 55 8.884 8.637 -1.535 1.00 0.36 C ATOM 1688 C SER B 55 9.637 9.062 -2.796 1.00 0.38 C ATOM 1689 O SER B 55 9.183 9.935 -3.538 1.00 0.41 O ATOM 1690 CB SER B 55 9.521 9.261 -0.295 1.00 0.40 C ATOM 1691 OG SER B 55 8.877 8.812 0.886 1.00 0.80 O ATOM 0 H SER B 55 9.345 6.847 -0.561 1.00 0.30 H new ATOM 0 HA SER B 55 7.857 8.989 -1.628 1.00 0.36 H new ATOM 0 HB2 SER B 55 10.580 9.004 -0.257 1.00 0.40 H new ATOM 0 HB3 SER B 55 9.459 10.347 -0.357 1.00 0.40 H new ATOM 0 HG SER B 55 9.249 7.945 1.152 1.00 0.80 H new ATOM 1697 N GLU B 56 10.776 8.422 -3.040 1.00 0.39 N ATOM 1698 CA GLU B 56 11.590 8.705 -4.218 1.00 0.48 C ATOM 1699 C GLU B 56 10.855 8.306 -5.499 1.00 0.42 C ATOM 1700 O GLU B 56 10.918 9.009 -6.509 1.00 0.45 O ATOM 1701 CB GLU B 56 12.921 7.952 -4.115 1.00 0.59 C ATOM 1702 CG GLU B 56 13.816 8.098 -5.333 1.00 0.82 C ATOM 1703 CD GLU B 56 15.127 7.355 -5.182 1.00 1.81 C ATOM 1704 OE1 GLU B 56 15.110 6.110 -5.118 1.00 2.66 O ATOM 1705 OE2 GLU B 56 16.185 8.012 -5.128 1.00 2.38 O ATOM 0 H GLU B 56 11.159 7.698 -2.432 1.00 0.39 H new ATOM 0 HA GLU B 56 11.782 9.777 -4.260 1.00 0.48 H new ATOM 0 HB2 GLU B 56 13.460 8.309 -3.237 1.00 0.59 H new ATOM 0 HB3 GLU B 56 12.715 6.894 -3.954 1.00 0.59 H new ATOM 0 HG2 GLU B 56 13.291 7.726 -6.213 1.00 0.82 H new ATOM 0 HG3 GLU B 56 14.019 9.155 -5.506 1.00 0.82 H new ATOM 1712 N ALA B 57 10.153 7.182 -5.440 1.00 0.38 N ATOM 1713 CA ALA B 57 9.450 6.646 -6.598 1.00 0.39 C ATOM 1714 C ALA B 57 8.289 7.539 -7.019 1.00 0.33 C ATOM 1715 O ALA B 57 8.178 7.914 -8.187 1.00 0.38 O ATOM 1716 CB ALA B 57 8.952 5.239 -6.301 1.00 0.41 C ATOM 0 H ALA B 57 10.055 6.620 -4.595 1.00 0.38 H new ATOM 0 HA ALA B 57 10.155 6.612 -7.428 1.00 0.39 H new ATOM 0 HB1 ALA B 57 8.428 4.847 -7.173 1.00 0.41 H new ATOM 0 HB2 ALA B 57 9.800 4.595 -6.067 1.00 0.41 H new ATOM 0 HB3 ALA B 57 8.271 5.266 -5.450 1.00 0.41 H new ATOM 1722 N PHE B 58 7.432 7.885 -6.065 1.00 0.28 N ATOM 1723 CA PHE B 58 6.228 8.654 -6.364 1.00 0.27 C ATOM 1724 C PHE B 58 6.505 10.153 -6.416 1.00 0.30 C ATOM 1725 O PHE B 58 5.676 10.931 -6.886 1.00 0.38 O ATOM 1726 CB PHE B 58 5.132 8.359 -5.337 1.00 0.27 C ATOM 1727 CG PHE B 58 4.521 6.993 -5.470 1.00 0.25 C ATOM 1728 CD1 PHE B 58 5.164 5.872 -4.970 1.00 1.24 C ATOM 1729 CD2 PHE B 58 3.297 6.833 -6.095 1.00 1.18 C ATOM 1730 CE1 PHE B 58 4.595 4.618 -5.090 1.00 1.21 C ATOM 1731 CE2 PHE B 58 2.721 5.584 -6.219 1.00 1.22 C ATOM 1732 CZ PHE B 58 3.372 4.475 -5.716 1.00 0.29 C ATOM 0 H PHE B 58 7.547 7.646 -5.080 1.00 0.28 H new ATOM 0 HA PHE B 58 5.887 8.345 -7.352 1.00 0.27 H new ATOM 0 HB2 PHE B 58 5.549 8.463 -4.335 1.00 0.27 H new ATOM 0 HB3 PHE B 58 4.346 9.108 -5.434 1.00 0.27 H new ATOM 0 HD1 PHE B 58 6.121 5.979 -4.481 1.00 1.24 H new ATOM 0 HD2 PHE B 58 2.785 7.697 -6.492 1.00 1.18 H new ATOM 0 HE1 PHE B 58 5.105 3.752 -4.695 1.00 1.21 H new ATOM 0 HE2 PHE B 58 1.764 5.475 -6.708 1.00 1.22 H new ATOM 0 HZ PHE B 58 2.925 3.496 -5.812 1.00 0.29 H new ATOM 1742 N GLY B 59 7.672 10.552 -5.923 1.00 0.33 N ATOM 1743 CA GLY B 59 8.074 11.945 -5.993 1.00 0.38 C ATOM 1744 C GLY B 59 7.416 12.802 -4.932 1.00 0.37 C ATOM 1745 O GLY B 59 6.825 13.837 -5.239 1.00 0.42 O ATOM 0 H GLY B 59 8.349 9.934 -5.475 1.00 0.33 H new ATOM 0 HA2 GLY B 59 9.157 12.011 -5.886 1.00 0.38 H new ATOM 0 HA3 GLY B 59 7.826 12.341 -6.978 1.00 0.38 H new ATOM 1749 N PHE B 60 7.517 12.376 -3.682 1.00 0.35 N ATOM 1750 CA PHE B 60 6.944 13.124 -2.572 1.00 0.39 C ATOM 1751 C PHE B 60 7.764 12.882 -1.313 1.00 0.39 C ATOM 1752 O PHE B 60 8.600 11.981 -1.276 1.00 0.42 O ATOM 1753 CB PHE B 60 5.474 12.729 -2.346 1.00 0.40 C ATOM 1754 CG PHE B 60 5.273 11.392 -1.678 1.00 0.30 C ATOM 1755 CD1 PHE B 60 5.657 10.216 -2.302 1.00 1.19 C ATOM 1756 CD2 PHE B 60 4.690 11.317 -0.422 1.00 1.21 C ATOM 1757 CE1 PHE B 60 5.465 8.994 -1.686 1.00 1.23 C ATOM 1758 CE2 PHE B 60 4.496 10.097 0.198 1.00 1.19 C ATOM 1759 CZ PHE B 60 4.885 8.934 -0.434 1.00 0.33 C ATOM 0 H PHE B 60 7.991 11.515 -3.410 1.00 0.35 H new ATOM 0 HA PHE B 60 6.970 14.186 -2.814 1.00 0.39 H new ATOM 0 HB2 PHE B 60 4.995 13.498 -1.740 1.00 0.40 H new ATOM 0 HB3 PHE B 60 4.963 12.719 -3.309 1.00 0.40 H new ATOM 0 HD1 PHE B 60 6.112 10.255 -3.281 1.00 1.19 H new ATOM 0 HD2 PHE B 60 4.384 12.224 0.078 1.00 1.21 H new ATOM 0 HE1 PHE B 60 5.769 8.085 -2.184 1.00 1.23 H new ATOM 0 HE2 PHE B 60 4.040 10.054 1.176 1.00 1.19 H new ATOM 0 HZ PHE B 60 4.736 7.979 0.049 1.00 0.33 H new ATOM 1769 N GLU B 61 7.540 13.696 -0.292 1.00 0.47 N ATOM 1770 CA GLU B 61 8.254 13.549 0.969 1.00 0.55 C ATOM 1771 C GLU B 61 7.381 12.829 1.988 1.00 0.50 C ATOM 1772 O GLU B 61 6.159 12.835 1.859 1.00 0.47 O ATOM 1773 CB GLU B 61 8.670 14.918 1.513 1.00 0.70 C ATOM 1774 CG GLU B 61 9.544 15.718 0.561 1.00 0.80 C ATOM 1775 CD GLU B 61 10.798 14.975 0.152 1.00 1.48 C ATOM 1776 OE1 GLU B 61 11.691 14.792 1.004 1.00 2.06 O ATOM 1777 OE2 GLU B 61 10.895 14.569 -1.027 1.00 2.33 O ATOM 0 H GLU B 61 6.870 14.465 -0.311 1.00 0.47 H new ATOM 0 HA GLU B 61 9.151 12.957 0.789 1.00 0.55 H new ATOM 0 HB2 GLU B 61 7.774 15.495 1.740 1.00 0.70 H new ATOM 0 HB3 GLU B 61 9.206 14.778 2.452 1.00 0.70 H new ATOM 0 HG2 GLU B 61 8.968 15.968 -0.330 1.00 0.80 H new ATOM 0 HG3 GLU B 61 9.823 16.659 1.035 1.00 0.80 H new ATOM 1784 N ARG B 62 7.993 12.222 2.997 1.00 0.53 N ATOM 1785 CA ARG B 62 7.244 11.452 3.987 1.00 0.53 C ATOM 1786 C ARG B 62 6.191 12.308 4.673 1.00 0.52 C ATOM 1787 O ARG B 62 5.012 11.999 4.599 1.00 0.64 O ATOM 1788 CB ARG B 62 8.182 10.833 5.025 1.00 0.62 C ATOM 1789 CG ARG B 62 7.460 10.000 6.069 1.00 1.40 C ATOM 1790 CD ARG B 62 8.432 9.318 7.014 1.00 1.46 C ATOM 1791 NE ARG B 62 7.738 8.581 8.068 1.00 2.25 N ATOM 1792 CZ ARG B 62 8.318 7.677 8.854 1.00 2.60 C ATOM 1793 NH1 ARG B 62 9.599 7.369 8.685 1.00 2.13 N ATOM 1794 NH2 ARG B 62 7.612 7.073 9.803 1.00 3.67 N ATOM 0 H ARG B 62 9.001 12.246 3.153 1.00 0.53 H new ATOM 0 HA ARG B 62 6.735 10.647 3.456 1.00 0.53 H new ATOM 0 HB2 ARG B 62 8.914 10.207 4.515 1.00 0.62 H new ATOM 0 HB3 ARG B 62 8.735 11.629 5.524 1.00 0.62 H new ATOM 0 HG2 ARG B 62 6.785 10.637 6.640 1.00 1.40 H new ATOM 0 HG3 ARG B 62 6.846 9.248 5.573 1.00 1.40 H new ATOM 0 HD2 ARG B 62 9.067 8.635 6.451 1.00 1.46 H new ATOM 0 HD3 ARG B 62 9.087 10.065 7.463 1.00 1.46 H new ATOM 0 HE ARG B 62 6.746 8.772 8.210 1.00 2.25 H new ATOM 0 HH11 ARG B 62 10.141 7.826 7.951 1.00 2.13 H new ATOM 0 HH12 ARG B 62 10.041 6.676 9.289 1.00 2.13 H new ATOM 0 HH21 ARG B 62 6.626 7.302 9.929 1.00 3.67 H new ATOM 0 HH22 ARG B 62 8.056 6.380 10.406 1.00 3.67 H new ATOM 1808 N GLU B 63 6.607 13.408 5.292 1.00 0.57 N ATOM 1809 CA GLU B 63 5.689 14.257 6.055 1.00 0.63 C ATOM 1810 C GLU B 63 4.586 14.838 5.161 1.00 0.62 C ATOM 1811 O GLU B 63 3.557 15.311 5.650 1.00 0.74 O ATOM 1812 CB GLU B 63 6.470 15.378 6.749 1.00 0.73 C ATOM 1813 CG GLU B 63 5.636 16.219 7.706 1.00 1.69 C ATOM 1814 CD GLU B 63 4.941 15.386 8.766 1.00 2.52 C ATOM 1815 OE1 GLU B 63 5.636 14.674 9.521 1.00 3.19 O ATOM 1816 OE2 GLU B 63 3.694 15.427 8.842 1.00 3.12 O ATOM 0 H GLU B 63 7.573 13.735 5.282 1.00 0.57 H new ATOM 0 HA GLU B 63 5.204 13.640 6.811 1.00 0.63 H new ATOM 0 HB2 GLU B 63 7.302 14.939 7.299 1.00 0.73 H new ATOM 0 HB3 GLU B 63 6.899 16.031 5.989 1.00 0.73 H new ATOM 0 HG2 GLU B 63 6.278 16.954 8.191 1.00 1.69 H new ATOM 0 HG3 GLU B 63 4.889 16.774 7.139 1.00 1.69 H new ATOM 1823 N ALA B 64 4.788 14.773 3.850 1.00 0.55 N ATOM 1824 CA ALA B 64 3.798 15.263 2.901 1.00 0.59 C ATOM 1825 C ALA B 64 2.541 14.395 2.918 1.00 0.53 C ATOM 1826 O ALA B 64 1.484 14.825 2.459 1.00 0.56 O ATOM 1827 CB ALA B 64 4.384 15.321 1.499 1.00 0.66 C ATOM 0 H ALA B 64 5.628 14.386 3.421 1.00 0.55 H new ATOM 0 HA ALA B 64 3.516 16.272 3.203 1.00 0.59 H new ATOM 0 HB1 ALA B 64 3.629 15.689 0.804 1.00 0.66 H new ATOM 0 HB2 ALA B 64 5.243 15.992 1.491 1.00 0.66 H new ATOM 0 HB3 ALA B 64 4.700 14.323 1.195 1.00 0.66 H new ATOM 1833 N VAL B 65 2.653 13.180 3.459 1.00 0.50 N ATOM 1834 CA VAL B 65 1.502 12.288 3.577 1.00 0.46 C ATOM 1835 C VAL B 65 0.398 12.942 4.410 1.00 0.52 C ATOM 1836 O VAL B 65 -0.791 12.767 4.135 1.00 0.53 O ATOM 1837 CB VAL B 65 1.885 10.913 4.190 1.00 0.46 C ATOM 1838 CG1 VAL B 65 2.526 11.063 5.558 1.00 0.51 C ATOM 1839 CG2 VAL B 65 0.677 10.002 4.288 1.00 0.50 C ATOM 0 H VAL B 65 3.525 12.794 3.820 1.00 0.50 H new ATOM 0 HA VAL B 65 1.134 12.108 2.567 1.00 0.46 H new ATOM 0 HB VAL B 65 2.616 10.462 3.518 1.00 0.46 H new ATOM 0 HG11 VAL B 65 2.779 10.078 5.951 1.00 0.51 H new ATOM 0 HG12 VAL B 65 3.432 11.663 5.471 1.00 0.51 H new ATOM 0 HG13 VAL B 65 1.828 11.556 6.235 1.00 0.51 H new ATOM 0 HG21 VAL B 65 0.976 9.047 4.721 1.00 0.50 H new ATOM 0 HG22 VAL B 65 -0.079 10.467 4.921 1.00 0.50 H new ATOM 0 HG23 VAL B 65 0.265 9.836 3.293 1.00 0.50 H new ATOM 1843 N SER B 66 0.804 13.731 5.398 1.00 0.62 N ATOM 1844 CA SER B 66 -0.133 14.435 6.255 1.00 0.74 C ATOM 1845 C SER B 66 -0.934 15.458 5.453 1.00 0.75 C ATOM 1846 O SER B 66 -2.092 15.744 5.766 1.00 0.83 O ATOM 1847 CB SER B 66 0.626 15.123 7.388 1.00 0.88 C ATOM 1848 OG SER B 66 1.485 14.206 8.048 1.00 1.63 O ATOM 0 H SER B 66 1.785 13.898 5.624 1.00 0.62 H new ATOM 0 HA SER B 66 -0.833 13.715 6.679 1.00 0.74 H new ATOM 0 HB2 SER B 66 1.210 15.953 6.990 1.00 0.88 H new ATOM 0 HB3 SER B 66 -0.081 15.545 8.102 1.00 0.88 H new ATOM 0 HG SER B 66 2.072 14.693 8.663 1.00 1.63 H new ATOM 1854 N GLY B 67 -0.314 15.992 4.408 1.00 0.71 N ATOM 1855 CA GLY B 67 -0.984 16.941 3.546 1.00 0.74 C ATOM 1856 C GLY B 67 -1.818 16.250 2.488 1.00 0.69 C ATOM 1857 O GLY B 67 -2.950 16.651 2.220 1.00 0.74 O ATOM 0 H GLY B 67 0.648 15.781 4.143 1.00 0.71 H new ATOM 0 HA2 GLY B 67 -1.623 17.589 4.146 1.00 0.74 H new ATOM 0 HA3 GLY B 67 -0.244 17.580 3.065 1.00 0.74 H new ATOM 1861 N ILE B 68 -1.258 15.199 1.897 1.00 0.61 N ATOM 1862 CA ILE B 68 -1.955 14.423 0.873 1.00 0.58 C ATOM 1863 C ILE B 68 -3.246 13.830 1.433 1.00 0.62 C ATOM 1864 O ILE B 68 -4.313 13.952 0.827 1.00 0.70 O ATOM 1865 CB ILE B 68 -1.067 13.285 0.323 1.00 0.50 C ATOM 1866 CG1 ILE B 68 0.218 13.857 -0.284 1.00 0.49 C ATOM 1867 CG2 ILE B 68 -1.827 12.468 -0.715 1.00 0.49 C ATOM 1868 CD1 ILE B 68 1.209 12.799 -0.721 1.00 0.45 C ATOM 0 H ILE B 68 -0.319 14.863 2.110 1.00 0.61 H new ATOM 0 HA ILE B 68 -2.192 15.105 0.056 1.00 0.58 H new ATOM 0 HB ILE B 68 -0.798 12.627 1.150 1.00 0.50 H new ATOM 0 HG12 ILE B 68 -0.041 14.476 -1.143 1.00 0.49 H new ATOM 0 HG13 ILE B 68 0.695 14.509 0.447 1.00 0.49 H new ATOM 0 HG21 ILE B 68 -1.186 11.671 -1.091 1.00 0.49 H new ATOM 0 HG22 ILE B 68 -2.715 12.033 -0.257 1.00 0.49 H new ATOM 0 HG23 ILE B 68 -2.124 13.115 -1.540 1.00 0.49 H new ATOM 0 HD11 ILE B 68 2.093 13.279 -1.140 1.00 0.45 H new ATOM 0 HD12 ILE B 68 1.498 12.194 0.138 1.00 0.45 H new ATOM 0 HD13 ILE B 68 0.750 12.161 -1.476 1.00 0.45 H new ATOM 1875 N LEU B 69 -3.151 13.222 2.612 1.00 0.61 N ATOM 1876 CA LEU B 69 -4.317 12.631 3.261 1.00 0.66 C ATOM 1877 C LEU B 69 -5.185 13.704 3.903 1.00 0.84 C ATOM 1878 O LEU B 69 -6.171 13.402 4.565 1.00 1.13 O ATOM 1879 CB LEU B 69 -3.895 11.600 4.309 1.00 0.61 C ATOM 1880 CG LEU B 69 -3.177 10.368 3.757 1.00 0.46 C ATOM 1881 CD1 LEU B 69 -2.870 9.386 4.875 1.00 0.49 C ATOM 1882 CD2 LEU B 69 -4.014 9.701 2.674 1.00 0.45 C ATOM 0 H LEU B 69 -2.281 13.126 3.136 1.00 0.61 H new ATOM 0 HA LEU B 69 -4.902 12.126 2.493 1.00 0.66 H new ATOM 0 HB2 LEU B 69 -3.242 12.088 5.033 1.00 0.61 H new ATOM 0 HB3 LEU B 69 -4.782 11.272 4.850 1.00 0.61 H new ATOM 0 HG LEU B 69 -2.235 10.689 3.313 1.00 0.46 H new ATOM 0 HD11 LEU B 69 -2.359 8.515 4.464 1.00 0.49 H new ATOM 0 HD12 LEU B 69 -2.230 9.866 5.616 1.00 0.49 H new ATOM 0 HD13 LEU B 69 -3.800 9.071 5.348 1.00 0.49 H new ATOM 0 HD21 LEU B 69 -3.486 8.826 2.293 1.00 0.45 H new ATOM 0 HD22 LEU B 69 -4.972 9.393 3.093 1.00 0.45 H new ATOM 0 HD23 LEU B 69 -4.183 10.405 1.860 1.00 0.45 H new ATOM 1894 N GLY B 70 -4.799 14.955 3.717 1.00 0.79 N ATOM 1895 CA GLY B 70 -5.624 16.056 4.156 1.00 0.93 C ATOM 1896 C GLY B 70 -6.443 16.605 3.008 1.00 0.98 C ATOM 1897 O GLY B 70 -7.545 17.114 3.203 1.00 1.24 O ATOM 0 H GLY B 70 -3.925 15.228 3.268 1.00 0.79 H new ATOM 0 HA2 GLY B 70 -6.287 15.724 4.955 1.00 0.93 H new ATOM 0 HA3 GLY B 70 -4.996 16.845 4.570 1.00 0.93 H new ATOM 1901 N LYS B 71 -5.895 16.487 1.803 1.00 0.86 N ATOM 1902 CA LYS B 71 -6.573 16.940 0.597 1.00 0.97 C ATOM 1903 C LYS B 71 -7.507 15.856 0.078 1.00 0.98 C ATOM 1904 O LYS B 71 -8.644 16.132 -0.312 1.00 1.25 O ATOM 1905 CB LYS B 71 -5.554 17.305 -0.488 1.00 1.11 C ATOM 1906 CG LYS B 71 -4.549 18.365 -0.063 1.00 1.68 C ATOM 1907 CD LYS B 71 -5.231 19.665 0.327 1.00 2.11 C ATOM 1908 CE LYS B 71 -4.219 20.722 0.738 1.00 2.60 C ATOM 1909 NZ LYS B 71 -3.408 20.293 1.910 1.00 3.15 N ATOM 0 H LYS B 71 -4.976 16.078 1.637 1.00 0.86 H new ATOM 0 HA LYS B 71 -7.157 17.826 0.846 1.00 0.97 H new ATOM 0 HB2 LYS B 71 -5.014 16.405 -0.782 1.00 1.11 H new ATOM 0 HB3 LYS B 71 -6.089 17.659 -1.370 1.00 1.11 H new ATOM 0 HG2 LYS B 71 -3.964 17.995 0.779 1.00 1.68 H new ATOM 0 HG3 LYS B 71 -3.851 18.551 -0.879 1.00 1.68 H new ATOM 0 HD2 LYS B 71 -5.823 20.033 -0.511 1.00 2.11 H new ATOM 0 HD3 LYS B 71 -5.922 19.482 1.150 1.00 2.11 H new ATOM 0 HE2 LYS B 71 -3.558 20.936 -0.101 1.00 2.60 H new ATOM 0 HE3 LYS B 71 -4.740 21.649 0.978 1.00 2.60 H new ATOM 0 HZ1 LYS B 71 -2.879 21.107 2.283 1.00 3.15 H new ATOM 0 HZ2 LYS B 71 -4.037 19.920 2.650 1.00 3.15 H new ATOM 0 HZ3 LYS B 71 -2.740 19.551 1.617 1.00 3.15 H new ATOM 1923 N SER B 72 -7.020 14.625 0.075 1.00 0.91 N ATOM 1924 CA SER B 72 -7.805 13.492 -0.381 1.00 1.08 C ATOM 1925 C SER B 72 -8.765 13.058 0.721 1.00 1.03 C ATOM 1926 O SER B 72 -8.468 13.214 1.905 1.00 1.20 O ATOM 1927 CB SER B 72 -6.878 12.339 -0.765 1.00 1.29 C ATOM 1928 OG SER B 72 -7.563 11.371 -1.537 1.00 2.02 O ATOM 0 H SER B 72 -6.078 14.386 0.386 1.00 0.91 H new ATOM 0 HA SER B 72 -8.383 13.781 -1.259 1.00 1.08 H new ATOM 0 HB2 SER B 72 -6.028 12.724 -1.329 1.00 1.29 H new ATOM 0 HB3 SER B 72 -6.478 11.874 0.136 1.00 1.29 H new ATOM 0 HG SER B 72 -7.221 11.384 -2.455 1.00 2.02 H new ATOM 1934 N GLU B 73 -9.907 12.499 0.340 1.00 1.12 N ATOM 1935 CA GLU B 73 -10.928 12.150 1.318 1.00 1.30 C ATOM 1936 C GLU B 73 -10.833 10.687 1.746 1.00 1.26 C ATOM 1937 O GLU B 73 -11.807 9.935 1.712 1.00 1.86 O ATOM 1938 CB GLU B 73 -12.338 12.526 0.829 1.00 1.67 C ATOM 1939 CG GLU B 73 -12.572 12.400 -0.670 1.00 1.87 C ATOM 1940 CD GLU B 73 -12.975 11.010 -1.108 1.00 2.11 C ATOM 1941 OE1 GLU B 73 -14.022 10.516 -0.647 1.00 2.46 O ATOM 1942 OE2 GLU B 73 -12.292 10.433 -1.974 1.00 2.64 O ATOM 0 H GLU B 73 -10.147 12.280 -0.627 1.00 1.12 H new ATOM 0 HA GLU B 73 -10.736 12.746 2.210 1.00 1.30 H new ATOM 0 HB2 GLU B 73 -13.062 11.896 1.345 1.00 1.67 H new ATOM 0 HB3 GLU B 73 -12.543 13.555 1.125 1.00 1.67 H new ATOM 0 HG2 GLU B 73 -13.348 13.105 -0.968 1.00 1.87 H new ATOM 0 HG3 GLU B 73 -11.662 12.687 -1.196 1.00 1.87 H new ATOM 1949 N PHE B 74 -9.628 10.305 2.150 1.00 1.03 N ATOM 1950 CA PHE B 74 -9.400 9.046 2.847 1.00 1.02 C ATOM 1951 C PHE B 74 -9.277 9.341 4.340 1.00 1.07 C ATOM 1952 O PHE B 74 -8.817 8.509 5.125 1.00 1.44 O ATOM 1953 CB PHE B 74 -8.117 8.357 2.353 1.00 0.94 C ATOM 1954 CG PHE B 74 -8.154 7.900 0.919 1.00 0.96 C ATOM 1955 CD1 PHE B 74 -8.964 6.845 0.537 1.00 1.61 C ATOM 1956 CD2 PHE B 74 -7.363 8.512 -0.043 1.00 1.18 C ATOM 1957 CE1 PHE B 74 -8.992 6.412 -0.775 1.00 1.70 C ATOM 1958 CE2 PHE B 74 -7.388 8.083 -1.357 1.00 1.25 C ATOM 1959 CZ PHE B 74 -8.204 7.033 -1.723 1.00 1.19 C ATOM 0 H PHE B 74 -8.783 10.858 2.004 1.00 1.03 H new ATOM 0 HA PHE B 74 -10.236 8.375 2.651 1.00 1.02 H new ATOM 0 HB2 PHE B 74 -7.281 9.045 2.478 1.00 0.94 H new ATOM 0 HB3 PHE B 74 -7.917 7.494 2.989 1.00 0.94 H new ATOM 0 HD1 PHE B 74 -9.582 6.354 1.274 1.00 1.61 H new ATOM 0 HD2 PHE B 74 -6.720 9.333 0.238 1.00 1.18 H new ATOM 0 HE1 PHE B 74 -9.630 5.588 -1.059 1.00 1.70 H new ATOM 0 HE2 PHE B 74 -6.769 8.570 -2.096 1.00 1.25 H new ATOM 0 HZ PHE B 74 -8.226 6.697 -2.749 1.00 1.19 H new ATOM 1969 N LYS B 75 -9.699 10.546 4.708 1.00 1.12 N ATOM 1970 CA LYS B 75 -9.524 11.064 6.058 1.00 1.23 C ATOM 1971 C LYS B 75 -10.380 10.300 7.060 1.00 1.54 C ATOM 1972 O LYS B 75 -11.520 9.935 6.769 1.00 2.04 O ATOM 1973 CB LYS B 75 -9.888 12.552 6.097 1.00 1.42 C ATOM 1974 CG LYS B 75 -9.170 13.382 5.046 1.00 1.46 C ATOM 1975 CD LYS B 75 -9.559 14.852 5.113 1.00 1.65 C ATOM 1976 CE LYS B 75 -9.094 15.508 6.406 1.00 2.27 C ATOM 1977 NZ LYS B 75 -9.412 16.961 6.435 1.00 2.85 N ATOM 0 H LYS B 75 -10.173 11.192 4.076 1.00 1.12 H new ATOM 0 HA LYS B 75 -8.478 10.934 6.335 1.00 1.23 H new ATOM 0 HB2 LYS B 75 -10.964 12.658 5.959 1.00 1.42 H new ATOM 0 HB3 LYS B 75 -9.653 12.949 7.084 1.00 1.42 H new ATOM 0 HG2 LYS B 75 -8.093 13.286 5.183 1.00 1.46 H new ATOM 0 HG3 LYS B 75 -9.402 12.991 4.055 1.00 1.46 H new ATOM 0 HD2 LYS B 75 -9.127 15.380 4.263 1.00 1.65 H new ATOM 0 HD3 LYS B 75 -10.642 14.944 5.029 1.00 1.65 H new ATOM 0 HE2 LYS B 75 -9.569 15.015 7.254 1.00 2.27 H new ATOM 0 HE3 LYS B 75 -8.019 15.369 6.518 1.00 2.27 H new ATOM 0 HZ1 LYS B 75 -9.080 17.371 7.331 1.00 2.85 H new ATOM 0 HZ2 LYS B 75 -8.939 17.436 5.640 1.00 2.85 H new ATOM 0 HZ3 LYS B 75 -10.440 17.093 6.354 1.00 2.85 H new ATOM 1991 N GLY B 76 -9.823 10.064 8.239 1.00 1.89 N ATOM 1992 CA GLY B 76 -10.545 9.352 9.274 1.00 2.41 C ATOM 1993 C GLY B 76 -10.469 7.851 9.099 1.00 1.95 C ATOM 1994 O GLY B 76 -11.033 7.096 9.891 1.00 2.43 O ATOM 0 H GLY B 76 -8.880 10.354 8.498 1.00 1.89 H new ATOM 0 HA2 GLY B 76 -10.139 9.623 10.249 1.00 2.41 H new ATOM 0 HA3 GLY B 76 -11.589 9.664 9.266 1.00 2.41 H new ATOM 1998 N GLN B 77 -9.770 7.415 8.062 1.00 1.50 N ATOM 1999 CA GLN B 77 -9.633 5.997 7.769 1.00 1.32 C ATOM 2000 C GLN B 77 -8.170 5.596 7.709 1.00 1.10 C ATOM 2001 O GLN B 77 -7.274 6.432 7.809 1.00 1.50 O ATOM 2002 CB GLN B 77 -10.300 5.660 6.436 1.00 1.56 C ATOM 2003 CG GLN B 77 -11.810 5.782 6.455 1.00 2.02 C ATOM 2004 CD GLN B 77 -12.470 4.786 7.389 1.00 2.54 C ATOM 2005 OE1 GLN B 77 -12.815 3.674 6.988 1.00 2.88 O ATOM 2006 NE2 GLN B 77 -12.652 5.176 8.639 1.00 3.28 N ATOM 0 H GLN B 77 -9.286 8.028 7.406 1.00 1.50 H new ATOM 0 HA GLN B 77 -10.122 5.444 8.571 1.00 1.32 H new ATOM 0 HB2 GLN B 77 -9.902 6.320 5.665 1.00 1.56 H new ATOM 0 HB3 GLN B 77 -10.031 4.642 6.154 1.00 1.56 H new ATOM 0 HG2 GLN B 77 -12.084 6.793 6.757 1.00 2.02 H new ATOM 0 HG3 GLN B 77 -12.194 5.636 5.445 1.00 2.02 H new ATOM 0 HE21 GLN B 77 -12.352 6.106 8.932 1.00 3.28 H new ATOM 0 HE22 GLN B 77 -13.092 4.547 9.310 1.00 3.28 H new ATOM 2015 N HIS B 78 -7.942 4.303 7.557 1.00 0.88 N ATOM 2016 CA HIS B 78 -6.603 3.773 7.371 1.00 0.85 C ATOM 2017 C HIS B 78 -6.620 2.835 6.179 1.00 0.69 C ATOM 2018 O HIS B 78 -7.695 2.408 5.759 1.00 0.68 O ATOM 2019 CB HIS B 78 -6.126 3.015 8.613 1.00 1.02 C ATOM 2020 CG HIS B 78 -6.253 3.783 9.892 1.00 1.16 C ATOM 2021 ND1 HIS B 78 -7.171 3.457 10.864 1.00 1.50 N ATOM 2022 CD2 HIS B 78 -5.566 4.850 10.367 1.00 1.41 C ATOM 2023 CE1 HIS B 78 -7.049 4.288 11.881 1.00 1.95 C ATOM 2024 NE2 HIS B 78 -6.082 5.143 11.606 1.00 1.85 N ATOM 0 H HIS B 78 -8.676 3.594 7.559 1.00 0.88 H new ATOM 0 HA HIS B 78 -5.915 4.601 7.201 1.00 0.85 H new ATOM 0 HB2 HIS B 78 -6.696 2.090 8.701 1.00 1.02 H new ATOM 0 HB3 HIS B 78 -5.082 2.734 8.474 1.00 1.02 H new ATOM 0 HD1 HIS B 78 -7.842 2.691 10.807 1.00 1.50 H new ATOM 0 HD2 HIS B 78 -4.764 5.372 9.866 1.00 1.41 H new ATOM 0 HE1 HIS B 78 -7.640 4.272 12.785 1.00 1.95 H new ATOM 2033 N LEU B 79 -5.455 2.506 5.640 1.00 0.60 N ATOM 2034 CA LEU B 79 -5.386 1.662 4.450 1.00 0.46 C ATOM 2035 C LEU B 79 -6.116 0.338 4.672 1.00 0.44 C ATOM 2036 O LEU B 79 -6.959 -0.055 3.871 1.00 0.42 O ATOM 2037 CB LEU B 79 -3.932 1.398 4.055 1.00 0.44 C ATOM 2038 CG LEU B 79 -3.749 0.566 2.782 1.00 0.37 C ATOM 2039 CD1 LEU B 79 -4.302 1.303 1.570 1.00 0.38 C ATOM 2040 CD2 LEU B 79 -2.284 0.225 2.572 1.00 0.41 C ATOM 0 H LEU B 79 -4.550 2.806 6.002 1.00 0.60 H new ATOM 0 HA LEU B 79 -5.879 2.196 3.637 1.00 0.46 H new ATOM 0 HB2 LEU B 79 -3.428 2.355 3.921 1.00 0.44 H new ATOM 0 HB3 LEU B 79 -3.434 0.888 4.879 1.00 0.44 H new ATOM 0 HG LEU B 79 -4.307 -0.363 2.901 1.00 0.37 H new ATOM 0 HD11 LEU B 79 -4.161 0.693 0.678 1.00 0.38 H new ATOM 0 HD12 LEU B 79 -5.365 1.494 1.714 1.00 0.38 H new ATOM 0 HD13 LEU B 79 -3.776 2.250 1.449 1.00 0.38 H new ATOM 0 HD21 LEU B 79 -2.175 -0.366 1.663 1.00 0.41 H new ATOM 0 HD22 LEU B 79 -1.706 1.145 2.479 1.00 0.41 H new ATOM 0 HD23 LEU B 79 -1.918 -0.348 3.424 1.00 0.41 H new ATOM 2052 N ALA B 80 -5.817 -0.325 5.780 1.00 0.50 N ATOM 2053 CA ALA B 80 -6.388 -1.637 6.058 1.00 0.54 C ATOM 2054 C ALA B 80 -7.895 -1.565 6.293 1.00 0.58 C ATOM 2055 O ALA B 80 -8.623 -2.498 5.963 1.00 0.61 O ATOM 2056 CB ALA B 80 -5.695 -2.273 7.244 1.00 0.63 C ATOM 0 H ALA B 80 -5.184 0.022 6.500 1.00 0.50 H new ATOM 0 HA ALA B 80 -6.226 -2.259 5.177 1.00 0.54 H new ATOM 0 HB1 ALA B 80 -6.133 -3.252 7.439 1.00 0.63 H new ATOM 0 HB2 ALA B 80 -4.633 -2.387 7.027 1.00 0.63 H new ATOM 0 HB3 ALA B 80 -5.820 -1.639 8.121 1.00 0.63 H new ATOM 2062 N ASP B 81 -8.362 -0.455 6.856 1.00 0.64 N ATOM 2063 CA ASP B 81 -9.797 -0.250 7.057 1.00 0.70 C ATOM 2064 C ASP B 81 -10.495 -0.125 5.711 1.00 0.60 C ATOM 2065 O ASP B 81 -11.622 -0.587 5.528 1.00 0.67 O ATOM 2066 CB ASP B 81 -10.067 0.999 7.902 1.00 0.78 C ATOM 2067 CG ASP B 81 -9.660 0.826 9.349 1.00 1.52 C ATOM 2068 OD1 ASP B 81 -10.315 0.043 10.065 1.00 2.06 O ATOM 2069 OD2 ASP B 81 -8.686 1.477 9.782 1.00 2.30 O ATOM 0 H ASP B 81 -7.774 0.313 7.180 1.00 0.64 H new ATOM 0 HA ASP B 81 -10.191 -1.113 7.593 1.00 0.70 H new ATOM 0 HB2 ASP B 81 -9.527 1.844 7.476 1.00 0.78 H new ATOM 0 HB3 ASP B 81 -11.128 1.242 7.854 1.00 0.78 H new ATOM 2074 N ILE B 82 -9.803 0.497 4.772 1.00 0.50 N ATOM 2075 CA ILE B 82 -10.285 0.630 3.405 1.00 0.44 C ATOM 2076 C ILE B 82 -10.349 -0.735 2.722 1.00 0.48 C ATOM 2077 O ILE B 82 -11.322 -1.062 2.042 1.00 0.60 O ATOM 2078 CB ILE B 82 -9.367 1.580 2.608 1.00 0.41 C ATOM 2079 CG1 ILE B 82 -9.558 3.019 3.092 1.00 0.51 C ATOM 2080 CG2 ILE B 82 -9.621 1.465 1.114 1.00 0.46 C ATOM 2081 CD1 ILE B 82 -8.571 3.993 2.496 1.00 0.61 C ATOM 0 H ILE B 82 -8.891 0.924 4.934 1.00 0.50 H new ATOM 0 HA ILE B 82 -11.291 1.050 3.433 1.00 0.44 H new ATOM 0 HB ILE B 82 -8.331 1.289 2.783 1.00 0.41 H new ATOM 0 HG12 ILE B 82 -10.569 3.344 2.848 1.00 0.51 H new ATOM 0 HG13 ILE B 82 -9.469 3.043 4.178 1.00 0.51 H new ATOM 0 HG21 ILE B 82 -8.959 2.146 0.579 1.00 0.46 H new ATOM 0 HG22 ILE B 82 -9.428 0.442 0.790 1.00 0.46 H new ATOM 0 HG23 ILE B 82 -10.658 1.724 0.900 1.00 0.46 H new ATOM 0 HD11 ILE B 82 -8.767 4.993 2.884 1.00 0.61 H new ATOM 0 HD12 ILE B 82 -7.558 3.692 2.762 1.00 0.61 H new ATOM 0 HD13 ILE B 82 -8.675 3.998 1.411 1.00 0.61 H new ATOM 2088 N LEU B 83 -9.313 -1.530 2.920 1.00 0.44 N ATOM 2089 CA LEU B 83 -9.252 -2.867 2.345 1.00 0.52 C ATOM 2090 C LEU B 83 -10.289 -3.783 2.993 1.00 0.69 C ATOM 2091 O LEU B 83 -10.819 -4.685 2.351 1.00 0.83 O ATOM 2092 CB LEU B 83 -7.844 -3.452 2.499 1.00 0.47 C ATOM 2093 CG LEU B 83 -6.832 -3.065 1.410 1.00 0.39 C ATOM 2094 CD1 LEU B 83 -6.730 -1.555 1.241 1.00 0.32 C ATOM 2095 CD2 LEU B 83 -5.467 -3.645 1.740 1.00 0.43 C ATOM 0 H LEU B 83 -8.498 -1.274 3.477 1.00 0.44 H new ATOM 0 HA LEU B 83 -9.481 -2.794 1.282 1.00 0.52 H new ATOM 0 HB2 LEU B 83 -7.446 -3.140 3.465 1.00 0.47 H new ATOM 0 HB3 LEU B 83 -7.924 -4.539 2.523 1.00 0.47 H new ATOM 0 HG LEU B 83 -7.187 -3.479 0.466 1.00 0.39 H new ATOM 0 HD11 LEU B 83 -6.004 -1.324 0.462 1.00 0.32 H new ATOM 0 HD12 LEU B 83 -7.704 -1.154 0.960 1.00 0.32 H new ATOM 0 HD13 LEU B 83 -6.409 -1.105 2.180 1.00 0.32 H new ATOM 0 HD21 LEU B 83 -4.756 -3.366 0.963 1.00 0.43 H new ATOM 0 HD22 LEU B 83 -5.128 -3.254 2.700 1.00 0.43 H new ATOM 0 HD23 LEU B 83 -5.537 -4.731 1.795 1.00 0.43 H new ATOM 2107 N ASN B 84 -10.588 -3.528 4.263 1.00 0.74 N ATOM 2108 CA ASN B 84 -11.580 -4.312 4.996 1.00 0.94 C ATOM 2109 C ASN B 84 -12.969 -4.153 4.378 1.00 0.97 C ATOM 2110 O ASN B 84 -13.757 -5.097 4.352 1.00 1.14 O ATOM 2111 CB ASN B 84 -11.615 -3.882 6.467 1.00 1.03 C ATOM 2112 CG ASN B 84 -12.634 -4.649 7.300 1.00 1.27 C ATOM 2113 OD1 ASN B 84 -13.245 -4.092 8.211 1.00 1.83 O ATOM 2114 ND2 ASN B 84 -12.808 -5.931 7.018 1.00 1.79 N ATOM 0 H ASN B 84 -10.157 -2.782 4.809 1.00 0.74 H new ATOM 0 HA ASN B 84 -11.292 -5.361 4.935 1.00 0.94 H new ATOM 0 HB2 ASN B 84 -10.625 -4.020 6.901 1.00 1.03 H new ATOM 0 HB3 ASN B 84 -11.841 -2.817 6.521 1.00 1.03 H new ATOM 0 HD21 ASN B 84 -13.465 -6.488 7.563 1.00 1.79 H new ATOM 0 HD22 ASN B 84 -12.285 -6.361 6.255 1.00 1.79 H new ATOM 2121 N SER B 85 -13.261 -2.962 3.871 1.00 0.87 N ATOM 2122 CA SER B 85 -14.566 -2.694 3.278 1.00 0.93 C ATOM 2123 C SER B 85 -14.683 -3.277 1.866 1.00 0.91 C ATOM 2124 O SER B 85 -15.750 -3.225 1.251 1.00 1.01 O ATOM 2125 CB SER B 85 -14.856 -1.189 3.271 1.00 0.97 C ATOM 2126 OG SER B 85 -13.715 -0.436 2.890 1.00 1.50 O ATOM 0 H SER B 85 -12.617 -2.171 3.858 1.00 0.87 H new ATOM 0 HA SER B 85 -15.314 -3.191 3.896 1.00 0.93 H new ATOM 0 HB2 SER B 85 -15.676 -0.980 2.584 1.00 0.97 H new ATOM 0 HB3 SER B 85 -15.183 -0.877 4.263 1.00 0.97 H new ATOM 0 HG SER B 85 -13.103 -1.006 2.379 1.00 1.50 H new ATOM 2132 N ALA B 86 -13.592 -3.833 1.356 1.00 0.88 N ATOM 2133 CA ALA B 86 -13.610 -4.466 0.045 1.00 0.95 C ATOM 2134 C ALA B 86 -14.082 -5.912 0.160 1.00 1.14 C ATOM 2135 O ALA B 86 -13.929 -6.546 1.209 1.00 1.70 O ATOM 2136 CB ALA B 86 -12.234 -4.400 -0.600 1.00 1.09 C ATOM 0 H ALA B 86 -12.688 -3.858 1.828 1.00 0.88 H new ATOM 0 HA ALA B 86 -14.310 -3.925 -0.591 1.00 0.95 H new ATOM 0 HB1 ALA B 86 -12.268 -4.878 -1.579 1.00 1.09 H new ATOM 0 HB2 ALA B 86 -11.936 -3.358 -0.715 1.00 1.09 H new ATOM 0 HB3 ALA B 86 -11.511 -4.917 0.031 1.00 1.09 H new ATOM 2142 N SER B 87 -14.667 -6.423 -0.914 1.00 1.42 N ATOM 2143 CA SER B 87 -15.183 -7.783 -0.936 1.00 1.71 C ATOM 2144 C SER B 87 -15.479 -8.216 -2.367 1.00 1.54 C ATOM 2145 O SER B 87 -16.483 -7.807 -2.949 1.00 1.80 O ATOM 2146 CB SER B 87 -16.453 -7.871 -0.084 1.00 2.36 C ATOM 2147 OG SER B 87 -17.392 -6.874 -0.459 1.00 3.09 O ATOM 0 H SER B 87 -14.796 -5.911 -1.787 1.00 1.42 H new ATOM 0 HA SER B 87 -14.429 -8.452 -0.521 1.00 1.71 H new ATOM 0 HB2 SER B 87 -16.902 -8.858 -0.196 1.00 2.36 H new ATOM 0 HB3 SER B 87 -16.197 -7.755 0.969 1.00 2.36 H new ATOM 0 HG SER B 87 -17.434 -6.816 -1.436 1.00 3.09 H new ATOM 2153 N ARG B 88 -14.598 -9.023 -2.942 1.00 1.61 N ATOM 2154 CA ARG B 88 -14.774 -9.480 -4.314 1.00 1.65 C ATOM 2155 C ARG B 88 -14.451 -10.958 -4.447 1.00 1.89 C ATOM 2156 O ARG B 88 -13.294 -11.365 -4.342 1.00 2.39 O ATOM 2157 CB ARG B 88 -13.889 -8.677 -5.269 1.00 2.06 C ATOM 2158 CG ARG B 88 -14.295 -7.220 -5.402 1.00 2.62 C ATOM 2159 CD ARG B 88 -15.679 -7.077 -6.009 1.00 3.31 C ATOM 2160 NE ARG B 88 -16.053 -5.675 -6.184 1.00 4.01 N ATOM 2161 CZ ARG B 88 -17.067 -5.262 -6.937 1.00 4.75 C ATOM 2162 NH1 ARG B 88 -17.815 -6.142 -7.591 1.00 5.00 N ATOM 2163 NH2 ARG B 88 -17.333 -3.966 -7.037 1.00 5.55 N ATOM 0 H ARG B 88 -13.758 -9.374 -2.482 1.00 1.61 H new ATOM 0 HA ARG B 88 -15.820 -9.326 -4.578 1.00 1.65 H new ATOM 0 HB2 ARG B 88 -12.857 -8.727 -4.921 1.00 2.06 H new ATOM 0 HB3 ARG B 88 -13.916 -9.143 -6.254 1.00 2.06 H new ATOM 0 HG2 ARG B 88 -14.277 -6.746 -4.421 1.00 2.62 H new ATOM 0 HG3 ARG B 88 -13.569 -6.695 -6.023 1.00 2.62 H new ATOM 0 HD2 ARG B 88 -15.707 -7.584 -6.974 1.00 3.31 H new ATOM 0 HD3 ARG B 88 -16.410 -7.571 -5.368 1.00 3.31 H new ATOM 0 HE ARG B 88 -15.501 -4.969 -5.697 1.00 4.01 H new ATOM 0 HH11 ARG B 88 -17.612 -7.139 -7.516 1.00 5.00 H new ATOM 0 HH12 ARG B 88 -18.593 -5.821 -8.168 1.00 5.00 H new ATOM 0 HH21 ARG B 88 -16.759 -3.287 -6.536 1.00 5.55 H new ATOM 0 HH22 ARG B 88 -18.111 -3.648 -7.615 1.00 5.55 H new ATOM 2177 N VAL B 89 -15.476 -11.759 -4.684 1.00 2.00 N ATOM 2178 CA VAL B 89 -15.290 -13.184 -4.896 1.00 2.42 C ATOM 2179 C VAL B 89 -15.672 -13.559 -6.326 1.00 2.25 C ATOM 2180 O VAL B 89 -16.825 -13.902 -6.601 1.00 2.29 O ATOM 2181 CB VAL B 89 -16.124 -14.029 -3.906 1.00 3.06 C ATOM 2182 CG1 VAL B 89 -15.791 -15.508 -4.047 1.00 3.58 C ATOM 2183 CG2 VAL B 89 -15.898 -13.565 -2.474 1.00 3.55 C ATOM 0 H VAL B 89 -16.446 -11.447 -4.734 1.00 2.00 H new ATOM 0 HA VAL B 89 -14.236 -13.401 -4.723 1.00 2.42 H new ATOM 0 HB VAL B 89 -17.178 -13.890 -4.147 1.00 3.06 H new ATOM 0 HG11 VAL B 89 -16.389 -16.084 -3.341 1.00 3.58 H new ATOM 0 HG12 VAL B 89 -16.013 -15.836 -5.063 1.00 3.58 H new ATOM 0 HG13 VAL B 89 -14.733 -15.664 -3.838 1.00 3.58 H new ATOM 0 HG21 VAL B 89 -16.495 -14.174 -1.796 1.00 3.55 H new ATOM 0 HG22 VAL B 89 -14.843 -13.668 -2.220 1.00 3.55 H new ATOM 0 HG23 VAL B 89 -16.194 -12.520 -2.379 1.00 3.55 H new ATOM 2187 N PRO B 90 -14.716 -13.477 -7.265 1.00 2.60 N ATOM 2188 CA PRO B 90 -14.945 -13.864 -8.651 1.00 2.83 C ATOM 2189 C PRO B 90 -14.908 -15.378 -8.812 1.00 2.80 C ATOM 2190 O PRO B 90 -13.953 -15.942 -9.354 1.00 3.31 O ATOM 2191 CB PRO B 90 -13.790 -13.201 -9.399 1.00 3.67 C ATOM 2192 CG PRO B 90 -12.687 -13.123 -8.402 1.00 3.95 C ATOM 2193 CD PRO B 90 -13.337 -13.005 -7.046 1.00 3.28 C ATOM 0 HA PRO B 90 -15.923 -13.557 -9.022 1.00 2.83 H new ATOM 0 HB2 PRO B 90 -13.495 -13.786 -10.270 1.00 3.67 H new ATOM 0 HB3 PRO B 90 -14.068 -12.211 -9.759 1.00 3.67 H new ATOM 0 HG2 PRO B 90 -12.056 -14.010 -8.453 1.00 3.95 H new ATOM 0 HG3 PRO B 90 -12.046 -12.264 -8.600 1.00 3.95 H new ATOM 0 HD2 PRO B 90 -12.821 -13.613 -6.303 1.00 3.28 H new ATOM 0 HD3 PRO B 90 -13.320 -11.977 -6.684 1.00 3.28 H new ATOM 2201 N GLU B 91 -15.944 -16.029 -8.307 1.00 2.59 N ATOM 2202 CA GLU B 91 -16.022 -17.478 -8.319 1.00 2.75 C ATOM 2203 C GLU B 91 -16.336 -17.981 -9.723 1.00 2.55 C ATOM 2204 O GLU B 91 -17.498 -18.104 -10.116 1.00 2.94 O ATOM 2205 CB GLU B 91 -17.079 -17.948 -7.320 1.00 3.30 C ATOM 2206 CG GLU B 91 -17.068 -19.445 -7.076 1.00 3.94 C ATOM 2207 CD GLU B 91 -18.076 -19.864 -6.030 1.00 4.58 C ATOM 2208 OE1 GLU B 91 -19.244 -20.108 -6.396 1.00 5.01 O ATOM 2209 OE2 GLU B 91 -17.702 -19.954 -4.838 1.00 5.08 O ATOM 0 H GLU B 91 -16.749 -15.570 -7.880 1.00 2.59 H new ATOM 0 HA GLU B 91 -15.058 -17.891 -8.023 1.00 2.75 H new ATOM 0 HB2 GLU B 91 -16.923 -17.434 -6.372 1.00 3.30 H new ATOM 0 HB3 GLU B 91 -18.064 -17.656 -7.683 1.00 3.30 H new ATOM 0 HG2 GLU B 91 -17.280 -19.965 -8.010 1.00 3.94 H new ATOM 0 HG3 GLU B 91 -16.071 -19.752 -6.760 1.00 3.94 H new ATOM 2216 N SER B 92 -15.286 -18.249 -10.478 1.00 2.56 N ATOM 2217 CA SER B 92 -15.414 -18.695 -11.850 1.00 2.76 C ATOM 2218 C SER B 92 -15.331 -20.215 -11.927 1.00 2.95 C ATOM 2219 O SER B 92 -16.382 -20.864 -12.120 1.00 3.07 O ATOM 2220 CB SER B 92 -14.320 -18.050 -12.702 1.00 3.61 C ATOM 2221 OG SER B 92 -13.045 -18.235 -12.106 1.00 4.13 O ATOM 2222 OXT SER B 92 -14.217 -20.758 -11.768 1.00 3.54 O ATOM 0 H SER B 92 -14.322 -18.163 -10.156 1.00 2.56 H new ATOM 0 HA SER B 92 -16.387 -18.392 -12.235 1.00 2.76 H new ATOM 0 HB2 SER B 92 -14.326 -18.485 -13.701 1.00 3.61 H new ATOM 0 HB3 SER B 92 -14.522 -16.985 -12.817 1.00 3.61 H new ATOM 0 HG SER B 92 -12.977 -19.148 -11.757 1.00 4.13 H new TER 2228 SER B 92