USER MOD reduce.3.24.130724 H: found=0, std=0, add=872, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 870 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 8 ASN : amide:sc= -1.81 K(o=-2.7,f=-11!) USER MOD Set 1.2: B 10 ASN : amide:sc= -0.913 K(o=-2.7,f=-10!) USER MOD Set 2.1: B 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.2: B 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 3.1: A 8 ASN : amide:sc= -1.79! C(o=-2.8!,f=-11!) USER MOD Set 3.2: A 10 ASN : amide:sc= -0.967 K(o=-2.8,f=-10!) USER MOD Set 4.1: A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 4.2: A 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET CE :methyl -109:sc= -4.19! (180deg=-8.79!) USER MOD Single : A 4 LYS NZ :NH3+ 169:sc= 0.107 (180deg=0.0787) USER MOD Single : A 9 HIS :FLIP no HD1:sc= -1.46 F(o=-2.1,f=-1.5) USER MOD Single : A 15 LYS NZ :NH3+ -173:sc= -0.0726 (180deg=-0.129) USER MOD Single : A 17 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 18 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 21 LYS NZ :NH3+ -136:sc= 0 (180deg=-0.51) USER MOD Single : A 31 ASN : amide:sc= -0.0467 X(o=-0.047,f=-0.049) USER MOD Single : A 32 LYS NZ :NH3+ -140:sc= -1.43 (180deg=-2.41) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 LYS NZ :NH3+ 157:sc= 0.0455 (180deg=0.00114) USER MOD Single : A 35 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 LYS NZ :NH3+ 169:sc= 0 (180deg=-0.199) USER MOD Single : A 46 THR OG1 : rot 180:sc= -0.355 USER MOD Single : B 1 MET CE :methyl -108:sc= -4.24! (180deg=-8.85!) USER MOD Single : B 4 LYS NZ :NH3+ 168:sc= 0.097 (180deg=0.073) USER MOD Single : B 9 HIS :FLIP no HD1:sc= -1.55 F(o=-2.1,f=-1.6) USER MOD Single : B 15 LYS NZ :NH3+ -173:sc= -0.0723 (180deg=-0.123) USER MOD Single : B 17 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 18 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 21 LYS NZ :NH3+ -135:sc= 0 (180deg=-0.494) USER MOD Single : B 31 ASN : amide:sc= -0.0364 X(o=-0.036,f=-0.041) USER MOD Single : B 32 LYS NZ :NH3+ -159:sc= -1.76 (180deg=-2.97) USER MOD Single : B 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 34 LYS NZ :NH3+ 156:sc= 0.0444 (180deg=0.000152) USER MOD Single : B 35 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 41 SER OG : rot 180:sc= 0 USER MOD Single : B 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 45 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.176) USER MOD Single : B 46 THR OG1 : rot 180:sc= -0.376 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -10.651 16.966 6.991 1.00 0.00 N ATOM 2 CA MET A 1 -10.592 15.475 7.023 1.00 0.00 C ATOM 3 C MET A 1 -10.901 14.922 5.625 1.00 0.00 C ATOM 4 O MET A 1 -11.969 14.391 5.373 1.00 0.00 O ATOM 5 CB MET A 1 -11.615 14.948 8.035 1.00 0.00 C ATOM 6 CG MET A 1 -10.936 14.739 9.389 1.00 0.00 C ATOM 7 SD MET A 1 -12.195 14.576 10.681 1.00 0.00 S ATOM 8 CE MET A 1 -12.706 12.882 10.298 1.00 0.00 C ATOM 0 H1 MET A 1 -10.442 17.342 7.938 1.00 0.00 H new ATOM 0 H2 MET A 1 -9.950 17.327 6.313 1.00 0.00 H new ATOM 0 H3 MET A 1 -11.602 17.270 6.700 1.00 0.00 H new ATOM 0 HA MET A 1 -9.595 15.151 7.321 1.00 0.00 H new ATOM 0 HB2 MET A 1 -12.439 15.654 8.135 1.00 0.00 H new ATOM 0 HB3 MET A 1 -12.041 14.009 7.682 1.00 0.00 H new ATOM 0 HG2 MET A 1 -10.312 13.846 9.360 1.00 0.00 H new ATOM 0 HG3 MET A 1 -10.279 15.580 9.611 1.00 0.00 H new ATOM 0 HE1 MET A 1 -13.703 12.893 9.858 1.00 0.00 H new ATOM 0 HE2 MET A 1 -12.003 12.441 9.591 1.00 0.00 H new ATOM 0 HE3 MET A 1 -12.720 12.290 11.213 1.00 0.00 H new ATOM 20 N LYS A 2 -9.965 15.048 4.718 1.00 0.00 N ATOM 21 CA LYS A 2 -10.174 14.541 3.334 1.00 0.00 C ATOM 22 C LYS A 2 -9.721 13.081 3.238 1.00 0.00 C ATOM 23 O LYS A 2 -9.135 12.532 4.154 1.00 0.00 O ATOM 24 CB LYS A 2 -9.378 15.398 2.343 1.00 0.00 C ATOM 25 CG LYS A 2 -7.879 15.320 2.656 1.00 0.00 C ATOM 26 CD LYS A 2 -7.272 16.726 2.618 1.00 0.00 C ATOM 27 CE LYS A 2 -7.171 17.284 4.042 1.00 0.00 C ATOM 28 NZ LYS A 2 -8.329 18.186 4.309 1.00 0.00 N ATOM 0 H LYS A 2 -9.058 15.485 4.882 1.00 0.00 H new ATOM 0 HA LYS A 2 -11.234 14.601 3.089 1.00 0.00 H new ATOM 0 HB2 LYS A 2 -9.562 15.055 1.325 1.00 0.00 H new ATOM 0 HB3 LYS A 2 -9.714 16.434 2.396 1.00 0.00 H new ATOM 0 HG2 LYS A 2 -7.725 14.873 3.638 1.00 0.00 H new ATOM 0 HG3 LYS A 2 -7.379 14.677 1.931 1.00 0.00 H new ATOM 0 HD2 LYS A 2 -6.284 16.694 2.159 1.00 0.00 H new ATOM 0 HD3 LYS A 2 -7.888 17.382 2.003 1.00 0.00 H new ATOM 0 HE2 LYS A 2 -7.159 16.467 4.764 1.00 0.00 H new ATOM 0 HE3 LYS A 2 -6.236 17.830 4.164 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 -8.259 18.564 5.275 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 -8.321 18.972 3.628 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 -9.216 17.651 4.210 1.00 0.00 H new ATOM 42 N ILE A 3 -10.003 12.456 2.127 1.00 0.00 N ATOM 43 CA ILE A 3 -9.619 11.027 1.930 1.00 0.00 C ATOM 44 C ILE A 3 -8.388 10.940 1.026 1.00 0.00 C ATOM 45 O ILE A 3 -8.411 11.349 -0.121 1.00 0.00 O ATOM 46 CB ILE A 3 -10.796 10.267 1.299 1.00 0.00 C ATOM 47 CG1 ILE A 3 -11.854 9.983 2.371 1.00 0.00 C ATOM 48 CG2 ILE A 3 -10.310 8.938 0.712 1.00 0.00 C ATOM 49 CD1 ILE A 3 -12.694 11.238 2.621 1.00 0.00 C ATOM 0 H ILE A 3 -10.489 12.880 1.337 1.00 0.00 H new ATOM 0 HA ILE A 3 -9.377 10.578 2.893 1.00 0.00 H new ATOM 0 HB ILE A 3 -11.226 10.877 0.504 1.00 0.00 H new ATOM 0 HG12 ILE A 3 -12.497 9.163 2.051 1.00 0.00 H new ATOM 0 HG13 ILE A 3 -11.371 9.668 3.296 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -11.152 8.407 0.267 1.00 0.00 H new ATOM 0 HG22 ILE A 3 -9.558 9.131 -0.053 1.00 0.00 H new ATOM 0 HG23 ILE A 3 -9.874 8.328 1.503 1.00 0.00 H new ATOM 0 HD11 ILE A 3 -13.444 11.028 3.384 1.00 0.00 H new ATOM 0 HD12 ILE A 3 -12.047 12.047 2.961 1.00 0.00 H new ATOM 0 HD13 ILE A 3 -13.190 11.534 1.697 1.00 0.00 H new ATOM 61 N LYS A 4 -7.317 10.392 1.542 1.00 0.00 N ATOM 62 CA LYS A 4 -6.073 10.240 0.739 1.00 0.00 C ATOM 63 C LYS A 4 -6.147 8.932 -0.053 1.00 0.00 C ATOM 64 O LYS A 4 -5.686 8.855 -1.177 1.00 0.00 O ATOM 65 CB LYS A 4 -4.861 10.201 1.674 1.00 0.00 C ATOM 66 CG LYS A 4 -3.628 10.740 0.941 1.00 0.00 C ATOM 67 CD LYS A 4 -2.419 9.849 1.242 1.00 0.00 C ATOM 68 CE LYS A 4 -1.327 10.678 1.925 1.00 0.00 C ATOM 69 NZ LYS A 4 -0.034 9.938 1.873 1.00 0.00 N ATOM 0 H LYS A 4 -7.254 10.040 2.497 1.00 0.00 H new ATOM 0 HA LYS A 4 -5.973 11.082 0.054 1.00 0.00 H new ATOM 0 HB2 LYS A 4 -5.057 10.798 2.565 1.00 0.00 H new ATOM 0 HB3 LYS A 4 -4.680 9.180 2.009 1.00 0.00 H new ATOM 0 HG2 LYS A 4 -3.814 10.767 -0.133 1.00 0.00 H new ATOM 0 HG3 LYS A 4 -3.425 11.764 1.255 1.00 0.00 H new ATOM 0 HD2 LYS A 4 -2.716 9.020 1.885 1.00 0.00 H new ATOM 0 HD3 LYS A 4 -2.036 9.415 0.319 1.00 0.00 H new ATOM 0 HE2 LYS A 4 -1.226 11.644 1.430 1.00 0.00 H new ATOM 0 HE3 LYS A 4 -1.602 10.878 2.961 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 0.739 10.569 2.165 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 -0.075 9.121 2.516 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 0.137 9.606 0.902 1.00 0.00 H new ATOM 83 N ARG A 5 -6.727 7.906 0.531 1.00 0.00 N ATOM 84 CA ARG A 5 -6.840 6.594 -0.173 1.00 0.00 C ATOM 85 C ARG A 5 -8.148 5.896 0.224 1.00 0.00 C ATOM 86 O ARG A 5 -8.812 6.284 1.166 1.00 0.00 O ATOM 87 CB ARG A 5 -5.661 5.701 0.220 1.00 0.00 C ATOM 88 CG ARG A 5 -4.381 6.191 -0.461 1.00 0.00 C ATOM 89 CD ARG A 5 -3.174 5.467 0.141 1.00 0.00 C ATOM 90 NE ARG A 5 -2.527 6.342 1.162 1.00 0.00 N ATOM 91 CZ ARG A 5 -1.227 6.467 1.187 1.00 0.00 C ATOM 92 NH1 ARG A 5 -0.623 7.204 0.291 1.00 0.00 N ATOM 93 NH2 ARG A 5 -0.530 5.853 2.108 1.00 0.00 N ATOM 0 H ARG A 5 -7.127 7.926 1.469 1.00 0.00 H new ATOM 0 HA ARG A 5 -6.833 6.768 -1.249 1.00 0.00 H new ATOM 0 HB2 ARG A 5 -5.533 5.710 1.302 1.00 0.00 H new ATOM 0 HB3 ARG A 5 -5.864 4.670 -0.068 1.00 0.00 H new ATOM 0 HG2 ARG A 5 -4.433 6.005 -1.534 1.00 0.00 H new ATOM 0 HG3 ARG A 5 -4.276 7.268 -0.329 1.00 0.00 H new ATOM 0 HD2 ARG A 5 -3.490 4.529 0.598 1.00 0.00 H new ATOM 0 HD3 ARG A 5 -2.460 5.215 -0.643 1.00 0.00 H new ATOM 0 HE ARG A 5 -3.100 6.843 1.841 1.00 0.00 H new ATOM 0 HH11 ARG A 5 -1.167 7.681 -0.428 1.00 0.00 H new ATOM 0 HH12 ARG A 5 0.392 7.301 0.311 1.00 0.00 H new ATOM 0 HH21 ARG A 5 -1.002 5.277 2.806 1.00 0.00 H new ATOM 0 HH22 ARG A 5 0.485 5.950 2.129 1.00 0.00 H new ATOM 107 N ILE A 6 -8.507 4.859 -0.491 1.00 0.00 N ATOM 108 CA ILE A 6 -9.759 4.107 -0.174 1.00 0.00 C ATOM 109 C ILE A 6 -9.411 2.638 0.072 1.00 0.00 C ATOM 110 O ILE A 6 -8.763 1.997 -0.740 1.00 0.00 O ATOM 111 CB ILE A 6 -10.746 4.215 -1.343 1.00 0.00 C ATOM 112 CG1 ILE A 6 -11.001 5.693 -1.671 1.00 0.00 C ATOM 113 CG2 ILE A 6 -12.071 3.547 -0.962 1.00 0.00 C ATOM 114 CD1 ILE A 6 -10.113 6.123 -2.842 1.00 0.00 C ATOM 0 H ILE A 6 -7.981 4.499 -1.287 1.00 0.00 H new ATOM 0 HA ILE A 6 -10.221 4.531 0.718 1.00 0.00 H new ATOM 0 HB ILE A 6 -10.322 3.716 -2.215 1.00 0.00 H new ATOM 0 HG12 ILE A 6 -12.051 5.843 -1.924 1.00 0.00 H new ATOM 0 HG13 ILE A 6 -10.792 6.311 -0.798 1.00 0.00 H new ATOM 0 HG21 ILE A 6 -12.770 3.625 -1.794 1.00 0.00 H new ATOM 0 HG22 ILE A 6 -11.896 2.496 -0.733 1.00 0.00 H new ATOM 0 HG23 ILE A 6 -12.491 4.044 -0.087 1.00 0.00 H new ATOM 0 HD11 ILE A 6 -10.297 7.173 -3.072 1.00 0.00 H new ATOM 0 HD12 ILE A 6 -9.065 5.989 -2.573 1.00 0.00 H new ATOM 0 HD13 ILE A 6 -10.344 5.514 -3.716 1.00 0.00 H new ATOM 126 N LEU A 7 -9.839 2.105 1.187 1.00 0.00 N ATOM 127 CA LEU A 7 -9.549 0.683 1.512 1.00 0.00 C ATOM 128 C LEU A 7 -10.714 -0.180 1.026 1.00 0.00 C ATOM 129 O LEU A 7 -10.523 -1.181 0.358 1.00 0.00 O ATOM 130 CB LEU A 7 -9.382 0.543 3.023 1.00 0.00 C ATOM 131 CG LEU A 7 -8.212 1.420 3.477 1.00 0.00 C ATOM 132 CD1 LEU A 7 -8.450 1.905 4.910 1.00 0.00 C ATOM 133 CD2 LEU A 7 -6.914 0.616 3.422 1.00 0.00 C ATOM 0 H LEU A 7 -10.383 2.603 1.892 1.00 0.00 H new ATOM 0 HA LEU A 7 -8.632 0.358 1.021 1.00 0.00 H new ATOM 0 HB2 LEU A 7 -10.298 0.843 3.533 1.00 0.00 H new ATOM 0 HB3 LEU A 7 -9.197 -0.498 3.287 1.00 0.00 H new ATOM 0 HG LEU A 7 -8.135 2.281 2.813 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -7.614 2.528 5.227 1.00 0.00 H new ATOM 0 HD12 LEU A 7 -9.371 2.486 4.949 1.00 0.00 H new ATOM 0 HD13 LEU A 7 -8.535 1.046 5.576 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -6.083 1.243 3.746 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -6.994 -0.249 4.080 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -6.738 0.279 2.400 1.00 0.00 H new ATOM 145 N ASN A 8 -11.921 0.230 1.332 1.00 0.00 N ATOM 146 CA ASN A 8 -13.130 -0.523 0.873 1.00 0.00 C ATOM 147 C ASN A 8 -14.396 0.308 1.164 1.00 0.00 C ATOM 148 O ASN A 8 -14.319 1.497 1.419 1.00 0.00 O ATOM 149 CB ASN A 8 -13.194 -1.916 1.537 1.00 0.00 C ATOM 150 CG ASN A 8 -13.574 -1.816 3.015 1.00 0.00 C ATOM 151 OD1 ASN A 8 -14.723 -1.620 3.346 1.00 0.00 O ATOM 152 ND2 ASN A 8 -12.661 -1.981 3.925 1.00 0.00 N ATOM 0 H ASN A 8 -12.122 1.063 1.886 1.00 0.00 H new ATOM 0 HA ASN A 8 -13.067 -0.686 -0.203 1.00 0.00 H new ATOM 0 HB2 ASN A 8 -13.922 -2.536 1.014 1.00 0.00 H new ATOM 0 HB3 ASN A 8 -12.227 -2.410 1.442 1.00 0.00 H new ATOM 0 HD21 ASN A 8 -12.913 -1.945 4.913 1.00 0.00 H new ATOM 0 HD22 ASN A 8 -11.692 -2.146 3.652 1.00 0.00 H new ATOM 159 N HIS A 9 -15.558 -0.300 1.096 1.00 0.00 N ATOM 160 CA HIS A 9 -16.838 0.450 1.335 1.00 0.00 C ATOM 161 C HIS A 9 -16.893 1.055 2.752 1.00 0.00 C ATOM 162 O HIS A 9 -17.614 2.007 2.989 1.00 0.00 O ATOM 163 CB HIS A 9 -18.021 -0.508 1.152 1.00 0.00 C ATOM 164 CG HIS A 9 -19.291 0.282 0.987 1.00 0.00 C ATOM 165 ND1 HIS A 9 -20.389 0.433 1.796 1.00 0.00 N flip ATOM 166 CD2 HIS A 9 -19.542 1.052 -0.139 1.00 0.00 C flip ATOM 167 CE1 HIS A 9 -21.308 1.281 1.185 1.00 0.00 C flip ATOM 168 NE2 HIS A 9 -20.748 1.625 0.022 1.00 0.00 N flip ATOM 0 H HIS A 9 -15.677 -1.291 0.884 1.00 0.00 H new ATOM 0 HA HIS A 9 -16.888 1.269 0.618 1.00 0.00 H new ATOM 0 HB2 HIS A 9 -17.858 -1.140 0.279 1.00 0.00 H new ATOM 0 HB3 HIS A 9 -18.102 -1.170 2.014 1.00 0.00 H new ATOM 0 HD2 HIS A 9 -18.888 1.170 -0.990 1.00 0.00 H new ATOM 0 HE1 HIS A 9 -22.268 1.594 1.569 1.00 0.00 H new ATOM 0 HE2 HIS A 9 -21.182 2.246 -0.661 1.00 0.00 H new ATOM 176 N ASN A 10 -16.168 0.500 3.694 1.00 0.00 N ATOM 177 CA ASN A 10 -16.208 1.022 5.090 1.00 0.00 C ATOM 178 C ASN A 10 -14.843 1.561 5.527 1.00 0.00 C ATOM 179 O ASN A 10 -14.768 2.437 6.369 1.00 0.00 O ATOM 180 CB ASN A 10 -16.614 -0.107 6.040 1.00 0.00 C ATOM 181 CG ASN A 10 -17.624 -1.041 5.358 1.00 0.00 C ATOM 182 OD1 ASN A 10 -18.740 -0.650 5.077 1.00 0.00 O ATOM 183 ND2 ASN A 10 -17.274 -2.266 5.077 1.00 0.00 N ATOM 0 H ASN A 10 -15.548 -0.297 3.551 1.00 0.00 H new ATOM 0 HA ASN A 10 -16.931 1.837 5.123 1.00 0.00 H new ATOM 0 HB2 ASN A 10 -15.732 -0.672 6.342 1.00 0.00 H new ATOM 0 HB3 ASN A 10 -17.050 0.311 6.947 1.00 0.00 H new ATOM 0 HD21 ASN A 10 -17.937 -2.894 4.622 1.00 0.00 H new ATOM 0 HD22 ASN A 10 -16.338 -2.596 5.312 1.00 0.00 H new ATOM 190 N ALA A 11 -13.769 1.041 4.991 1.00 0.00 N ATOM 191 CA ALA A 11 -12.425 1.517 5.413 1.00 0.00 C ATOM 192 C ALA A 11 -11.858 2.493 4.384 1.00 0.00 C ATOM 193 O ALA A 11 -11.973 2.294 3.188 1.00 0.00 O ATOM 194 CB ALA A 11 -11.485 0.321 5.564 1.00 0.00 C ATOM 0 H ALA A 11 -13.768 0.309 4.281 1.00 0.00 H new ATOM 0 HA ALA A 11 -12.517 2.033 6.369 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -10.500 0.669 5.873 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -11.882 -0.361 6.316 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -11.403 -0.200 4.610 1.00 0.00 H new ATOM 200 N ILE A 12 -11.235 3.543 4.854 1.00 0.00 N ATOM 201 CA ILE A 12 -10.631 4.552 3.938 1.00 0.00 C ATOM 202 C ILE A 12 -9.437 5.211 4.639 1.00 0.00 C ATOM 203 O ILE A 12 -9.416 5.355 5.847 1.00 0.00 O ATOM 204 CB ILE A 12 -11.696 5.600 3.560 1.00 0.00 C ATOM 205 CG1 ILE A 12 -12.354 5.197 2.235 1.00 0.00 C ATOM 206 CG2 ILE A 12 -11.063 6.986 3.398 1.00 0.00 C ATOM 207 CD1 ILE A 12 -13.730 4.589 2.501 1.00 0.00 C ATOM 0 H ILE A 12 -11.119 3.745 5.847 1.00 0.00 H new ATOM 0 HA ILE A 12 -10.280 4.073 3.024 1.00 0.00 H new ATOM 0 HB ILE A 12 -12.438 5.642 4.357 1.00 0.00 H new ATOM 0 HG12 ILE A 12 -12.451 6.068 1.587 1.00 0.00 H new ATOM 0 HG13 ILE A 12 -11.725 4.478 1.710 1.00 0.00 H new ATOM 0 HG21 ILE A 12 -11.834 7.709 3.131 1.00 0.00 H new ATOM 0 HG22 ILE A 12 -10.595 7.284 4.336 1.00 0.00 H new ATOM 0 HG23 ILE A 12 -10.309 6.952 2.611 1.00 0.00 H new ATOM 0 HD11 ILE A 12 -14.191 4.305 1.555 1.00 0.00 H new ATOM 0 HD12 ILE A 12 -13.622 3.706 3.131 1.00 0.00 H new ATOM 0 HD13 ILE A 12 -14.360 5.321 3.007 1.00 0.00 H new ATOM 219 N VAL A 13 -8.444 5.610 3.883 1.00 0.00 N ATOM 220 CA VAL A 13 -7.245 6.259 4.487 1.00 0.00 C ATOM 221 C VAL A 13 -7.391 7.777 4.380 1.00 0.00 C ATOM 222 O VAL A 13 -7.422 8.328 3.295 1.00 0.00 O ATOM 223 CB VAL A 13 -5.977 5.813 3.746 1.00 0.00 C ATOM 224 CG1 VAL A 13 -4.744 6.192 4.569 1.00 0.00 C ATOM 225 CG2 VAL A 13 -6.001 4.295 3.537 1.00 0.00 C ATOM 0 H VAL A 13 -8.415 5.512 2.868 1.00 0.00 H new ATOM 0 HA VAL A 13 -7.165 5.967 5.534 1.00 0.00 H new ATOM 0 HB VAL A 13 -5.938 6.309 2.776 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -3.844 5.875 4.043 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -4.720 7.272 4.712 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -4.789 5.699 5.540 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -5.098 3.986 3.011 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -6.046 3.795 4.505 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -6.876 4.023 2.947 1.00 0.00 H new ATOM 235 N VAL A 14 -7.481 8.453 5.497 1.00 0.00 N ATOM 236 CA VAL A 14 -7.624 9.939 5.474 1.00 0.00 C ATOM 237 C VAL A 14 -6.405 10.587 6.143 1.00 0.00 C ATOM 238 O VAL A 14 -5.562 9.914 6.713 1.00 0.00 O ATOM 239 CB VAL A 14 -8.905 10.352 6.216 1.00 0.00 C ATOM 240 CG1 VAL A 14 -10.127 9.775 5.497 1.00 0.00 C ATOM 241 CG2 VAL A 14 -8.872 9.829 7.657 1.00 0.00 C ATOM 0 H VAL A 14 -7.461 8.037 6.428 1.00 0.00 H new ATOM 0 HA VAL A 14 -7.687 10.276 4.439 1.00 0.00 H new ATOM 0 HB VAL A 14 -8.968 11.440 6.230 1.00 0.00 H new ATOM 0 HG11 VAL A 14 -11.033 10.070 6.026 1.00 0.00 H new ATOM 0 HG12 VAL A 14 -10.162 10.156 4.476 1.00 0.00 H new ATOM 0 HG13 VAL A 14 -10.057 8.687 5.476 1.00 0.00 H new ATOM 0 HG21 VAL A 14 -9.784 10.127 8.173 1.00 0.00 H new ATOM 0 HG22 VAL A 14 -8.799 8.741 7.648 1.00 0.00 H new ATOM 0 HG23 VAL A 14 -8.009 10.246 8.176 1.00 0.00 H new ATOM 251 N LYS A 15 -6.311 11.891 6.078 1.00 0.00 N ATOM 252 CA LYS A 15 -5.161 12.607 6.707 1.00 0.00 C ATOM 253 C LYS A 15 -5.682 13.653 7.696 1.00 0.00 C ATOM 254 O LYS A 15 -6.831 14.059 7.644 1.00 0.00 O ATOM 255 CB LYS A 15 -4.318 13.294 5.623 1.00 0.00 C ATOM 256 CG LYS A 15 -5.157 14.346 4.889 1.00 0.00 C ATOM 257 CD LYS A 15 -4.586 14.571 3.487 1.00 0.00 C ATOM 258 CE LYS A 15 -5.089 13.473 2.547 1.00 0.00 C ATOM 259 NZ LYS A 15 -4.958 13.925 1.132 1.00 0.00 N ATOM 0 H LYS A 15 -6.988 12.495 5.612 1.00 0.00 H new ATOM 0 HA LYS A 15 -4.540 11.886 7.239 1.00 0.00 H new ATOM 0 HB2 LYS A 15 -3.445 13.765 6.075 1.00 0.00 H new ATOM 0 HB3 LYS A 15 -3.949 12.553 4.914 1.00 0.00 H new ATOM 0 HG2 LYS A 15 -6.194 14.017 4.822 1.00 0.00 H new ATOM 0 HG3 LYS A 15 -5.155 15.282 5.448 1.00 0.00 H new ATOM 0 HD2 LYS A 15 -4.887 15.550 3.113 1.00 0.00 H new ATOM 0 HD3 LYS A 15 -3.497 14.564 3.521 1.00 0.00 H new ATOM 0 HE2 LYS A 15 -4.517 12.558 2.701 1.00 0.00 H new ATOM 0 HE3 LYS A 15 -6.130 13.239 2.769 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 -5.408 13.230 0.502 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 -5.424 14.848 1.018 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 -3.951 14.013 0.887 1.00 0.00 H new ATOM 273 N ASP A 16 -4.839 14.086 8.598 1.00 0.00 N ATOM 274 CA ASP A 16 -5.260 15.102 9.605 1.00 0.00 C ATOM 275 C ASP A 16 -4.050 15.935 10.050 1.00 0.00 C ATOM 276 O ASP A 16 -2.957 15.792 9.528 1.00 0.00 O ATOM 277 CB ASP A 16 -5.864 14.387 10.821 1.00 0.00 C ATOM 278 CG ASP A 16 -7.369 14.661 10.883 1.00 0.00 C ATOM 279 OD1 ASP A 16 -7.746 15.672 11.453 1.00 0.00 O ATOM 280 OD2 ASP A 16 -8.119 13.852 10.363 1.00 0.00 O ATOM 0 H ASP A 16 -3.871 13.776 8.679 1.00 0.00 H new ATOM 0 HA ASP A 16 -6.002 15.764 9.159 1.00 0.00 H new ATOM 0 HB2 ASP A 16 -5.682 13.315 10.752 1.00 0.00 H new ATOM 0 HB3 ASP A 16 -5.383 14.734 11.736 1.00 0.00 H new ATOM 285 N GLN A 17 -4.249 16.803 11.013 1.00 0.00 N ATOM 286 CA GLN A 17 -3.135 17.661 11.518 1.00 0.00 C ATOM 287 C GLN A 17 -1.992 16.787 12.016 1.00 0.00 C ATOM 288 O GLN A 17 -0.836 17.037 11.724 1.00 0.00 O ATOM 289 CB GLN A 17 -3.645 18.530 12.671 1.00 0.00 C ATOM 290 CG GLN A 17 -3.848 19.968 12.184 1.00 0.00 C ATOM 291 CD GLN A 17 -5.302 20.161 11.745 1.00 0.00 C ATOM 292 OE1 GLN A 17 -6.103 20.708 12.479 1.00 0.00 O ATOM 293 NE2 GLN A 17 -5.682 19.734 10.570 1.00 0.00 N ATOM 0 H GLN A 17 -5.146 16.954 11.474 1.00 0.00 H new ATOM 0 HA GLN A 17 -2.777 18.295 10.707 1.00 0.00 H new ATOM 0 HB2 GLN A 17 -4.584 18.129 13.053 1.00 0.00 H new ATOM 0 HB3 GLN A 17 -2.932 18.512 13.495 1.00 0.00 H new ATOM 0 HG2 GLN A 17 -3.602 20.671 12.980 1.00 0.00 H new ATOM 0 HG3 GLN A 17 -3.175 20.180 11.353 1.00 0.00 H new ATOM 0 HE21 GLN A 17 -5.012 19.275 9.953 1.00 0.00 H new ATOM 0 HE22 GLN A 17 -6.649 19.860 10.270 1.00 0.00 H new ATOM 302 N ASN A 18 -2.309 15.769 12.770 1.00 0.00 N ATOM 303 CA ASN A 18 -1.252 14.869 13.303 1.00 0.00 C ATOM 304 C ASN A 18 -0.557 14.137 12.149 1.00 0.00 C ATOM 305 O ASN A 18 0.651 14.209 12.011 1.00 0.00 O ATOM 306 CB ASN A 18 -1.874 13.849 14.262 1.00 0.00 C ATOM 307 CG ASN A 18 -1.865 14.412 15.686 1.00 0.00 C ATOM 308 OD1 ASN A 18 -1.014 14.068 16.481 1.00 0.00 O ATOM 309 ND2 ASN A 18 -2.784 15.268 16.043 1.00 0.00 N ATOM 0 H ASN A 18 -3.261 15.523 13.040 1.00 0.00 H new ATOM 0 HA ASN A 18 -0.516 15.466 13.841 1.00 0.00 H new ATOM 0 HB2 ASN A 18 -2.895 13.623 13.956 1.00 0.00 H new ATOM 0 HB3 ASN A 18 -1.316 12.913 14.226 1.00 0.00 H new ATOM 0 HD21 ASN A 18 -2.787 15.648 16.990 1.00 0.00 H new ATOM 0 HD22 ASN A 18 -3.499 15.557 15.375 1.00 0.00 H new ATOM 316 N GLU A 19 -1.309 13.439 11.319 1.00 0.00 N ATOM 317 CA GLU A 19 -0.699 12.698 10.170 1.00 0.00 C ATOM 318 C GLU A 19 -1.774 11.841 9.476 1.00 0.00 C ATOM 319 O GLU A 19 -2.954 12.141 9.535 1.00 0.00 O ATOM 320 CB GLU A 19 0.430 11.791 10.686 1.00 0.00 C ATOM 321 CG GLU A 19 1.664 11.942 9.788 1.00 0.00 C ATOM 322 CD GLU A 19 2.871 12.365 10.631 1.00 0.00 C ATOM 323 OE1 GLU A 19 3.475 11.500 11.247 1.00 0.00 O ATOM 324 OE2 GLU A 19 3.175 13.548 10.645 1.00 0.00 O ATOM 0 H GLU A 19 -2.323 13.354 11.393 1.00 0.00 H new ATOM 0 HA GLU A 19 -0.292 13.412 9.454 1.00 0.00 H new ATOM 0 HB2 GLU A 19 0.681 12.055 11.713 1.00 0.00 H new ATOM 0 HB3 GLU A 19 0.100 10.752 10.695 1.00 0.00 H new ATOM 0 HG2 GLU A 19 1.874 11.000 9.282 1.00 0.00 H new ATOM 0 HG3 GLU A 19 1.472 12.684 9.013 1.00 0.00 H new ATOM 331 N GLU A 20 -1.367 10.779 8.816 1.00 0.00 N ATOM 332 CA GLU A 20 -2.342 9.893 8.110 1.00 0.00 C ATOM 333 C GLU A 20 -3.079 9.003 9.117 1.00 0.00 C ATOM 334 O GLU A 20 -2.519 8.567 10.107 1.00 0.00 O ATOM 335 CB GLU A 20 -1.597 9.005 7.110 1.00 0.00 C ATOM 336 CG GLU A 20 -2.563 8.545 6.013 1.00 0.00 C ATOM 337 CD GLU A 20 -1.823 7.648 5.015 1.00 0.00 C ATOM 338 OE1 GLU A 20 -1.654 6.475 5.312 1.00 0.00 O ATOM 339 OE2 GLU A 20 -1.440 8.149 3.971 1.00 0.00 O ATOM 0 H GLU A 20 -0.392 10.489 8.738 1.00 0.00 H new ATOM 0 HA GLU A 20 -3.066 10.518 7.586 1.00 0.00 H new ATOM 0 HB2 GLU A 20 -0.765 9.555 6.669 1.00 0.00 H new ATOM 0 HB3 GLU A 20 -1.173 8.141 7.621 1.00 0.00 H new ATOM 0 HG2 GLU A 20 -3.398 8.002 6.455 1.00 0.00 H new ATOM 0 HG3 GLU A 20 -2.982 9.410 5.498 1.00 0.00 H new ATOM 346 N LYS A 21 -4.332 8.724 8.850 1.00 0.00 N ATOM 347 CA LYS A 21 -5.138 7.856 9.758 1.00 0.00 C ATOM 348 C LYS A 21 -6.219 7.139 8.944 1.00 0.00 C ATOM 349 O LYS A 21 -6.861 7.728 8.094 1.00 0.00 O ATOM 350 CB LYS A 21 -5.806 8.693 10.859 1.00 0.00 C ATOM 351 CG LYS A 21 -6.078 10.118 10.360 1.00 0.00 C ATOM 352 CD LYS A 21 -7.235 10.727 11.153 1.00 0.00 C ATOM 353 CE LYS A 21 -6.700 11.353 12.444 1.00 0.00 C ATOM 354 NZ LYS A 21 -7.784 12.130 13.113 1.00 0.00 N ATOM 0 H LYS A 21 -4.834 9.066 8.031 1.00 0.00 H new ATOM 0 HA LYS A 21 -4.474 7.129 10.225 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -6.741 8.223 11.164 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -5.164 8.726 11.739 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -5.184 10.731 10.473 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -6.321 10.102 9.297 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -7.742 11.483 10.553 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -7.972 9.959 11.388 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -6.332 10.574 13.112 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -5.856 12.006 12.221 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -7.406 13.042 13.440 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -8.558 12.298 12.439 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -8.145 11.592 13.927 1.00 0.00 H new ATOM 368 N ILE A 22 -6.428 5.873 9.205 1.00 0.00 N ATOM 369 CA ILE A 22 -7.469 5.108 8.458 1.00 0.00 C ATOM 370 C ILE A 22 -8.809 5.243 9.191 1.00 0.00 C ATOM 371 O ILE A 22 -8.937 4.881 10.347 1.00 0.00 O ATOM 372 CB ILE A 22 -7.055 3.630 8.356 1.00 0.00 C ATOM 373 CG1 ILE A 22 -6.208 3.427 7.095 1.00 0.00 C ATOM 374 CG2 ILE A 22 -8.298 2.736 8.266 1.00 0.00 C ATOM 375 CD1 ILE A 22 -4.835 4.074 7.283 1.00 0.00 C ATOM 0 H ILE A 22 -5.919 5.335 9.907 1.00 0.00 H new ATOM 0 HA ILE A 22 -7.572 5.506 7.449 1.00 0.00 H new ATOM 0 HB ILE A 22 -6.481 3.363 9.243 1.00 0.00 H new ATOM 0 HG12 ILE A 22 -6.094 2.363 6.890 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -6.712 3.865 6.233 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -7.991 1.693 8.194 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -8.911 2.874 9.157 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -8.877 3.006 7.383 1.00 0.00 H new ATOM 0 HD11 ILE A 22 -4.237 3.927 6.384 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -4.958 5.141 7.466 1.00 0.00 H new ATOM 0 HD13 ILE A 22 -4.330 3.616 8.133 1.00 0.00 H new ATOM 387 N LEU A 23 -9.803 5.767 8.518 1.00 0.00 N ATOM 388 CA LEU A 23 -11.139 5.938 9.152 1.00 0.00 C ATOM 389 C LEU A 23 -12.039 4.752 8.788 1.00 0.00 C ATOM 390 O LEU A 23 -12.467 4.606 7.656 1.00 0.00 O ATOM 391 CB LEU A 23 -11.775 7.248 8.667 1.00 0.00 C ATOM 392 CG LEU A 23 -12.047 8.168 9.863 1.00 0.00 C ATOM 393 CD1 LEU A 23 -10.757 8.382 10.658 1.00 0.00 C ATOM 394 CD2 LEU A 23 -12.557 9.517 9.358 1.00 0.00 C ATOM 0 H LEU A 23 -9.742 6.085 7.551 1.00 0.00 H new ATOM 0 HA LEU A 23 -11.024 5.977 10.235 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -11.112 7.744 7.958 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -12.705 7.038 8.139 1.00 0.00 H new ATOM 0 HG LEU A 23 -12.796 7.707 10.507 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -10.957 9.037 11.506 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -10.389 7.422 11.019 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -10.005 8.840 10.015 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -12.751 10.173 10.206 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -11.806 9.971 8.712 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -13.478 9.370 8.795 1.00 0.00 H new ATOM 406 N LEU A 24 -12.324 3.907 9.750 1.00 0.00 N ATOM 407 CA LEU A 24 -13.195 2.724 9.493 1.00 0.00 C ATOM 408 C LEU A 24 -14.636 3.075 9.863 1.00 0.00 C ATOM 409 O LEU A 24 -14.911 3.534 10.956 1.00 0.00 O ATOM 410 CB LEU A 24 -12.725 1.534 10.340 1.00 0.00 C ATOM 411 CG LEU A 24 -11.232 1.276 10.104 1.00 0.00 C ATOM 412 CD1 LEU A 24 -10.734 0.227 11.101 1.00 0.00 C ATOM 413 CD2 LEU A 24 -11.019 0.762 8.678 1.00 0.00 C ATOM 0 H LEU A 24 -11.986 3.990 10.709 1.00 0.00 H new ATOM 0 HA LEU A 24 -13.138 2.454 8.438 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -12.905 1.736 11.396 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -13.301 0.645 10.083 1.00 0.00 H new ATOM 0 HG LEU A 24 -10.678 2.204 10.241 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -9.673 0.042 10.935 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -10.884 0.591 12.117 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -11.290 -0.700 10.962 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -9.957 0.579 8.512 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -11.573 -0.166 8.539 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -11.375 1.507 7.966 1.00 0.00 H new ATOM 425 N GLY A 25 -15.551 2.862 8.954 1.00 0.00 N ATOM 426 CA GLY A 25 -16.982 3.175 9.227 1.00 0.00 C ATOM 427 C GLY A 25 -17.861 2.439 8.218 1.00 0.00 C ATOM 428 O GLY A 25 -17.733 2.630 7.027 1.00 0.00 O ATOM 0 H GLY A 25 -15.365 2.481 8.026 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -17.244 2.876 10.242 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -17.151 4.250 9.158 1.00 0.00 H new ATOM 432 N ALA A 26 -18.742 1.591 8.692 1.00 0.00 N ATOM 433 CA ALA A 26 -19.638 0.820 7.778 1.00 0.00 C ATOM 434 C ALA A 26 -20.397 1.775 6.852 1.00 0.00 C ATOM 435 O ALA A 26 -21.364 2.408 7.239 1.00 0.00 O ATOM 436 CB ALA A 26 -20.635 0.004 8.599 1.00 0.00 C ATOM 0 H ALA A 26 -18.879 1.399 9.684 1.00 0.00 H new ATOM 0 HA ALA A 26 -19.029 0.148 7.174 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -21.286 -0.556 7.928 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -20.094 -0.689 9.243 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -21.237 0.675 9.212 1.00 0.00 H new ATOM 442 N GLY A 27 -19.950 1.869 5.629 1.00 0.00 N ATOM 443 CA GLY A 27 -20.611 2.762 4.631 1.00 0.00 C ATOM 444 C GLY A 27 -19.898 4.120 4.549 1.00 0.00 C ATOM 445 O GLY A 27 -20.406 5.043 3.938 1.00 0.00 O ATOM 0 H GLY A 27 -19.143 1.357 5.273 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -20.605 2.285 3.651 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -21.655 2.912 4.907 1.00 0.00 H new ATOM 449 N ILE A 28 -18.730 4.256 5.146 1.00 0.00 N ATOM 450 CA ILE A 28 -17.999 5.549 5.089 1.00 0.00 C ATOM 451 C ILE A 28 -17.662 5.874 3.627 1.00 0.00 C ATOM 452 O ILE A 28 -17.778 7.006 3.204 1.00 0.00 O ATOM 453 CB ILE A 28 -16.730 5.435 5.951 1.00 0.00 C ATOM 454 CG1 ILE A 28 -16.489 6.761 6.658 1.00 0.00 C ATOM 455 CG2 ILE A 28 -15.507 5.086 5.094 1.00 0.00 C ATOM 456 CD1 ILE A 28 -15.726 6.512 7.957 1.00 0.00 C ATOM 0 H ILE A 28 -18.259 3.518 5.669 1.00 0.00 H new ATOM 0 HA ILE A 28 -18.612 6.361 5.481 1.00 0.00 H new ATOM 0 HB ILE A 28 -16.876 4.637 6.679 1.00 0.00 H new ATOM 0 HG12 ILE A 28 -15.922 7.432 6.013 1.00 0.00 H new ATOM 0 HG13 ILE A 28 -17.439 7.251 6.870 1.00 0.00 H new ATOM 0 HG21 ILE A 28 -14.626 5.012 5.731 1.00 0.00 H new ATOM 0 HG22 ILE A 28 -15.674 4.132 4.593 1.00 0.00 H new ATOM 0 HG23 ILE A 28 -15.351 5.865 4.348 1.00 0.00 H new ATOM 0 HD11 ILE A 28 -15.553 7.461 8.465 1.00 0.00 H new ATOM 0 HD12 ILE A 28 -16.311 5.857 8.603 1.00 0.00 H new ATOM 0 HD13 ILE A 28 -14.769 6.041 7.732 1.00 0.00 H new ATOM 468 N ALA A 29 -17.275 4.882 2.849 1.00 0.00 N ATOM 469 CA ALA A 29 -16.963 5.128 1.407 1.00 0.00 C ATOM 470 C ALA A 29 -18.208 5.696 0.726 1.00 0.00 C ATOM 471 O ALA A 29 -18.115 6.553 -0.135 1.00 0.00 O ATOM 472 CB ALA A 29 -16.562 3.814 0.732 1.00 0.00 C ATOM 0 H ALA A 29 -17.164 3.915 3.155 1.00 0.00 H new ATOM 0 HA ALA A 29 -16.137 5.835 1.323 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -16.336 3.999 -0.318 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -15.681 3.405 1.227 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -17.383 3.101 0.806 1.00 0.00 H new ATOM 478 N PHE A 30 -19.374 5.240 1.126 1.00 0.00 N ATOM 479 CA PHE A 30 -20.632 5.763 0.532 1.00 0.00 C ATOM 480 C PHE A 30 -20.874 7.183 1.057 1.00 0.00 C ATOM 481 O PHE A 30 -20.525 7.506 2.179 1.00 0.00 O ATOM 482 CB PHE A 30 -21.805 4.861 0.934 1.00 0.00 C ATOM 483 CG PHE A 30 -22.978 5.112 0.016 1.00 0.00 C ATOM 484 CD1 PHE A 30 -23.023 4.503 -1.244 1.00 0.00 C ATOM 485 CD2 PHE A 30 -24.019 5.955 0.423 1.00 0.00 C ATOM 486 CE1 PHE A 30 -24.109 4.737 -2.096 1.00 0.00 C ATOM 487 CE2 PHE A 30 -25.104 6.189 -0.428 1.00 0.00 C ATOM 488 CZ PHE A 30 -25.150 5.580 -1.688 1.00 0.00 C ATOM 0 H PHE A 30 -19.501 4.525 1.842 1.00 0.00 H new ATOM 0 HA PHE A 30 -20.549 5.778 -0.555 1.00 0.00 H new ATOM 0 HB2 PHE A 30 -21.506 3.814 0.880 1.00 0.00 H new ATOM 0 HB3 PHE A 30 -22.091 5.058 1.967 1.00 0.00 H new ATOM 0 HD1 PHE A 30 -22.220 3.853 -1.559 1.00 0.00 H new ATOM 0 HD2 PHE A 30 -23.984 6.425 1.395 1.00 0.00 H new ATOM 0 HE1 PHE A 30 -24.144 4.267 -3.068 1.00 0.00 H new ATOM 0 HE2 PHE A 30 -25.907 6.840 -0.113 1.00 0.00 H new ATOM 0 HZ PHE A 30 -25.988 5.760 -2.345 1.00 0.00 H new ATOM 498 N ASN A 31 -21.467 8.024 0.243 1.00 0.00 N ATOM 499 CA ASN A 31 -21.753 9.439 0.653 1.00 0.00 C ATOM 500 C ASN A 31 -20.473 10.293 0.604 1.00 0.00 C ATOM 501 O ASN A 31 -20.401 11.348 1.210 1.00 0.00 O ATOM 502 CB ASN A 31 -22.347 9.458 2.071 1.00 0.00 C ATOM 503 CG ASN A 31 -23.172 10.734 2.271 1.00 0.00 C ATOM 504 OD1 ASN A 31 -22.745 11.646 2.952 1.00 0.00 O ATOM 505 ND2 ASN A 31 -24.344 10.836 1.706 1.00 0.00 N ATOM 0 H ASN A 31 -21.770 7.788 -0.702 1.00 0.00 H new ATOM 0 HA ASN A 31 -22.473 9.865 -0.046 1.00 0.00 H new ATOM 0 HB2 ASN A 31 -22.975 8.580 2.224 1.00 0.00 H new ATOM 0 HB3 ASN A 31 -21.548 9.411 2.811 1.00 0.00 H new ATOM 0 HD21 ASN A 31 -24.901 11.681 1.836 1.00 0.00 H new ATOM 0 HD22 ASN A 31 -24.703 10.071 1.134 1.00 0.00 H new ATOM 512 N LYS A 32 -19.475 9.853 -0.128 1.00 0.00 N ATOM 513 CA LYS A 32 -18.199 10.640 -0.240 1.00 0.00 C ATOM 514 C LYS A 32 -17.200 9.896 -1.143 1.00 0.00 C ATOM 515 O LYS A 32 -17.491 8.835 -1.669 1.00 0.00 O ATOM 516 CB LYS A 32 -17.579 10.836 1.156 1.00 0.00 C ATOM 517 CG LYS A 32 -17.483 9.488 1.874 1.00 0.00 C ATOM 518 CD LYS A 32 -16.404 9.563 2.954 1.00 0.00 C ATOM 519 CE LYS A 32 -15.037 9.235 2.345 1.00 0.00 C ATOM 520 NZ LYS A 32 -15.003 7.810 1.910 1.00 0.00 N ATOM 0 H LYS A 32 -19.488 8.980 -0.655 1.00 0.00 H new ATOM 0 HA LYS A 32 -18.424 11.613 -0.676 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -16.588 11.281 1.065 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -18.187 11.527 1.740 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -18.444 9.233 2.321 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -17.244 8.700 1.160 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -16.386 10.560 3.395 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -16.632 8.863 3.758 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -14.842 9.888 1.495 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -14.250 9.420 3.076 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -14.076 7.399 2.139 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -15.749 7.279 2.403 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -15.161 7.757 0.883 1.00 0.00 H new ATOM 534 N LYS A 33 -16.021 10.451 -1.326 1.00 0.00 N ATOM 535 CA LYS A 33 -14.993 9.794 -2.193 1.00 0.00 C ATOM 536 C LYS A 33 -13.596 10.349 -1.866 1.00 0.00 C ATOM 537 O LYS A 33 -13.418 11.093 -0.915 1.00 0.00 O ATOM 538 CB LYS A 33 -15.325 10.059 -3.669 1.00 0.00 C ATOM 539 CG LYS A 33 -15.430 11.569 -3.920 1.00 0.00 C ATOM 540 CD LYS A 33 -16.898 11.954 -4.117 1.00 0.00 C ATOM 541 CE LYS A 33 -17.070 13.460 -3.897 1.00 0.00 C ATOM 542 NZ LYS A 33 -18.241 13.705 -3.008 1.00 0.00 N ATOM 0 H LYS A 33 -15.729 11.335 -0.909 1.00 0.00 H new ATOM 0 HA LYS A 33 -14.999 8.720 -2.006 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -14.553 9.629 -4.307 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -16.264 9.572 -3.932 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -15.009 12.118 -3.078 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -14.850 11.843 -4.801 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -17.223 11.684 -5.122 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -17.526 11.401 -3.419 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -16.168 13.878 -3.450 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -17.215 13.963 -4.853 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -18.356 14.728 -2.860 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -19.100 13.320 -3.451 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -18.085 13.238 -2.092 1.00 0.00 H new ATOM 556 N LYS A 34 -12.604 9.988 -2.651 1.00 0.00 N ATOM 557 CA LYS A 34 -11.215 10.482 -2.404 1.00 0.00 C ATOM 558 C LYS A 34 -11.159 11.994 -2.601 1.00 0.00 C ATOM 559 O LYS A 34 -11.732 12.535 -3.530 1.00 0.00 O ATOM 560 CB LYS A 34 -10.243 9.800 -3.374 1.00 0.00 C ATOM 561 CG LYS A 34 -8.834 9.811 -2.775 1.00 0.00 C ATOM 562 CD LYS A 34 -7.805 9.542 -3.876 1.00 0.00 C ATOM 563 CE LYS A 34 -6.626 10.506 -3.723 1.00 0.00 C ATOM 564 NZ LYS A 34 -5.364 9.818 -4.122 1.00 0.00 N ATOM 0 H LYS A 34 -12.702 9.369 -3.456 1.00 0.00 H new ATOM 0 HA LYS A 34 -10.929 10.244 -1.379 1.00 0.00 H new ATOM 0 HB2 LYS A 34 -10.561 8.775 -3.564 1.00 0.00 H new ATOM 0 HB3 LYS A 34 -10.246 10.318 -4.333 1.00 0.00 H new ATOM 0 HG2 LYS A 34 -8.635 10.774 -2.305 1.00 0.00 H new ATOM 0 HG3 LYS A 34 -8.754 9.054 -1.995 1.00 0.00 H new ATOM 0 HD2 LYS A 34 -7.455 8.511 -3.817 1.00 0.00 H new ATOM 0 HD3 LYS A 34 -8.265 9.667 -4.856 1.00 0.00 H new ATOM 0 HE2 LYS A 34 -6.782 11.389 -4.342 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -6.555 10.849 -2.691 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -4.653 10.527 -4.394 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -5.006 9.258 -3.322 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -5.552 9.188 -4.928 1.00 0.00 H new ATOM 578 N ASN A 35 -10.476 12.666 -1.703 1.00 0.00 N ATOM 579 CA ASN A 35 -10.338 14.157 -1.753 1.00 0.00 C ATOM 580 C ASN A 35 -11.534 14.823 -1.054 1.00 0.00 C ATOM 581 O ASN A 35 -11.435 15.946 -0.591 1.00 0.00 O ATOM 582 CB ASN A 35 -10.237 14.652 -3.203 1.00 0.00 C ATOM 583 CG ASN A 35 -9.404 15.935 -3.251 1.00 0.00 C ATOM 584 OD1 ASN A 35 -9.945 17.023 -3.275 1.00 0.00 O ATOM 585 ND2 ASN A 35 -8.100 15.855 -3.265 1.00 0.00 N ATOM 0 H ASN A 35 -9.996 12.230 -0.916 1.00 0.00 H new ATOM 0 HA ASN A 35 -9.420 14.430 -1.232 1.00 0.00 H new ATOM 0 HB2 ASN A 35 -9.779 13.886 -3.828 1.00 0.00 H new ATOM 0 HB3 ASN A 35 -11.233 14.838 -3.605 1.00 0.00 H new ATOM 0 HD21 ASN A 35 -7.537 16.705 -3.296 1.00 0.00 H new ATOM 0 HD22 ASN A 35 -7.645 14.942 -3.245 1.00 0.00 H new ATOM 592 N ASP A 36 -12.656 14.141 -0.962 1.00 0.00 N ATOM 593 CA ASP A 36 -13.848 14.725 -0.282 1.00 0.00 C ATOM 594 C ASP A 36 -13.697 14.550 1.234 1.00 0.00 C ATOM 595 O ASP A 36 -12.794 13.882 1.703 1.00 0.00 O ATOM 596 CB ASP A 36 -15.111 13.996 -0.762 1.00 0.00 C ATOM 597 CG ASP A 36 -16.331 14.914 -0.624 1.00 0.00 C ATOM 598 OD1 ASP A 36 -16.477 15.803 -1.448 1.00 0.00 O ATOM 599 OD2 ASP A 36 -17.100 14.710 0.302 1.00 0.00 O ATOM 0 H ASP A 36 -12.792 13.200 -1.333 1.00 0.00 H new ATOM 0 HA ASP A 36 -13.929 15.786 -0.520 1.00 0.00 H new ATOM 0 HB2 ASP A 36 -14.991 13.690 -1.801 1.00 0.00 H new ATOM 0 HB3 ASP A 36 -15.261 13.088 -0.178 1.00 0.00 H new ATOM 604 N ILE A 37 -14.576 15.142 2.004 1.00 0.00 N ATOM 605 CA ILE A 37 -14.491 15.009 3.487 1.00 0.00 C ATOM 606 C ILE A 37 -15.126 13.679 3.908 1.00 0.00 C ATOM 607 O ILE A 37 -16.083 13.218 3.310 1.00 0.00 O ATOM 608 CB ILE A 37 -15.236 16.167 4.164 1.00 0.00 C ATOM 609 CG1 ILE A 37 -14.854 17.498 3.496 1.00 0.00 C ATOM 610 CG2 ILE A 37 -14.868 16.215 5.651 1.00 0.00 C ATOM 611 CD1 ILE A 37 -13.352 17.760 3.659 1.00 0.00 C ATOM 0 H ILE A 37 -15.351 15.713 1.666 1.00 0.00 H new ATOM 0 HA ILE A 37 -13.445 15.035 3.792 1.00 0.00 H new ATOM 0 HB ILE A 37 -16.310 16.010 4.060 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -15.113 17.470 2.438 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -15.423 18.314 3.942 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -15.398 17.038 6.131 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -15.150 15.276 6.126 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -13.793 16.366 5.755 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -13.094 18.705 3.182 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -13.104 17.809 4.719 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -12.789 16.952 3.192 1.00 0.00 H new ATOM 623 N VAL A 38 -14.593 13.064 4.933 1.00 0.00 N ATOM 624 CA VAL A 38 -15.149 11.763 5.409 1.00 0.00 C ATOM 625 C VAL A 38 -16.458 12.001 6.165 1.00 0.00 C ATOM 626 O VAL A 38 -16.556 12.885 7.001 1.00 0.00 O ATOM 627 CB VAL A 38 -14.142 11.057 6.333 1.00 0.00 C ATOM 628 CG1 VAL A 38 -13.965 11.848 7.632 1.00 0.00 C ATOM 629 CG2 VAL A 38 -14.660 9.659 6.676 1.00 0.00 C ATOM 0 H VAL A 38 -13.793 13.410 5.463 1.00 0.00 H new ATOM 0 HA VAL A 38 -15.341 11.129 4.543 1.00 0.00 H new ATOM 0 HB VAL A 38 -13.184 10.990 5.818 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -13.250 11.336 8.275 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -13.596 12.847 7.402 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -14.924 11.925 8.145 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -13.947 9.157 7.331 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -15.622 9.741 7.182 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -14.780 9.081 5.760 1.00 0.00 H new ATOM 639 N ASP A 39 -17.457 11.203 5.885 1.00 0.00 N ATOM 640 CA ASP A 39 -18.760 11.347 6.590 1.00 0.00 C ATOM 641 C ASP A 39 -18.545 10.983 8.066 1.00 0.00 C ATOM 642 O ASP A 39 -18.096 9.892 8.365 1.00 0.00 O ATOM 643 CB ASP A 39 -19.791 10.401 5.962 1.00 0.00 C ATOM 644 CG ASP A 39 -21.193 10.747 6.477 1.00 0.00 C ATOM 645 OD1 ASP A 39 -21.843 11.574 5.858 1.00 0.00 O ATOM 646 OD2 ASP A 39 -21.592 10.178 7.479 1.00 0.00 O ATOM 0 H ASP A 39 -17.422 10.454 5.193 1.00 0.00 H new ATOM 0 HA ASP A 39 -19.129 12.369 6.506 1.00 0.00 H new ATOM 0 HB2 ASP A 39 -19.761 10.485 4.876 1.00 0.00 H new ATOM 0 HB3 ASP A 39 -19.548 9.367 6.208 1.00 0.00 H new ATOM 651 N PRO A 40 -18.853 11.912 8.942 1.00 0.00 N ATOM 652 CA PRO A 40 -18.677 11.719 10.395 1.00 0.00 C ATOM 653 C PRO A 40 -19.711 10.735 10.949 1.00 0.00 C ATOM 654 O PRO A 40 -19.407 9.945 11.825 1.00 0.00 O ATOM 655 CB PRO A 40 -18.861 13.123 10.975 1.00 0.00 C ATOM 656 CG PRO A 40 -19.660 13.926 9.924 1.00 0.00 C ATOM 657 CD PRO A 40 -19.420 13.227 8.572 1.00 0.00 C ATOM 0 HA PRO A 40 -17.709 11.290 10.653 1.00 0.00 H new ATOM 0 HB2 PRO A 40 -19.396 13.085 11.924 1.00 0.00 H new ATOM 0 HB3 PRO A 40 -17.897 13.592 11.172 1.00 0.00 H new ATOM 0 HG2 PRO A 40 -20.722 13.941 10.171 1.00 0.00 H new ATOM 0 HG3 PRO A 40 -19.326 14.963 9.890 1.00 0.00 H new ATOM 0 HD2 PRO A 40 -20.347 13.117 8.010 1.00 0.00 H new ATOM 0 HD3 PRO A 40 -18.733 13.796 7.946 1.00 0.00 H new ATOM 665 N SER A 41 -20.920 10.759 10.434 1.00 0.00 N ATOM 666 CA SER A 41 -21.960 9.800 10.917 1.00 0.00 C ATOM 667 C SER A 41 -21.474 8.370 10.649 1.00 0.00 C ATOM 668 O SER A 41 -21.813 7.445 11.366 1.00 0.00 O ATOM 669 CB SER A 41 -23.276 10.047 10.173 1.00 0.00 C ATOM 670 OG SER A 41 -24.365 9.660 11.001 1.00 0.00 O ATOM 0 H SER A 41 -21.228 11.400 9.703 1.00 0.00 H new ATOM 0 HA SER A 41 -22.127 9.941 11.985 1.00 0.00 H new ATOM 0 HB2 SER A 41 -23.364 11.100 9.906 1.00 0.00 H new ATOM 0 HB3 SER A 41 -23.293 9.480 9.242 1.00 0.00 H new ATOM 0 HG SER A 41 -25.208 9.819 10.528 1.00 0.00 H new ATOM 676 N LYS A 42 -20.673 8.193 9.620 1.00 0.00 N ATOM 677 CA LYS A 42 -20.141 6.842 9.285 1.00 0.00 C ATOM 678 C LYS A 42 -18.849 6.570 10.071 1.00 0.00 C ATOM 679 O LYS A 42 -18.525 5.428 10.338 1.00 0.00 O ATOM 680 CB LYS A 42 -19.850 6.768 7.783 1.00 0.00 C ATOM 681 CG LYS A 42 -21.146 6.974 6.993 1.00 0.00 C ATOM 682 CD LYS A 42 -21.891 5.642 6.868 1.00 0.00 C ATOM 683 CE LYS A 42 -23.363 5.836 7.245 1.00 0.00 C ATOM 684 NZ LYS A 42 -23.494 5.940 8.728 1.00 0.00 N ATOM 0 H LYS A 42 -20.366 8.939 8.996 1.00 0.00 H new ATOM 0 HA LYS A 42 -20.884 6.091 9.554 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -19.120 7.529 7.507 1.00 0.00 H new ATOM 0 HB3 LYS A 42 -19.412 5.801 7.535 1.00 0.00 H new ATOM 0 HG2 LYS A 42 -21.776 7.709 7.494 1.00 0.00 H new ATOM 0 HG3 LYS A 42 -20.921 7.370 6.003 1.00 0.00 H new ATOM 0 HD2 LYS A 42 -21.813 5.265 5.848 1.00 0.00 H new ATOM 0 HD3 LYS A 42 -21.434 4.896 7.519 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -23.754 6.737 6.772 1.00 0.00 H new ATOM 0 HE3 LYS A 42 -23.956 4.999 6.876 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 -24.494 6.072 8.980 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 -23.137 5.069 9.170 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 -22.941 6.752 9.069 1.00 0.00 H new ATOM 698 N ILE A 43 -18.112 7.603 10.444 1.00 0.00 N ATOM 699 CA ILE A 43 -16.839 7.398 11.217 1.00 0.00 C ATOM 700 C ILE A 43 -17.114 6.501 12.429 1.00 0.00 C ATOM 701 O ILE A 43 -17.755 6.904 13.385 1.00 0.00 O ATOM 702 CB ILE A 43 -16.286 8.749 11.696 1.00 0.00 C ATOM 703 CG1 ILE A 43 -15.753 9.537 10.495 1.00 0.00 C ATOM 704 CG2 ILE A 43 -15.143 8.511 12.690 1.00 0.00 C ATOM 705 CD1 ILE A 43 -15.378 10.955 10.933 1.00 0.00 C ATOM 0 H ILE A 43 -18.341 8.577 10.245 1.00 0.00 H new ATOM 0 HA ILE A 43 -16.104 6.923 10.568 1.00 0.00 H new ATOM 0 HB ILE A 43 -17.082 9.314 12.182 1.00 0.00 H new ATOM 0 HG12 ILE A 43 -14.882 9.034 10.075 1.00 0.00 H new ATOM 0 HG13 ILE A 43 -16.508 9.576 9.710 1.00 0.00 H new ATOM 0 HG21 ILE A 43 -14.751 9.470 13.030 1.00 0.00 H new ATOM 0 HG22 ILE A 43 -15.516 7.948 13.545 1.00 0.00 H new ATOM 0 HG23 ILE A 43 -14.348 7.946 12.202 1.00 0.00 H new ATOM 0 HD11 ILE A 43 -14.999 11.512 10.076 1.00 0.00 H new ATOM 0 HD12 ILE A 43 -16.259 11.458 11.332 1.00 0.00 H new ATOM 0 HD13 ILE A 43 -14.608 10.906 11.703 1.00 0.00 H new ATOM 717 N GLU A 44 -16.631 5.286 12.384 1.00 0.00 N ATOM 718 CA GLU A 44 -16.842 4.335 13.513 1.00 0.00 C ATOM 719 C GLU A 44 -15.552 4.212 14.327 1.00 0.00 C ATOM 720 O GLU A 44 -15.587 3.980 15.522 1.00 0.00 O ATOM 721 CB GLU A 44 -17.227 2.962 12.957 1.00 0.00 C ATOM 722 CG GLU A 44 -18.693 2.982 12.519 1.00 0.00 C ATOM 723 CD GLU A 44 -19.284 1.572 12.624 1.00 0.00 C ATOM 724 OE1 GLU A 44 -19.793 1.240 13.683 1.00 0.00 O ATOM 725 OE2 GLU A 44 -19.220 0.848 11.643 1.00 0.00 O ATOM 0 H GLU A 44 -16.093 4.909 11.603 1.00 0.00 H new ATOM 0 HA GLU A 44 -17.641 4.705 14.155 1.00 0.00 H new ATOM 0 HB2 GLU A 44 -16.587 2.708 12.112 1.00 0.00 H new ATOM 0 HB3 GLU A 44 -17.073 2.194 13.716 1.00 0.00 H new ATOM 0 HG2 GLU A 44 -19.260 3.672 13.145 1.00 0.00 H new ATOM 0 HG3 GLU A 44 -18.771 3.344 11.494 1.00 0.00 H new ATOM 732 N LYS A 45 -14.411 4.365 13.689 1.00 0.00 N ATOM 733 CA LYS A 45 -13.114 4.255 14.426 1.00 0.00 C ATOM 734 C LYS A 45 -11.996 4.948 13.637 1.00 0.00 C ATOM 735 O LYS A 45 -11.955 4.895 12.419 1.00 0.00 O ATOM 736 CB LYS A 45 -12.759 2.777 14.626 1.00 0.00 C ATOM 737 CG LYS A 45 -11.846 2.626 15.848 1.00 0.00 C ATOM 738 CD LYS A 45 -12.681 2.708 17.128 1.00 0.00 C ATOM 739 CE LYS A 45 -11.754 2.674 18.347 1.00 0.00 C ATOM 740 NZ LYS A 45 -11.519 1.261 18.760 1.00 0.00 N ATOM 0 H LYS A 45 -14.326 4.561 12.692 1.00 0.00 H new ATOM 0 HA LYS A 45 -13.217 4.741 15.396 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -13.667 2.190 14.764 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -12.261 2.389 13.738 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -11.320 1.672 15.806 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -11.087 3.409 15.846 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -13.271 3.625 17.132 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -13.384 1.876 17.170 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -10.806 3.156 18.108 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -12.198 3.234 19.170 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -10.751 1.227 19.461 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -12.388 0.873 19.179 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -11.253 0.696 17.928 1.00 0.00 H new ATOM 754 N THR A 46 -11.085 5.589 14.331 1.00 0.00 N ATOM 755 CA THR A 46 -9.955 6.287 13.649 1.00 0.00 C ATOM 756 C THR A 46 -8.640 5.584 14.005 1.00 0.00 C ATOM 757 O THR A 46 -8.212 5.589 15.146 1.00 0.00 O ATOM 758 CB THR A 46 -9.903 7.753 14.106 1.00 0.00 C ATOM 759 OG1 THR A 46 -11.130 8.395 13.782 1.00 0.00 O ATOM 760 CG2 THR A 46 -8.750 8.474 13.402 1.00 0.00 C ATOM 0 H THR A 46 -11.079 5.657 15.349 1.00 0.00 H new ATOM 0 HA THR A 46 -10.103 6.256 12.569 1.00 0.00 H new ATOM 0 HB THR A 46 -9.746 7.788 15.184 1.00 0.00 H new ATOM 0 HG1 THR A 46 -11.098 9.330 14.075 1.00 0.00 H new ATOM 0 HG21 THR A 46 -8.717 9.513 13.729 1.00 0.00 H new ATOM 0 HG22 THR A 46 -7.808 7.985 13.652 1.00 0.00 H new ATOM 0 HG23 THR A 46 -8.903 8.438 12.323 1.00 0.00 H new ATOM 768 N PHE A 47 -8.001 4.978 13.032 1.00 0.00 N ATOM 769 CA PHE A 47 -6.716 4.266 13.287 1.00 0.00 C ATOM 770 C PHE A 47 -5.545 5.113 12.783 1.00 0.00 C ATOM 771 O PHE A 47 -5.586 5.666 11.702 1.00 0.00 O ATOM 772 CB PHE A 47 -6.713 2.929 12.547 1.00 0.00 C ATOM 773 CG PHE A 47 -7.367 1.861 13.393 1.00 0.00 C ATOM 774 CD1 PHE A 47 -8.760 1.832 13.543 1.00 0.00 C ATOM 775 CD2 PHE A 47 -6.578 0.892 14.019 1.00 0.00 C ATOM 776 CE1 PHE A 47 -9.357 0.833 14.322 1.00 0.00 C ATOM 777 CE2 PHE A 47 -7.174 -0.105 14.795 1.00 0.00 C ATOM 778 CZ PHE A 47 -8.563 -0.136 14.947 1.00 0.00 C ATOM 0 H PHE A 47 -8.321 4.948 12.064 1.00 0.00 H new ATOM 0 HA PHE A 47 -6.613 4.096 14.359 1.00 0.00 H new ATOM 0 HB2 PHE A 47 -7.244 3.028 11.600 1.00 0.00 H new ATOM 0 HB3 PHE A 47 -5.689 2.639 12.310 1.00 0.00 H new ATOM 0 HD1 PHE A 47 -9.372 2.579 13.059 1.00 0.00 H new ATOM 0 HD2 PHE A 47 -5.505 0.914 13.902 1.00 0.00 H new ATOM 0 HE1 PHE A 47 -10.430 0.810 14.441 1.00 0.00 H new ATOM 0 HE2 PHE A 47 -6.561 -0.852 15.278 1.00 0.00 H new ATOM 0 HZ PHE A 47 -9.024 -0.907 15.546 1.00 0.00 H new ATOM 788 N ILE A 48 -4.506 5.212 13.568 1.00 0.00 N ATOM 789 CA ILE A 48 -3.310 6.013 13.169 1.00 0.00 C ATOM 790 C ILE A 48 -2.044 5.180 13.409 1.00 0.00 C ATOM 791 O ILE A 48 -1.920 4.509 14.418 1.00 0.00 O ATOM 792 CB ILE A 48 -3.241 7.300 14.003 1.00 0.00 C ATOM 793 CG1 ILE A 48 -4.637 7.628 14.556 1.00 0.00 C ATOM 794 CG2 ILE A 48 -2.742 8.449 13.123 1.00 0.00 C ATOM 795 CD1 ILE A 48 -4.668 9.057 15.094 1.00 0.00 C ATOM 0 H ILE A 48 -4.433 4.766 14.482 1.00 0.00 H new ATOM 0 HA ILE A 48 -3.386 6.276 12.114 1.00 0.00 H new ATOM 0 HB ILE A 48 -2.552 7.162 14.836 1.00 0.00 H new ATOM 0 HG12 ILE A 48 -5.384 7.511 13.771 1.00 0.00 H new ATOM 0 HG13 ILE A 48 -4.896 6.927 15.350 1.00 0.00 H new ATOM 0 HG21 ILE A 48 -2.692 9.364 13.713 1.00 0.00 H new ATOM 0 HG22 ILE A 48 -1.750 8.210 12.740 1.00 0.00 H new ATOM 0 HG23 ILE A 48 -3.428 8.592 12.288 1.00 0.00 H new ATOM 0 HD11 ILE A 48 -5.662 9.278 15.483 1.00 0.00 H new ATOM 0 HD12 ILE A 48 -3.934 9.161 15.893 1.00 0.00 H new ATOM 0 HD13 ILE A 48 -4.430 9.754 14.290 1.00 0.00 H new ATOM 807 N ARG A 49 -1.109 5.216 12.488 1.00 0.00 N ATOM 808 CA ARG A 49 0.149 4.423 12.653 1.00 0.00 C ATOM 809 C ARG A 49 0.903 4.901 13.904 1.00 0.00 C ATOM 810 O ARG A 49 1.396 6.014 13.964 1.00 0.00 O ATOM 811 CB ARG A 49 1.035 4.572 11.405 1.00 0.00 C ATOM 812 CG ARG A 49 1.338 6.051 11.135 1.00 0.00 C ATOM 813 CD ARG A 49 0.671 6.486 9.823 1.00 0.00 C ATOM 814 NE ARG A 49 1.295 7.749 9.315 1.00 0.00 N ATOM 815 CZ ARG A 49 2.044 8.488 10.096 1.00 0.00 C ATOM 816 NH1 ARG A 49 1.544 9.003 11.190 1.00 0.00 N ATOM 817 NH2 ARG A 49 3.294 8.710 9.781 1.00 0.00 N ATOM 0 H ARG A 49 -1.164 5.762 11.628 1.00 0.00 H new ATOM 0 HA ARG A 49 -0.105 3.370 12.774 1.00 0.00 H new ATOM 0 HB2 ARG A 49 1.966 4.024 11.545 1.00 0.00 H new ATOM 0 HB3 ARG A 49 0.534 4.134 10.542 1.00 0.00 H new ATOM 0 HG2 ARG A 49 0.973 6.663 11.960 1.00 0.00 H new ATOM 0 HG3 ARG A 49 2.415 6.206 11.075 1.00 0.00 H new ATOM 0 HD2 ARG A 49 0.772 5.697 9.077 1.00 0.00 H new ATOM 0 HD3 ARG A 49 -0.396 6.639 9.983 1.00 0.00 H new ATOM 0 HE ARG A 49 1.135 8.037 8.350 1.00 0.00 H new ATOM 0 HH11 ARG A 49 0.570 8.829 11.436 1.00 0.00 H new ATOM 0 HH12 ARG A 49 2.129 9.578 11.797 1.00 0.00 H new ATOM 0 HH21 ARG A 49 3.684 8.308 8.929 1.00 0.00 H new ATOM 0 HH22 ARG A 49 3.878 9.285 10.388 1.00 0.00 H new ATOM 928 N MET B 1 0.060 -12.514 15.780 1.00 0.00 N ATOM 929 CA MET B 1 -0.501 -11.467 14.876 1.00 0.00 C ATOM 930 C MET B 1 -1.547 -12.101 13.947 1.00 0.00 C ATOM 931 O MET B 1 -1.310 -12.306 12.768 1.00 0.00 O ATOM 932 CB MET B 1 0.631 -10.849 14.048 1.00 0.00 C ATOM 933 CG MET B 1 1.153 -9.595 14.750 1.00 0.00 C ATOM 934 SD MET B 1 2.762 -9.137 14.056 1.00 0.00 S ATOM 935 CE MET B 1 2.153 -8.425 12.506 1.00 0.00 C ATOM 0 H1 MET B 1 0.768 -12.086 16.410 1.00 0.00 H new ATOM 0 H2 MET B 1 -0.706 -12.927 16.350 1.00 0.00 H new ATOM 0 H3 MET B 1 0.509 -13.260 15.211 1.00 0.00 H new ATOM 0 HA MET B 1 -0.977 -10.686 15.469 1.00 0.00 H new ATOM 0 HB2 MET B 1 1.438 -11.570 13.922 1.00 0.00 H new ATOM 0 HB3 MET B 1 0.270 -10.597 13.051 1.00 0.00 H new ATOM 0 HG2 MET B 1 0.445 -8.775 14.626 1.00 0.00 H new ATOM 0 HG3 MET B 1 1.246 -9.777 15.821 1.00 0.00 H new ATOM 0 HE1 MET B 1 2.394 -9.093 11.679 1.00 0.00 H new ATOM 0 HE2 MET B 1 1.072 -8.295 12.565 1.00 0.00 H new ATOM 0 HE3 MET B 1 2.626 -7.457 12.340 1.00 0.00 H new ATOM 947 N LYS B 2 -2.703 -12.411 14.479 1.00 0.00 N ATOM 948 CA LYS B 2 -3.778 -13.031 13.657 1.00 0.00 C ATOM 949 C LYS B 2 -4.651 -11.940 13.029 1.00 0.00 C ATOM 950 O LYS B 2 -4.528 -10.767 13.338 1.00 0.00 O ATOM 951 CB LYS B 2 -4.640 -13.944 14.535 1.00 0.00 C ATOM 952 CG LYS B 2 -5.305 -13.133 15.654 1.00 0.00 C ATOM 953 CD LYS B 2 -5.165 -13.880 16.983 1.00 0.00 C ATOM 954 CE LYS B 2 -3.978 -13.317 17.770 1.00 0.00 C ATOM 955 NZ LYS B 2 -2.785 -14.188 17.568 1.00 0.00 N ATOM 0 H LYS B 2 -2.947 -12.258 15.458 1.00 0.00 H new ATOM 0 HA LYS B 2 -3.322 -13.623 12.863 1.00 0.00 H new ATOM 0 HB2 LYS B 2 -5.402 -14.431 13.927 1.00 0.00 H new ATOM 0 HB3 LYS B 2 -4.024 -14.733 14.966 1.00 0.00 H new ATOM 0 HG2 LYS B 2 -4.842 -12.149 15.728 1.00 0.00 H new ATOM 0 HG3 LYS B 2 -6.358 -12.973 15.424 1.00 0.00 H new ATOM 0 HD2 LYS B 2 -6.081 -13.779 17.566 1.00 0.00 H new ATOM 0 HD3 LYS B 2 -5.020 -14.945 16.799 1.00 0.00 H new ATOM 0 HE2 LYS B 2 -3.759 -12.301 17.440 1.00 0.00 H new ATOM 0 HE3 LYS B 2 -4.225 -13.262 18.830 1.00 0.00 H new ATOM 0 HZ1 LYS B 2 -1.980 -13.804 18.103 1.00 0.00 H new ATOM 0 HZ2 LYS B 2 -2.996 -15.150 17.903 1.00 0.00 H new ATOM 0 HZ3 LYS B 2 -2.545 -14.219 16.557 1.00 0.00 H new ATOM 969 N ILE B 3 -5.525 -12.333 12.144 1.00 0.00 N ATOM 970 CA ILE B 3 -6.421 -11.353 11.460 1.00 0.00 C ATOM 971 C ILE B 3 -7.819 -11.408 12.080 1.00 0.00 C ATOM 972 O ILE B 3 -8.489 -12.425 12.046 1.00 0.00 O ATOM 973 CB ILE B 3 -6.491 -11.691 9.962 1.00 0.00 C ATOM 974 CG1 ILE B 3 -5.218 -11.195 9.266 1.00 0.00 C ATOM 975 CG2 ILE B 3 -7.707 -11.007 9.325 1.00 0.00 C ATOM 976 CD1 ILE B 3 -4.066 -12.167 9.531 1.00 0.00 C ATOM 0 H ILE B 3 -5.659 -13.304 11.861 1.00 0.00 H new ATOM 0 HA ILE B 3 -6.024 -10.345 11.583 1.00 0.00 H new ATOM 0 HB ILE B 3 -6.582 -12.771 9.847 1.00 0.00 H new ATOM 0 HG12 ILE B 3 -5.391 -11.106 8.193 1.00 0.00 H new ATOM 0 HG13 ILE B 3 -4.958 -10.201 9.630 1.00 0.00 H new ATOM 0 HG21 ILE B 3 -7.748 -11.252 8.264 1.00 0.00 H new ATOM 0 HG22 ILE B 3 -8.617 -11.355 9.813 1.00 0.00 H new ATOM 0 HG23 ILE B 3 -7.621 -9.927 9.445 1.00 0.00 H new ATOM 0 HD11 ILE B 3 -3.165 -11.808 9.033 1.00 0.00 H new ATOM 0 HD12 ILE B 3 -3.886 -12.234 10.604 1.00 0.00 H new ATOM 0 HD13 ILE B 3 -4.325 -13.153 9.145 1.00 0.00 H new ATOM 988 N LYS B 4 -8.263 -10.305 12.629 1.00 0.00 N ATOM 989 CA LYS B 4 -9.619 -10.248 13.238 1.00 0.00 C ATOM 990 C LYS B 4 -10.638 -9.898 12.151 1.00 0.00 C ATOM 991 O LYS B 4 -11.752 -10.391 12.154 1.00 0.00 O ATOM 992 CB LYS B 4 -9.647 -9.173 14.329 1.00 0.00 C ATOM 993 CG LYS B 4 -10.691 -9.542 15.388 1.00 0.00 C ATOM 994 CD LYS B 4 -11.497 -8.298 15.772 1.00 0.00 C ATOM 995 CE LYS B 4 -11.326 -8.018 17.268 1.00 0.00 C ATOM 996 NZ LYS B 4 -12.383 -7.068 17.722 1.00 0.00 N ATOM 0 H LYS B 4 -7.735 -9.434 12.680 1.00 0.00 H new ATOM 0 HA LYS B 4 -9.865 -11.214 13.679 1.00 0.00 H new ATOM 0 HB2 LYS B 4 -8.663 -9.083 14.790 1.00 0.00 H new ATOM 0 HB3 LYS B 4 -9.885 -8.203 13.892 1.00 0.00 H new ATOM 0 HG2 LYS B 4 -11.357 -10.314 15.003 1.00 0.00 H new ATOM 0 HG3 LYS B 4 -10.200 -9.955 16.269 1.00 0.00 H new ATOM 0 HD2 LYS B 4 -11.160 -7.440 15.190 1.00 0.00 H new ATOM 0 HD3 LYS B 4 -12.551 -8.448 15.538 1.00 0.00 H new ATOM 0 HE2 LYS B 4 -11.392 -8.948 17.832 1.00 0.00 H new ATOM 0 HE3 LYS B 4 -10.339 -7.598 17.459 1.00 0.00 H new ATOM 0 HZ1 LYS B 4 -12.397 -7.035 18.761 1.00 0.00 H new ATOM 0 HZ2 LYS B 4 -12.181 -6.119 17.348 1.00 0.00 H new ATOM 0 HZ3 LYS B 4 -13.309 -7.387 17.374 1.00 0.00 H new ATOM 1010 N ARG B 5 -10.258 -9.049 11.220 1.00 0.00 N ATOM 1011 CA ARG B 5 -11.192 -8.654 10.123 1.00 0.00 C ATOM 1012 C ARG B 5 -10.405 -8.417 8.828 1.00 0.00 C ATOM 1013 O ARG B 5 -9.192 -8.317 8.834 1.00 0.00 O ATOM 1014 CB ARG B 5 -11.918 -7.363 10.507 1.00 0.00 C ATOM 1015 CG ARG B 5 -12.967 -7.650 11.584 1.00 0.00 C ATOM 1016 CD ARG B 5 -13.490 -6.327 12.149 1.00 0.00 C ATOM 1017 NE ARG B 5 -12.791 -6.023 13.431 1.00 0.00 N ATOM 1018 CZ ARG B 5 -13.474 -5.606 14.465 1.00 0.00 C ATOM 1019 NH1 ARG B 5 -14.201 -6.448 15.152 1.00 0.00 N ATOM 1020 NH2 ARG B 5 -13.427 -4.346 14.812 1.00 0.00 N ATOM 0 H ARG B 5 -9.337 -8.614 11.177 1.00 0.00 H new ATOM 0 HA ARG B 5 -11.916 -9.454 9.969 1.00 0.00 H new ATOM 0 HB2 ARG B 5 -11.201 -6.628 10.873 1.00 0.00 H new ATOM 0 HB3 ARG B 5 -12.397 -6.930 9.628 1.00 0.00 H new ATOM 0 HG2 ARG B 5 -13.789 -8.228 11.162 1.00 0.00 H new ATOM 0 HG3 ARG B 5 -12.531 -8.252 12.381 1.00 0.00 H new ATOM 0 HD2 ARG B 5 -13.324 -5.522 11.432 1.00 0.00 H new ATOM 0 HD3 ARG B 5 -14.565 -6.390 12.315 1.00 0.00 H new ATOM 0 HE ARG B 5 -11.780 -6.140 13.501 1.00 0.00 H new ATOM 0 HH11 ARG B 5 -14.236 -7.431 14.881 1.00 0.00 H new ATOM 0 HH12 ARG B 5 -14.734 -6.122 15.959 1.00 0.00 H new ATOM 0 HH21 ARG B 5 -12.858 -3.690 14.276 1.00 0.00 H new ATOM 0 HH22 ARG B 5 -13.959 -4.019 15.618 1.00 0.00 H new ATOM 1034 N ILE B 6 -11.099 -8.317 7.720 1.00 0.00 N ATOM 1035 CA ILE B 6 -10.424 -8.076 6.409 1.00 0.00 C ATOM 1036 C ILE B 6 -10.981 -6.795 5.788 1.00 0.00 C ATOM 1037 O ILE B 6 -12.181 -6.634 5.638 1.00 0.00 O ATOM 1038 CB ILE B 6 -10.677 -9.261 5.467 1.00 0.00 C ATOM 1039 CG1 ILE B 6 -10.219 -10.563 6.137 1.00 0.00 C ATOM 1040 CG2 ILE B 6 -9.898 -9.062 4.162 1.00 0.00 C ATOM 1041 CD1 ILE B 6 -11.420 -11.268 6.773 1.00 0.00 C ATOM 0 H ILE B 6 -12.115 -8.393 7.669 1.00 0.00 H new ATOM 0 HA ILE B 6 -9.350 -7.972 6.565 1.00 0.00 H new ATOM 0 HB ILE B 6 -11.743 -9.319 5.249 1.00 0.00 H new ATOM 0 HG12 ILE B 6 -9.750 -11.216 5.401 1.00 0.00 H new ATOM 0 HG13 ILE B 6 -9.468 -10.347 6.897 1.00 0.00 H new ATOM 0 HG21 ILE B 6 -10.081 -9.906 3.497 1.00 0.00 H new ATOM 0 HG22 ILE B 6 -10.226 -8.142 3.679 1.00 0.00 H new ATOM 0 HG23 ILE B 6 -8.832 -8.997 4.381 1.00 0.00 H new ATOM 0 HD11 ILE B 6 -11.090 -12.192 7.248 1.00 0.00 H new ATOM 0 HD12 ILE B 6 -11.870 -10.616 7.522 1.00 0.00 H new ATOM 0 HD13 ILE B 6 -12.156 -11.498 6.003 1.00 0.00 H new ATOM 1053 N LEU B 7 -10.114 -5.886 5.424 1.00 0.00 N ATOM 1054 CA LEU B 7 -10.562 -4.609 4.809 1.00 0.00 C ATOM 1055 C LEU B 7 -10.568 -4.768 3.289 1.00 0.00 C ATOM 1056 O LEU B 7 -11.535 -4.447 2.624 1.00 0.00 O ATOM 1057 CB LEU B 7 -9.605 -3.494 5.222 1.00 0.00 C ATOM 1058 CG LEU B 7 -9.601 -3.382 6.747 1.00 0.00 C ATOM 1059 CD1 LEU B 7 -8.242 -2.873 7.231 1.00 0.00 C ATOM 1060 CD2 LEU B 7 -10.693 -2.412 7.192 1.00 0.00 C ATOM 0 H LEU B 7 -9.104 -5.979 5.530 1.00 0.00 H new ATOM 0 HA LEU B 7 -11.567 -4.356 5.146 1.00 0.00 H new ATOM 0 HB2 LEU B 7 -8.600 -3.706 4.857 1.00 0.00 H new ATOM 0 HB3 LEU B 7 -9.913 -2.549 4.776 1.00 0.00 H new ATOM 0 HG LEU B 7 -9.789 -4.366 7.176 1.00 0.00 H new ATOM 0 HD11 LEU B 7 -8.248 -2.796 8.318 1.00 0.00 H new ATOM 0 HD12 LEU B 7 -7.462 -3.568 6.921 1.00 0.00 H new ATOM 0 HD13 LEU B 7 -8.046 -1.891 6.799 1.00 0.00 H new ATOM 0 HD21 LEU B 7 -10.689 -2.333 8.279 1.00 0.00 H new ATOM 0 HD22 LEU B 7 -10.507 -1.430 6.756 1.00 0.00 H new ATOM 0 HD23 LEU B 7 -11.664 -2.779 6.859 1.00 0.00 H new ATOM 1072 N ASN B 8 -9.497 -5.299 2.748 1.00 0.00 N ATOM 1073 CA ASN B 8 -9.415 -5.533 1.273 1.00 0.00 C ATOM 1074 C ASN B 8 -8.163 -6.376 0.954 1.00 0.00 C ATOM 1075 O ASN B 8 -7.577 -6.981 1.835 1.00 0.00 O ATOM 1076 CB ASN B 8 -9.414 -4.193 0.503 1.00 0.00 C ATOM 1077 CG ASN B 8 -8.079 -3.462 0.651 1.00 0.00 C ATOM 1078 OD1 ASN B 8 -7.108 -3.808 0.014 1.00 0.00 O ATOM 1079 ND2 ASN B 8 -7.996 -2.432 1.442 1.00 0.00 N ATOM 0 H ASN B 8 -8.669 -5.583 3.272 1.00 0.00 H new ATOM 0 HA ASN B 8 -10.295 -6.087 0.946 1.00 0.00 H new ATOM 0 HB2 ASN B 8 -9.613 -4.379 -0.552 1.00 0.00 H new ATOM 0 HB3 ASN B 8 -10.220 -3.559 0.873 1.00 0.00 H new ATOM 0 HD21 ASN B 8 -7.117 -1.921 1.523 1.00 0.00 H new ATOM 0 HD22 ASN B 8 -8.810 -2.136 1.981 1.00 0.00 H new ATOM 1086 N HIS B 9 -7.771 -6.444 -0.296 1.00 0.00 N ATOM 1087 CA HIS B 9 -6.581 -7.272 -0.690 1.00 0.00 C ATOM 1088 C HIS B 9 -5.295 -6.794 0.012 1.00 0.00 C ATOM 1089 O HIS B 9 -4.349 -7.551 0.149 1.00 0.00 O ATOM 1090 CB HIS B 9 -6.387 -7.179 -2.207 1.00 0.00 C ATOM 1091 CG HIS B 9 -5.487 -8.293 -2.670 1.00 0.00 C ATOM 1092 ND1 HIS B 9 -4.209 -8.290 -3.170 1.00 0.00 N flip ATOM 1093 CD2 HIS B 9 -5.882 -9.621 -2.647 1.00 0.00 C flip ATOM 1094 CE1 HIS B 9 -3.815 -9.595 -3.454 1.00 0.00 C flip ATOM 1095 NE2 HIS B 9 -4.860 -10.357 -3.120 1.00 0.00 N flip ATOM 0 H HIS B 9 -8.227 -5.958 -1.068 1.00 0.00 H new ATOM 0 HA HIS B 9 -6.770 -8.302 -0.386 1.00 0.00 H new ATOM 0 HB2 HIS B 9 -7.351 -7.243 -2.712 1.00 0.00 H new ATOM 0 HB3 HIS B 9 -5.953 -6.214 -2.470 1.00 0.00 H new ATOM 0 HD2 HIS B 9 -6.837 -9.997 -2.310 1.00 0.00 H new ATOM 0 HE1 HIS B 9 -2.868 -9.921 -3.858 1.00 0.00 H new ATOM 0 HE2 HIS B 9 -4.881 -11.373 -3.212 1.00 0.00 H new ATOM 1103 N ASN B 10 -5.236 -5.552 0.429 1.00 0.00 N ATOM 1104 CA ASN B 10 -4.002 -5.028 1.086 1.00 0.00 C ATOM 1105 C ASN B 10 -4.272 -4.602 2.531 1.00 0.00 C ATOM 1106 O ASN B 10 -3.379 -4.626 3.358 1.00 0.00 O ATOM 1107 CB ASN B 10 -3.494 -3.813 0.305 1.00 0.00 C ATOM 1108 CG ASN B 10 -3.752 -3.997 -1.197 1.00 0.00 C ATOM 1109 OD1 ASN B 10 -3.170 -4.858 -1.826 1.00 0.00 O ATOM 1110 ND2 ASN B 10 -4.610 -3.219 -1.800 1.00 0.00 N ATOM 0 H ASN B 10 -5.995 -4.877 0.341 1.00 0.00 H new ATOM 0 HA ASN B 10 -3.259 -5.826 1.093 1.00 0.00 H new ATOM 0 HB2 ASN B 10 -3.993 -2.911 0.658 1.00 0.00 H new ATOM 0 HB3 ASN B 10 -2.427 -3.678 0.483 1.00 0.00 H new ATOM 0 HD21 ASN B 10 -4.790 -3.335 -2.797 1.00 0.00 H new ATOM 0 HD22 ASN B 10 -5.100 -2.495 -1.274 1.00 0.00 H new ATOM 1117 N ALA B 11 -5.476 -4.192 2.846 1.00 0.00 N ATOM 1118 CA ALA B 11 -5.768 -3.743 4.234 1.00 0.00 C ATOM 1119 C ALA B 11 -6.458 -4.856 5.021 1.00 0.00 C ATOM 1120 O ALA B 11 -7.358 -5.513 4.533 1.00 0.00 O ATOM 1121 CB ALA B 11 -6.664 -2.506 4.190 1.00 0.00 C ATOM 0 H ALA B 11 -6.265 -4.150 2.201 1.00 0.00 H new ATOM 0 HA ALA B 11 -4.830 -3.497 4.732 1.00 0.00 H new ATOM 0 HB1 ALA B 11 -6.879 -2.176 5.206 1.00 0.00 H new ATOM 0 HB2 ALA B 11 -6.156 -1.708 3.649 1.00 0.00 H new ATOM 0 HB3 ALA B 11 -7.597 -2.751 3.683 1.00 0.00 H new ATOM 1127 N ILE B 12 -6.031 -5.062 6.241 1.00 0.00 N ATOM 1128 CA ILE B 12 -6.634 -6.121 7.103 1.00 0.00 C ATOM 1129 C ILE B 12 -6.639 -5.641 8.562 1.00 0.00 C ATOM 1130 O ILE B 12 -5.746 -4.933 8.988 1.00 0.00 O ATOM 1131 CB ILE B 12 -5.795 -7.406 7.001 1.00 0.00 C ATOM 1132 CG1 ILE B 12 -5.643 -7.833 5.533 1.00 0.00 C ATOM 1133 CG2 ILE B 12 -6.464 -8.530 7.793 1.00 0.00 C ATOM 1134 CD1 ILE B 12 -6.985 -8.301 4.970 1.00 0.00 C ATOM 0 H ILE B 12 -5.279 -4.533 6.682 1.00 0.00 H new ATOM 0 HA ILE B 12 -7.653 -6.322 6.773 1.00 0.00 H new ATOM 0 HB ILE B 12 -4.807 -7.208 7.416 1.00 0.00 H new ATOM 0 HG12 ILE B 12 -5.265 -6.998 4.943 1.00 0.00 H new ATOM 0 HG13 ILE B 12 -4.910 -8.636 5.456 1.00 0.00 H new ATOM 0 HG21 ILE B 12 -5.864 -9.437 7.716 1.00 0.00 H new ATOM 0 HG22 ILE B 12 -6.547 -8.238 8.840 1.00 0.00 H new ATOM 0 HG23 ILE B 12 -7.459 -8.718 7.389 1.00 0.00 H new ATOM 0 HD11 ILE B 12 -6.859 -8.600 3.929 1.00 0.00 H new ATOM 0 HD12 ILE B 12 -7.347 -9.150 5.550 1.00 0.00 H new ATOM 0 HD13 ILE B 12 -7.708 -7.487 5.029 1.00 0.00 H new ATOM 1146 N VAL B 13 -7.626 -6.035 9.332 1.00 0.00 N ATOM 1147 CA VAL B 13 -7.675 -5.618 10.763 1.00 0.00 C ATOM 1148 C VAL B 13 -7.117 -6.755 11.620 1.00 0.00 C ATOM 1149 O VAL B 13 -7.695 -7.823 11.695 1.00 0.00 O ATOM 1150 CB VAL B 13 -9.120 -5.322 11.184 1.00 0.00 C ATOM 1151 CG1 VAL B 13 -9.119 -4.601 12.534 1.00 0.00 C ATOM 1152 CG2 VAL B 13 -9.800 -4.435 10.134 1.00 0.00 C ATOM 0 H VAL B 13 -8.398 -6.628 9.028 1.00 0.00 H new ATOM 0 HA VAL B 13 -7.082 -4.714 10.899 1.00 0.00 H new ATOM 0 HB VAL B 13 -9.667 -6.261 11.268 1.00 0.00 H new ATOM 0 HG11 VAL B 13 -10.145 -4.390 12.835 1.00 0.00 H new ATOM 0 HG12 VAL B 13 -8.644 -5.234 13.284 1.00 0.00 H new ATOM 0 HG13 VAL B 13 -8.567 -3.665 12.446 1.00 0.00 H new ATOM 0 HG21 VAL B 13 -10.826 -4.229 10.440 1.00 0.00 H new ATOM 0 HG22 VAL B 13 -9.254 -3.496 10.042 1.00 0.00 H new ATOM 0 HG23 VAL B 13 -9.805 -4.948 9.172 1.00 0.00 H new ATOM 1162 N VAL B 14 -5.994 -6.536 12.257 1.00 0.00 N ATOM 1163 CA VAL B 14 -5.386 -7.603 13.106 1.00 0.00 C ATOM 1164 C VAL B 14 -5.368 -7.158 14.574 1.00 0.00 C ATOM 1165 O VAL B 14 -5.700 -6.031 14.899 1.00 0.00 O ATOM 1166 CB VAL B 14 -3.950 -7.891 12.634 1.00 0.00 C ATOM 1167 CG1 VAL B 14 -3.975 -8.434 11.204 1.00 0.00 C ATOM 1168 CG2 VAL B 14 -3.115 -6.606 12.673 1.00 0.00 C ATOM 0 H VAL B 14 -5.471 -5.661 12.225 1.00 0.00 H new ATOM 0 HA VAL B 14 -5.983 -8.511 13.016 1.00 0.00 H new ATOM 0 HB VAL B 14 -3.503 -8.631 13.299 1.00 0.00 H new ATOM 0 HG11 VAL B 14 -2.956 -8.637 10.874 1.00 0.00 H new ATOM 0 HG12 VAL B 14 -4.556 -9.356 11.175 1.00 0.00 H new ATOM 0 HG13 VAL B 14 -4.431 -7.697 10.543 1.00 0.00 H new ATOM 0 HG21 VAL B 14 -2.101 -6.821 12.337 1.00 0.00 H new ATOM 0 HG22 VAL B 14 -3.564 -5.860 12.017 1.00 0.00 H new ATOM 0 HG23 VAL B 14 -3.086 -6.222 13.693 1.00 0.00 H new ATOM 1178 N LYS B 15 -4.977 -8.041 15.457 1.00 0.00 N ATOM 1179 CA LYS B 15 -4.920 -7.698 16.911 1.00 0.00 C ATOM 1180 C LYS B 15 -3.512 -7.972 17.449 1.00 0.00 C ATOM 1181 O LYS B 15 -2.738 -8.706 16.858 1.00 0.00 O ATOM 1182 CB LYS B 15 -5.944 -8.537 17.687 1.00 0.00 C ATOM 1183 CG LYS B 15 -5.605 -10.029 17.564 1.00 0.00 C ATOM 1184 CD LYS B 15 -6.872 -10.861 17.774 1.00 0.00 C ATOM 1185 CE LYS B 15 -7.673 -10.913 16.469 1.00 0.00 C ATOM 1186 NZ LYS B 15 -8.613 -12.069 16.503 1.00 0.00 N ATOM 0 H LYS B 15 -4.692 -8.994 15.231 1.00 0.00 H new ATOM 0 HA LYS B 15 -5.156 -6.642 17.039 1.00 0.00 H new ATOM 0 HB2 LYS B 15 -5.947 -8.242 18.736 1.00 0.00 H new ATOM 0 HB3 LYS B 15 -6.946 -8.351 17.301 1.00 0.00 H new ATOM 0 HG2 LYS B 15 -5.180 -10.236 16.582 1.00 0.00 H new ATOM 0 HG3 LYS B 15 -4.851 -10.303 18.302 1.00 0.00 H new ATOM 0 HD2 LYS B 15 -6.609 -11.870 18.092 1.00 0.00 H new ATOM 0 HD3 LYS B 15 -7.478 -10.425 18.568 1.00 0.00 H new ATOM 0 HE2 LYS B 15 -8.228 -9.984 16.334 1.00 0.00 H new ATOM 0 HE3 LYS B 15 -6.997 -11.007 15.619 1.00 0.00 H new ATOM 0 HZ1 LYS B 15 -9.069 -12.173 15.574 1.00 0.00 H new ATOM 0 HZ2 LYS B 15 -8.087 -12.937 16.730 1.00 0.00 H new ATOM 0 HZ3 LYS B 15 -9.340 -11.904 17.229 1.00 0.00 H new ATOM 1200 N ASP B 16 -3.181 -7.381 18.568 1.00 0.00 N ATOM 1201 CA ASP B 16 -1.830 -7.586 19.164 1.00 0.00 C ATOM 1202 C ASP B 16 -1.895 -7.415 20.687 1.00 0.00 C ATOM 1203 O ASP B 16 -2.958 -7.240 21.261 1.00 0.00 O ATOM 1204 CB ASP B 16 -0.857 -6.556 18.575 1.00 0.00 C ATOM 1205 CG ASP B 16 0.157 -7.266 17.672 1.00 0.00 C ATOM 1206 OD1 ASP B 16 1.161 -7.729 18.188 1.00 0.00 O ATOM 1207 OD2 ASP B 16 -0.088 -7.330 16.478 1.00 0.00 O ATOM 0 H ASP B 16 -3.794 -6.761 19.097 1.00 0.00 H new ATOM 0 HA ASP B 16 -1.485 -8.594 18.935 1.00 0.00 H new ATOM 0 HB2 ASP B 16 -1.406 -5.807 18.004 1.00 0.00 H new ATOM 0 HB3 ASP B 16 -0.339 -6.029 19.377 1.00 0.00 H new ATOM 1212 N GLN B 17 -0.758 -7.465 21.340 1.00 0.00 N ATOM 1213 CA GLN B 17 -0.714 -7.309 22.825 1.00 0.00 C ATOM 1214 C GLN B 17 -1.332 -5.974 23.223 1.00 0.00 C ATOM 1215 O GLN B 17 -2.119 -5.897 24.149 1.00 0.00 O ATOM 1216 CB GLN B 17 0.742 -7.352 23.297 1.00 0.00 C ATOM 1217 CG GLN B 17 1.035 -8.706 23.947 1.00 0.00 C ATOM 1218 CD GLN B 17 1.624 -9.660 22.902 1.00 0.00 C ATOM 1219 OE1 GLN B 17 2.821 -9.859 22.854 1.00 0.00 O ATOM 1220 NE2 GLN B 17 0.828 -10.261 22.058 1.00 0.00 N ATOM 0 H GLN B 17 0.151 -7.609 20.900 1.00 0.00 H new ATOM 0 HA GLN B 17 -1.277 -8.120 23.288 1.00 0.00 H new ATOM 0 HB2 GLN B 17 1.413 -7.190 22.453 1.00 0.00 H new ATOM 0 HB3 GLN B 17 0.927 -6.548 24.010 1.00 0.00 H new ATOM 0 HG2 GLN B 17 1.733 -8.580 24.774 1.00 0.00 H new ATOM 0 HG3 GLN B 17 0.120 -9.127 24.364 1.00 0.00 H new ATOM 0 HE21 GLN B 17 -0.177 -10.094 22.098 1.00 0.00 H new ATOM 0 HE22 GLN B 17 1.212 -10.897 21.359 1.00 0.00 H new ATOM 1229 N ASN B 18 -0.974 -4.925 22.533 1.00 0.00 N ATOM 1230 CA ASN B 18 -1.526 -3.583 22.862 1.00 0.00 C ATOM 1231 C ASN B 18 -3.038 -3.564 22.609 1.00 0.00 C ATOM 1232 O ASN B 18 -3.808 -3.251 23.497 1.00 0.00 O ATOM 1233 CB ASN B 18 -0.844 -2.517 22.000 1.00 0.00 C ATOM 1234 CG ASN B 18 0.397 -1.989 22.723 1.00 0.00 C ATOM 1235 OD1 ASN B 18 0.362 -0.933 23.324 1.00 0.00 O ATOM 1236 ND2 ASN B 18 1.504 -2.683 22.692 1.00 0.00 N ATOM 0 H ASN B 18 -0.319 -4.942 21.751 1.00 0.00 H new ATOM 0 HA ASN B 18 -1.338 -3.369 23.914 1.00 0.00 H new ATOM 0 HB2 ASN B 18 -0.563 -2.940 21.036 1.00 0.00 H new ATOM 0 HB3 ASN B 18 -1.536 -1.699 21.800 1.00 0.00 H new ATOM 0 HD21 ASN B 18 2.336 -2.338 23.171 1.00 0.00 H new ATOM 0 HD22 ASN B 18 1.536 -3.569 22.188 1.00 0.00 H new ATOM 1243 N GLU B 19 -3.466 -3.901 21.407 1.00 0.00 N ATOM 1244 CA GLU B 19 -4.929 -3.904 21.087 1.00 0.00 C ATOM 1245 C GLU B 19 -5.130 -4.168 19.583 1.00 0.00 C ATOM 1246 O GLU B 19 -4.295 -4.771 18.932 1.00 0.00 O ATOM 1247 CB GLU B 19 -5.540 -2.543 21.458 1.00 0.00 C ATOM 1248 CG GLU B 19 -6.850 -2.756 22.226 1.00 0.00 C ATOM 1249 CD GLU B 19 -6.774 -2.053 23.586 1.00 0.00 C ATOM 1250 OE1 GLU B 19 -6.990 -0.852 23.626 1.00 0.00 O ATOM 1251 OE2 GLU B 19 -6.503 -2.728 24.567 1.00 0.00 O ATOM 0 H GLU B 19 -2.858 -4.174 20.635 1.00 0.00 H new ATOM 0 HA GLU B 19 -5.422 -4.690 21.659 1.00 0.00 H new ATOM 0 HB2 GLU B 19 -4.839 -1.973 22.067 1.00 0.00 H new ATOM 0 HB3 GLU B 19 -5.727 -1.960 20.556 1.00 0.00 H new ATOM 0 HG2 GLU B 19 -7.688 -2.364 21.650 1.00 0.00 H new ATOM 0 HG3 GLU B 19 -7.031 -3.822 22.367 1.00 0.00 H new ATOM 1258 N GLU B 20 -6.238 -3.719 19.034 1.00 0.00 N ATOM 1259 CA GLU B 20 -6.517 -3.933 17.581 1.00 0.00 C ATOM 1260 C GLU B 20 -5.684 -2.967 16.731 1.00 0.00 C ATOM 1261 O GLU B 20 -5.443 -1.835 17.110 1.00 0.00 O ATOM 1262 CB GLU B 20 -8.003 -3.692 17.302 1.00 0.00 C ATOM 1263 CG GLU B 20 -8.414 -4.440 16.030 1.00 0.00 C ATOM 1264 CD GLU B 20 -9.897 -4.187 15.738 1.00 0.00 C ATOM 1265 OE1 GLU B 20 -10.204 -3.148 15.177 1.00 0.00 O ATOM 1266 OE2 GLU B 20 -10.701 -5.039 16.079 1.00 0.00 O ATOM 0 H GLU B 20 -6.964 -3.210 19.538 1.00 0.00 H new ATOM 0 HA GLU B 20 -6.252 -4.958 17.322 1.00 0.00 H new ATOM 0 HB2 GLU B 20 -8.602 -4.033 18.146 1.00 0.00 H new ATOM 0 HB3 GLU B 20 -8.193 -2.625 17.186 1.00 0.00 H new ATOM 0 HG2 GLU B 20 -7.806 -4.108 15.189 1.00 0.00 H new ATOM 0 HG3 GLU B 20 -8.234 -5.508 16.151 1.00 0.00 H new ATOM 1273 N LYS B 21 -5.261 -3.415 15.574 1.00 0.00 N ATOM 1274 CA LYS B 21 -4.453 -2.552 14.663 1.00 0.00 C ATOM 1275 C LYS B 21 -4.689 -2.988 13.213 1.00 0.00 C ATOM 1276 O LYS B 21 -4.725 -4.165 12.909 1.00 0.00 O ATOM 1277 CB LYS B 21 -2.958 -2.668 14.988 1.00 0.00 C ATOM 1278 CG LYS B 21 -2.641 -4.050 15.573 1.00 0.00 C ATOM 1279 CD LYS B 21 -1.169 -4.388 15.323 1.00 0.00 C ATOM 1280 CE LYS B 21 -0.309 -3.789 16.441 1.00 0.00 C ATOM 1281 NZ LYS B 21 1.092 -4.286 16.317 1.00 0.00 N ATOM 0 H LYS B 21 -5.445 -4.354 15.220 1.00 0.00 H new ATOM 0 HA LYS B 21 -4.761 -1.515 14.800 1.00 0.00 H new ATOM 0 HB2 LYS B 21 -2.370 -2.505 14.085 1.00 0.00 H new ATOM 0 HB3 LYS B 21 -2.673 -1.892 15.698 1.00 0.00 H new ATOM 0 HG2 LYS B 21 -2.850 -4.060 16.643 1.00 0.00 H new ATOM 0 HG3 LYS B 21 -3.281 -4.805 15.116 1.00 0.00 H new ATOM 0 HD2 LYS B 21 -1.034 -5.469 15.286 1.00 0.00 H new ATOM 0 HD3 LYS B 21 -0.854 -3.994 14.357 1.00 0.00 H new ATOM 0 HE2 LYS B 21 -0.326 -2.701 16.383 1.00 0.00 H new ATOM 0 HE3 LYS B 21 -0.718 -4.062 17.414 1.00 0.00 H new ATOM 0 HZ1 LYS B 21 1.444 -4.570 17.254 1.00 0.00 H new ATOM 0 HZ2 LYS B 21 1.115 -5.104 15.676 1.00 0.00 H new ATOM 0 HZ3 LYS B 21 1.696 -3.530 15.935 1.00 0.00 H new ATOM 1295 N ILE B 22 -4.841 -2.044 12.319 1.00 0.00 N ATOM 1296 CA ILE B 22 -5.068 -2.389 10.885 1.00 0.00 C ATOM 1297 C ILE B 22 -3.713 -2.513 10.182 1.00 0.00 C ATOM 1298 O ILE B 22 -2.931 -1.579 10.145 1.00 0.00 O ATOM 1299 CB ILE B 22 -5.928 -1.300 10.218 1.00 0.00 C ATOM 1300 CG1 ILE B 22 -7.411 -1.652 10.383 1.00 0.00 C ATOM 1301 CG2 ILE B 22 -5.603 -1.211 8.722 1.00 0.00 C ATOM 1302 CD1 ILE B 22 -7.829 -1.463 11.842 1.00 0.00 C ATOM 0 H ILE B 22 -4.817 -1.045 12.523 1.00 0.00 H new ATOM 0 HA ILE B 22 -5.598 -3.339 10.809 1.00 0.00 H new ATOM 0 HB ILE B 22 -5.714 -0.342 10.692 1.00 0.00 H new ATOM 0 HG12 ILE B 22 -8.019 -1.019 9.736 1.00 0.00 H new ATOM 0 HG13 ILE B 22 -7.586 -2.683 10.076 1.00 0.00 H new ATOM 0 HG21 ILE B 22 -6.218 -0.437 8.262 1.00 0.00 H new ATOM 0 HG22 ILE B 22 -4.550 -0.962 8.593 1.00 0.00 H new ATOM 0 HG23 ILE B 22 -5.810 -2.170 8.247 1.00 0.00 H new ATOM 0 HD11 ILE B 22 -8.884 -1.714 11.954 1.00 0.00 H new ATOM 0 HD12 ILE B 22 -7.231 -2.115 12.479 1.00 0.00 H new ATOM 0 HD13 ILE B 22 -7.671 -0.425 12.134 1.00 0.00 H new ATOM 1314 N LEU B 23 -3.436 -3.667 9.628 1.00 0.00 N ATOM 1315 CA LEU B 23 -2.140 -3.878 8.923 1.00 0.00 C ATOM 1316 C LEU B 23 -2.325 -3.646 7.421 1.00 0.00 C ATOM 1317 O LEU B 23 -2.957 -4.428 6.732 1.00 0.00 O ATOM 1318 CB LEU B 23 -1.646 -5.308 9.176 1.00 0.00 C ATOM 1319 CG LEU B 23 -0.277 -5.270 9.866 1.00 0.00 C ATOM 1320 CD1 LEU B 23 -0.363 -4.427 11.141 1.00 0.00 C ATOM 1321 CD2 LEU B 23 0.145 -6.693 10.232 1.00 0.00 C ATOM 0 H LEU B 23 -4.058 -4.475 9.635 1.00 0.00 H new ATOM 0 HA LEU B 23 -1.401 -3.172 9.302 1.00 0.00 H new ATOM 0 HB2 LEU B 23 -2.362 -5.845 9.798 1.00 0.00 H new ATOM 0 HB3 LEU B 23 -1.573 -5.850 8.233 1.00 0.00 H new ATOM 0 HG LEU B 23 0.455 -4.829 9.189 1.00 0.00 H new ATOM 0 HD11 LEU B 23 0.612 -4.403 11.628 1.00 0.00 H new ATOM 0 HD12 LEU B 23 -0.666 -3.412 10.886 1.00 0.00 H new ATOM 0 HD13 LEU B 23 -1.096 -4.865 11.818 1.00 0.00 H new ATOM 0 HD21 LEU B 23 1.118 -6.669 10.723 1.00 0.00 H new ATOM 0 HD22 LEU B 23 -0.591 -7.129 10.907 1.00 0.00 H new ATOM 0 HD23 LEU B 23 0.210 -7.297 9.327 1.00 0.00 H new ATOM 1333 N LEU B 24 -1.771 -2.571 6.914 1.00 0.00 N ATOM 1334 CA LEU B 24 -1.893 -2.261 5.460 1.00 0.00 C ATOM 1335 C LEU B 24 -0.663 -2.802 4.731 1.00 0.00 C ATOM 1336 O LEU B 24 0.462 -2.535 5.110 1.00 0.00 O ATOM 1337 CB LEU B 24 -1.983 -0.743 5.253 1.00 0.00 C ATOM 1338 CG LEU B 24 -3.113 -0.163 6.111 1.00 0.00 C ATOM 1339 CD1 LEU B 24 -3.062 1.365 6.052 1.00 0.00 C ATOM 1340 CD2 LEU B 24 -4.465 -0.645 5.577 1.00 0.00 C ATOM 0 H LEU B 24 -1.235 -1.891 7.453 1.00 0.00 H new ATOM 0 HA LEU B 24 -2.795 -2.727 5.064 1.00 0.00 H new ATOM 0 HB2 LEU B 24 -1.036 -0.275 5.520 1.00 0.00 H new ATOM 0 HB3 LEU B 24 -2.163 -0.521 4.201 1.00 0.00 H new ATOM 0 HG LEU B 24 -2.991 -0.496 7.142 1.00 0.00 H new ATOM 0 HD11 LEU B 24 -3.865 1.780 6.662 1.00 0.00 H new ATOM 0 HD12 LEU B 24 -2.101 1.712 6.432 1.00 0.00 H new ATOM 0 HD13 LEU B 24 -3.183 1.694 5.020 1.00 0.00 H new ATOM 0 HD21 LEU B 24 -5.266 -0.231 6.189 1.00 0.00 H new ATOM 0 HD22 LEU B 24 -4.588 -0.314 4.546 1.00 0.00 H new ATOM 0 HD23 LEU B 24 -4.504 -1.734 5.616 1.00 0.00 H new ATOM 1352 N GLY B 25 -0.877 -3.563 3.690 1.00 0.00 N ATOM 1353 CA GLY B 25 0.263 -4.137 2.920 1.00 0.00 C ATOM 1354 C GLY B 25 -0.239 -4.615 1.559 1.00 0.00 C ATOM 1355 O GLY B 25 -1.108 -5.457 1.478 1.00 0.00 O ATOM 0 H GLY B 25 -1.801 -3.813 3.338 1.00 0.00 H new ATOM 0 HA2 GLY B 25 1.044 -3.387 2.790 1.00 0.00 H new ATOM 0 HA3 GLY B 25 0.707 -4.967 3.469 1.00 0.00 H new ATOM 1359 N ALA B 26 0.298 -4.069 0.494 1.00 0.00 N ATOM 1360 CA ALA B 26 -0.138 -4.468 -0.879 1.00 0.00 C ATOM 1361 C ALA B 26 -0.024 -5.985 -1.051 1.00 0.00 C ATOM 1362 O ALA B 26 1.049 -6.528 -1.252 1.00 0.00 O ATOM 1363 CB ALA B 26 0.735 -3.767 -1.921 1.00 0.00 C ATOM 0 H ALA B 26 1.027 -3.356 0.520 1.00 0.00 H new ATOM 0 HA ALA B 26 -1.178 -4.173 -1.018 1.00 0.00 H new ATOM 0 HB1 ALA B 26 0.415 -4.060 -2.921 1.00 0.00 H new ATOM 0 HB2 ALA B 26 0.637 -2.687 -1.811 1.00 0.00 H new ATOM 0 HB3 ALA B 26 1.776 -4.054 -1.775 1.00 0.00 H new ATOM 1369 N GLY B 27 -1.139 -6.661 -0.976 1.00 0.00 N ATOM 1370 CA GLY B 27 -1.157 -8.144 -1.137 1.00 0.00 C ATOM 1371 C GLY B 27 -1.125 -8.848 0.228 1.00 0.00 C ATOM 1372 O GLY B 27 -0.940 -10.050 0.294 1.00 0.00 O ATOM 0 H GLY B 27 -2.053 -6.241 -0.807 1.00 0.00 H new ATOM 0 HA2 GLY B 27 -2.052 -8.443 -1.683 1.00 0.00 H new ATOM 0 HA3 GLY B 27 -0.300 -8.459 -1.732 1.00 0.00 H new ATOM 1376 N ILE B 28 -1.305 -8.124 1.315 1.00 0.00 N ATOM 1377 CA ILE B 28 -1.289 -8.759 2.657 1.00 0.00 C ATOM 1378 C ILE B 28 -2.432 -9.781 2.747 1.00 0.00 C ATOM 1379 O ILE B 28 -2.258 -10.858 3.280 1.00 0.00 O ATOM 1380 CB ILE B 28 -1.428 -7.659 3.722 1.00 0.00 C ATOM 1381 CG1 ILE B 28 -0.575 -8.023 4.928 1.00 0.00 C ATOM 1382 CG2 ILE B 28 -2.887 -7.497 4.161 1.00 0.00 C ATOM 1383 CD1 ILE B 28 -0.157 -6.746 5.657 1.00 0.00 C ATOM 0 H ILE B 28 -1.462 -7.116 1.318 1.00 0.00 H new ATOM 0 HA ILE B 28 -0.352 -9.289 2.826 1.00 0.00 H new ATOM 0 HB ILE B 28 -1.093 -6.715 3.292 1.00 0.00 H new ATOM 0 HG12 ILE B 28 -1.135 -8.673 5.601 1.00 0.00 H new ATOM 0 HG13 ILE B 28 0.307 -8.579 4.609 1.00 0.00 H new ATOM 0 HG21 ILE B 28 -2.955 -6.712 4.915 1.00 0.00 H new ATOM 0 HG22 ILE B 28 -3.498 -7.227 3.300 1.00 0.00 H new ATOM 0 HG23 ILE B 28 -3.247 -8.436 4.581 1.00 0.00 H new ATOM 0 HD11 ILE B 28 0.454 -7.004 6.522 1.00 0.00 H new ATOM 0 HD12 ILE B 28 0.419 -6.113 4.981 1.00 0.00 H new ATOM 0 HD13 ILE B 28 -1.046 -6.209 5.988 1.00 0.00 H new ATOM 1395 N ALA B 29 -3.589 -9.459 2.202 1.00 0.00 N ATOM 1396 CA ALA B 29 -4.733 -10.423 2.229 1.00 0.00 C ATOM 1397 C ALA B 29 -4.308 -11.706 1.513 1.00 0.00 C ATOM 1398 O ALA B 29 -4.675 -12.797 1.909 1.00 0.00 O ATOM 1399 CB ALA B 29 -5.943 -9.814 1.517 1.00 0.00 C ATOM 0 H ALA B 29 -3.785 -8.570 1.742 1.00 0.00 H new ATOM 0 HA ALA B 29 -5.006 -10.644 3.261 1.00 0.00 H new ATOM 0 HB1 ALA B 29 -6.772 -10.521 1.540 1.00 0.00 H new ATOM 0 HB2 ALA B 29 -6.237 -8.893 2.021 1.00 0.00 H new ATOM 0 HB3 ALA B 29 -5.683 -9.593 0.482 1.00 0.00 H new ATOM 1405 N PHE B 30 -3.511 -11.580 0.474 1.00 0.00 N ATOM 1406 CA PHE B 30 -3.029 -12.782 -0.258 1.00 0.00 C ATOM 1407 C PHE B 30 -1.985 -13.499 0.604 1.00 0.00 C ATOM 1408 O PHE B 30 -1.247 -12.874 1.348 1.00 0.00 O ATOM 1409 CB PHE B 30 -2.394 -12.355 -1.587 1.00 0.00 C ATOM 1410 CG PHE B 30 -2.297 -13.548 -2.511 1.00 0.00 C ATOM 1411 CD1 PHE B 30 -3.414 -13.955 -3.249 1.00 0.00 C ATOM 1412 CD2 PHE B 30 -1.088 -14.245 -2.627 1.00 0.00 C ATOM 1413 CE1 PHE B 30 -3.323 -15.059 -4.104 1.00 0.00 C ATOM 1414 CE2 PHE B 30 -0.997 -15.350 -3.482 1.00 0.00 C ATOM 1415 CZ PHE B 30 -2.115 -15.757 -4.220 1.00 0.00 C ATOM 0 H PHE B 30 -3.177 -10.689 0.106 1.00 0.00 H new ATOM 0 HA PHE B 30 -3.865 -13.452 -0.462 1.00 0.00 H new ATOM 0 HB2 PHE B 30 -2.992 -11.571 -2.051 1.00 0.00 H new ATOM 0 HB3 PHE B 30 -1.403 -11.938 -1.410 1.00 0.00 H new ATOM 0 HD1 PHE B 30 -4.346 -13.417 -3.159 1.00 0.00 H new ATOM 0 HD2 PHE B 30 -0.226 -13.930 -2.057 1.00 0.00 H new ATOM 0 HE1 PHE B 30 -4.185 -15.373 -4.674 1.00 0.00 H new ATOM 0 HE2 PHE B 30 -0.065 -15.888 -3.572 1.00 0.00 H new ATOM 0 HZ PHE B 30 -2.045 -16.610 -4.879 1.00 0.00 H new ATOM 1425 N ASN B 31 -1.926 -14.805 0.503 1.00 0.00 N ATOM 1426 CA ASN B 31 -0.940 -15.608 1.301 1.00 0.00 C ATOM 1427 C ASN B 31 -1.397 -15.740 2.764 1.00 0.00 C ATOM 1428 O ASN B 31 -0.607 -16.043 3.643 1.00 0.00 O ATOM 1429 CB ASN B 31 0.444 -14.943 1.238 1.00 0.00 C ATOM 1430 CG ASN B 31 1.534 -15.987 1.503 1.00 0.00 C ATOM 1431 OD1 ASN B 31 2.120 -16.014 2.567 1.00 0.00 O ATOM 1432 ND2 ASN B 31 1.835 -16.853 0.573 1.00 0.00 N ATOM 0 H ASN B 31 -2.527 -15.359 -0.107 1.00 0.00 H new ATOM 0 HA ASN B 31 -0.880 -16.608 0.872 1.00 0.00 H new ATOM 0 HB2 ASN B 31 0.594 -14.487 0.259 1.00 0.00 H new ATOM 0 HB3 ASN B 31 0.507 -14.143 1.975 1.00 0.00 H new ATOM 0 HD21 ASN B 31 2.561 -17.550 0.741 1.00 0.00 H new ATOM 0 HD22 ASN B 31 1.344 -16.832 -0.321 1.00 0.00 H new ATOM 1439 N LYS B 32 -2.668 -15.535 3.028 1.00 0.00 N ATOM 1440 CA LYS B 32 -3.193 -15.662 4.431 1.00 0.00 C ATOM 1441 C LYS B 32 -4.701 -15.363 4.455 1.00 0.00 C ATOM 1442 O LYS B 32 -5.308 -15.088 3.434 1.00 0.00 O ATOM 1443 CB LYS B 32 -2.459 -14.674 5.357 1.00 0.00 C ATOM 1444 CG LYS B 32 -2.489 -13.273 4.744 1.00 0.00 C ATOM 1445 CD LYS B 32 -2.307 -12.231 5.850 1.00 0.00 C ATOM 1446 CE LYS B 32 -3.663 -11.895 6.475 1.00 0.00 C ATOM 1447 NZ LYS B 32 -4.527 -11.203 5.476 1.00 0.00 N ATOM 0 H LYS B 32 -3.368 -15.284 2.330 1.00 0.00 H new ATOM 0 HA LYS B 32 -3.022 -16.680 4.781 1.00 0.00 H new ATOM 0 HB2 LYS B 32 -2.931 -14.662 6.339 1.00 0.00 H new ATOM 0 HB3 LYS B 32 -1.428 -14.995 5.503 1.00 0.00 H new ATOM 0 HG2 LYS B 32 -1.698 -13.172 4.000 1.00 0.00 H new ATOM 0 HG3 LYS B 32 -3.435 -13.110 4.228 1.00 0.00 H new ATOM 0 HD2 LYS B 32 -1.629 -12.613 6.614 1.00 0.00 H new ATOM 0 HD3 LYS B 32 -1.851 -11.329 5.441 1.00 0.00 H new ATOM 0 HE2 LYS B 32 -4.150 -12.807 6.819 1.00 0.00 H new ATOM 0 HE3 LYS B 32 -3.522 -11.259 7.349 1.00 0.00 H new ATOM 0 HZ1 LYS B 32 -5.272 -10.672 5.970 1.00 0.00 H new ATOM 0 HZ2 LYS B 32 -3.949 -10.546 4.913 1.00 0.00 H new ATOM 0 HZ3 LYS B 32 -4.963 -11.907 4.847 1.00 0.00 H new ATOM 1461 N LYS B 33 -5.309 -15.418 5.620 1.00 0.00 N ATOM 1462 CA LYS B 33 -6.776 -15.143 5.729 1.00 0.00 C ATOM 1463 C LYS B 33 -7.140 -14.787 7.182 1.00 0.00 C ATOM 1464 O LYS B 33 -6.275 -14.616 8.025 1.00 0.00 O ATOM 1465 CB LYS B 33 -7.566 -16.384 5.286 1.00 0.00 C ATOM 1466 CG LYS B 33 -7.143 -17.601 6.118 1.00 0.00 C ATOM 1467 CD LYS B 33 -6.291 -18.539 5.257 1.00 0.00 C ATOM 1468 CE LYS B 33 -5.461 -19.454 6.162 1.00 0.00 C ATOM 1469 NZ LYS B 33 -4.059 -19.518 5.655 1.00 0.00 N ATOM 0 H LYS B 33 -4.848 -15.643 6.502 1.00 0.00 H new ATOM 0 HA LYS B 33 -7.030 -14.302 5.084 1.00 0.00 H new ATOM 0 HB2 LYS B 33 -8.635 -16.206 5.405 1.00 0.00 H new ATOM 0 HB3 LYS B 33 -7.391 -16.578 4.228 1.00 0.00 H new ATOM 0 HG2 LYS B 33 -6.577 -17.278 6.992 1.00 0.00 H new ATOM 0 HG3 LYS B 33 -8.024 -18.127 6.485 1.00 0.00 H new ATOM 0 HD2 LYS B 33 -6.932 -19.136 4.608 1.00 0.00 H new ATOM 0 HD3 LYS B 33 -5.634 -17.958 4.609 1.00 0.00 H new ATOM 0 HE2 LYS B 33 -5.472 -19.078 7.185 1.00 0.00 H new ATOM 0 HE3 LYS B 33 -5.897 -20.453 6.185 1.00 0.00 H new ATOM 0 HZ1 LYS B 33 -3.496 -20.139 6.270 1.00 0.00 H new ATOM 0 HZ2 LYS B 33 -4.057 -19.896 4.686 1.00 0.00 H new ATOM 0 HZ3 LYS B 33 -3.646 -18.564 5.655 1.00 0.00 H new ATOM 1483 N LYS B 34 -8.417 -14.673 7.475 1.00 0.00 N ATOM 1484 CA LYS B 34 -8.856 -14.332 8.861 1.00 0.00 C ATOM 1485 C LYS B 34 -8.472 -15.457 9.818 1.00 0.00 C ATOM 1486 O LYS B 34 -8.619 -16.627 9.514 1.00 0.00 O ATOM 1487 CB LYS B 34 -10.375 -14.128 8.888 1.00 0.00 C ATOM 1488 CG LYS B 34 -10.748 -13.231 10.070 1.00 0.00 C ATOM 1489 CD LYS B 34 -12.243 -13.365 10.366 1.00 0.00 C ATOM 1490 CE LYS B 34 -12.458 -13.475 11.879 1.00 0.00 C ATOM 1491 NZ LYS B 34 -13.729 -12.792 12.254 1.00 0.00 N ATOM 0 H LYS B 34 -9.175 -14.803 6.806 1.00 0.00 H new ATOM 0 HA LYS B 34 -8.364 -13.411 9.174 1.00 0.00 H new ATOM 0 HB2 LYS B 34 -10.708 -13.675 7.954 1.00 0.00 H new ATOM 0 HB3 LYS B 34 -10.880 -15.090 8.974 1.00 0.00 H new ATOM 0 HG2 LYS B 34 -10.167 -13.510 10.949 1.00 0.00 H new ATOM 0 HG3 LYS B 34 -10.504 -12.193 9.843 1.00 0.00 H new ATOM 0 HD2 LYS B 34 -12.781 -12.502 9.974 1.00 0.00 H new ATOM 0 HD3 LYS B 34 -12.646 -14.246 9.866 1.00 0.00 H new ATOM 0 HE2 LYS B 34 -12.495 -14.523 12.176 1.00 0.00 H new ATOM 0 HE3 LYS B 34 -11.620 -13.023 12.410 1.00 0.00 H new ATOM 0 HZ1 LYS B 34 -14.086 -13.189 13.147 1.00 0.00 H new ATOM 0 HZ2 LYS B 34 -13.554 -11.774 12.373 1.00 0.00 H new ATOM 0 HZ3 LYS B 34 -14.435 -12.937 11.504 1.00 0.00 H new ATOM 1505 N ASN B 35 -7.965 -15.082 10.970 1.00 0.00 N ATOM 1506 CA ASN B 35 -7.530 -16.068 12.011 1.00 0.00 C ATOM 1507 C ASN B 35 -6.085 -16.520 11.741 1.00 0.00 C ATOM 1508 O ASN B 35 -5.392 -16.952 12.645 1.00 0.00 O ATOM 1509 CB ASN B 35 -8.464 -17.287 12.036 1.00 0.00 C ATOM 1510 CG ASN B 35 -8.505 -17.872 13.450 1.00 0.00 C ATOM 1511 OD1 ASN B 35 -7.807 -18.820 13.748 1.00 0.00 O ATOM 1512 ND2 ASN B 35 -9.300 -17.342 14.341 1.00 0.00 N ATOM 0 H ASN B 35 -7.832 -14.107 11.238 1.00 0.00 H new ATOM 0 HA ASN B 35 -7.577 -15.579 12.984 1.00 0.00 H new ATOM 0 HB2 ASN B 35 -9.467 -16.996 11.722 1.00 0.00 H new ATOM 0 HB3 ASN B 35 -8.115 -18.040 11.330 1.00 0.00 H new ATOM 0 HD21 ASN B 35 -9.334 -17.724 15.286 1.00 0.00 H new ATOM 0 HD22 ASN B 35 -9.887 -16.546 14.092 1.00 0.00 H new ATOM 1519 N ASP B 36 -5.621 -16.412 10.514 1.00 0.00 N ATOM 1520 CA ASP B 36 -4.223 -16.820 10.192 1.00 0.00 C ATOM 1521 C ASP B 36 -3.268 -15.681 10.570 1.00 0.00 C ATOM 1522 O ASP B 36 -3.693 -14.592 10.911 1.00 0.00 O ATOM 1523 CB ASP B 36 -4.115 -17.104 8.687 1.00 0.00 C ATOM 1524 CG ASP B 36 -2.978 -18.095 8.421 1.00 0.00 C ATOM 1525 OD1 ASP B 36 -3.169 -19.273 8.681 1.00 0.00 O ATOM 1526 OD2 ASP B 36 -1.936 -17.661 7.956 1.00 0.00 O ATOM 0 H ASP B 36 -6.158 -16.057 9.723 1.00 0.00 H new ATOM 0 HA ASP B 36 -3.959 -17.718 10.751 1.00 0.00 H new ATOM 0 HB2 ASP B 36 -5.056 -17.510 8.317 1.00 0.00 H new ATOM 0 HB3 ASP B 36 -3.933 -16.176 8.146 1.00 0.00 H new ATOM 1531 N ILE B 37 -1.983 -15.924 10.509 1.00 0.00 N ATOM 1532 CA ILE B 37 -0.998 -14.858 10.857 1.00 0.00 C ATOM 1533 C ILE B 37 -0.816 -13.930 9.652 1.00 0.00 C ATOM 1534 O ILE B 37 -0.871 -14.358 8.511 1.00 0.00 O ATOM 1535 CB ILE B 37 0.352 -15.487 11.226 1.00 0.00 C ATOM 1536 CG1 ILE B 37 0.138 -16.671 12.183 1.00 0.00 C ATOM 1537 CG2 ILE B 37 1.241 -14.437 11.902 1.00 0.00 C ATOM 1538 CD1 ILE B 37 -0.513 -16.187 13.484 1.00 0.00 C ATOM 0 H ILE B 37 -1.574 -16.817 10.233 1.00 0.00 H new ATOM 0 HA ILE B 37 -1.369 -14.290 11.710 1.00 0.00 H new ATOM 0 HB ILE B 37 0.837 -15.845 10.318 1.00 0.00 H new ATOM 0 HG12 ILE B 37 -0.494 -17.422 11.709 1.00 0.00 H new ATOM 0 HG13 ILE B 37 1.093 -17.149 12.401 1.00 0.00 H new ATOM 0 HG21 ILE B 37 2.199 -14.886 12.163 1.00 0.00 H new ATOM 0 HG22 ILE B 37 1.405 -13.604 11.218 1.00 0.00 H new ATOM 0 HG23 ILE B 37 0.752 -14.074 12.806 1.00 0.00 H new ATOM 0 HD11 ILE B 37 -0.660 -17.034 14.154 1.00 0.00 H new ATOM 0 HD12 ILE B 37 0.134 -15.453 13.963 1.00 0.00 H new ATOM 0 HD13 ILE B 37 -1.477 -15.730 13.260 1.00 0.00 H new ATOM 1550 N VAL B 38 -0.604 -12.664 9.903 1.00 0.00 N ATOM 1551 CA VAL B 38 -0.418 -11.691 8.786 1.00 0.00 C ATOM 1552 C VAL B 38 0.975 -11.859 8.176 1.00 0.00 C ATOM 1553 O VAL B 38 1.967 -11.959 8.879 1.00 0.00 O ATOM 1554 CB VAL B 38 -0.586 -10.250 9.298 1.00 0.00 C ATOM 1555 CG1 VAL B 38 0.550 -9.891 10.260 1.00 0.00 C ATOM 1556 CG2 VAL B 38 -0.550 -9.282 8.113 1.00 0.00 C ATOM 0 H VAL B 38 -0.552 -12.261 10.838 1.00 0.00 H new ATOM 0 HA VAL B 38 -1.173 -11.886 8.025 1.00 0.00 H new ATOM 0 HB VAL B 38 -1.540 -10.174 9.820 1.00 0.00 H new ATOM 0 HG11 VAL B 38 0.418 -8.869 10.614 1.00 0.00 H new ATOM 0 HG12 VAL B 38 0.537 -10.574 11.110 1.00 0.00 H new ATOM 0 HG13 VAL B 38 1.505 -9.975 9.742 1.00 0.00 H new ATOM 0 HG21 VAL B 38 -0.669 -8.260 8.474 1.00 0.00 H new ATOM 0 HG22 VAL B 38 0.405 -9.375 7.596 1.00 0.00 H new ATOM 0 HG23 VAL B 38 -1.360 -9.520 7.424 1.00 0.00 H new ATOM 1566 N ASP B 39 1.051 -11.871 6.869 1.00 0.00 N ATOM 1567 CA ASP B 39 2.370 -12.007 6.191 1.00 0.00 C ATOM 1568 C ASP B 39 3.188 -10.742 6.487 1.00 0.00 C ATOM 1569 O ASP B 39 2.746 -9.647 6.193 1.00 0.00 O ATOM 1570 CB ASP B 39 2.159 -12.151 4.679 1.00 0.00 C ATOM 1571 CG ASP B 39 3.469 -12.581 4.011 1.00 0.00 C ATOM 1572 OD1 ASP B 39 3.696 -13.777 3.911 1.00 0.00 O ATOM 1573 OD2 ASP B 39 4.221 -11.710 3.609 1.00 0.00 O ATOM 0 H ASP B 39 0.250 -11.792 6.242 1.00 0.00 H new ATOM 0 HA ASP B 39 2.897 -12.889 6.554 1.00 0.00 H new ATOM 0 HB2 ASP B 39 1.380 -12.887 4.480 1.00 0.00 H new ATOM 0 HB3 ASP B 39 1.819 -11.205 4.258 1.00 0.00 H new ATOM 1578 N PRO B 40 4.348 -10.928 7.076 1.00 0.00 N ATOM 1579 CA PRO B 40 5.236 -9.809 7.447 1.00 0.00 C ATOM 1580 C PRO B 40 5.874 -9.177 6.206 1.00 0.00 C ATOM 1581 O PRO B 40 6.045 -7.973 6.143 1.00 0.00 O ATOM 1582 CB PRO B 40 6.282 -10.457 8.354 1.00 0.00 C ATOM 1583 CG PRO B 40 6.272 -11.966 8.020 1.00 0.00 C ATOM 1584 CD PRO B 40 4.889 -12.264 7.410 1.00 0.00 C ATOM 0 HA PRO B 40 4.708 -8.994 7.943 1.00 0.00 H new ATOM 0 HB2 PRO B 40 7.268 -10.027 8.179 1.00 0.00 H new ATOM 0 HB3 PRO B 40 6.043 -10.290 9.404 1.00 0.00 H new ATOM 0 HG2 PRO B 40 7.068 -12.214 7.318 1.00 0.00 H new ATOM 0 HG3 PRO B 40 6.439 -12.564 8.916 1.00 0.00 H new ATOM 0 HD2 PRO B 40 4.971 -12.894 6.524 1.00 0.00 H new ATOM 0 HD3 PRO B 40 4.246 -12.789 8.116 1.00 0.00 H new ATOM 1592 N SER B 41 6.204 -9.971 5.212 1.00 0.00 N ATOM 1593 CA SER B 41 6.803 -9.405 3.965 1.00 0.00 C ATOM 1594 C SER B 41 5.800 -8.428 3.338 1.00 0.00 C ATOM 1595 O SER B 41 6.177 -7.474 2.681 1.00 0.00 O ATOM 1596 CB SER B 41 7.109 -10.535 2.979 1.00 0.00 C ATOM 1597 OG SER B 41 8.197 -10.152 2.147 1.00 0.00 O ATOM 0 H SER B 41 6.084 -10.984 5.213 1.00 0.00 H new ATOM 0 HA SER B 41 7.731 -8.884 4.202 1.00 0.00 H new ATOM 0 HB2 SER B 41 7.354 -11.449 3.520 1.00 0.00 H new ATOM 0 HB3 SER B 41 6.230 -10.751 2.371 1.00 0.00 H new ATOM 0 HG SER B 41 8.396 -10.875 1.516 1.00 0.00 H new ATOM 1603 N LYS B 42 4.523 -8.662 3.549 1.00 0.00 N ATOM 1604 CA LYS B 42 3.473 -7.764 2.988 1.00 0.00 C ATOM 1605 C LYS B 42 3.202 -6.598 3.951 1.00 0.00 C ATOM 1606 O LYS B 42 2.790 -5.536 3.526 1.00 0.00 O ATOM 1607 CB LYS B 42 2.182 -8.561 2.774 1.00 0.00 C ATOM 1608 CG LYS B 42 2.430 -9.686 1.765 1.00 0.00 C ATOM 1609 CD LYS B 42 2.276 -9.144 0.341 1.00 0.00 C ATOM 1610 CE LYS B 42 3.471 -9.585 -0.511 1.00 0.00 C ATOM 1611 NZ LYS B 42 4.666 -8.760 -0.167 1.00 0.00 N ATOM 0 H LYS B 42 4.166 -9.447 4.093 1.00 0.00 H new ATOM 0 HA LYS B 42 3.820 -7.363 2.036 1.00 0.00 H new ATOM 0 HB2 LYS B 42 1.840 -8.978 3.721 1.00 0.00 H new ATOM 0 HB3 LYS B 42 1.393 -7.902 2.412 1.00 0.00 H new ATOM 0 HG2 LYS B 42 3.430 -10.097 1.902 1.00 0.00 H new ATOM 0 HG3 LYS B 42 1.725 -10.500 1.933 1.00 0.00 H new ATOM 0 HD2 LYS B 42 1.348 -9.510 -0.099 1.00 0.00 H new ATOM 0 HD3 LYS B 42 2.213 -8.056 0.360 1.00 0.00 H new ATOM 0 HE2 LYS B 42 3.684 -10.640 -0.338 1.00 0.00 H new ATOM 0 HE3 LYS B 42 3.235 -9.477 -1.570 1.00 0.00 H new ATOM 0 HZ1 LYS B 42 5.475 -9.062 -0.747 1.00 0.00 H new ATOM 0 HZ2 LYS B 42 4.461 -7.758 -0.354 1.00 0.00 H new ATOM 0 HZ3 LYS B 42 4.896 -8.885 0.840 1.00 0.00 H new ATOM 1625 N ILE B 43 3.430 -6.785 5.241 1.00 0.00 N ATOM 1626 CA ILE B 43 3.184 -5.678 6.231 1.00 0.00 C ATOM 1627 C ILE B 43 3.896 -4.404 5.763 1.00 0.00 C ATOM 1628 O ILE B 43 5.111 -4.306 5.797 1.00 0.00 O ATOM 1629 CB ILE B 43 3.712 -6.081 7.616 1.00 0.00 C ATOM 1630 CG1 ILE B 43 2.821 -7.179 8.204 1.00 0.00 C ATOM 1631 CG2 ILE B 43 3.689 -4.861 8.546 1.00 0.00 C ATOM 1632 CD1 ILE B 43 3.447 -7.718 9.492 1.00 0.00 C ATOM 0 H ILE B 43 3.775 -7.655 5.646 1.00 0.00 H new ATOM 0 HA ILE B 43 2.112 -5.494 6.299 1.00 0.00 H new ATOM 0 HB ILE B 43 4.733 -6.451 7.520 1.00 0.00 H new ATOM 0 HG12 ILE B 43 1.827 -6.782 8.410 1.00 0.00 H new ATOM 0 HG13 ILE B 43 2.699 -7.987 7.482 1.00 0.00 H new ATOM 0 HG21 ILE B 43 4.063 -5.146 9.529 1.00 0.00 H new ATOM 0 HG22 ILE B 43 4.320 -4.075 8.131 1.00 0.00 H new ATOM 0 HG23 ILE B 43 2.667 -4.494 8.639 1.00 0.00 H new ATOM 0 HD11 ILE B 43 2.810 -8.499 9.907 1.00 0.00 H new ATOM 0 HD12 ILE B 43 4.432 -8.131 9.273 1.00 0.00 H new ATOM 0 HD13 ILE B 43 3.546 -6.908 10.215 1.00 0.00 H new ATOM 1644 N GLU B 44 3.137 -3.433 5.325 1.00 0.00 N ATOM 1645 CA GLU B 44 3.732 -2.152 4.848 1.00 0.00 C ATOM 1646 C GLU B 44 3.536 -1.068 5.914 1.00 0.00 C ATOM 1647 O GLU B 44 4.344 -0.166 6.040 1.00 0.00 O ATOM 1648 CB GLU B 44 3.041 -1.722 3.551 1.00 0.00 C ATOM 1649 CG GLU B 44 3.573 -2.560 2.387 1.00 0.00 C ATOM 1650 CD GLU B 44 3.471 -1.761 1.084 1.00 0.00 C ATOM 1651 OE1 GLU B 44 4.415 -1.053 0.768 1.00 0.00 O ATOM 1652 OE2 GLU B 44 2.452 -1.872 0.421 1.00 0.00 O ATOM 0 H GLU B 44 2.119 -3.475 5.278 1.00 0.00 H new ATOM 0 HA GLU B 44 4.797 -2.292 4.665 1.00 0.00 H new ATOM 0 HB2 GLU B 44 1.962 -1.850 3.642 1.00 0.00 H new ATOM 0 HB3 GLU B 44 3.222 -0.664 3.364 1.00 0.00 H new ATOM 0 HG2 GLU B 44 4.610 -2.840 2.572 1.00 0.00 H new ATOM 0 HG3 GLU B 44 3.003 -3.485 2.303 1.00 0.00 H new ATOM 1659 N LYS B 45 2.471 -1.153 6.679 1.00 0.00 N ATOM 1660 CA LYS B 45 2.222 -0.127 7.740 1.00 0.00 C ATOM 1661 C LYS B 45 1.256 -0.679 8.796 1.00 0.00 C ATOM 1662 O LYS B 45 0.328 -1.405 8.487 1.00 0.00 O ATOM 1663 CB LYS B 45 1.617 1.132 7.105 1.00 0.00 C ATOM 1664 CG LYS B 45 1.926 2.351 7.981 1.00 0.00 C ATOM 1665 CD LYS B 45 3.370 2.803 7.747 1.00 0.00 C ATOM 1666 CE LYS B 45 3.712 3.946 8.708 1.00 0.00 C ATOM 1667 NZ LYS B 45 3.350 5.251 8.084 1.00 0.00 N ATOM 0 H LYS B 45 1.766 -1.887 6.613 1.00 0.00 H new ATOM 0 HA LYS B 45 3.169 0.121 8.219 1.00 0.00 H new ATOM 0 HB2 LYS B 45 2.024 1.278 6.105 1.00 0.00 H new ATOM 0 HB3 LYS B 45 0.539 1.014 6.996 1.00 0.00 H new ATOM 0 HG2 LYS B 45 1.238 3.163 7.746 1.00 0.00 H new ATOM 0 HG3 LYS B 45 1.779 2.102 9.032 1.00 0.00 H new ATOM 0 HD2 LYS B 45 4.053 1.968 7.902 1.00 0.00 H new ATOM 0 HD3 LYS B 45 3.496 3.131 6.715 1.00 0.00 H new ATOM 0 HE2 LYS B 45 3.173 3.819 9.647 1.00 0.00 H new ATOM 0 HE3 LYS B 45 4.776 3.928 8.946 1.00 0.00 H new ATOM 0 HZ1 LYS B 45 3.423 6.007 8.794 1.00 0.00 H new ATOM 0 HZ2 LYS B 45 4.000 5.452 7.297 1.00 0.00 H new ATOM 0 HZ3 LYS B 45 2.375 5.206 7.725 1.00 0.00 H new ATOM 1681 N THR B 46 1.474 -0.329 10.043 1.00 0.00 N ATOM 1682 CA THR B 46 0.582 -0.813 11.139 1.00 0.00 C ATOM 1683 C THR B 46 -0.176 0.380 11.736 1.00 0.00 C ATOM 1684 O THR B 46 0.411 1.263 12.336 1.00 0.00 O ATOM 1685 CB THR B 46 1.426 -1.493 12.228 1.00 0.00 C ATOM 1686 OG1 THR B 46 2.134 -2.589 11.664 1.00 0.00 O ATOM 1687 CG2 THR B 46 0.513 -1.997 13.349 1.00 0.00 C ATOM 0 H THR B 46 2.237 0.275 10.347 1.00 0.00 H new ATOM 0 HA THR B 46 -0.132 -1.534 10.741 1.00 0.00 H new ATOM 0 HB THR B 46 2.135 -0.773 12.637 1.00 0.00 H new ATOM 0 HG1 THR B 46 2.674 -3.022 12.358 1.00 0.00 H new ATOM 0 HG21 THR B 46 1.115 -2.479 14.120 1.00 0.00 H new ATOM 0 HG22 THR B 46 -0.028 -1.156 13.784 1.00 0.00 H new ATOM 0 HG23 THR B 46 -0.199 -2.715 12.943 1.00 0.00 H new ATOM 1695 N PHE B 47 -1.477 0.406 11.568 1.00 0.00 N ATOM 1696 CA PHE B 47 -2.296 1.529 12.113 1.00 0.00 C ATOM 1697 C PHE B 47 -3.024 1.073 13.378 1.00 0.00 C ATOM 1698 O PHE B 47 -3.584 -0.003 13.429 1.00 0.00 O ATOM 1699 CB PHE B 47 -3.330 1.962 11.075 1.00 0.00 C ATOM 1700 CG PHE B 47 -2.731 2.977 10.130 1.00 0.00 C ATOM 1701 CD1 PHE B 47 -1.828 2.574 9.138 1.00 0.00 C ATOM 1702 CD2 PHE B 47 -3.089 4.325 10.241 1.00 0.00 C ATOM 1703 CE1 PHE B 47 -1.283 3.522 8.262 1.00 0.00 C ATOM 1704 CE2 PHE B 47 -2.547 5.270 9.367 1.00 0.00 C ATOM 1705 CZ PHE B 47 -1.643 4.871 8.378 1.00 0.00 C ATOM 0 H PHE B 47 -2.008 -0.310 11.072 1.00 0.00 H new ATOM 0 HA PHE B 47 -1.638 2.365 12.350 1.00 0.00 H new ATOM 0 HB2 PHE B 47 -3.678 1.094 10.515 1.00 0.00 H new ATOM 0 HB3 PHE B 47 -4.200 2.389 11.574 1.00 0.00 H new ATOM 0 HD1 PHE B 47 -1.552 1.534 9.048 1.00 0.00 H new ATOM 0 HD2 PHE B 47 -3.787 4.636 11.005 1.00 0.00 H new ATOM 0 HE1 PHE B 47 -0.586 3.213 7.498 1.00 0.00 H new ATOM 0 HE2 PHE B 47 -2.826 6.310 9.455 1.00 0.00 H new ATOM 0 HZ PHE B 47 -1.222 5.602 7.704 1.00 0.00 H new ATOM 1715 N ILE B 48 -3.015 1.894 14.393 1.00 0.00 N ATOM 1716 CA ILE B 48 -3.700 1.544 15.675 1.00 0.00 C ATOM 1717 C ILE B 48 -4.561 2.731 16.124 1.00 0.00 C ATOM 1718 O ILE B 48 -4.145 3.873 16.040 1.00 0.00 O ATOM 1719 CB ILE B 48 -2.657 1.231 16.756 1.00 0.00 C ATOM 1720 CG1 ILE B 48 -1.327 0.842 16.090 1.00 0.00 C ATOM 1721 CG2 ILE B 48 -3.161 0.079 17.631 1.00 0.00 C ATOM 1722 CD1 ILE B 48 -0.389 0.208 17.115 1.00 0.00 C ATOM 0 H ILE B 48 -2.556 2.805 14.390 1.00 0.00 H new ATOM 0 HA ILE B 48 -4.329 0.667 15.522 1.00 0.00 H new ATOM 0 HB ILE B 48 -2.499 2.112 17.379 1.00 0.00 H new ATOM 0 HG12 ILE B 48 -1.511 0.143 15.274 1.00 0.00 H new ATOM 0 HG13 ILE B 48 -0.858 1.724 15.654 1.00 0.00 H new ATOM 0 HG21 ILE B 48 -2.421 -0.145 18.400 1.00 0.00 H new ATOM 0 HG22 ILE B 48 -4.100 0.365 18.104 1.00 0.00 H new ATOM 0 HG23 ILE B 48 -3.321 -0.805 17.013 1.00 0.00 H new ATOM 0 HD11 ILE B 48 0.549 -0.063 16.631 1.00 0.00 H new ATOM 0 HD12 ILE B 48 -0.191 0.920 17.917 1.00 0.00 H new ATOM 0 HD13 ILE B 48 -0.854 -0.686 17.530 1.00 0.00 H new ATOM 1734 N ARG B 49 -5.759 2.469 16.595 1.00 0.00 N ATOM 1735 CA ARG B 49 -6.655 3.579 17.045 1.00 0.00 C ATOM 1736 C ARG B 49 -6.002 4.334 18.212 1.00 0.00 C ATOM 1737 O ARG B 49 -5.833 3.804 19.297 1.00 0.00 O ATOM 1738 CB ARG B 49 -8.022 3.014 17.470 1.00 0.00 C ATOM 1739 CG ARG B 49 -7.848 1.956 18.566 1.00 0.00 C ATOM 1740 CD ARG B 49 -8.256 0.580 18.029 1.00 0.00 C ATOM 1741 NE ARG B 49 -8.522 -0.365 19.161 1.00 0.00 N ATOM 1742 CZ ARG B 49 -8.113 -0.088 20.374 1.00 0.00 C ATOM 1743 NH1 ARG B 49 -6.837 0.078 20.615 1.00 0.00 N ATOM 1744 NH2 ARG B 49 -8.982 0.023 21.346 1.00 0.00 N ATOM 0 H ARG B 49 -6.153 1.533 16.686 1.00 0.00 H new ATOM 0 HA ARG B 49 -6.808 4.273 16.219 1.00 0.00 H new ATOM 0 HB2 ARG B 49 -8.659 3.821 17.833 1.00 0.00 H new ATOM 0 HB3 ARG B 49 -8.524 2.574 16.608 1.00 0.00 H new ATOM 0 HG2 ARG B 49 -6.811 1.933 18.901 1.00 0.00 H new ATOM 0 HG3 ARG B 49 -8.457 2.213 19.433 1.00 0.00 H new ATOM 0 HD2 ARG B 49 -9.147 0.674 17.409 1.00 0.00 H new ATOM 0 HD3 ARG B 49 -7.466 0.182 17.393 1.00 0.00 H new ATOM 0 HE ARG B 49 -9.027 -1.233 18.985 1.00 0.00 H new ATOM 0 HH11 ARG B 49 -6.159 -0.008 19.857 1.00 0.00 H new ATOM 0 HH12 ARG B 49 -6.520 0.294 21.560 1.00 0.00 H new ATOM 0 HH21 ARG B 49 -9.976 -0.106 21.158 1.00 0.00 H new ATOM 0 HH22 ARG B 49 -8.665 0.239 22.291 1.00 0.00 H new