USER MOD reduce.3.24.130724 H: found=0, std=0, add=525, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 525 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 46 ASN : amide:sc= -0.715 K(o=-1.1,f=-9.1!) USER MOD Set 1.2: A 47 THR OG1 : rot 10:sc= -0.34! USER MOD Single : A 1 THR N :NH3+ -150:sc= 0.00592 (180deg=0) USER MOD Single : A 1 THR OG1 : rot 180:sc= -0.749 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 HIS : no HE2:sc= -0.675 K(o=-0.67,f=-1.3) USER MOD Single : A 7 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 LYS NZ :NH3+ 163:sc= -0.045 (180deg=-0.456) USER MOD Single : A 14 ASN : amide:sc= -1.1 K(o=-1.1,f=-3.8!) USER MOD Single : A 15 THR OG1 : rot 180:sc= 0.13 USER MOD Single : A 17 THR OG1 : rot 180:sc= 0 USER MOD Single : A 20 THR OG1 : rot 85:sc= 1.21 USER MOD Single : A 21 GLN : amide:sc= -0.199 K(o=-0.2,f=-1.5!) USER MOD Single : A 25 ASN : amide:sc= -0.0481 X(o=-0.048,f=0) USER MOD Single : A 29 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 30 SER OG : rot -52:sc= 1.22 USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 32 ASN : amide:sc= -0.33 K(o=-0.33,f=-5.1!) USER MOD Single : A 33 ASN : amide:sc= -0.0634 K(o=-0.063,f=-1.9!) USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 41 THR OG1 : rot 180:sc= -0.084 USER MOD Single : A 42 ASN : amide:sc= -0.0761 K(o=-0.076,f=-5!) USER MOD Single : A 45 SER OG : rot 180:sc= 0 USER MOD Single : A 48 TYR OH : rot 180:sc= -0.204 USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 ASN : amide:sc= -0.0111 X(o=-0.011,f=-0.011) USER MOD Single : A 58 LYS NZ :NH3+ -142:sc= 0 (180deg=-0.00854) USER MOD Single : A 63 ASN : amide:sc= -4.69 K(o=-4.7,f=-6.4!) USER MOD Single : A 64 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 1 -3.445 -3.679 -0.867 1.00 0.00 N ATOM 2 CA THR A 1 -2.404 -4.141 0.094 1.00 0.00 C ATOM 3 C THR A 1 -1.752 -2.922 0.748 1.00 0.00 C ATOM 4 O THR A 1 -1.851 -1.808 0.234 1.00 0.00 O ATOM 5 CB THR A 1 -1.364 -4.983 -0.662 1.00 0.00 C ATOM 6 OG1 THR A 1 -1.170 -6.213 0.020 1.00 0.00 O ATOM 7 CG2 THR A 1 -0.030 -4.235 -0.755 1.00 0.00 C ATOM 0 H1 THR A 1 -4.201 -4.391 -0.928 1.00 0.00 H new ATOM 0 H2 THR A 1 -3.845 -2.777 -0.539 1.00 0.00 H new ATOM 0 H3 THR A 1 -3.017 -3.547 -1.806 1.00 0.00 H new ATOM 0 HA THR A 1 -2.849 -4.757 0.875 1.00 0.00 H new ATOM 0 HB THR A 1 -1.730 -5.171 -1.671 1.00 0.00 H new ATOM 0 HG1 THR A 1 -0.508 -6.753 -0.461 1.00 0.00 H new ATOM 0 HG21 THR A 1 0.694 -4.847 -1.294 1.00 0.00 H new ATOM 0 HG22 THR A 1 -0.176 -3.295 -1.286 1.00 0.00 H new ATOM 0 HG23 THR A 1 0.343 -4.031 0.248 1.00 0.00 H new ATOM 17 N PRO A 2 -1.096 -3.111 1.865 1.00 0.00 N ATOM 18 CA PRO A 2 -0.423 -2.000 2.599 1.00 0.00 C ATOM 19 C PRO A 2 0.865 -1.552 1.914 1.00 0.00 C ATOM 20 O PRO A 2 1.248 -2.092 0.876 1.00 0.00 O ATOM 21 CB PRO A 2 -0.132 -2.600 3.975 1.00 0.00 C ATOM 22 CG PRO A 2 -0.028 -4.072 3.749 1.00 0.00 C ATOM 23 CD PRO A 2 -0.923 -4.402 2.551 1.00 0.00 C ATOM 0 HA PRO A 2 -1.042 -1.104 2.642 1.00 0.00 H new ATOM 0 HB2 PRO A 2 0.793 -2.200 4.391 1.00 0.00 H new ATOM 0 HB3 PRO A 2 -0.928 -2.366 4.682 1.00 0.00 H new ATOM 0 HG2 PRO A 2 1.004 -4.360 3.551 1.00 0.00 H new ATOM 0 HG3 PRO A 2 -0.348 -4.622 4.634 1.00 0.00 H new ATOM 0 HD2 PRO A 2 -0.459 -5.141 1.898 1.00 0.00 H new ATOM 0 HD3 PRO A 2 -1.880 -4.815 2.870 1.00 0.00 H new ATOM 31 N ILE A 3 1.530 -0.563 2.502 1.00 0.00 N ATOM 32 CA ILE A 3 2.774 -0.050 1.940 1.00 0.00 C ATOM 33 C ILE A 3 3.878 -1.097 2.040 1.00 0.00 C ATOM 34 O ILE A 3 4.024 -1.763 3.065 1.00 0.00 O ATOM 35 CB ILE A 3 3.200 1.216 2.685 1.00 0.00 C ATOM 36 CG1 ILE A 3 4.403 1.846 1.975 1.00 0.00 C ATOM 37 CG2 ILE A 3 3.588 0.858 4.120 1.00 0.00 C ATOM 38 CD1 ILE A 3 3.952 2.467 0.650 1.00 0.00 C ATOM 0 H ILE A 3 1.231 -0.103 3.362 1.00 0.00 H new ATOM 0 HA ILE A 3 2.607 0.186 0.889 1.00 0.00 H new ATOM 0 HB ILE A 3 2.372 1.925 2.698 1.00 0.00 H new ATOM 0 HG12 ILE A 3 4.854 2.608 2.610 1.00 0.00 H new ATOM 0 HG13 ILE A 3 5.167 1.090 1.792 1.00 0.00 H new ATOM 0 HG21 ILE A 3 3.892 1.760 4.651 1.00 0.00 H new ATOM 0 HG22 ILE A 3 2.734 0.409 4.627 1.00 0.00 H new ATOM 0 HG23 ILE A 3 4.416 0.149 4.107 1.00 0.00 H new ATOM 0 HD11 ILE A 3 4.810 2.914 0.147 1.00 0.00 H new ATOM 0 HD12 ILE A 3 3.521 1.694 0.014 1.00 0.00 H new ATOM 0 HD13 ILE A 3 3.204 3.236 0.844 1.00 0.00 H new ATOM 50 N GLU A 4 4.652 -1.239 0.969 1.00 0.00 N ATOM 51 CA GLU A 4 5.738 -2.211 0.947 1.00 0.00 C ATOM 52 C GLU A 4 6.892 -1.709 0.085 1.00 0.00 C ATOM 53 O GLU A 4 6.734 -0.768 -0.694 1.00 0.00 O ATOM 54 CB GLU A 4 5.233 -3.547 0.401 1.00 0.00 C ATOM 55 CG GLU A 4 4.834 -3.382 -1.067 1.00 0.00 C ATOM 56 CD GLU A 4 4.223 -4.678 -1.590 1.00 0.00 C ATOM 57 OE1 GLU A 4 4.127 -5.618 -0.819 1.00 0.00 O ATOM 58 OE2 GLU A 4 3.861 -4.711 -2.755 1.00 0.00 O ATOM 0 H GLU A 4 4.548 -0.697 0.111 1.00 0.00 H new ATOM 0 HA GLU A 4 6.097 -2.348 1.967 1.00 0.00 H new ATOM 0 HB2 GLU A 4 6.009 -4.307 0.494 1.00 0.00 H new ATOM 0 HB3 GLU A 4 4.379 -3.891 0.984 1.00 0.00 H new ATOM 0 HG2 GLU A 4 4.118 -2.566 -1.168 1.00 0.00 H new ATOM 0 HG3 GLU A 4 5.708 -3.116 -1.662 1.00 0.00 H new ATOM 65 N SER A 5 8.051 -2.342 0.229 1.00 0.00 N ATOM 66 CA SER A 5 9.226 -1.952 -0.541 1.00 0.00 C ATOM 67 C SER A 5 8.940 -2.044 -2.037 1.00 0.00 C ATOM 68 O SER A 5 8.123 -2.855 -2.474 1.00 0.00 O ATOM 69 CB SER A 5 10.405 -2.858 -0.188 1.00 0.00 C ATOM 70 OG SER A 5 10.710 -2.715 1.193 1.00 0.00 O ATOM 0 H SER A 5 8.202 -3.123 0.868 1.00 0.00 H new ATOM 0 HA SER A 5 9.475 -0.920 -0.293 1.00 0.00 H new ATOM 0 HB2 SER A 5 10.161 -3.896 -0.413 1.00 0.00 H new ATOM 0 HB3 SER A 5 11.273 -2.597 -0.793 1.00 0.00 H new ATOM 0 HG SER A 5 11.465 -3.296 1.423 1.00 0.00 H new ATOM 76 N HIS A 6 9.616 -1.206 -2.816 1.00 0.00 N ATOM 77 CA HIS A 6 9.424 -1.201 -4.262 1.00 0.00 C ATOM 78 C HIS A 6 10.374 -2.185 -4.945 1.00 0.00 C ATOM 79 O HIS A 6 10.631 -2.077 -6.144 1.00 0.00 O ATOM 80 CB HIS A 6 9.665 0.206 -4.814 1.00 0.00 C ATOM 81 CG HIS A 6 11.070 0.637 -4.494 1.00 0.00 C ATOM 82 ND1 HIS A 6 12.149 0.289 -5.292 1.00 0.00 N ATOM 83 CD2 HIS A 6 11.588 1.387 -3.468 1.00 0.00 C ATOM 84 CE1 HIS A 6 13.252 0.825 -4.737 1.00 0.00 C ATOM 85 NE2 HIS A 6 12.966 1.504 -3.623 1.00 0.00 N ATOM 0 H HIS A 6 10.296 -0.527 -2.474 1.00 0.00 H new ATOM 0 HA HIS A 6 8.399 -1.508 -4.469 1.00 0.00 H new ATOM 0 HB2 HIS A 6 9.507 0.217 -5.892 1.00 0.00 H new ATOM 0 HB3 HIS A 6 8.951 0.906 -4.380 1.00 0.00 H new ATOM 0 HD1 HIS A 6 12.114 -0.271 -6.144 1.00 0.00 H new ATOM 0 HD2 HIS A 6 11.014 1.821 -2.663 1.00 0.00 H new ATOM 0 HE1 HIS A 6 14.247 0.719 -5.143 1.00 0.00 H new ATOM 94 N GLN A 7 10.890 -3.143 -4.180 1.00 0.00 N ATOM 95 CA GLN A 7 11.807 -4.134 -4.735 1.00 0.00 C ATOM 96 C GLN A 7 11.046 -5.386 -5.158 1.00 0.00 C ATOM 97 O GLN A 7 10.872 -6.315 -4.369 1.00 0.00 O ATOM 98 CB GLN A 7 12.867 -4.505 -3.696 1.00 0.00 C ATOM 99 CG GLN A 7 14.039 -5.202 -4.390 1.00 0.00 C ATOM 100 CD GLN A 7 15.079 -5.625 -3.359 1.00 0.00 C ATOM 101 OE1 GLN A 7 15.046 -6.753 -2.869 1.00 0.00 O ATOM 102 NE2 GLN A 7 16.007 -4.781 -2.998 1.00 0.00 N ATOM 0 H GLN A 7 10.692 -3.254 -3.186 1.00 0.00 H new ATOM 0 HA GLN A 7 12.293 -3.703 -5.610 1.00 0.00 H new ATOM 0 HB2 GLN A 7 13.216 -3.610 -3.181 1.00 0.00 H new ATOM 0 HB3 GLN A 7 12.436 -5.161 -2.939 1.00 0.00 H new ATOM 0 HG2 GLN A 7 13.682 -6.074 -4.937 1.00 0.00 H new ATOM 0 HG3 GLN A 7 14.491 -4.531 -5.120 1.00 0.00 H new ATOM 0 HE21 GLN A 7 16.033 -3.846 -3.405 1.00 0.00 H new ATOM 0 HE22 GLN A 7 16.706 -5.056 -2.309 1.00 0.00 H new ATOM 111 N VAL A 8 10.593 -5.402 -6.408 1.00 0.00 N ATOM 112 CA VAL A 8 9.849 -6.545 -6.925 1.00 0.00 C ATOM 113 C VAL A 8 10.273 -6.857 -8.357 1.00 0.00 C ATOM 114 O VAL A 8 10.801 -5.996 -9.060 1.00 0.00 O ATOM 115 CB VAL A 8 8.349 -6.250 -6.889 1.00 0.00 C ATOM 116 CG1 VAL A 8 8.006 -5.211 -7.958 1.00 0.00 C ATOM 117 CG2 VAL A 8 7.569 -7.538 -7.163 1.00 0.00 C ATOM 0 H VAL A 8 10.727 -4.643 -7.076 1.00 0.00 H new ATOM 0 HA VAL A 8 10.065 -7.410 -6.297 1.00 0.00 H new ATOM 0 HB VAL A 8 8.080 -5.863 -5.906 1.00 0.00 H new ATOM 0 HG11 VAL A 8 6.937 -5.001 -7.932 1.00 0.00 H new ATOM 0 HG12 VAL A 8 8.561 -4.293 -7.764 1.00 0.00 H new ATOM 0 HG13 VAL A 8 8.276 -5.597 -8.941 1.00 0.00 H new ATOM 0 HG21 VAL A 8 6.500 -7.328 -7.137 1.00 0.00 H new ATOM 0 HG22 VAL A 8 7.839 -7.925 -8.145 1.00 0.00 H new ATOM 0 HG23 VAL A 8 7.812 -8.279 -6.402 1.00 0.00 H new ATOM 127 N GLU A 9 10.037 -8.094 -8.782 1.00 0.00 N ATOM 128 CA GLU A 9 10.398 -8.509 -10.132 1.00 0.00 C ATOM 129 C GLU A 9 9.341 -9.448 -10.704 1.00 0.00 C ATOM 130 O GLU A 9 8.547 -10.028 -9.963 1.00 0.00 O ATOM 131 CB GLU A 9 11.760 -9.210 -10.125 1.00 0.00 C ATOM 132 CG GLU A 9 11.958 -9.952 -8.799 1.00 0.00 C ATOM 133 CD GLU A 9 10.773 -10.874 -8.532 1.00 0.00 C ATOM 134 OE1 GLU A 9 10.420 -11.626 -9.426 1.00 0.00 O ATOM 135 OE2 GLU A 9 10.236 -10.815 -7.438 1.00 0.00 O ATOM 0 H GLU A 9 9.601 -8.821 -8.216 1.00 0.00 H new ATOM 0 HA GLU A 9 10.456 -7.619 -10.759 1.00 0.00 H new ATOM 0 HB2 GLU A 9 11.822 -9.911 -10.957 1.00 0.00 H new ATOM 0 HB3 GLU A 9 12.556 -8.479 -10.265 1.00 0.00 H new ATOM 0 HG2 GLU A 9 12.880 -10.532 -8.832 1.00 0.00 H new ATOM 0 HG3 GLU A 9 12.062 -9.235 -7.984 1.00 0.00 H new ATOM 142 N LYS A 10 9.336 -9.592 -12.025 1.00 0.00 N ATOM 143 CA LYS A 10 8.370 -10.462 -12.684 1.00 0.00 C ATOM 144 C LYS A 10 9.037 -11.253 -13.805 1.00 0.00 C ATOM 145 O LYS A 10 10.194 -11.008 -14.146 1.00 0.00 O ATOM 146 CB LYS A 10 7.222 -9.629 -13.258 1.00 0.00 C ATOM 147 CG LYS A 10 7.784 -8.363 -13.908 1.00 0.00 C ATOM 148 CD LYS A 10 7.681 -7.195 -12.925 1.00 0.00 C ATOM 149 CE LYS A 10 8.020 -5.890 -13.647 1.00 0.00 C ATOM 150 NZ LYS A 10 7.865 -4.746 -12.704 1.00 0.00 N ATOM 0 H LYS A 10 9.985 -9.121 -12.656 1.00 0.00 H new ATOM 0 HA LYS A 10 7.977 -11.161 -11.946 1.00 0.00 H new ATOM 0 HB2 LYS A 10 6.668 -10.212 -13.993 1.00 0.00 H new ATOM 0 HB3 LYS A 10 6.521 -9.364 -12.467 1.00 0.00 H new ATOM 0 HG2 LYS A 10 8.824 -8.520 -14.195 1.00 0.00 H new ATOM 0 HG3 LYS A 10 7.233 -8.134 -14.820 1.00 0.00 H new ATOM 0 HD2 LYS A 10 6.674 -7.143 -12.510 1.00 0.00 H new ATOM 0 HD3 LYS A 10 8.363 -7.348 -12.089 1.00 0.00 H new ATOM 0 HE2 LYS A 10 9.041 -5.927 -14.027 1.00 0.00 H new ATOM 0 HE3 LYS A 10 7.365 -5.757 -14.508 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 8.095 -3.858 -13.194 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 6.883 -4.708 -12.362 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 8.508 -4.872 -11.896 1.00 0.00 H new ATOM 164 N ARG A 11 8.298 -12.199 -14.373 1.00 0.00 N ATOM 165 CA ARG A 11 8.827 -13.019 -15.457 1.00 0.00 C ATOM 166 C ARG A 11 7.735 -13.315 -16.482 1.00 0.00 C ATOM 167 O ARG A 11 7.356 -14.466 -16.692 1.00 0.00 O ATOM 168 CB ARG A 11 9.424 -14.340 -14.925 1.00 0.00 C ATOM 169 CG ARG A 11 8.709 -14.826 -13.648 1.00 0.00 C ATOM 170 CD ARG A 11 7.345 -15.425 -14.002 1.00 0.00 C ATOM 171 NE ARG A 11 6.331 -14.378 -14.083 1.00 0.00 N ATOM 172 CZ ARG A 11 5.759 -13.867 -12.990 1.00 0.00 C ATOM 173 NH1 ARG A 11 6.095 -14.289 -11.797 1.00 0.00 N ATOM 174 NH2 ARG A 11 4.855 -12.934 -13.113 1.00 0.00 N ATOM 0 H ARG A 11 7.338 -12.416 -14.104 1.00 0.00 H new ATOM 0 HA ARG A 11 9.626 -12.456 -15.938 1.00 0.00 H new ATOM 0 HB2 ARG A 11 9.350 -15.107 -15.696 1.00 0.00 H new ATOM 0 HB3 ARG A 11 10.484 -14.200 -14.715 1.00 0.00 H new ATOM 0 HG2 ARG A 11 9.321 -15.572 -13.141 1.00 0.00 H new ATOM 0 HG3 ARG A 11 8.581 -13.994 -12.955 1.00 0.00 H new ATOM 0 HD2 ARG A 11 7.409 -15.952 -14.954 1.00 0.00 H new ATOM 0 HD3 ARG A 11 7.058 -16.160 -13.250 1.00 0.00 H new ATOM 0 HE ARG A 11 6.052 -14.027 -14.999 1.00 0.00 H new ATOM 0 HH11 ARG A 11 6.802 -15.017 -11.694 1.00 0.00 H new ATOM 0 HH12 ARG A 11 5.650 -13.890 -10.971 1.00 0.00 H new ATOM 0 HH21 ARG A 11 4.590 -12.600 -14.039 1.00 0.00 H new ATOM 0 HH22 ARG A 11 4.414 -12.539 -12.283 1.00 0.00 H new ATOM 188 N LYS A 12 7.235 -12.263 -17.121 1.00 0.00 N ATOM 189 CA LYS A 12 6.189 -12.417 -18.125 1.00 0.00 C ATOM 190 C LYS A 12 6.722 -12.077 -19.512 1.00 0.00 C ATOM 191 O LYS A 12 7.709 -11.355 -19.648 1.00 0.00 O ATOM 192 CB LYS A 12 5.007 -11.505 -17.791 1.00 0.00 C ATOM 193 CG LYS A 12 5.450 -10.042 -17.871 1.00 0.00 C ATOM 194 CD LYS A 12 4.282 -9.132 -17.484 1.00 0.00 C ATOM 195 CE LYS A 12 4.737 -7.671 -17.520 1.00 0.00 C ATOM 196 NZ LYS A 12 5.114 -7.299 -18.914 1.00 0.00 N ATOM 0 H LYS A 12 7.535 -11.301 -16.963 1.00 0.00 H new ATOM 0 HA LYS A 12 5.858 -13.456 -18.122 1.00 0.00 H new ATOM 0 HB2 LYS A 12 4.187 -11.686 -18.486 1.00 0.00 H new ATOM 0 HB3 LYS A 12 4.633 -11.728 -16.792 1.00 0.00 H new ATOM 0 HG2 LYS A 12 6.295 -9.870 -17.204 1.00 0.00 H new ATOM 0 HG3 LYS A 12 5.788 -9.808 -18.881 1.00 0.00 H new ATOM 0 HD2 LYS A 12 3.449 -9.281 -18.170 1.00 0.00 H new ATOM 0 HD3 LYS A 12 3.923 -9.387 -16.487 1.00 0.00 H new ATOM 0 HE2 LYS A 12 3.938 -7.022 -17.163 1.00 0.00 H new ATOM 0 HE3 LYS A 12 5.586 -7.527 -16.852 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 5.144 -6.263 -19.001 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 6.051 -7.692 -19.137 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 4.411 -7.682 -19.578 1.00 0.00 H new ATOM 210 N CYS A 13 6.062 -12.605 -20.538 1.00 0.00 N ATOM 211 CA CYS A 13 6.475 -12.356 -21.914 1.00 0.00 C ATOM 212 C CYS A 13 6.752 -10.873 -22.137 1.00 0.00 C ATOM 213 O CYS A 13 5.911 -10.022 -21.846 1.00 0.00 O ATOM 214 CB CYS A 13 5.380 -12.822 -22.875 1.00 0.00 C ATOM 215 SG CYS A 13 5.707 -12.163 -24.527 1.00 0.00 S ATOM 0 H CYS A 13 5.243 -13.205 -20.443 1.00 0.00 H new ATOM 0 HA CYS A 13 7.392 -12.914 -22.104 1.00 0.00 H new ATOM 0 HB2 CYS A 13 5.348 -13.911 -22.906 1.00 0.00 H new ATOM 0 HB3 CYS A 13 4.405 -12.484 -22.524 1.00 0.00 H new ATOM 220 N ASN A 14 7.938 -10.574 -22.657 1.00 0.00 N ATOM 221 CA ASN A 14 8.323 -9.192 -22.921 1.00 0.00 C ATOM 222 C ASN A 14 8.696 -8.992 -24.391 1.00 0.00 C ATOM 223 O ASN A 14 9.293 -7.977 -24.751 1.00 0.00 O ATOM 224 CB ASN A 14 9.511 -8.808 -22.036 1.00 0.00 C ATOM 225 CG ASN A 14 10.685 -9.747 -22.297 1.00 0.00 C ATOM 226 OD1 ASN A 14 11.096 -9.927 -23.443 1.00 0.00 O ATOM 227 ND2 ASN A 14 11.253 -10.361 -21.294 1.00 0.00 N ATOM 0 H ASN A 14 8.646 -11.266 -22.903 1.00 0.00 H new ATOM 0 HA ASN A 14 7.469 -8.553 -22.693 1.00 0.00 H new ATOM 0 HB2 ASN A 14 9.807 -7.779 -22.238 1.00 0.00 H new ATOM 0 HB3 ASN A 14 9.223 -8.857 -20.986 1.00 0.00 H new ATOM 0 HD21 ASN A 14 12.038 -10.991 -21.460 1.00 0.00 H new ATOM 0 HD22 ASN A 14 10.911 -10.211 -20.345 1.00 0.00 H new ATOM 234 N THR A 15 8.349 -9.961 -25.237 1.00 0.00 N ATOM 235 CA THR A 15 8.661 -9.870 -26.660 1.00 0.00 C ATOM 236 C THR A 15 8.083 -8.591 -27.263 1.00 0.00 C ATOM 237 O THR A 15 7.552 -7.740 -26.549 1.00 0.00 O ATOM 238 CB THR A 15 8.107 -11.093 -27.398 1.00 0.00 C ATOM 239 OG1 THR A 15 8.708 -11.179 -28.683 1.00 0.00 O ATOM 240 CG2 THR A 15 6.590 -10.968 -27.554 1.00 0.00 C ATOM 0 H THR A 15 7.856 -10.811 -24.964 1.00 0.00 H new ATOM 0 HA THR A 15 9.745 -9.843 -26.772 1.00 0.00 H new ATOM 0 HB THR A 15 8.334 -11.991 -26.823 1.00 0.00 H new ATOM 0 HG1 THR A 15 8.357 -11.962 -29.157 1.00 0.00 H new ATOM 0 HG21 THR A 15 6.205 -11.842 -28.080 1.00 0.00 H new ATOM 0 HG22 THR A 15 6.127 -10.904 -26.569 1.00 0.00 H new ATOM 0 HG23 THR A 15 6.356 -10.069 -28.124 1.00 0.00 H new ATOM 248 N ALA A 16 8.194 -8.461 -28.581 1.00 0.00 N ATOM 249 CA ALA A 16 7.685 -7.278 -29.270 1.00 0.00 C ATOM 250 C ALA A 16 6.171 -7.162 -29.110 1.00 0.00 C ATOM 251 O ALA A 16 5.659 -6.121 -28.697 1.00 0.00 O ATOM 252 CB ALA A 16 8.036 -7.352 -30.757 1.00 0.00 C ATOM 0 H ALA A 16 8.628 -9.154 -29.191 1.00 0.00 H new ATOM 0 HA ALA A 16 8.150 -6.398 -28.825 1.00 0.00 H new ATOM 0 HB1 ALA A 16 7.654 -6.467 -31.266 1.00 0.00 H new ATOM 0 HB2 ALA A 16 9.119 -7.398 -30.873 1.00 0.00 H new ATOM 0 HB3 ALA A 16 7.586 -8.244 -31.193 1.00 0.00 H new ATOM 258 N THR A 17 5.461 -8.234 -29.444 1.00 0.00 N ATOM 259 CA THR A 17 4.005 -8.239 -29.339 1.00 0.00 C ATOM 260 C THR A 17 3.563 -7.931 -27.911 1.00 0.00 C ATOM 261 O THR A 17 2.666 -7.116 -27.692 1.00 0.00 O ATOM 262 CB THR A 17 3.454 -9.603 -29.764 1.00 0.00 C ATOM 263 OG1 THR A 17 3.835 -9.867 -31.107 1.00 0.00 O ATOM 264 CG2 THR A 17 1.928 -9.595 -29.657 1.00 0.00 C ATOM 0 H THR A 17 5.865 -9.105 -29.787 1.00 0.00 H new ATOM 0 HA THR A 17 3.613 -7.466 -30.000 1.00 0.00 H new ATOM 0 HB THR A 17 3.857 -10.378 -29.112 1.00 0.00 H new ATOM 0 HG1 THR A 17 3.485 -10.740 -31.381 1.00 0.00 H new ATOM 0 HG21 THR A 17 1.537 -10.566 -29.960 1.00 0.00 H new ATOM 0 HG22 THR A 17 1.637 -9.392 -28.627 1.00 0.00 H new ATOM 0 HG23 THR A 17 1.522 -8.821 -30.308 1.00 0.00 H new ATOM 272 N CYS A 18 4.198 -8.583 -26.944 1.00 0.00 N ATOM 273 CA CYS A 18 3.862 -8.369 -25.541 1.00 0.00 C ATOM 274 C CYS A 18 4.162 -6.929 -25.136 1.00 0.00 C ATOM 275 O CYS A 18 3.388 -6.299 -24.416 1.00 0.00 O ATOM 276 CB CYS A 18 4.666 -9.328 -24.660 1.00 0.00 C ATOM 277 SG CYS A 18 4.089 -11.022 -24.933 1.00 0.00 S ATOM 0 H CYS A 18 4.944 -9.260 -27.104 1.00 0.00 H new ATOM 0 HA CYS A 18 2.797 -8.560 -25.406 1.00 0.00 H new ATOM 0 HB2 CYS A 18 5.728 -9.251 -24.895 1.00 0.00 H new ATOM 0 HB3 CYS A 18 4.551 -9.058 -23.610 1.00 0.00 H new ATOM 282 N ALA A 19 5.293 -6.416 -25.605 1.00 0.00 N ATOM 283 CA ALA A 19 5.695 -5.049 -25.291 1.00 0.00 C ATOM 284 C ALA A 19 4.799 -4.037 -26.006 1.00 0.00 C ATOM 285 O ALA A 19 4.725 -2.875 -25.609 1.00 0.00 O ATOM 286 CB ALA A 19 7.149 -4.825 -25.708 1.00 0.00 C ATOM 0 H ALA A 19 5.946 -6.923 -26.202 1.00 0.00 H new ATOM 0 HA ALA A 19 5.594 -4.904 -24.215 1.00 0.00 H new ATOM 0 HB1 ALA A 19 7.442 -3.802 -25.471 1.00 0.00 H new ATOM 0 HB2 ALA A 19 7.793 -5.521 -25.171 1.00 0.00 H new ATOM 0 HB3 ALA A 19 7.250 -4.992 -26.780 1.00 0.00 H new ATOM 292 N THR A 20 4.129 -4.480 -27.065 1.00 0.00 N ATOM 293 CA THR A 20 3.253 -3.593 -27.824 1.00 0.00 C ATOM 294 C THR A 20 1.897 -3.437 -27.138 1.00 0.00 C ATOM 295 O THR A 20 1.405 -2.321 -26.971 1.00 0.00 O ATOM 296 CB THR A 20 3.051 -4.141 -29.239 1.00 0.00 C ATOM 297 OG1 THR A 20 4.309 -4.239 -29.892 1.00 0.00 O ATOM 298 CG2 THR A 20 2.137 -3.201 -30.027 1.00 0.00 C ATOM 0 H THR A 20 4.174 -5.437 -27.415 1.00 0.00 H new ATOM 0 HA THR A 20 3.729 -2.614 -27.875 1.00 0.00 H new ATOM 0 HB THR A 20 2.592 -5.128 -29.184 1.00 0.00 H new ATOM 0 HG1 THR A 20 4.732 -5.092 -29.661 1.00 0.00 H new ATOM 0 HG21 THR A 20 1.994 -3.592 -31.034 1.00 0.00 H new ATOM 0 HG22 THR A 20 1.172 -3.127 -29.526 1.00 0.00 H new ATOM 0 HG23 THR A 20 2.593 -2.213 -30.083 1.00 0.00 H new ATOM 306 N GLN A 21 1.290 -4.556 -26.755 1.00 0.00 N ATOM 307 CA GLN A 21 -0.016 -4.516 -26.102 1.00 0.00 C ATOM 308 C GLN A 21 0.070 -3.829 -24.739 1.00 0.00 C ATOM 309 O GLN A 21 -0.888 -3.194 -24.297 1.00 0.00 O ATOM 310 CB GLN A 21 -0.569 -5.936 -25.938 1.00 0.00 C ATOM 311 CG GLN A 21 0.033 -6.591 -24.693 1.00 0.00 C ATOM 312 CD GLN A 21 -0.261 -8.087 -24.695 1.00 0.00 C ATOM 313 OE1 GLN A 21 0.396 -8.849 -25.404 1.00 0.00 O ATOM 314 NE2 GLN A 21 -1.216 -8.556 -23.939 1.00 0.00 N ATOM 0 H GLN A 21 1.675 -5.492 -26.883 1.00 0.00 H new ATOM 0 HA GLN A 21 -0.691 -3.938 -26.733 1.00 0.00 H new ATOM 0 HB2 GLN A 21 -1.655 -5.905 -25.853 1.00 0.00 H new ATOM 0 HB3 GLN A 21 -0.335 -6.531 -26.821 1.00 0.00 H new ATOM 0 HG2 GLN A 21 1.110 -6.424 -24.669 1.00 0.00 H new ATOM 0 HG3 GLN A 21 -0.381 -6.132 -23.795 1.00 0.00 H new ATOM 0 HE21 GLN A 21 -1.759 -7.923 -23.352 1.00 0.00 H new ATOM 0 HE22 GLN A 21 -1.419 -9.556 -23.935 1.00 0.00 H new ATOM 323 N ARG A 22 1.216 -3.956 -24.076 1.00 0.00 N ATOM 324 CA ARG A 22 1.393 -3.335 -22.767 1.00 0.00 C ATOM 325 C ARG A 22 1.626 -1.832 -22.911 1.00 0.00 C ATOM 326 O ARG A 22 1.368 -1.064 -21.983 1.00 0.00 O ATOM 327 CB ARG A 22 2.563 -3.989 -22.019 1.00 0.00 C ATOM 328 CG ARG A 22 3.898 -3.421 -22.511 1.00 0.00 C ATOM 329 CD ARG A 22 4.341 -2.276 -21.597 1.00 0.00 C ATOM 330 NE ARG A 22 5.466 -2.699 -20.767 1.00 0.00 N ATOM 331 CZ ARG A 22 6.710 -2.754 -21.246 1.00 0.00 C ATOM 332 NH1 ARG A 22 6.966 -2.427 -22.488 1.00 0.00 N ATOM 333 NH2 ARG A 22 7.684 -3.139 -20.468 1.00 0.00 N ATOM 0 H ARG A 22 2.025 -4.475 -24.417 1.00 0.00 H new ATOM 0 HA ARG A 22 0.482 -3.487 -22.188 1.00 0.00 H new ATOM 0 HB2 ARG A 22 2.460 -3.816 -20.948 1.00 0.00 H new ATOM 0 HB3 ARG A 22 2.542 -5.068 -22.171 1.00 0.00 H new ATOM 0 HG2 ARG A 22 4.656 -4.205 -22.521 1.00 0.00 H new ATOM 0 HG3 ARG A 22 3.796 -3.063 -23.535 1.00 0.00 H new ATOM 0 HD2 ARG A 22 4.627 -1.412 -22.197 1.00 0.00 H new ATOM 0 HD3 ARG A 22 3.510 -1.964 -20.964 1.00 0.00 H new ATOM 0 HE ARG A 22 5.296 -2.959 -19.796 1.00 0.00 H new ATOM 0 HH11 ARG A 22 6.210 -2.126 -23.102 1.00 0.00 H new ATOM 0 HH12 ARG A 22 7.922 -2.474 -22.841 1.00 0.00 H new ATOM 0 HH21 ARG A 22 7.492 -3.396 -19.500 1.00 0.00 H new ATOM 0 HH22 ARG A 22 8.637 -3.183 -20.828 1.00 0.00 H new ATOM 347 N LEU A 23 2.100 -1.416 -24.082 1.00 0.00 N ATOM 348 CA LEU A 23 2.347 -0.002 -24.335 1.00 0.00 C ATOM 349 C LEU A 23 1.057 0.688 -24.768 1.00 0.00 C ATOM 350 O LEU A 23 0.886 1.890 -24.569 1.00 0.00 O ATOM 351 CB LEU A 23 3.409 0.155 -25.428 1.00 0.00 C ATOM 352 CG LEU A 23 3.709 1.640 -25.656 1.00 0.00 C ATOM 353 CD1 LEU A 23 4.358 2.234 -24.403 1.00 0.00 C ATOM 354 CD2 LEU A 23 4.665 1.787 -26.842 1.00 0.00 C ATOM 0 H LEU A 23 2.319 -2.033 -24.864 1.00 0.00 H new ATOM 0 HA LEU A 23 2.706 0.461 -23.416 1.00 0.00 H new ATOM 0 HB2 LEU A 23 4.320 -0.369 -25.139 1.00 0.00 H new ATOM 0 HB3 LEU A 23 3.060 -0.301 -26.355 1.00 0.00 H new ATOM 0 HG LEU A 23 2.779 2.169 -25.866 1.00 0.00 H new ATOM 0 HD11 LEU A 23 4.570 3.290 -24.569 1.00 0.00 H new ATOM 0 HD12 LEU A 23 3.679 2.129 -23.557 1.00 0.00 H new ATOM 0 HD13 LEU A 23 5.288 1.707 -24.190 1.00 0.00 H new ATOM 0 HD21 LEU A 23 4.881 2.843 -27.007 1.00 0.00 H new ATOM 0 HD22 LEU A 23 5.593 1.256 -26.629 1.00 0.00 H new ATOM 0 HD23 LEU A 23 4.203 1.367 -27.736 1.00 0.00 H new ATOM 366 N ALA A 24 0.151 -0.086 -25.358 1.00 0.00 N ATOM 367 CA ALA A 24 -1.123 0.455 -25.813 1.00 0.00 C ATOM 368 C ALA A 24 -1.931 0.979 -24.632 1.00 0.00 C ATOM 369 O ALA A 24 -2.519 2.058 -24.699 1.00 0.00 O ATOM 370 CB ALA A 24 -1.922 -0.627 -26.542 1.00 0.00 C ATOM 0 H ALA A 24 0.275 -1.084 -25.531 1.00 0.00 H new ATOM 0 HA ALA A 24 -0.923 1.279 -26.498 1.00 0.00 H new ATOM 0 HB1 ALA A 24 -2.873 -0.213 -26.878 1.00 0.00 H new ATOM 0 HB2 ALA A 24 -1.355 -0.980 -27.403 1.00 0.00 H new ATOM 0 HB3 ALA A 24 -2.109 -1.460 -25.864 1.00 0.00 H new ATOM 376 N ASN A 25 -1.953 0.208 -23.548 1.00 0.00 N ATOM 377 CA ASN A 25 -2.689 0.608 -22.356 1.00 0.00 C ATOM 378 C ASN A 25 -2.061 1.851 -21.734 1.00 0.00 C ATOM 379 O ASN A 25 -2.764 2.740 -21.253 1.00 0.00 O ATOM 380 CB ASN A 25 -2.690 -0.532 -21.336 1.00 0.00 C ATOM 381 CG ASN A 25 -3.563 -1.677 -21.837 1.00 0.00 C ATOM 382 OD1 ASN A 25 -3.078 -2.793 -22.024 1.00 0.00 O ATOM 383 ND2 ASN A 25 -4.831 -1.467 -22.066 1.00 0.00 N ATOM 0 H ASN A 25 -1.474 -0.689 -23.472 1.00 0.00 H new ATOM 0 HA ASN A 25 -3.715 0.837 -22.643 1.00 0.00 H new ATOM 0 HB2 ASN A 25 -1.672 -0.885 -21.171 1.00 0.00 H new ATOM 0 HB3 ASN A 25 -3.062 -0.173 -20.377 1.00 0.00 H new ATOM 0 HD21 ASN A 25 -5.422 -2.228 -22.400 1.00 0.00 H new ATOM 0 HD22 ASN A 25 -5.231 -0.542 -21.910 1.00 0.00 H new ATOM 390 N PHE A 26 -0.733 1.906 -21.747 1.00 0.00 N ATOM 391 CA PHE A 26 -0.019 3.046 -21.185 1.00 0.00 C ATOM 392 C PHE A 26 -0.232 4.293 -22.040 1.00 0.00 C ATOM 393 O PHE A 26 -0.344 5.402 -21.518 1.00 0.00 O ATOM 394 CB PHE A 26 1.477 2.734 -21.096 1.00 0.00 C ATOM 395 CG PHE A 26 2.192 3.881 -20.422 1.00 0.00 C ATOM 396 CD1 PHE A 26 2.132 4.023 -19.031 1.00 0.00 C ATOM 397 CD2 PHE A 26 2.915 4.802 -21.189 1.00 0.00 C ATOM 398 CE1 PHE A 26 2.794 5.087 -18.406 1.00 0.00 C ATOM 399 CE2 PHE A 26 3.578 5.865 -20.565 1.00 0.00 C ATOM 400 CZ PHE A 26 3.517 6.008 -19.174 1.00 0.00 C ATOM 0 H PHE A 26 -0.133 1.179 -22.138 1.00 0.00 H new ATOM 0 HA PHE A 26 -0.411 3.236 -20.186 1.00 0.00 H new ATOM 0 HB2 PHE A 26 1.634 1.813 -20.534 1.00 0.00 H new ATOM 0 HB3 PHE A 26 1.886 2.573 -22.094 1.00 0.00 H new ATOM 0 HD1 PHE A 26 1.575 3.312 -18.439 1.00 0.00 H new ATOM 0 HD2 PHE A 26 2.961 4.692 -22.262 1.00 0.00 H new ATOM 0 HE1 PHE A 26 2.747 5.197 -17.333 1.00 0.00 H new ATOM 0 HE2 PHE A 26 4.137 6.575 -21.157 1.00 0.00 H new ATOM 0 HZ PHE A 26 4.028 6.829 -18.693 1.00 0.00 H new ATOM 410 N LEU A 27 -0.282 4.104 -23.355 1.00 0.00 N ATOM 411 CA LEU A 27 -0.474 5.222 -24.273 1.00 0.00 C ATOM 412 C LEU A 27 -1.846 5.855 -24.048 1.00 0.00 C ATOM 413 O LEU A 27 -1.974 7.077 -23.998 1.00 0.00 O ATOM 414 CB LEU A 27 -0.335 4.716 -25.724 1.00 0.00 C ATOM 415 CG LEU A 27 -0.486 5.845 -26.772 1.00 0.00 C ATOM 416 CD1 LEU A 27 -1.971 6.119 -27.063 1.00 0.00 C ATOM 417 CD2 LEU A 27 0.200 7.136 -26.297 1.00 0.00 C ATOM 0 H LEU A 27 -0.193 3.194 -23.807 1.00 0.00 H new ATOM 0 HA LEU A 27 0.284 5.984 -24.089 1.00 0.00 H new ATOM 0 HB2 LEU A 27 0.639 4.241 -25.846 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -1.088 3.951 -25.910 1.00 0.00 H new ATOM 0 HG LEU A 27 -0.000 5.513 -27.690 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -2.056 6.916 -27.802 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -2.439 5.214 -27.450 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -2.472 6.422 -26.144 1.00 0.00 H new ATOM 0 HD21 LEU A 27 0.078 7.912 -27.053 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -0.253 7.466 -25.362 1.00 0.00 H new ATOM 0 HD23 LEU A 27 1.262 6.947 -26.139 1.00 0.00 H new ATOM 429 N VAL A 28 -2.868 5.018 -23.902 1.00 0.00 N ATOM 430 CA VAL A 28 -4.220 5.519 -23.673 1.00 0.00 C ATOM 431 C VAL A 28 -4.378 5.987 -22.229 1.00 0.00 C ATOM 432 O VAL A 28 -5.111 6.936 -21.953 1.00 0.00 O ATOM 433 CB VAL A 28 -5.252 4.431 -23.985 1.00 0.00 C ATOM 434 CG1 VAL A 28 -5.090 3.974 -25.436 1.00 0.00 C ATOM 435 CG2 VAL A 28 -5.044 3.237 -23.050 1.00 0.00 C ATOM 0 H VAL A 28 -2.789 4.002 -23.937 1.00 0.00 H new ATOM 0 HA VAL A 28 -4.389 6.366 -24.337 1.00 0.00 H new ATOM 0 HB VAL A 28 -6.254 4.834 -23.838 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -5.824 3.200 -25.658 1.00 0.00 H new ATOM 0 HG12 VAL A 28 -5.243 4.822 -26.104 1.00 0.00 H new ATOM 0 HG13 VAL A 28 -4.086 3.574 -25.582 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -5.780 2.466 -23.276 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -4.041 2.834 -23.192 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -5.162 3.560 -22.016 1.00 0.00 H new ATOM 445 N HIS A 29 -3.686 5.319 -21.312 1.00 0.00 N ATOM 446 CA HIS A 29 -3.760 5.683 -19.902 1.00 0.00 C ATOM 447 C HIS A 29 -3.098 7.037 -19.662 1.00 0.00 C ATOM 448 O HIS A 29 -3.460 7.759 -18.733 1.00 0.00 O ATOM 449 CB HIS A 29 -3.072 4.616 -19.050 1.00 0.00 C ATOM 450 CG HIS A 29 -3.194 4.980 -17.596 1.00 0.00 C ATOM 451 ND1 HIS A 29 -4.385 4.847 -16.898 1.00 0.00 N ATOM 452 CD2 HIS A 29 -2.285 5.474 -16.693 1.00 0.00 C ATOM 453 CE1 HIS A 29 -4.162 5.252 -15.635 1.00 0.00 C ATOM 454 NE2 HIS A 29 -2.898 5.645 -15.456 1.00 0.00 N ATOM 0 H HIS A 29 -3.073 4.530 -21.517 1.00 0.00 H new ATOM 0 HA HIS A 29 -4.810 5.751 -19.618 1.00 0.00 H new ATOM 0 HB2 HIS A 29 -3.526 3.642 -19.231 1.00 0.00 H new ATOM 0 HB3 HIS A 29 -2.021 4.535 -19.329 1.00 0.00 H new ATOM 0 HD2 HIS A 29 -1.251 5.696 -16.910 1.00 0.00 H new ATOM 0 HE1 HIS A 29 -4.914 5.259 -14.860 1.00 0.00 H new ATOM 0 HE2 HIS A 29 -2.474 5.995 -14.597 1.00 0.00 H new ATOM 463 N SER A 30 -2.130 7.374 -20.512 1.00 0.00 N ATOM 464 CA SER A 30 -1.430 8.650 -20.385 1.00 0.00 C ATOM 465 C SER A 30 -1.620 9.510 -21.634 1.00 0.00 C ATOM 466 O SER A 30 -0.853 10.443 -21.874 1.00 0.00 O ATOM 467 CB SER A 30 0.060 8.412 -20.141 1.00 0.00 C ATOM 468 OG SER A 30 0.728 9.665 -20.059 1.00 0.00 O ATOM 0 H SER A 30 -1.816 6.790 -21.287 1.00 0.00 H new ATOM 0 HA SER A 30 -1.854 9.183 -19.534 1.00 0.00 H new ATOM 0 HB2 SER A 30 0.204 7.849 -19.219 1.00 0.00 H new ATOM 0 HB3 SER A 30 0.482 7.814 -20.949 1.00 0.00 H new ATOM 0 HG SER A 30 0.506 10.206 -20.845 1.00 0.00 H new ATOM 474 N SER A 31 -2.640 9.193 -22.429 1.00 0.00 N ATOM 475 CA SER A 31 -2.906 9.949 -23.648 1.00 0.00 C ATOM 476 C SER A 31 -3.256 11.398 -23.325 1.00 0.00 C ATOM 477 O SER A 31 -2.769 12.321 -23.977 1.00 0.00 O ATOM 478 CB SER A 31 -4.054 9.307 -24.426 1.00 0.00 C ATOM 479 OG SER A 31 -4.339 10.093 -25.576 1.00 0.00 O ATOM 0 H SER A 31 -3.289 8.426 -22.253 1.00 0.00 H new ATOM 0 HA SER A 31 -2.002 9.936 -24.257 1.00 0.00 H new ATOM 0 HB2 SER A 31 -3.786 8.293 -24.722 1.00 0.00 H new ATOM 0 HB3 SER A 31 -4.939 9.231 -23.794 1.00 0.00 H new ATOM 0 HG SER A 31 -5.074 9.683 -26.078 1.00 0.00 H new ATOM 485 N ASN A 32 -4.105 11.595 -22.324 1.00 0.00 N ATOM 486 CA ASN A 32 -4.512 12.941 -21.939 1.00 0.00 C ATOM 487 C ASN A 32 -3.320 13.741 -21.428 1.00 0.00 C ATOM 488 O ASN A 32 -3.207 14.940 -21.685 1.00 0.00 O ATOM 489 CB ASN A 32 -5.582 12.869 -20.848 1.00 0.00 C ATOM 490 CG ASN A 32 -5.045 12.107 -19.641 1.00 0.00 C ATOM 491 OD1 ASN A 32 -4.565 10.982 -19.779 1.00 0.00 O ATOM 492 ND2 ASN A 32 -5.098 12.656 -18.458 1.00 0.00 N ATOM 0 H ASN A 32 -4.522 10.848 -21.769 1.00 0.00 H new ATOM 0 HA ASN A 32 -4.918 13.440 -22.819 1.00 0.00 H new ATOM 0 HB2 ASN A 32 -5.879 13.875 -20.551 1.00 0.00 H new ATOM 0 HB3 ASN A 32 -6.474 12.375 -21.233 1.00 0.00 H new ATOM 0 HD21 ASN A 32 -4.741 12.153 -17.646 1.00 0.00 H new ATOM 0 HD22 ASN A 32 -5.496 13.588 -18.346 1.00 0.00 H new ATOM 499 N ASN A 33 -2.432 13.071 -20.703 1.00 0.00 N ATOM 500 CA ASN A 33 -1.254 13.739 -20.163 1.00 0.00 C ATOM 501 C ASN A 33 -0.256 14.033 -21.277 1.00 0.00 C ATOM 502 O ASN A 33 0.452 15.039 -21.247 1.00 0.00 O ATOM 503 CB ASN A 33 -0.595 12.863 -19.095 1.00 0.00 C ATOM 504 CG ASN A 33 -1.460 12.832 -17.840 1.00 0.00 C ATOM 505 OD1 ASN A 33 -2.301 13.709 -17.642 1.00 0.00 O ATOM 506 ND2 ASN A 33 -1.304 11.867 -16.975 1.00 0.00 N ATOM 0 H ASN A 33 -2.503 12.079 -20.478 1.00 0.00 H new ATOM 0 HA ASN A 33 -1.566 14.680 -19.710 1.00 0.00 H new ATOM 0 HB2 ASN A 33 -0.457 11.851 -19.477 1.00 0.00 H new ATOM 0 HB3 ASN A 33 0.395 13.251 -18.855 1.00 0.00 H new ATOM 0 HD21 ASN A 33 -1.879 11.839 -16.133 1.00 0.00 H new ATOM 0 HD22 ASN A 33 -0.607 11.141 -17.141 1.00 0.00 H new ATOM 513 N PHE A 34 -0.207 13.137 -22.257 1.00 0.00 N ATOM 514 CA PHE A 34 0.707 13.295 -23.383 1.00 0.00 C ATOM 515 C PHE A 34 0.601 14.704 -23.958 1.00 0.00 C ATOM 516 O PHE A 34 1.612 15.353 -24.226 1.00 0.00 O ATOM 517 CB PHE A 34 0.387 12.268 -24.471 1.00 0.00 C ATOM 518 CG PHE A 34 1.348 12.439 -25.623 1.00 0.00 C ATOM 519 CD1 PHE A 34 2.688 12.059 -25.479 1.00 0.00 C ATOM 520 CD2 PHE A 34 0.899 12.975 -26.836 1.00 0.00 C ATOM 521 CE1 PHE A 34 3.579 12.216 -26.547 1.00 0.00 C ATOM 522 CE2 PHE A 34 1.791 13.132 -27.904 1.00 0.00 C ATOM 523 CZ PHE A 34 3.130 12.753 -27.760 1.00 0.00 C ATOM 0 H PHE A 34 -0.786 12.298 -22.295 1.00 0.00 H new ATOM 0 HA PHE A 34 1.725 13.133 -23.028 1.00 0.00 H new ATOM 0 HB2 PHE A 34 0.463 11.259 -24.067 1.00 0.00 H new ATOM 0 HB3 PHE A 34 -0.639 12.396 -24.817 1.00 0.00 H new ATOM 0 HD1 PHE A 34 3.034 11.645 -24.544 1.00 0.00 H new ATOM 0 HD2 PHE A 34 -0.135 13.267 -26.948 1.00 0.00 H new ATOM 0 HE1 PHE A 34 4.613 11.923 -26.436 1.00 0.00 H new ATOM 0 HE2 PHE A 34 1.445 13.546 -28.840 1.00 0.00 H new ATOM 0 HZ PHE A 34 3.817 12.875 -28.584 1.00 0.00 H new ATOM 533 N GLY A 35 -0.629 15.174 -24.135 1.00 0.00 N ATOM 534 CA GLY A 35 -0.854 16.512 -24.669 1.00 0.00 C ATOM 535 C GLY A 35 -0.325 17.570 -23.708 1.00 0.00 C ATOM 536 O GLY A 35 0.319 18.533 -24.126 1.00 0.00 O ATOM 0 H GLY A 35 -1.479 14.653 -23.919 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -0.360 16.611 -25.635 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -1.920 16.667 -24.838 1.00 0.00 H new ATOM 540 N ALA A 36 -0.607 17.394 -22.421 1.00 0.00 N ATOM 541 CA ALA A 36 -0.159 18.353 -21.419 1.00 0.00 C ATOM 542 C ALA A 36 1.359 18.500 -21.460 1.00 0.00 C ATOM 543 O ALA A 36 1.894 19.592 -21.272 1.00 0.00 O ATOM 544 CB ALA A 36 -0.593 17.895 -20.026 1.00 0.00 C ATOM 0 H ALA A 36 -1.138 16.605 -22.051 1.00 0.00 H new ATOM 0 HA ALA A 36 -0.612 19.319 -21.640 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -0.254 18.617 -19.283 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -1.680 17.820 -19.990 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -0.155 16.920 -19.810 1.00 0.00 H new ATOM 550 N ILE A 37 2.044 17.388 -21.706 1.00 0.00 N ATOM 551 CA ILE A 37 3.501 17.395 -21.773 1.00 0.00 C ATOM 552 C ILE A 37 3.985 18.339 -22.869 1.00 0.00 C ATOM 553 O ILE A 37 4.991 19.030 -22.709 1.00 0.00 O ATOM 554 CB ILE A 37 4.020 15.982 -22.052 1.00 0.00 C ATOM 555 CG1 ILE A 37 3.833 15.115 -20.803 1.00 0.00 C ATOM 556 CG2 ILE A 37 5.506 16.046 -22.410 1.00 0.00 C ATOM 557 CD1 ILE A 37 4.087 13.648 -21.155 1.00 0.00 C ATOM 0 H ILE A 37 1.617 16.475 -21.862 1.00 0.00 H new ATOM 0 HA ILE A 37 3.885 17.742 -20.814 1.00 0.00 H new ATOM 0 HB ILE A 37 3.465 15.548 -22.883 1.00 0.00 H new ATOM 0 HG12 ILE A 37 4.519 15.436 -20.019 1.00 0.00 H new ATOM 0 HG13 ILE A 37 2.823 15.236 -20.412 1.00 0.00 H new ATOM 0 HG21 ILE A 37 5.876 15.040 -22.609 1.00 0.00 H new ATOM 0 HG22 ILE A 37 5.640 16.664 -23.298 1.00 0.00 H new ATOM 0 HG23 ILE A 37 6.062 16.480 -21.579 1.00 0.00 H new ATOM 0 HD11 ILE A 37 3.954 13.032 -20.266 1.00 0.00 H new ATOM 0 HD12 ILE A 37 3.383 13.331 -21.925 1.00 0.00 H new ATOM 0 HD13 ILE A 37 5.106 13.534 -21.526 1.00 0.00 H new ATOM 569 N LEU A 38 3.261 18.359 -23.984 1.00 0.00 N ATOM 570 CA LEU A 38 3.623 19.217 -25.106 1.00 0.00 C ATOM 571 C LEU A 38 3.714 20.671 -24.657 1.00 0.00 C ATOM 572 O LEU A 38 4.585 21.415 -25.107 1.00 0.00 O ATOM 573 CB LEU A 38 2.581 19.083 -26.222 1.00 0.00 C ATOM 574 CG LEU A 38 3.047 19.839 -27.470 1.00 0.00 C ATOM 575 CD1 LEU A 38 4.075 18.998 -28.230 1.00 0.00 C ATOM 576 CD2 LEU A 38 1.844 20.111 -28.376 1.00 0.00 C ATOM 0 H LEU A 38 2.425 17.794 -24.134 1.00 0.00 H new ATOM 0 HA LEU A 38 4.597 18.905 -25.483 1.00 0.00 H new ATOM 0 HB2 LEU A 38 2.426 18.031 -26.461 1.00 0.00 H new ATOM 0 HB3 LEU A 38 1.623 19.478 -25.885 1.00 0.00 H new ATOM 0 HG LEU A 38 3.503 20.783 -27.171 1.00 0.00 H new ATOM 0 HD11 LEU A 38 4.404 19.539 -29.117 1.00 0.00 H new ATOM 0 HD12 LEU A 38 4.932 18.802 -27.586 1.00 0.00 H new ATOM 0 HD13 LEU A 38 3.622 18.053 -28.529 1.00 0.00 H new ATOM 0 HD21 LEU A 38 2.172 20.649 -29.265 1.00 0.00 H new ATOM 0 HD22 LEU A 38 1.390 19.165 -28.671 1.00 0.00 H new ATOM 0 HD23 LEU A 38 1.112 20.713 -27.838 1.00 0.00 H new ATOM 588 N SER A 39 2.813 21.071 -23.766 1.00 0.00 N ATOM 589 CA SER A 39 2.809 22.439 -23.264 1.00 0.00 C ATOM 590 C SER A 39 4.119 22.749 -22.546 1.00 0.00 C ATOM 591 O SER A 39 4.657 23.850 -22.662 1.00 0.00 O ATOM 592 CB SER A 39 1.639 22.638 -22.301 1.00 0.00 C ATOM 593 OG SER A 39 0.416 22.513 -23.016 1.00 0.00 O ATOM 0 H SER A 39 2.082 20.473 -23.380 1.00 0.00 H new ATOM 0 HA SER A 39 2.702 23.117 -24.111 1.00 0.00 H new ATOM 0 HB2 SER A 39 1.683 21.900 -21.500 1.00 0.00 H new ATOM 0 HB3 SER A 39 1.701 23.620 -21.833 1.00 0.00 H new ATOM 0 HG SER A 39 -0.337 22.638 -22.401 1.00 0.00 H new ATOM 599 N SER A 40 4.627 21.769 -21.805 1.00 0.00 N ATOM 600 CA SER A 40 5.876 21.948 -21.072 1.00 0.00 C ATOM 601 C SER A 40 7.062 21.489 -21.914 1.00 0.00 C ATOM 602 O SER A 40 8.030 20.937 -21.391 1.00 0.00 O ATOM 603 CB SER A 40 5.834 21.149 -19.768 1.00 0.00 C ATOM 604 OG SER A 40 4.525 21.219 -19.217 1.00 0.00 O ATOM 0 H SER A 40 4.198 20.850 -21.696 1.00 0.00 H new ATOM 0 HA SER A 40 5.995 23.008 -20.846 1.00 0.00 H new ATOM 0 HB2 SER A 40 6.107 20.111 -19.955 1.00 0.00 H new ATOM 0 HB3 SER A 40 6.561 21.547 -19.060 1.00 0.00 H new ATOM 0 HG SER A 40 4.494 20.707 -18.382 1.00 0.00 H new ATOM 610 N THR A 41 6.979 21.720 -23.220 1.00 0.00 N ATOM 611 CA THR A 41 8.052 21.326 -24.126 1.00 0.00 C ATOM 612 C THR A 41 9.392 21.895 -23.663 1.00 0.00 C ATOM 613 O THR A 41 10.450 21.374 -24.015 1.00 0.00 O ATOM 614 CB THR A 41 7.749 21.822 -25.542 1.00 0.00 C ATOM 615 OG1 THR A 41 8.837 21.501 -26.397 1.00 0.00 O ATOM 616 CG2 THR A 41 7.544 23.338 -25.521 1.00 0.00 C ATOM 0 H THR A 41 6.186 22.175 -23.672 1.00 0.00 H new ATOM 0 HA THR A 41 8.116 20.238 -24.125 1.00 0.00 H new ATOM 0 HB THR A 41 6.843 21.341 -25.910 1.00 0.00 H new ATOM 0 HG1 THR A 41 8.644 21.817 -27.305 1.00 0.00 H new ATOM 0 HG21 THR A 41 7.328 23.690 -26.530 1.00 0.00 H new ATOM 0 HG22 THR A 41 6.709 23.583 -24.865 1.00 0.00 H new ATOM 0 HG23 THR A 41 8.449 23.822 -25.153 1.00 0.00 H new ATOM 624 N ASN A 42 9.341 22.964 -22.874 1.00 0.00 N ATOM 625 CA ASN A 42 10.560 23.590 -22.374 1.00 0.00 C ATOM 626 C ASN A 42 10.977 22.980 -21.036 1.00 0.00 C ATOM 627 O ASN A 42 11.734 23.588 -20.279 1.00 0.00 O ATOM 628 CB ASN A 42 10.343 25.094 -22.204 1.00 0.00 C ATOM 629 CG ASN A 42 9.368 25.355 -21.060 1.00 0.00 C ATOM 630 OD1 ASN A 42 8.550 24.496 -20.733 1.00 0.00 O ATOM 631 ND2 ASN A 42 9.407 26.497 -20.430 1.00 0.00 N ATOM 0 H ASN A 42 8.477 23.412 -22.569 1.00 0.00 H new ATOM 0 HA ASN A 42 11.354 23.415 -23.100 1.00 0.00 H new ATOM 0 HB2 ASN A 42 11.294 25.586 -22.001 1.00 0.00 H new ATOM 0 HB3 ASN A 42 9.954 25.520 -23.129 1.00 0.00 H new ATOM 0 HD21 ASN A 42 8.758 26.679 -19.664 1.00 0.00 H new ATOM 0 HD22 ASN A 42 10.086 27.207 -20.703 1.00 0.00 H new ATOM 638 N VAL A 43 10.482 21.779 -20.750 1.00 0.00 N ATOM 639 CA VAL A 43 10.816 21.105 -19.500 1.00 0.00 C ATOM 640 C VAL A 43 12.055 20.225 -19.675 1.00 0.00 C ATOM 641 O VAL A 43 12.291 19.305 -18.893 1.00 0.00 O ATOM 642 CB VAL A 43 9.628 20.252 -19.040 1.00 0.00 C ATOM 643 CG1 VAL A 43 9.567 18.959 -19.860 1.00 0.00 C ATOM 644 CG2 VAL A 43 9.781 19.912 -17.552 1.00 0.00 C ATOM 0 H VAL A 43 9.854 21.257 -21.361 1.00 0.00 H new ATOM 0 HA VAL A 43 11.034 21.859 -18.744 1.00 0.00 H new ATOM 0 HB VAL A 43 8.706 20.814 -19.189 1.00 0.00 H new ATOM 0 HG11 VAL A 43 8.721 18.357 -19.528 1.00 0.00 H new ATOM 0 HG12 VAL A 43 9.447 19.203 -20.916 1.00 0.00 H new ATOM 0 HG13 VAL A 43 10.490 18.396 -19.720 1.00 0.00 H new ATOM 0 HG21 VAL A 43 8.935 19.306 -17.228 1.00 0.00 H new ATOM 0 HG22 VAL A 43 10.706 19.356 -17.399 1.00 0.00 H new ATOM 0 HG23 VAL A 43 9.811 20.833 -16.970 1.00 0.00 H new ATOM 654 N GLY A 44 12.849 20.517 -20.702 1.00 0.00 N ATOM 655 CA GLY A 44 14.059 19.745 -20.962 1.00 0.00 C ATOM 656 C GLY A 44 13.831 18.714 -22.065 1.00 0.00 C ATOM 657 O GLY A 44 14.785 18.206 -22.655 1.00 0.00 O ATOM 0 H GLY A 44 12.678 21.276 -21.362 1.00 0.00 H new ATOM 0 HA2 GLY A 44 14.867 20.417 -21.251 1.00 0.00 H new ATOM 0 HA3 GLY A 44 14.375 19.240 -20.049 1.00 0.00 H new ATOM 661 N SER A 45 12.566 18.408 -22.341 1.00 0.00 N ATOM 662 CA SER A 45 12.235 17.437 -23.377 1.00 0.00 C ATOM 663 C SER A 45 11.986 18.138 -24.710 1.00 0.00 C ATOM 664 O SER A 45 11.267 17.624 -25.566 1.00 0.00 O ATOM 665 CB SER A 45 10.989 16.648 -22.974 1.00 0.00 C ATOM 666 OG SER A 45 9.843 17.477 -23.113 1.00 0.00 O ATOM 0 H SER A 45 11.760 18.815 -21.866 1.00 0.00 H new ATOM 0 HA SER A 45 13.077 16.754 -23.490 1.00 0.00 H new ATOM 0 HB2 SER A 45 10.888 15.761 -23.599 1.00 0.00 H new ATOM 0 HB3 SER A 45 11.080 16.303 -21.944 1.00 0.00 H new ATOM 0 HG SER A 45 9.042 16.974 -22.857 1.00 0.00 H new ATOM 672 N ASN A 46 12.584 19.314 -24.877 1.00 0.00 N ATOM 673 CA ASN A 46 12.419 20.077 -26.110 1.00 0.00 C ATOM 674 C ASN A 46 13.059 19.354 -27.297 1.00 0.00 C ATOM 675 O ASN A 46 12.854 19.742 -28.447 1.00 0.00 O ATOM 676 CB ASN A 46 13.054 21.460 -25.953 1.00 0.00 C ATOM 677 CG ASN A 46 14.551 21.321 -25.698 1.00 0.00 C ATOM 678 OD1 ASN A 46 15.071 20.207 -25.640 1.00 0.00 O ATOM 679 ND2 ASN A 46 15.279 22.392 -25.540 1.00 0.00 N ATOM 0 H ASN A 46 13.183 19.757 -24.180 1.00 0.00 H new ATOM 0 HA ASN A 46 11.351 20.180 -26.304 1.00 0.00 H new ATOM 0 HB2 ASN A 46 12.883 22.052 -26.852 1.00 0.00 H new ATOM 0 HB3 ASN A 46 12.584 21.993 -25.127 1.00 0.00 H new ATOM 0 HD21 ASN A 46 16.281 22.307 -25.368 1.00 0.00 H new ATOM 0 HD22 ASN A 46 14.846 23.314 -25.588 1.00 0.00 H new ATOM 686 N THR A 47 13.832 18.306 -27.017 1.00 0.00 N ATOM 687 CA THR A 47 14.487 17.551 -28.080 1.00 0.00 C ATOM 688 C THR A 47 13.611 16.387 -28.535 1.00 0.00 C ATOM 689 O THR A 47 14.115 15.363 -28.996 1.00 0.00 O ATOM 690 CB THR A 47 15.833 17.017 -27.587 1.00 0.00 C ATOM 691 OG1 THR A 47 16.437 17.977 -26.731 1.00 0.00 O ATOM 692 CG2 THR A 47 16.748 16.751 -28.784 1.00 0.00 C ATOM 0 H THR A 47 14.018 17.964 -26.074 1.00 0.00 H new ATOM 0 HA THR A 47 14.648 18.219 -28.926 1.00 0.00 H new ATOM 0 HB THR A 47 15.677 16.088 -27.039 1.00 0.00 H new ATOM 0 HG1 THR A 47 15.794 18.689 -26.533 1.00 0.00 H new ATOM 0 HG21 THR A 47 17.707 16.371 -28.432 1.00 0.00 H new ATOM 0 HG22 THR A 47 16.284 16.014 -29.440 1.00 0.00 H new ATOM 0 HG23 THR A 47 16.906 17.678 -29.334 1.00 0.00 H new ATOM 700 N TYR A 48 12.298 16.549 -28.402 1.00 0.00 N ATOM 701 CA TYR A 48 11.364 15.503 -28.804 1.00 0.00 C ATOM 702 C TYR A 48 10.962 15.665 -30.270 1.00 0.00 C ATOM 703 O TYR A 48 9.958 15.104 -30.710 1.00 0.00 O ATOM 704 CB TYR A 48 10.115 15.554 -27.920 1.00 0.00 C ATOM 705 CG TYR A 48 9.224 16.693 -28.360 1.00 0.00 C ATOM 706 CD1 TYR A 48 8.058 16.428 -29.088 1.00 0.00 C ATOM 707 CD2 TYR A 48 9.564 18.013 -28.038 1.00 0.00 C ATOM 708 CE1 TYR A 48 7.232 17.483 -29.496 1.00 0.00 C ATOM 709 CE2 TYR A 48 8.738 19.067 -28.446 1.00 0.00 C ATOM 710 CZ TYR A 48 7.572 18.802 -29.174 1.00 0.00 C ATOM 711 OH TYR A 48 6.758 19.841 -29.576 1.00 0.00 O ATOM 0 H TYR A 48 11.859 17.388 -28.022 1.00 0.00 H new ATOM 0 HA TYR A 48 11.858 14.539 -28.685 1.00 0.00 H new ATOM 0 HB2 TYR A 48 9.573 14.610 -27.985 1.00 0.00 H new ATOM 0 HB3 TYR A 48 10.402 15.686 -26.877 1.00 0.00 H new ATOM 0 HD1 TYR A 48 7.795 15.410 -29.335 1.00 0.00 H new ATOM 0 HD2 TYR A 48 10.463 18.218 -27.475 1.00 0.00 H new ATOM 0 HE1 TYR A 48 6.333 17.279 -30.059 1.00 0.00 H new ATOM 0 HE2 TYR A 48 9.000 20.085 -28.199 1.00 0.00 H new ATOM 0 HH TYR A 48 7.138 20.691 -29.270 1.00 0.00 H new ATOM 721 N GLY A 49 11.748 16.431 -31.023 1.00 0.00 N ATOM 722 CA GLY A 49 11.453 16.652 -32.434 1.00 0.00 C ATOM 723 C GLY A 49 11.463 15.337 -33.207 1.00 0.00 C ATOM 724 O GLY A 49 12.524 14.801 -33.526 1.00 0.00 O ATOM 0 H GLY A 49 12.585 16.904 -30.683 1.00 0.00 H new ATOM 0 HA2 GLY A 49 10.479 17.130 -32.535 1.00 0.00 H new ATOM 0 HA3 GLY A 49 12.188 17.334 -32.860 1.00 0.00 H new ATOM 728 N LYS A 50 10.274 14.826 -33.507 1.00 0.00 N ATOM 729 CA LYS A 50 10.154 13.574 -34.246 1.00 0.00 C ATOM 730 C LYS A 50 10.693 13.736 -35.663 1.00 0.00 C ATOM 731 O LYS A 50 11.318 12.827 -36.210 1.00 0.00 O ATOM 732 CB LYS A 50 8.689 13.138 -34.301 1.00 0.00 C ATOM 733 CG LYS A 50 8.233 12.702 -32.907 1.00 0.00 C ATOM 734 CD LYS A 50 6.915 11.932 -33.014 1.00 0.00 C ATOM 735 CE LYS A 50 5.769 12.906 -33.302 1.00 0.00 C ATOM 736 NZ LYS A 50 5.294 13.515 -32.026 1.00 0.00 N ATOM 0 H LYS A 50 9.385 15.256 -33.252 1.00 0.00 H new ATOM 0 HA LYS A 50 10.739 12.812 -33.732 1.00 0.00 H new ATOM 0 HB2 LYS A 50 8.067 13.959 -34.658 1.00 0.00 H new ATOM 0 HB3 LYS A 50 8.569 12.317 -35.008 1.00 0.00 H new ATOM 0 HG2 LYS A 50 8.995 12.075 -32.444 1.00 0.00 H new ATOM 0 HG3 LYS A 50 8.105 13.574 -32.266 1.00 0.00 H new ATOM 0 HD2 LYS A 50 6.981 11.188 -33.808 1.00 0.00 H new ATOM 0 HD3 LYS A 50 6.722 11.392 -32.087 1.00 0.00 H new ATOM 0 HE2 LYS A 50 6.105 13.686 -33.985 1.00 0.00 H new ATOM 0 HE3 LYS A 50 4.949 12.383 -33.794 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 4.516 14.176 -32.225 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 4.957 12.766 -31.388 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 6.077 14.029 -31.574 1.00 0.00 H new ATOM 750 N ARG A 51 10.441 14.900 -36.254 1.00 0.00 N ATOM 751 CA ARG A 51 10.900 15.176 -37.612 1.00 0.00 C ATOM 752 C ARG A 51 12.398 14.916 -37.744 1.00 0.00 C ATOM 753 O ARG A 51 12.900 14.678 -38.842 1.00 0.00 O ATOM 754 CB ARG A 51 10.598 16.630 -37.980 1.00 0.00 C ATOM 755 CG ARG A 51 11.497 17.565 -37.168 1.00 0.00 C ATOM 756 CD ARG A 51 11.079 19.015 -37.413 1.00 0.00 C ATOM 757 NE ARG A 51 11.965 19.925 -36.693 1.00 0.00 N ATOM 758 CZ ARG A 51 11.817 20.164 -35.388 1.00 0.00 C ATOM 759 NH1 ARG A 51 10.866 19.581 -34.703 1.00 0.00 N ATOM 760 NH2 ARG A 51 12.631 20.988 -34.787 1.00 0.00 N ATOM 0 H ARG A 51 9.925 15.664 -35.817 1.00 0.00 H new ATOM 0 HA ARG A 51 10.370 14.509 -38.292 1.00 0.00 H new ATOM 0 HB2 ARG A 51 10.762 16.787 -39.046 1.00 0.00 H new ATOM 0 HB3 ARG A 51 9.550 16.855 -37.782 1.00 0.00 H new ATOM 0 HG2 ARG A 51 11.422 17.328 -36.107 1.00 0.00 H new ATOM 0 HG3 ARG A 51 12.539 17.423 -37.453 1.00 0.00 H new ATOM 0 HD2 ARG A 51 11.110 19.234 -38.480 1.00 0.00 H new ATOM 0 HD3 ARG A 51 10.050 19.164 -37.087 1.00 0.00 H new ATOM 0 HE ARG A 51 12.717 20.391 -37.201 1.00 0.00 H new ATOM 0 HH11 ARG A 51 10.227 18.935 -35.166 1.00 0.00 H new ATOM 0 HH12 ARG A 51 10.764 19.773 -33.706 1.00 0.00 H new ATOM 0 HH21 ARG A 51 13.375 21.445 -35.314 1.00 0.00 H new ATOM 0 HH22 ARG A 51 12.523 21.175 -33.790 1.00 0.00 H new ATOM 774 N ASN A 52 13.109 14.963 -36.621 1.00 0.00 N ATOM 775 CA ASN A 52 14.549 14.734 -36.632 1.00 0.00 C ATOM 776 C ASN A 52 14.881 13.448 -37.382 1.00 0.00 C ATOM 777 O ASN A 52 15.963 13.310 -37.952 1.00 0.00 O ATOM 778 CB ASN A 52 15.075 14.639 -35.199 1.00 0.00 C ATOM 779 CG ASN A 52 16.586 14.439 -35.211 1.00 0.00 C ATOM 780 OD1 ASN A 52 17.339 15.397 -35.383 1.00 0.00 O ATOM 781 ND2 ASN A 52 17.077 13.242 -35.041 1.00 0.00 N ATOM 0 H ASN A 52 12.715 15.156 -35.700 1.00 0.00 H new ATOM 0 HA ASN A 52 15.026 15.572 -37.139 1.00 0.00 H new ATOM 0 HB2 ASN A 52 14.824 15.547 -34.650 1.00 0.00 H new ATOM 0 HB3 ASN A 52 14.594 13.810 -34.680 1.00 0.00 H new ATOM 0 HD21 ASN A 52 18.087 13.099 -35.050 1.00 0.00 H new ATOM 0 HD22 ASN A 52 16.451 12.449 -34.899 1.00 0.00 H new ATOM 788 N ALA A 53 13.938 12.512 -37.380 1.00 0.00 N ATOM 789 CA ALA A 53 14.134 11.239 -38.065 1.00 0.00 C ATOM 790 C ALA A 53 14.282 11.457 -39.568 1.00 0.00 C ATOM 791 O ALA A 53 15.117 10.827 -40.217 1.00 0.00 O ATOM 792 CB ALA A 53 12.946 10.314 -37.797 1.00 0.00 C ATOM 0 H ALA A 53 13.035 12.609 -36.915 1.00 0.00 H new ATOM 0 HA ALA A 53 15.046 10.779 -37.684 1.00 0.00 H new ATOM 0 HB1 ALA A 53 13.100 9.366 -38.312 1.00 0.00 H new ATOM 0 HB2 ALA A 53 12.859 10.135 -36.725 1.00 0.00 H new ATOM 0 HB3 ALA A 53 12.031 10.781 -38.163 1.00 0.00 H new ATOM 798 N VAL A 54 13.464 12.349 -40.115 1.00 0.00 N ATOM 799 CA VAL A 54 13.511 12.637 -41.545 1.00 0.00 C ATOM 800 C VAL A 54 14.740 13.474 -41.890 1.00 0.00 C ATOM 801 O VAL A 54 15.204 13.469 -43.030 1.00 0.00 O ATOM 802 CB VAL A 54 12.242 13.383 -41.968 1.00 0.00 C ATOM 803 CG1 VAL A 54 12.507 14.891 -41.987 1.00 0.00 C ATOM 804 CG2 VAL A 54 11.824 12.920 -43.367 1.00 0.00 C ATOM 0 H VAL A 54 12.766 12.882 -39.596 1.00 0.00 H new ATOM 0 HA VAL A 54 13.574 11.692 -42.084 1.00 0.00 H new ATOM 0 HB VAL A 54 11.444 13.169 -41.257 1.00 0.00 H new ATOM 0 HG11 VAL A 54 11.601 15.416 -42.289 1.00 0.00 H new ATOM 0 HG12 VAL A 54 12.803 15.221 -40.991 1.00 0.00 H new ATOM 0 HG13 VAL A 54 13.306 15.111 -42.695 1.00 0.00 H new ATOM 0 HG21 VAL A 54 10.921 13.449 -43.671 1.00 0.00 H new ATOM 0 HG22 VAL A 54 12.625 13.133 -44.075 1.00 0.00 H new ATOM 0 HG23 VAL A 54 11.628 11.848 -43.352 1.00 0.00 H new ATOM 814 N GLU A 55 15.262 14.194 -40.901 1.00 0.00 N ATOM 815 CA GLU A 55 16.435 15.033 -41.123 1.00 0.00 C ATOM 816 C GLU A 55 17.700 14.183 -41.187 1.00 0.00 C ATOM 817 O GLU A 55 18.433 14.216 -42.175 1.00 0.00 O ATOM 818 CB GLU A 55 16.562 16.062 -39.998 1.00 0.00 C ATOM 819 CG GLU A 55 17.143 17.362 -40.557 1.00 0.00 C ATOM 820 CD GLU A 55 18.656 17.243 -40.702 1.00 0.00 C ATOM 821 OE1 GLU A 55 19.317 17.066 -39.692 1.00 0.00 O ATOM 822 OE2 GLU A 55 19.133 17.329 -41.822 1.00 0.00 O ATOM 0 H GLU A 55 14.896 14.214 -39.949 1.00 0.00 H new ATOM 0 HA GLU A 55 16.313 15.550 -42.075 1.00 0.00 H new ATOM 0 HB2 GLU A 55 15.586 16.250 -39.551 1.00 0.00 H new ATOM 0 HB3 GLU A 55 17.205 15.675 -39.208 1.00 0.00 H new ATOM 0 HG2 GLU A 55 16.694 17.583 -41.525 1.00 0.00 H new ATOM 0 HG3 GLU A 55 16.898 18.193 -39.895 1.00 0.00 H new ATOM 829 N VAL A 56 17.952 13.423 -40.125 1.00 0.00 N ATOM 830 CA VAL A 56 19.135 12.571 -40.074 1.00 0.00 C ATOM 831 C VAL A 56 19.251 11.738 -41.348 1.00 0.00 C ATOM 832 O VAL A 56 20.353 11.470 -41.825 1.00 0.00 O ATOM 833 CB VAL A 56 19.070 11.648 -38.854 1.00 0.00 C ATOM 834 CG1 VAL A 56 17.788 10.816 -38.902 1.00 0.00 C ATOM 835 CG2 VAL A 56 20.282 10.713 -38.861 1.00 0.00 C ATOM 0 H VAL A 56 17.359 13.380 -39.296 1.00 0.00 H new ATOM 0 HA VAL A 56 20.015 13.210 -39.992 1.00 0.00 H new ATOM 0 HB VAL A 56 19.075 12.250 -37.946 1.00 0.00 H new ATOM 0 HG11 VAL A 56 17.747 10.161 -38.032 1.00 0.00 H new ATOM 0 HG12 VAL A 56 16.923 11.480 -38.898 1.00 0.00 H new ATOM 0 HG13 VAL A 56 17.779 10.214 -39.810 1.00 0.00 H new ATOM 0 HG21 VAL A 56 20.239 10.055 -37.993 1.00 0.00 H new ATOM 0 HG22 VAL A 56 20.274 10.114 -39.772 1.00 0.00 H new ATOM 0 HG23 VAL A 56 21.197 11.304 -38.823 1.00 0.00 H new ATOM 845 N LEU A 57 18.109 11.336 -41.896 1.00 0.00 N ATOM 846 CA LEU A 57 18.104 10.539 -43.118 1.00 0.00 C ATOM 847 C LEU A 57 18.684 11.344 -44.277 1.00 0.00 C ATOM 848 O LEU A 57 19.425 10.813 -45.105 1.00 0.00 O ATOM 849 CB LEU A 57 16.678 10.098 -43.459 1.00 0.00 C ATOM 850 CG LEU A 57 16.549 8.588 -43.254 1.00 0.00 C ATOM 851 CD1 LEU A 57 16.339 8.287 -41.769 1.00 0.00 C ATOM 852 CD2 LEU A 57 15.351 8.067 -44.053 1.00 0.00 C ATOM 0 H LEU A 57 17.185 11.546 -41.519 1.00 0.00 H new ATOM 0 HA LEU A 57 18.720 9.655 -42.955 1.00 0.00 H new ATOM 0 HB2 LEU A 57 15.962 10.624 -42.827 1.00 0.00 H new ATOM 0 HB3 LEU A 57 16.443 10.357 -44.491 1.00 0.00 H new ATOM 0 HG LEU A 57 17.460 8.097 -43.597 1.00 0.00 H new ATOM 0 HD11 LEU A 57 16.247 7.210 -41.625 1.00 0.00 H new ATOM 0 HD12 LEU A 57 17.191 8.658 -41.199 1.00 0.00 H new ATOM 0 HD13 LEU A 57 15.429 8.778 -41.423 1.00 0.00 H new ATOM 0 HD21 LEU A 57 15.257 6.991 -43.908 1.00 0.00 H new ATOM 0 HD22 LEU A 57 14.442 8.560 -43.709 1.00 0.00 H new ATOM 0 HD23 LEU A 57 15.500 8.279 -45.112 1.00 0.00 H new ATOM 864 N LYS A 58 18.349 12.629 -44.323 1.00 0.00 N ATOM 865 CA LYS A 58 18.850 13.504 -45.378 1.00 0.00 C ATOM 866 C LYS A 58 20.361 13.676 -45.254 1.00 0.00 C ATOM 867 O LYS A 58 21.092 13.551 -46.236 1.00 0.00 O ATOM 868 CB LYS A 58 18.171 14.872 -45.286 1.00 0.00 C ATOM 869 CG LYS A 58 16.712 14.753 -45.735 1.00 0.00 C ATOM 870 CD LYS A 58 16.647 14.741 -47.264 1.00 0.00 C ATOM 871 CE LYS A 58 15.187 14.645 -47.712 1.00 0.00 C ATOM 872 NZ LYS A 58 14.719 13.236 -47.581 1.00 0.00 N ATOM 0 H LYS A 58 17.737 13.086 -43.647 1.00 0.00 H new ATOM 0 HA LYS A 58 18.623 13.050 -46.342 1.00 0.00 H new ATOM 0 HB2 LYS A 58 18.218 15.244 -44.263 1.00 0.00 H new ATOM 0 HB3 LYS A 58 18.697 15.593 -45.912 1.00 0.00 H new ATOM 0 HG2 LYS A 58 16.271 13.840 -45.335 1.00 0.00 H new ATOM 0 HG3 LYS A 58 16.131 15.587 -45.342 1.00 0.00 H new ATOM 0 HD2 LYS A 58 17.103 15.646 -47.665 1.00 0.00 H new ATOM 0 HD3 LYS A 58 17.215 13.897 -47.656 1.00 0.00 H new ATOM 0 HE2 LYS A 58 14.565 15.304 -47.106 1.00 0.00 H new ATOM 0 HE3 LYS A 58 15.090 14.977 -48.746 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 14.095 13.002 -48.379 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 15.539 12.596 -47.583 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 14.196 13.125 -46.689 1.00 0.00 H new ATOM 886 N ARG A 59 20.821 13.966 -44.041 1.00 0.00 N ATOM 887 CA ARG A 59 22.247 14.156 -43.799 1.00 0.00 C ATOM 888 C ARG A 59 23.021 12.864 -44.053 1.00 0.00 C ATOM 889 O ARG A 59 24.222 12.897 -44.323 1.00 0.00 O ATOM 890 CB ARG A 59 22.473 14.614 -42.357 1.00 0.00 C ATOM 891 CG ARG A 59 23.885 15.184 -42.216 1.00 0.00 C ATOM 892 CD ARG A 59 24.785 14.155 -41.529 1.00 0.00 C ATOM 893 NE ARG A 59 26.148 14.667 -41.422 1.00 0.00 N ATOM 894 CZ ARG A 59 27.088 14.022 -40.729 1.00 0.00 C ATOM 895 NH1 ARG A 59 26.816 12.897 -40.116 1.00 0.00 N ATOM 896 NH2 ARG A 59 28.293 14.518 -40.660 1.00 0.00 N ATOM 0 H ARG A 59 20.232 14.074 -43.215 1.00 0.00 H new ATOM 0 HA ARG A 59 22.611 14.919 -44.487 1.00 0.00 H new ATOM 0 HB2 ARG A 59 21.736 15.370 -42.085 1.00 0.00 H new ATOM 0 HB3 ARG A 59 22.338 13.776 -41.673 1.00 0.00 H new ATOM 0 HG2 ARG A 59 24.286 15.436 -43.198 1.00 0.00 H new ATOM 0 HG3 ARG A 59 23.860 16.106 -41.635 1.00 0.00 H new ATOM 0 HD2 ARG A 59 24.396 13.926 -40.537 1.00 0.00 H new ATOM 0 HD3 ARG A 59 24.782 13.224 -42.095 1.00 0.00 H new ATOM 0 HE ARG A 59 26.388 15.541 -41.890 1.00 0.00 H new ATOM 0 HH11 ARG A 59 25.876 12.504 -40.165 1.00 0.00 H new ATOM 0 HH12 ARG A 59 27.544 12.414 -39.590 1.00 0.00 H new ATOM 0 HH21 ARG A 59 28.512 15.394 -41.134 1.00 0.00 H new ATOM 0 HH22 ARG A 59 29.016 14.030 -40.132 1.00 0.00 H new ATOM 910 N GLU A 60 22.333 11.729 -43.962 1.00 0.00 N ATOM 911 CA GLU A 60 22.977 10.440 -44.182 1.00 0.00 C ATOM 912 C GLU A 60 22.381 9.741 -45.400 1.00 0.00 C ATOM 913 O GLU A 60 21.634 8.772 -45.268 1.00 0.00 O ATOM 914 CB GLU A 60 22.802 9.554 -42.948 1.00 0.00 C ATOM 915 CG GLU A 60 23.524 10.187 -41.756 1.00 0.00 C ATOM 916 CD GLU A 60 25.033 10.083 -41.947 1.00 0.00 C ATOM 917 OE1 GLU A 60 25.450 9.377 -42.850 1.00 0.00 O ATOM 918 OE2 GLU A 60 25.751 10.711 -41.186 1.00 0.00 O ATOM 0 H GLU A 60 21.339 11.676 -43.740 1.00 0.00 H new ATOM 0 HA GLU A 60 24.038 10.612 -44.361 1.00 0.00 H new ATOM 0 HB2 GLU A 60 21.743 9.433 -42.722 1.00 0.00 H new ATOM 0 HB3 GLU A 60 23.202 8.559 -43.142 1.00 0.00 H new ATOM 0 HG2 GLU A 60 23.233 11.233 -41.657 1.00 0.00 H new ATOM 0 HG3 GLU A 60 23.230 9.686 -40.834 1.00 0.00 H new ATOM 925 N PRO A 61 22.702 10.211 -46.574 1.00 0.00 N ATOM 926 CA PRO A 61 22.195 9.618 -47.847 1.00 0.00 C ATOM 927 C PRO A 61 22.756 8.218 -48.098 1.00 0.00 C ATOM 928 O PRO A 61 22.285 7.502 -48.982 1.00 0.00 O ATOM 929 CB PRO A 61 22.668 10.598 -48.925 1.00 0.00 C ATOM 930 CG PRO A 61 23.829 11.320 -48.327 1.00 0.00 C ATOM 931 CD PRO A 61 23.586 11.362 -46.819 1.00 0.00 C ATOM 0 HA PRO A 61 21.113 9.489 -47.831 1.00 0.00 H new ATOM 0 HB2 PRO A 61 22.959 10.071 -49.834 1.00 0.00 H new ATOM 0 HB3 PRO A 61 21.874 11.292 -49.200 1.00 0.00 H new ATOM 0 HG2 PRO A 61 24.763 10.807 -48.555 1.00 0.00 H new ATOM 0 HG3 PRO A 61 23.911 12.328 -48.735 1.00 0.00 H new ATOM 0 HD2 PRO A 61 24.518 11.276 -46.261 1.00 0.00 H new ATOM 0 HD3 PRO A 61 23.118 12.298 -46.515 1.00 0.00 H new ATOM 939 N LEU A 62 23.764 7.833 -47.318 1.00 0.00 N ATOM 940 CA LEU A 62 24.376 6.520 -47.469 1.00 0.00 C ATOM 941 C LEU A 62 23.359 5.418 -47.189 1.00 0.00 C ATOM 942 O LEU A 62 23.302 4.417 -47.903 1.00 0.00 O ATOM 943 CB LEU A 62 25.556 6.383 -46.505 1.00 0.00 C ATOM 944 CG LEU A 62 26.397 5.168 -46.898 1.00 0.00 C ATOM 945 CD1 LEU A 62 27.882 5.499 -46.736 1.00 0.00 C ATOM 946 CD2 LEU A 62 26.038 3.986 -45.995 1.00 0.00 C ATOM 0 H LEU A 62 24.170 8.409 -46.581 1.00 0.00 H new ATOM 0 HA LEU A 62 24.729 6.420 -48.495 1.00 0.00 H new ATOM 0 HB2 LEU A 62 26.167 7.285 -46.531 1.00 0.00 H new ATOM 0 HB3 LEU A 62 25.194 6.273 -45.483 1.00 0.00 H new ATOM 0 HG LEU A 62 26.194 4.908 -47.937 1.00 0.00 H new ATOM 0 HD11 LEU A 62 28.481 4.632 -47.016 1.00 0.00 H new ATOM 0 HD12 LEU A 62 28.139 6.341 -47.379 1.00 0.00 H new ATOM 0 HD13 LEU A 62 28.085 5.760 -45.697 1.00 0.00 H new ATOM 0 HD21 LEU A 62 26.637 3.119 -46.275 1.00 0.00 H new ATOM 0 HD22 LEU A 62 26.240 4.247 -44.956 1.00 0.00 H new ATOM 0 HD23 LEU A 62 24.980 3.748 -46.110 1.00 0.00 H new ATOM 958 N ASN A 63 22.561 5.607 -46.142 1.00 0.00 N ATOM 959 CA ASN A 63 21.552 4.619 -45.776 1.00 0.00 C ATOM 960 C ASN A 63 20.400 4.614 -46.779 1.00 0.00 C ATOM 961 O ASN A 63 19.625 3.659 -46.836 1.00 0.00 O ATOM 962 CB ASN A 63 21.012 4.916 -44.375 1.00 0.00 C ATOM 963 CG ASN A 63 20.682 6.398 -44.239 1.00 0.00 C ATOM 964 OD1 ASN A 63 21.289 7.097 -43.427 1.00 0.00 O ATOM 965 ND2 ASN A 63 19.750 6.922 -44.987 1.00 0.00 N ATOM 0 H ASN A 63 22.593 6.428 -45.537 1.00 0.00 H new ATOM 0 HA ASN A 63 22.022 3.636 -45.785 1.00 0.00 H new ATOM 0 HB2 ASN A 63 20.120 4.319 -44.188 1.00 0.00 H new ATOM 0 HB3 ASN A 63 21.750 4.630 -43.625 1.00 0.00 H new ATOM 0 HD21 ASN A 63 19.523 7.913 -44.900 1.00 0.00 H new ATOM 0 HD22 ASN A 63 19.249 6.341 -45.659 1.00 0.00 H new ATOM 972 N TYR A 64 20.288 5.680 -47.568 1.00 0.00 N ATOM 973 CA TYR A 64 19.221 5.774 -48.558 1.00 0.00 C ATOM 974 C TYR A 64 19.513 4.859 -49.743 1.00 0.00 C ATOM 975 O TYR A 64 18.611 4.227 -50.291 1.00 0.00 O ATOM 976 CB TYR A 64 19.087 7.217 -49.046 1.00 0.00 C ATOM 977 CG TYR A 64 17.899 7.329 -49.970 1.00 0.00 C ATOM 978 CD1 TYR A 64 16.600 7.230 -49.456 1.00 0.00 C ATOM 979 CD2 TYR A 64 18.095 7.531 -51.342 1.00 0.00 C ATOM 980 CE1 TYR A 64 15.498 7.333 -50.313 1.00 0.00 C ATOM 981 CE2 TYR A 64 16.992 7.635 -52.198 1.00 0.00 C ATOM 982 CZ TYR A 64 15.694 7.536 -51.684 1.00 0.00 C ATOM 983 OH TYR A 64 14.607 7.638 -52.528 1.00 0.00 O ATOM 0 H TYR A 64 20.917 6.483 -47.541 1.00 0.00 H new ATOM 0 HA TYR A 64 18.287 5.462 -48.091 1.00 0.00 H new ATOM 0 HB2 TYR A 64 18.965 7.889 -48.197 1.00 0.00 H new ATOM 0 HB3 TYR A 64 19.995 7.522 -49.566 1.00 0.00 H new ATOM 0 HD1 TYR A 64 16.448 7.074 -48.398 1.00 0.00 H new ATOM 0 HD2 TYR A 64 19.096 7.606 -51.739 1.00 0.00 H new ATOM 0 HE1 TYR A 64 14.496 7.256 -49.916 1.00 0.00 H new ATOM 0 HE2 TYR A 64 17.143 7.792 -53.256 1.00 0.00 H new ATOM 0 HH TYR A 64 14.918 7.779 -53.447 1.00 0.00 H new ATOM 993 N LEU A 65 20.783 4.797 -50.131 1.00 0.00 N ATOM 994 CA LEU A 65 21.192 3.959 -51.252 1.00 0.00 C ATOM 995 C LEU A 65 21.146 2.483 -50.855 1.00 0.00 C ATOM 996 O LEU A 65 21.182 2.155 -49.669 1.00 0.00 O ATOM 997 CB LEU A 65 22.611 4.333 -51.688 1.00 0.00 C ATOM 998 CG LEU A 65 22.622 5.763 -52.231 1.00 0.00 C ATOM 999 CD1 LEU A 65 24.068 6.224 -52.422 1.00 0.00 C ATOM 1000 CD2 LEU A 65 21.892 5.806 -53.577 1.00 0.00 C ATOM 0 H LEU A 65 21.543 5.314 -49.688 1.00 0.00 H new ATOM 0 HA LEU A 65 20.504 4.122 -52.082 1.00 0.00 H new ATOM 0 HB2 LEU A 65 23.296 4.249 -50.844 1.00 0.00 H new ATOM 0 HB3 LEU A 65 22.961 3.640 -52.453 1.00 0.00 H new ATOM 0 HG LEU A 65 22.119 6.423 -51.524 1.00 0.00 H new ATOM 0 HD11 LEU A 65 24.077 7.243 -52.809 1.00 0.00 H new ATOM 0 HD12 LEU A 65 24.589 6.195 -51.465 1.00 0.00 H new ATOM 0 HD13 LEU A 65 24.570 5.563 -53.129 1.00 0.00 H new ATOM 0 HD21 LEU A 65 21.900 6.825 -53.963 1.00 0.00 H new ATOM 0 HD22 LEU A 65 22.394 5.146 -54.284 1.00 0.00 H new ATOM 0 HD23 LEU A 65 20.861 5.477 -53.443 1.00 0.00 H new ATOM 1012 N PRO A 66 21.068 1.591 -51.813 1.00 0.00 N ATOM 1013 CA PRO A 66 21.019 0.124 -51.536 1.00 0.00 C ATOM 1014 C PRO A 66 22.170 -0.330 -50.643 1.00 0.00 C ATOM 1015 O PRO A 66 23.302 0.129 -50.792 1.00 0.00 O ATOM 1016 CB PRO A 66 21.122 -0.518 -52.923 1.00 0.00 C ATOM 1017 CG PRO A 66 20.656 0.528 -53.879 1.00 0.00 C ATOM 1018 CD PRO A 66 21.018 1.874 -53.258 1.00 0.00 C ATOM 0 HA PRO A 66 20.113 -0.158 -51.000 1.00 0.00 H new ATOM 0 HB2 PRO A 66 22.146 -0.821 -53.141 1.00 0.00 H new ATOM 0 HB3 PRO A 66 20.504 -1.413 -52.988 1.00 0.00 H new ATOM 0 HG2 PRO A 66 21.136 0.407 -54.850 1.00 0.00 H new ATOM 0 HG3 PRO A 66 19.581 0.453 -54.043 1.00 0.00 H new ATOM 0 HD2 PRO A 66 21.976 2.241 -53.627 1.00 0.00 H new ATOM 0 HD3 PRO A 66 20.274 2.635 -53.491 1.00 0.00 H new ATOM 1026 N LEU A 67 21.872 -1.234 -49.715 1.00 0.00 N ATOM 1027 CA LEU A 67 22.889 -1.742 -48.802 1.00 0.00 C ATOM 1028 C LEU A 67 23.462 -3.059 -49.317 1.00 0.00 C ATOM 1029 O LEU A 67 22.908 -3.593 -50.264 1.00 0.00 O ATOM 1030 CB LEU A 67 22.285 -1.955 -47.413 1.00 0.00 C ATOM 1031 CG LEU A 67 23.007 -1.066 -46.400 1.00 0.00 C ATOM 1032 CD1 LEU A 67 22.228 -1.054 -45.083 1.00 0.00 C ATOM 1033 CD2 LEU A 67 24.414 -1.615 -46.153 1.00 0.00 C ATOM 0 H LEU A 67 20.941 -1.627 -49.576 1.00 0.00 H new ATOM 0 HA LEU A 67 23.693 -1.009 -48.740 1.00 0.00 H new ATOM 0 HB2 LEU A 67 21.221 -1.718 -47.427 1.00 0.00 H new ATOM 0 HB3 LEU A 67 22.374 -3.002 -47.123 1.00 0.00 H new ATOM 0 HG LEU A 67 23.074 -0.051 -46.791 1.00 0.00 H new ATOM 0 HD11 LEU A 67 22.743 -0.420 -44.361 1.00 0.00 H new ATOM 0 HD12 LEU A 67 21.225 -0.665 -45.257 1.00 0.00 H new ATOM 0 HD13 LEU A 67 22.160 -2.069 -44.691 1.00 0.00 H new ATOM 0 HD21 LEU A 67 24.930 -0.982 -45.431 1.00 0.00 H new ATOM 0 HD22 LEU A 67 24.345 -2.630 -45.762 1.00 0.00 H new ATOM 0 HD23 LEU A 67 24.971 -1.624 -47.090 1.00 0.00 H new TER 1045 LEU A 67