USER MOD reduce.3.24.130724 H: found=0, std=0, add=623, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 623 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 74 ASN : amide:sc= 0.253 X(o=0.48,f=0.063) USER MOD Set 1.2: A 76 GLN : amide:sc= 0.231 X(o=0.48,f=0.063) USER MOD Set 2.1: A 24 GLN : amide:sc= -0.569 X(o=-0.52,f=-0.4) USER MOD Set 2.2: A 39 GLN : amide:sc= 0.0471 X(o=-0.52,f=-0.74) USER MOD Set 2.3: A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 3 THR OG1 : rot 19:sc= 0.799 USER MOD Single : A 5 THR OG1 : rot 180:sc= -0.0418 USER MOD Single : A 8 TYR OH : rot 180:sc= 0 USER MOD Single : A 9 GLN : amide:sc= 0 X(o=0,f=-0.35) USER MOD Single : A 13 LYS NZ :NH3+ -120:sc= 0.923 (180deg=-0.471) USER MOD Single : A 16 THR OG1 : rot 180:sc= -0.72 USER MOD Single : A 18 LYS NZ :NH3+ -169:sc= -0.0172 (180deg=-0.185) USER MOD Single : A 20 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 21 ASN : amide:sc= -0.0165 K(o=-0.017,f=-1.2!) USER MOD Single : A 27 SER OG : rot 180:sc= -0.0277 USER MOD Single : A 30 TYR OH : rot 180:sc= 0 USER MOD Single : A 32 ASN : amide:sc= -0.099 X(o=-0.099,f=-0.41) USER MOD Single : A 33 GLN : amide:sc= 0.773 K(o=0.77,f=-0.022) USER MOD Single : A 36 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 SER OG : rot -108:sc= 0.178 USER MOD Single : A 44 SER OG : rot 180:sc= 0.128 USER MOD Single : A 49 THR OG1 : rot 80:sc= -0.452 USER MOD Single : A 53 TYR OH : rot -130:sc= 1.16 USER MOD Single : A 57 SER OG : rot -116:sc= 0.629 USER MOD Single : A 58 LYS NZ :NH3+ -144:sc= 0.943 (180deg=0.0307) USER MOD Single : A 63 THR OG1 : rot 180:sc= 0 USER MOD Single : A 65 TYR OH : rot 100:sc= 0.195 USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 ASN : amide:sc= 0 K(o=0,f=-1.5!) USER MOD Single : A 78 GLN : amide:sc= 1.06 K(o=1.1,f=-0.74) USER MOD Single : A 79 ASN : amide:sc= 0.395 K(o=0.4,f=-7.5!) USER MOD Single : A 81 GLN : amide:sc= 0 K(o=0,f=-0.69) USER MOD ----------------------------------------------------------------- ATOM 35 N THR A 3 5.275 -19.121 -16.886 1.00 13.00 N ATOM 36 CA THR A 3 4.737 -18.490 -18.040 1.00 54.00 C ATOM 37 C THR A 3 3.849 -17.364 -17.551 1.00 4.00 C ATOM 38 O THR A 3 3.254 -17.469 -16.442 1.00 55.00 O ATOM 39 CB THR A 3 3.876 -19.514 -18.801 1.00 34.00 C ATOM 40 OG1 THR A 3 4.363 -20.837 -18.517 1.00 13.00 O ATOM 41 CG2 THR A 3 4.000 -19.283 -20.279 1.00 70.00 C ATOM 0 HA THR A 3 5.523 -18.115 -18.696 1.00 54.00 H new ATOM 0 HB THR A 3 2.837 -19.407 -18.491 1.00 34.00 H new ATOM 0 HG1 THR A 3 4.907 -20.817 -17.702 1.00 13.00 H new ATOM 0 HG21 THR A 3 3.389 -20.010 -20.813 1.00 70.00 H new ATOM 0 HG22 THR A 3 3.659 -18.276 -20.520 1.00 70.00 H new ATOM 0 HG23 THR A 3 5.042 -19.395 -20.579 1.00 70.00 H new ATOM 49 N ASP A 4 3.771 -16.300 -18.311 1.00 31.00 N ATOM 50 CA ASP A 4 2.917 -15.186 -17.938 1.00 74.00 C ATOM 51 C ASP A 4 1.482 -15.549 -18.295 1.00 5.00 C ATOM 52 O ASP A 4 1.254 -16.439 -19.119 1.00 24.00 O ATOM 53 CB ASP A 4 3.354 -13.874 -18.623 1.00 44.00 C ATOM 54 CG ASP A 4 4.721 -13.377 -18.199 1.00 44.00 C ATOM 55 OD1 ASP A 4 5.747 -13.879 -18.740 1.00 60.00 O ATOM 56 OD2 ASP A 4 4.812 -12.439 -17.393 1.00 53.00 O ATOM 0 H ASP A 4 4.281 -16.176 -19.185 1.00 31.00 H new ATOM 0 HA ASP A 4 2.999 -15.008 -16.866 1.00 74.00 H new ATOM 0 HB2 ASP A 4 3.353 -14.023 -19.703 1.00 44.00 H new ATOM 0 HB3 ASP A 4 2.616 -13.101 -18.407 1.00 44.00 H new ATOM 61 N THR A 5 0.529 -14.934 -17.675 1.00 24.00 N ATOM 62 CA THR A 5 -0.857 -15.271 -17.885 1.00 10.00 C ATOM 63 C THR A 5 -1.735 -14.031 -17.768 1.00 62.00 C ATOM 64 O THR A 5 -1.514 -13.205 -16.914 1.00 25.00 O ATOM 65 CB THR A 5 -1.297 -16.361 -16.879 1.00 71.00 C ATOM 66 OG1 THR A 5 -0.444 -17.514 -17.013 1.00 12.00 O ATOM 67 CG2 THR A 5 -2.738 -16.778 -17.090 1.00 53.00 C ATOM 0 H THR A 5 0.681 -14.180 -17.005 1.00 24.00 H new ATOM 0 HA THR A 5 -0.973 -15.667 -18.894 1.00 10.00 H new ATOM 0 HB THR A 5 -1.212 -15.940 -15.877 1.00 71.00 H new ATOM 0 HG1 THR A 5 -0.723 -18.203 -16.374 1.00 12.00 H new ATOM 0 HG21 THR A 5 -3.005 -17.545 -16.363 1.00 53.00 H new ATOM 0 HG22 THR A 5 -3.389 -15.914 -16.962 1.00 53.00 H new ATOM 0 HG23 THR A 5 -2.858 -17.176 -18.098 1.00 53.00 H new ATOM 75 N LEU A 6 -2.737 -13.918 -18.633 1.00 4.00 N ATOM 76 CA LEU A 6 -3.568 -12.727 -18.659 1.00 14.00 C ATOM 77 C LEU A 6 -4.620 -12.701 -17.530 1.00 31.00 C ATOM 78 O LEU A 6 -4.490 -13.406 -16.524 1.00 13.00 O ATOM 79 CB LEU A 6 -4.191 -12.506 -20.051 1.00 41.00 C ATOM 80 CG LEU A 6 -3.201 -12.311 -21.204 1.00 3.00 C ATOM 81 CD1 LEU A 6 -3.937 -11.959 -22.479 1.00 1.00 C ATOM 82 CD2 LEU A 6 -2.161 -11.244 -20.884 1.00 14.00 C ATOM 0 H LEU A 6 -2.989 -14.631 -19.318 1.00 4.00 H new ATOM 0 HA LEU A 6 -2.909 -11.881 -18.462 1.00 14.00 H new ATOM 0 HB2 LEU A 6 -4.826 -13.361 -20.283 1.00 41.00 H new ATOM 0 HB3 LEU A 6 -4.840 -11.631 -20.003 1.00 41.00 H new ATOM 0 HG LEU A 6 -2.674 -13.255 -21.345 1.00 3.00 H new ATOM 0 HD11 LEU A 6 -3.219 -11.824 -23.288 1.00 1.00 H new ATOM 0 HD12 LEU A 6 -4.626 -12.764 -22.736 1.00 1.00 H new ATOM 0 HD13 LEU A 6 -4.497 -11.035 -22.333 1.00 1.00 H new ATOM 0 HD21 LEU A 6 -1.478 -11.137 -21.727 1.00 14.00 H new ATOM 0 HD22 LEU A 6 -2.661 -10.293 -20.698 1.00 14.00 H new ATOM 0 HD23 LEU A 6 -1.599 -11.538 -19.997 1.00 14.00 H new ATOM 94 N GLU A 7 -5.677 -11.905 -17.724 1.00 50.00 N ATOM 95 CA GLU A 7 -6.643 -11.631 -16.693 1.00 22.00 C ATOM 96 C GLU A 7 -7.470 -12.879 -16.454 1.00 35.00 C ATOM 97 O GLU A 7 -7.846 -13.189 -15.334 1.00 74.00 O ATOM 98 CB GLU A 7 -7.563 -10.486 -17.145 1.00 53.00 C ATOM 99 CG GLU A 7 -8.594 -10.107 -16.107 1.00 34.00 C ATOM 100 CD GLU A 7 -9.614 -9.111 -16.604 1.00 24.00 C ATOM 101 OE1 GLU A 7 -10.487 -9.505 -17.395 1.00 65.00 O ATOM 102 OE2 GLU A 7 -9.566 -7.918 -16.210 1.00 23.00 O ATOM 0 H GLU A 7 -5.874 -11.438 -18.609 1.00 50.00 H new ATOM 0 HA GLU A 7 -6.133 -11.342 -15.774 1.00 22.00 H new ATOM 0 HB2 GLU A 7 -6.956 -9.612 -17.381 1.00 53.00 H new ATOM 0 HB3 GLU A 7 -8.072 -10.778 -18.064 1.00 53.00 H new ATOM 0 HG2 GLU A 7 -9.110 -11.007 -15.774 1.00 34.00 H new ATOM 0 HG3 GLU A 7 -8.086 -9.691 -15.237 1.00 34.00 H new ATOM 109 N TYR A 8 -7.666 -13.614 -17.550 1.00 44.00 N ATOM 110 CA TYR A 8 -8.481 -14.818 -17.664 1.00 40.00 C ATOM 111 C TYR A 8 -9.930 -14.703 -17.124 1.00 23.00 C ATOM 112 O TYR A 8 -10.643 -15.698 -17.043 1.00 55.00 O ATOM 113 CB TYR A 8 -7.773 -16.100 -17.148 1.00 51.00 C ATOM 114 CG TYR A 8 -7.624 -16.297 -15.642 1.00 52.00 C ATOM 115 CD1 TYR A 8 -8.654 -16.855 -14.895 1.00 71.00 C ATOM 116 CD2 TYR A 8 -6.449 -15.972 -14.985 1.00 61.00 C ATOM 117 CE1 TYR A 8 -8.522 -17.076 -13.546 1.00 74.00 C ATOM 118 CE2 TYR A 8 -6.313 -16.187 -13.628 1.00 31.00 C ATOM 119 CZ TYR A 8 -7.354 -16.740 -12.915 1.00 2.00 C ATOM 120 OH TYR A 8 -7.219 -16.969 -11.558 1.00 62.00 O ATOM 0 H TYR A 8 -7.230 -13.365 -18.438 1.00 44.00 H new ATOM 0 HA TYR A 8 -8.595 -14.923 -18.743 1.00 40.00 H new ATOM 0 HB2 TYR A 8 -8.316 -16.959 -17.542 1.00 51.00 H new ATOM 0 HB3 TYR A 8 -6.775 -16.126 -17.585 1.00 51.00 H new ATOM 0 HD1 TYR A 8 -9.579 -17.121 -15.386 1.00 71.00 H new ATOM 0 HD2 TYR A 8 -5.628 -15.545 -15.542 1.00 61.00 H new ATOM 0 HE1 TYR A 8 -9.335 -17.513 -12.986 1.00 74.00 H new ATOM 0 HE2 TYR A 8 -5.393 -15.923 -13.127 1.00 31.00 H new ATOM 0 HH TYR A 8 -6.331 -16.676 -11.264 1.00 62.00 H new ATOM 130 N GLN A 9 -10.391 -13.510 -16.872 1.00 74.00 N ATOM 131 CA GLN A 9 -11.673 -13.302 -16.213 1.00 5.00 C ATOM 132 C GLN A 9 -12.463 -12.337 -16.984 1.00 61.00 C ATOM 133 O GLN A 9 -13.160 -11.475 -16.447 1.00 43.00 O ATOM 134 CB GLN A 9 -11.467 -12.832 -14.794 1.00 35.00 C ATOM 135 CG GLN A 9 -10.746 -13.858 -13.993 1.00 42.00 C ATOM 136 CD GLN A 9 -10.562 -13.487 -12.543 1.00 11.00 C ATOM 137 OE1 GLN A 9 -10.448 -12.313 -12.194 1.00 70.00 O ATOM 138 NE2 GLN A 9 -10.535 -14.475 -11.684 1.00 24.00 N ATOM 0 H GLN A 9 -9.899 -12.649 -17.112 1.00 74.00 H new ATOM 0 HA GLN A 9 -12.218 -14.245 -16.170 1.00 5.00 H new ATOM 0 HB2 GLN A 9 -10.900 -11.901 -14.794 1.00 35.00 H new ATOM 0 HB3 GLN A 9 -12.432 -12.618 -14.334 1.00 35.00 H new ATOM 0 HG2 GLN A 9 -11.293 -14.799 -14.050 1.00 42.00 H new ATOM 0 HG3 GLN A 9 -9.767 -14.031 -14.440 1.00 42.00 H new ATOM 0 HE21 GLN A 9 -10.633 -15.437 -12.010 1.00 24.00 H new ATOM 0 HE22 GLN A 9 -10.416 -14.283 -10.689 1.00 24.00 H new ATOM 147 N CYS A 10 -12.411 -12.549 -18.244 1.00 13.00 N ATOM 148 CA CYS A 10 -13.088 -11.725 -19.183 1.00 31.00 C ATOM 149 C CYS A 10 -14.573 -11.973 -19.016 1.00 55.00 C ATOM 150 O CYS A 10 -14.965 -13.087 -18.623 1.00 33.00 O ATOM 151 CB CYS A 10 -12.598 -12.040 -20.587 1.00 30.00 C ATOM 152 SG CYS A 10 -10.791 -11.835 -20.793 1.00 74.00 S ATOM 0 H CYS A 10 -11.887 -13.316 -18.666 1.00 13.00 H new ATOM 0 HA CYS A 10 -12.886 -10.667 -19.013 1.00 31.00 H new ATOM 0 HB2 CYS A 10 -12.870 -13.066 -20.837 1.00 30.00 H new ATOM 0 HB3 CYS A 10 -13.112 -11.392 -21.297 1.00 30.00 H new ATOM 157 N ASP A 11 -15.377 -10.964 -19.317 1.00 22.00 N ATOM 158 CA ASP A 11 -16.825 -10.931 -19.013 1.00 72.00 C ATOM 159 C ASP A 11 -17.563 -12.235 -19.260 1.00 15.00 C ATOM 160 O ASP A 11 -18.356 -12.651 -18.435 1.00 33.00 O ATOM 161 CB ASP A 11 -17.534 -9.796 -19.754 1.00 72.00 C ATOM 162 CG ASP A 11 -18.982 -9.637 -19.311 1.00 12.00 C ATOM 163 OD1 ASP A 11 -19.235 -8.892 -18.335 1.00 54.00 O ATOM 164 OD2 ASP A 11 -19.895 -10.239 -19.922 1.00 43.00 O ATOM 0 H ASP A 11 -15.048 -10.122 -19.789 1.00 22.00 H new ATOM 0 HA ASP A 11 -16.862 -10.756 -17.938 1.00 72.00 H new ATOM 0 HB2 ASP A 11 -16.999 -8.862 -19.583 1.00 72.00 H new ATOM 0 HB3 ASP A 11 -17.503 -9.989 -20.826 1.00 72.00 H new ATOM 169 N GLU A 12 -17.294 -12.908 -20.350 1.00 72.00 N ATOM 170 CA GLU A 12 -18.074 -14.093 -20.624 1.00 62.00 C ATOM 171 C GLU A 12 -17.246 -15.329 -20.522 1.00 0.00 C ATOM 172 O GLU A 12 -17.763 -16.412 -20.252 1.00 32.00 O ATOM 173 CB GLU A 12 -18.586 -14.096 -22.054 1.00 20.00 C ATOM 174 CG GLU A 12 -18.769 -12.760 -22.698 1.00 62.00 C ATOM 175 CD GLU A 12 -19.364 -12.913 -24.063 1.00 73.00 C ATOM 176 OE1 GLU A 12 -20.425 -13.558 -24.186 1.00 43.00 O ATOM 177 OE2 GLU A 12 -18.795 -12.404 -25.043 1.00 71.00 O ATOM 0 H GLU A 12 -16.576 -12.673 -21.035 1.00 72.00 H new ATOM 0 HA GLU A 12 -18.883 -14.082 -19.894 1.00 62.00 H new ATOM 0 HB2 GLU A 12 -17.894 -14.677 -22.663 1.00 20.00 H new ATOM 0 HB3 GLU A 12 -19.543 -14.618 -22.073 1.00 20.00 H new ATOM 0 HG2 GLU A 12 -19.416 -12.138 -22.080 1.00 62.00 H new ATOM 0 HG3 GLU A 12 -17.809 -12.249 -22.769 1.00 62.00 H new ATOM 184 N LYS A 13 -15.976 -15.176 -20.677 1.00 52.00 N ATOM 185 CA LYS A 13 -15.211 -16.256 -21.099 1.00 50.00 C ATOM 186 C LYS A 13 -13.821 -16.132 -20.524 1.00 43.00 C ATOM 187 O LYS A 13 -13.278 -15.026 -20.452 1.00 31.00 O ATOM 188 CB LYS A 13 -15.275 -16.130 -22.642 1.00 44.00 C ATOM 189 CG LYS A 13 -13.987 -16.066 -23.388 1.00 13.00 C ATOM 190 CD LYS A 13 -13.498 -17.451 -23.733 1.00 4.00 C ATOM 191 CE LYS A 13 -12.153 -17.439 -24.408 1.00 10.00 C ATOM 192 NZ LYS A 13 -11.708 -18.814 -24.687 1.00 43.00 N ATOM 0 H LYS A 13 -15.463 -14.309 -20.514 1.00 52.00 H new ATOM 0 HA LYS A 13 -15.554 -17.238 -20.774 1.00 50.00 H new ATOM 0 HB2 LYS A 13 -15.841 -16.979 -23.024 1.00 44.00 H new ATOM 0 HB3 LYS A 13 -15.846 -15.233 -22.881 1.00 44.00 H new ATOM 0 HG2 LYS A 13 -14.119 -15.484 -24.300 1.00 13.00 H new ATOM 0 HG3 LYS A 13 -13.238 -15.551 -22.786 1.00 13.00 H new ATOM 0 HD2 LYS A 13 -13.438 -18.048 -22.823 1.00 4.00 H new ATOM 0 HD3 LYS A 13 -14.224 -17.936 -24.386 1.00 4.00 H new ATOM 0 HE2 LYS A 13 -12.210 -16.873 -25.338 1.00 10.00 H new ATOM 0 HE3 LYS A 13 -11.424 -16.936 -23.773 1.00 10.00 H new ATOM 0 HZ1 LYS A 13 -10.810 -18.995 -24.195 1.00 43.00 H new ATOM 0 HZ2 LYS A 13 -12.428 -19.486 -24.353 1.00 43.00 H new ATOM 0 HZ3 LYS A 13 -11.571 -18.934 -25.711 1.00 43.00 H new ATOM 206 N PRO A 14 -13.244 -17.231 -20.060 1.00 34.00 N ATOM 207 CA PRO A 14 -11.921 -17.207 -19.504 1.00 14.00 C ATOM 208 C PRO A 14 -10.863 -17.152 -20.605 1.00 13.00 C ATOM 209 O PRO A 14 -10.865 -17.968 -21.542 1.00 71.00 O ATOM 210 CB PRO A 14 -11.829 -18.518 -18.719 1.00 30.00 C ATOM 211 CG PRO A 14 -12.761 -19.450 -19.423 1.00 65.00 C ATOM 212 CD PRO A 14 -13.842 -18.591 -20.030 1.00 42.00 C ATOM 0 HA PRO A 14 -11.744 -16.330 -18.881 1.00 14.00 H new ATOM 0 HB2 PRO A 14 -10.810 -18.906 -18.714 1.00 30.00 H new ATOM 0 HB3 PRO A 14 -12.121 -18.377 -17.678 1.00 30.00 H new ATOM 0 HG2 PRO A 14 -12.236 -20.016 -20.193 1.00 65.00 H new ATOM 0 HG3 PRO A 14 -13.185 -20.174 -18.728 1.00 65.00 H new ATOM 0 HD2 PRO A 14 -14.109 -18.932 -21.030 1.00 42.00 H new ATOM 0 HD3 PRO A 14 -14.753 -18.614 -19.432 1.00 42.00 H new ATOM 220 N LEU A 15 -9.980 -16.208 -20.509 1.00 0.00 N ATOM 221 CA LEU A 15 -8.948 -16.079 -21.466 1.00 70.00 C ATOM 222 C LEU A 15 -7.636 -16.198 -20.770 1.00 35.00 C ATOM 223 O LEU A 15 -6.962 -15.203 -20.447 1.00 75.00 O ATOM 224 CB LEU A 15 -9.053 -14.793 -22.285 1.00 30.00 C ATOM 225 CG LEU A 15 -7.939 -14.587 -23.312 1.00 60.00 C ATOM 226 CD1 LEU A 15 -7.901 -15.743 -24.308 1.00 0.00 C ATOM 227 CD2 LEU A 15 -8.105 -13.272 -24.040 1.00 72.00 C ATOM 0 H LEU A 15 -9.961 -15.511 -19.764 1.00 0.00 H new ATOM 0 HA LEU A 15 -9.046 -16.883 -22.196 1.00 70.00 H new ATOM 0 HB2 LEU A 15 -10.011 -14.789 -22.805 1.00 30.00 H new ATOM 0 HB3 LEU A 15 -9.058 -13.944 -21.601 1.00 30.00 H new ATOM 0 HG LEU A 15 -6.992 -14.561 -22.774 1.00 60.00 H new ATOM 0 HD11 LEU A 15 -7.101 -15.576 -25.029 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -7.720 -16.676 -23.775 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -8.855 -15.804 -24.832 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -7.299 -13.153 -24.764 1.00 72.00 H new ATOM 0 HD22 LEU A 15 -9.063 -13.262 -24.559 1.00 72.00 H new ATOM 0 HD23 LEU A 15 -8.073 -12.452 -23.322 1.00 72.00 H new ATOM 239 N THR A 16 -7.359 -17.389 -20.398 1.00 1.00 N ATOM 240 CA THR A 16 -6.155 -17.701 -19.763 1.00 54.00 C ATOM 241 C THR A 16 -5.135 -17.949 -20.844 1.00 3.00 C ATOM 242 O THR A 16 -5.316 -18.828 -21.694 1.00 13.00 O ATOM 243 CB THR A 16 -6.325 -18.943 -18.886 1.00 1.00 C ATOM 244 OG1 THR A 16 -7.683 -18.982 -18.395 1.00 44.00 O ATOM 245 CG2 THR A 16 -5.403 -18.837 -17.700 1.00 50.00 C ATOM 0 H THR A 16 -7.982 -18.186 -20.533 1.00 1.00 H new ATOM 0 HA THR A 16 -5.834 -16.886 -19.115 1.00 54.00 H new ATOM 0 HB THR A 16 -6.098 -19.838 -19.466 1.00 1.00 H new ATOM 0 HG1 THR A 16 -7.805 -19.775 -17.833 1.00 44.00 H new ATOM 0 HG21 THR A 16 -5.518 -19.719 -17.070 1.00 50.00 H new ATOM 0 HG22 THR A 16 -4.371 -18.770 -18.046 1.00 50.00 H new ATOM 0 HG23 THR A 16 -5.651 -17.945 -17.125 1.00 50.00 H new ATOM 253 N VAL A 17 -4.114 -17.152 -20.848 1.00 32.00 N ATOM 254 CA VAL A 17 -3.119 -17.209 -21.872 1.00 14.00 C ATOM 255 C VAL A 17 -1.810 -17.474 -21.240 1.00 22.00 C ATOM 256 O VAL A 17 -1.525 -16.932 -20.190 1.00 50.00 O ATOM 257 CB VAL A 17 -3.028 -15.868 -22.638 1.00 1.00 C ATOM 258 CG1 VAL A 17 -1.961 -15.917 -23.718 1.00 14.00 C ATOM 259 CG2 VAL A 17 -4.365 -15.514 -23.247 1.00 41.00 C ATOM 0 H VAL A 17 -3.946 -16.440 -20.138 1.00 32.00 H new ATOM 0 HA VAL A 17 -3.388 -17.997 -22.575 1.00 14.00 H new ATOM 0 HB VAL A 17 -2.748 -15.097 -21.920 1.00 1.00 H new ATOM 0 HG11 VAL A 17 -1.924 -14.959 -24.236 1.00 14.00 H new ATOM 0 HG12 VAL A 17 -0.992 -16.121 -23.263 1.00 14.00 H new ATOM 0 HG13 VAL A 17 -2.201 -16.706 -24.431 1.00 14.00 H new ATOM 0 HG21 VAL A 17 -4.282 -14.568 -23.782 1.00 41.00 H new ATOM 0 HG22 VAL A 17 -4.668 -16.298 -23.941 1.00 41.00 H new ATOM 0 HG23 VAL A 17 -5.111 -15.420 -22.458 1.00 41.00 H new ATOM 269 N LYS A 18 -1.035 -18.307 -21.846 1.00 33.00 N ATOM 270 CA LYS A 18 0.259 -18.567 -21.374 1.00 11.00 C ATOM 271 C LYS A 18 1.199 -17.848 -22.250 1.00 51.00 C ATOM 272 O LYS A 18 1.489 -18.287 -23.355 1.00 34.00 O ATOM 273 CB LYS A 18 0.589 -20.066 -21.299 1.00 52.00 C ATOM 274 CG LYS A 18 -0.016 -20.799 -20.105 1.00 0.00 C ATOM 275 CD LYS A 18 -1.525 -20.885 -20.179 1.00 20.00 C ATOM 276 CE LYS A 18 -2.111 -21.507 -18.928 1.00 32.00 C ATOM 277 NZ LYS A 18 -1.550 -22.843 -18.648 1.00 64.00 N ATOM 0 H LYS A 18 -1.293 -18.824 -22.687 1.00 33.00 H new ATOM 0 HA LYS A 18 0.341 -18.216 -20.345 1.00 11.00 H new ATOM 0 HB2 LYS A 18 0.243 -20.545 -22.215 1.00 52.00 H new ATOM 0 HB3 LYS A 18 1.672 -20.183 -21.268 1.00 52.00 H new ATOM 0 HG2 LYS A 18 0.399 -21.805 -20.053 1.00 0.00 H new ATOM 0 HG3 LYS A 18 0.271 -20.288 -19.186 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -1.940 -19.887 -20.318 1.00 20.00 H new ATOM 0 HD3 LYS A 18 -1.814 -21.475 -21.049 1.00 20.00 H new ATOM 0 HE2 LYS A 18 -1.923 -20.852 -18.078 1.00 32.00 H new ATOM 0 HE3 LYS A 18 -3.193 -21.586 -19.037 1.00 32.00 H new ATOM 0 HZ1 LYS A 18 -2.107 -23.304 -17.900 1.00 64.00 H new ATOM 0 HZ2 LYS A 18 -1.584 -23.422 -19.511 1.00 64.00 H new ATOM 0 HZ3 LYS A 18 -0.563 -22.746 -18.335 1.00 64.00 H new ATOM 291 N LEU A 19 1.575 -16.701 -21.801 1.00 11.00 N ATOM 292 CA LEU A 19 2.489 -15.868 -22.483 1.00 44.00 C ATOM 293 C LEU A 19 3.860 -16.401 -22.318 1.00 63.00 C ATOM 294 O LEU A 19 4.521 -16.180 -21.289 1.00 73.00 O ATOM 295 CB LEU A 19 2.419 -14.442 -21.965 1.00 71.00 C ATOM 296 CG LEU A 19 1.422 -13.492 -22.619 1.00 4.00 C ATOM 297 CD1 LEU A 19 1.341 -12.217 -21.800 1.00 12.00 C ATOM 298 CD2 LEU A 19 1.881 -13.151 -24.033 1.00 75.00 C ATOM 0 H LEU A 19 1.241 -16.309 -20.920 1.00 11.00 H new ATOM 0 HA LEU A 19 2.226 -15.856 -23.541 1.00 44.00 H new ATOM 0 HB2 LEU A 19 2.191 -14.484 -20.900 1.00 71.00 H new ATOM 0 HB3 LEU A 19 3.412 -14.002 -22.061 1.00 71.00 H new ATOM 0 HG LEU A 19 0.444 -13.970 -22.664 1.00 4.00 H new ATOM 0 HD11 LEU A 19 0.630 -11.532 -22.262 1.00 12.00 H new ATOM 0 HD12 LEU A 19 1.012 -12.455 -20.788 1.00 12.00 H new ATOM 0 HD13 LEU A 19 2.324 -11.747 -21.761 1.00 12.00 H new ATOM 0 HD21 LEU A 19 1.164 -12.472 -24.494 1.00 75.00 H new ATOM 0 HD22 LEU A 19 2.860 -12.673 -23.992 1.00 75.00 H new ATOM 0 HD23 LEU A 19 1.948 -14.064 -24.624 1.00 75.00 H new ATOM 310 N ASN A 20 4.255 -17.177 -23.262 1.00 54.00 N ATOM 311 CA ASN A 20 5.610 -17.653 -23.296 1.00 70.00 C ATOM 312 C ASN A 20 6.455 -16.546 -23.857 1.00 33.00 C ATOM 313 O ASN A 20 6.684 -16.467 -25.066 1.00 31.00 O ATOM 314 CB ASN A 20 5.791 -18.953 -24.112 1.00 15.00 C ATOM 315 CG ASN A 20 5.219 -20.186 -23.447 1.00 73.00 C ATOM 316 OD1 ASN A 20 4.050 -20.544 -23.631 1.00 74.00 O ATOM 317 ND2 ASN A 20 6.037 -20.868 -22.694 1.00 42.00 N ATOM 0 H ASN A 20 3.665 -17.502 -24.028 1.00 54.00 H new ATOM 0 HA ASN A 20 5.914 -17.916 -22.283 1.00 70.00 H new ATOM 0 HB2 ASN A 20 5.318 -18.826 -25.086 1.00 15.00 H new ATOM 0 HB3 ASN A 20 6.854 -19.111 -24.292 1.00 15.00 H new ATOM 0 HD21 ASN A 20 5.718 -21.723 -22.238 1.00 42.00 H new ATOM 0 HD22 ASN A 20 6.996 -20.547 -22.561 1.00 42.00 H new ATOM 324 N ASN A 21 6.847 -15.653 -22.977 1.00 15.00 N ATOM 325 CA ASN A 21 7.555 -14.424 -23.330 1.00 41.00 C ATOM 326 C ASN A 21 8.814 -14.648 -24.213 1.00 61.00 C ATOM 327 O ASN A 21 8.942 -14.005 -25.242 1.00 13.00 O ATOM 328 CB ASN A 21 7.886 -13.601 -22.080 1.00 71.00 C ATOM 329 CG ASN A 21 8.262 -12.175 -22.420 1.00 14.00 C ATOM 330 OD1 ASN A 21 7.771 -11.617 -23.396 1.00 40.00 O ATOM 331 ND2 ASN A 21 9.107 -11.567 -21.627 1.00 22.00 N ATOM 0 H ASN A 21 6.684 -15.754 -21.975 1.00 15.00 H new ATOM 0 HA ASN A 21 6.865 -13.854 -23.952 1.00 41.00 H new ATOM 0 HB2 ASN A 21 7.026 -13.599 -21.410 1.00 71.00 H new ATOM 0 HB3 ASN A 21 8.708 -14.074 -21.542 1.00 71.00 H new ATOM 0 HD21 ASN A 21 9.375 -10.601 -21.812 1.00 22.00 H new ATOM 0 HD22 ASN A 21 9.497 -12.060 -20.824 1.00 22.00 H new ATOM 338 N PRO A 22 9.749 -15.594 -23.869 1.00 41.00 N ATOM 339 CA PRO A 22 10.958 -15.836 -24.692 1.00 24.00 C ATOM 340 C PRO A 22 10.644 -16.557 -26.016 1.00 53.00 C ATOM 341 O PRO A 22 11.523 -16.767 -26.854 1.00 63.00 O ATOM 342 CB PRO A 22 11.831 -16.742 -23.806 1.00 43.00 C ATOM 343 CG PRO A 22 11.206 -16.706 -22.454 1.00 4.00 C ATOM 344 CD PRO A 22 9.754 -16.469 -22.677 1.00 55.00 C ATOM 0 HA PRO A 22 11.433 -14.897 -24.977 1.00 24.00 H new ATOM 0 HB2 PRO A 22 11.862 -17.759 -24.196 1.00 43.00 H new ATOM 0 HB3 PRO A 22 12.859 -16.383 -23.772 1.00 43.00 H new ATOM 0 HG2 PRO A 22 11.371 -17.644 -21.923 1.00 4.00 H new ATOM 0 HG3 PRO A 22 11.641 -15.914 -21.844 1.00 4.00 H new ATOM 0 HD2 PRO A 22 9.214 -17.399 -22.855 1.00 55.00 H new ATOM 0 HD3 PRO A 22 9.285 -15.987 -21.819 1.00 55.00 H new ATOM 352 N ARG A 23 9.405 -16.949 -26.179 1.00 70.00 N ATOM 353 CA ARG A 23 8.973 -17.696 -27.350 1.00 71.00 C ATOM 354 C ARG A 23 8.160 -16.867 -28.306 1.00 64.00 C ATOM 355 O ARG A 23 8.208 -17.092 -29.519 1.00 64.00 O ATOM 356 CB ARG A 23 8.110 -18.863 -26.921 1.00 45.00 C ATOM 357 CG ARG A 23 8.849 -20.030 -26.349 1.00 4.00 C ATOM 358 CD ARG A 23 9.653 -20.704 -27.430 1.00 44.00 C ATOM 359 NE ARG A 23 10.160 -21.996 -27.021 1.00 23.00 N ATOM 360 CZ ARG A 23 9.816 -23.147 -27.614 1.00 73.00 C ATOM 361 NH1 ARG A 23 8.780 -23.190 -28.478 1.00 63.00 N ATOM 362 NH2 ARG A 23 10.455 -24.258 -27.297 1.00 1.00 N ATOM 0 H ARG A 23 8.661 -16.762 -25.507 1.00 70.00 H new ATOM 0 HA ARG A 23 9.881 -18.024 -27.856 1.00 71.00 H new ATOM 0 HB2 ARG A 23 7.393 -18.510 -26.180 1.00 45.00 H new ATOM 0 HB3 ARG A 23 7.536 -19.205 -27.782 1.00 45.00 H new ATOM 0 HG2 ARG A 23 9.508 -19.697 -25.547 1.00 4.00 H new ATOM 0 HG3 ARG A 23 8.146 -20.738 -25.911 1.00 4.00 H new ATOM 0 HD2 ARG A 23 9.032 -20.826 -28.318 1.00 44.00 H new ATOM 0 HD3 ARG A 23 10.488 -20.062 -27.711 1.00 44.00 H new ATOM 0 HE ARG A 23 10.814 -22.032 -26.239 1.00 23.00 H new ATOM 0 HH11 ARG A 23 8.252 -22.342 -28.684 1.00 63.00 H new ATOM 0 HH12 ARG A 23 8.525 -24.071 -28.925 1.00 63.00 H new ATOM 0 HH21 ARG A 23 11.204 -24.236 -26.605 1.00 1.00 H new ATOM 0 HH22 ARG A 23 10.199 -25.139 -27.744 1.00 1.00 H new ATOM 376 N GLN A 24 7.409 -15.920 -27.756 1.00 13.00 N ATOM 377 CA GLN A 24 6.412 -15.185 -28.495 1.00 43.00 C ATOM 378 C GLN A 24 5.350 -16.158 -28.971 1.00 54.00 C ATOM 379 O GLN A 24 4.894 -16.149 -30.133 1.00 74.00 O ATOM 380 CB GLN A 24 7.012 -14.352 -29.618 1.00 73.00 C ATOM 381 CG GLN A 24 7.807 -13.160 -29.123 1.00 22.00 C ATOM 382 CD GLN A 24 6.992 -12.284 -28.188 1.00 30.00 C ATOM 383 OE1 GLN A 24 6.993 -12.477 -26.973 1.00 54.00 O ATOM 384 NE2 GLN A 24 6.291 -11.337 -28.732 1.00 1.00 N ATOM 0 H GLN A 24 7.482 -15.645 -26.776 1.00 13.00 H new ATOM 0 HA GLN A 24 5.943 -14.451 -27.839 1.00 43.00 H new ATOM 0 HB2 GLN A 24 7.660 -14.985 -30.224 1.00 73.00 H new ATOM 0 HB3 GLN A 24 6.211 -14.001 -30.268 1.00 73.00 H new ATOM 0 HG2 GLN A 24 8.701 -13.509 -28.606 1.00 22.00 H new ATOM 0 HG3 GLN A 24 8.142 -12.568 -29.975 1.00 22.00 H new ATOM 0 HE21 GLN A 24 6.312 -11.203 -29.743 1.00 1.00 H new ATOM 0 HE22 GLN A 24 5.719 -10.726 -28.149 1.00 1.00 H new ATOM 393 N GLU A 25 4.991 -17.008 -28.040 1.00 0.00 N ATOM 394 CA GLU A 25 3.971 -17.997 -28.178 1.00 52.00 C ATOM 395 C GLU A 25 3.032 -17.865 -27.036 1.00 65.00 C ATOM 396 O GLU A 25 3.419 -17.447 -25.947 1.00 60.00 O ATOM 397 CB GLU A 25 4.542 -19.414 -28.187 1.00 45.00 C ATOM 398 CG GLU A 25 5.105 -19.855 -29.508 1.00 73.00 C ATOM 399 CD GLU A 25 5.768 -21.207 -29.424 1.00 21.00 C ATOM 400 OE1 GLU A 25 5.079 -22.236 -29.595 1.00 52.00 O ATOM 401 OE2 GLU A 25 6.994 -21.268 -29.197 1.00 2.00 O ATOM 0 H GLU A 25 5.431 -17.022 -27.120 1.00 0.00 H new ATOM 0 HA GLU A 25 3.466 -17.836 -29.131 1.00 52.00 H new ATOM 0 HB2 GLU A 25 5.326 -19.480 -27.433 1.00 45.00 H new ATOM 0 HB3 GLU A 25 3.757 -20.110 -27.892 1.00 45.00 H new ATOM 0 HG2 GLU A 25 4.305 -19.890 -30.248 1.00 73.00 H new ATOM 0 HG3 GLU A 25 5.829 -19.118 -29.856 1.00 73.00 H new ATOM 408 N VAL A 26 1.821 -18.175 -27.285 1.00 1.00 N ATOM 409 CA VAL A 26 0.804 -18.173 -26.276 1.00 74.00 C ATOM 410 C VAL A 26 0.060 -19.447 -26.347 1.00 4.00 C ATOM 411 O VAL A 26 -0.055 -20.049 -27.399 1.00 40.00 O ATOM 412 CB VAL A 26 -0.195 -16.998 -26.425 1.00 61.00 C ATOM 413 CG1 VAL A 26 0.487 -15.660 -26.270 1.00 63.00 C ATOM 414 CG2 VAL A 26 -0.958 -17.058 -27.724 1.00 71.00 C ATOM 0 H VAL A 26 1.487 -18.445 -28.210 1.00 1.00 H new ATOM 0 HA VAL A 26 1.301 -18.053 -25.314 1.00 74.00 H new ATOM 0 HB VAL A 26 -0.916 -17.106 -25.615 1.00 61.00 H new ATOM 0 HG11 VAL A 26 -0.247 -14.862 -26.381 1.00 63.00 H new ATOM 0 HG12 VAL A 26 0.945 -15.597 -25.283 1.00 63.00 H new ATOM 0 HG13 VAL A 26 1.257 -15.553 -27.034 1.00 63.00 H new ATOM 0 HG21 VAL A 26 -1.645 -16.214 -27.782 1.00 71.00 H new ATOM 0 HG22 VAL A 26 -0.259 -17.015 -28.559 1.00 71.00 H new ATOM 0 HG23 VAL A 26 -1.523 -17.989 -27.772 1.00 71.00 H new ATOM 424 N SER A 27 -0.372 -19.887 -25.252 1.00 14.00 N ATOM 425 CA SER A 27 -1.221 -21.004 -25.189 1.00 50.00 C ATOM 426 C SER A 27 -2.435 -20.551 -24.479 1.00 0.00 C ATOM 427 O SER A 27 -2.355 -20.125 -23.339 1.00 72.00 O ATOM 428 CB SER A 27 -0.560 -22.169 -24.477 1.00 63.00 C ATOM 429 OG SER A 27 0.687 -22.500 -25.100 1.00 70.00 O ATOM 0 H SER A 27 -0.146 -19.478 -24.345 1.00 14.00 H new ATOM 0 HA SER A 27 -1.462 -21.372 -26.186 1.00 50.00 H new ATOM 0 HB2 SER A 27 -0.393 -21.915 -23.430 1.00 63.00 H new ATOM 0 HB3 SER A 27 -1.222 -23.035 -24.493 1.00 63.00 H new ATOM 0 HG SER A 27 1.100 -23.252 -24.626 1.00 70.00 H new ATOM 435 N PHE A 28 -3.526 -20.566 -25.137 1.00 22.00 N ATOM 436 CA PHE A 28 -4.695 -20.048 -24.539 1.00 12.00 C ATOM 437 C PHE A 28 -5.732 -21.109 -24.431 1.00 0.00 C ATOM 438 O PHE A 28 -5.708 -22.121 -25.156 1.00 54.00 O ATOM 439 CB PHE A 28 -5.225 -18.778 -25.246 1.00 74.00 C ATOM 440 CG PHE A 28 -6.171 -19.000 -26.408 1.00 2.00 C ATOM 441 CD1 PHE A 28 -5.713 -19.374 -27.650 1.00 35.00 C ATOM 442 CD2 PHE A 28 -7.538 -18.823 -26.233 1.00 4.00 C ATOM 443 CE1 PHE A 28 -6.599 -19.569 -28.696 1.00 2.00 C ATOM 444 CE2 PHE A 28 -8.421 -19.018 -27.269 1.00 61.00 C ATOM 445 CZ PHE A 28 -7.951 -19.392 -28.502 1.00 33.00 C ATOM 0 H PHE A 28 -3.638 -20.928 -26.084 1.00 22.00 H new ATOM 0 HA PHE A 28 -4.431 -19.725 -23.532 1.00 12.00 H new ATOM 0 HB2 PHE A 28 -5.733 -18.161 -24.505 1.00 74.00 H new ATOM 0 HB3 PHE A 28 -4.370 -18.205 -25.606 1.00 74.00 H new ATOM 0 HD1 PHE A 28 -4.655 -19.517 -27.810 1.00 35.00 H new ATOM 0 HD2 PHE A 28 -7.914 -18.527 -25.265 1.00 4.00 H new ATOM 0 HE1 PHE A 28 -6.229 -19.861 -29.668 1.00 2.00 H new ATOM 0 HE2 PHE A 28 -9.480 -18.877 -27.112 1.00 61.00 H new ATOM 0 HZ PHE A 28 -8.640 -19.547 -29.319 1.00 33.00 H new ATOM 455 N VAL A 29 -6.601 -20.896 -23.531 1.00 22.00 N ATOM 456 CA VAL A 29 -7.634 -21.791 -23.241 1.00 25.00 C ATOM 457 C VAL A 29 -8.858 -21.471 -24.085 1.00 23.00 C ATOM 458 O VAL A 29 -9.426 -20.362 -24.053 1.00 52.00 O ATOM 459 CB VAL A 29 -7.956 -21.827 -21.708 1.00 40.00 C ATOM 460 CG1 VAL A 29 -8.561 -20.535 -21.199 1.00 43.00 C ATOM 461 CG2 VAL A 29 -8.801 -23.032 -21.338 1.00 42.00 C ATOM 0 H VAL A 29 -6.611 -20.056 -22.952 1.00 22.00 H new ATOM 0 HA VAL A 29 -7.305 -22.797 -23.503 1.00 25.00 H new ATOM 0 HB VAL A 29 -6.998 -21.932 -21.199 1.00 40.00 H new ATOM 0 HG11 VAL A 29 -8.761 -20.623 -20.131 1.00 43.00 H new ATOM 0 HG12 VAL A 29 -7.864 -19.714 -21.371 1.00 43.00 H new ATOM 0 HG13 VAL A 29 -9.493 -20.337 -21.728 1.00 43.00 H new ATOM 0 HG21 VAL A 29 -9.002 -23.020 -20.267 1.00 42.00 H new ATOM 0 HG22 VAL A 29 -9.743 -22.997 -21.885 1.00 42.00 H new ATOM 0 HG23 VAL A 29 -8.265 -23.945 -21.596 1.00 42.00 H new ATOM 471 N TYR A 30 -9.172 -22.391 -24.914 1.00 72.00 N ATOM 472 CA TYR A 30 -10.380 -22.338 -25.705 1.00 13.00 C ATOM 473 C TYR A 30 -11.544 -22.467 -24.763 1.00 61.00 C ATOM 474 O TYR A 30 -12.292 -21.521 -24.567 1.00 51.00 O ATOM 475 CB TYR A 30 -10.377 -23.459 -26.762 1.00 23.00 C ATOM 476 CG TYR A 30 -11.675 -23.608 -27.533 1.00 64.00 C ATOM 477 CD1 TYR A 30 -12.277 -22.522 -28.148 1.00 14.00 C ATOM 478 CD2 TYR A 30 -12.303 -24.842 -27.626 1.00 14.00 C ATOM 479 CE1 TYR A 30 -13.462 -22.664 -28.834 1.00 12.00 C ATOM 480 CE2 TYR A 30 -13.489 -24.992 -28.313 1.00 70.00 C ATOM 481 CZ TYR A 30 -14.063 -23.900 -28.915 1.00 11.00 C ATOM 482 OH TYR A 30 -15.245 -24.043 -29.611 1.00 54.00 O ATOM 0 H TYR A 30 -8.603 -23.221 -25.079 1.00 72.00 H new ATOM 0 HA TYR A 30 -10.450 -21.395 -26.247 1.00 13.00 H new ATOM 0 HB2 TYR A 30 -9.570 -23.270 -27.470 1.00 23.00 H new ATOM 0 HB3 TYR A 30 -10.153 -24.405 -26.268 1.00 23.00 H new ATOM 0 HD1 TYR A 30 -11.810 -21.550 -28.088 1.00 14.00 H new ATOM 0 HD2 TYR A 30 -11.854 -25.702 -27.151 1.00 14.00 H new ATOM 0 HE1 TYR A 30 -13.919 -21.808 -29.308 1.00 12.00 H new ATOM 0 HE2 TYR A 30 -13.962 -25.961 -28.377 1.00 70.00 H new ATOM 0 HH TYR A 30 -15.536 -24.978 -29.573 1.00 54.00 H new ATOM 492 N ASP A 31 -11.643 -23.590 -24.119 1.00 54.00 N ATOM 493 CA ASP A 31 -12.725 -23.785 -23.193 1.00 61.00 C ATOM 494 C ASP A 31 -12.224 -24.458 -21.920 1.00 12.00 C ATOM 495 O ASP A 31 -12.503 -24.002 -20.816 1.00 2.00 O ATOM 496 CB ASP A 31 -13.867 -24.576 -23.852 1.00 74.00 C ATOM 497 CG ASP A 31 -13.606 -26.060 -23.977 1.00 11.00 C ATOM 498 OD1 ASP A 31 -12.780 -26.469 -24.822 1.00 51.00 O ATOM 499 OD2 ASP A 31 -14.181 -26.840 -23.191 1.00 60.00 O ATOM 0 H ASP A 31 -11.000 -24.377 -24.212 1.00 54.00 H new ATOM 0 HA ASP A 31 -13.127 -22.812 -22.911 1.00 61.00 H new ATOM 0 HB2 ASP A 31 -14.778 -24.427 -23.272 1.00 74.00 H new ATOM 0 HB3 ASP A 31 -14.051 -24.167 -24.845 1.00 74.00 H new ATOM 504 N ASN A 32 -11.496 -25.537 -22.082 1.00 24.00 N ATOM 505 CA ASN A 32 -10.899 -26.278 -20.976 1.00 3.00 C ATOM 506 C ASN A 32 -9.719 -27.022 -21.564 1.00 72.00 C ATOM 507 O ASN A 32 -9.254 -28.029 -21.064 1.00 14.00 O ATOM 508 CB ASN A 32 -11.938 -27.271 -20.378 1.00 51.00 C ATOM 509 CG ASN A 32 -11.490 -27.933 -19.066 1.00 13.00 C ATOM 510 OD1 ASN A 32 -10.870 -28.999 -19.058 1.00 3.00 O ATOM 511 ND2 ASN A 32 -11.799 -27.313 -17.958 1.00 72.00 N ATOM 0 H ASN A 32 -11.293 -25.938 -22.998 1.00 24.00 H new ATOM 0 HA ASN A 32 -10.584 -25.619 -20.167 1.00 3.00 H new ATOM 0 HB2 ASN A 32 -12.874 -26.740 -20.203 1.00 51.00 H new ATOM 0 HB3 ASN A 32 -12.146 -28.049 -21.113 1.00 51.00 H new ATOM 0 HD21 ASN A 32 -11.527 -27.710 -17.059 1.00 72.00 H new ATOM 0 HD22 ASN A 32 -12.312 -26.432 -17.993 1.00 72.00 H new ATOM 518 N GLN A 33 -9.195 -26.461 -22.616 1.00 15.00 N ATOM 519 CA GLN A 33 -8.161 -27.067 -23.346 1.00 44.00 C ATOM 520 C GLN A 33 -7.287 -25.958 -23.783 1.00 3.00 C ATOM 521 O GLN A 33 -7.766 -24.820 -23.977 1.00 71.00 O ATOM 522 CB GLN A 33 -8.719 -27.834 -24.544 1.00 1.00 C ATOM 523 CG GLN A 33 -9.312 -26.942 -25.599 1.00 41.00 C ATOM 524 CD GLN A 33 -9.954 -27.701 -26.720 1.00 55.00 C ATOM 525 OE1 GLN A 33 -9.302 -28.052 -27.695 1.00 24.00 O ATOM 526 NE2 GLN A 33 -11.238 -27.917 -26.623 1.00 31.00 N ATOM 0 H GLN A 33 -9.491 -25.556 -22.982 1.00 15.00 H new ATOM 0 HA GLN A 33 -7.614 -27.795 -22.747 1.00 44.00 H new ATOM 0 HB2 GLN A 33 -7.922 -28.430 -24.988 1.00 1.00 H new ATOM 0 HB3 GLN A 33 -9.482 -28.531 -24.197 1.00 1.00 H new ATOM 0 HG2 GLN A 33 -10.054 -26.289 -25.139 1.00 41.00 H new ATOM 0 HG3 GLN A 33 -8.530 -26.300 -26.004 1.00 41.00 H new ATOM 0 HE21 GLN A 33 -11.746 -27.609 -25.794 1.00 31.00 H new ATOM 0 HE22 GLN A 33 -11.733 -28.394 -27.376 1.00 31.00 H new ATOM 535 N LEU A 34 -6.072 -26.237 -23.919 1.00 33.00 N ATOM 536 CA LEU A 34 -5.125 -25.241 -24.227 1.00 63.00 C ATOM 537 C LEU A 34 -4.548 -25.511 -25.588 1.00 3.00 C ATOM 538 O LEU A 34 -4.183 -26.653 -25.907 1.00 3.00 O ATOM 539 CB LEU A 34 -3.981 -25.205 -23.175 1.00 51.00 C ATOM 540 CG LEU A 34 -4.260 -24.647 -21.742 1.00 64.00 C ATOM 541 CD1 LEU A 34 -4.642 -23.191 -21.774 1.00 71.00 C ATOM 542 CD2 LEU A 34 -5.296 -25.465 -20.973 1.00 0.00 C ATOM 0 H LEU A 34 -5.685 -27.176 -23.821 1.00 33.00 H new ATOM 0 HA LEU A 34 -5.626 -24.273 -24.215 1.00 63.00 H new ATOM 0 HB2 LEU A 34 -3.612 -26.224 -23.061 1.00 51.00 H new ATOM 0 HB3 LEU A 34 -3.167 -24.617 -23.600 1.00 51.00 H new ATOM 0 HG LEU A 34 -3.319 -24.740 -21.199 1.00 64.00 H new ATOM 0 HD11 LEU A 34 -4.828 -22.841 -20.759 1.00 71.00 H new ATOM 0 HD12 LEU A 34 -3.831 -22.612 -22.215 1.00 71.00 H new ATOM 0 HD13 LEU A 34 -5.545 -23.065 -22.372 1.00 71.00 H new ATOM 0 HD21 LEU A 34 -5.446 -25.027 -19.986 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -6.240 -25.462 -21.518 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -4.943 -26.491 -20.865 1.00 0.00 H new ATOM 554 N LEU A 35 -4.507 -24.517 -26.395 1.00 43.00 N ATOM 555 CA LEU A 35 -3.827 -24.627 -27.653 1.00 50.00 C ATOM 556 C LEU A 35 -2.869 -23.505 -27.774 1.00 0.00 C ATOM 557 O LEU A 35 -2.966 -22.534 -27.029 1.00 11.00 O ATOM 558 CB LEU A 35 -4.755 -24.784 -28.900 1.00 45.00 C ATOM 559 CG LEU A 35 -5.704 -23.650 -29.352 1.00 61.00 C ATOM 560 CD1 LEU A 35 -6.706 -23.230 -28.289 1.00 52.00 C ATOM 561 CD2 LEU A 35 -4.975 -22.457 -29.959 1.00 52.00 C ATOM 0 H LEU A 35 -4.935 -23.609 -26.216 1.00 43.00 H new ATOM 0 HA LEU A 35 -3.285 -25.573 -27.649 1.00 50.00 H new ATOM 0 HB2 LEU A 35 -4.109 -25.013 -29.748 1.00 45.00 H new ATOM 0 HB3 LEU A 35 -5.374 -25.664 -28.725 1.00 45.00 H new ATOM 0 HG LEU A 35 -6.291 -24.092 -30.157 1.00 61.00 H new ATOM 0 HD11 LEU A 35 -7.337 -22.431 -28.679 1.00 52.00 H new ATOM 0 HD12 LEU A 35 -7.328 -24.083 -28.017 1.00 52.00 H new ATOM 0 HD13 LEU A 35 -6.173 -22.874 -27.407 1.00 52.00 H new ATOM 0 HD21 LEU A 35 -5.701 -21.699 -30.254 1.00 52.00 H new ATOM 0 HD22 LEU A 35 -4.290 -22.036 -29.223 1.00 52.00 H new ATOM 0 HD23 LEU A 35 -4.413 -22.781 -30.835 1.00 52.00 H new ATOM 573 N HIS A 36 -1.989 -23.583 -28.705 1.00 3.00 N ATOM 574 CA HIS A 36 -0.956 -22.612 -28.776 1.00 55.00 C ATOM 575 C HIS A 36 -0.939 -21.879 -30.078 1.00 3.00 C ATOM 576 O HIS A 36 -1.384 -22.379 -31.110 1.00 73.00 O ATOM 577 CB HIS A 36 0.426 -23.179 -28.383 1.00 20.00 C ATOM 578 CG HIS A 36 0.974 -24.276 -29.257 1.00 50.00 C ATOM 579 ND1 HIS A 36 0.912 -25.600 -28.880 1.00 13.00 N ATOM 580 CD2 HIS A 36 1.626 -24.182 -30.434 1.00 22.00 C ATOM 581 CE1 HIS A 36 1.536 -26.270 -29.842 1.00 22.00 C ATOM 582 NE2 HIS A 36 1.979 -25.453 -30.794 1.00 3.00 N ATOM 0 H HIS A 36 -1.962 -24.304 -29.426 1.00 3.00 H new ATOM 0 HA HIS A 36 -1.194 -21.864 -28.020 1.00 55.00 H new ATOM 0 HB2 HIS A 36 1.143 -22.358 -28.376 1.00 20.00 H new ATOM 0 HB3 HIS A 36 0.363 -23.555 -27.362 1.00 20.00 H new ATOM 0 HD2 HIS A 36 1.830 -23.277 -30.986 1.00 22.00 H new ATOM 0 HE1 HIS A 36 1.667 -27.342 -29.850 1.00 22.00 H new ATOM 0 HE2 HIS A 36 2.487 -25.724 -31.636 1.00 3.00 H new ATOM 590 N LEU A 37 -0.461 -20.694 -29.998 1.00 21.00 N ATOM 591 CA LEU A 37 -0.362 -19.781 -31.094 1.00 25.00 C ATOM 592 C LEU A 37 0.953 -19.156 -31.004 1.00 52.00 C ATOM 593 O LEU A 37 1.576 -19.151 -29.943 1.00 41.00 O ATOM 594 CB LEU A 37 -1.386 -18.690 -30.940 1.00 32.00 C ATOM 595 CG LEU A 37 -2.783 -19.178 -30.768 1.00 22.00 C ATOM 596 CD1 LEU A 37 -3.609 -18.155 -30.052 1.00 23.00 C ATOM 597 CD2 LEU A 37 -3.420 -19.558 -32.083 1.00 23.00 C ATOM 0 H LEU A 37 -0.107 -20.306 -29.124 1.00 21.00 H new ATOM 0 HA LEU A 37 -0.516 -20.304 -32.038 1.00 25.00 H new ATOM 0 HB2 LEU A 37 -1.119 -18.077 -30.079 1.00 32.00 H new ATOM 0 HB3 LEU A 37 -1.345 -18.043 -31.817 1.00 32.00 H new ATOM 0 HG LEU A 37 -2.740 -20.083 -30.162 1.00 22.00 H new ATOM 0 HD11 LEU A 37 -4.627 -18.527 -29.934 1.00 23.00 H new ATOM 0 HD12 LEU A 37 -3.178 -17.961 -29.070 1.00 23.00 H new ATOM 0 HD13 LEU A 37 -3.625 -17.231 -30.630 1.00 23.00 H new ATOM 0 HD21 LEU A 37 -4.437 -19.908 -31.907 1.00 23.00 H new ATOM 0 HD22 LEU A 37 -3.444 -18.689 -32.740 1.00 23.00 H new ATOM 0 HD23 LEU A 37 -2.840 -20.352 -32.552 1.00 23.00 H new ATOM 609 N LYS A 38 1.348 -18.596 -32.053 1.00 62.00 N ATOM 610 CA LYS A 38 2.617 -17.964 -32.120 1.00 10.00 C ATOM 611 C LYS A 38 2.520 -16.663 -32.845 1.00 3.00 C ATOM 612 O LYS A 38 1.678 -16.498 -33.732 1.00 70.00 O ATOM 613 CB LYS A 38 3.606 -18.848 -32.831 1.00 3.00 C ATOM 614 CG LYS A 38 3.220 -19.186 -34.255 1.00 21.00 C ATOM 615 CD LYS A 38 4.400 -19.695 -35.019 1.00 72.00 C ATOM 616 CE LYS A 38 3.993 -20.100 -36.428 1.00 21.00 C ATOM 617 NZ LYS A 38 5.138 -20.558 -37.247 1.00 72.00 N ATOM 0 H LYS A 38 0.806 -18.551 -32.916 1.00 62.00 H new ATOM 0 HA LYS A 38 2.955 -17.784 -31.100 1.00 10.00 H new ATOM 0 HB2 LYS A 38 4.579 -18.356 -32.837 1.00 3.00 H new ATOM 0 HB3 LYS A 38 3.720 -19.774 -32.267 1.00 3.00 H new ATOM 0 HG2 LYS A 38 2.430 -19.937 -34.254 1.00 21.00 H new ATOM 0 HG3 LYS A 38 2.817 -18.301 -34.747 1.00 21.00 H new ATOM 0 HD2 LYS A 38 5.170 -18.925 -35.065 1.00 72.00 H new ATOM 0 HD3 LYS A 38 4.834 -20.550 -34.500 1.00 72.00 H new ATOM 0 HE2 LYS A 38 3.251 -20.896 -36.372 1.00 21.00 H new ATOM 0 HE3 LYS A 38 3.515 -19.253 -36.921 1.00 21.00 H new ATOM 0 HZ1 LYS A 38 4.803 -20.821 -38.196 1.00 72.00 H new ATOM 0 HZ2 LYS A 38 5.837 -19.792 -37.326 1.00 72.00 H new ATOM 0 HZ3 LYS A 38 5.580 -21.384 -36.795 1.00 72.00 H new ATOM 631 N GLN A 39 3.359 -15.760 -32.479 1.00 33.00 N ATOM 632 CA GLN A 39 3.436 -14.495 -33.146 1.00 52.00 C ATOM 633 C GLN A 39 4.350 -14.658 -34.305 1.00 42.00 C ATOM 634 O GLN A 39 5.530 -14.982 -34.142 1.00 10.00 O ATOM 635 CB GLN A 39 3.959 -13.383 -32.243 1.00 42.00 C ATOM 636 CG GLN A 39 4.079 -12.036 -32.967 1.00 32.00 C ATOM 637 CD GLN A 39 4.612 -10.916 -32.100 1.00 61.00 C ATOM 638 OE1 GLN A 39 4.399 -10.883 -30.900 1.00 40.00 O ATOM 639 NE2 GLN A 39 5.318 -9.995 -32.705 1.00 70.00 N ATOM 0 H GLN A 39 4.016 -15.871 -31.707 1.00 33.00 H new ATOM 0 HA GLN A 39 2.432 -14.202 -33.454 1.00 52.00 H new ATOM 0 HB2 GLN A 39 3.293 -13.272 -31.388 1.00 42.00 H new ATOM 0 HB3 GLN A 39 4.936 -13.668 -31.852 1.00 42.00 H new ATOM 0 HG2 GLN A 39 4.734 -12.156 -33.830 1.00 32.00 H new ATOM 0 HG3 GLN A 39 3.098 -11.751 -33.348 1.00 32.00 H new ATOM 0 HE21 GLN A 39 5.477 -10.053 -33.711 1.00 70.00 H new ATOM 0 HE22 GLN A 39 5.709 -9.219 -32.171 1.00 70.00 H new ATOM 648 N GLY A 40 3.806 -14.510 -35.440 1.00 43.00 N ATOM 649 CA GLY A 40 4.566 -14.587 -36.644 1.00 1.00 C ATOM 650 C GLY A 40 4.211 -13.453 -37.531 1.00 75.00 C ATOM 651 O GLY A 40 4.894 -12.418 -37.553 1.00 24.00 O ATOM 0 H GLY A 40 2.812 -14.330 -35.578 1.00 43.00 H new ATOM 0 HA2 GLY A 40 5.631 -14.563 -36.415 1.00 1.00 H new ATOM 0 HA3 GLY A 40 4.370 -15.532 -37.150 1.00 1.00 H new ATOM 655 N ILE A 41 3.105 -13.598 -38.200 1.00 12.00 N ATOM 656 CA ILE A 41 2.629 -12.582 -39.084 1.00 31.00 C ATOM 657 C ILE A 41 1.835 -11.597 -38.272 1.00 13.00 C ATOM 658 O ILE A 41 0.699 -11.850 -37.882 1.00 52.00 O ATOM 659 CB ILE A 41 1.798 -13.137 -40.295 1.00 41.00 C ATOM 660 CG1 ILE A 41 2.681 -13.953 -41.270 1.00 23.00 C ATOM 661 CG2 ILE A 41 1.100 -12.009 -41.058 1.00 75.00 C ATOM 662 CD1 ILE A 41 3.216 -15.270 -40.735 1.00 34.00 C ATOM 0 H ILE A 41 2.510 -14.425 -38.146 1.00 12.00 H new ATOM 0 HA ILE A 41 3.489 -12.096 -39.544 1.00 31.00 H new ATOM 0 HB ILE A 41 1.041 -13.800 -39.875 1.00 41.00 H new ATOM 0 HG12 ILE A 41 2.102 -14.157 -42.170 1.00 23.00 H new ATOM 0 HG13 ILE A 41 3.527 -13.334 -41.569 1.00 23.00 H new ATOM 0 HG21 ILE A 41 0.534 -12.428 -41.890 1.00 75.00 H new ATOM 0 HG22 ILE A 41 0.422 -11.481 -40.387 1.00 75.00 H new ATOM 0 HG23 ILE A 41 1.846 -11.313 -41.441 1.00 75.00 H new ATOM 0 HD11 ILE A 41 3.820 -15.756 -41.501 1.00 34.00 H new ATOM 0 HD12 ILE A 41 3.830 -15.082 -39.854 1.00 34.00 H new ATOM 0 HD13 ILE A 41 2.383 -15.919 -40.465 1.00 34.00 H new ATOM 674 N SER A 42 2.469 -10.527 -37.957 1.00 74.00 N ATOM 675 CA SER A 42 1.909 -9.519 -37.147 1.00 13.00 C ATOM 676 C SER A 42 2.442 -8.190 -37.622 1.00 11.00 C ATOM 677 O SER A 42 3.455 -8.160 -38.332 1.00 60.00 O ATOM 678 CB SER A 42 2.290 -9.792 -35.688 1.00 4.00 C ATOM 679 OG SER A 42 1.769 -8.814 -34.807 1.00 43.00 O ATOM 0 H SER A 42 3.420 -10.327 -38.267 1.00 74.00 H new ATOM 0 HA SER A 42 0.821 -9.505 -37.215 1.00 13.00 H new ATOM 0 HB2 SER A 42 1.921 -10.775 -35.396 1.00 4.00 H new ATOM 0 HB3 SER A 42 3.376 -9.819 -35.597 1.00 4.00 H new ATOM 0 HG SER A 42 2.498 -8.248 -34.478 1.00 43.00 H new ATOM 685 N ALA A 43 1.764 -7.120 -37.254 1.00 62.00 N ATOM 686 CA ALA A 43 2.101 -5.767 -37.639 1.00 63.00 C ATOM 687 C ALA A 43 1.134 -4.811 -36.986 1.00 3.00 C ATOM 688 O ALA A 43 1.499 -3.723 -36.574 1.00 20.00 O ATOM 689 CB ALA A 43 2.081 -5.563 -39.152 1.00 3.00 C ATOM 0 H ALA A 43 0.937 -7.173 -36.659 1.00 62.00 H new ATOM 0 HA ALA A 43 3.120 -5.574 -37.304 1.00 63.00 H new ATOM 0 HB1 ALA A 43 2.341 -4.530 -39.383 1.00 3.00 H new ATOM 0 HB2 ALA A 43 2.803 -6.233 -39.619 1.00 3.00 H new ATOM 0 HB3 ALA A 43 1.084 -5.780 -39.535 1.00 3.00 H new ATOM 695 N SER A 44 -0.097 -5.240 -36.882 1.00 50.00 N ATOM 696 CA SER A 44 -1.164 -4.454 -36.308 1.00 43.00 C ATOM 697 C SER A 44 -1.249 -4.626 -34.775 1.00 11.00 C ATOM 698 O SER A 44 -2.158 -4.114 -34.123 1.00 44.00 O ATOM 699 CB SER A 44 -2.432 -4.932 -36.978 1.00 13.00 C ATOM 700 OG SER A 44 -2.401 -6.363 -37.064 1.00 12.00 O ATOM 0 H SER A 44 -0.394 -6.163 -37.199 1.00 50.00 H new ATOM 0 HA SER A 44 -0.994 -3.390 -36.474 1.00 43.00 H new ATOM 0 HB2 SER A 44 -3.304 -4.607 -36.410 1.00 13.00 H new ATOM 0 HB3 SER A 44 -2.520 -4.496 -37.973 1.00 13.00 H new ATOM 0 HG SER A 44 -3.221 -6.683 -37.496 1.00 12.00 H new ATOM 706 N GLY A 45 -0.304 -5.326 -34.215 1.00 54.00 N ATOM 707 CA GLY A 45 -0.307 -5.612 -32.804 1.00 15.00 C ATOM 708 C GLY A 45 0.646 -6.717 -32.529 1.00 61.00 C ATOM 709 O GLY A 45 1.830 -6.627 -32.875 1.00 61.00 O ATOM 0 H GLY A 45 0.491 -5.716 -34.721 1.00 54.00 H new ATOM 0 HA2 GLY A 45 -0.025 -4.723 -32.240 1.00 15.00 H new ATOM 0 HA3 GLY A 45 -1.309 -5.891 -32.479 1.00 15.00 H new ATOM 713 N ALA A 46 0.134 -7.771 -32.010 1.00 4.00 N ATOM 714 CA ALA A 46 0.864 -8.919 -31.710 1.00 51.00 C ATOM 715 C ALA A 46 -0.051 -10.020 -32.036 1.00 3.00 C ATOM 716 O ALA A 46 -1.049 -10.237 -31.355 1.00 42.00 O ATOM 717 CB ALA A 46 1.254 -8.936 -30.261 1.00 61.00 C ATOM 0 H ALA A 46 -0.856 -7.848 -31.776 1.00 4.00 H new ATOM 0 HA ALA A 46 1.799 -8.985 -32.267 1.00 51.00 H new ATOM 0 HB1 ALA A 46 1.823 -9.841 -30.048 1.00 61.00 H new ATOM 0 HB2 ALA A 46 1.866 -8.062 -30.039 1.00 61.00 H new ATOM 0 HB3 ALA A 46 0.357 -8.918 -29.642 1.00 61.00 H new ATOM 723 N ARG A 47 0.199 -10.636 -33.117 1.00 24.00 N ATOM 724 CA ARG A 47 -0.688 -11.609 -33.593 1.00 61.00 C ATOM 725 C ARG A 47 -0.154 -12.973 -33.342 1.00 3.00 C ATOM 726 O ARG A 47 0.744 -13.437 -34.039 1.00 11.00 O ATOM 727 CB ARG A 47 -1.018 -11.425 -35.071 1.00 34.00 C ATOM 728 CG ARG A 47 -1.929 -10.253 -35.375 1.00 41.00 C ATOM 729 CD ARG A 47 -2.078 -10.043 -36.877 1.00 23.00 C ATOM 730 NE ARG A 47 -2.455 -11.271 -37.593 1.00 44.00 N ATOM 731 CZ ARG A 47 -2.626 -11.361 -38.923 1.00 52.00 C ATOM 732 NH1 ARG A 47 -2.473 -10.288 -39.693 1.00 73.00 N ATOM 733 NH2 ARG A 47 -2.917 -12.535 -39.475 1.00 21.00 N ATOM 0 H ARG A 47 1.024 -10.481 -33.697 1.00 24.00 H new ATOM 0 HA ARG A 47 -1.620 -11.486 -33.041 1.00 61.00 H new ATOM 0 HB2 ARG A 47 -0.087 -11.297 -35.624 1.00 34.00 H new ATOM 0 HB3 ARG A 47 -1.486 -12.337 -35.441 1.00 34.00 H new ATOM 0 HG2 ARG A 47 -2.909 -10.427 -34.931 1.00 41.00 H new ATOM 0 HG3 ARG A 47 -1.527 -9.349 -34.917 1.00 41.00 H new ATOM 0 HD2 ARG A 47 -2.832 -9.277 -37.058 1.00 23.00 H new ATOM 0 HD3 ARG A 47 -1.138 -9.667 -37.281 1.00 23.00 H new ATOM 0 HE ARG A 47 -2.597 -12.116 -37.040 1.00 44.00 H new ATOM 0 HH11 ARG A 47 -2.225 -9.391 -39.275 1.00 73.00 H new ATOM 0 HH12 ARG A 47 -2.604 -10.361 -40.702 1.00 73.00 H new ATOM 0 HH21 ARG A 47 -3.010 -13.365 -38.889 1.00 21.00 H new ATOM 0 HH22 ARG A 47 -3.047 -12.606 -40.484 1.00 21.00 H new ATOM 747 N TYR A 48 -0.667 -13.583 -32.336 1.00 41.00 N ATOM 748 CA TYR A 48 -0.338 -14.908 -31.996 1.00 13.00 C ATOM 749 C TYR A 48 -1.389 -15.737 -32.649 1.00 51.00 C ATOM 750 O TYR A 48 -2.539 -15.733 -32.253 1.00 45.00 O ATOM 751 CB TYR A 48 -0.331 -15.084 -30.483 1.00 33.00 C ATOM 752 CG TYR A 48 0.657 -14.188 -29.734 1.00 43.00 C ATOM 753 CD1 TYR A 48 0.317 -12.890 -29.355 1.00 2.00 C ATOM 754 CD2 TYR A 48 1.919 -14.648 -29.394 1.00 73.00 C ATOM 755 CE1 TYR A 48 1.204 -12.087 -28.666 1.00 74.00 C ATOM 756 CE2 TYR A 48 2.811 -13.846 -28.699 1.00 20.00 C ATOM 757 CZ TYR A 48 2.447 -12.569 -28.338 1.00 40.00 C ATOM 758 OH TYR A 48 3.332 -11.768 -27.646 1.00 0.00 O ATOM 0 H TYR A 48 -1.349 -13.155 -31.710 1.00 41.00 H new ATOM 0 HA TYR A 48 0.659 -15.196 -32.330 1.00 13.00 H new ATOM 0 HB2 TYR A 48 -1.334 -14.889 -30.105 1.00 33.00 H new ATOM 0 HB3 TYR A 48 -0.101 -16.125 -30.254 1.00 33.00 H new ATOM 0 HD1 TYR A 48 -0.660 -12.505 -29.606 1.00 2.00 H new ATOM 0 HD2 TYR A 48 2.213 -15.648 -29.675 1.00 73.00 H new ATOM 0 HE1 TYR A 48 0.921 -11.083 -28.386 1.00 74.00 H new ATOM 0 HE2 TYR A 48 3.790 -14.223 -28.441 1.00 20.00 H new ATOM 0 HH TYR A 48 4.166 -12.259 -27.492 1.00 0.00 H new ATOM 768 N THR A 49 -1.036 -16.373 -33.695 1.00 10.00 N ATOM 769 CA THR A 49 -1.998 -17.025 -34.504 1.00 31.00 C ATOM 770 C THR A 49 -1.416 -18.271 -35.113 1.00 12.00 C ATOM 771 O THR A 49 -0.235 -18.310 -35.459 1.00 12.00 O ATOM 772 CB THR A 49 -2.458 -16.066 -35.624 1.00 75.00 C ATOM 773 OG1 THR A 49 -3.014 -14.876 -35.045 1.00 72.00 O ATOM 774 CG2 THR A 49 -3.472 -16.708 -36.565 1.00 12.00 C ATOM 0 H THR A 49 -0.073 -16.460 -34.020 1.00 10.00 H new ATOM 0 HA THR A 49 -2.850 -17.305 -33.885 1.00 31.00 H new ATOM 0 HB THR A 49 -1.579 -15.818 -36.220 1.00 75.00 H new ATOM 0 HG1 THR A 49 -2.289 -14.276 -34.771 1.00 72.00 H new ATOM 0 HG21 THR A 49 -3.761 -15.990 -37.333 1.00 12.00 H new ATOM 0 HG22 THR A 49 -3.027 -17.584 -37.037 1.00 12.00 H new ATOM 0 HG23 THR A 49 -4.354 -17.009 -35.999 1.00 12.00 H new ATOM 782 N ASP A 50 -2.219 -19.295 -35.152 1.00 43.00 N ATOM 783 CA ASP A 50 -1.867 -20.516 -35.839 1.00 72.00 C ATOM 784 C ASP A 50 -2.876 -20.802 -36.948 1.00 24.00 C ATOM 785 O ASP A 50 -2.531 -21.337 -37.996 1.00 11.00 O ATOM 786 CB ASP A 50 -1.801 -21.697 -34.873 1.00 61.00 C ATOM 787 CG ASP A 50 -1.624 -23.018 -35.594 1.00 41.00 C ATOM 788 OD1 ASP A 50 -0.479 -23.364 -35.979 1.00 73.00 O ATOM 789 OD2 ASP A 50 -2.621 -23.722 -35.794 1.00 60.00 O ATOM 0 H ASP A 50 -3.138 -19.313 -34.710 1.00 43.00 H new ATOM 0 HA ASP A 50 -0.878 -20.383 -36.277 1.00 72.00 H new ATOM 0 HB2 ASP A 50 -0.974 -21.550 -34.179 1.00 61.00 H new ATOM 0 HB3 ASP A 50 -2.714 -21.729 -34.278 1.00 61.00 H new ATOM 794 N GLY A 51 -4.110 -20.392 -36.717 1.00 21.00 N ATOM 795 CA GLY A 51 -5.173 -20.657 -37.655 1.00 11.00 C ATOM 796 C GLY A 51 -6.385 -21.162 -36.930 1.00 40.00 C ATOM 797 O GLY A 51 -7.509 -21.070 -37.420 1.00 72.00 O ATOM 0 H GLY A 51 -4.396 -19.874 -35.886 1.00 21.00 H new ATOM 0 HA2 GLY A 51 -5.420 -19.748 -38.203 1.00 11.00 H new ATOM 0 HA3 GLY A 51 -4.846 -21.393 -38.389 1.00 11.00 H new ATOM 801 N ILE A 52 -6.142 -21.691 -35.732 1.00 11.00 N ATOM 802 CA ILE A 52 -7.199 -22.182 -34.863 1.00 54.00 C ATOM 803 C ILE A 52 -8.045 -20.986 -34.472 1.00 74.00 C ATOM 804 O ILE A 52 -9.262 -21.016 -34.559 1.00 22.00 O ATOM 805 CB ILE A 52 -6.618 -22.830 -33.571 1.00 33.00 C ATOM 806 CG1 ILE A 52 -5.519 -23.866 -33.899 1.00 64.00 C ATOM 807 CG2 ILE A 52 -7.730 -23.479 -32.747 1.00 75.00 C ATOM 808 CD1 ILE A 52 -5.977 -25.037 -34.745 1.00 51.00 C ATOM 0 H ILE A 52 -5.205 -21.789 -35.341 1.00 11.00 H new ATOM 0 HA ILE A 52 -7.779 -22.942 -35.387 1.00 54.00 H new ATOM 0 HB ILE A 52 -6.162 -22.034 -32.982 1.00 33.00 H new ATOM 0 HG12 ILE A 52 -4.705 -23.359 -34.417 1.00 64.00 H new ATOM 0 HG13 ILE A 52 -5.111 -24.250 -32.964 1.00 64.00 H new ATOM 0 HG21 ILE A 52 -7.304 -23.926 -31.849 1.00 75.00 H new ATOM 0 HG22 ILE A 52 -8.462 -22.722 -32.464 1.00 75.00 H new ATOM 0 HG23 ILE A 52 -8.219 -24.252 -33.340 1.00 75.00 H new ATOM 0 HD11 ILE A 52 -5.137 -25.709 -34.922 1.00 51.00 H new ATOM 0 HD12 ILE A 52 -6.768 -25.575 -34.223 1.00 51.00 H new ATOM 0 HD13 ILE A 52 -6.356 -24.670 -35.699 1.00 51.00 H new ATOM 820 N TYR A 53 -7.354 -19.951 -34.027 1.00 24.00 N ATOM 821 CA TYR A 53 -7.886 -18.642 -33.728 1.00 11.00 C ATOM 822 C TYR A 53 -6.784 -17.673 -33.940 1.00 62.00 C ATOM 823 O TYR A 53 -5.599 -18.072 -34.020 1.00 3.00 O ATOM 824 CB TYR A 53 -8.418 -18.490 -32.284 1.00 42.00 C ATOM 825 CG TYR A 53 -9.664 -19.305 -32.044 1.00 10.00 C ATOM 826 CD1 TYR A 53 -10.886 -18.837 -32.468 1.00 22.00 C ATOM 827 CD2 TYR A 53 -9.604 -20.579 -31.492 1.00 53.00 C ATOM 828 CE1 TYR A 53 -12.015 -19.604 -32.375 1.00 22.00 C ATOM 829 CE2 TYR A 53 -10.743 -21.349 -31.369 1.00 75.00 C ATOM 830 CZ TYR A 53 -11.946 -20.853 -31.827 1.00 32.00 C ATOM 831 OH TYR A 53 -13.076 -21.632 -31.789 1.00 23.00 O ATOM 0 H TYR A 53 -6.350 -20.010 -33.857 1.00 24.00 H new ATOM 0 HA TYR A 53 -8.743 -18.470 -34.380 1.00 11.00 H new ATOM 0 HB2 TYR A 53 -7.645 -18.797 -31.580 1.00 42.00 H new ATOM 0 HB3 TYR A 53 -8.630 -17.439 -32.086 1.00 42.00 H new ATOM 0 HD1 TYR A 53 -10.956 -17.842 -32.883 1.00 22.00 H new ATOM 0 HD2 TYR A 53 -8.656 -20.971 -31.155 1.00 53.00 H new ATOM 0 HE1 TYR A 53 -12.959 -19.222 -32.734 1.00 22.00 H new ATOM 0 HE2 TYR A 53 -10.693 -22.329 -30.919 1.00 75.00 H new ATOM 0 HH TYR A 53 -13.205 -21.977 -30.881 1.00 23.00 H new ATOM 841 N VAL A 54 -7.141 -16.463 -34.078 1.00 32.00 N ATOM 842 CA VAL A 54 -6.227 -15.387 -34.230 1.00 33.00 C ATOM 843 C VAL A 54 -6.244 -14.602 -32.943 1.00 54.00 C ATOM 844 O VAL A 54 -7.258 -13.989 -32.593 1.00 24.00 O ATOM 845 CB VAL A 54 -6.701 -14.488 -35.372 1.00 70.00 C ATOM 846 CG1 VAL A 54 -5.887 -13.194 -35.482 1.00 62.00 C ATOM 847 CG2 VAL A 54 -6.702 -15.230 -36.706 1.00 12.00 C ATOM 0 H VAL A 54 -8.118 -16.171 -34.090 1.00 32.00 H new ATOM 0 HA VAL A 54 -5.224 -15.752 -34.452 1.00 33.00 H new ATOM 0 HB VAL A 54 -7.726 -14.208 -35.130 1.00 70.00 H new ATOM 0 HG11 VAL A 54 -6.267 -12.594 -36.309 1.00 62.00 H new ATOM 0 HG12 VAL A 54 -5.975 -12.629 -34.554 1.00 62.00 H new ATOM 0 HG13 VAL A 54 -4.840 -13.437 -35.661 1.00 62.00 H new ATOM 0 HG21 VAL A 54 -7.045 -14.560 -37.495 1.00 12.00 H new ATOM 0 HG22 VAL A 54 -5.692 -15.572 -36.933 1.00 12.00 H new ATOM 0 HG23 VAL A 54 -7.370 -16.089 -36.644 1.00 12.00 H new ATOM 857 N PHE A 55 -5.181 -14.667 -32.219 1.00 35.00 N ATOM 858 CA PHE A 55 -5.076 -13.938 -30.996 1.00 23.00 C ATOM 859 C PHE A 55 -4.342 -12.659 -31.303 1.00 11.00 C ATOM 860 O PHE A 55 -3.124 -12.649 -31.489 1.00 71.00 O ATOM 861 CB PHE A 55 -4.345 -14.781 -29.944 1.00 60.00 C ATOM 862 CG PHE A 55 -4.205 -14.171 -28.583 1.00 55.00 C ATOM 863 CD1 PHE A 55 -5.190 -14.344 -27.634 1.00 75.00 C ATOM 864 CD2 PHE A 55 -3.074 -13.453 -28.244 1.00 0.00 C ATOM 865 CE1 PHE A 55 -5.050 -13.811 -26.377 1.00 35.00 C ATOM 866 CE2 PHE A 55 -2.928 -12.913 -26.990 1.00 41.00 C ATOM 867 CZ PHE A 55 -3.916 -13.092 -26.054 1.00 5.00 C ATOM 0 H PHE A 55 -4.360 -15.225 -32.454 1.00 35.00 H new ATOM 0 HA PHE A 55 -6.058 -13.705 -30.583 1.00 23.00 H new ATOM 0 HB2 PHE A 55 -4.871 -15.730 -29.841 1.00 60.00 H new ATOM 0 HB3 PHE A 55 -3.348 -15.009 -30.321 1.00 60.00 H new ATOM 0 HD1 PHE A 55 -6.080 -14.904 -27.882 1.00 75.00 H new ATOM 0 HD2 PHE A 55 -2.293 -13.314 -28.977 1.00 0.00 H new ATOM 0 HE1 PHE A 55 -5.827 -13.954 -25.640 1.00 35.00 H new ATOM 0 HE2 PHE A 55 -2.040 -12.350 -26.741 1.00 41.00 H new ATOM 0 HZ PHE A 55 -3.807 -12.671 -25.066 1.00 5.00 H new ATOM 877 N TRP A 56 -5.079 -11.613 -31.417 1.00 13.00 N ATOM 878 CA TRP A 56 -4.553 -10.361 -31.751 1.00 50.00 C ATOM 879 C TRP A 56 -4.509 -9.546 -30.517 1.00 61.00 C ATOM 880 O TRP A 56 -5.528 -9.168 -29.931 1.00 11.00 O ATOM 881 CB TRP A 56 -5.357 -9.710 -32.857 1.00 50.00 C ATOM 882 CG TRP A 56 -4.908 -8.331 -33.228 1.00 51.00 C ATOM 883 CD1 TRP A 56 -3.634 -7.839 -33.201 1.00 12.00 C ATOM 884 CD2 TRP A 56 -5.733 -7.279 -33.717 1.00 54.00 C ATOM 885 NE1 TRP A 56 -3.631 -6.539 -33.594 1.00 10.00 N ATOM 886 CE2 TRP A 56 -4.906 -6.169 -33.933 1.00 1.00 C ATOM 887 CE3 TRP A 56 -7.100 -7.164 -33.983 1.00 22.00 C ATOM 888 CZ2 TRP A 56 -5.395 -4.956 -34.406 1.00 71.00 C ATOM 889 CZ3 TRP A 56 -7.584 -5.964 -34.456 1.00 21.00 C ATOM 890 CH2 TRP A 56 -6.734 -4.875 -34.663 1.00 55.00 C ATOM 0 H TRP A 56 -6.089 -11.616 -31.275 1.00 13.00 H new ATOM 0 HA TRP A 56 -3.542 -10.460 -32.146 1.00 50.00 H new ATOM 0 HB2 TRP A 56 -5.310 -10.343 -33.743 1.00 50.00 H new ATOM 0 HB3 TRP A 56 -6.402 -9.667 -32.551 1.00 50.00 H new ATOM 0 HD1 TRP A 56 -2.759 -8.401 -32.910 1.00 12.00 H new ATOM 0 HE1 TRP A 56 -2.810 -5.934 -33.631 1.00 10.00 H new ATOM 0 HE3 TRP A 56 -7.764 -8.000 -33.821 1.00 22.00 H new ATOM 0 HZ2 TRP A 56 -4.741 -4.111 -34.564 1.00 71.00 H new ATOM 0 HZ3 TRP A 56 -8.638 -5.864 -34.670 1.00 21.00 H new ATOM 0 HH2 TRP A 56 -7.145 -3.948 -35.035 1.00 55.00 H new ATOM 901 N SER A 57 -3.356 -9.310 -30.132 1.00 13.00 N ATOM 902 CA SER A 57 -3.074 -8.668 -28.924 1.00 70.00 C ATOM 903 C SER A 57 -2.527 -7.305 -29.197 1.00 10.00 C ATOM 904 O SER A 57 -1.900 -7.068 -30.231 1.00 35.00 O ATOM 905 CB SER A 57 -2.049 -9.505 -28.137 1.00 43.00 C ATOM 906 OG SER A 57 -1.711 -8.907 -26.890 1.00 51.00 O ATOM 0 H SER A 57 -2.525 -9.565 -30.666 1.00 13.00 H new ATOM 0 HA SER A 57 -3.986 -8.568 -28.335 1.00 70.00 H new ATOM 0 HB2 SER A 57 -2.454 -10.502 -27.962 1.00 43.00 H new ATOM 0 HB3 SER A 57 -1.146 -9.628 -28.736 1.00 43.00 H new ATOM 0 HG SER A 57 -0.762 -8.664 -26.890 1.00 51.00 H new ATOM 912 N LYS A 58 -2.853 -6.400 -28.339 1.00 52.00 N ATOM 913 CA LYS A 58 -2.212 -5.105 -28.340 1.00 34.00 C ATOM 914 C LYS A 58 -1.414 -4.973 -27.046 1.00 72.00 C ATOM 915 O LYS A 58 -0.990 -3.886 -26.661 1.00 1.00 O ATOM 916 CB LYS A 58 -3.188 -3.923 -28.438 1.00 71.00 C ATOM 917 CG LYS A 58 -4.060 -3.796 -29.697 1.00 4.00 C ATOM 918 CD LYS A 58 -5.190 -4.808 -29.774 1.00 74.00 C ATOM 919 CE LYS A 58 -6.253 -4.349 -30.765 1.00 43.00 C ATOM 920 NZ LYS A 58 -6.818 -3.017 -30.386 1.00 23.00 N ATOM 0 H LYS A 58 -3.564 -6.523 -27.618 1.00 52.00 H new ATOM 0 HA LYS A 58 -1.582 -5.059 -29.229 1.00 34.00 H new ATOM 0 HB2 LYS A 58 -3.854 -3.971 -27.577 1.00 71.00 H new ATOM 0 HB3 LYS A 58 -2.608 -3.005 -28.342 1.00 71.00 H new ATOM 0 HG2 LYS A 58 -4.483 -2.792 -29.733 1.00 4.00 H new ATOM 0 HG3 LYS A 58 -3.427 -3.907 -30.577 1.00 4.00 H new ATOM 0 HD2 LYS A 58 -4.797 -5.778 -30.077 1.00 74.00 H new ATOM 0 HD3 LYS A 58 -5.636 -4.939 -28.788 1.00 74.00 H new ATOM 0 HE2 LYS A 58 -5.820 -4.291 -31.764 1.00 43.00 H new ATOM 0 HE3 LYS A 58 -7.055 -5.086 -30.808 1.00 43.00 H new ATOM 0 HZ1 LYS A 58 -7.832 -2.991 -30.617 1.00 23.00 H new ATOM 0 HZ2 LYS A 58 -6.692 -2.864 -29.365 1.00 23.00 H new ATOM 0 HZ3 LYS A 58 -6.324 -2.268 -30.912 1.00 23.00 H new ATOM 934 N GLY A 59 -1.256 -6.084 -26.350 1.00 33.00 N ATOM 935 CA GLY A 59 -0.490 -6.093 -25.129 1.00 25.00 C ATOM 936 C GLY A 59 -1.349 -5.963 -23.893 1.00 75.00 C ATOM 937 O GLY A 59 -1.319 -6.825 -23.017 1.00 52.00 O ATOM 0 H GLY A 59 -1.649 -6.988 -26.613 1.00 33.00 H new ATOM 0 HA2 GLY A 59 0.082 -7.019 -25.072 1.00 25.00 H new ATOM 0 HA3 GLY A 59 0.230 -5.275 -25.152 1.00 25.00 H new ATOM 941 N ASP A 60 -2.126 -4.900 -23.825 1.00 31.00 N ATOM 942 CA ASP A 60 -2.953 -4.623 -22.641 1.00 12.00 C ATOM 943 C ASP A 60 -4.358 -5.106 -22.880 1.00 64.00 C ATOM 944 O ASP A 60 -5.156 -5.252 -21.959 1.00 23.00 O ATOM 945 CB ASP A 60 -2.998 -3.117 -22.339 1.00 5.00 C ATOM 946 CG ASP A 60 -1.638 -2.492 -22.161 1.00 55.00 C ATOM 947 OD1 ASP A 60 -0.996 -2.694 -21.115 1.00 63.00 O ATOM 948 OD2 ASP A 60 -1.188 -1.756 -23.071 1.00 41.00 O ATOM 0 H ASP A 60 -2.210 -4.207 -24.569 1.00 31.00 H new ATOM 0 HA ASP A 60 -2.510 -5.144 -21.792 1.00 12.00 H new ATOM 0 HB2 ASP A 60 -3.518 -2.608 -23.151 1.00 5.00 H new ATOM 0 HB3 ASP A 60 -3.584 -2.955 -21.434 1.00 5.00 H new ATOM 953 N GLU A 61 -4.643 -5.358 -24.117 1.00 64.00 N ATOM 954 CA GLU A 61 -5.925 -5.789 -24.551 1.00 14.00 C ATOM 955 C GLU A 61 -5.731 -6.867 -25.589 1.00 42.00 C ATOM 956 O GLU A 61 -4.734 -6.847 -26.336 1.00 21.00 O ATOM 957 CB GLU A 61 -6.706 -4.600 -25.099 1.00 61.00 C ATOM 958 CG GLU A 61 -5.931 -3.814 -26.127 1.00 53.00 C ATOM 959 CD GLU A 61 -6.671 -2.629 -26.655 1.00 12.00 C ATOM 960 OE1 GLU A 61 -6.675 -1.575 -25.985 1.00 33.00 O ATOM 961 OE2 GLU A 61 -7.233 -2.710 -27.767 1.00 35.00 O ATOM 0 H GLU A 61 -3.966 -5.265 -24.874 1.00 64.00 H new ATOM 0 HA GLU A 61 -6.503 -6.200 -23.724 1.00 14.00 H new ATOM 0 HB2 GLU A 61 -7.635 -4.956 -25.545 1.00 61.00 H new ATOM 0 HB3 GLU A 61 -6.980 -3.941 -24.275 1.00 61.00 H new ATOM 0 HG2 GLU A 61 -4.993 -3.479 -25.685 1.00 53.00 H new ATOM 0 HG3 GLU A 61 -5.675 -4.472 -26.958 1.00 53.00 H new ATOM 968 N ALA A 62 -6.634 -7.796 -25.639 1.00 72.00 N ATOM 969 CA ALA A 62 -6.509 -8.914 -26.500 1.00 74.00 C ATOM 970 C ALA A 62 -7.837 -9.229 -27.130 1.00 32.00 C ATOM 971 O ALA A 62 -8.894 -9.136 -26.487 1.00 34.00 O ATOM 972 CB ALA A 62 -5.986 -10.118 -25.731 1.00 75.00 C ATOM 0 H ALA A 62 -7.484 -7.793 -25.075 1.00 72.00 H new ATOM 0 HA ALA A 62 -5.796 -8.673 -27.288 1.00 74.00 H new ATOM 0 HB1 ALA A 62 -5.895 -10.969 -26.406 1.00 75.00 H new ATOM 0 HB2 ALA A 62 -5.009 -9.884 -25.309 1.00 75.00 H new ATOM 0 HB3 ALA A 62 -6.679 -10.365 -24.927 1.00 75.00 H new ATOM 978 N THR A 63 -7.781 -9.510 -28.375 1.00 40.00 N ATOM 979 CA THR A 63 -8.926 -9.911 -29.158 1.00 43.00 C ATOM 980 C THR A 63 -8.639 -11.279 -29.784 1.00 55.00 C ATOM 981 O THR A 63 -7.566 -11.489 -30.332 1.00 23.00 O ATOM 982 CB THR A 63 -9.170 -8.864 -30.258 1.00 15.00 C ATOM 983 OG1 THR A 63 -9.326 -7.579 -29.630 1.00 40.00 O ATOM 984 CG2 THR A 63 -10.420 -9.186 -31.077 1.00 74.00 C ATOM 0 H THR A 63 -6.915 -9.472 -28.913 1.00 40.00 H new ATOM 0 HA THR A 63 -9.814 -9.981 -28.530 1.00 43.00 H new ATOM 0 HB THR A 63 -8.320 -8.866 -30.940 1.00 15.00 H new ATOM 0 HG1 THR A 63 -9.481 -6.896 -30.316 1.00 40.00 H new ATOM 0 HG21 THR A 63 -10.559 -8.424 -31.844 1.00 74.00 H new ATOM 0 HG22 THR A 63 -10.303 -10.161 -31.551 1.00 74.00 H new ATOM 0 HG23 THR A 63 -11.290 -9.203 -30.421 1.00 74.00 H new ATOM 992 N VAL A 64 -9.566 -12.211 -29.680 1.00 11.00 N ATOM 993 CA VAL A 64 -9.341 -13.517 -30.220 1.00 51.00 C ATOM 994 C VAL A 64 -10.428 -13.878 -31.266 1.00 62.00 C ATOM 995 O VAL A 64 -11.562 -14.248 -30.931 1.00 73.00 O ATOM 996 CB VAL A 64 -9.172 -14.584 -29.084 1.00 73.00 C ATOM 997 CG1 VAL A 64 -10.374 -14.680 -28.176 1.00 62.00 C ATOM 998 CG2 VAL A 64 -8.763 -15.931 -29.647 1.00 54.00 C ATOM 0 H VAL A 64 -10.471 -12.080 -29.229 1.00 11.00 H new ATOM 0 HA VAL A 64 -8.394 -13.516 -30.760 1.00 51.00 H new ATOM 0 HB VAL A 64 -8.357 -14.235 -28.449 1.00 73.00 H new ATOM 0 HG11 VAL A 64 -10.193 -15.436 -27.412 1.00 62.00 H new ATOM 0 HG12 VAL A 64 -10.547 -13.716 -27.699 1.00 62.00 H new ATOM 0 HG13 VAL A 64 -11.251 -14.958 -28.761 1.00 62.00 H new ATOM 0 HG21 VAL A 64 -8.654 -16.648 -28.833 1.00 54.00 H new ATOM 0 HG22 VAL A 64 -9.527 -16.283 -30.341 1.00 54.00 H new ATOM 0 HG23 VAL A 64 -7.813 -15.832 -30.173 1.00 54.00 H new ATOM 1008 N TYR A 65 -10.060 -13.734 -32.525 1.00 62.00 N ATOM 1009 CA TYR A 65 -10.965 -13.887 -33.665 1.00 62.00 C ATOM 1010 C TYR A 65 -10.445 -14.862 -34.689 1.00 32.00 C ATOM 1011 O TYR A 65 -9.459 -14.636 -35.282 1.00 53.00 O ATOM 1012 CB TYR A 65 -11.200 -12.496 -34.336 1.00 3.00 C ATOM 1013 CG TYR A 65 -11.729 -12.503 -35.800 1.00 64.00 C ATOM 1014 CD1 TYR A 65 -13.078 -12.659 -36.101 1.00 54.00 C ATOM 1015 CD2 TYR A 65 -10.848 -12.352 -36.874 1.00 34.00 C ATOM 1016 CE1 TYR A 65 -13.531 -12.667 -37.406 1.00 3.00 C ATOM 1017 CE2 TYR A 65 -11.298 -12.361 -38.181 1.00 64.00 C ATOM 1018 CZ TYR A 65 -12.641 -12.520 -38.440 1.00 34.00 C ATOM 1019 OH TYR A 65 -13.097 -12.538 -39.746 1.00 12.00 O ATOM 0 H TYR A 65 -9.105 -13.502 -32.797 1.00 62.00 H new ATOM 0 HA TYR A 65 -11.904 -14.289 -33.284 1.00 62.00 H new ATOM 0 HB2 TYR A 65 -11.907 -11.938 -33.722 1.00 3.00 H new ATOM 0 HB3 TYR A 65 -10.259 -11.947 -34.318 1.00 3.00 H new ATOM 0 HD1 TYR A 65 -13.788 -12.777 -35.296 1.00 54.00 H new ATOM 0 HD2 TYR A 65 -9.793 -12.226 -36.679 1.00 34.00 H new ATOM 0 HE1 TYR A 65 -14.584 -12.789 -37.612 1.00 3.00 H new ATOM 0 HE2 TYR A 65 -10.599 -12.244 -38.996 1.00 64.00 H new ATOM 0 HH TYR A 65 -13.172 -11.619 -40.079 1.00 12.00 H new ATOM 1029 N LYS A 66 -11.103 -15.947 -34.856 1.00 60.00 N ATOM 1030 CA LYS A 66 -10.862 -16.782 -35.958 1.00 4.00 C ATOM 1031 C LYS A 66 -11.820 -16.276 -36.982 1.00 10.00 C ATOM 1032 O LYS A 66 -12.823 -15.662 -36.633 1.00 32.00 O ATOM 1033 CB LYS A 66 -11.228 -18.237 -35.667 1.00 12.00 C ATOM 1034 CG LYS A 66 -10.835 -19.210 -36.765 1.00 41.00 C ATOM 1035 CD LYS A 66 -11.507 -20.537 -36.591 1.00 71.00 C ATOM 1036 CE LYS A 66 -10.975 -21.573 -37.577 1.00 44.00 C ATOM 1037 NZ LYS A 66 -11.620 -22.895 -37.404 1.00 64.00 N ATOM 0 H LYS A 66 -11.830 -16.279 -34.222 1.00 60.00 H new ATOM 0 HA LYS A 66 -9.811 -16.764 -36.246 1.00 4.00 H new ATOM 0 HB2 LYS A 66 -10.747 -18.542 -34.738 1.00 12.00 H new ATOM 0 HB3 LYS A 66 -12.304 -18.304 -35.506 1.00 12.00 H new ATOM 0 HG2 LYS A 66 -11.101 -18.791 -37.736 1.00 41.00 H new ATOM 0 HG3 LYS A 66 -9.753 -19.346 -36.762 1.00 41.00 H new ATOM 0 HD2 LYS A 66 -11.353 -20.892 -35.572 1.00 71.00 H new ATOM 0 HD3 LYS A 66 -12.582 -20.421 -36.729 1.00 71.00 H new ATOM 0 HE2 LYS A 66 -11.140 -21.221 -38.595 1.00 44.00 H new ATOM 0 HE3 LYS A 66 -9.898 -21.677 -37.446 1.00 44.00 H new ATOM 0 HZ1 LYS A 66 -11.227 -23.566 -38.095 1.00 64.00 H new ATOM 0 HZ2 LYS A 66 -11.441 -23.245 -36.441 1.00 64.00 H new ATOM 0 HZ3 LYS A 66 -12.645 -22.804 -37.555 1.00 64.00 H new ATOM 1051 N ARG A 67 -11.567 -16.590 -38.179 1.00 51.00 N ATOM 1052 CA ARG A 67 -12.385 -16.180 -39.319 1.00 14.00 C ATOM 1053 C ARG A 67 -13.839 -16.648 -39.152 1.00 71.00 C ATOM 1054 O ARG A 67 -14.775 -16.028 -39.648 1.00 53.00 O ATOM 1055 CB ARG A 67 -11.814 -16.779 -40.607 1.00 31.00 C ATOM 1056 CG ARG A 67 -12.535 -16.330 -41.862 1.00 20.00 C ATOM 1057 CD ARG A 67 -12.356 -14.849 -42.054 1.00 72.00 C ATOM 1058 NE ARG A 67 -10.946 -14.510 -42.336 1.00 11.00 N ATOM 1059 CZ ARG A 67 -10.383 -13.302 -42.200 1.00 31.00 C ATOM 1060 NH1 ARG A 67 -11.037 -12.315 -41.603 1.00 52.00 N ATOM 1061 NH2 ARG A 67 -9.130 -13.115 -42.606 1.00 30.00 N ATOM 0 H ARG A 67 -10.763 -17.160 -38.443 1.00 51.00 H new ATOM 0 HA ARG A 67 -12.370 -15.091 -39.372 1.00 14.00 H new ATOM 0 HB2 ARG A 67 -10.761 -16.508 -40.687 1.00 31.00 H new ATOM 0 HB3 ARG A 67 -11.859 -17.866 -40.542 1.00 31.00 H new ATOM 0 HG2 ARG A 67 -12.146 -16.867 -42.727 1.00 20.00 H new ATOM 0 HG3 ARG A 67 -13.596 -16.570 -41.788 1.00 20.00 H new ATOM 0 HD2 ARG A 67 -12.985 -14.508 -42.876 1.00 72.00 H new ATOM 0 HD3 ARG A 67 -12.687 -14.322 -41.159 1.00 72.00 H new ATOM 0 HE ARG A 67 -10.345 -15.266 -42.665 1.00 11.00 H new ATOM 0 HH11 ARG A 67 -11.978 -12.472 -41.242 1.00 52.00 H new ATOM 0 HH12 ARG A 67 -10.599 -11.399 -41.505 1.00 52.00 H new ATOM 0 HH21 ARG A 67 -8.606 -13.888 -43.017 1.00 30.00 H new ATOM 0 HH22 ARG A 67 -8.693 -12.199 -42.507 1.00 30.00 H new ATOM 1075 N ASP A 68 -13.992 -17.705 -38.412 1.00 15.00 N ATOM 1076 CA ASP A 68 -15.267 -18.337 -38.215 1.00 71.00 C ATOM 1077 C ASP A 68 -15.912 -17.884 -36.953 1.00 51.00 C ATOM 1078 O ASP A 68 -17.134 -17.821 -36.876 1.00 35.00 O ATOM 1079 CB ASP A 68 -15.168 -19.866 -38.214 1.00 41.00 C ATOM 1080 CG ASP A 68 -14.658 -20.443 -39.506 1.00 42.00 C ATOM 1081 OD1 ASP A 68 -15.421 -20.490 -40.497 1.00 20.00 O ATOM 1082 OD2 ASP A 68 -13.488 -20.891 -39.556 1.00 13.00 O ATOM 0 H ASP A 68 -13.224 -18.161 -37.920 1.00 15.00 H new ATOM 0 HA ASP A 68 -15.884 -18.035 -39.062 1.00 71.00 H new ATOM 0 HB2 ASP A 68 -14.510 -20.177 -37.403 1.00 41.00 H new ATOM 0 HB3 ASP A 68 -16.152 -20.284 -38.004 1.00 41.00 H new ATOM 1087 N ARG A 69 -15.122 -17.511 -35.978 1.00 52.00 N ATOM 1088 CA ARG A 69 -15.656 -17.154 -34.713 1.00 34.00 C ATOM 1089 C ARG A 69 -14.626 -16.498 -33.807 1.00 74.00 C ATOM 1090 O ARG A 69 -13.478 -16.929 -33.693 1.00 51.00 O ATOM 1091 CB ARG A 69 -16.302 -18.334 -33.946 1.00 53.00 C ATOM 1092 CG ARG A 69 -17.119 -17.848 -32.757 1.00 63.00 C ATOM 1093 CD ARG A 69 -17.525 -18.928 -31.780 1.00 15.00 C ATOM 1094 NE ARG A 69 -18.353 -18.342 -30.706 1.00 12.00 N ATOM 1095 CZ ARG A 69 -18.205 -18.535 -29.378 1.00 14.00 C ATOM 1096 NH1 ARG A 69 -17.319 -19.407 -28.909 1.00 21.00 N ATOM 1097 NH2 ARG A 69 -18.975 -17.859 -28.527 1.00 3.00 N ATOM 0 H ARG A 69 -14.106 -17.451 -36.048 1.00 52.00 H new ATOM 0 HA ARG A 69 -16.440 -16.437 -34.959 1.00 34.00 H new ATOM 0 HB2 ARG A 69 -16.943 -18.901 -34.621 1.00 53.00 H new ATOM 0 HB3 ARG A 69 -15.523 -19.014 -33.600 1.00 53.00 H new ATOM 0 HG2 ARG A 69 -16.542 -17.093 -32.223 1.00 63.00 H new ATOM 0 HG3 ARG A 69 -18.019 -17.358 -33.129 1.00 63.00 H new ATOM 0 HD2 ARG A 69 -18.083 -19.709 -32.297 1.00 15.00 H new ATOM 0 HD3 ARG A 69 -16.639 -19.398 -31.354 1.00 15.00 H new ATOM 0 HE ARG A 69 -19.114 -17.729 -30.998 1.00 12.00 H new ATOM 0 HH11 ARG A 69 -16.739 -19.942 -29.555 1.00 21.00 H new ATOM 0 HH12 ARG A 69 -17.219 -19.541 -27.903 1.00 21.00 H new ATOM 0 HH21 ARG A 69 -19.670 -17.201 -28.880 1.00 3.00 H new ATOM 0 HH22 ARG A 69 -18.870 -17.999 -27.522 1.00 3.00 H new ATOM 1111 N ILE A 70 -15.062 -15.452 -33.234 1.00 15.00 N ATOM 1112 CA ILE A 70 -14.418 -14.756 -32.144 1.00 61.00 C ATOM 1113 C ILE A 70 -14.794 -15.488 -30.879 1.00 62.00 C ATOM 1114 O ILE A 70 -15.958 -15.831 -30.682 1.00 30.00 O ATOM 1115 CB ILE A 70 -14.994 -13.332 -32.000 1.00 11.00 C ATOM 1116 CG1 ILE A 70 -14.937 -12.565 -33.303 1.00 74.00 C ATOM 1117 CG2 ILE A 70 -14.302 -12.563 -30.894 1.00 4.00 C ATOM 1118 CD1 ILE A 70 -15.573 -11.189 -33.259 1.00 41.00 C ATOM 0 H ILE A 70 -15.937 -15.010 -33.516 1.00 15.00 H new ATOM 0 HA ILE A 70 -13.344 -14.712 -32.322 1.00 61.00 H new ATOM 0 HB ILE A 70 -16.044 -13.443 -31.729 1.00 11.00 H new ATOM 0 HG12 ILE A 70 -13.894 -12.458 -33.600 1.00 74.00 H new ATOM 0 HG13 ILE A 70 -15.430 -13.153 -34.077 1.00 74.00 H new ATOM 0 HG21 ILE A 70 -14.733 -11.564 -30.821 1.00 4.00 H new ATOM 0 HG22 ILE A 70 -14.436 -13.087 -29.948 1.00 4.00 H new ATOM 0 HG23 ILE A 70 -13.238 -12.484 -31.117 1.00 4.00 H new ATOM 0 HD11 ILE A 70 -15.484 -10.716 -34.237 1.00 41.00 H new ATOM 0 HD12 ILE A 70 -16.627 -11.283 -32.996 1.00 41.00 H new ATOM 0 HD13 ILE A 70 -15.066 -10.578 -32.512 1.00 41.00 H new ATOM 1130 N VAL A 71 -13.858 -15.697 -30.027 1.00 44.00 N ATOM 1131 CA VAL A 71 -14.159 -16.375 -28.774 1.00 73.00 C ATOM 1132 C VAL A 71 -14.059 -15.446 -27.593 1.00 34.00 C ATOM 1133 O VAL A 71 -14.338 -15.829 -26.480 1.00 71.00 O ATOM 1134 CB VAL A 71 -13.451 -17.761 -28.556 1.00 44.00 C ATOM 1135 CG1 VAL A 71 -13.902 -18.747 -29.609 1.00 34.00 C ATOM 1136 CG2 VAL A 71 -11.931 -17.697 -28.525 1.00 40.00 C ATOM 0 H VAL A 71 -12.884 -15.421 -30.151 1.00 44.00 H new ATOM 0 HA VAL A 71 -15.206 -16.665 -28.864 1.00 73.00 H new ATOM 0 HB VAL A 71 -13.756 -18.092 -27.563 1.00 44.00 H new ATOM 0 HG11 VAL A 71 -13.405 -19.704 -29.448 1.00 34.00 H new ATOM 0 HG12 VAL A 71 -14.981 -18.883 -29.542 1.00 34.00 H new ATOM 0 HG13 VAL A 71 -13.645 -18.366 -30.598 1.00 34.00 H new ATOM 0 HG21 VAL A 71 -11.528 -18.698 -28.370 1.00 40.00 H new ATOM 0 HG22 VAL A 71 -11.564 -17.300 -29.472 1.00 40.00 H new ATOM 0 HG23 VAL A 71 -11.611 -17.047 -27.711 1.00 40.00 H new ATOM 1146 N LEU A 72 -13.667 -14.199 -27.888 1.00 21.00 N ATOM 1147 CA LEU A 72 -13.673 -13.077 -26.955 1.00 61.00 C ATOM 1148 C LEU A 72 -13.068 -11.858 -27.677 1.00 61.00 C ATOM 1149 O LEU A 72 -12.034 -11.995 -28.334 1.00 1.00 O ATOM 1150 CB LEU A 72 -12.870 -13.367 -25.688 1.00 62.00 C ATOM 1151 CG LEU A 72 -13.496 -12.747 -24.392 1.00 30.00 C ATOM 1152 CD1 LEU A 72 -13.308 -11.278 -24.361 1.00 14.00 C ATOM 1153 CD2 LEU A 72 -15.008 -12.988 -24.321 1.00 34.00 C ATOM 0 H LEU A 72 -13.327 -13.941 -28.814 1.00 21.00 H new ATOM 0 HA LEU A 72 -14.701 -12.890 -26.644 1.00 61.00 H new ATOM 0 HB2 LEU A 72 -12.786 -14.446 -25.560 1.00 62.00 H new ATOM 0 HB3 LEU A 72 -11.858 -12.981 -25.813 1.00 62.00 H new ATOM 0 HG LEU A 72 -12.990 -13.230 -23.556 1.00 30.00 H new ATOM 0 HD11 LEU A 72 -13.752 -10.874 -23.451 1.00 14.00 H new ATOM 0 HD12 LEU A 72 -12.243 -11.047 -24.379 1.00 14.00 H new ATOM 0 HD13 LEU A 72 -13.791 -10.831 -25.230 1.00 14.00 H new ATOM 0 HD21 LEU A 72 -15.405 -12.543 -23.408 1.00 34.00 H new ATOM 0 HD22 LEU A 72 -15.490 -12.533 -25.186 1.00 34.00 H new ATOM 0 HD23 LEU A 72 -15.206 -14.060 -24.318 1.00 34.00 H new ATOM 1165 N ASN A 73 -13.685 -10.689 -27.608 1.00 31.00 N ATOM 1166 CA ASN A 73 -13.123 -9.521 -28.334 1.00 1.00 C ATOM 1167 C ASN A 73 -12.906 -8.316 -27.441 1.00 34.00 C ATOM 1168 O ASN A 73 -12.718 -7.201 -27.924 1.00 0.00 O ATOM 1169 CB ASN A 73 -13.958 -9.121 -29.583 1.00 51.00 C ATOM 1170 CG ASN A 73 -15.332 -8.506 -29.294 1.00 23.00 C ATOM 1171 OD1 ASN A 73 -15.969 -8.781 -28.277 1.00 11.00 O ATOM 1172 ND2 ASN A 73 -15.799 -7.685 -30.200 1.00 51.00 N ATOM 0 H ASN A 73 -14.541 -10.508 -27.084 1.00 31.00 H new ATOM 0 HA ASN A 73 -12.146 -9.858 -28.681 1.00 1.00 H new ATOM 0 HB2 ASN A 73 -13.379 -8.410 -30.172 1.00 51.00 H new ATOM 0 HB3 ASN A 73 -14.100 -10.007 -30.202 1.00 51.00 H new ATOM 0 HD21 ASN A 73 -16.715 -7.253 -30.074 1.00 51.00 H new ATOM 0 HD22 ASN A 73 -15.247 -7.477 -31.032 1.00 51.00 H new ATOM 1179 N ASN A 74 -12.850 -8.545 -26.166 1.00 61.00 N ATOM 1180 CA ASN A 74 -12.663 -7.481 -25.210 1.00 14.00 C ATOM 1181 C ASN A 74 -12.133 -8.033 -23.900 1.00 54.00 C ATOM 1182 O ASN A 74 -12.884 -8.320 -22.970 1.00 43.00 O ATOM 1183 CB ASN A 74 -13.947 -6.647 -24.980 1.00 11.00 C ATOM 1184 CG ASN A 74 -13.697 -5.419 -24.106 1.00 64.00 C ATOM 1185 OD1 ASN A 74 -13.341 -4.358 -24.604 1.00 72.00 O ATOM 1186 ND2 ASN A 74 -13.913 -5.534 -22.829 1.00 70.00 N ATOM 0 H ASN A 74 -12.932 -9.473 -25.751 1.00 61.00 H new ATOM 0 HA ASN A 74 -11.925 -6.800 -25.633 1.00 14.00 H new ATOM 0 HB2 ASN A 74 -14.347 -6.329 -25.943 1.00 11.00 H new ATOM 0 HB3 ASN A 74 -14.705 -7.274 -24.511 1.00 11.00 H new ATOM 0 HD21 ASN A 74 -13.787 -4.729 -22.216 1.00 70.00 H new ATOM 0 HD22 ASN A 74 -14.209 -6.429 -22.440 1.00 70.00 H new ATOM 1193 N CYS A 75 -10.864 -8.265 -23.883 1.00 60.00 N ATOM 1194 CA CYS A 75 -10.158 -8.693 -22.710 1.00 63.00 C ATOM 1195 C CYS A 75 -9.168 -7.660 -22.440 1.00 73.00 C ATOM 1196 O CYS A 75 -8.498 -7.185 -23.368 1.00 12.00 O ATOM 1197 CB CYS A 75 -9.466 -10.045 -22.862 1.00 20.00 C ATOM 1198 SG CYS A 75 -10.570 -11.478 -22.780 1.00 75.00 S ATOM 0 H CYS A 75 -10.268 -8.161 -24.704 1.00 60.00 H new ATOM 0 HA CYS A 75 -10.871 -8.829 -21.896 1.00 63.00 H new ATOM 0 HB2 CYS A 75 -8.941 -10.063 -23.817 1.00 20.00 H new ATOM 0 HB3 CYS A 75 -8.711 -10.141 -22.081 1.00 20.00 H new ATOM 1203 N GLN A 76 -9.064 -7.288 -21.225 1.00 12.00 N ATOM 1204 CA GLN A 76 -8.281 -6.204 -20.846 1.00 12.00 C ATOM 1205 C GLN A 76 -7.511 -6.658 -19.693 1.00 31.00 C ATOM 1206 O GLN A 76 -8.051 -7.139 -18.710 1.00 35.00 O ATOM 1207 CB GLN A 76 -9.168 -5.013 -20.567 1.00 2.00 C ATOM 1208 CG GLN A 76 -9.891 -4.541 -21.824 1.00 22.00 C ATOM 1209 CD GLN A 76 -10.939 -3.491 -21.541 1.00 44.00 C ATOM 1210 OE1 GLN A 76 -12.104 -3.810 -21.291 1.00 23.00 O ATOM 1211 NE2 GLN A 76 -10.546 -2.248 -21.557 1.00 14.00 N ATOM 0 H GLN A 76 -9.540 -7.750 -20.450 1.00 12.00 H new ATOM 0 HA GLN A 76 -7.593 -5.869 -21.622 1.00 12.00 H new ATOM 0 HB2 GLN A 76 -9.900 -5.275 -19.803 1.00 2.00 H new ATOM 0 HB3 GLN A 76 -8.567 -4.198 -20.165 1.00 2.00 H new ATOM 0 HG2 GLN A 76 -9.162 -4.139 -22.527 1.00 22.00 H new ATOM 0 HG3 GLN A 76 -10.362 -5.396 -22.308 1.00 22.00 H new ATOM 0 HE21 GLN A 76 -9.574 -2.023 -21.768 1.00 14.00 H new ATOM 0 HE22 GLN A 76 -11.211 -1.500 -21.358 1.00 14.00 H new ATOM 1220 N LEU A 77 -6.275 -6.582 -19.847 1.00 24.00 N ATOM 1221 CA LEU A 77 -5.373 -7.218 -18.969 1.00 41.00 C ATOM 1222 C LEU A 77 -5.077 -6.380 -17.706 1.00 43.00 C ATOM 1223 O LEU A 77 -5.018 -5.146 -17.769 1.00 33.00 O ATOM 1224 CB LEU A 77 -4.116 -7.626 -19.799 1.00 11.00 C ATOM 1225 CG LEU A 77 -2.882 -8.219 -19.106 1.00 51.00 C ATOM 1226 CD1 LEU A 77 -2.078 -7.154 -18.406 1.00 41.00 C ATOM 1227 CD2 LEU A 77 -3.261 -9.342 -18.150 1.00 4.00 C ATOM 0 H LEU A 77 -5.828 -6.065 -20.604 1.00 24.00 H new ATOM 0 HA LEU A 77 -5.815 -8.123 -18.553 1.00 41.00 H new ATOM 0 HB2 LEU A 77 -4.444 -8.350 -20.545 1.00 11.00 H new ATOM 0 HB3 LEU A 77 -3.786 -6.739 -20.339 1.00 11.00 H new ATOM 0 HG LEU A 77 -2.252 -8.651 -19.883 1.00 51.00 H new ATOM 0 HD11 LEU A 77 -1.212 -7.609 -17.926 1.00 41.00 H new ATOM 0 HD12 LEU A 77 -1.743 -6.414 -19.133 1.00 41.00 H new ATOM 0 HD13 LEU A 77 -2.697 -6.668 -17.652 1.00 41.00 H new ATOM 0 HD21 LEU A 77 -2.361 -9.737 -17.678 1.00 4.00 H new ATOM 0 HD22 LEU A 77 -3.933 -8.956 -17.384 1.00 4.00 H new ATOM 0 HD23 LEU A 77 -3.760 -10.138 -18.703 1.00 4.00 H new ATOM 1239 N GLN A 78 -4.947 -7.071 -16.558 1.00 32.00 N ATOM 1240 CA GLN A 78 -4.559 -6.436 -15.299 1.00 62.00 C ATOM 1241 C GLN A 78 -3.039 -6.532 -15.064 1.00 51.00 C ATOM 1242 O GLN A 78 -2.360 -5.518 -14.942 1.00 12.00 O ATOM 1243 CB GLN A 78 -5.317 -7.069 -14.135 1.00 4.00 C ATOM 1244 CG GLN A 78 -6.816 -7.057 -14.335 1.00 3.00 C ATOM 1245 CD GLN A 78 -7.359 -5.669 -14.595 1.00 63.00 C ATOM 1246 OE1 GLN A 78 -6.836 -4.663 -14.103 1.00 10.00 O ATOM 1247 NE2 GLN A 78 -8.366 -5.596 -15.389 1.00 15.00 N ATOM 0 H GLN A 78 -5.108 -8.076 -16.484 1.00 32.00 H new ATOM 0 HA GLN A 78 -4.819 -5.379 -15.362 1.00 62.00 H new ATOM 0 HB2 GLN A 78 -4.981 -8.098 -14.005 1.00 4.00 H new ATOM 0 HB3 GLN A 78 -5.074 -6.536 -13.216 1.00 4.00 H new ATOM 0 HG2 GLN A 78 -7.072 -7.706 -15.173 1.00 3.00 H new ATOM 0 HG3 GLN A 78 -7.300 -7.472 -13.451 1.00 3.00 H new ATOM 0 HE21 GLN A 78 -8.773 -6.447 -15.777 1.00 15.00 H new ATOM 0 HE22 GLN A 78 -8.759 -4.687 -15.632 1.00 15.00 H new ATOM 1256 N ASN A 79 -2.517 -7.750 -15.040 1.00 13.00 N ATOM 1257 CA ASN A 79 -1.105 -8.016 -14.807 1.00 2.00 C ATOM 1258 C ASN A 79 -0.889 -9.381 -15.368 1.00 5.00 C ATOM 1259 O ASN A 79 -1.632 -10.290 -15.002 1.00 25.00 O ATOM 1260 CB ASN A 79 -0.802 -8.062 -13.289 1.00 3.00 C ATOM 1261 CG ASN A 79 0.688 -8.249 -12.939 1.00 71.00 C ATOM 1262 OD1 ASN A 79 1.485 -8.776 -13.715 1.00 55.00 O ATOM 1263 ND2 ASN A 79 1.054 -7.858 -11.749 1.00 64.00 N ATOM 0 H ASN A 79 -3.071 -8.594 -15.184 1.00 13.00 H new ATOM 0 HA ASN A 79 -0.472 -7.249 -15.254 1.00 2.00 H new ATOM 0 HB2 ASN A 79 -1.156 -7.138 -12.833 1.00 3.00 H new ATOM 0 HB3 ASN A 79 -1.372 -8.877 -12.842 1.00 3.00 H new ATOM 0 HD21 ASN A 79 2.019 -7.987 -11.444 1.00 64.00 H new ATOM 0 HD22 ASN A 79 0.375 -7.424 -11.124 1.00 64.00 H new ATOM 1270 N PRO A 80 0.030 -9.582 -16.307 1.00 43.00 N ATOM 1271 CA PRO A 80 0.223 -10.882 -16.838 1.00 15.00 C ATOM 1272 C PRO A 80 1.294 -11.687 -16.086 1.00 61.00 C ATOM 1273 O PRO A 80 1.362 -12.903 -16.202 1.00 11.00 O ATOM 1274 CB PRO A 80 0.644 -10.621 -18.269 1.00 31.00 C ATOM 1275 CG PRO A 80 1.426 -9.339 -18.194 1.00 23.00 C ATOM 1276 CD PRO A 80 0.915 -8.589 -16.968 1.00 30.00 C ATOM 0 HA PRO A 80 -0.678 -11.489 -16.751 1.00 15.00 H new ATOM 0 HB2 PRO A 80 1.252 -11.436 -18.660 1.00 31.00 H new ATOM 0 HB3 PRO A 80 -0.220 -10.523 -18.927 1.00 31.00 H new ATOM 0 HG2 PRO A 80 2.494 -9.541 -18.108 1.00 23.00 H new ATOM 0 HG3 PRO A 80 1.286 -8.746 -19.098 1.00 23.00 H new ATOM 0 HD2 PRO A 80 1.732 -8.280 -16.315 1.00 30.00 H new ATOM 0 HD3 PRO A 80 0.371 -7.687 -17.246 1.00 30.00 H new ATOM 1284 N GLN A 81 2.101 -11.029 -15.298 1.00 23.00 N ATOM 1285 CA GLN A 81 3.148 -11.675 -14.647 1.00 15.00 C ATOM 1286 C GLN A 81 2.677 -12.206 -13.324 1.00 70.00 C ATOM 1287 O GLN A 81 2.807 -11.571 -12.255 1.00 4.00 O ATOM 1288 CB GLN A 81 4.316 -10.772 -14.505 1.00 60.00 C ATOM 1289 CG GLN A 81 5.531 -11.453 -13.981 1.00 5.00 C ATOM 1290 CD GLN A 81 6.720 -10.534 -13.887 1.00 70.00 C ATOM 1291 OE1 GLN A 81 6.865 -9.584 -14.668 1.00 64.00 O ATOM 1292 NE2 GLN A 81 7.565 -10.785 -12.943 1.00 61.00 N ATOM 0 H GLN A 81 2.030 -10.030 -15.106 1.00 23.00 H new ATOM 0 HA GLN A 81 3.476 -12.523 -15.248 1.00 15.00 H new ATOM 0 HB2 GLN A 81 4.546 -10.332 -15.476 1.00 60.00 H new ATOM 0 HB3 GLN A 81 4.052 -9.952 -13.837 1.00 60.00 H new ATOM 0 HG2 GLN A 81 5.315 -11.863 -12.994 1.00 5.00 H new ATOM 0 HG3 GLN A 81 5.778 -12.294 -14.628 1.00 5.00 H new ATOM 0 HE21 GLN A 81 7.412 -11.577 -12.319 1.00 61.00 H new ATOM 0 HE22 GLN A 81 8.385 -10.191 -12.822 1.00 61.00 H new