USER MOD reduce.3.24.130724 H: found=0, std=0, add=680, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 679 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 45 LYS NZ :NH3+ -114:sc= 1.87 (180deg=-0.3) USER MOD Set 1.2: A 59 MET CE :methyl 163:sc= -0.0654 (180deg=-0.146) USER MOD Single : A 21 TYR OH : rot 180:sc= 0 USER MOD Single : A 23 LYS NZ :NH3+ -151:sc= 1.39 (180deg=0.064!) USER MOD Single : A 25 LYS NZ :NH3+ 173:sc= 1.3 (180deg=1.17) USER MOD Single : A 29 GLN : amide:sc= 0.324 X(o=0.32,f=-0.13) USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 32 SER OG : rot -67:sc= 1.22 USER MOD Single : A 35 HIS : no HD1:sc= -2.09 K(o=-2.1,f=-4.5!) USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 MET CE :methyl -142:sc= 0 (180deg=-0.843) USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 42 THR OG1 : rot 180:sc= 0 USER MOD Single : A 43 HIS : no HD1:sc= -0.168 X(o=-0.17,f=0.0094) USER MOD Single : A 46 LYS NZ :NH3+ -162:sc= 1.25 (180deg=1.09) USER MOD Single : A 48 LYS NZ :NH3+ 173:sc= 2.29 (180deg=2.23) USER MOD Single : A 50 SER OG : rot 94:sc= 1.28 USER MOD Single : A 51 TYR OH : rot -140:sc= -0.0701 USER MOD Single : A 52 CYS SG : rot 80:sc= -0.134 USER MOD Single : A 53 GLN : amide:sc= -0.871 K(o=-0.87,f=-3.8!) USER MOD Single : A 55 GLN : amide:sc= -0.254 X(o=-0.25,f=-0.56) USER MOD Single : A 60 ASN : amide:sc= -0.0997 K(o=-0.1,f=-1.8!) USER MOD Single : A 61 SER OG : rot 118:sc= 0.365 USER MOD Single : A 69 GLN : amide:sc= 0 X(o=0,f=-0.27) USER MOD Single : A 74 ASN : amide:sc= -0.0511 X(o=-0.051,f=-0.22) USER MOD Single : A 75 HIS : no HD1:sc= -0.0834 K(o=-0.083,f=-9.2!) USER MOD Single : A 76 THR OG1 : rot 44:sc= 0.784 USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 82 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 91 TYR OH : rot 173:sc= 1.23 USER MOD Single : A 92 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 94 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 95 THR OG1 : rot 180:sc= -0.542 USER MOD ----------------------------------------------------------------- ATOM 1 N TYR A 21 13.923 -5.327 -1.563 1.00 10.00 N ATOM 2 CA TYR A 21 12.864 -4.323 -1.322 1.00 10.00 C ATOM 3 C TYR A 21 11.993 -4.759 -0.160 1.00 10.00 C ATOM 4 O TYR A 21 12.126 -5.878 0.334 1.00 10.00 O ATOM 5 CB TYR A 21 12.000 -4.144 -2.572 1.00 10.00 C ATOM 6 CG TYR A 21 12.712 -3.492 -3.737 1.00 10.00 C ATOM 7 CD1 TYR A 21 13.588 -2.430 -3.540 1.00 10.00 C ATOM 8 CD2 TYR A 21 12.492 -3.927 -5.036 1.00 10.00 C ATOM 9 CE1 TYR A 21 14.228 -1.831 -4.605 1.00 10.00 C ATOM 10 CE2 TYR A 21 13.132 -3.333 -6.105 1.00 10.00 C ATOM 11 CZ TYR A 21 13.993 -2.282 -5.886 1.00 10.00 C ATOM 12 OH TYR A 21 14.626 -1.683 -6.949 1.00 10.00 O ATOM 0 HA TYR A 21 13.338 -3.371 -1.083 1.00 10.00 H new ATOM 0 HB2 TYR A 21 11.632 -5.120 -2.887 1.00 10.00 H new ATOM 0 HB3 TYR A 21 11.128 -3.543 -2.313 1.00 10.00 H new ATOM 0 HD1 TYR A 21 13.770 -2.069 -2.539 1.00 10.00 H new ATOM 0 HD2 TYR A 21 11.809 -4.744 -5.214 1.00 10.00 H new ATOM 0 HE1 TYR A 21 14.911 -1.012 -4.436 1.00 10.00 H new ATOM 0 HE2 TYR A 21 12.958 -3.691 -7.109 1.00 10.00 H new ATOM 0 HH TYR A 21 14.352 -2.121 -7.782 1.00 10.00 H new ATOM 22 N ILE A 22 11.099 -3.879 0.270 1.00 10.00 N ATOM 23 CA ILE A 22 10.204 -4.181 1.376 1.00 10.00 C ATOM 24 C ILE A 22 8.857 -4.632 0.833 1.00 10.00 C ATOM 25 O ILE A 22 8.248 -3.942 0.018 1.00 10.00 O ATOM 26 CB ILE A 22 9.999 -2.958 2.297 1.00 10.00 C ATOM 27 CG1 ILE A 22 11.346 -2.346 2.695 1.00 10.00 C ATOM 28 CG2 ILE A 22 9.201 -3.345 3.535 1.00 10.00 C ATOM 29 CD1 ILE A 22 12.244 -3.288 3.470 1.00 10.00 C ATOM 0 H ILE A 22 10.975 -2.950 -0.131 1.00 10.00 H new ATOM 0 HA ILE A 22 10.660 -4.976 1.966 1.00 10.00 H new ATOM 0 HB ILE A 22 9.433 -2.208 1.744 1.00 10.00 H new ATOM 0 HG12 ILE A 22 11.867 -2.022 1.794 1.00 10.00 H new ATOM 0 HG13 ILE A 22 11.165 -1.455 3.296 1.00 10.00 H new ATOM 0 HG21 ILE A 22 9.068 -2.469 4.170 1.00 10.00 H new ATOM 0 HG22 ILE A 22 8.225 -3.727 3.234 1.00 10.00 H new ATOM 0 HG23 ILE A 22 9.738 -4.116 4.088 1.00 10.00 H new ATOM 0 HD11 ILE A 22 13.178 -2.782 3.715 1.00 10.00 H new ATOM 0 HD12 ILE A 22 11.744 -3.593 4.390 1.00 10.00 H new ATOM 0 HD13 ILE A 22 12.457 -4.169 2.864 1.00 10.00 H new ATOM 41 N LYS A 23 8.409 -5.796 1.262 1.00 10.00 N ATOM 42 CA LYS A 23 7.135 -6.329 0.810 1.00 10.00 C ATOM 43 C LYS A 23 6.077 -6.178 1.897 1.00 10.00 C ATOM 44 O LYS A 23 6.197 -6.750 2.983 1.00 10.00 O ATOM 45 CB LYS A 23 7.300 -7.795 0.422 1.00 10.00 C ATOM 46 CG LYS A 23 6.141 -8.356 -0.383 1.00 10.00 C ATOM 47 CD LYS A 23 6.284 -9.857 -0.579 1.00 10.00 C ATOM 48 CE LYS A 23 5.984 -10.618 0.706 1.00 10.00 C ATOM 49 NZ LYS A 23 7.204 -10.864 1.517 1.00 10.00 N ATOM 0 H LYS A 23 8.907 -6.392 1.923 1.00 10.00 H new ATOM 0 HA LYS A 23 6.805 -5.767 -0.064 1.00 10.00 H new ATOM 0 HB2 LYS A 23 8.218 -7.906 -0.156 1.00 10.00 H new ATOM 0 HB3 LYS A 23 7.420 -8.389 1.328 1.00 10.00 H new ATOM 0 HG2 LYS A 23 5.202 -8.141 0.128 1.00 10.00 H new ATOM 0 HG3 LYS A 23 6.096 -7.862 -1.354 1.00 10.00 H new ATOM 0 HD2 LYS A 23 5.607 -10.189 -1.366 1.00 10.00 H new ATOM 0 HD3 LYS A 23 7.296 -10.087 -0.912 1.00 10.00 H new ATOM 0 HE2 LYS A 23 5.264 -10.054 1.299 1.00 10.00 H new ATOM 0 HE3 LYS A 23 5.517 -11.571 0.460 1.00 10.00 H new ATOM 0 HZ1 LYS A 23 7.084 -11.738 2.068 1.00 10.00 H new ATOM 0 HZ2 LYS A 23 8.026 -10.962 0.887 1.00 10.00 H new ATOM 0 HZ3 LYS A 23 7.357 -10.065 2.165 1.00 10.00 H new ATOM 63 N LEU A 24 5.044 -5.405 1.595 1.00 10.00 N ATOM 64 CA LEU A 24 3.966 -5.161 2.542 1.00 10.00 C ATOM 65 C LEU A 24 2.745 -6.001 2.195 1.00 10.00 C ATOM 66 O LEU A 24 2.392 -6.148 1.025 1.00 10.00 O ATOM 67 CB LEU A 24 3.592 -3.676 2.548 1.00 10.00 C ATOM 68 CG LEU A 24 4.756 -2.710 2.780 1.00 10.00 C ATOM 69 CD1 LEU A 24 4.288 -1.274 2.629 1.00 10.00 C ATOM 70 CD2 LEU A 24 5.364 -2.925 4.158 1.00 10.00 C ATOM 0 H LEU A 24 4.930 -4.934 0.697 1.00 10.00 H new ATOM 0 HA LEU A 24 4.313 -5.445 3.535 1.00 10.00 H new ATOM 0 HB2 LEU A 24 3.124 -3.432 1.594 1.00 10.00 H new ATOM 0 HB3 LEU A 24 2.843 -3.510 3.323 1.00 10.00 H new ATOM 0 HG LEU A 24 5.522 -2.909 2.031 1.00 10.00 H new ATOM 0 HD11 LEU A 24 5.127 -0.598 2.797 1.00 10.00 H new ATOM 0 HD12 LEU A 24 3.896 -1.123 1.623 1.00 10.00 H new ATOM 0 HD13 LEU A 24 3.505 -1.068 3.358 1.00 10.00 H new ATOM 0 HD21 LEU A 24 6.190 -2.229 4.304 1.00 10.00 H new ATOM 0 HD22 LEU A 24 4.605 -2.753 4.921 1.00 10.00 H new ATOM 0 HD23 LEU A 24 5.733 -3.948 4.237 1.00 10.00 H new ATOM 82 N LYS A 25 2.110 -6.551 3.216 1.00 10.00 N ATOM 83 CA LYS A 25 0.925 -7.369 3.028 1.00 10.00 C ATOM 84 C LYS A 25 -0.335 -6.536 3.194 1.00 10.00 C ATOM 85 O LYS A 25 -0.698 -6.165 4.313 1.00 10.00 O ATOM 86 CB LYS A 25 0.907 -8.517 4.031 1.00 10.00 C ATOM 87 CG LYS A 25 1.666 -9.749 3.570 1.00 10.00 C ATOM 88 CD LYS A 25 1.596 -10.866 4.599 1.00 10.00 C ATOM 89 CE LYS A 25 0.194 -11.016 5.177 1.00 10.00 C ATOM 90 NZ LYS A 25 -0.060 -12.389 5.680 1.00 10.00 N ATOM 0 H LYS A 25 2.398 -6.445 4.189 1.00 10.00 H new ATOM 0 HA LYS A 25 0.953 -7.774 2.016 1.00 10.00 H new ATOM 0 HB2 LYS A 25 1.334 -8.171 4.972 1.00 10.00 H new ATOM 0 HB3 LYS A 25 -0.128 -8.794 4.233 1.00 10.00 H new ATOM 0 HG2 LYS A 25 1.253 -10.099 2.624 1.00 10.00 H new ATOM 0 HG3 LYS A 25 2.708 -9.488 3.386 1.00 10.00 H new ATOM 0 HD2 LYS A 25 1.901 -11.805 4.137 1.00 10.00 H new ATOM 0 HD3 LYS A 25 2.301 -10.663 5.405 1.00 10.00 H new ATOM 0 HE2 LYS A 25 0.059 -10.302 5.990 1.00 10.00 H new ATOM 0 HE3 LYS A 25 -0.541 -10.769 4.411 1.00 10.00 H new ATOM 0 HZ1 LYS A 25 -0.977 -12.415 6.169 1.00 10.00 H new ATOM 0 HZ2 LYS A 25 -0.075 -13.054 4.881 1.00 10.00 H new ATOM 0 HZ3 LYS A 25 0.694 -12.661 6.343 1.00 10.00 H new ATOM 104 N VAL A 26 -0.990 -6.241 2.087 1.00 10.00 N ATOM 105 CA VAL A 26 -2.213 -5.460 2.116 1.00 10.00 C ATOM 106 C VAL A 26 -3.416 -6.392 2.123 1.00 10.00 C ATOM 107 O VAL A 26 -3.564 -7.233 1.234 1.00 10.00 O ATOM 108 CB VAL A 26 -2.323 -4.497 0.913 1.00 10.00 C ATOM 109 CG1 VAL A 26 -3.276 -3.357 1.231 1.00 10.00 C ATOM 110 CG2 VAL A 26 -0.957 -3.961 0.512 1.00 10.00 C ATOM 0 H VAL A 26 -0.695 -6.531 1.155 1.00 10.00 H new ATOM 0 HA VAL A 26 -2.191 -4.857 3.024 1.00 10.00 H new ATOM 0 HB VAL A 26 -2.722 -5.057 0.067 1.00 10.00 H new ATOM 0 HG11 VAL A 26 -3.342 -2.688 0.373 1.00 10.00 H new ATOM 0 HG12 VAL A 26 -4.264 -3.760 1.454 1.00 10.00 H new ATOM 0 HG13 VAL A 26 -2.907 -2.804 2.095 1.00 10.00 H new ATOM 0 HG21 VAL A 26 -1.066 -3.286 -0.337 1.00 10.00 H new ATOM 0 HG22 VAL A 26 -0.517 -3.421 1.351 1.00 10.00 H new ATOM 0 HG23 VAL A 26 -0.307 -4.791 0.235 1.00 10.00 H new ATOM 120 N ILE A 27 -4.253 -6.258 3.140 1.00 10.00 N ATOM 121 CA ILE A 27 -5.440 -7.091 3.270 1.00 10.00 C ATOM 122 C ILE A 27 -6.621 -6.459 2.547 1.00 10.00 C ATOM 123 O ILE A 27 -7.109 -5.400 2.946 1.00 10.00 O ATOM 124 CB ILE A 27 -5.816 -7.324 4.753 1.00 10.00 C ATOM 125 CG1 ILE A 27 -4.585 -7.751 5.565 1.00 10.00 C ATOM 126 CG2 ILE A 27 -6.920 -8.372 4.867 1.00 10.00 C ATOM 127 CD1 ILE A 27 -3.932 -9.031 5.073 1.00 10.00 C ATOM 0 H ILE A 27 -4.132 -5.578 3.890 1.00 10.00 H new ATOM 0 HA ILE A 27 -5.206 -8.054 2.817 1.00 10.00 H new ATOM 0 HB ILE A 27 -6.187 -6.384 5.162 1.00 10.00 H new ATOM 0 HG12 ILE A 27 -3.849 -6.947 5.539 1.00 10.00 H new ATOM 0 HG13 ILE A 27 -4.878 -7.882 6.607 1.00 10.00 H new ATOM 0 HG21 ILE A 27 -7.171 -8.523 5.917 1.00 10.00 H new ATOM 0 HG22 ILE A 27 -7.803 -8.030 4.328 1.00 10.00 H new ATOM 0 HG23 ILE A 27 -6.575 -9.313 4.438 1.00 10.00 H new ATOM 0 HD11 ILE A 27 -3.071 -9.264 5.699 1.00 10.00 H new ATOM 0 HD12 ILE A 27 -4.650 -9.849 5.125 1.00 10.00 H new ATOM 0 HD13 ILE A 27 -3.606 -8.900 4.041 1.00 10.00 H new ATOM 139 N GLY A 28 -7.063 -7.107 1.478 1.00 10.00 N ATOM 140 CA GLY A 28 -8.187 -6.606 0.715 1.00 10.00 C ATOM 141 C GLY A 28 -9.521 -7.015 1.310 1.00 10.00 C ATOM 142 O GLY A 28 -9.602 -7.987 2.066 1.00 10.00 O ATOM 0 H GLY A 28 -6.660 -7.975 1.125 1.00 10.00 H new ATOM 0 HA2 GLY A 28 -8.133 -5.518 0.666 1.00 10.00 H new ATOM 0 HA3 GLY A 28 -8.121 -6.975 -0.308 1.00 10.00 H new ATOM 146 N GLN A 29 -10.576 -6.288 0.946 1.00 10.00 N ATOM 147 CA GLN A 29 -11.924 -6.558 1.447 1.00 10.00 C ATOM 148 C GLN A 29 -12.454 -7.879 0.884 1.00 10.00 C ATOM 149 O GLN A 29 -13.432 -8.438 1.381 1.00 10.00 O ATOM 150 CB GLN A 29 -12.857 -5.397 1.071 1.00 10.00 C ATOM 151 CG GLN A 29 -14.260 -5.499 1.657 1.00 10.00 C ATOM 152 CD GLN A 29 -14.263 -5.638 3.168 1.00 10.00 C ATOM 153 OE1 GLN A 29 -14.224 -4.646 3.897 1.00 10.00 O ATOM 154 NE2 GLN A 29 -14.316 -6.872 3.647 1.00 10.00 N ATOM 0 H GLN A 29 -10.522 -5.500 0.300 1.00 10.00 H new ATOM 0 HA GLN A 29 -11.887 -6.646 2.533 1.00 10.00 H new ATOM 0 HB2 GLN A 29 -12.405 -4.462 1.403 1.00 10.00 H new ATOM 0 HB3 GLN A 29 -12.933 -5.346 -0.015 1.00 10.00 H new ATOM 0 HG2 GLN A 29 -14.830 -4.612 1.378 1.00 10.00 H new ATOM 0 HG3 GLN A 29 -14.770 -6.357 1.218 1.00 10.00 H new ATOM 0 HE21 GLN A 29 -14.347 -7.666 3.008 1.00 10.00 H new ATOM 0 HE22 GLN A 29 -14.326 -7.028 4.655 1.00 10.00 H new ATOM 163 N ASP A 30 -11.788 -8.381 -0.141 1.00 10.00 N ATOM 164 CA ASP A 30 -12.179 -9.631 -0.779 1.00 10.00 C ATOM 165 C ASP A 30 -11.379 -10.800 -0.213 1.00 10.00 C ATOM 166 O ASP A 30 -11.442 -11.915 -0.733 1.00 10.00 O ATOM 167 CB ASP A 30 -11.995 -9.548 -2.298 1.00 10.00 C ATOM 168 CG ASP A 30 -10.597 -9.133 -2.713 1.00 10.00 C ATOM 169 OD1 ASP A 30 -9.758 -8.856 -1.833 1.00 10.00 O ATOM 170 OD2 ASP A 30 -10.331 -9.074 -3.931 1.00 10.00 O ATOM 0 H ASP A 30 -10.966 -7.939 -0.554 1.00 10.00 H new ATOM 0 HA ASP A 30 -13.235 -9.800 -0.568 1.00 10.00 H new ATOM 0 HB2 ASP A 30 -12.224 -10.519 -2.738 1.00 10.00 H new ATOM 0 HB3 ASP A 30 -12.713 -8.836 -2.705 1.00 10.00 H new ATOM 175 N SER A 31 -10.636 -10.524 0.859 1.00 10.00 N ATOM 176 CA SER A 31 -9.817 -11.526 1.544 1.00 10.00 C ATOM 177 C SER A 31 -8.662 -12.011 0.668 1.00 10.00 C ATOM 178 O SER A 31 -8.465 -13.213 0.492 1.00 10.00 O ATOM 179 CB SER A 31 -10.676 -12.715 1.989 1.00 10.00 C ATOM 180 OG SER A 31 -11.853 -12.279 2.654 1.00 10.00 O ATOM 0 H SER A 31 -10.585 -9.596 1.279 1.00 10.00 H new ATOM 0 HA SER A 31 -9.390 -11.047 2.425 1.00 10.00 H new ATOM 0 HB2 SER A 31 -10.947 -13.316 1.121 1.00 10.00 H new ATOM 0 HB3 SER A 31 -10.097 -13.357 2.653 1.00 10.00 H new ATOM 0 HG SER A 31 -12.383 -13.057 2.925 1.00 10.00 H new ATOM 186 N SER A 32 -7.897 -11.073 0.128 1.00 10.00 N ATOM 187 CA SER A 32 -6.765 -11.418 -0.717 1.00 10.00 C ATOM 188 C SER A 32 -5.457 -10.915 -0.112 1.00 10.00 C ATOM 189 O SER A 32 -5.410 -9.831 0.480 1.00 10.00 O ATOM 190 CB SER A 32 -6.954 -10.844 -2.125 1.00 10.00 C ATOM 191 OG SER A 32 -7.261 -9.457 -2.082 1.00 10.00 O ATOM 0 H SER A 32 -8.039 -10.072 0.260 1.00 10.00 H new ATOM 0 HA SER A 32 -6.713 -12.505 -0.785 1.00 10.00 H new ATOM 0 HB2 SER A 32 -6.046 -10.999 -2.708 1.00 10.00 H new ATOM 0 HB3 SER A 32 -7.755 -11.380 -2.634 1.00 10.00 H new ATOM 0 HG SER A 32 -8.145 -9.330 -1.678 1.00 10.00 H new ATOM 197 N GLU A 33 -4.403 -11.711 -0.247 1.00 10.00 N ATOM 198 CA GLU A 33 -3.094 -11.345 0.267 1.00 10.00 C ATOM 199 C GLU A 33 -2.324 -10.560 -0.785 1.00 10.00 C ATOM 200 O GLU A 33 -1.558 -11.130 -1.565 1.00 10.00 O ATOM 201 CB GLU A 33 -2.290 -12.589 0.655 1.00 10.00 C ATOM 202 CG GLU A 33 -2.347 -12.929 2.133 1.00 10.00 C ATOM 203 CD GLU A 33 -1.223 -13.854 2.548 1.00 10.00 C ATOM 204 OE1 GLU A 33 -0.255 -13.380 3.181 1.00 10.00 O ATOM 205 OE2 GLU A 33 -1.288 -15.060 2.241 1.00 10.00 O ATOM 0 H GLU A 33 -4.433 -12.619 -0.711 1.00 10.00 H new ATOM 0 HA GLU A 33 -3.240 -10.730 1.155 1.00 10.00 H new ATOM 0 HB2 GLU A 33 -2.660 -13.440 0.083 1.00 10.00 H new ATOM 0 HB3 GLU A 33 -1.249 -12.440 0.368 1.00 10.00 H new ATOM 0 HG2 GLU A 33 -2.295 -12.011 2.718 1.00 10.00 H new ATOM 0 HG3 GLU A 33 -3.304 -13.398 2.360 1.00 10.00 H new ATOM 212 N ILE A 34 -2.537 -9.258 -0.822 1.00 10.00 N ATOM 213 CA ILE A 34 -1.854 -8.417 -1.786 1.00 10.00 C ATOM 214 C ILE A 34 -0.457 -8.085 -1.287 1.00 10.00 C ATOM 215 O ILE A 34 -0.287 -7.277 -0.373 1.00 10.00 O ATOM 216 CB ILE A 34 -2.637 -7.118 -2.069 1.00 10.00 C ATOM 217 CG1 ILE A 34 -4.088 -7.435 -2.448 1.00 10.00 C ATOM 218 CG2 ILE A 34 -1.958 -6.323 -3.174 1.00 10.00 C ATOM 219 CD1 ILE A 34 -4.225 -8.290 -3.693 1.00 10.00 C ATOM 0 H ILE A 34 -3.174 -8.762 -0.199 1.00 10.00 H new ATOM 0 HA ILE A 34 -1.785 -8.972 -2.722 1.00 10.00 H new ATOM 0 HB ILE A 34 -2.645 -6.514 -1.162 1.00 10.00 H new ATOM 0 HG12 ILE A 34 -4.568 -7.946 -1.613 1.00 10.00 H new ATOM 0 HG13 ILE A 34 -4.626 -6.499 -2.601 1.00 10.00 H new ATOM 0 HG21 ILE A 34 -2.521 -5.409 -3.363 1.00 10.00 H new ATOM 0 HG22 ILE A 34 -0.944 -6.067 -2.868 1.00 10.00 H new ATOM 0 HG23 ILE A 34 -1.922 -6.922 -4.084 1.00 10.00 H new ATOM 0 HD11 ILE A 34 -5.281 -8.471 -3.896 1.00 10.00 H new ATOM 0 HD12 ILE A 34 -3.776 -7.773 -4.541 1.00 10.00 H new ATOM 0 HD13 ILE A 34 -3.717 -9.242 -3.538 1.00 10.00 H new ATOM 231 N HIS A 35 0.538 -8.729 -1.875 1.00 10.00 N ATOM 232 CA HIS A 35 1.917 -8.516 -1.478 1.00 10.00 C ATOM 233 C HIS A 35 2.544 -7.407 -2.310 1.00 10.00 C ATOM 234 O HIS A 35 3.188 -7.658 -3.325 1.00 10.00 O ATOM 235 CB HIS A 35 2.718 -9.813 -1.615 1.00 10.00 C ATOM 236 CG HIS A 35 2.397 -10.840 -0.567 1.00 10.00 C ATOM 237 ND1 HIS A 35 3.247 -11.889 -0.314 1.00 10.00 N ATOM 238 CD2 HIS A 35 1.322 -10.936 0.256 1.00 10.00 C ATOM 239 CE1 HIS A 35 2.679 -12.592 0.648 1.00 10.00 C ATOM 240 NE2 HIS A 35 1.513 -12.053 1.027 1.00 10.00 N ATOM 0 H HIS A 35 0.415 -9.404 -2.630 1.00 10.00 H new ATOM 0 HA HIS A 35 1.934 -8.211 -0.432 1.00 10.00 H new ATOM 0 HB2 HIS A 35 2.531 -10.242 -2.599 1.00 10.00 H new ATOM 0 HB3 HIS A 35 3.781 -9.579 -1.566 1.00 10.00 H new ATOM 0 HD2 HIS A 35 0.479 -10.262 0.296 1.00 10.00 H new ATOM 0 HE1 HIS A 35 3.101 -13.489 1.076 1.00 10.00 H new ATOM 0 HE2 HIS A 35 0.887 -12.406 1.751 1.00 10.00 H new ATOM 248 N PHE A 36 2.340 -6.178 -1.875 1.00 10.00 N ATOM 249 CA PHE A 36 2.866 -5.021 -2.580 1.00 10.00 C ATOM 250 C PHE A 36 4.332 -4.785 -2.225 1.00 10.00 C ATOM 251 O PHE A 36 4.667 -4.516 -1.070 1.00 10.00 O ATOM 252 CB PHE A 36 2.036 -3.783 -2.238 1.00 10.00 C ATOM 253 CG PHE A 36 1.703 -2.931 -3.430 1.00 10.00 C ATOM 254 CD1 PHE A 36 0.879 -3.413 -4.433 1.00 10.00 C ATOM 255 CD2 PHE A 36 2.213 -1.649 -3.548 1.00 10.00 C ATOM 256 CE1 PHE A 36 0.566 -2.632 -5.530 1.00 10.00 C ATOM 257 CE2 PHE A 36 1.904 -0.864 -4.643 1.00 10.00 C ATOM 258 CZ PHE A 36 1.081 -1.357 -5.634 1.00 10.00 C ATOM 0 H PHE A 36 1.811 -5.953 -1.032 1.00 10.00 H new ATOM 0 HA PHE A 36 2.803 -5.212 -3.651 1.00 10.00 H new ATOM 0 HB2 PHE A 36 1.110 -4.099 -1.758 1.00 10.00 H new ATOM 0 HB3 PHE A 36 2.582 -3.180 -1.512 1.00 10.00 H new ATOM 0 HD1 PHE A 36 0.476 -4.412 -4.357 1.00 10.00 H new ATOM 0 HD2 PHE A 36 2.859 -1.258 -2.776 1.00 10.00 H new ATOM 0 HE1 PHE A 36 -0.080 -3.020 -6.304 1.00 10.00 H new ATOM 0 HE2 PHE A 36 2.307 0.135 -4.723 1.00 10.00 H new ATOM 0 HZ PHE A 36 0.840 -0.745 -6.491 1.00 10.00 H new ATOM 268 N LYS A 37 5.206 -4.901 -3.216 1.00 10.00 N ATOM 269 CA LYS A 37 6.630 -4.690 -2.994 1.00 10.00 C ATOM 270 C LYS A 37 6.977 -3.221 -3.225 1.00 10.00 C ATOM 271 O LYS A 37 6.841 -2.709 -4.338 1.00 10.00 O ATOM 272 CB LYS A 37 7.459 -5.601 -3.908 1.00 10.00 C ATOM 273 CG LYS A 37 8.944 -5.595 -3.587 1.00 10.00 C ATOM 274 CD LYS A 37 9.657 -6.788 -4.206 1.00 10.00 C ATOM 275 CE LYS A 37 9.538 -8.032 -3.335 1.00 10.00 C ATOM 276 NZ LYS A 37 10.285 -9.182 -3.907 1.00 10.00 N ATOM 0 H LYS A 37 4.956 -5.139 -4.176 1.00 10.00 H new ATOM 0 HA LYS A 37 6.871 -4.946 -1.962 1.00 10.00 H new ATOM 0 HB2 LYS A 37 7.083 -6.621 -3.829 1.00 10.00 H new ATOM 0 HB3 LYS A 37 7.318 -5.289 -4.943 1.00 10.00 H new ATOM 0 HG2 LYS A 37 9.392 -4.672 -3.955 1.00 10.00 H new ATOM 0 HG3 LYS A 37 9.083 -5.608 -2.506 1.00 10.00 H new ATOM 0 HD2 LYS A 37 9.236 -6.992 -5.191 1.00 10.00 H new ATOM 0 HD3 LYS A 37 10.710 -6.546 -4.353 1.00 10.00 H new ATOM 0 HE2 LYS A 37 9.917 -7.814 -2.336 1.00 10.00 H new ATOM 0 HE3 LYS A 37 8.487 -8.300 -3.226 1.00 10.00 H new ATOM 0 HZ1 LYS A 37 10.179 -10.009 -3.285 1.00 10.00 H new ATOM 0 HZ2 LYS A 37 9.907 -9.407 -4.849 1.00 10.00 H new ATOM 0 HZ3 LYS A 37 11.292 -8.936 -3.987 1.00 10.00 H new ATOM 290 N VAL A 38 7.415 -2.548 -2.169 1.00 10.00 N ATOM 291 CA VAL A 38 7.747 -1.133 -2.246 1.00 10.00 C ATOM 292 C VAL A 38 9.257 -0.897 -2.243 1.00 10.00 C ATOM 293 O VAL A 38 10.038 -1.761 -1.835 1.00 10.00 O ATOM 294 CB VAL A 38 7.102 -0.345 -1.079 1.00 10.00 C ATOM 295 CG1 VAL A 38 5.616 -0.655 -0.979 1.00 10.00 C ATOM 296 CG2 VAL A 38 7.797 -0.650 0.240 1.00 10.00 C ATOM 0 H VAL A 38 7.549 -2.962 -1.246 1.00 10.00 H new ATOM 0 HA VAL A 38 7.345 -0.771 -3.192 1.00 10.00 H new ATOM 0 HB VAL A 38 7.223 0.718 -1.287 1.00 10.00 H new ATOM 0 HG11 VAL A 38 5.182 -0.092 -0.153 1.00 10.00 H new ATOM 0 HG12 VAL A 38 5.122 -0.374 -1.909 1.00 10.00 H new ATOM 0 HG13 VAL A 38 5.478 -1.722 -0.803 1.00 10.00 H new ATOM 0 HG21 VAL A 38 7.323 -0.083 1.041 1.00 10.00 H new ATOM 0 HG22 VAL A 38 7.719 -1.716 0.455 1.00 10.00 H new ATOM 0 HG23 VAL A 38 8.848 -0.370 0.171 1.00 10.00 H new ATOM 306 N LYS A 39 9.650 0.288 -2.696 1.00 10.00 N ATOM 307 CA LYS A 39 11.053 0.674 -2.756 1.00 10.00 C ATOM 308 C LYS A 39 11.377 1.624 -1.605 1.00 10.00 C ATOM 309 O LYS A 39 10.810 2.715 -1.514 1.00 10.00 O ATOM 310 CB LYS A 39 11.357 1.339 -4.106 1.00 10.00 C ATOM 311 CG LYS A 39 12.813 1.734 -4.292 1.00 10.00 C ATOM 312 CD LYS A 39 13.056 2.301 -5.683 1.00 10.00 C ATOM 313 CE LYS A 39 14.482 2.808 -5.840 1.00 10.00 C ATOM 314 NZ LYS A 39 14.759 3.292 -7.218 1.00 10.00 N ATOM 0 H LYS A 39 9.007 1.005 -3.031 1.00 10.00 H new ATOM 0 HA LYS A 39 11.676 -0.216 -2.661 1.00 10.00 H new ATOM 0 HB2 LYS A 39 11.072 0.657 -4.907 1.00 10.00 H new ATOM 0 HB3 LYS A 39 10.735 2.228 -4.209 1.00 10.00 H new ATOM 0 HG2 LYS A 39 13.091 2.474 -3.541 1.00 10.00 H new ATOM 0 HG3 LYS A 39 13.451 0.865 -4.134 1.00 10.00 H new ATOM 0 HD2 LYS A 39 12.858 1.532 -6.430 1.00 10.00 H new ATOM 0 HD3 LYS A 39 12.357 3.116 -5.872 1.00 10.00 H new ATOM 0 HE2 LYS A 39 14.658 3.617 -5.131 1.00 10.00 H new ATOM 0 HE3 LYS A 39 15.179 2.008 -5.591 1.00 10.00 H new ATOM 0 HZ1 LYS A 39 15.742 3.627 -7.277 1.00 10.00 H new ATOM 0 HZ2 LYS A 39 14.617 2.515 -7.894 1.00 10.00 H new ATOM 0 HZ3 LYS A 39 14.112 4.073 -7.448 1.00 10.00 H new ATOM 328 N MET A 40 12.276 1.200 -0.721 1.00 10.00 N ATOM 329 CA MET A 40 12.667 2.014 0.430 1.00 10.00 C ATOM 330 C MET A 40 13.544 3.192 0.001 1.00 10.00 C ATOM 331 O MET A 40 14.768 3.152 0.127 1.00 10.00 O ATOM 332 CB MET A 40 13.398 1.156 1.474 1.00 10.00 C ATOM 333 CG MET A 40 13.837 1.931 2.712 1.00 10.00 C ATOM 334 SD MET A 40 12.451 2.558 3.680 1.00 10.00 S ATOM 335 CE MET A 40 12.088 1.134 4.709 1.00 10.00 C ATOM 0 H MET A 40 12.748 0.298 -0.778 1.00 10.00 H new ATOM 0 HA MET A 40 11.759 2.415 0.880 1.00 10.00 H new ATOM 0 HB2 MET A 40 12.744 0.340 1.781 1.00 10.00 H new ATOM 0 HB3 MET A 40 14.275 0.705 1.010 1.00 10.00 H new ATOM 0 HG2 MET A 40 14.449 1.284 3.341 1.00 10.00 H new ATOM 0 HG3 MET A 40 14.467 2.766 2.406 1.00 10.00 H new ATOM 0 HE1 MET A 40 11.009 1.040 4.833 1.00 10.00 H new ATOM 0 HE2 MET A 40 12.478 0.233 4.235 1.00 10.00 H new ATOM 0 HE3 MET A 40 12.556 1.262 5.685 1.00 10.00 H new ATOM 345 N THR A 41 12.897 4.226 -0.518 1.00 10.00 N ATOM 346 CA THR A 41 13.568 5.435 -0.974 1.00 10.00 C ATOM 347 C THR A 41 12.545 6.371 -1.616 1.00 10.00 C ATOM 348 O THR A 41 12.679 7.596 -1.561 1.00 10.00 O ATOM 349 CB THR A 41 14.732 5.119 -1.960 1.00 10.00 C ATOM 350 OG1 THR A 41 15.975 5.560 -1.392 1.00 10.00 O ATOM 351 CG2 THR A 41 14.542 5.774 -3.327 1.00 10.00 C ATOM 0 H THR A 41 11.884 4.250 -0.635 1.00 10.00 H new ATOM 0 HA THR A 41 14.015 5.926 -0.110 1.00 10.00 H new ATOM 0 HB THR A 41 14.739 4.040 -2.114 1.00 10.00 H new ATOM 0 HG1 THR A 41 16.707 5.360 -2.012 1.00 10.00 H new ATOM 0 HG21 THR A 41 15.383 5.519 -3.972 1.00 10.00 H new ATOM 0 HG22 THR A 41 13.617 5.414 -3.777 1.00 10.00 H new ATOM 0 HG23 THR A 41 14.491 6.856 -3.208 1.00 10.00 H new ATOM 359 N THR A 42 11.515 5.781 -2.205 1.00 10.00 N ATOM 360 CA THR A 42 10.458 6.541 -2.839 1.00 10.00 C ATOM 361 C THR A 42 9.309 6.753 -1.856 1.00 10.00 C ATOM 362 O THR A 42 9.057 5.908 -0.993 1.00 10.00 O ATOM 363 CB THR A 42 9.936 5.817 -4.095 1.00 10.00 C ATOM 364 OG1 THR A 42 11.031 5.187 -4.778 1.00 10.00 O ATOM 365 CG2 THR A 42 9.232 6.791 -5.033 1.00 10.00 C ATOM 0 H THR A 42 11.392 4.770 -2.255 1.00 10.00 H new ATOM 0 HA THR A 42 10.866 7.506 -3.140 1.00 10.00 H new ATOM 0 HB THR A 42 9.215 5.061 -3.784 1.00 10.00 H new ATOM 0 HG1 THR A 42 10.697 4.726 -5.576 1.00 10.00 H new ATOM 0 HG21 THR A 42 8.873 6.255 -5.912 1.00 10.00 H new ATOM 0 HG22 THR A 42 8.388 7.248 -4.516 1.00 10.00 H new ATOM 0 HG23 THR A 42 9.931 7.568 -5.343 1.00 10.00 H new ATOM 373 N HIS A 43 8.641 7.894 -1.968 1.00 10.00 N ATOM 374 CA HIS A 43 7.516 8.211 -1.101 1.00 10.00 C ATOM 375 C HIS A 43 6.366 7.248 -1.362 1.00 10.00 C ATOM 376 O HIS A 43 6.240 6.701 -2.460 1.00 10.00 O ATOM 377 CB HIS A 43 7.048 9.650 -1.332 1.00 10.00 C ATOM 378 CG HIS A 43 7.469 10.598 -0.253 1.00 10.00 C ATOM 379 ND1 HIS A 43 8.566 11.413 -0.399 1.00 10.00 N ATOM 380 CD2 HIS A 43 6.903 10.828 0.952 1.00 10.00 C ATOM 381 CE1 HIS A 43 8.641 12.116 0.718 1.00 10.00 C ATOM 382 NE2 HIS A 43 7.654 11.795 1.565 1.00 10.00 N ATOM 0 H HIS A 43 8.861 8.617 -2.653 1.00 10.00 H new ATOM 0 HA HIS A 43 7.841 8.110 -0.065 1.00 10.00 H new ATOM 0 HB2 HIS A 43 7.440 10.002 -2.286 1.00 10.00 H new ATOM 0 HB3 HIS A 43 5.961 9.661 -1.410 1.00 10.00 H new ATOM 0 HD2 HIS A 43 6.026 10.342 1.355 1.00 10.00 H new ATOM 0 HE1 HIS A 43 9.401 12.855 0.922 1.00 10.00 H new ATOM 0 HE2 HIS A 43 7.493 12.194 2.490 1.00 10.00 H new ATOM 390 N LEU A 44 5.519 7.053 -0.360 1.00 10.00 N ATOM 391 CA LEU A 44 4.386 6.147 -0.489 1.00 10.00 C ATOM 392 C LEU A 44 3.321 6.729 -1.414 1.00 10.00 C ATOM 393 O LEU A 44 2.333 6.070 -1.726 1.00 10.00 O ATOM 394 CB LEU A 44 3.796 5.826 0.887 1.00 10.00 C ATOM 395 CG LEU A 44 4.568 4.773 1.687 1.00 10.00 C ATOM 396 CD1 LEU A 44 4.228 4.864 3.166 1.00 10.00 C ATOM 397 CD2 LEU A 44 4.263 3.378 1.157 1.00 10.00 C ATOM 0 H LEU A 44 5.595 7.509 0.549 1.00 10.00 H new ATOM 0 HA LEU A 44 4.743 5.219 -0.935 1.00 10.00 H new ATOM 0 HB2 LEU A 44 3.752 6.745 1.471 1.00 10.00 H new ATOM 0 HB3 LEU A 44 2.770 5.482 0.756 1.00 10.00 H new ATOM 0 HG LEU A 44 5.634 4.966 1.569 1.00 10.00 H new ATOM 0 HD11 LEU A 44 4.788 4.107 3.715 1.00 10.00 H new ATOM 0 HD12 LEU A 44 4.492 5.853 3.540 1.00 10.00 H new ATOM 0 HD13 LEU A 44 3.160 4.697 3.305 1.00 10.00 H new ATOM 0 HD21 LEU A 44 4.819 2.640 1.735 1.00 10.00 H new ATOM 0 HD22 LEU A 44 3.195 3.180 1.247 1.00 10.00 H new ATOM 0 HD23 LEU A 44 4.557 3.315 0.109 1.00 10.00 H new ATOM 409 N LYS A 45 3.541 7.964 -1.857 1.00 10.00 N ATOM 410 CA LYS A 45 2.624 8.637 -2.767 1.00 10.00 C ATOM 411 C LYS A 45 2.454 7.819 -4.044 1.00 10.00 C ATOM 412 O LYS A 45 1.334 7.473 -4.431 1.00 10.00 O ATOM 413 CB LYS A 45 3.155 10.035 -3.111 1.00 10.00 C ATOM 414 CG LYS A 45 2.461 10.690 -4.298 1.00 10.00 C ATOM 415 CD LYS A 45 1.042 11.110 -3.957 1.00 10.00 C ATOM 416 CE LYS A 45 0.224 11.385 -5.208 1.00 10.00 C ATOM 417 NZ LYS A 45 -1.145 11.865 -4.885 1.00 10.00 N ATOM 0 H LYS A 45 4.354 8.522 -1.597 1.00 10.00 H new ATOM 0 HA LYS A 45 1.655 8.735 -2.278 1.00 10.00 H new ATOM 0 HB2 LYS A 45 3.044 10.679 -2.238 1.00 10.00 H new ATOM 0 HB3 LYS A 45 4.222 9.965 -3.321 1.00 10.00 H new ATOM 0 HG2 LYS A 45 3.032 11.562 -4.618 1.00 10.00 H new ATOM 0 HG3 LYS A 45 2.443 9.995 -5.138 1.00 10.00 H new ATOM 0 HD2 LYS A 45 0.561 10.326 -3.372 1.00 10.00 H new ATOM 0 HD3 LYS A 45 1.066 12.004 -3.334 1.00 10.00 H new ATOM 0 HE2 LYS A 45 0.735 12.130 -5.818 1.00 10.00 H new ATOM 0 HE3 LYS A 45 0.158 10.475 -5.805 1.00 10.00 H new ATOM 0 HZ1 LYS A 45 -1.842 11.157 -5.192 1.00 10.00 H new ATOM 0 HZ2 LYS A 45 -1.228 12.011 -3.859 1.00 10.00 H new ATOM 0 HZ3 LYS A 45 -1.323 12.763 -5.378 1.00 10.00 H new ATOM 431 N LYS A 46 3.578 7.494 -4.677 1.00 10.00 N ATOM 432 CA LYS A 46 3.570 6.723 -5.912 1.00 10.00 C ATOM 433 C LYS A 46 3.014 5.324 -5.671 1.00 10.00 C ATOM 434 O LYS A 46 2.312 4.771 -6.514 1.00 10.00 O ATOM 435 CB LYS A 46 4.986 6.639 -6.496 1.00 10.00 C ATOM 436 CG LYS A 46 5.051 5.963 -7.860 1.00 10.00 C ATOM 437 CD LYS A 46 4.307 6.765 -8.915 1.00 10.00 C ATOM 438 CE LYS A 46 4.031 5.935 -10.157 1.00 10.00 C ATOM 439 NZ LYS A 46 3.112 6.632 -11.090 1.00 10.00 N ATOM 0 H LYS A 46 4.509 7.755 -4.351 1.00 10.00 H new ATOM 0 HA LYS A 46 2.924 7.230 -6.629 1.00 10.00 H new ATOM 0 HB2 LYS A 46 5.394 7.646 -6.581 1.00 10.00 H new ATOM 0 HB3 LYS A 46 5.624 6.094 -5.800 1.00 10.00 H new ATOM 0 HG2 LYS A 46 6.092 5.844 -8.159 1.00 10.00 H new ATOM 0 HG3 LYS A 46 4.623 4.963 -7.792 1.00 10.00 H new ATOM 0 HD2 LYS A 46 3.365 7.126 -8.501 1.00 10.00 H new ATOM 0 HD3 LYS A 46 4.893 7.643 -9.186 1.00 10.00 H new ATOM 0 HE2 LYS A 46 4.970 5.718 -10.666 1.00 10.00 H new ATOM 0 HE3 LYS A 46 3.597 4.978 -9.866 1.00 10.00 H new ATOM 0 HZ1 LYS A 46 2.707 5.944 -11.757 1.00 10.00 H new ATOM 0 HZ2 LYS A 46 2.346 7.083 -10.550 1.00 10.00 H new ATOM 0 HZ3 LYS A 46 3.638 7.358 -11.618 1.00 10.00 H new ATOM 453 N LEU A 47 3.317 4.767 -4.509 1.00 10.00 N ATOM 454 CA LEU A 47 2.854 3.430 -4.155 1.00 10.00 C ATOM 455 C LEU A 47 1.335 3.401 -4.003 1.00 10.00 C ATOM 456 O LEU A 47 0.674 2.469 -4.463 1.00 10.00 O ATOM 457 CB LEU A 47 3.521 2.960 -2.857 1.00 10.00 C ATOM 458 CG LEU A 47 4.925 2.360 -3.003 1.00 10.00 C ATOM 459 CD1 LEU A 47 4.921 1.205 -3.991 1.00 10.00 C ATOM 460 CD2 LEU A 47 5.931 3.419 -3.428 1.00 10.00 C ATOM 0 H LEU A 47 3.883 5.220 -3.792 1.00 10.00 H new ATOM 0 HA LEU A 47 3.132 2.752 -4.962 1.00 10.00 H new ATOM 0 HB2 LEU A 47 3.579 3.807 -2.174 1.00 10.00 H new ATOM 0 HB3 LEU A 47 2.876 2.216 -2.389 1.00 10.00 H new ATOM 0 HG LEU A 47 5.225 1.977 -2.028 1.00 10.00 H new ATOM 0 HD11 LEU A 47 5.928 0.796 -4.077 1.00 10.00 H new ATOM 0 HD12 LEU A 47 4.243 0.428 -3.639 1.00 10.00 H new ATOM 0 HD13 LEU A 47 4.589 1.562 -4.966 1.00 10.00 H new ATOM 0 HD21 LEU A 47 6.918 2.966 -3.524 1.00 10.00 H new ATOM 0 HD22 LEU A 47 5.631 3.842 -4.387 1.00 10.00 H new ATOM 0 HD23 LEU A 47 5.966 4.209 -2.678 1.00 10.00 H new ATOM 472 N LYS A 48 0.788 4.432 -3.369 1.00 10.00 N ATOM 473 CA LYS A 48 -0.650 4.523 -3.144 1.00 10.00 C ATOM 474 C LYS A 48 -1.426 4.603 -4.457 1.00 10.00 C ATOM 475 O LYS A 48 -2.427 3.905 -4.632 1.00 10.00 O ATOM 476 CB LYS A 48 -0.980 5.731 -2.265 1.00 10.00 C ATOM 477 CG LYS A 48 -0.637 5.528 -0.796 1.00 10.00 C ATOM 478 CD LYS A 48 -0.928 6.775 0.028 1.00 10.00 C ATOM 479 CE LYS A 48 -2.423 7.014 0.182 1.00 10.00 C ATOM 480 NZ LYS A 48 -2.710 8.257 0.947 1.00 10.00 N ATOM 0 H LYS A 48 1.321 5.220 -3.000 1.00 10.00 H new ATOM 0 HA LYS A 48 -0.957 3.612 -2.630 1.00 10.00 H new ATOM 0 HB2 LYS A 48 -0.439 6.600 -2.639 1.00 10.00 H new ATOM 0 HB3 LYS A 48 -2.043 5.955 -2.354 1.00 10.00 H new ATOM 0 HG2 LYS A 48 -1.210 4.689 -0.401 1.00 10.00 H new ATOM 0 HG3 LYS A 48 0.417 5.267 -0.701 1.00 10.00 H new ATOM 0 HD2 LYS A 48 -0.473 6.674 1.013 1.00 10.00 H new ATOM 0 HD3 LYS A 48 -0.469 7.641 -0.448 1.00 10.00 H new ATOM 0 HE2 LYS A 48 -2.884 7.080 -0.804 1.00 10.00 H new ATOM 0 HE3 LYS A 48 -2.876 6.163 0.689 1.00 10.00 H new ATOM 0 HZ1 LYS A 48 -3.732 8.448 0.929 1.00 10.00 H new ATOM 0 HZ2 LYS A 48 -2.397 8.139 1.932 1.00 10.00 H new ATOM 0 HZ3 LYS A 48 -2.201 9.055 0.516 1.00 10.00 H new ATOM 494 N GLU A 49 -0.967 5.442 -5.382 1.00 10.00 N ATOM 495 CA GLU A 49 -1.650 5.587 -6.665 1.00 10.00 C ATOM 496 C GLU A 49 -1.479 4.333 -7.519 1.00 10.00 C ATOM 497 O GLU A 49 -2.396 3.942 -8.241 1.00 10.00 O ATOM 498 CB GLU A 49 -1.168 6.830 -7.424 1.00 10.00 C ATOM 499 CG GLU A 49 0.340 6.969 -7.508 1.00 10.00 C ATOM 500 CD GLU A 49 0.771 8.085 -8.436 1.00 10.00 C ATOM 501 OE1 GLU A 49 0.637 9.267 -8.059 1.00 10.00 O ATOM 502 OE2 GLU A 49 1.248 7.785 -9.549 1.00 10.00 O ATOM 0 H GLU A 49 -0.137 6.024 -5.271 1.00 10.00 H new ATOM 0 HA GLU A 49 -2.712 5.718 -6.456 1.00 10.00 H new ATOM 0 HB2 GLU A 49 -1.575 6.804 -8.435 1.00 10.00 H new ATOM 0 HB3 GLU A 49 -1.576 7.717 -6.939 1.00 10.00 H new ATOM 0 HG2 GLU A 49 0.740 7.155 -6.511 1.00 10.00 H new ATOM 0 HG3 GLU A 49 0.769 6.028 -7.853 1.00 10.00 H new ATOM 509 N SER A 50 -0.318 3.694 -7.423 1.00 10.00 N ATOM 510 CA SER A 50 -0.055 2.479 -8.186 1.00 10.00 C ATOM 511 C SER A 50 -0.990 1.355 -7.738 1.00 10.00 C ATOM 512 O SER A 50 -1.455 0.556 -8.553 1.00 10.00 O ATOM 513 CB SER A 50 1.404 2.046 -8.028 1.00 10.00 C ATOM 514 OG SER A 50 2.296 3.054 -8.481 1.00 10.00 O ATOM 0 H SER A 50 0.453 3.995 -6.827 1.00 10.00 H new ATOM 0 HA SER A 50 -0.240 2.691 -9.239 1.00 10.00 H new ATOM 0 HB2 SER A 50 1.607 1.822 -6.981 1.00 10.00 H new ATOM 0 HB3 SER A 50 1.575 1.127 -8.589 1.00 10.00 H new ATOM 0 HG SER A 50 2.569 3.614 -7.724 1.00 10.00 H new ATOM 520 N TYR A 51 -1.265 1.305 -6.438 1.00 10.00 N ATOM 521 CA TYR A 51 -2.155 0.296 -5.884 1.00 10.00 C ATOM 522 C TYR A 51 -3.565 0.488 -6.428 1.00 10.00 C ATOM 523 O TYR A 51 -4.239 -0.478 -6.791 1.00 10.00 O ATOM 524 CB TYR A 51 -2.168 0.372 -4.354 1.00 10.00 C ATOM 525 CG TYR A 51 -2.878 -0.785 -3.690 1.00 10.00 C ATOM 526 CD1 TYR A 51 -2.165 -1.884 -3.234 1.00 10.00 C ATOM 527 CD2 TYR A 51 -4.258 -0.783 -3.523 1.00 10.00 C ATOM 528 CE1 TYR A 51 -2.802 -2.946 -2.629 1.00 10.00 C ATOM 529 CE2 TYR A 51 -4.903 -1.842 -2.916 1.00 10.00 C ATOM 530 CZ TYR A 51 -4.170 -2.922 -2.473 1.00 10.00 C ATOM 531 OH TYR A 51 -4.806 -3.981 -1.870 1.00 10.00 O ATOM 0 H TYR A 51 -0.883 1.953 -5.750 1.00 10.00 H new ATOM 0 HA TYR A 51 -1.790 -0.688 -6.179 1.00 10.00 H new ATOM 0 HB2 TYR A 51 -1.140 0.410 -3.993 1.00 10.00 H new ATOM 0 HB3 TYR A 51 -2.647 1.303 -4.050 1.00 10.00 H new ATOM 0 HD1 TYR A 51 -1.092 -1.908 -3.355 1.00 10.00 H new ATOM 0 HD2 TYR A 51 -4.835 0.060 -3.874 1.00 10.00 H new ATOM 0 HE1 TYR A 51 -2.231 -3.793 -2.279 1.00 10.00 H new ATOM 0 HE2 TYR A 51 -5.975 -1.824 -2.789 1.00 10.00 H new ATOM 0 HH TYR A 51 -5.645 -4.169 -2.340 1.00 10.00 H new ATOM 541 N CYS A 52 -4.000 1.744 -6.482 1.00 10.00 N ATOM 542 CA CYS A 52 -5.323 2.073 -6.991 1.00 10.00 C ATOM 543 C CYS A 52 -5.456 1.607 -8.438 1.00 10.00 C ATOM 544 O CYS A 52 -6.450 0.981 -8.815 1.00 10.00 O ATOM 545 CB CYS A 52 -5.572 3.581 -6.890 1.00 10.00 C ATOM 546 SG CYS A 52 -5.322 4.257 -5.229 1.00 10.00 S ATOM 0 H CYS A 52 -3.453 2.550 -6.179 1.00 10.00 H new ATOM 0 HA CYS A 52 -6.071 1.559 -6.387 1.00 10.00 H new ATOM 0 HB2 CYS A 52 -4.909 4.096 -7.585 1.00 10.00 H new ATOM 0 HB3 CYS A 52 -6.593 3.793 -7.208 1.00 10.00 H new ATOM 0 HG CYS A 52 -4.051 4.430 -5.018 1.00 10.00 H new ATOM 552 N GLN A 53 -4.428 1.890 -9.232 1.00 10.00 N ATOM 553 CA GLN A 53 -4.401 1.501 -10.638 1.00 10.00 C ATOM 554 C GLN A 53 -4.464 -0.016 -10.781 1.00 10.00 C ATOM 555 O GLN A 53 -5.117 -0.535 -11.684 1.00 10.00 O ATOM 556 CB GLN A 53 -3.136 2.034 -11.308 1.00 10.00 C ATOM 557 CG GLN A 53 -3.076 3.551 -11.380 1.00 10.00 C ATOM 558 CD GLN A 53 -1.687 4.058 -11.695 1.00 10.00 C ATOM 559 OE1 GLN A 53 -0.690 3.435 -11.329 1.00 10.00 O ATOM 560 NE2 GLN A 53 -1.606 5.184 -12.383 1.00 10.00 N ATOM 0 H GLN A 53 -3.596 2.392 -8.922 1.00 10.00 H new ATOM 0 HA GLN A 53 -5.274 1.932 -11.128 1.00 10.00 H new ATOM 0 HB2 GLN A 53 -2.265 1.670 -10.762 1.00 10.00 H new ATOM 0 HB3 GLN A 53 -3.072 1.628 -12.318 1.00 10.00 H new ATOM 0 HG2 GLN A 53 -3.770 3.904 -12.143 1.00 10.00 H new ATOM 0 HG3 GLN A 53 -3.406 3.971 -10.430 1.00 10.00 H new ATOM 0 HE21 GLN A 53 -2.456 5.670 -12.668 1.00 10.00 H new ATOM 0 HE22 GLN A 53 -0.693 5.567 -12.629 1.00 10.00 H new ATOM 569 N ARG A 54 -3.787 -0.714 -9.873 1.00 10.00 N ATOM 570 CA ARG A 54 -3.754 -2.175 -9.877 1.00 10.00 C ATOM 571 C ARG A 54 -5.146 -2.754 -9.622 1.00 10.00 C ATOM 572 O ARG A 54 -5.504 -3.801 -10.165 1.00 10.00 O ATOM 573 CB ARG A 54 -2.767 -2.678 -8.814 1.00 10.00 C ATOM 574 CG ARG A 54 -2.724 -4.194 -8.667 1.00 10.00 C ATOM 575 CD ARG A 54 -2.083 -4.864 -9.873 1.00 10.00 C ATOM 576 NE ARG A 54 -1.809 -6.284 -9.630 1.00 10.00 N ATOM 577 CZ ARG A 54 -1.648 -7.190 -10.595 1.00 10.00 C ATOM 578 NH1 ARG A 54 -1.749 -6.831 -11.872 1.00 10.00 N ATOM 579 NH2 ARG A 54 -1.378 -8.455 -10.283 1.00 10.00 N ATOM 0 H ARG A 54 -3.249 -0.287 -9.119 1.00 10.00 H new ATOM 0 HA ARG A 54 -3.423 -2.510 -10.860 1.00 10.00 H new ATOM 0 HB2 ARG A 54 -1.768 -2.320 -9.064 1.00 10.00 H new ATOM 0 HB3 ARG A 54 -3.032 -2.239 -7.852 1.00 10.00 H new ATOM 0 HG2 ARG A 54 -2.166 -4.456 -7.768 1.00 10.00 H new ATOM 0 HG3 ARG A 54 -3.737 -4.575 -8.536 1.00 10.00 H new ATOM 0 HD2 ARG A 54 -2.741 -4.764 -10.736 1.00 10.00 H new ATOM 0 HD3 ARG A 54 -1.153 -4.352 -10.121 1.00 10.00 H new ATOM 0 HE ARG A 54 -1.737 -6.598 -8.662 1.00 10.00 H new ATOM 0 HH11 ARG A 54 -1.950 -5.861 -12.115 1.00 10.00 H new ATOM 0 HH12 ARG A 54 -1.625 -7.526 -12.608 1.00 10.00 H new ATOM 0 HH21 ARG A 54 -1.294 -8.732 -9.305 1.00 10.00 H new ATOM 0 HH22 ARG A 54 -1.255 -9.147 -11.022 1.00 10.00 H new ATOM 593 N GLN A 55 -5.925 -2.071 -8.799 1.00 10.00 N ATOM 594 CA GLN A 55 -7.274 -2.522 -8.480 1.00 10.00 C ATOM 595 C GLN A 55 -8.277 -1.998 -9.502 1.00 10.00 C ATOM 596 O GLN A 55 -9.427 -2.436 -9.537 1.00 10.00 O ATOM 597 CB GLN A 55 -7.669 -2.081 -7.069 1.00 10.00 C ATOM 598 CG GLN A 55 -6.888 -2.784 -5.970 1.00 10.00 C ATOM 599 CD GLN A 55 -7.073 -4.291 -5.989 1.00 10.00 C ATOM 600 OE1 GLN A 55 -6.352 -5.007 -6.684 1.00 10.00 O ATOM 601 NE2 GLN A 55 -8.040 -4.782 -5.231 1.00 10.00 N ATOM 0 H GLN A 55 -5.649 -1.203 -8.339 1.00 10.00 H new ATOM 0 HA GLN A 55 -7.285 -3.611 -8.518 1.00 10.00 H new ATOM 0 HB2 GLN A 55 -7.519 -1.005 -6.978 1.00 10.00 H new ATOM 0 HB3 GLN A 55 -8.733 -2.268 -6.924 1.00 10.00 H new ATOM 0 HG2 GLN A 55 -5.829 -2.551 -6.077 1.00 10.00 H new ATOM 0 HG3 GLN A 55 -7.203 -2.396 -5.001 1.00 10.00 H new ATOM 0 HE21 GLN A 55 -8.616 -4.155 -4.669 1.00 10.00 H new ATOM 0 HE22 GLN A 55 -8.210 -5.788 -5.208 1.00 10.00 H new ATOM 610 N GLY A 56 -7.835 -1.057 -10.324 1.00 10.00 N ATOM 611 CA GLY A 56 -8.693 -0.489 -11.345 1.00 10.00 C ATOM 612 C GLY A 56 -9.617 0.581 -10.800 1.00 10.00 C ATOM 613 O GLY A 56 -10.696 0.813 -11.346 1.00 10.00 O ATOM 0 H GLY A 56 -6.890 -0.674 -10.302 1.00 10.00 H new ATOM 0 HA2 GLY A 56 -8.077 -0.063 -12.137 1.00 10.00 H new ATOM 0 HA3 GLY A 56 -9.288 -1.282 -11.797 1.00 10.00 H new ATOM 617 N VAL A 57 -9.195 1.236 -9.731 1.00 10.00 N ATOM 618 CA VAL A 57 -9.987 2.288 -9.106 1.00 10.00 C ATOM 619 C VAL A 57 -9.168 3.570 -8.987 1.00 10.00 C ATOM 620 O VAL A 57 -7.937 3.521 -8.979 1.00 10.00 O ATOM 621 CB VAL A 57 -10.482 1.869 -7.702 1.00 10.00 C ATOM 622 CG1 VAL A 57 -11.563 0.805 -7.803 1.00 10.00 C ATOM 623 CG2 VAL A 57 -9.326 1.370 -6.848 1.00 10.00 C ATOM 0 H VAL A 57 -8.301 1.057 -9.273 1.00 10.00 H new ATOM 0 HA VAL A 57 -10.855 2.462 -9.742 1.00 10.00 H new ATOM 0 HB VAL A 57 -10.911 2.749 -7.222 1.00 10.00 H new ATOM 0 HG11 VAL A 57 -11.895 0.527 -6.803 1.00 10.00 H new ATOM 0 HG12 VAL A 57 -12.408 1.197 -8.369 1.00 10.00 H new ATOM 0 HG13 VAL A 57 -11.163 -0.073 -8.310 1.00 10.00 H new ATOM 0 HG21 VAL A 57 -9.698 1.081 -5.865 1.00 10.00 H new ATOM 0 HG22 VAL A 57 -8.864 0.508 -7.329 1.00 10.00 H new ATOM 0 HG23 VAL A 57 -8.587 2.163 -6.737 1.00 10.00 H new ATOM 633 N PRO A 58 -9.831 4.734 -8.913 1.00 10.00 N ATOM 634 CA PRO A 58 -9.136 6.016 -8.785 1.00 10.00 C ATOM 635 C PRO A 58 -8.495 6.178 -7.410 1.00 10.00 C ATOM 636 O PRO A 58 -8.787 5.418 -6.479 1.00 10.00 O ATOM 637 CB PRO A 58 -10.246 7.050 -8.992 1.00 10.00 C ATOM 638 CG PRO A 58 -11.505 6.348 -8.624 1.00 10.00 C ATOM 639 CD PRO A 58 -11.296 4.897 -8.955 1.00 10.00 C ATOM 0 HA PRO A 58 -8.317 6.115 -9.498 1.00 10.00 H new ATOM 0 HB2 PRO A 58 -10.088 7.929 -8.367 1.00 10.00 H new ATOM 0 HB3 PRO A 58 -10.275 7.395 -10.025 1.00 10.00 H new ATOM 0 HG2 PRO A 58 -11.725 6.476 -7.564 1.00 10.00 H new ATOM 0 HG3 PRO A 58 -12.352 6.754 -9.177 1.00 10.00 H new ATOM 0 HD2 PRO A 58 -11.792 4.247 -8.234 1.00 10.00 H new ATOM 0 HD3 PRO A 58 -11.698 4.649 -9.937 1.00 10.00 H new ATOM 647 N MET A 59 -7.625 7.163 -7.281 1.00 10.00 N ATOM 648 CA MET A 59 -6.943 7.412 -6.021 1.00 10.00 C ATOM 649 C MET A 59 -7.879 8.090 -5.024 1.00 10.00 C ATOM 650 O MET A 59 -8.870 8.704 -5.419 1.00 10.00 O ATOM 651 CB MET A 59 -5.697 8.272 -6.247 1.00 10.00 C ATOM 652 CG MET A 59 -4.682 8.171 -5.120 1.00 10.00 C ATOM 653 SD MET A 59 -3.236 9.214 -5.383 1.00 10.00 S ATOM 654 CE MET A 59 -2.208 8.702 -4.008 1.00 10.00 C ATOM 0 H MET A 59 -7.373 7.805 -8.033 1.00 10.00 H new ATOM 0 HA MET A 59 -6.635 6.452 -5.606 1.00 10.00 H new ATOM 0 HB2 MET A 59 -5.222 7.973 -7.181 1.00 10.00 H new ATOM 0 HB3 MET A 59 -5.999 9.313 -6.362 1.00 10.00 H new ATOM 0 HG2 MET A 59 -5.160 8.451 -4.181 1.00 10.00 H new ATOM 0 HG3 MET A 59 -4.362 7.134 -5.018 1.00 10.00 H new ATOM 0 HE1 MET A 59 -1.179 9.015 -4.187 1.00 10.00 H new ATOM 0 HE2 MET A 59 -2.573 9.162 -3.090 1.00 10.00 H new ATOM 0 HE3 MET A 59 -2.245 7.617 -3.910 1.00 10.00 H new ATOM 664 N ASN A 60 -7.562 7.936 -3.735 1.00 10.00 N ATOM 665 CA ASN A 60 -8.337 8.523 -2.630 1.00 10.00 C ATOM 666 C ASN A 60 -9.647 7.770 -2.396 1.00 10.00 C ATOM 667 O ASN A 60 -10.460 8.155 -1.555 1.00 10.00 O ATOM 668 CB ASN A 60 -8.608 10.017 -2.863 1.00 10.00 C ATOM 669 CG ASN A 60 -8.792 10.792 -1.568 1.00 10.00 C ATOM 670 OD1 ASN A 60 -8.295 10.393 -0.512 1.00 10.00 O ATOM 671 ND2 ASN A 60 -9.493 11.916 -1.644 1.00 10.00 N ATOM 0 H ASN A 60 -6.754 7.397 -3.423 1.00 10.00 H new ATOM 0 HA ASN A 60 -7.729 8.425 -1.731 1.00 10.00 H new ATOM 0 HB2 ASN A 60 -7.779 10.448 -3.425 1.00 10.00 H new ATOM 0 HB3 ASN A 60 -9.501 10.128 -3.477 1.00 10.00 H new ATOM 0 HD21 ASN A 60 -9.637 12.485 -0.810 1.00 10.00 H new ATOM 0 HD22 ASN A 60 -9.888 12.211 -2.537 1.00 10.00 H new ATOM 678 N SER A 61 -9.843 6.688 -3.140 1.00 10.00 N ATOM 679 CA SER A 61 -11.037 5.867 -2.996 1.00 10.00 C ATOM 680 C SER A 61 -10.788 4.763 -1.973 1.00 10.00 C ATOM 681 O SER A 61 -11.720 4.153 -1.453 1.00 10.00 O ATOM 682 CB SER A 61 -11.417 5.247 -4.341 1.00 10.00 C ATOM 683 OG SER A 61 -11.123 6.130 -5.408 1.00 10.00 O ATOM 0 H SER A 61 -9.189 6.359 -3.850 1.00 10.00 H new ATOM 0 HA SER A 61 -11.857 6.498 -2.652 1.00 10.00 H new ATOM 0 HB2 SER A 61 -10.876 4.311 -4.480 1.00 10.00 H new ATOM 0 HB3 SER A 61 -12.480 5.005 -4.347 1.00 10.00 H new ATOM 0 HG SER A 61 -10.463 5.716 -6.002 1.00 10.00 H new ATOM 689 N LEU A 62 -9.515 4.518 -1.693 1.00 10.00 N ATOM 690 CA LEU A 62 -9.120 3.488 -0.749 1.00 10.00 C ATOM 691 C LEU A 62 -8.235 4.077 0.340 1.00 10.00 C ATOM 692 O LEU A 62 -7.313 4.845 0.056 1.00 10.00 O ATOM 693 CB LEU A 62 -8.370 2.362 -1.468 1.00 10.00 C ATOM 694 CG LEU A 62 -9.165 1.626 -2.552 1.00 10.00 C ATOM 695 CD1 LEU A 62 -8.268 0.647 -3.293 1.00 10.00 C ATOM 696 CD2 LEU A 62 -10.359 0.899 -1.944 1.00 10.00 C ATOM 0 H LEU A 62 -8.735 5.024 -2.111 1.00 10.00 H new ATOM 0 HA LEU A 62 -10.022 3.080 -0.293 1.00 10.00 H new ATOM 0 HB2 LEU A 62 -7.471 2.780 -1.922 1.00 10.00 H new ATOM 0 HB3 LEU A 62 -8.043 1.635 -0.725 1.00 10.00 H new ATOM 0 HG LEU A 62 -9.539 2.362 -3.263 1.00 10.00 H new ATOM 0 HD11 LEU A 62 -8.847 0.132 -4.060 1.00 10.00 H new ATOM 0 HD12 LEU A 62 -7.447 1.189 -3.761 1.00 10.00 H new ATOM 0 HD13 LEU A 62 -7.867 -0.083 -2.590 1.00 10.00 H new ATOM 0 HD21 LEU A 62 -10.910 0.383 -2.730 1.00 10.00 H new ATOM 0 HD22 LEU A 62 -10.008 0.173 -1.211 1.00 10.00 H new ATOM 0 HD23 LEU A 62 -11.014 1.620 -1.456 1.00 10.00 H new ATOM 708 N ARG A 63 -8.526 3.729 1.583 1.00 10.00 N ATOM 709 CA ARG A 63 -7.747 4.216 2.708 1.00 10.00 C ATOM 710 C ARG A 63 -6.808 3.127 3.207 1.00 10.00 C ATOM 711 O ARG A 63 -7.228 1.997 3.465 1.00 10.00 O ATOM 712 CB ARG A 63 -8.654 4.701 3.848 1.00 10.00 C ATOM 713 CG ARG A 63 -9.574 3.631 4.418 1.00 10.00 C ATOM 714 CD ARG A 63 -10.260 4.104 5.691 1.00 10.00 C ATOM 715 NE ARG A 63 -11.250 3.141 6.172 1.00 10.00 N ATOM 716 CZ ARG A 63 -12.532 3.136 5.802 1.00 10.00 C ATOM 717 NH1 ARG A 63 -13.003 4.072 4.987 1.00 10.00 N ATOM 718 NH2 ARG A 63 -13.348 2.197 6.263 1.00 10.00 N ATOM 0 H ARG A 63 -9.296 3.111 1.838 1.00 10.00 H new ATOM 0 HA ARG A 63 -7.157 5.066 2.366 1.00 10.00 H new ATOM 0 HB2 ARG A 63 -8.030 5.092 4.652 1.00 10.00 H new ATOM 0 HB3 ARG A 63 -9.262 5.530 3.485 1.00 10.00 H new ATOM 0 HG2 ARG A 63 -10.326 3.364 3.676 1.00 10.00 H new ATOM 0 HG3 ARG A 63 -8.999 2.729 4.627 1.00 10.00 H new ATOM 0 HD2 ARG A 63 -9.511 4.271 6.465 1.00 10.00 H new ATOM 0 HD3 ARG A 63 -10.746 5.062 5.506 1.00 10.00 H new ATOM 0 HE ARG A 63 -10.941 2.428 6.832 1.00 10.00 H new ATOM 0 HH11 ARG A 63 -12.383 4.803 4.638 1.00 10.00 H new ATOM 0 HH12 ARG A 63 -13.985 4.060 4.710 1.00 10.00 H new ATOM 0 HH21 ARG A 63 -12.995 1.482 6.898 1.00 10.00 H new ATOM 0 HH22 ARG A 63 -14.329 2.191 5.982 1.00 10.00 H new ATOM 732 N PHE A 64 -5.536 3.469 3.319 1.00 10.00 N ATOM 733 CA PHE A 64 -4.532 2.534 3.793 1.00 10.00 C ATOM 734 C PHE A 64 -4.329 2.724 5.288 1.00 10.00 C ATOM 735 O PHE A 64 -3.820 3.756 5.726 1.00 10.00 O ATOM 736 CB PHE A 64 -3.219 2.743 3.039 1.00 10.00 C ATOM 737 CG PHE A 64 -3.296 2.344 1.592 1.00 10.00 C ATOM 738 CD1 PHE A 64 -3.702 3.253 0.631 1.00 10.00 C ATOM 739 CD2 PHE A 64 -2.970 1.057 1.198 1.00 10.00 C ATOM 740 CE1 PHE A 64 -3.780 2.888 -0.699 1.00 10.00 C ATOM 741 CE2 PHE A 64 -3.045 0.685 -0.129 1.00 10.00 C ATOM 742 CZ PHE A 64 -3.453 1.603 -1.079 1.00 10.00 C ATOM 0 H PHE A 64 -5.173 4.393 3.086 1.00 10.00 H new ATOM 0 HA PHE A 64 -4.871 1.514 3.609 1.00 10.00 H new ATOM 0 HB2 PHE A 64 -2.933 3.793 3.105 1.00 10.00 H new ATOM 0 HB3 PHE A 64 -2.432 2.167 3.526 1.00 10.00 H new ATOM 0 HD1 PHE A 64 -3.961 4.260 0.924 1.00 10.00 H new ATOM 0 HD2 PHE A 64 -2.654 0.336 1.937 1.00 10.00 H new ATOM 0 HE1 PHE A 64 -4.096 3.607 -1.440 1.00 10.00 H new ATOM 0 HE2 PHE A 64 -2.786 -0.321 -0.425 1.00 10.00 H new ATOM 0 HZ PHE A 64 -3.516 1.314 -2.118 1.00 10.00 H new ATOM 752 N LEU A 65 -4.740 1.738 6.064 1.00 10.00 N ATOM 753 CA LEU A 65 -4.628 1.811 7.512 1.00 10.00 C ATOM 754 C LEU A 65 -3.459 0.986 8.025 1.00 10.00 C ATOM 755 O LEU A 65 -3.393 -0.227 7.816 1.00 10.00 O ATOM 756 CB LEU A 65 -5.927 1.338 8.167 1.00 10.00 C ATOM 757 CG LEU A 65 -7.165 2.172 7.831 1.00 10.00 C ATOM 758 CD1 LEU A 65 -8.378 1.654 8.581 1.00 10.00 C ATOM 759 CD2 LEU A 65 -6.928 3.637 8.158 1.00 10.00 C ATOM 0 H LEU A 65 -5.156 0.874 5.716 1.00 10.00 H new ATOM 0 HA LEU A 65 -4.447 2.852 7.778 1.00 10.00 H new ATOM 0 HB2 LEU A 65 -6.111 0.306 7.868 1.00 10.00 H new ATOM 0 HB3 LEU A 65 -5.791 1.337 9.248 1.00 10.00 H new ATOM 0 HG LEU A 65 -7.356 2.083 6.762 1.00 10.00 H new ATOM 0 HD11 LEU A 65 -9.248 2.260 8.329 1.00 10.00 H new ATOM 0 HD12 LEU A 65 -8.564 0.617 8.300 1.00 10.00 H new ATOM 0 HD13 LEU A 65 -8.194 1.712 9.654 1.00 10.00 H new ATOM 0 HD21 LEU A 65 -7.820 4.214 7.912 1.00 10.00 H new ATOM 0 HD22 LEU A 65 -6.710 3.742 9.221 1.00 10.00 H new ATOM 0 HD23 LEU A 65 -6.084 4.008 7.576 1.00 10.00 H new ATOM 771 N PHE A 66 -2.546 1.658 8.704 1.00 10.00 N ATOM 772 CA PHE A 66 -1.373 1.024 9.275 1.00 10.00 C ATOM 773 C PHE A 66 -1.338 1.301 10.771 1.00 10.00 C ATOM 774 O PHE A 66 -1.110 2.437 11.189 1.00 10.00 O ATOM 775 CB PHE A 66 -0.101 1.558 8.605 1.00 10.00 C ATOM 776 CG PHE A 66 1.146 0.796 8.966 1.00 10.00 C ATOM 777 CD1 PHE A 66 1.439 -0.409 8.347 1.00 10.00 C ATOM 778 CD2 PHE A 66 2.031 1.291 9.914 1.00 10.00 C ATOM 779 CE1 PHE A 66 2.586 -1.109 8.671 1.00 10.00 C ATOM 780 CE2 PHE A 66 3.179 0.595 10.240 1.00 10.00 C ATOM 781 CZ PHE A 66 3.456 -0.606 9.617 1.00 10.00 C ATOM 0 H PHE A 66 -2.598 2.662 8.875 1.00 10.00 H new ATOM 0 HA PHE A 66 -1.422 -0.052 9.105 1.00 10.00 H new ATOM 0 HB2 PHE A 66 -0.232 1.528 7.523 1.00 10.00 H new ATOM 0 HB3 PHE A 66 0.032 2.604 8.882 1.00 10.00 H new ATOM 0 HD1 PHE A 66 0.764 -0.805 7.603 1.00 10.00 H new ATOM 0 HD2 PHE A 66 1.820 2.231 10.402 1.00 10.00 H new ATOM 0 HE1 PHE A 66 2.801 -2.049 8.184 1.00 10.00 H new ATOM 0 HE2 PHE A 66 3.859 0.989 10.981 1.00 10.00 H new ATOM 0 HZ PHE A 66 4.353 -1.151 9.870 1.00 10.00 H new ATOM 791 N GLU A 67 -1.610 0.266 11.565 1.00 10.00 N ATOM 792 CA GLU A 67 -1.618 0.372 13.026 1.00 10.00 C ATOM 793 C GLU A 67 -2.745 1.283 13.508 1.00 10.00 C ATOM 794 O GLU A 67 -2.711 1.804 14.626 1.00 10.00 O ATOM 795 CB GLU A 67 -0.265 0.867 13.547 1.00 10.00 C ATOM 796 CG GLU A 67 0.841 -0.172 13.435 1.00 10.00 C ATOM 797 CD GLU A 67 0.629 -1.354 14.360 1.00 10.00 C ATOM 798 OE1 GLU A 67 -0.112 -2.286 13.985 1.00 10.00 O ATOM 799 OE2 GLU A 67 1.206 -1.356 15.469 1.00 10.00 O ATOM 0 H GLU A 67 -1.830 -0.667 11.217 1.00 10.00 H new ATOM 0 HA GLU A 67 -1.795 -0.625 13.428 1.00 10.00 H new ATOM 0 HB2 GLU A 67 0.026 1.758 12.991 1.00 10.00 H new ATOM 0 HB3 GLU A 67 -0.372 1.163 14.591 1.00 10.00 H new ATOM 0 HG2 GLU A 67 0.898 -0.527 12.406 1.00 10.00 H new ATOM 0 HG3 GLU A 67 1.798 0.296 13.664 1.00 10.00 H new ATOM 806 N GLY A 68 -3.754 1.458 12.665 1.00 10.00 N ATOM 807 CA GLY A 68 -4.879 2.297 13.020 1.00 10.00 C ATOM 808 C GLY A 68 -4.800 3.670 12.386 1.00 10.00 C ATOM 809 O GLY A 68 -5.811 4.366 12.265 1.00 10.00 O ATOM 0 H GLY A 68 -3.812 1.032 11.740 1.00 10.00 H new ATOM 0 HA2 GLY A 68 -5.804 1.810 12.710 1.00 10.00 H new ATOM 0 HA3 GLY A 68 -4.922 2.403 14.104 1.00 10.00 H new ATOM 813 N GLN A 69 -3.600 4.062 11.980 1.00 10.00 N ATOM 814 CA GLN A 69 -3.391 5.360 11.355 1.00 10.00 C ATOM 815 C GLN A 69 -3.534 5.246 9.844 1.00 10.00 C ATOM 816 O GLN A 69 -3.347 4.170 9.278 1.00 10.00 O ATOM 817 CB GLN A 69 -2.009 5.909 11.712 1.00 10.00 C ATOM 818 CG GLN A 69 -1.719 5.904 13.205 1.00 10.00 C ATOM 819 CD GLN A 69 -0.523 6.758 13.572 1.00 10.00 C ATOM 820 OE1 GLN A 69 0.419 6.899 12.791 1.00 10.00 O ATOM 821 NE2 GLN A 69 -0.554 7.342 14.759 1.00 10.00 N ATOM 0 H GLN A 69 -2.755 3.498 12.073 1.00 10.00 H new ATOM 0 HA GLN A 69 -4.147 6.050 11.730 1.00 10.00 H new ATOM 0 HB2 GLN A 69 -1.249 5.318 11.201 1.00 10.00 H new ATOM 0 HB3 GLN A 69 -1.925 6.929 11.337 1.00 10.00 H new ATOM 0 HG2 GLN A 69 -2.596 6.265 13.742 1.00 10.00 H new ATOM 0 HG3 GLN A 69 -1.543 4.880 13.533 1.00 10.00 H new ATOM 0 HE21 GLN A 69 -1.353 7.200 15.377 1.00 10.00 H new ATOM 0 HE22 GLN A 69 0.221 7.935 15.056 1.00 10.00 H new ATOM 830 N ARG A 70 -3.864 6.347 9.187 1.00 10.00 N ATOM 831 CA ARG A 70 -4.021 6.329 7.742 1.00 10.00 C ATOM 832 C ARG A 70 -2.755 6.840 7.064 1.00 10.00 C ATOM 833 O ARG A 70 -2.211 7.884 7.430 1.00 10.00 O ATOM 834 CB ARG A 70 -5.250 7.141 7.307 1.00 10.00 C ATOM 835 CG ARG A 70 -5.206 8.613 7.695 1.00 10.00 C ATOM 836 CD ARG A 70 -6.555 9.286 7.482 1.00 10.00 C ATOM 837 NE ARG A 70 -7.008 9.207 6.089 1.00 10.00 N ATOM 838 CZ ARG A 70 -8.245 8.852 5.721 1.00 10.00 C ATOM 839 NH1 ARG A 70 -9.158 8.539 6.636 1.00 10.00 N ATOM 840 NH2 ARG A 70 -8.568 8.817 4.431 1.00 10.00 N ATOM 0 H ARG A 70 -4.027 7.254 9.625 1.00 10.00 H new ATOM 0 HA ARG A 70 -4.184 5.298 7.429 1.00 10.00 H new ATOM 0 HB2 ARG A 70 -5.354 7.067 6.224 1.00 10.00 H new ATOM 0 HB3 ARG A 70 -6.141 6.690 7.744 1.00 10.00 H new ATOM 0 HG2 ARG A 70 -4.913 8.706 8.741 1.00 10.00 H new ATOM 0 HG3 ARG A 70 -4.446 9.124 7.104 1.00 10.00 H new ATOM 0 HD2 ARG A 70 -7.297 8.818 8.129 1.00 10.00 H new ATOM 0 HD3 ARG A 70 -6.487 10.332 7.780 1.00 10.00 H new ATOM 0 HE ARG A 70 -6.338 9.437 5.355 1.00 10.00 H new ATOM 0 HH11 ARG A 70 -8.918 8.568 7.627 1.00 10.00 H new ATOM 0 HH12 ARG A 70 -10.098 8.270 6.347 1.00 10.00 H new ATOM 0 HH21 ARG A 70 -7.874 9.060 3.725 1.00 10.00 H new ATOM 0 HH22 ARG A 70 -9.510 8.547 4.148 1.00 10.00 H new ATOM 854 N ILE A 71 -2.273 6.070 6.099 1.00 10.00 N ATOM 855 CA ILE A 71 -1.075 6.422 5.354 1.00 10.00 C ATOM 856 C ILE A 71 -1.349 7.605 4.433 1.00 10.00 C ATOM 857 O ILE A 71 -2.198 7.530 3.542 1.00 10.00 O ATOM 858 CB ILE A 71 -0.558 5.225 4.520 1.00 10.00 C ATOM 859 CG1 ILE A 71 -0.206 4.046 5.434 1.00 10.00 C ATOM 860 CG2 ILE A 71 0.647 5.629 3.685 1.00 10.00 C ATOM 861 CD1 ILE A 71 0.878 4.357 6.447 1.00 10.00 C ATOM 0 H ILE A 71 -2.699 5.189 5.812 1.00 10.00 H new ATOM 0 HA ILE A 71 -0.307 6.696 6.077 1.00 10.00 H new ATOM 0 HB ILE A 71 -1.353 4.913 3.843 1.00 10.00 H new ATOM 0 HG12 ILE A 71 -1.104 3.729 5.964 1.00 10.00 H new ATOM 0 HG13 ILE A 71 0.115 3.205 4.819 1.00 10.00 H new ATOM 0 HG21 ILE A 71 0.993 4.772 3.107 1.00 10.00 H new ATOM 0 HG22 ILE A 71 0.366 6.434 3.006 1.00 10.00 H new ATOM 0 HG23 ILE A 71 1.447 5.971 4.342 1.00 10.00 H new ATOM 0 HD11 ILE A 71 1.071 3.474 7.056 1.00 10.00 H new ATOM 0 HD12 ILE A 71 1.791 4.645 5.926 1.00 10.00 H new ATOM 0 HD13 ILE A 71 0.553 5.176 7.088 1.00 10.00 H new ATOM 873 N ALA A 72 -0.635 8.695 4.661 1.00 10.00 N ATOM 874 CA ALA A 72 -0.798 9.892 3.857 1.00 10.00 C ATOM 875 C ALA A 72 0.029 9.797 2.582 1.00 10.00 C ATOM 876 O ALA A 72 0.815 8.867 2.408 1.00 10.00 O ATOM 877 CB ALA A 72 -0.407 11.126 4.654 1.00 10.00 C ATOM 0 H ALA A 72 0.065 8.774 5.399 1.00 10.00 H new ATOM 0 HA ALA A 72 -1.849 9.979 3.580 1.00 10.00 H new ATOM 0 HB1 ALA A 72 -0.535 12.014 4.036 1.00 10.00 H new ATOM 0 HB2 ALA A 72 -1.040 11.204 5.538 1.00 10.00 H new ATOM 0 HB3 ALA A 72 0.636 11.045 4.961 1.00 10.00 H new ATOM 883 N ASP A 73 -0.158 10.756 1.696 1.00 10.00 N ATOM 884 CA ASP A 73 0.567 10.781 0.432 1.00 10.00 C ATOM 885 C ASP A 73 2.010 11.215 0.650 1.00 10.00 C ATOM 886 O ASP A 73 2.899 10.870 -0.125 1.00 10.00 O ATOM 887 CB ASP A 73 -0.125 11.716 -0.562 1.00 10.00 C ATOM 888 CG ASP A 73 -1.338 11.078 -1.215 1.00 10.00 C ATOM 889 OD1 ASP A 73 -1.956 10.189 -0.597 1.00 10.00 O ATOM 890 OD2 ASP A 73 -1.674 11.467 -2.354 1.00 10.00 O ATOM 0 H ASP A 73 -0.807 11.532 1.825 1.00 10.00 H new ATOM 0 HA ASP A 73 0.569 9.773 0.018 1.00 10.00 H new ATOM 0 HB2 ASP A 73 -0.431 12.626 -0.047 1.00 10.00 H new ATOM 0 HB3 ASP A 73 0.586 12.010 -1.334 1.00 10.00 H new ATOM 895 N ASN A 74 2.239 11.955 1.725 1.00 10.00 N ATOM 896 CA ASN A 74 3.579 12.430 2.051 1.00 10.00 C ATOM 897 C ASN A 74 4.240 11.505 3.069 1.00 10.00 C ATOM 898 O ASN A 74 5.186 11.890 3.756 1.00 10.00 O ATOM 899 CB ASN A 74 3.527 13.864 2.597 1.00 10.00 C ATOM 900 CG ASN A 74 2.727 13.978 3.881 1.00 10.00 C ATOM 901 OD1 ASN A 74 1.507 14.143 3.852 1.00 10.00 O ATOM 902 ND2 ASN A 74 3.407 13.892 5.012 1.00 10.00 N ATOM 0 H ASN A 74 1.517 12.240 2.386 1.00 10.00 H new ATOM 0 HA ASN A 74 4.173 12.427 1.137 1.00 10.00 H new ATOM 0 HB2 ASN A 74 4.543 14.217 2.775 1.00 10.00 H new ATOM 0 HB3 ASN A 74 3.090 14.519 1.843 1.00 10.00 H new ATOM 0 HD21 ASN A 74 2.921 13.963 5.906 1.00 10.00 H new ATOM 0 HD22 ASN A 74 4.418 13.755 4.990 1.00 10.00 H new ATOM 909 N HIS A 75 3.740 10.282 3.157 1.00 10.00 N ATOM 910 CA HIS A 75 4.280 9.303 4.088 1.00 10.00 C ATOM 911 C HIS A 75 5.418 8.517 3.447 1.00 10.00 C ATOM 912 O HIS A 75 5.432 8.296 2.232 1.00 10.00 O ATOM 913 CB HIS A 75 3.180 8.343 4.551 1.00 10.00 C ATOM 914 CG HIS A 75 2.750 8.556 5.969 1.00 10.00 C ATOM 915 ND1 HIS A 75 1.706 9.387 6.285 1.00 10.00 N ATOM 916 CD2 HIS A 75 3.246 8.018 7.110 1.00 10.00 C ATOM 917 CE1 HIS A 75 1.588 9.339 7.600 1.00 10.00 C ATOM 918 NE2 HIS A 75 2.498 8.523 8.143 1.00 10.00 N ATOM 0 H HIS A 75 2.960 9.943 2.594 1.00 10.00 H new ATOM 0 HA HIS A 75 4.671 9.839 4.953 1.00 10.00 H new ATOM 0 HB2 HIS A 75 2.314 8.455 3.898 1.00 10.00 H new ATOM 0 HB3 HIS A 75 3.534 7.318 4.438 1.00 10.00 H new ATOM 0 HD2 HIS A 75 4.071 7.325 7.190 1.00 10.00 H new ATOM 0 HE1 HIS A 75 0.850 9.889 8.165 1.00 10.00 H new ATOM 0 HE2 HIS A 75 2.614 8.316 9.135 1.00 10.00 H new ATOM 926 N THR A 76 6.369 8.107 4.267 1.00 10.00 N ATOM 927 CA THR A 76 7.510 7.341 3.796 1.00 10.00 C ATOM 928 C THR A 76 7.609 6.014 4.548 1.00 10.00 C ATOM 929 O THR A 76 7.263 5.945 5.723 1.00 10.00 O ATOM 930 CB THR A 76 8.820 8.136 3.975 1.00 10.00 C ATOM 931 OG1 THR A 76 8.566 9.354 4.697 1.00 10.00 O ATOM 932 CG2 THR A 76 9.442 8.464 2.626 1.00 10.00 C ATOM 0 H THR A 76 6.373 8.293 5.270 1.00 10.00 H new ATOM 0 HA THR A 76 7.364 7.142 2.734 1.00 10.00 H new ATOM 0 HB THR A 76 9.517 7.518 4.541 1.00 10.00 H new ATOM 0 HG1 THR A 76 7.971 9.168 5.453 1.00 10.00 H new ATOM 0 HG21 THR A 76 10.364 9.025 2.777 1.00 10.00 H new ATOM 0 HG22 THR A 76 9.663 7.539 2.093 1.00 10.00 H new ATOM 0 HG23 THR A 76 8.745 9.063 2.040 1.00 10.00 H new ATOM 940 N PRO A 77 8.078 4.937 3.889 1.00 10.00 N ATOM 941 CA PRO A 77 8.210 3.617 4.527 1.00 10.00 C ATOM 942 C PRO A 77 9.276 3.606 5.621 1.00 10.00 C ATOM 943 O PRO A 77 9.353 2.677 6.424 1.00 10.00 O ATOM 944 CB PRO A 77 8.622 2.687 3.374 1.00 10.00 C ATOM 945 CG PRO A 77 8.344 3.451 2.123 1.00 10.00 C ATOM 946 CD PRO A 77 8.495 4.902 2.477 1.00 10.00 C ATOM 0 HA PRO A 77 7.285 3.317 5.020 1.00 10.00 H new ATOM 0 HB2 PRO A 77 9.676 2.420 3.444 1.00 10.00 H new ATOM 0 HB3 PRO A 77 8.055 1.757 3.399 1.00 10.00 H new ATOM 0 HG2 PRO A 77 9.039 3.169 1.332 1.00 10.00 H new ATOM 0 HG3 PRO A 77 7.340 3.243 1.754 1.00 10.00 H new ATOM 0 HD2 PRO A 77 9.522 5.245 2.350 1.00 10.00 H new ATOM 0 HD3 PRO A 77 7.867 5.538 1.854 1.00 10.00 H new ATOM 954 N LYS A 78 10.095 4.650 5.645 1.00 10.00 N ATOM 955 CA LYS A 78 11.161 4.771 6.630 1.00 10.00 C ATOM 956 C LYS A 78 10.599 5.123 8.006 1.00 10.00 C ATOM 957 O LYS A 78 11.094 4.647 9.030 1.00 10.00 O ATOM 958 CB LYS A 78 12.162 5.842 6.185 1.00 10.00 C ATOM 959 CG LYS A 78 13.401 5.943 7.064 1.00 10.00 C ATOM 960 CD LYS A 78 14.421 4.857 6.740 1.00 10.00 C ATOM 961 CE LYS A 78 14.925 4.968 5.307 1.00 10.00 C ATOM 962 NZ LYS A 78 16.244 4.309 5.132 1.00 10.00 N ATOM 0 H LYS A 78 10.040 5.429 4.989 1.00 10.00 H new ATOM 0 HA LYS A 78 11.668 3.809 6.705 1.00 10.00 H new ATOM 0 HB2 LYS A 78 12.473 5.630 5.162 1.00 10.00 H new ATOM 0 HB3 LYS A 78 11.660 6.809 6.172 1.00 10.00 H new ATOM 0 HG2 LYS A 78 13.860 6.923 6.932 1.00 10.00 H new ATOM 0 HG3 LYS A 78 13.110 5.866 8.112 1.00 10.00 H new ATOM 0 HD2 LYS A 78 15.263 4.931 7.429 1.00 10.00 H new ATOM 0 HD3 LYS A 78 13.970 3.877 6.892 1.00 10.00 H new ATOM 0 HE2 LYS A 78 14.200 4.515 4.631 1.00 10.00 H new ATOM 0 HE3 LYS A 78 15.005 6.019 5.030 1.00 10.00 H new ATOM 0 HZ1 LYS A 78 16.552 4.407 4.144 1.00 10.00 H new ATOM 0 HZ2 LYS A 78 16.942 4.758 5.758 1.00 10.00 H new ATOM 0 HZ3 LYS A 78 16.163 3.300 5.371 1.00 10.00 H new ATOM 976 N GLU A 79 9.557 5.945 8.021 1.00 10.00 N ATOM 977 CA GLU A 79 8.938 6.373 9.268 1.00 10.00 C ATOM 978 C GLU A 79 7.933 5.333 9.751 1.00 10.00 C ATOM 979 O GLU A 79 7.672 4.350 9.053 1.00 10.00 O ATOM 980 CB GLU A 79 8.258 7.732 9.083 1.00 10.00 C ATOM 981 CG GLU A 79 7.042 7.692 8.175 1.00 10.00 C ATOM 982 CD GLU A 79 6.546 9.071 7.807 1.00 10.00 C ATOM 983 OE1 GLU A 79 6.025 9.775 8.699 1.00 10.00 O ATOM 984 OE2 GLU A 79 6.677 9.454 6.625 1.00 10.00 O ATOM 0 H GLU A 79 9.123 6.329 7.182 1.00 10.00 H new ATOM 0 HA GLU A 79 9.716 6.474 10.025 1.00 10.00 H new ATOM 0 HB2 GLU A 79 7.958 8.113 10.059 1.00 10.00 H new ATOM 0 HB3 GLU A 79 8.982 8.437 8.674 1.00 10.00 H new ATOM 0 HG2 GLU A 79 7.290 7.144 7.266 1.00 10.00 H new ATOM 0 HG3 GLU A 79 6.242 7.142 8.670 1.00 10.00 H new ATOM 991 N LEU A 80 7.383 5.558 10.949 1.00 10.00 N ATOM 992 CA LEU A 80 6.404 4.655 11.573 1.00 10.00 C ATOM 993 C LEU A 80 7.066 3.359 12.043 1.00 10.00 C ATOM 994 O LEU A 80 6.933 2.969 13.207 1.00 10.00 O ATOM 995 CB LEU A 80 5.238 4.335 10.621 1.00 10.00 C ATOM 996 CG LEU A 80 4.328 5.514 10.268 1.00 10.00 C ATOM 997 CD1 LEU A 80 3.260 5.074 9.281 1.00 10.00 C ATOM 998 CD2 LEU A 80 3.691 6.095 11.520 1.00 10.00 C ATOM 0 H LEU A 80 7.604 6.375 11.518 1.00 10.00 H new ATOM 0 HA LEU A 80 6.002 5.176 12.442 1.00 10.00 H new ATOM 0 HB2 LEU A 80 5.649 3.927 9.697 1.00 10.00 H new ATOM 0 HB3 LEU A 80 4.629 3.552 11.072 1.00 10.00 H new ATOM 0 HG LEU A 80 4.934 6.292 9.803 1.00 10.00 H new ATOM 0 HD11 LEU A 80 2.619 5.921 9.037 1.00 10.00 H new ATOM 0 HD12 LEU A 80 3.735 4.705 8.372 1.00 10.00 H new ATOM 0 HD13 LEU A 80 2.659 4.280 9.725 1.00 10.00 H new ATOM 0 HD21 LEU A 80 3.048 6.932 11.246 1.00 10.00 H new ATOM 0 HD22 LEU A 80 3.096 5.327 12.015 1.00 10.00 H new ATOM 0 HD23 LEU A 80 4.471 6.443 12.197 1.00 10.00 H new ATOM 1010 N GLY A 81 7.776 2.700 11.138 1.00 10.00 N ATOM 1011 CA GLY A 81 8.451 1.462 11.465 1.00 10.00 C ATOM 1012 C GLY A 81 7.950 0.308 10.619 1.00 10.00 C ATOM 1013 O GLY A 81 7.489 -0.700 11.149 1.00 10.00 O ATOM 0 H GLY A 81 7.897 3.006 10.172 1.00 10.00 H new ATOM 0 HA2 GLY A 81 9.524 1.583 11.316 1.00 10.00 H new ATOM 0 HA3 GLY A 81 8.299 1.233 12.520 1.00 10.00 H new ATOM 1017 N MET A 82 8.030 0.460 9.302 1.00 10.00 N ATOM 1018 CA MET A 82 7.581 -0.581 8.386 1.00 10.00 C ATOM 1019 C MET A 82 8.658 -1.643 8.219 1.00 10.00 C ATOM 1020 O MET A 82 9.829 -1.325 7.992 1.00 10.00 O ATOM 1021 CB MET A 82 7.217 0.017 7.023 1.00 10.00 C ATOM 1022 CG MET A 82 5.852 0.683 6.999 1.00 10.00 C ATOM 1023 SD MET A 82 5.394 1.282 5.360 1.00 10.00 S ATOM 1024 CE MET A 82 3.706 1.798 5.653 1.00 10.00 C ATOM 0 H MET A 82 8.401 1.293 8.845 1.00 10.00 H new ATOM 0 HA MET A 82 6.691 -1.046 8.810 1.00 10.00 H new ATOM 0 HB2 MET A 82 7.975 0.749 6.742 1.00 10.00 H new ATOM 0 HB3 MET A 82 7.241 -0.772 6.271 1.00 10.00 H new ATOM 0 HG2 MET A 82 5.100 -0.027 7.344 1.00 10.00 H new ATOM 0 HG3 MET A 82 5.848 1.518 7.700 1.00 10.00 H new ATOM 0 HE1 MET A 82 3.281 2.194 4.731 1.00 10.00 H new ATOM 0 HE2 MET A 82 3.117 0.944 5.986 1.00 10.00 H new ATOM 0 HE3 MET A 82 3.690 2.571 6.421 1.00 10.00 H new ATOM 1034 N GLU A 83 8.265 -2.900 8.348 1.00 10.00 N ATOM 1035 CA GLU A 83 9.199 -4.004 8.213 1.00 10.00 C ATOM 1036 C GLU A 83 8.757 -4.978 7.131 1.00 10.00 C ATOM 1037 O GLU A 83 7.727 -4.787 6.485 1.00 10.00 O ATOM 1038 CB GLU A 83 9.337 -4.743 9.544 1.00 10.00 C ATOM 1039 CG GLU A 83 10.588 -4.370 10.319 1.00 10.00 C ATOM 1040 CD GLU A 83 11.857 -4.577 9.517 1.00 10.00 C ATOM 1041 OE1 GLU A 83 11.870 -5.451 8.623 1.00 10.00 O ATOM 1042 OE2 GLU A 83 12.851 -3.862 9.777 1.00 10.00 O ATOM 0 H GLU A 83 7.305 -3.180 8.546 1.00 10.00 H new ATOM 0 HA GLU A 83 10.164 -3.588 7.924 1.00 10.00 H new ATOM 0 HB2 GLU A 83 8.462 -4.533 10.159 1.00 10.00 H new ATOM 0 HB3 GLU A 83 9.343 -5.816 9.355 1.00 10.00 H new ATOM 0 HG2 GLU A 83 10.523 -3.326 10.625 1.00 10.00 H new ATOM 0 HG3 GLU A 83 10.637 -4.967 11.230 1.00 10.00 H new ATOM 1049 N GLU A 84 9.554 -6.018 6.934 1.00 10.00 N ATOM 1050 CA GLU A 84 9.249 -7.043 5.948 1.00 10.00 C ATOM 1051 C GLU A 84 8.114 -7.926 6.468 1.00 10.00 C ATOM 1052 O GLU A 84 8.065 -8.232 7.664 1.00 10.00 O ATOM 1053 CB GLU A 84 10.504 -7.876 5.663 1.00 10.00 C ATOM 1054 CG GLU A 84 10.317 -8.960 4.610 1.00 10.00 C ATOM 1055 CD GLU A 84 9.656 -8.451 3.343 1.00 10.00 C ATOM 1056 OE1 GLU A 84 10.088 -7.404 2.816 1.00 10.00 O ATOM 1057 OE2 GLU A 84 8.702 -9.109 2.871 1.00 10.00 O ATOM 0 H GLU A 84 10.421 -6.174 7.447 1.00 10.00 H new ATOM 0 HA GLU A 84 8.929 -6.577 5.016 1.00 10.00 H new ATOM 0 HB2 GLU A 84 11.303 -7.208 5.341 1.00 10.00 H new ATOM 0 HB3 GLU A 84 10.834 -8.342 6.591 1.00 10.00 H new ATOM 0 HG2 GLU A 84 11.288 -9.387 4.360 1.00 10.00 H new ATOM 0 HG3 GLU A 84 9.714 -9.765 5.029 1.00 10.00 H new ATOM 1064 N GLU A 85 7.205 -8.315 5.567 1.00 10.00 N ATOM 1065 CA GLU A 85 6.047 -9.144 5.914 1.00 10.00 C ATOM 1066 C GLU A 85 5.086 -8.366 6.808 1.00 10.00 C ATOM 1067 O GLU A 85 4.299 -8.957 7.555 1.00 10.00 O ATOM 1068 CB GLU A 85 6.468 -10.443 6.618 1.00 10.00 C ATOM 1069 CG GLU A 85 7.163 -11.450 5.716 1.00 10.00 C ATOM 1070 CD GLU A 85 6.208 -12.155 4.773 1.00 10.00 C ATOM 1071 OE1 GLU A 85 5.121 -12.580 5.217 1.00 10.00 O ATOM 1072 OE2 GLU A 85 6.553 -12.302 3.585 1.00 10.00 O ATOM 0 H GLU A 85 7.252 -8.064 4.579 1.00 10.00 H new ATOM 0 HA GLU A 85 5.546 -9.409 4.983 1.00 10.00 H new ATOM 0 HB2 GLU A 85 7.133 -10.194 7.445 1.00 10.00 H new ATOM 0 HB3 GLU A 85 5.583 -10.911 7.050 1.00 10.00 H new ATOM 0 HG2 GLU A 85 7.930 -10.940 5.134 1.00 10.00 H new ATOM 0 HG3 GLU A 85 7.671 -12.192 6.332 1.00 10.00 H new ATOM 1079 N ASP A 86 5.152 -7.039 6.727 1.00 10.00 N ATOM 1080 CA ASP A 86 4.291 -6.181 7.533 1.00 10.00 C ATOM 1081 C ASP A 86 2.857 -6.251 7.040 1.00 10.00 C ATOM 1082 O ASP A 86 2.607 -6.625 5.895 1.00 10.00 O ATOM 1083 CB ASP A 86 4.778 -4.734 7.512 1.00 10.00 C ATOM 1084 CG ASP A 86 4.707 -4.100 8.883 1.00 10.00 C ATOM 1085 OD1 ASP A 86 3.686 -4.297 9.578 1.00 10.00 O ATOM 1086 OD2 ASP A 86 5.675 -3.422 9.282 1.00 10.00 O ATOM 0 H ASP A 86 5.792 -6.536 6.112 1.00 10.00 H new ATOM 0 HA ASP A 86 4.332 -6.542 8.561 1.00 10.00 H new ATOM 0 HB2 ASP A 86 5.805 -4.701 7.149 1.00 10.00 H new ATOM 0 HB3 ASP A 86 4.174 -4.157 6.812 1.00 10.00 H new ATOM 1091 N VAL A 87 1.921 -5.876 7.895 1.00 10.00 N ATOM 1092 CA VAL A 87 0.511 -5.934 7.543 1.00 10.00 C ATOM 1093 C VAL A 87 -0.108 -4.543 7.473 1.00 10.00 C ATOM 1094 O VAL A 87 0.054 -3.726 8.383 1.00 10.00 O ATOM 1095 CB VAL A 87 -0.288 -6.793 8.550 1.00 10.00 C ATOM 1096 CG1 VAL A 87 -1.735 -6.942 8.102 1.00 10.00 C ATOM 1097 CG2 VAL A 87 0.365 -8.156 8.728 1.00 10.00 C ATOM 0 H VAL A 87 2.110 -5.529 8.835 1.00 10.00 H new ATOM 0 HA VAL A 87 0.457 -6.396 6.557 1.00 10.00 H new ATOM 0 HB VAL A 87 -0.282 -6.284 9.514 1.00 10.00 H new ATOM 0 HG11 VAL A 87 -2.279 -7.550 8.825 1.00 10.00 H new ATOM 0 HG12 VAL A 87 -2.198 -5.958 8.034 1.00 10.00 H new ATOM 0 HG13 VAL A 87 -1.766 -7.425 7.125 1.00 10.00 H new ATOM 0 HG21 VAL A 87 -0.212 -8.746 9.440 1.00 10.00 H new ATOM 0 HG22 VAL A 87 0.395 -8.673 7.769 1.00 10.00 H new ATOM 0 HG23 VAL A 87 1.381 -8.027 9.102 1.00 10.00 H new ATOM 1107 N ILE A 88 -0.808 -4.284 6.381 1.00 10.00 N ATOM 1108 CA ILE A 88 -1.485 -3.020 6.172 1.00 10.00 C ATOM 1109 C ILE A 88 -2.876 -3.298 5.599 1.00 10.00 C ATOM 1110 O ILE A 88 -3.048 -4.210 4.790 1.00 10.00 O ATOM 1111 CB ILE A 88 -0.673 -2.085 5.243 1.00 10.00 C ATOM 1112 CG1 ILE A 88 -1.392 -0.744 5.054 1.00 10.00 C ATOM 1113 CG2 ILE A 88 -0.406 -2.750 3.901 1.00 10.00 C ATOM 1114 CD1 ILE A 88 -0.543 0.306 4.368 1.00 10.00 C ATOM 0 H ILE A 88 -0.922 -4.947 5.614 1.00 10.00 H new ATOM 0 HA ILE A 88 -1.580 -2.503 7.127 1.00 10.00 H new ATOM 0 HB ILE A 88 0.288 -1.889 5.719 1.00 10.00 H new ATOM 0 HG12 ILE A 88 -2.298 -0.906 4.470 1.00 10.00 H new ATOM 0 HG13 ILE A 88 -1.704 -0.368 6.028 1.00 10.00 H new ATOM 0 HG21 ILE A 88 0.166 -2.073 3.267 1.00 10.00 H new ATOM 0 HG22 ILE A 88 0.161 -3.668 4.056 1.00 10.00 H new ATOM 0 HG23 ILE A 88 -1.354 -2.987 3.417 1.00 10.00 H new ATOM 0 HD11 ILE A 88 -1.115 1.228 4.268 1.00 10.00 H new ATOM 0 HD12 ILE A 88 0.351 0.496 4.962 1.00 10.00 H new ATOM 0 HD13 ILE A 88 -0.252 -0.050 3.380 1.00 10.00 H new ATOM 1126 N GLU A 89 -3.868 -2.542 6.032 1.00 10.00 N ATOM 1127 CA GLU A 89 -5.232 -2.756 5.572 1.00 10.00 C ATOM 1128 C GLU A 89 -5.666 -1.689 4.582 1.00 10.00 C ATOM 1129 O GLU A 89 -5.222 -0.543 4.652 1.00 10.00 O ATOM 1130 CB GLU A 89 -6.189 -2.759 6.759 1.00 10.00 C ATOM 1131 CG GLU A 89 -6.011 -3.943 7.690 1.00 10.00 C ATOM 1132 CD GLU A 89 -6.628 -3.700 9.048 1.00 10.00 C ATOM 1133 OE1 GLU A 89 -7.837 -3.973 9.218 1.00 10.00 O ATOM 1134 OE2 GLU A 89 -5.906 -3.239 9.957 1.00 10.00 O ATOM 0 H GLU A 89 -3.758 -1.777 6.698 1.00 10.00 H new ATOM 0 HA GLU A 89 -5.259 -3.722 5.067 1.00 10.00 H new ATOM 0 HB2 GLU A 89 -6.051 -1.839 7.327 1.00 10.00 H new ATOM 0 HB3 GLU A 89 -7.214 -2.753 6.387 1.00 10.00 H new ATOM 0 HG2 GLU A 89 -6.463 -4.827 7.241 1.00 10.00 H new ATOM 0 HG3 GLU A 89 -4.948 -4.153 7.808 1.00 10.00 H new ATOM 1141 N VAL A 90 -6.536 -2.081 3.665 1.00 10.00 N ATOM 1142 CA VAL A 90 -7.066 -1.169 2.669 1.00 10.00 C ATOM 1143 C VAL A 90 -8.590 -1.270 2.645 1.00 10.00 C ATOM 1144 O VAL A 90 -9.156 -2.351 2.477 1.00 10.00 O ATOM 1145 CB VAL A 90 -6.472 -1.440 1.263 1.00 10.00 C ATOM 1146 CG1 VAL A 90 -6.809 -2.839 0.770 1.00 10.00 C ATOM 1147 CG2 VAL A 90 -6.946 -0.396 0.266 1.00 10.00 C ATOM 0 H VAL A 90 -6.892 -3.034 3.592 1.00 10.00 H new ATOM 0 HA VAL A 90 -6.775 -0.155 2.944 1.00 10.00 H new ATOM 0 HB VAL A 90 -5.388 -1.372 1.350 1.00 10.00 H new ATOM 0 HG11 VAL A 90 -6.375 -2.991 -0.218 1.00 10.00 H new ATOM 0 HG12 VAL A 90 -6.402 -3.576 1.462 1.00 10.00 H new ATOM 0 HG13 VAL A 90 -7.891 -2.954 0.713 1.00 10.00 H new ATOM 0 HG21 VAL A 90 -6.516 -0.607 -0.713 1.00 10.00 H new ATOM 0 HG22 VAL A 90 -8.034 -0.424 0.199 1.00 10.00 H new ATOM 0 HG23 VAL A 90 -6.629 0.593 0.596 1.00 10.00 H new ATOM 1157 N TYR A 91 -9.253 -0.146 2.858 1.00 10.00 N ATOM 1158 CA TYR A 91 -10.709 -0.117 2.873 1.00 10.00 C ATOM 1159 C TYR A 91 -11.232 0.960 1.938 1.00 10.00 C ATOM 1160 O TYR A 91 -10.507 1.891 1.591 1.00 10.00 O ATOM 1161 CB TYR A 91 -11.229 0.124 4.293 1.00 10.00 C ATOM 1162 CG TYR A 91 -10.945 -1.013 5.249 1.00 10.00 C ATOM 1163 CD1 TYR A 91 -11.777 -2.125 5.306 1.00 10.00 C ATOM 1164 CD2 TYR A 91 -9.844 -0.974 6.096 1.00 10.00 C ATOM 1165 CE1 TYR A 91 -11.517 -3.165 6.178 1.00 10.00 C ATOM 1166 CE2 TYR A 91 -9.579 -2.008 6.971 1.00 10.00 C ATOM 1167 CZ TYR A 91 -10.419 -3.101 7.009 1.00 10.00 C ATOM 1168 OH TYR A 91 -10.156 -4.137 7.877 1.00 10.00 O ATOM 0 H TYR A 91 -8.809 0.757 3.023 1.00 10.00 H new ATOM 0 HA TYR A 91 -11.071 -1.086 2.528 1.00 10.00 H new ATOM 0 HB2 TYR A 91 -10.779 1.036 4.685 1.00 10.00 H new ATOM 0 HB3 TYR A 91 -12.305 0.292 4.252 1.00 10.00 H new ATOM 0 HD1 TYR A 91 -12.640 -2.177 4.659 1.00 10.00 H new ATOM 0 HD2 TYR A 91 -9.184 -0.120 6.069 1.00 10.00 H new ATOM 0 HE1 TYR A 91 -12.171 -4.024 6.208 1.00 10.00 H new ATOM 0 HE2 TYR A 91 -8.719 -1.961 7.622 1.00 10.00 H new ATOM 0 HH TYR A 91 -9.292 -3.986 8.314 1.00 10.00 H new ATOM 1178 N GLN A 92 -12.487 0.833 1.540 1.00 10.00 N ATOM 1179 CA GLN A 92 -13.103 1.797 0.646 1.00 10.00 C ATOM 1180 C GLN A 92 -13.524 3.041 1.421 1.00 10.00 C ATOM 1181 O GLN A 92 -14.225 2.947 2.431 1.00 10.00 O ATOM 1182 CB GLN A 92 -14.307 1.168 -0.055 1.00 10.00 C ATOM 1183 CG GLN A 92 -15.032 2.112 -1.000 1.00 10.00 C ATOM 1184 CD GLN A 92 -16.058 1.400 -1.857 1.00 10.00 C ATOM 1185 OE1 GLN A 92 -15.761 0.971 -2.975 1.00 10.00 O ATOM 1186 NE2 GLN A 92 -17.267 1.263 -1.339 1.00 10.00 N ATOM 0 H GLN A 92 -13.100 0.069 1.824 1.00 10.00 H new ATOM 0 HA GLN A 92 -12.376 2.092 -0.111 1.00 10.00 H new ATOM 0 HB2 GLN A 92 -13.973 0.294 -0.615 1.00 10.00 H new ATOM 0 HB3 GLN A 92 -15.010 0.814 0.699 1.00 10.00 H new ATOM 0 HG2 GLN A 92 -15.526 2.892 -0.421 1.00 10.00 H new ATOM 0 HG3 GLN A 92 -14.304 2.605 -1.644 1.00 10.00 H new ATOM 0 HE21 GLN A 92 -17.469 1.633 -0.410 1.00 10.00 H new ATOM 0 HE22 GLN A 92 -17.998 0.787 -1.868 1.00 10.00 H new ATOM 1195 N GLU A 93 -13.074 4.195 0.951 1.00 10.00 N ATOM 1196 CA GLU A 93 -13.393 5.464 1.586 1.00 10.00 C ATOM 1197 C GLU A 93 -14.843 5.847 1.327 1.00 10.00 C ATOM 1198 O GLU A 93 -15.393 5.543 0.267 1.00 10.00 O ATOM 1199 CB GLU A 93 -12.464 6.563 1.065 1.00 10.00 C ATOM 1200 CG GLU A 93 -11.143 6.652 1.813 1.00 10.00 C ATOM 1201 CD GLU A 93 -11.320 7.118 3.245 1.00 10.00 C ATOM 1202 OE1 GLU A 93 -11.729 6.301 4.094 1.00 10.00 O ATOM 1203 OE2 GLU A 93 -11.057 8.309 3.526 1.00 10.00 O ATOM 0 H GLU A 93 -12.482 4.278 0.125 1.00 10.00 H new ATOM 0 HA GLU A 93 -13.250 5.354 2.661 1.00 10.00 H new ATOM 0 HB2 GLU A 93 -12.262 6.385 0.009 1.00 10.00 H new ATOM 0 HB3 GLU A 93 -12.976 7.523 1.135 1.00 10.00 H new ATOM 0 HG2 GLU A 93 -10.660 5.675 1.809 1.00 10.00 H new ATOM 0 HG3 GLU A 93 -10.478 7.339 1.290 1.00 10.00 H new ATOM 1210 N GLN A 94 -15.449 6.538 2.292 1.00 10.00 N ATOM 1211 CA GLN A 94 -16.842 6.970 2.176 1.00 10.00 C ATOM 1212 C GLN A 94 -17.010 7.989 1.052 1.00 10.00 C ATOM 1213 O GLN A 94 -18.120 8.231 0.581 1.00 10.00 O ATOM 1214 CB GLN A 94 -17.328 7.569 3.498 1.00 10.00 C ATOM 1215 CG GLN A 94 -17.435 6.554 4.620 1.00 10.00 C ATOM 1216 CD GLN A 94 -18.372 7.004 5.723 1.00 10.00 C ATOM 1217 OE1 GLN A 94 -19.574 6.735 5.679 1.00 10.00 O ATOM 1218 NE2 GLN A 94 -17.832 7.691 6.717 1.00 10.00 N ATOM 0 H GLN A 94 -14.996 6.811 3.164 1.00 10.00 H new ATOM 0 HA GLN A 94 -17.444 6.093 1.939 1.00 10.00 H new ATOM 0 HB2 GLN A 94 -16.645 8.363 3.801 1.00 10.00 H new ATOM 0 HB3 GLN A 94 -18.303 8.030 3.342 1.00 10.00 H new ATOM 0 HG2 GLN A 94 -17.786 5.605 4.215 1.00 10.00 H new ATOM 0 HG3 GLN A 94 -16.445 6.375 5.039 1.00 10.00 H new ATOM 0 HE21 GLN A 94 -16.832 7.892 6.714 1.00 10.00 H new ATOM 0 HE22 GLN A 94 -18.416 8.020 7.486 1.00 10.00 H new ATOM 1227 N THR A 95 -15.901 8.577 0.624 1.00 10.00 N ATOM 1228 CA THR A 95 -15.921 9.554 -0.448 1.00 10.00 C ATOM 1229 C THR A 95 -16.240 8.887 -1.783 1.00 10.00 C ATOM 1230 O THR A 95 -16.781 9.518 -2.688 1.00 10.00 O ATOM 1231 CB THR A 95 -14.567 10.276 -0.548 1.00 10.00 C ATOM 1232 OG1 THR A 95 -13.532 9.429 -0.023 1.00 10.00 O ATOM 1233 CG2 THR A 95 -14.594 11.589 0.221 1.00 10.00 C ATOM 0 H THR A 95 -14.974 8.391 1.007 1.00 10.00 H new ATOM 0 HA THR A 95 -16.699 10.282 -0.220 1.00 10.00 H new ATOM 0 HB THR A 95 -14.368 10.496 -1.597 1.00 10.00 H new ATOM 0 HG1 THR A 95 -12.669 9.888 -0.088 1.00 10.00 H new ATOM 0 HG21 THR A 95 -13.625 12.081 0.135 1.00 10.00 H new ATOM 0 HG22 THR A 95 -15.368 12.237 -0.192 1.00 10.00 H new ATOM 0 HG23 THR A 95 -14.809 11.391 1.271 1.00 10.00 H new ATOM 1241 N GLY A 96 -15.909 7.605 -1.899 1.00 10.00 N ATOM 1242 CA GLY A 96 -16.165 6.879 -3.128 1.00 10.00 C ATOM 1243 C GLY A 96 -15.008 6.979 -4.101 1.00 10.00 C ATOM 1244 O GLY A 96 -14.711 6.027 -4.825 1.00 10.00 O ATOM 0 H GLY A 96 -15.467 7.056 -1.162 1.00 10.00 H new ATOM 0 HA2 GLY A 96 -16.354 5.831 -2.897 1.00 10.00 H new ATOM 0 HA3 GLY A 96 -17.068 7.269 -3.598 1.00 10.00 H new ATOM 1286 N ARG B 359 -2.177 -15.043 -2.591 1.00 10.00 N ATOM 1287 CA ARG B 359 -1.142 -14.032 -2.435 1.00 10.00 C ATOM 1288 C ARG B 359 -0.581 -13.623 -3.795 1.00 10.00 C ATOM 1289 O ARG B 359 -0.185 -14.478 -4.597 1.00 10.00 O ATOM 1290 CB ARG B 359 -0.017 -14.540 -1.523 1.00 10.00 C ATOM 1291 CG ARG B 359 -0.047 -16.043 -1.279 1.00 10.00 C ATOM 1292 CD ARG B 359 1.076 -16.485 -0.354 1.00 10.00 C ATOM 1293 NE ARG B 359 0.987 -15.862 0.966 1.00 10.00 N ATOM 1294 CZ ARG B 359 2.024 -15.686 1.786 1.00 10.00 C ATOM 1295 NH1 ARG B 359 3.228 -16.125 1.447 1.00 10.00 N ATOM 1296 NH2 ARG B 359 1.858 -15.058 2.942 1.00 10.00 N ATOM 0 HA ARG B 359 -1.592 -13.156 -1.968 1.00 10.00 H new ATOM 0 HB2 ARG B 359 0.943 -14.273 -1.965 1.00 10.00 H new ATOM 0 HB3 ARG B 359 -0.081 -14.025 -0.564 1.00 10.00 H new ATOM 0 HG2 ARG B 359 -1.007 -16.322 -0.845 1.00 10.00 H new ATOM 0 HG3 ARG B 359 0.037 -16.568 -2.231 1.00 10.00 H new ATOM 0 HD2 ARG B 359 1.047 -17.569 -0.244 1.00 10.00 H new ATOM 0 HD3 ARG B 359 2.036 -16.236 -0.807 1.00 10.00 H new ATOM 0 HE ARG B 359 0.071 -15.541 1.280 1.00 10.00 H new ATOM 0 HH11 ARG B 359 3.365 -16.600 0.555 1.00 10.00 H new ATOM 0 HH12 ARG B 359 4.017 -15.988 2.078 1.00 10.00 H new ATOM 0 HH21 ARG B 359 0.936 -14.709 3.205 1.00 10.00 H new ATOM 0 HH22 ARG B 359 2.652 -14.924 3.568 1.00 10.00 H new ATOM 1310 N ASP B 360 -0.542 -12.319 -4.045 1.00 10.00 N ATOM 1311 CA ASP B 360 -0.039 -11.785 -5.310 1.00 10.00 C ATOM 1312 C ASP B 360 0.998 -10.693 -5.072 1.00 10.00 C ATOM 1313 O ASP B 360 0.671 -9.616 -4.570 1.00 10.00 O ATOM 1314 CB ASP B 360 -1.198 -11.236 -6.158 1.00 10.00 C ATOM 1315 CG ASP B 360 -0.737 -10.622 -7.471 1.00 10.00 C ATOM 1316 OD1 ASP B 360 -1.198 -9.508 -7.809 1.00 10.00 O ATOM 1317 OD2 ASP B 360 0.070 -11.260 -8.183 1.00 10.00 O ATOM 0 H ASP B 360 -0.854 -11.607 -3.385 1.00 10.00 H new ATOM 0 HA ASP B 360 0.442 -12.600 -5.851 1.00 10.00 H new ATOM 0 HB2 ASP B 360 -1.901 -12.042 -6.368 1.00 10.00 H new ATOM 0 HB3 ASP B 360 -1.738 -10.484 -5.582 1.00 10.00 H new ATOM 1322 N PRO B 361 2.272 -10.973 -5.391 1.00 10.00 N ATOM 1323 CA PRO B 361 3.359 -10.008 -5.233 1.00 10.00 C ATOM 1324 C PRO B 361 3.391 -9.008 -6.388 1.00 10.00 C ATOM 1325 O PRO B 361 3.462 -9.394 -7.556 1.00 10.00 O ATOM 1326 CB PRO B 361 4.606 -10.886 -5.236 1.00 10.00 C ATOM 1327 CG PRO B 361 4.242 -12.066 -6.070 1.00 10.00 C ATOM 1328 CD PRO B 361 2.754 -12.262 -5.923 1.00 10.00 C ATOM 0 HA PRO B 361 3.260 -9.403 -4.332 1.00 10.00 H new ATOM 0 HB2 PRO B 361 5.462 -10.356 -5.654 1.00 10.00 H new ATOM 0 HB3 PRO B 361 4.880 -11.186 -4.225 1.00 10.00 H new ATOM 0 HG2 PRO B 361 4.508 -11.899 -7.114 1.00 10.00 H new ATOM 0 HG3 PRO B 361 4.783 -12.953 -5.741 1.00 10.00 H new ATOM 0 HD2 PRO B 361 2.287 -12.498 -6.879 1.00 10.00 H new ATOM 0 HD3 PRO B 361 2.525 -13.084 -5.244 1.00 10.00 H new ATOM 1336 N ILE B 362 3.336 -7.726 -6.065 1.00 10.00 N ATOM 1337 CA ILE B 362 3.331 -6.689 -7.086 1.00 10.00 C ATOM 1338 C ILE B 362 4.512 -5.735 -6.956 1.00 10.00 C ATOM 1339 O ILE B 362 4.715 -5.118 -5.911 1.00 10.00 O ATOM 1340 CB ILE B 362 2.016 -5.878 -7.047 1.00 10.00 C ATOM 1341 CG1 ILE B 362 0.813 -6.818 -7.181 1.00 10.00 C ATOM 1342 CG2 ILE B 362 1.998 -4.830 -8.153 1.00 10.00 C ATOM 1343 CD1 ILE B 362 -0.410 -6.343 -6.429 1.00 10.00 C ATOM 0 H ILE B 362 3.294 -7.378 -5.107 1.00 10.00 H new ATOM 0 HA ILE B 362 3.416 -7.205 -8.042 1.00 10.00 H new ATOM 0 HB ILE B 362 1.954 -5.363 -6.088 1.00 10.00 H new ATOM 0 HG12 ILE B 362 0.562 -6.926 -8.236 1.00 10.00 H new ATOM 0 HG13 ILE B 362 1.092 -7.807 -6.817 1.00 10.00 H new ATOM 0 HG21 ILE B 362 1.064 -4.270 -8.108 1.00 10.00 H new ATOM 0 HG22 ILE B 362 2.837 -4.147 -8.021 1.00 10.00 H new ATOM 0 HG23 ILE B 362 2.080 -5.322 -9.122 1.00 10.00 H new ATOM 0 HD11 ILE B 362 -1.222 -7.056 -6.568 1.00 10.00 H new ATOM 0 HD12 ILE B 362 -0.176 -6.262 -5.368 1.00 10.00 H new ATOM 0 HD13 ILE B 362 -0.714 -5.368 -6.809 1.00 10.00 H new ATOM 1355 N VAL B 363 5.290 -5.632 -8.026 1.00 10.00 N ATOM 1356 CA VAL B 363 6.434 -4.737 -8.068 1.00 10.00 C ATOM 1357 C VAL B 363 6.118 -3.565 -8.991 1.00 10.00 C ATOM 1358 O VAL B 363 5.816 -3.760 -10.170 1.00 10.00 O ATOM 1359 CB VAL B 363 7.705 -5.455 -8.572 1.00 10.00 C ATOM 1360 CG1 VAL B 363 8.916 -4.542 -8.459 1.00 10.00 C ATOM 1361 CG2 VAL B 363 7.937 -6.747 -7.804 1.00 10.00 C ATOM 0 H VAL B 363 5.145 -6.164 -8.884 1.00 10.00 H new ATOM 0 HA VAL B 363 6.627 -4.386 -7.054 1.00 10.00 H new ATOM 0 HB VAL B 363 7.559 -5.705 -9.623 1.00 10.00 H new ATOM 0 HG11 VAL B 363 9.801 -5.066 -8.819 1.00 10.00 H new ATOM 0 HG12 VAL B 363 8.754 -3.647 -9.060 1.00 10.00 H new ATOM 0 HG13 VAL B 363 9.061 -4.258 -7.417 1.00 10.00 H new ATOM 0 HG21 VAL B 363 8.838 -7.235 -8.177 1.00 10.00 H new ATOM 0 HG22 VAL B 363 8.057 -6.524 -6.744 1.00 10.00 H new ATOM 0 HG23 VAL B 363 7.082 -7.410 -7.940 1.00 10.00 H new ATOM 1371 N ILE B 364 6.169 -2.355 -8.455 1.00 10.00 N ATOM 1372 CA ILE B 364 5.872 -1.165 -9.245 1.00 10.00 C ATOM 1373 C ILE B 364 7.121 -0.635 -9.940 1.00 10.00 C ATOM 1374 O ILE B 364 8.237 -1.084 -9.671 1.00 10.00 O ATOM 1375 CB ILE B 364 5.262 -0.040 -8.380 1.00 10.00 C ATOM 1376 CG1 ILE B 364 6.294 0.498 -7.385 1.00 10.00 C ATOM 1377 CG2 ILE B 364 4.029 -0.545 -7.644 1.00 10.00 C ATOM 1378 CD1 ILE B 364 6.284 2.009 -7.262 1.00 10.00 C ATOM 0 H ILE B 364 6.412 -2.169 -7.482 1.00 10.00 H new ATOM 0 HA ILE B 364 5.142 -1.468 -9.996 1.00 10.00 H new ATOM 0 HB ILE B 364 4.964 0.775 -9.039 1.00 10.00 H new ATOM 0 HG12 ILE B 364 6.105 0.060 -6.405 1.00 10.00 H new ATOM 0 HG13 ILE B 364 7.288 0.173 -7.693 1.00 10.00 H new ATOM 0 HG21 ILE B 364 3.611 0.260 -7.039 1.00 10.00 H new ATOM 0 HG22 ILE B 364 3.285 -0.879 -8.367 1.00 10.00 H new ATOM 0 HG23 ILE B 364 4.307 -1.378 -6.998 1.00 10.00 H new ATOM 0 HD11 ILE B 364 7.040 2.320 -6.541 1.00 10.00 H new ATOM 0 HD12 ILE B 364 6.503 2.454 -8.232 1.00 10.00 H new ATOM 0 HD13 ILE B 364 5.302 2.340 -6.924 1.00 10.00 H new