USER MOD reduce.3.24.130724 H: found=0, std=0, add=879, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 874 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 96 GLN : amide:sc= 0 X(o=-5.3,f=-5.5) USER MOD Set 1.2: A 99 MET CE :methyl 174:sc= -5.27! (180deg=-5.46!) USER MOD Set 2.1: A 74 THR OG1 : rot -100:sc= 1.22 USER MOD Set 2.2: A 92 THR OG1 : rot 180:sc= -0.616! USER MOD Set 3.1: A 61 HIS : no HE2:sc= -5.95! C(o=-6.1!,f=-14!) USER MOD Set 3.2: A 82 THR OG1 : rot 54:sc= -0.166 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 TYR OH : rot 180:sc= -1.26 USER MOD Single : A 18 SER OG : rot 180:sc= -1.08 USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 24 SER OG : rot 180:sc= 0 USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 LYS NZ :NH3+ -113:sc= 0.518 (180deg=0) USER MOD Single : A 31 TYR OH : rot 180:sc= -1.02 USER MOD Single : A 34 GLN : amide:sc= -0.0074 X(o=-0.0074,f=0) USER MOD Single : A 36 SER OG : rot 180:sc= -0.138 USER MOD Single : A 38 THR OG1 : rot 180:sc= 0 USER MOD Single : A 42 THR OG1 : rot 180:sc= 0 USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 ASN : amide:sc= -0.0109 X(o=-0.011,f=-0.013) USER MOD Single : A 49 SER OG : rot -98:sc= 0.343 USER MOD Single : A 51 GLN : amide:sc= -0.0348 K(o=-0.035,f=-1.6!) USER MOD Single : A 58 GLN : amide:sc= -3.92! C(o=-3.9!,f=-3.8!) USER MOD Single : A 60 HIS : no HD1:sc= -1.55 K(o=-1.6,f=-5.6!) USER MOD Single : A 62 CYS SG : rot 120:sc= -0.527 USER MOD Single : A 65 THR OG1 : rot 180:sc= -0.0109 USER MOD Single : A 66 ASN : amide:sc= -3.76! C(o=-3.8!,f=-6.4!) USER MOD Single : A 67 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 72 THR OG1 : rot 37:sc= 0.265 USER MOD Single : A 77 SER OG : rot 140:sc= 0.281 USER MOD Single : A 78 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 83 TYR OH : rot 30:sc= -0.305 USER MOD Single : A 87 GLN : amide:sc= -0.0139 X(o=-0.014,f=0) USER MOD Single : A 90 SER OG : rot -30:sc= 0.317 USER MOD Single : A 93 THR OG1 : rot 180:sc= 0 USER MOD Single : A 94 MET CE :methyl -145:sc= -0.0927 (180deg=-2) USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 102 GLN : amide:sc= -1.43! C(o=-1.4!,f=-4.8!) USER MOD Single : A 105 THR OG1 : rot 72:sc= 0.599 USER MOD Single : A 106 SER OG : rot -150:sc= 0 USER MOD Single : A 107 HIS : no HD1:sc= 0.802 K(o=0.8,f=-5.4!) USER MOD Single : A 110 LYS NZ :NH3+ 141:sc= -0.0543 (180deg=-1.86!) USER MOD Single : A 115 SER OG : rot 180:sc= 0 USER MOD Single : A 118 SER OG : rot 38:sc= 0.754 USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 2.413 -30.970 11.620 1.00 0.00 N ATOM 2 CA GLY A 1 2.237 -30.444 10.277 1.00 0.00 C ATOM 3 C GLY A 1 3.195 -29.281 10.013 1.00 0.00 C ATOM 4 O GLY A 1 4.387 -29.492 9.796 1.00 0.00 O ATOM 0 H1 GLY A 1 1.752 -31.758 11.774 1.00 0.00 H new ATOM 0 H2 GLY A 1 3.389 -31.310 11.734 1.00 0.00 H new ATOM 0 H3 GLY A 1 2.224 -30.219 12.314 1.00 0.00 H new ATOM 0 HA2 GLY A 1 2.410 -31.235 9.547 1.00 0.00 H new ATOM 0 HA3 GLY A 1 1.208 -30.109 10.146 1.00 0.00 H new ATOM 8 N SER A 2 2.638 -28.079 10.040 1.00 0.00 N ATOM 9 CA SER A 2 3.428 -26.883 9.807 1.00 0.00 C ATOM 10 C SER A 2 3.429 -26.003 11.059 1.00 0.00 C ATOM 11 O SER A 2 2.552 -26.132 11.912 1.00 0.00 O ATOM 12 CB SER A 2 2.897 -26.097 8.606 1.00 0.00 C ATOM 13 OG SER A 2 1.624 -25.514 8.871 1.00 0.00 O ATOM 0 H SER A 2 1.649 -27.908 10.220 1.00 0.00 H new ATOM 0 HA SER A 2 4.451 -27.187 9.584 1.00 0.00 H new ATOM 0 HB2 SER A 2 3.607 -25.313 8.343 1.00 0.00 H new ATOM 0 HB3 SER A 2 2.820 -26.760 7.744 1.00 0.00 H new ATOM 0 HG SER A 2 1.320 -25.020 8.081 1.00 0.00 H new ATOM 19 N SER A 3 4.422 -25.129 11.129 1.00 0.00 N ATOM 20 CA SER A 3 4.548 -24.229 12.262 1.00 0.00 C ATOM 21 C SER A 3 4.494 -22.776 11.785 1.00 0.00 C ATOM 22 O SER A 3 5.531 -22.144 11.589 1.00 0.00 O ATOM 23 CB SER A 3 5.846 -24.487 13.030 1.00 0.00 C ATOM 24 OG SER A 3 5.673 -24.341 14.436 1.00 0.00 O ATOM 0 H SER A 3 5.147 -25.025 10.419 1.00 0.00 H new ATOM 0 HA SER A 3 3.714 -24.414 12.939 1.00 0.00 H new ATOM 0 HB2 SER A 3 6.202 -25.494 12.811 1.00 0.00 H new ATOM 0 HB3 SER A 3 6.614 -23.795 12.686 1.00 0.00 H new ATOM 0 HG SER A 3 6.524 -24.516 14.890 1.00 0.00 H new ATOM 30 N GLY A 4 3.274 -22.289 11.612 1.00 0.00 N ATOM 31 CA GLY A 4 3.071 -20.922 11.161 1.00 0.00 C ATOM 32 C GLY A 4 1.830 -20.817 10.272 1.00 0.00 C ATOM 33 O GLY A 4 1.636 -21.632 9.372 1.00 0.00 O ATOM 0 H GLY A 4 2.416 -22.816 11.776 1.00 0.00 H new ATOM 0 HA2 GLY A 4 2.962 -20.263 12.023 1.00 0.00 H new ATOM 0 HA3 GLY A 4 3.948 -20.583 10.609 1.00 0.00 H new ATOM 37 N SER A 5 1.023 -19.806 10.556 1.00 0.00 N ATOM 38 CA SER A 5 -0.194 -19.583 9.793 1.00 0.00 C ATOM 39 C SER A 5 -0.316 -18.103 9.423 1.00 0.00 C ATOM 40 O SER A 5 0.126 -17.234 10.172 1.00 0.00 O ATOM 41 CB SER A 5 -1.427 -20.036 10.578 1.00 0.00 C ATOM 42 OG SER A 5 -1.279 -21.360 11.085 1.00 0.00 O ATOM 0 H SER A 5 1.187 -19.132 11.304 1.00 0.00 H new ATOM 0 HA SER A 5 -0.139 -20.176 8.880 1.00 0.00 H new ATOM 0 HB2 SER A 5 -1.603 -19.348 11.405 1.00 0.00 H new ATOM 0 HB3 SER A 5 -2.305 -19.990 9.933 1.00 0.00 H new ATOM 0 HG SER A 5 -2.086 -21.612 11.581 1.00 0.00 H new ATOM 48 N SER A 6 -0.917 -17.863 8.267 1.00 0.00 N ATOM 49 CA SER A 6 -1.103 -16.504 7.787 1.00 0.00 C ATOM 50 C SER A 6 -2.325 -15.875 8.458 1.00 0.00 C ATOM 51 O SER A 6 -3.435 -15.954 7.934 1.00 0.00 O ATOM 52 CB SER A 6 -1.257 -16.473 6.266 1.00 0.00 C ATOM 53 OG SER A 6 -1.372 -15.143 5.768 1.00 0.00 O ATOM 0 H SER A 6 -1.282 -18.587 7.648 1.00 0.00 H new ATOM 0 HA SER A 6 -0.216 -15.925 8.046 1.00 0.00 H new ATOM 0 HB2 SER A 6 -0.398 -16.960 5.805 1.00 0.00 H new ATOM 0 HB3 SER A 6 -2.139 -17.045 5.979 1.00 0.00 H new ATOM 0 HG SER A 6 -1.467 -15.166 4.793 1.00 0.00 H new ATOM 59 N GLY A 7 -2.080 -15.264 9.608 1.00 0.00 N ATOM 60 CA GLY A 7 -3.148 -14.622 10.356 1.00 0.00 C ATOM 61 C GLY A 7 -3.076 -13.100 10.216 1.00 0.00 C ATOM 62 O GLY A 7 -2.721 -12.586 9.156 1.00 0.00 O ATOM 0 H GLY A 7 -1.158 -15.200 10.040 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -4.114 -14.979 9.997 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -3.077 -14.898 11.408 1.00 0.00 H new ATOM 66 N PRO A 8 -3.427 -12.403 11.330 1.00 0.00 N ATOM 67 CA PRO A 8 -3.406 -10.950 11.342 1.00 0.00 C ATOM 68 C PRO A 8 -1.972 -10.423 11.423 1.00 0.00 C ATOM 69 O PRO A 8 -1.723 -9.248 11.158 1.00 0.00 O ATOM 70 CB PRO A 8 -4.253 -10.554 12.541 1.00 0.00 C ATOM 71 CG PRO A 8 -4.331 -11.790 13.422 1.00 0.00 C ATOM 72 CD PRO A 8 -3.852 -12.978 12.603 1.00 0.00 C ATOM 0 HA PRO A 8 -3.808 -10.516 10.426 1.00 0.00 H new ATOM 0 HB2 PRO A 8 -3.803 -9.719 13.078 1.00 0.00 H new ATOM 0 HB3 PRO A 8 -5.247 -10.234 12.228 1.00 0.00 H new ATOM 0 HG2 PRO A 8 -3.712 -11.665 14.311 1.00 0.00 H new ATOM 0 HG3 PRO A 8 -5.353 -11.950 13.765 1.00 0.00 H new ATOM 0 HD2 PRO A 8 -3.030 -13.495 13.098 1.00 0.00 H new ATOM 0 HD3 PRO A 8 -4.649 -13.708 12.461 1.00 0.00 H new ATOM 80 N GLU A 9 -1.066 -11.318 11.789 1.00 0.00 N ATOM 81 CA GLU A 9 0.336 -10.958 11.908 1.00 0.00 C ATOM 82 C GLU A 9 1.056 -11.180 10.576 1.00 0.00 C ATOM 83 O GLU A 9 2.270 -11.378 10.548 1.00 0.00 O ATOM 84 CB GLU A 9 1.011 -11.745 13.033 1.00 0.00 C ATOM 85 CG GLU A 9 0.661 -13.232 12.948 1.00 0.00 C ATOM 86 CD GLU A 9 1.891 -14.101 13.219 1.00 0.00 C ATOM 87 OE1 GLU A 9 3.006 -13.609 12.940 1.00 0.00 O ATOM 88 OE2 GLU A 9 1.689 -15.238 13.699 1.00 0.00 O ATOM 0 H GLU A 9 -1.276 -12.292 12.007 1.00 0.00 H new ATOM 0 HA GLU A 9 0.399 -9.900 12.161 1.00 0.00 H new ATOM 0 HB2 GLU A 9 2.092 -11.618 12.973 1.00 0.00 H new ATOM 0 HB3 GLU A 9 0.697 -11.348 13.998 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -0.121 -13.467 13.670 1.00 0.00 H new ATOM 0 HG3 GLU A 9 0.261 -13.459 11.960 1.00 0.00 H new ATOM 95 N LYS A 10 0.277 -11.140 9.505 1.00 0.00 N ATOM 96 CA LYS A 10 0.824 -11.334 8.174 1.00 0.00 C ATOM 97 C LYS A 10 -0.050 -10.600 7.155 1.00 0.00 C ATOM 98 O LYS A 10 -0.358 -11.139 6.093 1.00 0.00 O ATOM 99 CB LYS A 10 0.995 -12.825 7.876 1.00 0.00 C ATOM 100 CG LYS A 10 2.304 -13.355 8.463 1.00 0.00 C ATOM 101 CD LYS A 10 2.961 -14.362 7.516 1.00 0.00 C ATOM 102 CE LYS A 10 2.911 -15.776 8.098 1.00 0.00 C ATOM 103 NZ LYS A 10 4.261 -16.212 8.519 1.00 0.00 N ATOM 0 H LYS A 10 -0.729 -10.976 9.533 1.00 0.00 H new ATOM 0 HA LYS A 10 1.823 -10.903 8.107 1.00 0.00 H new ATOM 0 HB2 LYS A 10 0.155 -13.381 8.291 1.00 0.00 H new ATOM 0 HB3 LYS A 10 0.983 -12.988 6.798 1.00 0.00 H new ATOM 0 HG2 LYS A 10 2.986 -12.525 8.648 1.00 0.00 H new ATOM 0 HG3 LYS A 10 2.110 -13.828 9.425 1.00 0.00 H new ATOM 0 HD2 LYS A 10 2.454 -14.344 6.551 1.00 0.00 H new ATOM 0 HD3 LYS A 10 3.997 -14.075 7.337 1.00 0.00 H new ATOM 0 HE2 LYS A 10 2.232 -15.801 8.951 1.00 0.00 H new ATOM 0 HE3 LYS A 10 2.515 -16.468 7.355 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 4.209 -17.174 8.912 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 4.899 -16.208 7.698 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 4.625 -15.562 9.244 1.00 0.00 H new ATOM 117 N LEU A 11 -0.425 -9.381 7.514 1.00 0.00 N ATOM 118 CA LEU A 11 -1.257 -8.567 6.645 1.00 0.00 C ATOM 119 C LEU A 11 -0.526 -7.263 6.320 1.00 0.00 C ATOM 120 O LEU A 11 0.274 -6.780 7.119 1.00 0.00 O ATOM 121 CB LEU A 11 -2.639 -8.358 7.269 1.00 0.00 C ATOM 122 CG LEU A 11 -3.461 -9.624 7.518 1.00 0.00 C ATOM 123 CD1 LEU A 11 -4.754 -9.300 8.267 1.00 0.00 C ATOM 124 CD2 LEU A 11 -3.728 -10.370 6.209 1.00 0.00 C ATOM 0 H LEU A 11 -0.168 -8.937 8.396 1.00 0.00 H new ATOM 0 HA LEU A 11 -1.433 -9.078 5.699 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -2.512 -7.839 8.219 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -3.213 -7.698 6.619 1.00 0.00 H new ATOM 0 HG LEU A 11 -2.879 -10.290 8.155 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -5.319 -10.217 8.431 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -4.514 -8.845 9.228 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -5.352 -8.606 7.677 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -4.314 -11.266 6.414 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -4.280 -9.723 5.528 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -2.780 -10.653 5.752 1.00 0.00 H new ATOM 136 N PRO A 12 -0.835 -6.716 5.114 1.00 0.00 N ATOM 137 CA PRO A 12 -0.216 -5.478 4.673 1.00 0.00 C ATOM 138 C PRO A 12 -0.811 -4.275 5.409 1.00 0.00 C ATOM 139 O PRO A 12 -2.023 -4.199 5.603 1.00 0.00 O ATOM 140 CB PRO A 12 -0.453 -5.432 3.172 1.00 0.00 C ATOM 141 CG PRO A 12 -1.590 -6.404 2.900 1.00 0.00 C ATOM 142 CD PRO A 12 -1.778 -7.260 4.141 1.00 0.00 C ATOM 0 HA PRO A 12 0.850 -5.438 4.896 1.00 0.00 H new ATOM 0 HB2 PRO A 12 -0.715 -4.425 2.849 1.00 0.00 H new ATOM 0 HB3 PRO A 12 0.445 -5.719 2.626 1.00 0.00 H new ATOM 0 HG2 PRO A 12 -2.507 -5.863 2.667 1.00 0.00 H new ATOM 0 HG3 PRO A 12 -1.360 -7.028 2.037 1.00 0.00 H new ATOM 0 HD2 PRO A 12 -2.803 -7.204 4.509 1.00 0.00 H new ATOM 0 HD3 PRO A 12 -1.571 -8.310 3.933 1.00 0.00 H new ATOM 150 N TYR A 13 0.070 -3.366 5.799 1.00 0.00 N ATOM 151 CA TYR A 13 -0.352 -2.171 6.509 1.00 0.00 C ATOM 152 C TYR A 13 0.328 -0.925 5.939 1.00 0.00 C ATOM 153 O TYR A 13 1.267 -1.031 5.152 1.00 0.00 O ATOM 154 CB TYR A 13 0.095 -2.363 7.960 1.00 0.00 C ATOM 155 CG TYR A 13 1.600 -2.582 8.123 1.00 0.00 C ATOM 156 CD1 TYR A 13 2.126 -3.854 8.027 1.00 0.00 C ATOM 157 CD2 TYR A 13 2.432 -1.508 8.367 1.00 0.00 C ATOM 158 CE1 TYR A 13 3.543 -4.061 8.181 1.00 0.00 C ATOM 159 CE2 TYR A 13 3.848 -1.715 8.521 1.00 0.00 C ATOM 160 CZ TYR A 13 4.334 -2.981 8.420 1.00 0.00 C ATOM 161 OH TYR A 13 5.672 -3.177 8.566 1.00 0.00 O ATOM 0 H TYR A 13 1.075 -3.433 5.637 1.00 0.00 H new ATOM 0 HA TYR A 13 -1.429 -2.031 6.418 1.00 0.00 H new ATOM 0 HB2 TYR A 13 -0.199 -1.488 8.539 1.00 0.00 H new ATOM 0 HB3 TYR A 13 -0.434 -3.217 8.382 1.00 0.00 H new ATOM 0 HD1 TYR A 13 1.475 -4.694 7.836 1.00 0.00 H new ATOM 0 HD2 TYR A 13 2.020 -0.512 8.442 1.00 0.00 H new ATOM 0 HE1 TYR A 13 3.968 -5.051 8.108 1.00 0.00 H new ATOM 0 HE2 TYR A 13 4.510 -0.883 8.713 1.00 0.00 H new ATOM 0 HH TYR A 13 6.112 -2.317 8.731 1.00 0.00 H new ATOM 171 N LEU A 14 -0.172 0.228 6.359 1.00 0.00 N ATOM 172 CA LEU A 14 0.375 1.493 5.900 1.00 0.00 C ATOM 173 C LEU A 14 0.884 2.290 7.103 1.00 0.00 C ATOM 174 O LEU A 14 0.092 2.786 7.903 1.00 0.00 O ATOM 175 CB LEU A 14 -0.653 2.246 5.053 1.00 0.00 C ATOM 176 CG LEU A 14 -1.138 1.529 3.792 1.00 0.00 C ATOM 177 CD1 LEU A 14 -2.495 2.071 3.340 1.00 0.00 C ATOM 178 CD2 LEU A 14 -0.090 1.608 2.679 1.00 0.00 C ATOM 0 H LEU A 14 -0.951 0.312 7.013 1.00 0.00 H new ATOM 0 HA LEU A 14 1.230 1.323 5.245 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -1.519 2.465 5.678 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -0.221 3.203 4.760 1.00 0.00 H new ATOM 0 HG LEU A 14 -1.276 0.474 4.031 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -2.816 1.544 2.442 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -3.229 1.920 4.131 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -2.408 3.136 3.124 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -0.460 1.091 1.794 1.00 0.00 H new ATOM 0 HD22 LEU A 14 0.103 2.653 2.435 1.00 0.00 H new ATOM 0 HD23 LEU A 14 0.834 1.137 3.015 1.00 0.00 H new ATOM 190 N VAL A 15 2.202 2.389 7.193 1.00 0.00 N ATOM 191 CA VAL A 15 2.825 3.118 8.284 1.00 0.00 C ATOM 192 C VAL A 15 3.064 4.566 7.854 1.00 0.00 C ATOM 193 O VAL A 15 4.004 4.850 7.113 1.00 0.00 O ATOM 194 CB VAL A 15 4.106 2.406 8.725 1.00 0.00 C ATOM 195 CG1 VAL A 15 5.197 2.531 7.660 1.00 0.00 C ATOM 196 CG2 VAL A 15 4.592 2.938 10.074 1.00 0.00 C ATOM 0 H VAL A 15 2.856 1.976 6.528 1.00 0.00 H new ATOM 0 HA VAL A 15 2.166 3.142 9.152 1.00 0.00 H new ATOM 0 HB VAL A 15 3.876 1.347 8.846 1.00 0.00 H new ATOM 0 HG11 VAL A 15 6.096 2.017 7.998 1.00 0.00 H new ATOM 0 HG12 VAL A 15 4.850 2.082 6.729 1.00 0.00 H new ATOM 0 HG13 VAL A 15 5.423 3.584 7.492 1.00 0.00 H new ATOM 0 HG21 VAL A 15 5.503 2.415 10.364 1.00 0.00 H new ATOM 0 HG22 VAL A 15 4.796 4.006 9.992 1.00 0.00 H new ATOM 0 HG23 VAL A 15 3.823 2.773 10.829 1.00 0.00 H new ATOM 206 N GLU A 16 2.198 5.445 8.338 1.00 0.00 N ATOM 207 CA GLU A 16 2.304 6.857 8.012 1.00 0.00 C ATOM 208 C GLU A 16 3.758 7.319 8.121 1.00 0.00 C ATOM 209 O GLU A 16 4.450 6.984 9.082 1.00 0.00 O ATOM 210 CB GLU A 16 1.393 7.696 8.911 1.00 0.00 C ATOM 211 CG GLU A 16 1.588 9.190 8.646 1.00 0.00 C ATOM 212 CD GLU A 16 1.001 10.029 9.783 1.00 0.00 C ATOM 213 OE1 GLU A 16 -0.246 10.086 9.862 1.00 0.00 O ATOM 214 OE2 GLU A 16 1.812 10.595 10.548 1.00 0.00 O ATOM 0 H GLU A 16 1.420 5.206 8.953 1.00 0.00 H new ATOM 0 HA GLU A 16 1.975 6.999 6.983 1.00 0.00 H new ATOM 0 HB2 GLU A 16 0.352 7.424 8.735 1.00 0.00 H new ATOM 0 HB3 GLU A 16 1.607 7.477 9.957 1.00 0.00 H new ATOM 0 HG2 GLU A 16 2.651 9.408 8.539 1.00 0.00 H new ATOM 0 HG3 GLU A 16 1.110 9.462 7.705 1.00 0.00 H new ATOM 221 N LEU A 17 4.179 8.082 7.123 1.00 0.00 N ATOM 222 CA LEU A 17 5.538 8.594 7.095 1.00 0.00 C ATOM 223 C LEU A 17 5.503 10.124 7.108 1.00 0.00 C ATOM 224 O LEU A 17 4.460 10.727 6.859 1.00 0.00 O ATOM 225 CB LEU A 17 6.307 8.007 5.909 1.00 0.00 C ATOM 226 CG LEU A 17 6.650 6.519 6.003 1.00 0.00 C ATOM 227 CD1 LEU A 17 7.783 6.156 5.042 1.00 0.00 C ATOM 228 CD2 LEU A 17 6.972 6.120 7.445 1.00 0.00 C ATOM 0 H LEU A 17 3.603 8.358 6.328 1.00 0.00 H new ATOM 0 HA LEU A 17 6.082 8.280 7.986 1.00 0.00 H new ATOM 0 HB2 LEU A 17 5.720 8.168 5.005 1.00 0.00 H new ATOM 0 HB3 LEU A 17 7.235 8.567 5.790 1.00 0.00 H new ATOM 0 HG LEU A 17 5.774 5.947 5.699 1.00 0.00 H new ATOM 0 HD11 LEU A 17 8.007 5.093 5.129 1.00 0.00 H new ATOM 0 HD12 LEU A 17 7.479 6.380 4.020 1.00 0.00 H new ATOM 0 HD13 LEU A 17 8.672 6.736 5.292 1.00 0.00 H new ATOM 0 HD21 LEU A 17 7.212 5.058 7.484 1.00 0.00 H new ATOM 0 HD22 LEU A 17 7.825 6.698 7.801 1.00 0.00 H new ATOM 0 HD23 LEU A 17 6.108 6.320 8.079 1.00 0.00 H new ATOM 240 N SER A 18 6.656 10.708 7.401 1.00 0.00 N ATOM 241 CA SER A 18 6.770 12.156 7.450 1.00 0.00 C ATOM 242 C SER A 18 6.349 12.760 6.108 1.00 0.00 C ATOM 243 O SER A 18 6.118 12.034 5.142 1.00 0.00 O ATOM 244 CB SER A 18 8.196 12.584 7.801 1.00 0.00 C ATOM 245 OG SER A 18 8.228 13.466 8.920 1.00 0.00 O ATOM 0 H SER A 18 7.519 10.205 7.607 1.00 0.00 H new ATOM 0 HA SER A 18 6.106 12.525 8.231 1.00 0.00 H new ATOM 0 HB2 SER A 18 8.797 11.701 8.018 1.00 0.00 H new ATOM 0 HB3 SER A 18 8.650 13.074 6.940 1.00 0.00 H new ATOM 0 HG SER A 18 9.156 13.715 9.114 1.00 0.00 H new ATOM 251 N PRO A 19 6.260 14.117 6.091 1.00 0.00 N ATOM 252 CA PRO A 19 5.871 14.826 4.885 1.00 0.00 C ATOM 253 C PRO A 19 7.018 14.854 3.872 1.00 0.00 C ATOM 254 O PRO A 19 6.880 15.422 2.789 1.00 0.00 O ATOM 255 CB PRO A 19 5.462 16.212 5.357 1.00 0.00 C ATOM 256 CG PRO A 19 6.075 16.378 6.738 1.00 0.00 C ATOM 257 CD PRO A 19 6.526 15.008 7.217 1.00 0.00 C ATOM 0 HA PRO A 19 5.049 14.341 4.359 1.00 0.00 H new ATOM 0 HB2 PRO A 19 5.824 16.980 4.674 1.00 0.00 H new ATOM 0 HB3 PRO A 19 4.377 16.307 5.397 1.00 0.00 H new ATOM 0 HG2 PRO A 19 6.920 17.066 6.700 1.00 0.00 H new ATOM 0 HG3 PRO A 19 5.348 16.804 7.430 1.00 0.00 H new ATOM 0 HD2 PRO A 19 7.584 15.009 7.480 1.00 0.00 H new ATOM 0 HD3 PRO A 19 5.976 14.698 8.106 1.00 0.00 H new ATOM 265 N ASP A 20 8.122 14.233 4.259 1.00 0.00 N ATOM 266 CA ASP A 20 9.292 14.180 3.398 1.00 0.00 C ATOM 267 C ASP A 20 9.582 12.724 3.029 1.00 0.00 C ATOM 268 O ASP A 20 10.496 12.446 2.254 1.00 0.00 O ATOM 269 CB ASP A 20 10.525 14.743 4.108 1.00 0.00 C ATOM 270 CG ASP A 20 11.351 15.731 3.283 1.00 0.00 C ATOM 271 OD1 ASP A 20 11.110 15.788 2.058 1.00 0.00 O ATOM 272 OD2 ASP A 20 12.206 16.406 3.896 1.00 0.00 O ATOM 0 H ASP A 20 8.232 13.762 5.157 1.00 0.00 H new ATOM 0 HA ASP A 20 9.084 14.777 2.510 1.00 0.00 H new ATOM 0 HB2 ASP A 20 10.204 15.238 5.025 1.00 0.00 H new ATOM 0 HB3 ASP A 20 11.167 13.913 4.402 1.00 0.00 H new ATOM 277 N GLY A 21 8.787 11.832 3.602 1.00 0.00 N ATOM 278 CA GLY A 21 8.947 10.411 3.343 1.00 0.00 C ATOM 279 C GLY A 21 10.046 9.814 4.225 1.00 0.00 C ATOM 280 O GLY A 21 10.816 8.966 3.775 1.00 0.00 O ATOM 0 H GLY A 21 8.030 12.066 4.245 1.00 0.00 H new ATOM 0 HA2 GLY A 21 8.005 9.895 3.530 1.00 0.00 H new ATOM 0 HA3 GLY A 21 9.193 10.254 2.293 1.00 0.00 H new ATOM 284 N SER A 22 10.083 10.279 5.465 1.00 0.00 N ATOM 285 CA SER A 22 11.075 9.801 6.414 1.00 0.00 C ATOM 286 C SER A 22 10.382 9.259 7.666 1.00 0.00 C ATOM 287 O SER A 22 9.210 9.545 7.905 1.00 0.00 O ATOM 288 CB SER A 22 12.057 10.912 6.790 1.00 0.00 C ATOM 289 OG SER A 22 11.408 12.003 7.436 1.00 0.00 O ATOM 0 H SER A 22 9.442 10.981 5.835 1.00 0.00 H new ATOM 0 HA SER A 22 11.641 8.997 5.943 1.00 0.00 H new ATOM 0 HB2 SER A 22 12.827 10.508 7.447 1.00 0.00 H new ATOM 0 HB3 SER A 22 12.560 11.270 5.892 1.00 0.00 H new ATOM 0 HG SER A 22 12.069 12.690 7.661 1.00 0.00 H new ATOM 295 N ASP A 23 11.137 8.484 8.432 1.00 0.00 N ATOM 296 CA ASP A 23 10.610 7.899 9.653 1.00 0.00 C ATOM 297 C ASP A 23 10.978 8.792 10.841 1.00 0.00 C ATOM 298 O ASP A 23 12.151 8.920 11.185 1.00 0.00 O ATOM 299 CB ASP A 23 11.207 6.513 9.901 1.00 0.00 C ATOM 300 CG ASP A 23 10.463 5.358 9.226 1.00 0.00 C ATOM 301 OD1 ASP A 23 10.233 5.470 8.003 1.00 0.00 O ATOM 302 OD2 ASP A 23 10.142 4.390 9.949 1.00 0.00 O ATOM 0 H ASP A 23 12.109 8.248 8.230 1.00 0.00 H new ATOM 0 HA ASP A 23 9.529 7.812 9.547 1.00 0.00 H new ATOM 0 HB2 ASP A 23 12.240 6.512 9.554 1.00 0.00 H new ATOM 0 HB3 ASP A 23 11.231 6.331 10.975 1.00 0.00 H new ATOM 307 N SER A 24 9.952 9.385 11.433 1.00 0.00 N ATOM 308 CA SER A 24 10.153 10.262 12.575 1.00 0.00 C ATOM 309 C SER A 24 10.758 9.475 13.739 1.00 0.00 C ATOM 310 O SER A 24 10.786 8.245 13.714 1.00 0.00 O ATOM 311 CB SER A 24 8.838 10.917 13.004 1.00 0.00 C ATOM 312 OG SER A 24 8.944 12.336 13.066 1.00 0.00 O ATOM 0 H SER A 24 8.980 9.276 11.144 1.00 0.00 H new ATOM 0 HA SER A 24 10.843 11.053 12.282 1.00 0.00 H new ATOM 0 HB2 SER A 24 8.050 10.643 12.302 1.00 0.00 H new ATOM 0 HB3 SER A 24 8.543 10.532 13.980 1.00 0.00 H new ATOM 0 HG SER A 24 8.084 12.717 13.342 1.00 0.00 H new ATOM 318 N ARG A 25 11.228 10.216 14.731 1.00 0.00 N ATOM 319 CA ARG A 25 11.831 9.603 15.902 1.00 0.00 C ATOM 320 C ARG A 25 10.750 9.198 16.906 1.00 0.00 C ATOM 321 O ARG A 25 10.829 9.544 18.084 1.00 0.00 O ATOM 322 CB ARG A 25 12.814 10.560 16.581 1.00 0.00 C ATOM 323 CG ARG A 25 14.090 10.715 15.750 1.00 0.00 C ATOM 324 CD ARG A 25 14.749 12.072 16.007 1.00 0.00 C ATOM 325 NE ARG A 25 15.086 12.722 14.721 1.00 0.00 N ATOM 326 CZ ARG A 25 14.203 13.377 13.955 1.00 0.00 C ATOM 327 NH1 ARG A 25 12.924 13.474 14.342 1.00 0.00 N ATOM 328 NH2 ARG A 25 14.599 13.936 12.803 1.00 0.00 N ATOM 0 H ARG A 25 11.204 11.236 14.748 1.00 0.00 H new ATOM 0 HA ARG A 25 12.373 8.718 15.570 1.00 0.00 H new ATOM 0 HB2 ARG A 25 12.344 11.534 16.717 1.00 0.00 H new ATOM 0 HB3 ARG A 25 13.065 10.186 17.573 1.00 0.00 H new ATOM 0 HG2 ARG A 25 14.788 9.915 15.996 1.00 0.00 H new ATOM 0 HG3 ARG A 25 13.853 10.616 14.691 1.00 0.00 H new ATOM 0 HD2 ARG A 25 14.076 12.709 16.581 1.00 0.00 H new ATOM 0 HD3 ARG A 25 15.651 11.940 16.605 1.00 0.00 H new ATOM 0 HE ARG A 25 16.052 12.668 14.397 1.00 0.00 H new ATOM 0 HH11 ARG A 25 12.623 13.049 15.219 1.00 0.00 H new ATOM 0 HH12 ARG A 25 12.251 13.972 13.759 1.00 0.00 H new ATOM 0 HH21 ARG A 25 15.573 13.863 12.509 1.00 0.00 H new ATOM 0 HH22 ARG A 25 13.926 14.434 12.220 1.00 0.00 H new ATOM 342 N ASP A 26 9.764 8.469 16.403 1.00 0.00 N ATOM 343 CA ASP A 26 8.668 8.012 17.241 1.00 0.00 C ATOM 344 C ASP A 26 7.941 6.863 16.540 1.00 0.00 C ATOM 345 O ASP A 26 8.401 6.367 15.513 1.00 0.00 O ATOM 346 CB ASP A 26 7.657 9.134 17.484 1.00 0.00 C ATOM 347 CG ASP A 26 7.643 9.695 18.907 1.00 0.00 C ATOM 348 OD1 ASP A 26 7.378 8.895 19.830 1.00 0.00 O ATOM 349 OD2 ASP A 26 7.897 10.912 19.040 1.00 0.00 O ATOM 0 H ASP A 26 9.701 8.184 15.426 1.00 0.00 H new ATOM 0 HA ASP A 26 9.084 7.689 18.195 1.00 0.00 H new ATOM 0 HB2 ASP A 26 7.867 9.948 16.791 1.00 0.00 H new ATOM 0 HB3 ASP A 26 6.660 8.762 17.246 1.00 0.00 H new ATOM 354 N LYS A 27 6.817 6.474 17.123 1.00 0.00 N ATOM 355 CA LYS A 27 6.021 5.392 16.568 1.00 0.00 C ATOM 356 C LYS A 27 4.873 5.980 15.745 1.00 0.00 C ATOM 357 O LYS A 27 3.940 6.559 16.300 1.00 0.00 O ATOM 358 CB LYS A 27 5.561 4.442 17.675 1.00 0.00 C ATOM 359 CG LYS A 27 6.757 3.869 18.438 1.00 0.00 C ATOM 360 CD LYS A 27 6.429 3.695 19.922 1.00 0.00 C ATOM 361 CE LYS A 27 7.651 3.205 20.701 1.00 0.00 C ATOM 362 NZ LYS A 27 7.869 4.040 21.903 1.00 0.00 N ATOM 0 H LYS A 27 6.438 6.889 17.974 1.00 0.00 H new ATOM 0 HA LYS A 27 6.622 4.786 15.890 1.00 0.00 H new ATOM 0 HB2 LYS A 27 4.905 4.973 18.365 1.00 0.00 H new ATOM 0 HB3 LYS A 27 4.978 3.629 17.242 1.00 0.00 H new ATOM 0 HG2 LYS A 27 7.039 2.907 18.009 1.00 0.00 H new ATOM 0 HG3 LYS A 27 7.615 4.532 18.327 1.00 0.00 H new ATOM 0 HD2 LYS A 27 6.086 4.643 20.336 1.00 0.00 H new ATOM 0 HD3 LYS A 27 5.611 2.983 20.036 1.00 0.00 H new ATOM 0 HE2 LYS A 27 7.509 2.165 20.994 1.00 0.00 H new ATOM 0 HE3 LYS A 27 8.534 3.239 20.063 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 8.702 3.694 22.420 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 8.025 5.027 21.616 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 7.033 3.987 22.519 1.00 0.00 H new ATOM 376 N PRO A 28 4.981 5.806 14.401 1.00 0.00 N ATOM 377 CA PRO A 28 3.963 6.312 13.496 1.00 0.00 C ATOM 378 C PRO A 28 2.706 5.442 13.543 1.00 0.00 C ATOM 379 O PRO A 28 2.750 4.306 14.014 1.00 0.00 O ATOM 380 CB PRO A 28 4.625 6.327 12.128 1.00 0.00 C ATOM 381 CG PRO A 28 5.823 5.399 12.234 1.00 0.00 C ATOM 382 CD PRO A 28 6.071 5.125 13.709 1.00 0.00 C ATOM 0 HA PRO A 28 3.617 7.310 13.767 1.00 0.00 H new ATOM 0 HB2 PRO A 28 3.935 5.987 11.356 1.00 0.00 H new ATOM 0 HB3 PRO A 28 4.935 7.336 11.855 1.00 0.00 H new ATOM 0 HG2 PRO A 28 5.633 4.468 11.699 1.00 0.00 H new ATOM 0 HG3 PRO A 28 6.701 5.856 11.778 1.00 0.00 H new ATOM 0 HD2 PRO A 28 6.067 4.055 13.919 1.00 0.00 H new ATOM 0 HD3 PRO A 28 7.041 5.508 14.025 1.00 0.00 H new ATOM 390 N LYS A 29 1.615 6.007 13.047 1.00 0.00 N ATOM 391 CA LYS A 29 0.348 5.296 13.026 1.00 0.00 C ATOM 392 C LYS A 29 0.439 4.129 12.042 1.00 0.00 C ATOM 393 O LYS A 29 1.207 4.180 11.082 1.00 0.00 O ATOM 394 CB LYS A 29 -0.803 6.261 12.732 1.00 0.00 C ATOM 395 CG LYS A 29 -1.848 6.225 13.849 1.00 0.00 C ATOM 396 CD LYS A 29 -2.998 5.280 13.494 1.00 0.00 C ATOM 397 CE LYS A 29 -3.341 4.368 14.673 1.00 0.00 C ATOM 398 NZ LYS A 29 -4.523 3.535 14.357 1.00 0.00 N ATOM 0 H LYS A 29 1.582 6.949 12.657 1.00 0.00 H new ATOM 0 HA LYS A 29 0.134 4.870 14.006 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -0.415 7.274 12.625 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -1.270 5.997 11.783 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -1.380 5.901 14.779 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -2.237 7.229 14.020 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -3.876 5.860 13.211 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -2.723 4.675 12.630 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -2.490 3.728 14.905 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -3.539 4.970 15.560 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -5.318 3.816 14.966 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -4.786 3.670 13.360 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -4.296 2.534 14.523 1.00 0.00 H new ATOM 412 N LEU A 30 -0.356 3.104 12.313 1.00 0.00 N ATOM 413 CA LEU A 30 -0.375 1.926 11.462 1.00 0.00 C ATOM 414 C LEU A 30 -1.823 1.582 11.107 1.00 0.00 C ATOM 415 O LEU A 30 -2.753 2.026 11.779 1.00 0.00 O ATOM 416 CB LEU A 30 0.386 0.775 12.124 1.00 0.00 C ATOM 417 CG LEU A 30 1.336 -0.009 11.217 1.00 0.00 C ATOM 418 CD1 LEU A 30 2.786 0.141 11.682 1.00 0.00 C ATOM 419 CD2 LEU A 30 0.915 -1.477 11.121 1.00 0.00 C ATOM 0 H LEU A 30 -0.992 3.065 13.110 1.00 0.00 H new ATOM 0 HA LEU A 30 0.145 2.124 10.525 1.00 0.00 H new ATOM 0 HB2 LEU A 30 0.961 1.178 12.958 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -0.340 0.079 12.544 1.00 0.00 H new ATOM 0 HG LEU A 30 1.274 0.411 10.213 1.00 0.00 H new ATOM 0 HD11 LEU A 30 3.441 -0.426 11.020 1.00 0.00 H new ATOM 0 HD12 LEU A 30 3.069 1.193 11.658 1.00 0.00 H new ATOM 0 HD13 LEU A 30 2.883 -0.237 12.700 1.00 0.00 H new ATOM 0 HD21 LEU A 30 1.607 -2.012 10.470 1.00 0.00 H new ATOM 0 HD22 LEU A 30 0.930 -1.926 12.114 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -0.092 -1.540 10.710 1.00 0.00 H new ATOM 431 N TYR A 31 -1.968 0.794 10.052 1.00 0.00 N ATOM 432 CA TYR A 31 -3.287 0.385 9.600 1.00 0.00 C ATOM 433 C TYR A 31 -3.216 -0.929 8.819 1.00 0.00 C ATOM 434 O TYR A 31 -2.832 -0.942 7.651 1.00 0.00 O ATOM 435 CB TYR A 31 -3.775 1.493 8.665 1.00 0.00 C ATOM 436 CG TYR A 31 -4.035 2.829 9.365 1.00 0.00 C ATOM 437 CD1 TYR A 31 -4.936 2.897 10.408 1.00 0.00 C ATOM 438 CD2 TYR A 31 -3.367 3.965 8.954 1.00 0.00 C ATOM 439 CE1 TYR A 31 -5.180 4.154 11.067 1.00 0.00 C ATOM 440 CE2 TYR A 31 -3.612 5.221 9.613 1.00 0.00 C ATOM 441 CZ TYR A 31 -4.506 5.254 10.638 1.00 0.00 C ATOM 442 OH TYR A 31 -4.737 6.441 11.260 1.00 0.00 O ATOM 0 H TYR A 31 -1.194 0.428 9.497 1.00 0.00 H new ATOM 0 HA TYR A 31 -3.953 0.231 10.449 1.00 0.00 H new ATOM 0 HB2 TYR A 31 -3.034 1.644 7.880 1.00 0.00 H new ATOM 0 HB3 TYR A 31 -4.693 1.165 8.178 1.00 0.00 H new ATOM 0 HD1 TYR A 31 -5.458 2.008 10.730 1.00 0.00 H new ATOM 0 HD2 TYR A 31 -2.661 3.911 8.138 1.00 0.00 H new ATOM 0 HE1 TYR A 31 -5.883 4.221 11.884 1.00 0.00 H new ATOM 0 HE2 TYR A 31 -3.097 6.118 9.301 1.00 0.00 H new ATOM 0 HH TYR A 31 -4.185 7.139 10.849 1.00 0.00 H new ATOM 452 N ARG A 32 -3.593 -2.004 9.497 1.00 0.00 N ATOM 453 CA ARG A 32 -3.577 -3.320 8.882 1.00 0.00 C ATOM 454 C ARG A 32 -4.667 -3.420 7.813 1.00 0.00 C ATOM 455 O ARG A 32 -5.853 -3.306 8.119 1.00 0.00 O ATOM 456 CB ARG A 32 -3.792 -4.418 9.925 1.00 0.00 C ATOM 457 CG ARG A 32 -2.814 -4.266 11.091 1.00 0.00 C ATOM 458 CD ARG A 32 -2.254 -5.624 11.519 1.00 0.00 C ATOM 459 NE ARG A 32 -2.715 -5.954 12.886 1.00 0.00 N ATOM 460 CZ ARG A 32 -2.096 -6.821 13.699 1.00 0.00 C ATOM 461 NH1 ARG A 32 -0.988 -7.451 13.287 1.00 0.00 N ATOM 462 NH2 ARG A 32 -2.586 -7.058 14.923 1.00 0.00 N ATOM 0 H ARG A 32 -3.911 -1.990 10.466 1.00 0.00 H new ATOM 0 HA ARG A 32 -2.599 -3.459 8.422 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -4.816 -4.376 10.297 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -3.661 -5.396 9.461 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -1.996 -3.607 10.800 1.00 0.00 H new ATOM 0 HG3 ARG A 32 -3.319 -3.795 11.934 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -2.577 -6.396 10.821 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -1.165 -5.603 11.489 1.00 0.00 H new ATOM 0 HE ARG A 32 -3.557 -5.493 13.231 1.00 0.00 H new ATOM 0 HH11 ARG A 32 -0.616 -7.271 12.355 1.00 0.00 H new ATOM 0 HH12 ARG A 32 -0.517 -8.111 13.906 1.00 0.00 H new ATOM 0 HH21 ARG A 32 -3.430 -6.579 15.236 1.00 0.00 H new ATOM 0 HH22 ARG A 32 -2.115 -7.718 15.542 1.00 0.00 H new ATOM 476 N LEU A 33 -4.227 -3.633 6.582 1.00 0.00 N ATOM 477 CA LEU A 33 -5.151 -3.750 5.467 1.00 0.00 C ATOM 478 C LEU A 33 -5.684 -5.183 5.399 1.00 0.00 C ATOM 479 O LEU A 33 -5.213 -5.986 4.596 1.00 0.00 O ATOM 480 CB LEU A 33 -4.489 -3.278 4.170 1.00 0.00 C ATOM 481 CG LEU A 33 -3.663 -1.994 4.268 1.00 0.00 C ATOM 482 CD1 LEU A 33 -3.193 -1.538 2.885 1.00 0.00 C ATOM 483 CD2 LEU A 33 -4.438 -0.898 5.001 1.00 0.00 C ATOM 0 H LEU A 33 -3.243 -3.728 6.332 1.00 0.00 H new ATOM 0 HA LEU A 33 -6.011 -3.097 5.615 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -3.842 -4.076 3.804 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -5.267 -3.130 3.421 1.00 0.00 H new ATOM 0 HG LEU A 33 -2.771 -2.206 4.857 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -2.608 -0.623 2.983 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -2.577 -2.316 2.435 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -4.059 -1.349 2.251 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -3.828 0.004 5.057 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -5.359 -0.680 4.461 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -4.680 -1.235 6.009 1.00 0.00 H new ATOM 495 N GLN A 34 -6.658 -5.458 6.253 1.00 0.00 N ATOM 496 CA GLN A 34 -7.260 -6.780 6.301 1.00 0.00 C ATOM 497 C GLN A 34 -7.758 -7.187 4.912 1.00 0.00 C ATOM 498 O GLN A 34 -7.841 -6.355 4.010 1.00 0.00 O ATOM 499 CB GLN A 34 -8.395 -6.830 7.326 1.00 0.00 C ATOM 500 CG GLN A 34 -7.871 -6.553 8.737 1.00 0.00 C ATOM 501 CD GLN A 34 -8.716 -7.278 9.786 1.00 0.00 C ATOM 502 OE1 GLN A 34 -9.890 -7.006 9.972 1.00 0.00 O ATOM 503 NE2 GLN A 34 -8.054 -8.214 10.461 1.00 0.00 N ATOM 0 H GLN A 34 -7.046 -4.788 6.917 1.00 0.00 H new ATOM 0 HA GLN A 34 -6.498 -7.493 6.617 1.00 0.00 H new ATOM 0 HB2 GLN A 34 -9.157 -6.095 7.066 1.00 0.00 H new ATOM 0 HB3 GLN A 34 -8.873 -7.809 7.297 1.00 0.00 H new ATOM 0 HG2 GLN A 34 -6.833 -6.877 8.814 1.00 0.00 H new ATOM 0 HG3 GLN A 34 -7.886 -5.480 8.931 1.00 0.00 H new ATOM 0 HE21 GLN A 34 -7.071 -8.392 10.255 1.00 0.00 H new ATOM 0 HE22 GLN A 34 -8.530 -8.754 11.184 1.00 0.00 H new ATOM 512 N LEU A 35 -8.075 -8.467 4.784 1.00 0.00 N ATOM 513 CA LEU A 35 -8.562 -8.994 3.520 1.00 0.00 C ATOM 514 C LEU A 35 -10.000 -8.522 3.296 1.00 0.00 C ATOM 515 O LEU A 35 -10.931 -9.042 3.910 1.00 0.00 O ATOM 516 CB LEU A 35 -8.400 -10.515 3.476 1.00 0.00 C ATOM 517 CG LEU A 35 -6.962 -11.037 3.484 1.00 0.00 C ATOM 518 CD1 LEU A 35 -6.484 -11.349 2.065 1.00 0.00 C ATOM 519 CD2 LEU A 35 -6.028 -10.060 4.201 1.00 0.00 C ATOM 0 H LEU A 35 -8.004 -9.154 5.534 1.00 0.00 H new ATOM 0 HA LEU A 35 -7.967 -8.609 2.692 1.00 0.00 H new ATOM 0 HB2 LEU A 35 -8.925 -10.941 4.331 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -8.896 -10.887 2.580 1.00 0.00 H new ATOM 0 HG LEU A 35 -6.942 -11.972 4.044 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -5.459 -11.718 2.099 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -7.129 -12.108 1.623 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -6.523 -10.443 1.460 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -5.012 -10.455 4.192 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -6.047 -9.097 3.690 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -6.358 -9.931 5.232 1.00 0.00 H new ATOM 531 N SER A 36 -10.137 -7.542 2.415 1.00 0.00 N ATOM 532 CA SER A 36 -11.446 -6.994 2.103 1.00 0.00 C ATOM 533 C SER A 36 -11.297 -5.762 1.207 1.00 0.00 C ATOM 534 O SER A 36 -10.535 -5.780 0.242 1.00 0.00 O ATOM 535 CB SER A 36 -12.211 -6.634 3.378 1.00 0.00 C ATOM 536 OG SER A 36 -11.565 -5.599 4.114 1.00 0.00 O ATOM 0 H SER A 36 -9.363 -7.113 1.907 1.00 0.00 H new ATOM 0 HA SER A 36 -12.018 -7.755 1.572 1.00 0.00 H new ATOM 0 HB2 SER A 36 -13.221 -6.317 3.118 1.00 0.00 H new ATOM 0 HB3 SER A 36 -12.307 -7.520 4.006 1.00 0.00 H new ATOM 0 HG SER A 36 -12.085 -5.397 4.920 1.00 0.00 H new ATOM 542 N VAL A 37 -12.037 -4.721 1.559 1.00 0.00 N ATOM 543 CA VAL A 37 -11.997 -3.483 0.800 1.00 0.00 C ATOM 544 C VAL A 37 -11.743 -2.313 1.753 1.00 0.00 C ATOM 545 O VAL A 37 -12.643 -1.893 2.479 1.00 0.00 O ATOM 546 CB VAL A 37 -13.285 -3.325 -0.011 1.00 0.00 C ATOM 547 CG1 VAL A 37 -13.083 -2.354 -1.176 1.00 0.00 C ATOM 548 CG2 VAL A 37 -13.790 -4.681 -0.508 1.00 0.00 C ATOM 0 H VAL A 37 -12.668 -4.710 2.360 1.00 0.00 H new ATOM 0 HA VAL A 37 -11.177 -3.501 0.082 1.00 0.00 H new ATOM 0 HB VAL A 37 -14.046 -2.905 0.647 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -14.013 -2.259 -1.736 1.00 0.00 H new ATOM 0 HG12 VAL A 37 -12.791 -1.377 -0.789 1.00 0.00 H new ATOM 0 HG13 VAL A 37 -12.300 -2.732 -1.833 1.00 0.00 H new ATOM 0 HG21 VAL A 37 -14.706 -4.540 -1.081 1.00 0.00 H new ATOM 0 HG22 VAL A 37 -13.032 -5.141 -1.142 1.00 0.00 H new ATOM 0 HG23 VAL A 37 -13.992 -5.329 0.345 1.00 0.00 H new ATOM 558 N THR A 38 -10.514 -1.820 1.719 1.00 0.00 N ATOM 559 CA THR A 38 -10.131 -0.707 2.571 1.00 0.00 C ATOM 560 C THR A 38 -10.185 0.606 1.788 1.00 0.00 C ATOM 561 O THR A 38 -9.279 0.910 1.014 1.00 0.00 O ATOM 562 CB THR A 38 -8.748 -1.011 3.152 1.00 0.00 C ATOM 563 OG1 THR A 38 -9.015 -1.898 4.235 1.00 0.00 O ATOM 564 CG2 THR A 38 -8.112 0.210 3.819 1.00 0.00 C ATOM 0 H THR A 38 -9.771 -2.171 1.115 1.00 0.00 H new ATOM 0 HA THR A 38 -10.828 -0.584 3.400 1.00 0.00 H new ATOM 0 HB THR A 38 -8.093 -1.374 2.360 1.00 0.00 H new ATOM 0 HG1 THR A 38 -8.172 -2.148 4.668 1.00 0.00 H new ATOM 0 HG21 THR A 38 -7.133 -0.060 4.214 1.00 0.00 H new ATOM 0 HG22 THR A 38 -8.000 1.008 3.085 1.00 0.00 H new ATOM 0 HG23 THR A 38 -8.750 0.553 4.633 1.00 0.00 H new ATOM 572 N GLU A 39 -11.257 1.350 2.017 1.00 0.00 N ATOM 573 CA GLU A 39 -11.442 2.624 1.344 1.00 0.00 C ATOM 574 C GLU A 39 -10.683 3.730 2.081 1.00 0.00 C ATOM 575 O GLU A 39 -10.878 3.929 3.279 1.00 0.00 O ATOM 576 CB GLU A 39 -12.928 2.968 1.219 1.00 0.00 C ATOM 577 CG GLU A 39 -13.604 2.100 0.157 1.00 0.00 C ATOM 578 CD GLU A 39 -14.113 0.789 0.762 1.00 0.00 C ATOM 579 OE1 GLU A 39 -13.904 0.609 1.982 1.00 0.00 O ATOM 580 OE2 GLU A 39 -14.698 -0.002 -0.008 1.00 0.00 O ATOM 0 H GLU A 39 -12.007 1.095 2.660 1.00 0.00 H new ATOM 0 HA GLU A 39 -11.036 2.542 0.336 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -13.421 2.822 2.180 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -13.041 4.021 0.959 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -14.436 2.646 -0.289 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -12.898 1.885 -0.645 1.00 0.00 H new ATOM 587 N VAL A 40 -9.834 4.420 1.334 1.00 0.00 N ATOM 588 CA VAL A 40 -9.045 5.500 1.902 1.00 0.00 C ATOM 589 C VAL A 40 -9.672 6.841 1.516 1.00 0.00 C ATOM 590 O VAL A 40 -10.311 6.954 0.471 1.00 0.00 O ATOM 591 CB VAL A 40 -7.587 5.372 1.456 1.00 0.00 C ATOM 592 CG1 VAL A 40 -6.739 6.514 2.021 1.00 0.00 C ATOM 593 CG2 VAL A 40 -7.009 4.013 1.854 1.00 0.00 C ATOM 0 H VAL A 40 -9.675 4.252 0.340 1.00 0.00 H new ATOM 0 HA VAL A 40 -9.045 5.442 2.990 1.00 0.00 H new ATOM 0 HB VAL A 40 -7.562 5.441 0.368 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -5.707 6.400 1.689 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -7.130 7.468 1.667 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -6.775 6.489 3.110 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -5.972 3.948 1.525 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -7.054 3.902 2.937 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -7.589 3.219 1.384 1.00 0.00 H new ATOM 603 N GLY A 41 -9.469 7.824 2.382 1.00 0.00 N ATOM 604 CA GLY A 41 -10.007 9.152 2.145 1.00 0.00 C ATOM 605 C GLY A 41 -10.487 9.790 3.451 1.00 0.00 C ATOM 606 O GLY A 41 -9.834 9.660 4.485 1.00 0.00 O ATOM 0 H GLY A 41 -8.939 7.727 3.248 1.00 0.00 H new ATOM 0 HA2 GLY A 41 -9.244 9.781 1.688 1.00 0.00 H new ATOM 0 HA3 GLY A 41 -10.836 9.092 1.439 1.00 0.00 H new ATOM 610 N THR A 42 -11.623 10.466 3.359 1.00 0.00 N ATOM 611 CA THR A 42 -12.197 11.124 4.520 1.00 0.00 C ATOM 612 C THR A 42 -13.580 10.546 4.831 1.00 0.00 C ATOM 613 O THR A 42 -14.297 11.068 5.683 1.00 0.00 O ATOM 614 CB THR A 42 -12.215 12.630 4.250 1.00 0.00 C ATOM 615 OG1 THR A 42 -13.008 12.762 3.073 1.00 0.00 O ATOM 616 CG2 THR A 42 -10.843 13.166 3.836 1.00 0.00 C ATOM 0 H THR A 42 -12.161 10.572 2.499 1.00 0.00 H new ATOM 0 HA THR A 42 -11.596 10.946 5.412 1.00 0.00 H new ATOM 0 HB THR A 42 -12.556 13.155 5.142 1.00 0.00 H new ATOM 0 HG1 THR A 42 -13.074 13.708 2.827 1.00 0.00 H new ATOM 0 HG21 THR A 42 -10.911 14.239 3.656 1.00 0.00 H new ATOM 0 HG22 THR A 42 -10.123 12.976 4.632 1.00 0.00 H new ATOM 0 HG23 THR A 42 -10.517 12.665 2.924 1.00 0.00 H new ATOM 624 N GLU A 43 -13.911 9.476 4.123 1.00 0.00 N ATOM 625 CA GLU A 43 -15.195 8.822 4.313 1.00 0.00 C ATOM 626 C GLU A 43 -15.015 7.512 5.083 1.00 0.00 C ATOM 627 O GLU A 43 -13.889 7.087 5.336 1.00 0.00 O ATOM 628 CB GLU A 43 -15.890 8.579 2.972 1.00 0.00 C ATOM 629 CG GLU A 43 -17.131 9.461 2.829 1.00 0.00 C ATOM 630 CD GLU A 43 -18.411 8.637 2.989 1.00 0.00 C ATOM 631 OE1 GLU A 43 -18.853 8.071 1.967 1.00 0.00 O ATOM 632 OE2 GLU A 43 -18.918 8.593 4.131 1.00 0.00 O ATOM 0 H GLU A 43 -13.313 9.046 3.417 1.00 0.00 H new ATOM 0 HA GLU A 43 -15.833 9.481 4.901 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -15.197 8.786 2.157 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -16.174 7.530 2.891 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -17.108 10.252 3.578 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -17.126 9.946 1.853 1.00 0.00 H new ATOM 639 N LYS A 44 -16.141 6.910 5.434 1.00 0.00 N ATOM 640 CA LYS A 44 -16.122 5.657 6.170 1.00 0.00 C ATOM 641 C LYS A 44 -16.946 4.613 5.413 1.00 0.00 C ATOM 642 O LYS A 44 -17.999 4.929 4.863 1.00 0.00 O ATOM 643 CB LYS A 44 -16.582 5.876 7.612 1.00 0.00 C ATOM 644 CG LYS A 44 -16.316 4.635 8.467 1.00 0.00 C ATOM 645 CD LYS A 44 -15.520 4.994 9.723 1.00 0.00 C ATOM 646 CE LYS A 44 -15.882 4.067 10.886 1.00 0.00 C ATOM 647 NZ LYS A 44 -17.028 4.614 11.646 1.00 0.00 N ATOM 0 H LYS A 44 -17.073 7.266 5.223 1.00 0.00 H new ATOM 0 HA LYS A 44 -15.105 5.271 6.239 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -16.061 6.734 8.037 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -17.646 6.111 7.626 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -17.263 4.175 8.751 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -15.766 3.897 7.882 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -14.453 4.922 9.514 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -15.721 6.028 10.002 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -16.130 3.076 10.506 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -15.023 3.949 11.546 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -17.261 3.973 12.431 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -16.778 5.550 12.025 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -17.851 4.704 11.017 1.00 0.00 H new ATOM 661 N PHE A 45 -16.434 3.391 5.410 1.00 0.00 N ATOM 662 CA PHE A 45 -17.110 2.299 4.730 1.00 0.00 C ATOM 663 C PHE A 45 -17.054 1.017 5.563 1.00 0.00 C ATOM 664 O PHE A 45 -18.089 0.491 5.969 1.00 0.00 O ATOM 665 CB PHE A 45 -16.371 2.068 3.410 1.00 0.00 C ATOM 666 CG PHE A 45 -16.563 3.188 2.386 1.00 0.00 C ATOM 667 CD1 PHE A 45 -17.638 3.170 1.552 1.00 0.00 C ATOM 668 CD2 PHE A 45 -15.660 4.202 2.308 1.00 0.00 C ATOM 669 CE1 PHE A 45 -17.817 4.209 0.601 1.00 0.00 C ATOM 670 CE2 PHE A 45 -15.838 5.241 1.357 1.00 0.00 C ATOM 671 CZ PHE A 45 -16.913 5.223 0.524 1.00 0.00 C ATOM 0 H PHE A 45 -15.560 3.133 5.867 1.00 0.00 H new ATOM 0 HA PHE A 45 -18.158 2.552 4.570 1.00 0.00 H new ATOM 0 HB2 PHE A 45 -15.306 1.956 3.616 1.00 0.00 H new ATOM 0 HB3 PHE A 45 -16.712 1.129 2.974 1.00 0.00 H new ATOM 0 HD1 PHE A 45 -18.355 2.365 1.613 1.00 0.00 H new ATOM 0 HD2 PHE A 45 -14.807 4.217 2.970 1.00 0.00 H new ATOM 0 HE1 PHE A 45 -18.670 4.194 -0.061 1.00 0.00 H new ATOM 0 HE2 PHE A 45 -15.120 6.045 1.295 1.00 0.00 H new ATOM 0 HZ PHE A 45 -17.049 6.014 -0.199 1.00 0.00 H new ATOM 681 N ASP A 46 -15.835 0.550 5.792 1.00 0.00 N ATOM 682 CA ASP A 46 -15.631 -0.661 6.569 1.00 0.00 C ATOM 683 C ASP A 46 -15.212 -0.284 7.991 1.00 0.00 C ATOM 684 O ASP A 46 -14.847 0.861 8.252 1.00 0.00 O ATOM 685 CB ASP A 46 -14.523 -1.524 5.962 1.00 0.00 C ATOM 686 CG ASP A 46 -13.276 -0.757 5.516 1.00 0.00 C ATOM 687 OD1 ASP A 46 -13.421 0.075 4.595 1.00 0.00 O ATOM 688 OD2 ASP A 46 -12.207 -1.020 6.107 1.00 0.00 O ATOM 0 H ASP A 46 -14.979 0.989 5.453 1.00 0.00 H new ATOM 0 HA ASP A 46 -16.565 -1.223 6.571 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -14.226 -2.275 6.694 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -14.929 -2.058 5.103 1.00 0.00 H new ATOM 693 N ASP A 47 -15.278 -1.270 8.874 1.00 0.00 N ATOM 694 CA ASP A 47 -14.909 -1.056 10.263 1.00 0.00 C ATOM 695 C ASP A 47 -13.423 -0.703 10.344 1.00 0.00 C ATOM 696 O ASP A 47 -13.032 0.183 11.102 1.00 0.00 O ATOM 697 CB ASP A 47 -15.141 -2.320 11.095 1.00 0.00 C ATOM 698 CG ASP A 47 -15.503 -2.072 12.560 1.00 0.00 C ATOM 699 OD1 ASP A 47 -14.556 -1.946 13.366 1.00 0.00 O ATOM 700 OD2 ASP A 47 -16.720 -2.013 12.842 1.00 0.00 O ATOM 0 H ASP A 47 -15.581 -2.219 8.654 1.00 0.00 H new ATOM 0 HA ASP A 47 -15.526 -0.247 10.655 1.00 0.00 H new ATOM 0 HB2 ASP A 47 -15.940 -2.900 10.632 1.00 0.00 H new ATOM 0 HB3 ASP A 47 -14.240 -2.932 11.058 1.00 0.00 H new ATOM 705 N ASN A 48 -12.635 -1.414 9.552 1.00 0.00 N ATOM 706 CA ASN A 48 -11.200 -1.187 9.524 1.00 0.00 C ATOM 707 C ASN A 48 -10.836 -0.406 8.260 1.00 0.00 C ATOM 708 O ASN A 48 -10.091 -0.899 7.414 1.00 0.00 O ATOM 709 CB ASN A 48 -10.433 -2.511 9.499 1.00 0.00 C ATOM 710 CG ASN A 48 -10.280 -3.083 10.910 1.00 0.00 C ATOM 711 OD1 ASN A 48 -11.237 -3.487 11.550 1.00 0.00 O ATOM 712 ND2 ASN A 48 -9.028 -3.094 11.356 1.00 0.00 N ATOM 0 H ASN A 48 -12.963 -2.148 8.924 1.00 0.00 H new ATOM 0 HA ASN A 48 -10.929 -0.630 10.421 1.00 0.00 H new ATOM 0 HB2 ASN A 48 -10.958 -3.228 8.867 1.00 0.00 H new ATOM 0 HB3 ASN A 48 -9.449 -2.357 9.057 1.00 0.00 H new ATOM 0 HD21 ASN A 48 -8.821 -3.456 12.287 1.00 0.00 H new ATOM 0 HD22 ASN A 48 -8.274 -2.740 10.767 1.00 0.00 H new ATOM 719 N SER A 49 -11.379 0.799 8.170 1.00 0.00 N ATOM 720 CA SER A 49 -11.121 1.653 7.024 1.00 0.00 C ATOM 721 C SER A 49 -10.081 2.716 7.386 1.00 0.00 C ATOM 722 O SER A 49 -9.806 2.944 8.563 1.00 0.00 O ATOM 723 CB SER A 49 -12.408 2.317 6.530 1.00 0.00 C ATOM 724 OG SER A 49 -13.021 3.111 7.542 1.00 0.00 O ATOM 0 H SER A 49 -11.997 1.204 8.873 1.00 0.00 H new ATOM 0 HA SER A 49 -10.731 1.032 6.217 1.00 0.00 H new ATOM 0 HB2 SER A 49 -12.185 2.941 5.665 1.00 0.00 H new ATOM 0 HB3 SER A 49 -13.107 1.550 6.198 1.00 0.00 H new ATOM 0 HG SER A 49 -13.734 2.596 7.975 1.00 0.00 H new ATOM 730 N ILE A 50 -9.532 3.337 6.352 1.00 0.00 N ATOM 731 CA ILE A 50 -8.529 4.370 6.547 1.00 0.00 C ATOM 732 C ILE A 50 -9.178 5.745 6.376 1.00 0.00 C ATOM 733 O ILE A 50 -9.676 6.070 5.299 1.00 0.00 O ATOM 734 CB ILE A 50 -7.332 4.136 5.623 1.00 0.00 C ATOM 735 CG1 ILE A 50 -6.631 2.818 5.956 1.00 0.00 C ATOM 736 CG2 ILE A 50 -6.368 5.324 5.662 1.00 0.00 C ATOM 737 CD1 ILE A 50 -5.508 2.526 4.959 1.00 0.00 C ATOM 0 H ILE A 50 -9.763 3.145 5.377 1.00 0.00 H new ATOM 0 HA ILE A 50 -8.132 4.328 7.561 1.00 0.00 H new ATOM 0 HB ILE A 50 -7.701 4.055 4.601 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -6.223 2.864 6.966 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -7.355 2.003 5.942 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -5.526 5.132 4.997 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -6.888 6.225 5.338 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -6.002 5.462 6.679 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -5.026 1.583 5.219 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -5.923 2.456 3.954 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -4.773 3.330 4.993 1.00 0.00 H new ATOM 749 N GLN A 51 -9.152 6.515 7.454 1.00 0.00 N ATOM 750 CA GLN A 51 -9.732 7.847 7.436 1.00 0.00 C ATOM 751 C GLN A 51 -8.637 8.905 7.580 1.00 0.00 C ATOM 752 O GLN A 51 -8.183 9.187 8.688 1.00 0.00 O ATOM 753 CB GLN A 51 -10.789 7.999 8.532 1.00 0.00 C ATOM 754 CG GLN A 51 -12.015 8.751 8.011 1.00 0.00 C ATOM 755 CD GLN A 51 -13.234 8.495 8.900 1.00 0.00 C ATOM 756 OE1 GLN A 51 -13.178 7.772 9.881 1.00 0.00 O ATOM 757 NE2 GLN A 51 -14.335 9.127 8.503 1.00 0.00 N ATOM 0 H GLN A 51 -8.738 6.242 8.345 1.00 0.00 H new ATOM 0 HA GLN A 51 -10.227 7.994 6.476 1.00 0.00 H new ATOM 0 HB2 GLN A 51 -11.088 7.015 8.893 1.00 0.00 H new ATOM 0 HB3 GLN A 51 -10.363 8.534 9.381 1.00 0.00 H new ATOM 0 HG2 GLN A 51 -11.803 9.820 7.977 1.00 0.00 H new ATOM 0 HG3 GLN A 51 -12.232 8.436 6.990 1.00 0.00 H new ATOM 0 HE21 GLN A 51 -14.312 9.718 7.672 1.00 0.00 H new ATOM 0 HE22 GLN A 51 -15.202 9.021 9.030 1.00 0.00 H new ATOM 766 N LEU A 52 -8.243 9.462 6.444 1.00 0.00 N ATOM 767 CA LEU A 52 -7.209 10.483 6.430 1.00 0.00 C ATOM 768 C LEU A 52 -7.857 11.857 6.246 1.00 0.00 C ATOM 769 O LEU A 52 -8.879 11.980 5.571 1.00 0.00 O ATOM 770 CB LEU A 52 -6.149 10.157 5.376 1.00 0.00 C ATOM 771 CG LEU A 52 -5.549 8.751 5.441 1.00 0.00 C ATOM 772 CD1 LEU A 52 -4.568 8.520 4.290 1.00 0.00 C ATOM 773 CD2 LEU A 52 -4.904 8.492 6.804 1.00 0.00 C ATOM 0 H LEU A 52 -8.621 9.226 5.527 1.00 0.00 H new ATOM 0 HA LEU A 52 -6.682 10.504 7.384 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -6.591 10.297 4.389 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -5.339 10.881 5.468 1.00 0.00 H new ATOM 0 HG LEU A 52 -6.358 8.029 5.325 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -4.156 7.513 4.360 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -5.089 8.634 3.339 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -3.759 9.248 4.350 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -4.485 7.486 6.823 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -4.110 9.219 6.975 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -5.657 8.587 7.587 1.00 0.00 H new ATOM 785 N PHE A 53 -7.238 12.855 6.858 1.00 0.00 N ATOM 786 CA PHE A 53 -7.741 14.215 6.770 1.00 0.00 C ATOM 787 C PHE A 53 -6.631 15.185 6.361 1.00 0.00 C ATOM 788 O PHE A 53 -5.649 15.351 7.084 1.00 0.00 O ATOM 789 CB PHE A 53 -8.248 14.595 8.162 1.00 0.00 C ATOM 790 CG PHE A 53 -9.138 13.534 8.812 1.00 0.00 C ATOM 791 CD1 PHE A 53 -10.286 13.140 8.198 1.00 0.00 C ATOM 792 CD2 PHE A 53 -8.781 12.984 10.003 1.00 0.00 C ATOM 793 CE1 PHE A 53 -11.112 12.155 8.801 1.00 0.00 C ATOM 794 CE2 PHE A 53 -9.607 11.999 10.606 1.00 0.00 C ATOM 795 CZ PHE A 53 -10.755 11.605 9.992 1.00 0.00 C ATOM 0 H PHE A 53 -6.392 12.749 7.417 1.00 0.00 H new ATOM 0 HA PHE A 53 -8.530 14.272 6.020 1.00 0.00 H new ATOM 0 HB2 PHE A 53 -7.392 14.783 8.810 1.00 0.00 H new ATOM 0 HB3 PHE A 53 -8.806 15.529 8.092 1.00 0.00 H new ATOM 0 HD1 PHE A 53 -10.569 13.576 7.252 1.00 0.00 H new ATOM 0 HD2 PHE A 53 -7.869 13.296 10.490 1.00 0.00 H new ATOM 0 HE1 PHE A 53 -12.024 11.843 8.314 1.00 0.00 H new ATOM 0 HE2 PHE A 53 -9.324 11.563 11.552 1.00 0.00 H new ATOM 0 HZ PHE A 53 -11.383 10.855 10.451 1.00 0.00 H new ATOM 805 N GLY A 54 -6.824 15.802 5.205 1.00 0.00 N ATOM 806 CA GLY A 54 -5.851 16.752 4.692 1.00 0.00 C ATOM 807 C GLY A 54 -6.477 17.657 3.628 1.00 0.00 C ATOM 808 O GLY A 54 -7.535 17.343 3.085 1.00 0.00 O ATOM 0 H GLY A 54 -7.640 15.663 4.609 1.00 0.00 H new ATOM 0 HA2 GLY A 54 -5.465 17.360 5.510 1.00 0.00 H new ATOM 0 HA3 GLY A 54 -5.003 16.216 4.265 1.00 0.00 H new ATOM 812 N PRO A 55 -5.778 18.791 3.356 1.00 0.00 N ATOM 813 CA PRO A 55 -6.253 19.744 2.367 1.00 0.00 C ATOM 814 C PRO A 55 -6.025 19.221 0.947 1.00 0.00 C ATOM 815 O PRO A 55 -4.906 19.262 0.439 1.00 0.00 O ATOM 816 CB PRO A 55 -5.491 21.026 2.657 1.00 0.00 C ATOM 817 CG PRO A 55 -4.287 20.615 3.490 1.00 0.00 C ATOM 818 CD PRO A 55 -4.521 19.195 3.979 1.00 0.00 C ATOM 0 HA PRO A 55 -7.328 19.913 2.429 1.00 0.00 H new ATOM 0 HB2 PRO A 55 -5.179 21.513 1.733 1.00 0.00 H new ATOM 0 HB3 PRO A 55 -6.115 21.738 3.197 1.00 0.00 H new ATOM 0 HG2 PRO A 55 -3.375 20.668 2.895 1.00 0.00 H new ATOM 0 HG3 PRO A 55 -4.157 21.293 4.334 1.00 0.00 H new ATOM 0 HD2 PRO A 55 -3.704 18.536 3.686 1.00 0.00 H new ATOM 0 HD3 PRO A 55 -4.588 19.156 5.066 1.00 0.00 H new ATOM 826 N GLY A 56 -7.104 18.741 0.347 1.00 0.00 N ATOM 827 CA GLY A 56 -7.036 18.210 -1.004 1.00 0.00 C ATOM 828 C GLY A 56 -7.339 16.710 -1.020 1.00 0.00 C ATOM 829 O GLY A 56 -6.975 16.010 -1.964 1.00 0.00 O ATOM 0 H GLY A 56 -8.031 18.709 0.772 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -7.748 18.735 -1.641 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -6.044 18.389 -1.419 1.00 0.00 H new ATOM 833 N ILE A 57 -8.001 16.261 0.036 1.00 0.00 N ATOM 834 CA ILE A 57 -8.356 14.858 0.155 1.00 0.00 C ATOM 835 C ILE A 57 -9.841 14.683 -0.169 1.00 0.00 C ATOM 836 O ILE A 57 -10.633 15.606 0.016 1.00 0.00 O ATOM 837 CB ILE A 57 -7.960 14.319 1.532 1.00 0.00 C ATOM 838 CG1 ILE A 57 -6.578 14.831 1.943 1.00 0.00 C ATOM 839 CG2 ILE A 57 -8.040 12.792 1.567 1.00 0.00 C ATOM 840 CD1 ILE A 57 -5.472 14.088 1.190 1.00 0.00 C ATOM 0 H ILE A 57 -8.301 16.845 0.817 1.00 0.00 H new ATOM 0 HA ILE A 57 -7.798 14.262 -0.568 1.00 0.00 H new ATOM 0 HB ILE A 57 -8.674 14.695 2.265 1.00 0.00 H new ATOM 0 HG12 ILE A 57 -6.507 15.900 1.740 1.00 0.00 H new ATOM 0 HG13 ILE A 57 -6.443 14.701 3.017 1.00 0.00 H new ATOM 0 HG21 ILE A 57 -7.754 12.435 2.556 1.00 0.00 H new ATOM 0 HG22 ILE A 57 -9.060 12.476 1.348 1.00 0.00 H new ATOM 0 HG23 ILE A 57 -7.363 12.375 0.821 1.00 0.00 H new ATOM 0 HD11 ILE A 57 -4.500 14.471 1.500 1.00 0.00 H new ATOM 0 HD12 ILE A 57 -5.531 13.023 1.415 1.00 0.00 H new ATOM 0 HD13 ILE A 57 -5.596 14.240 0.118 1.00 0.00 H new ATOM 852 N GLN A 58 -10.174 13.493 -0.646 1.00 0.00 N ATOM 853 CA GLN A 58 -11.550 13.185 -0.998 1.00 0.00 C ATOM 854 C GLN A 58 -12.093 12.076 -0.095 1.00 0.00 C ATOM 855 O GLN A 58 -11.371 11.548 0.750 1.00 0.00 O ATOM 856 CB GLN A 58 -11.665 12.796 -2.473 1.00 0.00 C ATOM 857 CG GLN A 58 -10.418 13.221 -3.251 1.00 0.00 C ATOM 858 CD GLN A 58 -10.198 14.732 -3.152 1.00 0.00 C ATOM 859 OE1 GLN A 58 -11.120 15.508 -2.960 1.00 0.00 O ATOM 860 NE2 GLN A 58 -8.929 15.105 -3.293 1.00 0.00 N ATOM 0 H GLN A 58 -9.514 12.730 -0.797 1.00 0.00 H new ATOM 0 HA GLN A 58 -12.153 14.080 -0.844 1.00 0.00 H new ATOM 0 HB2 GLN A 58 -11.802 11.718 -2.559 1.00 0.00 H new ATOM 0 HB3 GLN A 58 -12.547 13.265 -2.909 1.00 0.00 H new ATOM 0 HG2 GLN A 58 -9.546 12.697 -2.861 1.00 0.00 H new ATOM 0 HG3 GLN A 58 -10.522 12.933 -4.297 1.00 0.00 H new ATOM 0 HE21 GLN A 58 -8.206 14.403 -3.452 1.00 0.00 H new ATOM 0 HE22 GLN A 58 -8.679 16.093 -3.243 1.00 0.00 H new ATOM 869 N PRO A 59 -13.395 11.747 -0.309 1.00 0.00 N ATOM 870 CA PRO A 59 -14.044 10.710 0.476 1.00 0.00 C ATOM 871 C PRO A 59 -13.584 9.320 0.035 1.00 0.00 C ATOM 872 O PRO A 59 -13.009 8.572 0.825 1.00 0.00 O ATOM 873 CB PRO A 59 -15.533 10.936 0.272 1.00 0.00 C ATOM 874 CG PRO A 59 -15.658 11.791 -0.979 1.00 0.00 C ATOM 875 CD PRO A 59 -14.281 12.351 -1.300 1.00 0.00 C ATOM 0 HA PRO A 59 -13.788 10.762 1.534 1.00 0.00 H new ATOM 0 HB2 PRO A 59 -16.059 9.989 0.152 1.00 0.00 H new ATOM 0 HB3 PRO A 59 -15.973 11.438 1.134 1.00 0.00 H new ATOM 0 HG2 PRO A 59 -16.032 11.196 -1.812 1.00 0.00 H new ATOM 0 HG3 PRO A 59 -16.371 12.600 -0.819 1.00 0.00 H new ATOM 0 HD2 PRO A 59 -13.975 12.093 -2.314 1.00 0.00 H new ATOM 0 HD3 PRO A 59 -14.270 13.439 -1.231 1.00 0.00 H new ATOM 883 N HIS A 60 -13.854 9.014 -1.226 1.00 0.00 N ATOM 884 CA HIS A 60 -13.476 7.727 -1.782 1.00 0.00 C ATOM 885 C HIS A 60 -12.168 7.870 -2.563 1.00 0.00 C ATOM 886 O HIS A 60 -12.173 7.879 -3.793 1.00 0.00 O ATOM 887 CB HIS A 60 -14.610 7.145 -2.627 1.00 0.00 C ATOM 888 CG HIS A 60 -14.602 5.637 -2.712 1.00 0.00 C ATOM 889 ND1 HIS A 60 -15.709 4.902 -3.098 1.00 0.00 N ATOM 890 CD2 HIS A 60 -13.611 4.735 -2.457 1.00 0.00 C ATOM 891 CE1 HIS A 60 -15.387 3.617 -3.073 1.00 0.00 C ATOM 892 NE2 HIS A 60 -14.087 3.516 -2.675 1.00 0.00 N ATOM 0 H HIS A 60 -14.331 9.637 -1.878 1.00 0.00 H new ATOM 0 HA HIS A 60 -13.301 7.016 -0.975 1.00 0.00 H new ATOM 0 HB2 HIS A 60 -15.563 7.470 -2.210 1.00 0.00 H new ATOM 0 HB3 HIS A 60 -14.546 7.556 -3.635 1.00 0.00 H new ATOM 0 HD2 HIS A 60 -12.609 4.973 -2.133 1.00 0.00 H new ATOM 0 HE1 HIS A 60 -16.040 2.794 -3.324 1.00 0.00 H new ATOM 0 HE2 HIS A 60 -13.566 2.646 -2.563 1.00 0.00 H new ATOM 900 N HIS A 61 -11.079 7.978 -1.816 1.00 0.00 N ATOM 901 CA HIS A 61 -9.766 8.120 -2.424 1.00 0.00 C ATOM 902 C HIS A 61 -9.439 6.867 -3.238 1.00 0.00 C ATOM 903 O HIS A 61 -9.363 6.922 -4.465 1.00 0.00 O ATOM 904 CB HIS A 61 -8.708 8.431 -1.363 1.00 0.00 C ATOM 905 CG HIS A 61 -7.505 9.173 -1.895 1.00 0.00 C ATOM 906 ND1 HIS A 61 -7.174 10.454 -1.489 1.00 0.00 N ATOM 907 CD2 HIS A 61 -6.558 8.800 -2.804 1.00 0.00 C ATOM 908 CE1 HIS A 61 -6.076 10.825 -2.131 1.00 0.00 C ATOM 909 NE2 HIS A 61 -5.696 9.799 -2.946 1.00 0.00 N ATOM 0 H HIS A 61 -11.078 7.970 -0.796 1.00 0.00 H new ATOM 0 HA HIS A 61 -9.768 8.966 -3.111 1.00 0.00 H new ATOM 0 HB2 HIS A 61 -9.166 9.023 -0.570 1.00 0.00 H new ATOM 0 HB3 HIS A 61 -8.375 7.496 -0.911 1.00 0.00 H new ATOM 0 HD1 HIS A 61 -7.688 11.017 -0.811 1.00 0.00 H new ATOM 0 HD2 HIS A 61 -6.517 7.852 -3.320 1.00 0.00 H new ATOM 0 HE1 HIS A 61 -5.570 11.774 -2.027 1.00 0.00 H new ATOM 917 N CYS A 62 -9.255 5.767 -2.523 1.00 0.00 N ATOM 918 CA CYS A 62 -8.938 4.502 -3.164 1.00 0.00 C ATOM 919 C CYS A 62 -9.393 3.369 -2.243 1.00 0.00 C ATOM 920 O CYS A 62 -9.775 3.610 -1.099 1.00 0.00 O ATOM 921 CB CYS A 62 -7.450 4.398 -3.505 1.00 0.00 C ATOM 922 SG CYS A 62 -6.454 4.417 -1.970 1.00 0.00 S ATOM 0 H CYS A 62 -9.319 5.725 -1.506 1.00 0.00 H new ATOM 0 HA CYS A 62 -9.467 4.430 -4.114 1.00 0.00 H new ATOM 0 HB2 CYS A 62 -7.259 3.480 -4.061 1.00 0.00 H new ATOM 0 HB3 CYS A 62 -7.157 5.227 -4.149 1.00 0.00 H new ATOM 0 HG CYS A 62 -5.768 3.316 -1.884 1.00 0.00 H new ATOM 928 N ASP A 63 -9.337 2.157 -2.776 1.00 0.00 N ATOM 929 CA ASP A 63 -9.739 0.986 -2.016 1.00 0.00 C ATOM 930 C ASP A 63 -8.591 -0.026 -2.002 1.00 0.00 C ATOM 931 O ASP A 63 -8.253 -0.600 -3.036 1.00 0.00 O ATOM 932 CB ASP A 63 -10.957 0.311 -2.647 1.00 0.00 C ATOM 933 CG ASP A 63 -11.751 1.187 -3.619 1.00 0.00 C ATOM 934 OD1 ASP A 63 -11.740 2.419 -3.411 1.00 0.00 O ATOM 935 OD2 ASP A 63 -12.349 0.604 -4.549 1.00 0.00 O ATOM 0 H ASP A 63 -9.019 1.961 -3.725 1.00 0.00 H new ATOM 0 HA ASP A 63 -9.990 1.309 -1.006 1.00 0.00 H new ATOM 0 HB2 ASP A 63 -10.625 -0.583 -3.175 1.00 0.00 H new ATOM 0 HB3 ASP A 63 -11.624 -0.019 -1.851 1.00 0.00 H new ATOM 940 N LEU A 64 -8.025 -0.214 -0.819 1.00 0.00 N ATOM 941 CA LEU A 64 -6.922 -1.147 -0.658 1.00 0.00 C ATOM 942 C LEU A 64 -7.480 -2.555 -0.442 1.00 0.00 C ATOM 943 O LEU A 64 -7.808 -2.931 0.682 1.00 0.00 O ATOM 944 CB LEU A 64 -5.984 -0.680 0.457 1.00 0.00 C ATOM 945 CG LEU A 64 -5.331 0.689 0.254 1.00 0.00 C ATOM 946 CD1 LEU A 64 -5.136 1.407 1.591 1.00 0.00 C ATOM 947 CD2 LEU A 64 -4.021 0.562 -0.525 1.00 0.00 C ATOM 0 H LEU A 64 -8.309 0.263 0.037 1.00 0.00 H new ATOM 0 HA LEU A 64 -6.314 -1.179 -1.562 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -6.545 -0.658 1.391 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -5.195 -1.423 0.576 1.00 0.00 H new ATOM 0 HG LEU A 64 -6.003 1.302 -0.346 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -4.670 2.377 1.418 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -6.104 1.549 2.072 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -4.495 0.806 2.236 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -3.578 1.549 -0.655 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -3.330 -0.076 0.026 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -4.220 0.122 -1.502 1.00 0.00 H new ATOM 959 N THR A 65 -7.569 -3.296 -1.537 1.00 0.00 N ATOM 960 CA THR A 65 -8.081 -4.655 -1.482 1.00 0.00 C ATOM 961 C THR A 65 -6.927 -5.660 -1.492 1.00 0.00 C ATOM 962 O THR A 65 -5.887 -5.411 -2.099 1.00 0.00 O ATOM 963 CB THR A 65 -9.058 -4.840 -2.644 1.00 0.00 C ATOM 964 OG1 THR A 65 -10.198 -4.073 -2.265 1.00 0.00 O ATOM 965 CG2 THR A 65 -9.588 -6.272 -2.742 1.00 0.00 C ATOM 0 H THR A 65 -7.295 -2.981 -2.468 1.00 0.00 H new ATOM 0 HA THR A 65 -8.621 -4.837 -0.553 1.00 0.00 H new ATOM 0 HB THR A 65 -8.565 -4.571 -3.578 1.00 0.00 H new ATOM 0 HG1 THR A 65 -10.882 -4.136 -2.964 1.00 0.00 H new ATOM 0 HG21 THR A 65 -10.277 -6.348 -3.583 1.00 0.00 H new ATOM 0 HG22 THR A 65 -8.755 -6.959 -2.892 1.00 0.00 H new ATOM 0 HG23 THR A 65 -10.110 -6.531 -1.821 1.00 0.00 H new ATOM 973 N ASN A 66 -7.151 -6.775 -0.812 1.00 0.00 N ATOM 974 CA ASN A 66 -6.143 -7.819 -0.735 1.00 0.00 C ATOM 975 C ASN A 66 -6.652 -9.067 -1.459 1.00 0.00 C ATOM 976 O ASN A 66 -7.539 -9.759 -0.961 1.00 0.00 O ATOM 977 CB ASN A 66 -5.854 -8.200 0.718 1.00 0.00 C ATOM 978 CG ASN A 66 -4.636 -9.121 0.812 1.00 0.00 C ATOM 979 OD1 ASN A 66 -4.211 -9.731 -0.155 1.00 0.00 O ATOM 980 ND2 ASN A 66 -4.100 -9.187 2.028 1.00 0.00 N ATOM 0 H ASN A 66 -8.015 -6.978 -0.310 1.00 0.00 H new ATOM 0 HA ASN A 66 -5.231 -7.442 -1.197 1.00 0.00 H new ATOM 0 HB2 ASN A 66 -5.679 -7.299 1.306 1.00 0.00 H new ATOM 0 HB3 ASN A 66 -6.724 -8.697 1.147 1.00 0.00 H new ATOM 0 HD21 ASN A 66 -3.283 -9.775 2.194 1.00 0.00 H new ATOM 0 HD22 ASN A 66 -4.506 -8.650 2.794 1.00 0.00 H new ATOM 987 N MET A 67 -6.068 -9.318 -2.621 1.00 0.00 N ATOM 988 CA MET A 67 -6.452 -10.470 -3.418 1.00 0.00 C ATOM 989 C MET A 67 -5.272 -11.428 -3.601 1.00 0.00 C ATOM 990 O MET A 67 -4.421 -11.213 -4.463 1.00 0.00 O ATOM 991 CB MET A 67 -6.946 -10.003 -4.789 1.00 0.00 C ATOM 992 CG MET A 67 -8.449 -10.244 -4.941 1.00 0.00 C ATOM 993 SD MET A 67 -8.778 -11.996 -5.046 1.00 0.00 S ATOM 994 CE MET A 67 -10.043 -12.149 -3.795 1.00 0.00 C ATOM 0 H MET A 67 -5.331 -8.743 -3.030 1.00 0.00 H new ATOM 0 HA MET A 67 -7.249 -10.999 -2.896 1.00 0.00 H new ATOM 0 HB2 MET A 67 -6.729 -8.942 -4.916 1.00 0.00 H new ATOM 0 HB3 MET A 67 -6.408 -10.534 -5.574 1.00 0.00 H new ATOM 0 HG2 MET A 67 -8.982 -9.816 -4.092 1.00 0.00 H new ATOM 0 HG3 MET A 67 -8.818 -9.742 -5.835 1.00 0.00 H new ATOM 0 HE1 MET A 67 -10.365 -13.188 -3.728 1.00 0.00 H new ATOM 0 HE2 MET A 67 -9.643 -11.830 -2.832 1.00 0.00 H new ATOM 0 HE3 MET A 67 -10.894 -11.522 -4.060 1.00 0.00 H new ATOM 1004 N ASP A 68 -5.259 -12.464 -2.775 1.00 0.00 N ATOM 1005 CA ASP A 68 -4.197 -13.454 -2.834 1.00 0.00 C ATOM 1006 C ASP A 68 -2.874 -12.803 -2.428 1.00 0.00 C ATOM 1007 O ASP A 68 -2.030 -12.521 -3.277 1.00 0.00 O ATOM 1008 CB ASP A 68 -4.037 -14.006 -4.252 1.00 0.00 C ATOM 1009 CG ASP A 68 -4.572 -15.424 -4.458 1.00 0.00 C ATOM 1010 OD1 ASP A 68 -5.670 -15.700 -3.928 1.00 0.00 O ATOM 1011 OD2 ASP A 68 -3.872 -16.201 -5.143 1.00 0.00 O ATOM 0 H ASP A 68 -5.967 -12.639 -2.062 1.00 0.00 H new ATOM 0 HA ASP A 68 -4.457 -14.268 -2.157 1.00 0.00 H new ATOM 0 HB2 ASP A 68 -4.547 -13.337 -4.946 1.00 0.00 H new ATOM 0 HB3 ASP A 68 -2.979 -13.991 -4.514 1.00 0.00 H new ATOM 1016 N GLY A 69 -2.734 -12.583 -1.129 1.00 0.00 N ATOM 1017 CA GLY A 69 -1.527 -11.970 -0.600 1.00 0.00 C ATOM 1018 C GLY A 69 -1.004 -10.885 -1.543 1.00 0.00 C ATOM 1019 O GLY A 69 0.201 -10.648 -1.616 1.00 0.00 O ATOM 0 H GLY A 69 -3.436 -12.818 -0.427 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -1.734 -11.537 0.379 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -0.761 -12.732 -0.456 1.00 0.00 H new ATOM 1023 N VAL A 70 -1.937 -10.254 -2.242 1.00 0.00 N ATOM 1024 CA VAL A 70 -1.585 -9.199 -3.178 1.00 0.00 C ATOM 1025 C VAL A 70 -2.559 -8.031 -3.013 1.00 0.00 C ATOM 1026 O VAL A 70 -3.773 -8.229 -2.992 1.00 0.00 O ATOM 1027 CB VAL A 70 -1.553 -9.754 -4.604 1.00 0.00 C ATOM 1028 CG1 VAL A 70 -1.461 -8.624 -5.630 1.00 0.00 C ATOM 1029 CG2 VAL A 70 -0.403 -10.748 -4.779 1.00 0.00 C ATOM 0 H VAL A 70 -2.935 -10.453 -2.179 1.00 0.00 H new ATOM 0 HA VAL A 70 -0.585 -8.820 -2.968 1.00 0.00 H new ATOM 0 HB VAL A 70 -2.487 -10.288 -4.777 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -1.440 -9.046 -6.635 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -2.327 -7.970 -5.529 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -0.551 -8.050 -5.458 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -0.402 -11.128 -5.801 1.00 0.00 H new ATOM 0 HG22 VAL A 70 0.544 -10.248 -4.577 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -0.530 -11.578 -4.084 1.00 0.00 H new ATOM 1039 N VAL A 71 -1.991 -6.840 -2.901 1.00 0.00 N ATOM 1040 CA VAL A 71 -2.795 -5.640 -2.739 1.00 0.00 C ATOM 1041 C VAL A 71 -2.504 -4.677 -3.892 1.00 0.00 C ATOM 1042 O VAL A 71 -1.353 -4.513 -4.294 1.00 0.00 O ATOM 1043 CB VAL A 71 -2.538 -5.020 -1.364 1.00 0.00 C ATOM 1044 CG1 VAL A 71 -2.947 -3.546 -1.342 1.00 0.00 C ATOM 1045 CG2 VAL A 71 -3.258 -5.806 -0.266 1.00 0.00 C ATOM 0 H VAL A 71 -0.984 -6.680 -2.919 1.00 0.00 H new ATOM 0 HA VAL A 71 -3.857 -5.883 -2.778 1.00 0.00 H new ATOM 0 HB VAL A 71 -1.467 -5.073 -1.167 1.00 0.00 H new ATOM 0 HG11 VAL A 71 -2.754 -3.130 -0.353 1.00 0.00 H new ATOM 0 HG12 VAL A 71 -2.370 -2.997 -2.086 1.00 0.00 H new ATOM 0 HG13 VAL A 71 -4.009 -3.460 -1.571 1.00 0.00 H new ATOM 0 HG21 VAL A 71 -3.059 -5.345 0.701 1.00 0.00 H new ATOM 0 HG22 VAL A 71 -4.331 -5.799 -0.458 1.00 0.00 H new ATOM 0 HG23 VAL A 71 -2.897 -6.835 -0.259 1.00 0.00 H new ATOM 1055 N THR A 72 -3.568 -4.065 -4.392 1.00 0.00 N ATOM 1056 CA THR A 72 -3.441 -3.123 -5.491 1.00 0.00 C ATOM 1057 C THR A 72 -4.248 -1.856 -5.203 1.00 0.00 C ATOM 1058 O THR A 72 -5.462 -1.919 -5.012 1.00 0.00 O ATOM 1059 CB THR A 72 -3.868 -3.836 -6.776 1.00 0.00 C ATOM 1060 OG1 THR A 72 -5.112 -4.443 -6.440 1.00 0.00 O ATOM 1061 CG2 THR A 72 -2.958 -5.017 -7.121 1.00 0.00 C ATOM 0 H THR A 72 -4.521 -4.203 -4.056 1.00 0.00 H new ATOM 0 HA THR A 72 -2.409 -2.793 -5.612 1.00 0.00 H new ATOM 0 HB THR A 72 -3.868 -3.125 -7.602 1.00 0.00 H new ATOM 0 HG1 THR A 72 -5.616 -3.848 -5.846 1.00 0.00 H new ATOM 0 HG21 THR A 72 -3.305 -5.487 -8.041 1.00 0.00 H new ATOM 0 HG22 THR A 72 -1.937 -4.661 -7.258 1.00 0.00 H new ATOM 0 HG23 THR A 72 -2.983 -5.745 -6.310 1.00 0.00 H new ATOM 1069 N VAL A 73 -3.542 -0.735 -5.180 1.00 0.00 N ATOM 1070 CA VAL A 73 -4.178 0.545 -4.918 1.00 0.00 C ATOM 1071 C VAL A 73 -5.116 0.890 -6.076 1.00 0.00 C ATOM 1072 O VAL A 73 -4.691 0.948 -7.229 1.00 0.00 O ATOM 1073 CB VAL A 73 -3.114 1.617 -4.672 1.00 0.00 C ATOM 1074 CG1 VAL A 73 -2.085 1.638 -5.804 1.00 0.00 C ATOM 1075 CG2 VAL A 73 -3.755 2.993 -4.488 1.00 0.00 C ATOM 0 H VAL A 73 -2.536 -0.687 -5.339 1.00 0.00 H new ATOM 0 HA VAL A 73 -4.784 0.492 -4.013 1.00 0.00 H new ATOM 0 HB VAL A 73 -2.591 1.365 -3.749 1.00 0.00 H new ATOM 0 HG11 VAL A 73 -1.340 2.409 -5.605 1.00 0.00 H new ATOM 0 HG12 VAL A 73 -1.594 0.667 -5.868 1.00 0.00 H new ATOM 0 HG13 VAL A 73 -2.586 1.854 -6.748 1.00 0.00 H new ATOM 0 HG21 VAL A 73 -2.977 3.737 -4.315 1.00 0.00 H new ATOM 0 HG22 VAL A 73 -4.315 3.256 -5.385 1.00 0.00 H new ATOM 0 HG23 VAL A 73 -4.430 2.968 -3.633 1.00 0.00 H new ATOM 1085 N THR A 74 -6.376 1.108 -5.729 1.00 0.00 N ATOM 1086 CA THR A 74 -7.379 1.446 -6.726 1.00 0.00 C ATOM 1087 C THR A 74 -8.023 2.794 -6.398 1.00 0.00 C ATOM 1088 O THR A 74 -8.844 2.889 -5.487 1.00 0.00 O ATOM 1089 CB THR A 74 -8.383 0.293 -6.795 1.00 0.00 C ATOM 1090 OG1 THR A 74 -7.574 -0.859 -7.016 1.00 0.00 O ATOM 1091 CG2 THR A 74 -9.274 0.367 -8.036 1.00 0.00 C ATOM 0 H THR A 74 -6.726 1.057 -4.772 1.00 0.00 H new ATOM 0 HA THR A 74 -6.932 1.567 -7.713 1.00 0.00 H new ATOM 0 HB THR A 74 -9.006 0.299 -5.900 1.00 0.00 H new ATOM 0 HG1 THR A 74 -7.600 -1.099 -7.966 1.00 0.00 H new ATOM 0 HG21 THR A 74 -9.968 -0.474 -8.036 1.00 0.00 H new ATOM 0 HG22 THR A 74 -9.836 1.301 -8.025 1.00 0.00 H new ATOM 0 HG23 THR A 74 -8.654 0.326 -8.932 1.00 0.00 H new ATOM 1099 N PRO A 75 -7.616 3.830 -7.180 1.00 0.00 N ATOM 1100 CA PRO A 75 -8.145 5.169 -6.982 1.00 0.00 C ATOM 1101 C PRO A 75 -9.573 5.280 -7.519 1.00 0.00 C ATOM 1102 O PRO A 75 -9.801 5.140 -8.720 1.00 0.00 O ATOM 1103 CB PRO A 75 -7.168 6.087 -7.699 1.00 0.00 C ATOM 1104 CG PRO A 75 -6.391 5.201 -8.658 1.00 0.00 C ATOM 1105 CD PRO A 75 -6.646 3.755 -8.268 1.00 0.00 C ATOM 0 HA PRO A 75 -8.225 5.438 -5.929 1.00 0.00 H new ATOM 0 HB2 PRO A 75 -7.695 6.876 -8.236 1.00 0.00 H new ATOM 0 HB3 PRO A 75 -6.500 6.576 -6.990 1.00 0.00 H new ATOM 0 HG2 PRO A 75 -6.708 5.381 -9.685 1.00 0.00 H new ATOM 0 HG3 PRO A 75 -5.326 5.427 -8.609 1.00 0.00 H new ATOM 0 HD2 PRO A 75 -7.037 3.181 -9.108 1.00 0.00 H new ATOM 0 HD3 PRO A 75 -5.728 3.264 -7.947 1.00 0.00 H new ATOM 1113 N ARG A 76 -10.498 5.530 -6.604 1.00 0.00 N ATOM 1114 CA ARG A 76 -11.898 5.660 -6.971 1.00 0.00 C ATOM 1115 C ARG A 76 -12.227 7.118 -7.298 1.00 0.00 C ATOM 1116 O ARG A 76 -13.357 7.436 -7.664 1.00 0.00 O ATOM 1117 CB ARG A 76 -12.811 5.180 -5.840 1.00 0.00 C ATOM 1118 CG ARG A 76 -12.995 3.662 -5.891 1.00 0.00 C ATOM 1119 CD ARG A 76 -13.824 3.251 -7.110 1.00 0.00 C ATOM 1120 NE ARG A 76 -15.235 3.047 -6.716 1.00 0.00 N ATOM 1121 CZ ARG A 76 -16.249 2.931 -7.585 1.00 0.00 C ATOM 1122 NH1 ARG A 76 -16.013 2.999 -8.902 1.00 0.00 N ATOM 1123 NH2 ARG A 76 -17.498 2.748 -7.137 1.00 0.00 N ATOM 0 H ARG A 76 -10.305 5.646 -5.609 1.00 0.00 H new ATOM 0 HA ARG A 76 -12.070 5.039 -7.850 1.00 0.00 H new ATOM 0 HB2 ARG A 76 -12.386 5.466 -4.878 1.00 0.00 H new ATOM 0 HB3 ARG A 76 -13.781 5.670 -5.918 1.00 0.00 H new ATOM 0 HG2 ARG A 76 -12.021 3.175 -5.928 1.00 0.00 H new ATOM 0 HG3 ARG A 76 -13.487 3.321 -4.980 1.00 0.00 H new ATOM 0 HD2 ARG A 76 -13.760 4.020 -7.880 1.00 0.00 H new ATOM 0 HD3 ARG A 76 -13.422 2.334 -7.541 1.00 0.00 H new ATOM 0 HE ARG A 76 -15.450 2.991 -5.720 1.00 0.00 H new ATOM 0 HH11 ARG A 76 -15.062 3.139 -9.243 1.00 0.00 H new ATOM 0 HH12 ARG A 76 -16.784 2.911 -9.564 1.00 0.00 H new ATOM 0 HH21 ARG A 76 -17.678 2.697 -6.134 1.00 0.00 H new ATOM 0 HH22 ARG A 76 -18.269 2.660 -7.799 1.00 0.00 H new ATOM 1137 N SER A 77 -11.218 7.966 -7.155 1.00 0.00 N ATOM 1138 CA SER A 77 -11.386 9.382 -7.431 1.00 0.00 C ATOM 1139 C SER A 77 -10.247 9.880 -8.322 1.00 0.00 C ATOM 1140 O SER A 77 -9.078 9.614 -8.048 1.00 0.00 O ATOM 1141 CB SER A 77 -11.440 10.193 -6.135 1.00 0.00 C ATOM 1142 OG SER A 77 -11.265 11.588 -6.370 1.00 0.00 O ATOM 0 H SER A 77 -10.282 7.699 -6.852 1.00 0.00 H new ATOM 0 HA SER A 77 -12.333 9.519 -7.953 1.00 0.00 H new ATOM 0 HB2 SER A 77 -12.398 10.026 -5.642 1.00 0.00 H new ATOM 0 HB3 SER A 77 -10.665 9.840 -5.454 1.00 0.00 H new ATOM 0 HG SER A 77 -11.875 12.096 -5.795 1.00 0.00 H new ATOM 1148 N MET A 78 -10.627 10.594 -9.371 1.00 0.00 N ATOM 1149 CA MET A 78 -9.652 11.132 -10.304 1.00 0.00 C ATOM 1150 C MET A 78 -8.948 12.357 -9.717 1.00 0.00 C ATOM 1151 O MET A 78 -7.833 12.688 -10.116 1.00 0.00 O ATOM 1152 CB MET A 78 -10.353 11.522 -11.607 1.00 0.00 C ATOM 1153 CG MET A 78 -10.607 10.293 -12.482 1.00 0.00 C ATOM 1154 SD MET A 78 -11.664 10.727 -13.853 1.00 0.00 S ATOM 1155 CE MET A 78 -10.669 10.134 -15.212 1.00 0.00 C ATOM 0 H MET A 78 -11.598 10.813 -9.596 1.00 0.00 H new ATOM 0 HA MET A 78 -8.903 10.365 -10.499 1.00 0.00 H new ATOM 0 HB2 MET A 78 -11.299 12.014 -11.382 1.00 0.00 H new ATOM 0 HB3 MET A 78 -9.741 12.241 -12.152 1.00 0.00 H new ATOM 0 HG2 MET A 78 -9.661 9.898 -12.852 1.00 0.00 H new ATOM 0 HG3 MET A 78 -11.071 9.504 -11.890 1.00 0.00 H new ATOM 0 HE1 MET A 78 -11.185 10.327 -16.152 1.00 0.00 H new ATOM 0 HE2 MET A 78 -9.709 10.650 -15.212 1.00 0.00 H new ATOM 0 HE3 MET A 78 -10.505 9.062 -15.102 1.00 0.00 H new ATOM 1165 N ASP A 79 -9.629 12.997 -8.777 1.00 0.00 N ATOM 1166 CA ASP A 79 -9.083 14.178 -8.130 1.00 0.00 C ATOM 1167 C ASP A 79 -8.131 13.748 -7.013 1.00 0.00 C ATOM 1168 O ASP A 79 -7.169 14.451 -6.707 1.00 0.00 O ATOM 1169 CB ASP A 79 -10.193 15.026 -7.506 1.00 0.00 C ATOM 1170 CG ASP A 79 -10.962 15.910 -8.490 1.00 0.00 C ATOM 1171 OD1 ASP A 79 -10.980 15.546 -9.685 1.00 0.00 O ATOM 1172 OD2 ASP A 79 -11.515 16.930 -8.024 1.00 0.00 O ATOM 0 H ASP A 79 -10.554 12.720 -8.448 1.00 0.00 H new ATOM 0 HA ASP A 79 -8.561 14.766 -8.885 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -10.900 14.363 -7.008 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -9.755 15.661 -6.736 1.00 0.00 H new ATOM 1177 N ALA A 80 -8.432 12.595 -6.433 1.00 0.00 N ATOM 1178 CA ALA A 80 -7.615 12.063 -5.356 1.00 0.00 C ATOM 1179 C ALA A 80 -6.238 11.685 -5.905 1.00 0.00 C ATOM 1180 O ALA A 80 -6.086 10.646 -6.546 1.00 0.00 O ATOM 1181 CB ALA A 80 -8.332 10.875 -4.710 1.00 0.00 C ATOM 0 H ALA A 80 -9.231 12.015 -6.689 1.00 0.00 H new ATOM 0 HA ALA A 80 -7.466 12.814 -4.581 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -7.719 10.476 -3.902 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -9.291 11.203 -4.310 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -8.497 10.099 -5.458 1.00 0.00 H new ATOM 1187 N GLU A 81 -5.271 12.548 -5.633 1.00 0.00 N ATOM 1188 CA GLU A 81 -3.911 12.317 -6.092 1.00 0.00 C ATOM 1189 C GLU A 81 -3.244 11.229 -5.249 1.00 0.00 C ATOM 1190 O GLU A 81 -3.072 11.392 -4.042 1.00 0.00 O ATOM 1191 CB GLU A 81 -3.096 13.611 -6.061 1.00 0.00 C ATOM 1192 CG GLU A 81 -3.844 14.748 -6.760 1.00 0.00 C ATOM 1193 CD GLU A 81 -3.921 15.986 -5.864 1.00 0.00 C ATOM 1194 OE1 GLU A 81 -4.131 15.794 -4.647 1.00 0.00 O ATOM 1195 OE2 GLU A 81 -3.768 17.097 -6.417 1.00 0.00 O ATOM 0 H GLU A 81 -5.401 13.408 -5.101 1.00 0.00 H new ATOM 0 HA GLU A 81 -3.950 11.975 -7.126 1.00 0.00 H new ATOM 0 HB2 GLU A 81 -2.888 13.889 -5.028 1.00 0.00 H new ATOM 0 HB3 GLU A 81 -2.134 13.451 -6.548 1.00 0.00 H new ATOM 0 HG2 GLU A 81 -3.340 15.001 -7.693 1.00 0.00 H new ATOM 0 HG3 GLU A 81 -4.850 14.420 -7.020 1.00 0.00 H new ATOM 1202 N THR A 82 -2.887 10.143 -5.918 1.00 0.00 N ATOM 1203 CA THR A 82 -2.242 9.027 -5.246 1.00 0.00 C ATOM 1204 C THR A 82 -0.948 8.646 -5.966 1.00 0.00 C ATOM 1205 O THR A 82 -0.984 8.044 -7.038 1.00 0.00 O ATOM 1206 CB THR A 82 -3.251 7.880 -5.161 1.00 0.00 C ATOM 1207 OG1 THR A 82 -4.080 8.227 -4.055 1.00 0.00 O ATOM 1208 CG2 THR A 82 -2.602 6.560 -4.740 1.00 0.00 C ATOM 0 H THR A 82 -3.032 10.012 -6.919 1.00 0.00 H new ATOM 0 HA THR A 82 -1.945 9.294 -4.232 1.00 0.00 H new ATOM 0 HB THR A 82 -3.738 7.753 -6.128 1.00 0.00 H new ATOM 0 HG1 THR A 82 -4.438 9.130 -4.185 1.00 0.00 H new ATOM 0 HG21 THR A 82 -3.361 5.779 -4.695 1.00 0.00 H new ATOM 0 HG22 THR A 82 -1.838 6.282 -5.466 1.00 0.00 H new ATOM 0 HG23 THR A 82 -2.143 6.677 -3.758 1.00 0.00 H new ATOM 1216 N TYR A 83 0.166 9.013 -5.349 1.00 0.00 N ATOM 1217 CA TYR A 83 1.470 8.718 -5.918 1.00 0.00 C ATOM 1218 C TYR A 83 2.175 7.614 -5.128 1.00 0.00 C ATOM 1219 O TYR A 83 2.484 7.789 -3.950 1.00 0.00 O ATOM 1220 CB TYR A 83 2.282 10.009 -5.804 1.00 0.00 C ATOM 1221 CG TYR A 83 1.538 11.257 -6.283 1.00 0.00 C ATOM 1222 CD1 TYR A 83 1.623 11.645 -7.605 1.00 0.00 C ATOM 1223 CD2 TYR A 83 0.783 11.994 -5.394 1.00 0.00 C ATOM 1224 CE1 TYR A 83 0.922 12.819 -8.056 1.00 0.00 C ATOM 1225 CE2 TYR A 83 0.083 13.169 -5.846 1.00 0.00 C ATOM 1226 CZ TYR A 83 0.187 13.523 -7.155 1.00 0.00 C ATOM 1227 OH TYR A 83 -0.474 14.633 -7.581 1.00 0.00 O ATOM 0 H TYR A 83 0.192 9.512 -4.460 1.00 0.00 H new ATOM 0 HA TYR A 83 1.371 8.377 -6.948 1.00 0.00 H new ATOM 0 HB2 TYR A 83 2.576 10.151 -4.764 1.00 0.00 H new ATOM 0 HB3 TYR A 83 3.200 9.901 -6.382 1.00 0.00 H new ATOM 0 HD1 TYR A 83 2.215 11.068 -8.300 1.00 0.00 H new ATOM 0 HD2 TYR A 83 0.717 11.690 -4.360 1.00 0.00 H new ATOM 0 HE1 TYR A 83 0.979 13.133 -9.088 1.00 0.00 H new ATOM 0 HE2 TYR A 83 -0.511 13.756 -5.161 1.00 0.00 H new ATOM 0 HH TYR A 83 -0.721 14.525 -8.523 1.00 0.00 H new ATOM 1237 N VAL A 84 2.409 6.501 -5.807 1.00 0.00 N ATOM 1238 CA VAL A 84 3.072 5.368 -5.184 1.00 0.00 C ATOM 1239 C VAL A 84 4.587 5.525 -5.332 1.00 0.00 C ATOM 1240 O VAL A 84 5.166 5.086 -6.324 1.00 0.00 O ATOM 1241 CB VAL A 84 2.546 4.061 -5.779 1.00 0.00 C ATOM 1242 CG1 VAL A 84 3.305 2.858 -5.216 1.00 0.00 C ATOM 1243 CG2 VAL A 84 1.041 3.918 -5.543 1.00 0.00 C ATOM 0 H VAL A 84 2.151 6.359 -6.784 1.00 0.00 H new ATOM 0 HA VAL A 84 2.851 5.336 -4.117 1.00 0.00 H new ATOM 0 HB VAL A 84 2.716 4.091 -6.855 1.00 0.00 H new ATOM 0 HG11 VAL A 84 2.911 1.941 -5.655 1.00 0.00 H new ATOM 0 HG12 VAL A 84 4.364 2.950 -5.457 1.00 0.00 H new ATOM 0 HG13 VAL A 84 3.181 2.824 -4.134 1.00 0.00 H new ATOM 0 HG21 VAL A 84 0.692 2.980 -5.976 1.00 0.00 H new ATOM 0 HG22 VAL A 84 0.839 3.921 -4.472 1.00 0.00 H new ATOM 0 HG23 VAL A 84 0.518 4.751 -6.013 1.00 0.00 H new ATOM 1253 N ASP A 85 5.186 6.153 -4.330 1.00 0.00 N ATOM 1254 CA ASP A 85 6.622 6.373 -4.337 1.00 0.00 C ATOM 1255 C ASP A 85 6.946 7.573 -5.229 1.00 0.00 C ATOM 1256 O ASP A 85 8.042 7.664 -5.779 1.00 0.00 O ATOM 1257 CB ASP A 85 7.363 5.156 -4.895 1.00 0.00 C ATOM 1258 CG ASP A 85 8.645 4.781 -4.148 1.00 0.00 C ATOM 1259 OD1 ASP A 85 8.992 5.528 -3.207 1.00 0.00 O ATOM 1260 OD2 ASP A 85 9.249 3.757 -4.535 1.00 0.00 O ATOM 0 H ASP A 85 4.703 6.516 -3.508 1.00 0.00 H new ATOM 0 HA ASP A 85 6.941 6.550 -3.310 1.00 0.00 H new ATOM 0 HB2 ASP A 85 6.688 4.300 -4.880 1.00 0.00 H new ATOM 0 HB3 ASP A 85 7.611 5.348 -5.939 1.00 0.00 H new ATOM 1265 N GLY A 86 5.972 8.464 -5.343 1.00 0.00 N ATOM 1266 CA GLY A 86 6.139 9.655 -6.159 1.00 0.00 C ATOM 1267 C GLY A 86 5.617 9.425 -7.579 1.00 0.00 C ATOM 1268 O GLY A 86 5.795 10.271 -8.454 1.00 0.00 O ATOM 0 H GLY A 86 5.065 8.385 -4.884 1.00 0.00 H new ATOM 0 HA2 GLY A 86 5.607 10.490 -5.703 1.00 0.00 H new ATOM 0 HA3 GLY A 86 7.193 9.930 -6.195 1.00 0.00 H new ATOM 1272 N GLN A 87 4.983 8.277 -7.763 1.00 0.00 N ATOM 1273 CA GLN A 87 4.434 7.925 -9.061 1.00 0.00 C ATOM 1274 C GLN A 87 2.908 7.844 -8.988 1.00 0.00 C ATOM 1275 O GLN A 87 2.361 6.986 -8.297 1.00 0.00 O ATOM 1276 CB GLN A 87 5.029 6.611 -9.571 1.00 0.00 C ATOM 1277 CG GLN A 87 6.314 6.861 -10.362 1.00 0.00 C ATOM 1278 CD GLN A 87 7.405 5.863 -9.967 1.00 0.00 C ATOM 1279 OE1 GLN A 87 8.505 6.226 -9.584 1.00 0.00 O ATOM 1280 NE2 GLN A 87 7.040 4.590 -10.081 1.00 0.00 N ATOM 0 H GLN A 87 4.837 7.578 -7.035 1.00 0.00 H new ATOM 0 HA GLN A 87 4.703 8.707 -9.771 1.00 0.00 H new ATOM 0 HB2 GLN A 87 5.239 5.952 -8.729 1.00 0.00 H new ATOM 0 HB3 GLN A 87 4.303 6.100 -10.203 1.00 0.00 H new ATOM 0 HG2 GLN A 87 6.110 6.778 -11.430 1.00 0.00 H new ATOM 0 HG3 GLN A 87 6.664 7.878 -10.182 1.00 0.00 H new ATOM 0 HE21 GLN A 87 6.103 4.356 -10.408 1.00 0.00 H new ATOM 0 HE22 GLN A 87 7.697 3.848 -9.841 1.00 0.00 H new ATOM 1289 N ARG A 88 2.264 8.749 -9.710 1.00 0.00 N ATOM 1290 CA ARG A 88 0.811 8.790 -9.735 1.00 0.00 C ATOM 1291 C ARG A 88 0.258 7.567 -10.470 1.00 0.00 C ATOM 1292 O ARG A 88 0.920 7.013 -11.346 1.00 0.00 O ATOM 1293 CB ARG A 88 0.309 10.060 -10.424 1.00 0.00 C ATOM 1294 CG ARG A 88 -1.095 10.429 -9.939 1.00 0.00 C ATOM 1295 CD ARG A 88 -1.439 11.874 -10.303 1.00 0.00 C ATOM 1296 NE ARG A 88 -2.840 11.957 -10.775 1.00 0.00 N ATOM 1297 CZ ARG A 88 -3.472 13.105 -11.052 1.00 0.00 C ATOM 1298 NH1 ARG A 88 -2.833 14.274 -10.907 1.00 0.00 N ATOM 1299 NH2 ARG A 88 -4.744 13.085 -11.475 1.00 0.00 N ATOM 0 H ARG A 88 2.721 9.459 -10.282 1.00 0.00 H new ATOM 0 HA ARG A 88 0.461 8.787 -8.703 1.00 0.00 H new ATOM 0 HB2 ARG A 88 0.995 10.883 -10.223 1.00 0.00 H new ATOM 0 HB3 ARG A 88 0.297 9.912 -11.504 1.00 0.00 H new ATOM 0 HG2 ARG A 88 -1.826 9.754 -10.384 1.00 0.00 H new ATOM 0 HG3 ARG A 88 -1.156 10.298 -8.859 1.00 0.00 H new ATOM 0 HD2 ARG A 88 -1.300 12.519 -9.436 1.00 0.00 H new ATOM 0 HD3 ARG A 88 -0.763 12.233 -11.079 1.00 0.00 H new ATOM 0 HE ARG A 88 -3.356 11.086 -10.897 1.00 0.00 H new ATOM 0 HH11 ARG A 88 -1.865 14.290 -10.586 1.00 0.00 H new ATOM 0 HH12 ARG A 88 -3.315 15.148 -11.118 1.00 0.00 H new ATOM 0 HH21 ARG A 88 -5.231 12.195 -11.586 1.00 0.00 H new ATOM 0 HH22 ARG A 88 -5.225 13.959 -11.686 1.00 0.00 H new ATOM 1313 N ILE A 89 -0.950 7.182 -10.085 1.00 0.00 N ATOM 1314 CA ILE A 89 -1.600 6.035 -10.695 1.00 0.00 C ATOM 1315 C ILE A 89 -2.921 6.478 -11.326 1.00 0.00 C ATOM 1316 O ILE A 89 -3.525 7.455 -10.887 1.00 0.00 O ATOM 1317 CB ILE A 89 -1.753 4.902 -9.679 1.00 0.00 C ATOM 1318 CG1 ILE A 89 -2.712 5.300 -8.555 1.00 0.00 C ATOM 1319 CG2 ILE A 89 -0.391 4.460 -9.140 1.00 0.00 C ATOM 1320 CD1 ILE A 89 -3.439 4.075 -7.995 1.00 0.00 C ATOM 0 H ILE A 89 -1.496 7.644 -9.358 1.00 0.00 H new ATOM 0 HA ILE A 89 -0.983 5.631 -11.498 1.00 0.00 H new ATOM 0 HB ILE A 89 -2.191 4.044 -10.188 1.00 0.00 H new ATOM 0 HG12 ILE A 89 -2.158 5.795 -7.757 1.00 0.00 H new ATOM 0 HG13 ILE A 89 -3.440 6.019 -8.931 1.00 0.00 H new ATOM 0 HG21 ILE A 89 -0.529 3.654 -8.420 1.00 0.00 H new ATOM 0 HG22 ILE A 89 0.230 4.108 -9.964 1.00 0.00 H new ATOM 0 HG23 ILE A 89 0.098 5.303 -8.652 1.00 0.00 H new ATOM 0 HD11 ILE A 89 -4.114 4.386 -7.198 1.00 0.00 H new ATOM 0 HD12 ILE A 89 -4.012 3.597 -8.790 1.00 0.00 H new ATOM 0 HD13 ILE A 89 -2.710 3.369 -7.598 1.00 0.00 H new ATOM 1332 N SER A 90 -3.331 5.738 -12.346 1.00 0.00 N ATOM 1333 CA SER A 90 -4.570 6.043 -13.041 1.00 0.00 C ATOM 1334 C SER A 90 -5.511 4.838 -12.986 1.00 0.00 C ATOM 1335 O SER A 90 -6.648 4.913 -13.449 1.00 0.00 O ATOM 1336 CB SER A 90 -4.303 6.442 -14.494 1.00 0.00 C ATOM 1337 OG SER A 90 -5.494 6.842 -15.165 1.00 0.00 O ATOM 0 H SER A 90 -2.827 4.928 -12.708 1.00 0.00 H new ATOM 0 HA SER A 90 -5.043 6.889 -12.542 1.00 0.00 H new ATOM 0 HB2 SER A 90 -3.581 7.258 -14.519 1.00 0.00 H new ATOM 0 HB3 SER A 90 -3.853 5.602 -15.024 1.00 0.00 H new ATOM 0 HG SER A 90 -6.261 6.367 -14.781 1.00 0.00 H new ATOM 1343 N GLU A 91 -5.002 3.756 -12.416 1.00 0.00 N ATOM 1344 CA GLU A 91 -5.783 2.536 -12.295 1.00 0.00 C ATOM 1345 C GLU A 91 -5.211 1.648 -11.188 1.00 0.00 C ATOM 1346 O GLU A 91 -4.299 2.054 -10.470 1.00 0.00 O ATOM 1347 CB GLU A 91 -5.838 1.786 -13.627 1.00 0.00 C ATOM 1348 CG GLU A 91 -6.655 2.564 -14.661 1.00 0.00 C ATOM 1349 CD GLU A 91 -6.975 1.691 -15.877 1.00 0.00 C ATOM 1350 OE1 GLU A 91 -7.871 0.831 -15.737 1.00 0.00 O ATOM 1351 OE2 GLU A 91 -6.316 1.904 -16.917 1.00 0.00 O ATOM 0 H GLU A 91 -4.058 3.698 -12.033 1.00 0.00 H new ATOM 0 HA GLU A 91 -6.804 2.806 -12.026 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -4.827 1.628 -14.002 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -6.279 0.801 -13.476 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -7.582 2.916 -14.208 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -6.100 3.447 -14.979 1.00 0.00 H new ATOM 1358 N THR A 92 -5.771 0.451 -11.086 1.00 0.00 N ATOM 1359 CA THR A 92 -5.329 -0.498 -10.079 1.00 0.00 C ATOM 1360 C THR A 92 -3.841 -0.810 -10.257 1.00 0.00 C ATOM 1361 O THR A 92 -3.461 -1.532 -11.177 1.00 0.00 O ATOM 1362 CB THR A 92 -6.224 -1.735 -10.169 1.00 0.00 C ATOM 1363 OG1 THR A 92 -7.469 -1.303 -9.627 1.00 0.00 O ATOM 1364 CG2 THR A 92 -5.775 -2.853 -9.226 1.00 0.00 C ATOM 0 H THR A 92 -6.527 0.117 -11.684 1.00 0.00 H new ATOM 0 HA THR A 92 -5.424 -0.083 -9.076 1.00 0.00 H new ATOM 0 HB THR A 92 -6.229 -2.105 -11.194 1.00 0.00 H new ATOM 0 HG1 THR A 92 -8.110 -2.044 -9.648 1.00 0.00 H new ATOM 0 HG21 THR A 92 -6.444 -3.707 -9.330 1.00 0.00 H new ATOM 0 HG22 THR A 92 -4.759 -3.155 -9.478 1.00 0.00 H new ATOM 0 HG23 THR A 92 -5.802 -2.494 -8.197 1.00 0.00 H new ATOM 1372 N THR A 93 -3.040 -0.250 -9.363 1.00 0.00 N ATOM 1373 CA THR A 93 -1.603 -0.460 -9.410 1.00 0.00 C ATOM 1374 C THR A 93 -1.151 -1.323 -8.230 1.00 0.00 C ATOM 1375 O THR A 93 -1.590 -1.115 -7.100 1.00 0.00 O ATOM 1376 CB THR A 93 -0.927 0.912 -9.454 1.00 0.00 C ATOM 1377 OG1 THR A 93 -0.974 1.278 -10.830 1.00 0.00 O ATOM 1378 CG2 THR A 93 0.569 0.837 -9.139 1.00 0.00 C ATOM 0 H THR A 93 -3.359 0.349 -8.602 1.00 0.00 H new ATOM 0 HA THR A 93 -1.312 -1.011 -10.304 1.00 0.00 H new ATOM 0 HB THR A 93 -1.415 1.580 -8.744 1.00 0.00 H new ATOM 0 HG1 THR A 93 -0.558 2.157 -10.949 1.00 0.00 H new ATOM 0 HG21 THR A 93 1.001 1.837 -9.184 1.00 0.00 H new ATOM 0 HG22 THR A 93 0.710 0.425 -8.140 1.00 0.00 H new ATOM 0 HG23 THR A 93 1.063 0.196 -9.869 1.00 0.00 H new ATOM 1386 N MET A 94 -0.279 -2.273 -8.533 1.00 0.00 N ATOM 1387 CA MET A 94 0.237 -3.168 -7.512 1.00 0.00 C ATOM 1388 C MET A 94 1.071 -2.403 -6.483 1.00 0.00 C ATOM 1389 O MET A 94 1.635 -1.354 -6.791 1.00 0.00 O ATOM 1390 CB MET A 94 1.101 -4.248 -8.168 1.00 0.00 C ATOM 1391 CG MET A 94 1.240 -5.468 -7.256 1.00 0.00 C ATOM 1392 SD MET A 94 1.626 -6.915 -8.227 1.00 0.00 S ATOM 1393 CE MET A 94 -0.022 -7.447 -8.659 1.00 0.00 C ATOM 0 H MET A 94 0.083 -2.442 -9.471 1.00 0.00 H new ATOM 0 HA MET A 94 -0.607 -3.628 -6.999 1.00 0.00 H new ATOM 0 HB2 MET A 94 0.656 -4.548 -9.117 1.00 0.00 H new ATOM 0 HB3 MET A 94 2.088 -3.843 -8.392 1.00 0.00 H new ATOM 0 HG2 MET A 94 2.025 -5.294 -6.519 1.00 0.00 H new ATOM 0 HG3 MET A 94 0.314 -5.627 -6.704 1.00 0.00 H new ATOM 0 HE1 MET A 94 -0.057 -8.536 -8.689 1.00 0.00 H new ATOM 0 HE2 MET A 94 -0.729 -7.082 -7.914 1.00 0.00 H new ATOM 0 HE3 MET A 94 -0.288 -7.048 -9.638 1.00 0.00 H new ATOM 1403 N LEU A 95 1.124 -2.958 -5.281 1.00 0.00 N ATOM 1404 CA LEU A 95 1.880 -2.340 -4.204 1.00 0.00 C ATOM 1405 C LEU A 95 2.979 -3.300 -3.743 1.00 0.00 C ATOM 1406 O LEU A 95 2.792 -4.516 -3.758 1.00 0.00 O ATOM 1407 CB LEU A 95 0.943 -1.892 -3.081 1.00 0.00 C ATOM 1408 CG LEU A 95 0.046 -0.693 -3.393 1.00 0.00 C ATOM 1409 CD1 LEU A 95 -0.934 -0.428 -2.249 1.00 0.00 C ATOM 1410 CD2 LEU A 95 0.882 0.544 -3.731 1.00 0.00 C ATOM 0 H LEU A 95 0.656 -3.829 -5.029 1.00 0.00 H new ATOM 0 HA LEU A 95 2.374 -1.434 -4.555 1.00 0.00 H new ATOM 0 HB2 LEU A 95 0.307 -2.734 -2.808 1.00 0.00 H new ATOM 0 HB3 LEU A 95 1.547 -1.651 -2.206 1.00 0.00 H new ATOM 0 HG LEU A 95 -0.548 -0.931 -4.276 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -1.559 0.430 -2.497 1.00 0.00 H new ATOM 0 HD12 LEU A 95 -1.564 -1.305 -2.099 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -0.378 -0.219 -1.335 1.00 0.00 H new ATOM 0 HD21 LEU A 95 0.220 1.382 -3.949 1.00 0.00 H new ATOM 0 HD22 LEU A 95 1.519 0.796 -2.883 1.00 0.00 H new ATOM 0 HD23 LEU A 95 1.503 0.336 -4.602 1.00 0.00 H new ATOM 1422 N GLN A 96 4.100 -2.718 -3.344 1.00 0.00 N ATOM 1423 CA GLN A 96 5.228 -3.506 -2.879 1.00 0.00 C ATOM 1424 C GLN A 96 5.794 -2.913 -1.587 1.00 0.00 C ATOM 1425 O GLN A 96 6.013 -1.706 -1.497 1.00 0.00 O ATOM 1426 CB GLN A 96 6.310 -3.604 -3.957 1.00 0.00 C ATOM 1427 CG GLN A 96 5.767 -4.278 -5.218 1.00 0.00 C ATOM 1428 CD GLN A 96 6.048 -3.427 -6.459 1.00 0.00 C ATOM 1429 OE1 GLN A 96 5.150 -2.990 -7.159 1.00 0.00 O ATOM 1430 NE2 GLN A 96 7.341 -3.218 -6.690 1.00 0.00 N ATOM 0 H GLN A 96 4.251 -1.709 -3.333 1.00 0.00 H new ATOM 0 HA GLN A 96 4.878 -4.517 -2.669 1.00 0.00 H new ATOM 0 HB2 GLN A 96 6.676 -2.607 -4.202 1.00 0.00 H new ATOM 0 HB3 GLN A 96 7.159 -4.170 -3.575 1.00 0.00 H new ATOM 0 HG2 GLN A 96 6.224 -5.260 -5.335 1.00 0.00 H new ATOM 0 HG3 GLN A 96 4.693 -4.436 -5.117 1.00 0.00 H new ATOM 0 HE21 GLN A 96 8.042 -3.614 -6.063 1.00 0.00 H new ATOM 0 HE22 GLN A 96 7.632 -2.662 -7.494 1.00 0.00 H new ATOM 1439 N SER A 97 6.014 -3.789 -0.618 1.00 0.00 N ATOM 1440 CA SER A 97 6.549 -3.367 0.665 1.00 0.00 C ATOM 1441 C SER A 97 7.673 -2.350 0.455 1.00 0.00 C ATOM 1442 O SER A 97 8.564 -2.565 -0.365 1.00 0.00 O ATOM 1443 CB SER A 97 7.062 -4.564 1.469 1.00 0.00 C ATOM 1444 OG SER A 97 8.453 -4.792 1.260 1.00 0.00 O ATOM 0 H SER A 97 5.831 -4.790 -0.696 1.00 0.00 H new ATOM 0 HA SER A 97 5.745 -2.899 1.233 1.00 0.00 H new ATOM 0 HB2 SER A 97 6.878 -4.394 2.530 1.00 0.00 H new ATOM 0 HB3 SER A 97 6.502 -5.456 1.188 1.00 0.00 H new ATOM 0 HG SER A 97 8.742 -5.563 1.792 1.00 0.00 H new ATOM 1450 N GLY A 98 7.593 -1.263 1.209 1.00 0.00 N ATOM 1451 CA GLY A 98 8.592 -0.212 1.115 1.00 0.00 C ATOM 1452 C GLY A 98 8.069 0.969 0.294 1.00 0.00 C ATOM 1453 O GLY A 98 8.446 2.114 0.538 1.00 0.00 O ATOM 0 H GLY A 98 6.852 -1.088 1.887 1.00 0.00 H new ATOM 0 HA2 GLY A 98 8.864 0.127 2.115 1.00 0.00 H new ATOM 0 HA3 GLY A 98 9.498 -0.606 0.655 1.00 0.00 H new ATOM 1457 N MET A 99 7.209 0.649 -0.662 1.00 0.00 N ATOM 1458 CA MET A 99 6.632 1.669 -1.521 1.00 0.00 C ATOM 1459 C MET A 99 5.865 2.708 -0.699 1.00 0.00 C ATOM 1460 O MET A 99 5.155 2.358 0.243 1.00 0.00 O ATOM 1461 CB MET A 99 5.683 1.013 -2.526 1.00 0.00 C ATOM 1462 CG MET A 99 6.463 0.358 -3.668 1.00 0.00 C ATOM 1463 SD MET A 99 5.797 0.880 -5.240 1.00 0.00 S ATOM 1464 CE MET A 99 4.266 -0.038 -5.248 1.00 0.00 C ATOM 0 H MET A 99 6.898 -0.302 -0.861 1.00 0.00 H new ATOM 0 HA MET A 99 7.441 2.174 -2.048 1.00 0.00 H new ATOM 0 HB2 MET A 99 5.073 0.264 -2.021 1.00 0.00 H new ATOM 0 HB3 MET A 99 5.000 1.761 -2.929 1.00 0.00 H new ATOM 0 HG2 MET A 99 7.517 0.629 -3.602 1.00 0.00 H new ATOM 0 HG3 MET A 99 6.407 -0.727 -3.582 1.00 0.00 H new ATOM 0 HE1 MET A 99 3.672 0.253 -6.114 1.00 0.00 H new ATOM 0 HE2 MET A 99 4.482 -1.105 -5.298 1.00 0.00 H new ATOM 0 HE3 MET A 99 3.708 0.177 -4.337 1.00 0.00 H new ATOM 1474 N ARG A 100 6.036 3.964 -1.084 1.00 0.00 N ATOM 1475 CA ARG A 100 5.370 5.055 -0.395 1.00 0.00 C ATOM 1476 C ARG A 100 4.004 5.328 -1.028 1.00 0.00 C ATOM 1477 O ARG A 100 3.770 4.976 -2.183 1.00 0.00 O ATOM 1478 CB ARG A 100 6.211 6.332 -0.443 1.00 0.00 C ATOM 1479 CG ARG A 100 6.733 6.698 0.948 1.00 0.00 C ATOM 1480 CD ARG A 100 7.548 7.992 0.905 1.00 0.00 C ATOM 1481 NE ARG A 100 8.893 7.762 1.477 1.00 0.00 N ATOM 1482 CZ ARG A 100 9.926 7.255 0.790 1.00 0.00 C ATOM 1483 NH1 ARG A 100 9.774 6.923 -0.500 1.00 0.00 N ATOM 1484 NH2 ARG A 100 11.111 7.081 1.391 1.00 0.00 N ATOM 0 H ARG A 100 6.627 4.250 -1.865 1.00 0.00 H new ATOM 0 HA ARG A 100 5.239 4.759 0.646 1.00 0.00 H new ATOM 0 HB2 ARG A 100 7.050 6.194 -1.125 1.00 0.00 H new ATOM 0 HB3 ARG A 100 5.611 7.152 -0.838 1.00 0.00 H new ATOM 0 HG2 ARG A 100 5.895 6.814 1.636 1.00 0.00 H new ATOM 0 HG3 ARG A 100 7.351 5.887 1.333 1.00 0.00 H new ATOM 0 HD2 ARG A 100 7.636 8.342 -0.124 1.00 0.00 H new ATOM 0 HD3 ARG A 100 7.035 8.774 1.465 1.00 0.00 H new ATOM 0 HE ARG A 100 9.044 8.005 2.456 1.00 0.00 H new ATOM 0 HH11 ARG A 100 8.872 7.056 -0.958 1.00 0.00 H new ATOM 0 HH12 ARG A 100 10.560 6.537 -1.023 1.00 0.00 H new ATOM 0 HH21 ARG A 100 11.227 7.334 2.372 1.00 0.00 H new ATOM 0 HH22 ARG A 100 11.897 6.695 0.867 1.00 0.00 H new ATOM 1498 N LEU A 101 3.138 5.953 -0.244 1.00 0.00 N ATOM 1499 CA LEU A 101 1.802 6.277 -0.714 1.00 0.00 C ATOM 1500 C LEU A 101 1.468 7.721 -0.334 1.00 0.00 C ATOM 1501 O LEU A 101 1.223 8.018 0.834 1.00 0.00 O ATOM 1502 CB LEU A 101 0.788 5.255 -0.195 1.00 0.00 C ATOM 1503 CG LEU A 101 0.511 4.061 -1.111 1.00 0.00 C ATOM 1504 CD1 LEU A 101 1.095 2.773 -0.524 1.00 0.00 C ATOM 1505 CD2 LEU A 101 -0.984 3.931 -1.405 1.00 0.00 C ATOM 0 H LEU A 101 3.336 6.244 0.714 1.00 0.00 H new ATOM 0 HA LEU A 101 1.756 6.214 -1.801 1.00 0.00 H new ATOM 0 HB2 LEU A 101 1.141 4.877 0.765 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -0.154 5.770 -0.008 1.00 0.00 H new ATOM 0 HG LEU A 101 1.012 4.237 -2.063 1.00 0.00 H new ATOM 0 HD11 LEU A 101 0.884 1.940 -1.194 1.00 0.00 H new ATOM 0 HD12 LEU A 101 2.173 2.882 -0.408 1.00 0.00 H new ATOM 0 HD13 LEU A 101 0.644 2.579 0.449 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -1.153 3.075 -2.058 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -1.527 3.788 -0.471 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -1.338 4.837 -1.896 1.00 0.00 H new ATOM 1517 N GLN A 102 1.469 8.580 -1.343 1.00 0.00 N ATOM 1518 CA GLN A 102 1.170 9.986 -1.128 1.00 0.00 C ATOM 1519 C GLN A 102 -0.270 10.292 -1.546 1.00 0.00 C ATOM 1520 O GLN A 102 -0.617 10.179 -2.721 1.00 0.00 O ATOM 1521 CB GLN A 102 2.160 10.878 -1.880 1.00 0.00 C ATOM 1522 CG GLN A 102 1.980 12.347 -1.490 1.00 0.00 C ATOM 1523 CD GLN A 102 3.278 13.131 -1.694 1.00 0.00 C ATOM 1524 OE1 GLN A 102 4.001 13.439 -0.761 1.00 0.00 O ATOM 1525 NE2 GLN A 102 3.532 13.436 -2.963 1.00 0.00 N ATOM 0 H GLN A 102 1.672 8.330 -2.311 1.00 0.00 H new ATOM 0 HA GLN A 102 1.273 10.201 -0.064 1.00 0.00 H new ATOM 0 HB2 GLN A 102 3.180 10.562 -1.660 1.00 0.00 H new ATOM 0 HB3 GLN A 102 2.015 10.763 -2.954 1.00 0.00 H new ATOM 0 HG2 GLN A 102 1.185 12.791 -2.089 1.00 0.00 H new ATOM 0 HG3 GLN A 102 1.670 12.415 -0.447 1.00 0.00 H new ATOM 0 HE21 GLN A 102 2.884 13.147 -3.696 1.00 0.00 H new ATOM 0 HE22 GLN A 102 4.374 13.958 -3.203 1.00 0.00 H new ATOM 1534 N PHE A 103 -1.070 10.673 -0.561 1.00 0.00 N ATOM 1535 CA PHE A 103 -2.464 10.995 -0.811 1.00 0.00 C ATOM 1536 C PHE A 103 -2.716 12.496 -0.656 1.00 0.00 C ATOM 1537 O PHE A 103 -2.834 12.998 0.461 1.00 0.00 O ATOM 1538 CB PHE A 103 -3.292 10.241 0.231 1.00 0.00 C ATOM 1539 CG PHE A 103 -3.149 8.720 0.158 1.00 0.00 C ATOM 1540 CD1 PHE A 103 -3.921 8.005 -0.703 1.00 0.00 C ATOM 1541 CD2 PHE A 103 -2.249 8.082 0.954 1.00 0.00 C ATOM 1542 CE1 PHE A 103 -3.788 6.592 -0.772 1.00 0.00 C ATOM 1543 CE2 PHE A 103 -2.116 6.670 0.885 1.00 0.00 C ATOM 1544 CZ PHE A 103 -2.888 5.955 0.024 1.00 0.00 C ATOM 0 H PHE A 103 -0.779 10.766 0.412 1.00 0.00 H new ATOM 0 HA PHE A 103 -2.734 10.711 -1.828 1.00 0.00 H new ATOM 0 HB2 PHE A 103 -2.997 10.576 1.226 1.00 0.00 H new ATOM 0 HB3 PHE A 103 -4.342 10.503 0.104 1.00 0.00 H new ATOM 0 HD1 PHE A 103 -4.636 8.511 -1.335 1.00 0.00 H new ATOM 0 HD2 PHE A 103 -1.636 8.649 1.638 1.00 0.00 H new ATOM 0 HE1 PHE A 103 -4.401 6.024 -1.456 1.00 0.00 H new ATOM 0 HE2 PHE A 103 -1.401 6.164 1.517 1.00 0.00 H new ATOM 0 HZ PHE A 103 -2.786 4.881 -0.028 1.00 0.00 H new ATOM 1554 N GLY A 104 -2.792 13.172 -1.794 1.00 0.00 N ATOM 1555 CA GLY A 104 -3.027 14.606 -1.798 1.00 0.00 C ATOM 1556 C GLY A 104 -1.769 15.369 -1.381 1.00 0.00 C ATOM 1557 O GLY A 104 -1.857 16.401 -0.716 1.00 0.00 O ATOM 0 H GLY A 104 -2.695 12.753 -2.719 1.00 0.00 H new ATOM 0 HA2 GLY A 104 -3.337 14.925 -2.793 1.00 0.00 H new ATOM 0 HA3 GLY A 104 -3.844 14.846 -1.118 1.00 0.00 H new ATOM 1561 N THR A 105 -0.628 14.834 -1.788 1.00 0.00 N ATOM 1562 CA THR A 105 0.647 15.452 -1.465 1.00 0.00 C ATOM 1563 C THR A 105 0.614 16.031 -0.049 1.00 0.00 C ATOM 1564 O THR A 105 0.941 17.199 0.155 1.00 0.00 O ATOM 1565 CB THR A 105 0.953 16.495 -2.541 1.00 0.00 C ATOM 1566 OG1 THR A 105 0.051 17.562 -2.257 1.00 0.00 O ATOM 1567 CG2 THR A 105 0.549 16.028 -3.941 1.00 0.00 C ATOM 0 H THR A 105 -0.559 13.978 -2.339 1.00 0.00 H new ATOM 0 HA THR A 105 1.454 14.719 -1.465 1.00 0.00 H new ATOM 0 HB THR A 105 2.018 16.727 -2.529 1.00 0.00 H new ATOM 0 HG1 THR A 105 0.336 18.023 -1.440 1.00 0.00 H new ATOM 0 HG21 THR A 105 0.788 16.805 -4.667 1.00 0.00 H new ATOM 0 HG22 THR A 105 1.093 15.118 -4.192 1.00 0.00 H new ATOM 0 HG23 THR A 105 -0.522 15.828 -3.963 1.00 0.00 H new ATOM 1575 N SER A 106 0.218 15.187 0.892 1.00 0.00 N ATOM 1576 CA SER A 106 0.139 15.600 2.283 1.00 0.00 C ATOM 1577 C SER A 106 0.238 14.379 3.199 1.00 0.00 C ATOM 1578 O SER A 106 1.086 14.332 4.088 1.00 0.00 O ATOM 1579 CB SER A 106 -1.157 16.366 2.557 1.00 0.00 C ATOM 1580 OG SER A 106 -1.089 17.116 3.767 1.00 0.00 O ATOM 0 H SER A 106 -0.052 14.219 0.719 1.00 0.00 H new ATOM 0 HA SER A 106 0.975 16.268 2.489 1.00 0.00 H new ATOM 0 HB2 SER A 106 -1.363 17.039 1.725 1.00 0.00 H new ATOM 0 HB3 SER A 106 -1.988 15.663 2.612 1.00 0.00 H new ATOM 0 HG SER A 106 -1.985 17.189 4.158 1.00 0.00 H new ATOM 1586 N HIS A 107 -0.642 13.420 2.949 1.00 0.00 N ATOM 1587 CA HIS A 107 -0.665 12.201 3.740 1.00 0.00 C ATOM 1588 C HIS A 107 0.194 11.132 3.060 1.00 0.00 C ATOM 1589 O HIS A 107 -0.259 10.468 2.129 1.00 0.00 O ATOM 1590 CB HIS A 107 -2.102 11.739 3.986 1.00 0.00 C ATOM 1591 CG HIS A 107 -2.755 12.377 5.188 1.00 0.00 C ATOM 1592 ND1 HIS A 107 -3.006 11.686 6.361 1.00 0.00 N ATOM 1593 CD2 HIS A 107 -3.206 13.649 5.387 1.00 0.00 C ATOM 1594 CE1 HIS A 107 -3.582 12.514 7.220 1.00 0.00 C ATOM 1595 NE2 HIS A 107 -3.705 13.730 6.614 1.00 0.00 N ATOM 0 H HIS A 107 -1.344 13.463 2.210 1.00 0.00 H new ATOM 0 HA HIS A 107 -0.234 12.393 4.723 1.00 0.00 H new ATOM 0 HB2 HIS A 107 -2.700 11.959 3.101 1.00 0.00 H new ATOM 0 HB3 HIS A 107 -2.108 10.657 4.114 1.00 0.00 H new ATOM 0 HD2 HIS A 107 -3.164 14.454 4.668 1.00 0.00 H new ATOM 0 HE1 HIS A 107 -3.898 12.269 8.223 1.00 0.00 H new ATOM 0 HE2 HIS A 107 -4.113 14.564 7.035 1.00 0.00 H new ATOM 1603 N VAL A 108 1.417 11.000 3.552 1.00 0.00 N ATOM 1604 CA VAL A 108 2.342 10.023 3.004 1.00 0.00 C ATOM 1605 C VAL A 108 2.397 8.804 3.927 1.00 0.00 C ATOM 1606 O VAL A 108 2.511 8.948 5.144 1.00 0.00 O ATOM 1607 CB VAL A 108 3.712 10.667 2.782 1.00 0.00 C ATOM 1608 CG1 VAL A 108 4.794 9.602 2.590 1.00 0.00 C ATOM 1609 CG2 VAL A 108 3.678 11.634 1.596 1.00 0.00 C ATOM 0 H VAL A 108 1.789 11.553 4.324 1.00 0.00 H new ATOM 0 HA VAL A 108 1.998 9.677 2.029 1.00 0.00 H new ATOM 0 HB VAL A 108 3.961 11.241 3.675 1.00 0.00 H new ATOM 0 HG11 VAL A 108 5.758 10.087 2.434 1.00 0.00 H new ATOM 0 HG12 VAL A 108 4.845 8.971 3.477 1.00 0.00 H new ATOM 0 HG13 VAL A 108 4.551 8.989 1.722 1.00 0.00 H new ATOM 0 HG21 VAL A 108 4.664 12.078 1.460 1.00 0.00 H new ATOM 0 HG22 VAL A 108 3.396 11.092 0.693 1.00 0.00 H new ATOM 0 HG23 VAL A 108 2.949 12.421 1.789 1.00 0.00 H new ATOM 1619 N PHE A 109 2.314 7.633 3.314 1.00 0.00 N ATOM 1620 CA PHE A 109 2.353 6.390 4.066 1.00 0.00 C ATOM 1621 C PHE A 109 3.253 5.361 3.379 1.00 0.00 C ATOM 1622 O PHE A 109 3.482 5.439 2.173 1.00 0.00 O ATOM 1623 CB PHE A 109 0.922 5.850 4.111 1.00 0.00 C ATOM 1624 CG PHE A 109 0.045 6.500 5.183 1.00 0.00 C ATOM 1625 CD1 PHE A 109 -0.313 7.808 5.067 1.00 0.00 C ATOM 1626 CD2 PHE A 109 -0.378 5.772 6.250 1.00 0.00 C ATOM 1627 CE1 PHE A 109 -1.127 8.412 6.061 1.00 0.00 C ATOM 1628 CE2 PHE A 109 -1.192 6.376 7.244 1.00 0.00 C ATOM 1629 CZ PHE A 109 -1.550 7.683 7.129 1.00 0.00 C ATOM 0 H PHE A 109 2.220 7.518 2.305 1.00 0.00 H new ATOM 0 HA PHE A 109 2.751 6.571 5.064 1.00 0.00 H new ATOM 0 HB2 PHE A 109 0.457 5.999 3.136 1.00 0.00 H new ATOM 0 HB3 PHE A 109 0.956 4.775 4.287 1.00 0.00 H new ATOM 0 HD1 PHE A 109 0.022 8.386 4.219 1.00 0.00 H new ATOM 0 HD2 PHE A 109 -0.095 4.734 6.342 1.00 0.00 H new ATOM 0 HE1 PHE A 109 -1.410 9.450 5.969 1.00 0.00 H new ATOM 0 HE2 PHE A 109 -1.527 5.797 8.092 1.00 0.00 H new ATOM 0 HZ PHE A 109 -2.170 8.142 7.885 1.00 0.00 H new ATOM 1639 N LYS A 110 3.738 4.420 4.176 1.00 0.00 N ATOM 1640 CA LYS A 110 4.607 3.377 3.659 1.00 0.00 C ATOM 1641 C LYS A 110 3.928 2.018 3.838 1.00 0.00 C ATOM 1642 O LYS A 110 3.601 1.626 4.958 1.00 0.00 O ATOM 1643 CB LYS A 110 5.991 3.464 4.306 1.00 0.00 C ATOM 1644 CG LYS A 110 6.896 2.330 3.819 1.00 0.00 C ATOM 1645 CD LYS A 110 7.371 1.467 4.990 1.00 0.00 C ATOM 1646 CE LYS A 110 8.569 2.109 5.693 1.00 0.00 C ATOM 1647 NZ LYS A 110 8.583 1.745 7.128 1.00 0.00 N ATOM 0 H LYS A 110 3.546 4.358 5.176 1.00 0.00 H new ATOM 0 HA LYS A 110 4.771 3.513 2.590 1.00 0.00 H new ATOM 0 HB2 LYS A 110 6.447 4.425 4.070 1.00 0.00 H new ATOM 0 HB3 LYS A 110 5.893 3.416 5.391 1.00 0.00 H new ATOM 0 HG2 LYS A 110 6.356 1.711 3.102 1.00 0.00 H new ATOM 0 HG3 LYS A 110 7.757 2.746 3.296 1.00 0.00 H new ATOM 0 HD2 LYS A 110 6.556 1.333 5.702 1.00 0.00 H new ATOM 0 HD3 LYS A 110 7.645 0.476 4.628 1.00 0.00 H new ATOM 0 HE2 LYS A 110 9.495 1.782 5.219 1.00 0.00 H new ATOM 0 HE3 LYS A 110 8.523 3.193 5.587 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 9.562 1.574 7.433 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 8.177 2.522 7.687 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 8.020 0.883 7.273 1.00 0.00 H new ATOM 1661 N PHE A 111 3.736 1.336 2.719 1.00 0.00 N ATOM 1662 CA PHE A 111 3.102 0.029 2.738 1.00 0.00 C ATOM 1663 C PHE A 111 4.140 -1.082 2.910 1.00 0.00 C ATOM 1664 O PHE A 111 5.194 -1.054 2.277 1.00 0.00 O ATOM 1665 CB PHE A 111 2.401 -0.148 1.390 1.00 0.00 C ATOM 1666 CG PHE A 111 1.873 -1.563 1.144 1.00 0.00 C ATOM 1667 CD1 PHE A 111 2.742 -2.579 0.893 1.00 0.00 C ATOM 1668 CD2 PHE A 111 0.535 -1.805 1.176 1.00 0.00 C ATOM 1669 CE1 PHE A 111 2.252 -3.892 0.665 1.00 0.00 C ATOM 1670 CE2 PHE A 111 0.046 -3.119 0.948 1.00 0.00 C ATOM 1671 CZ PHE A 111 0.914 -4.134 0.697 1.00 0.00 C ATOM 0 H PHE A 111 4.009 1.664 1.792 1.00 0.00 H new ATOM 0 HA PHE A 111 2.402 -0.033 3.571 1.00 0.00 H new ATOM 0 HB2 PHE A 111 1.570 0.555 1.329 1.00 0.00 H new ATOM 0 HB3 PHE A 111 3.097 0.113 0.593 1.00 0.00 H new ATOM 0 HD1 PHE A 111 3.804 -2.387 0.867 1.00 0.00 H new ATOM 0 HD2 PHE A 111 -0.155 -0.999 1.375 1.00 0.00 H new ATOM 0 HE1 PHE A 111 2.942 -4.699 0.466 1.00 0.00 H new ATOM 0 HE2 PHE A 111 -1.016 -3.312 0.974 1.00 0.00 H new ATOM 0 HZ PHE A 111 0.541 -5.133 0.523 1.00 0.00 H new ATOM 1681 N VAL A 112 3.805 -2.033 3.768 1.00 0.00 N ATOM 1682 CA VAL A 112 4.695 -3.151 4.031 1.00 0.00 C ATOM 1683 C VAL A 112 3.889 -4.452 4.024 1.00 0.00 C ATOM 1684 O VAL A 112 2.703 -4.453 4.349 1.00 0.00 O ATOM 1685 CB VAL A 112 5.449 -2.923 5.343 1.00 0.00 C ATOM 1686 CG1 VAL A 112 6.083 -4.222 5.844 1.00 0.00 C ATOM 1687 CG2 VAL A 112 6.502 -1.824 5.185 1.00 0.00 C ATOM 0 H VAL A 112 2.929 -2.053 4.291 1.00 0.00 H new ATOM 0 HA VAL A 112 5.449 -3.231 3.248 1.00 0.00 H new ATOM 0 HB VAL A 112 4.728 -2.592 6.091 1.00 0.00 H new ATOM 0 HG11 VAL A 112 6.613 -4.032 6.778 1.00 0.00 H new ATOM 0 HG12 VAL A 112 5.304 -4.965 6.014 1.00 0.00 H new ATOM 0 HG13 VAL A 112 6.785 -4.596 5.098 1.00 0.00 H new ATOM 0 HG21 VAL A 112 7.024 -1.681 6.131 1.00 0.00 H new ATOM 0 HG22 VAL A 112 7.218 -2.114 4.416 1.00 0.00 H new ATOM 0 HG23 VAL A 112 6.015 -0.893 4.895 1.00 0.00 H new ATOM 1697 N ASP A 113 4.566 -5.528 3.649 1.00 0.00 N ATOM 1698 CA ASP A 113 3.927 -6.832 3.596 1.00 0.00 C ATOM 1699 C ASP A 113 4.651 -7.789 4.545 1.00 0.00 C ATOM 1700 O ASP A 113 5.727 -8.292 4.224 1.00 0.00 O ATOM 1701 CB ASP A 113 3.997 -7.422 2.186 1.00 0.00 C ATOM 1702 CG ASP A 113 3.714 -8.923 2.098 1.00 0.00 C ATOM 1703 OD1 ASP A 113 2.533 -9.289 2.284 1.00 0.00 O ATOM 1704 OD2 ASP A 113 4.684 -9.670 1.846 1.00 0.00 O ATOM 0 H ASP A 113 5.550 -5.523 3.379 1.00 0.00 H new ATOM 0 HA ASP A 113 2.883 -6.708 3.884 1.00 0.00 H new ATOM 0 HB2 ASP A 113 3.283 -6.895 1.552 1.00 0.00 H new ATOM 0 HB3 ASP A 113 4.989 -7.230 1.777 1.00 0.00 H new ATOM 1709 N PRO A 114 4.016 -8.018 5.725 1.00 0.00 N ATOM 1710 CA PRO A 114 4.588 -8.906 6.723 1.00 0.00 C ATOM 1711 C PRO A 114 4.425 -10.371 6.311 1.00 0.00 C ATOM 1712 O PRO A 114 5.122 -11.245 6.825 1.00 0.00 O ATOM 1713 CB PRO A 114 3.860 -8.568 8.014 1.00 0.00 C ATOM 1714 CG PRO A 114 2.593 -7.838 7.599 1.00 0.00 C ATOM 1715 CD PRO A 114 2.741 -7.441 6.139 1.00 0.00 C ATOM 0 HA PRO A 114 5.663 -8.770 6.840 1.00 0.00 H new ATOM 0 HB2 PRO A 114 3.624 -9.471 8.577 1.00 0.00 H new ATOM 0 HB3 PRO A 114 4.478 -7.943 8.659 1.00 0.00 H new ATOM 0 HG2 PRO A 114 1.722 -8.479 7.734 1.00 0.00 H new ATOM 0 HG3 PRO A 114 2.439 -6.956 8.221 1.00 0.00 H new ATOM 0 HD2 PRO A 114 1.918 -7.828 5.538 1.00 0.00 H new ATOM 0 HD3 PRO A 114 2.740 -6.357 6.021 1.00 0.00 H new ATOM 1723 N SER A 115 3.502 -10.594 5.388 1.00 0.00 N ATOM 1724 CA SER A 115 3.239 -11.938 4.901 1.00 0.00 C ATOM 1725 C SER A 115 4.493 -12.507 4.236 1.00 0.00 C ATOM 1726 O SER A 115 4.916 -13.620 4.548 1.00 0.00 O ATOM 1727 CB SER A 115 2.066 -11.948 3.920 1.00 0.00 C ATOM 1728 OG SER A 115 1.719 -13.270 3.517 1.00 0.00 O ATOM 0 H SER A 115 2.926 -9.867 4.964 1.00 0.00 H new ATOM 0 HA SER A 115 2.971 -12.565 5.752 1.00 0.00 H new ATOM 0 HB2 SER A 115 1.202 -11.472 4.383 1.00 0.00 H new ATOM 0 HB3 SER A 115 2.323 -11.357 3.041 1.00 0.00 H new ATOM 0 HG SER A 115 0.965 -13.234 2.892 1.00 0.00 H new ATOM 1734 N GLY A 116 5.054 -11.719 3.330 1.00 0.00 N ATOM 1735 CA GLY A 116 6.251 -12.132 2.618 1.00 0.00 C ATOM 1736 C GLY A 116 5.960 -12.338 1.130 1.00 0.00 C ATOM 1737 O GLY A 116 4.882 -12.803 0.763 1.00 0.00 O ATOM 0 H GLY A 116 4.701 -10.797 3.073 1.00 0.00 H new ATOM 0 HA2 GLY A 116 7.029 -11.378 2.739 1.00 0.00 H new ATOM 0 HA3 GLY A 116 6.634 -13.057 3.049 1.00 0.00 H new ATOM 1741 N PRO A 117 6.967 -11.974 0.291 1.00 0.00 N ATOM 1742 CA PRO A 117 6.829 -12.115 -1.149 1.00 0.00 C ATOM 1743 C PRO A 117 6.961 -13.579 -1.571 1.00 0.00 C ATOM 1744 O PRO A 117 8.028 -14.175 -1.435 1.00 0.00 O ATOM 1745 CB PRO A 117 7.915 -11.227 -1.736 1.00 0.00 C ATOM 1746 CG PRO A 117 8.911 -10.989 -0.613 1.00 0.00 C ATOM 1747 CD PRO A 117 8.258 -11.420 0.690 1.00 0.00 C ATOM 0 HA PRO A 117 5.846 -11.812 -1.510 1.00 0.00 H new ATOM 0 HB2 PRO A 117 8.395 -11.708 -2.588 1.00 0.00 H new ATOM 0 HB3 PRO A 117 7.498 -10.286 -2.095 1.00 0.00 H new ATOM 0 HG2 PRO A 117 9.825 -11.556 -0.787 1.00 0.00 H new ATOM 0 HG3 PRO A 117 9.192 -9.937 -0.569 1.00 0.00 H new ATOM 0 HD2 PRO A 117 8.864 -12.162 1.210 1.00 0.00 H new ATOM 0 HD3 PRO A 117 8.134 -10.576 1.369 1.00 0.00 H new ATOM 1755 N SER A 118 5.860 -14.117 -2.076 1.00 0.00 N ATOM 1756 CA SER A 118 5.839 -15.501 -2.520 1.00 0.00 C ATOM 1757 C SER A 118 4.881 -15.657 -3.702 1.00 0.00 C ATOM 1758 O SER A 118 3.664 -15.659 -3.523 1.00 0.00 O ATOM 1759 CB SER A 118 5.434 -16.438 -1.380 1.00 0.00 C ATOM 1760 OG SER A 118 4.133 -16.141 -0.881 1.00 0.00 O ATOM 0 H SER A 118 4.976 -13.620 -2.188 1.00 0.00 H new ATOM 0 HA SER A 118 6.845 -15.774 -2.839 1.00 0.00 H new ATOM 0 HB2 SER A 118 5.461 -17.469 -1.732 1.00 0.00 H new ATOM 0 HB3 SER A 118 6.160 -16.359 -0.570 1.00 0.00 H new ATOM 0 HG SER A 118 3.546 -15.893 -1.625 1.00 0.00 H new ATOM 1766 N SER A 119 5.465 -15.784 -4.884 1.00 0.00 N ATOM 1767 CA SER A 119 4.678 -15.940 -6.095 1.00 0.00 C ATOM 1768 C SER A 119 3.627 -14.831 -6.183 1.00 0.00 C ATOM 1769 O SER A 119 2.582 -14.910 -5.540 1.00 0.00 O ATOM 1770 CB SER A 119 4.006 -17.313 -6.142 1.00 0.00 C ATOM 1771 OG SER A 119 4.764 -18.253 -6.900 1.00 0.00 O ATOM 0 H SER A 119 6.475 -15.782 -5.029 1.00 0.00 H new ATOM 0 HA SER A 119 5.349 -15.865 -6.951 1.00 0.00 H new ATOM 0 HB2 SER A 119 3.875 -17.687 -5.127 1.00 0.00 H new ATOM 0 HB3 SER A 119 3.011 -17.215 -6.576 1.00 0.00 H new ATOM 0 HG SER A 119 4.303 -19.118 -6.905 1.00 0.00 H new ATOM 1777 N GLY A 120 3.942 -13.824 -6.984 1.00 0.00 N ATOM 1778 CA GLY A 120 3.037 -12.701 -7.164 1.00 0.00 C ATOM 1779 C GLY A 120 3.751 -11.374 -6.897 1.00 0.00 C ATOM 1780 O GLY A 120 4.506 -10.891 -7.740 1.00 0.00 O ATOM 0 H GLY A 120 4.810 -13.762 -7.515 1.00 0.00 H new ATOM 0 HA2 GLY A 120 2.641 -12.707 -8.180 1.00 0.00 H new ATOM 0 HA3 GLY A 120 2.187 -12.803 -6.490 1.00 0.00 H new TER 1784 GLY A 120