USER MOD reduce.3.24.130724 H: found=0, std=0, add=691, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 688 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 66 MET CE :methyl -150:sc= -1.36 (180deg=-1.63) USER MOD Set 1.2: A 67 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 2.1: A 43 ASN : amide:sc= 0.914 K(o=2,f=-2.6) USER MOD Set 2.2: A 46 LYS NZ :NH3+ -153:sc= 1.1 (180deg=0) USER MOD Set 3.1: A 27 SER OG : rot 169:sc= 0.941 USER MOD Set 3.2: A 35 THR OG1 : rot -119:sc= 2.02 USER MOD Single : A 1 LEU N :NH3+ 146:sc= -0.238 (180deg=-1.43!) USER MOD Single : A 3 SER OG : rot 180:sc=0.000438 USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 LYS NZ :NH3+ 177:sc= 1.29 (180deg=1.24) USER MOD Single : A 15 TYR OH : rot -158:sc= 1.28 USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 LYS NZ :NH3+ -175:sc= 0.784 (180deg=0.768) USER MOD Single : A 23 SER OG : rot -40:sc= 0.429 USER MOD Single : A 24 TYR OH : rot 180:sc= 0 USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 THR OG1 : rot 180:sc= 0 USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 HIS : no HE2:sc= 0.305 K(o=0.3,f=-1.5) USER MOD Single : A 33 THR OG1 : rot 180:sc= 0.163 USER MOD Single : A 40 ASN : amide:sc= 0 X(o=0,f=-0.19) USER MOD Single : A 44 ASN : amide:sc= 0.951 K(o=0.95,f=-0.069) USER MOD Single : A 47 ASN : amide:sc=-0.00466 X(o=-0.0047,f=0) USER MOD Single : A 49 TYR OH : rot -30:sc= -0.214 USER MOD Single : A 51 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 52 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0204) USER MOD Single : A 56 SER OG : rot 160:sc= 0.25 USER MOD Single : A 57 THR OG1 : rot -40:sc= 0.157 USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : A 60 SER OG : rot 180:sc= 0.0336 USER MOD Single : A 61 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 63 GLN : amide:sc= 0.723 K(o=0.72,f=-0.051) USER MOD Single : A 69 SER OG : rot 98:sc= 1.24 USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 72 LYS NZ :NH3+ -138:sc= 1.1 (180deg=0.0133) USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 82 LYS NZ :NH3+ -165:sc= -0.0197 (180deg=-0.231) USER MOD ----------------------------------------------------------------- ATOM 1 N LEU A 1 36.884 20.227 58.642 1.00 0.00 N ATOM 2 CA LEU A 1 37.517 20.598 57.354 1.00 0.00 C ATOM 3 C LEU A 1 37.018 19.782 56.149 1.00 0.00 C ATOM 4 O LEU A 1 36.727 20.367 55.113 1.00 0.00 O ATOM 5 CB LEU A 1 39.056 20.662 57.443 1.00 0.00 C ATOM 6 CG LEU A 1 39.846 19.333 57.452 1.00 0.00 C ATOM 7 CD1 LEU A 1 41.343 19.637 57.499 1.00 0.00 C ATOM 8 CD2 LEU A 1 39.513 18.434 58.645 1.00 0.00 C ATOM 0 H1 LEU A 1 37.575 20.334 59.412 1.00 0.00 H new ATOM 0 H2 LEU A 1 36.069 20.848 58.820 1.00 0.00 H new ATOM 0 H3 LEU A 1 36.563 19.239 58.599 1.00 0.00 H new ATOM 0 HA LEU A 1 37.178 21.615 57.157 1.00 0.00 H new ATOM 0 HB2 LEU A 1 39.413 21.255 56.601 1.00 0.00 H new ATOM 0 HB3 LEU A 1 39.314 21.208 58.350 1.00 0.00 H new ATOM 0 HG LEU A 1 39.563 18.801 56.544 1.00 0.00 H new ATOM 0 HD11 LEU A 1 41.904 18.702 57.506 1.00 0.00 H new ATOM 0 HD12 LEU A 1 41.623 20.222 56.623 1.00 0.00 H new ATOM 0 HD13 LEU A 1 41.571 20.203 58.402 1.00 0.00 H new ATOM 0 HD21 LEU A 1 40.103 17.519 58.587 1.00 0.00 H new ATOM 0 HD22 LEU A 1 39.746 18.958 59.572 1.00 0.00 H new ATOM 0 HD23 LEU A 1 38.452 18.183 58.627 1.00 0.00 H new ATOM 20 N ASP A 2 36.896 18.453 56.242 1.00 0.00 N ATOM 21 CA ASP A 2 36.522 17.576 55.114 1.00 0.00 C ATOM 22 C ASP A 2 34.995 17.450 54.972 1.00 0.00 C ATOM 23 O ASP A 2 34.438 17.610 53.890 1.00 0.00 O ATOM 24 CB ASP A 2 37.199 16.198 55.205 1.00 0.00 C ATOM 25 CG ASP A 2 37.134 15.450 53.860 1.00 0.00 C ATOM 26 OD1 ASP A 2 36.022 15.224 53.332 1.00 0.00 O ATOM 27 OD2 ASP A 2 38.196 15.130 53.286 1.00 0.00 O ATOM 0 H ASP A 2 37.055 17.945 57.112 1.00 0.00 H new ATOM 0 HA ASP A 2 36.893 18.053 54.207 1.00 0.00 H new ATOM 0 HB2 ASP A 2 38.240 16.321 55.505 1.00 0.00 H new ATOM 0 HB3 ASP A 2 36.713 15.603 55.978 1.00 0.00 H new ATOM 32 N SER A 3 34.291 17.300 56.095 1.00 0.00 N ATOM 33 CA SER A 3 32.831 17.470 56.149 1.00 0.00 C ATOM 34 C SER A 3 32.373 18.875 55.730 1.00 0.00 C ATOM 35 O SER A 3 31.233 19.054 55.318 1.00 0.00 O ATOM 36 CB SER A 3 32.329 17.143 57.554 1.00 0.00 C ATOM 37 OG SER A 3 33.070 17.823 58.556 1.00 0.00 O ATOM 0 H SER A 3 34.712 17.058 56.992 1.00 0.00 H new ATOM 0 HA SER A 3 32.398 16.778 55.427 1.00 0.00 H new ATOM 0 HB2 SER A 3 31.276 17.414 57.635 1.00 0.00 H new ATOM 0 HB3 SER A 3 32.395 16.068 57.721 1.00 0.00 H new ATOM 0 HG SER A 3 32.717 17.589 59.440 1.00 0.00 H new ATOM 43 N GLU A 4 33.275 19.857 55.764 1.00 0.00 N ATOM 44 CA GLU A 4 33.102 21.186 55.175 1.00 0.00 C ATOM 45 C GLU A 4 33.302 21.180 53.654 1.00 0.00 C ATOM 46 O GLU A 4 32.386 21.499 52.893 1.00 0.00 O ATOM 47 CB GLU A 4 34.078 22.161 55.860 1.00 0.00 C ATOM 48 CG GLU A 4 33.405 23.068 56.891 1.00 0.00 C ATOM 49 CD GLU A 4 32.285 23.943 56.328 1.00 0.00 C ATOM 50 OE1 GLU A 4 32.446 24.503 55.226 1.00 0.00 O ATOM 51 OE2 GLU A 4 31.262 24.098 57.042 1.00 0.00 O ATOM 0 H GLU A 4 34.181 19.744 56.220 1.00 0.00 H new ATOM 0 HA GLU A 4 32.075 21.510 55.343 1.00 0.00 H new ATOM 0 HB2 GLU A 4 34.867 21.590 56.349 1.00 0.00 H new ATOM 0 HB3 GLU A 4 34.556 22.779 55.100 1.00 0.00 H new ATOM 0 HG2 GLU A 4 32.999 22.449 57.691 1.00 0.00 H new ATOM 0 HG3 GLU A 4 34.162 23.712 57.339 1.00 0.00 H new ATOM 58 N ARG A 5 34.477 20.755 53.181 1.00 0.00 N ATOM 59 CA ARG A 5 34.817 20.774 51.749 1.00 0.00 C ATOM 60 C ARG A 5 33.909 19.868 50.902 1.00 0.00 C ATOM 61 O ARG A 5 33.667 20.162 49.732 1.00 0.00 O ATOM 62 CB ARG A 5 36.325 20.504 51.599 1.00 0.00 C ATOM 63 CG ARG A 5 36.740 19.057 51.797 1.00 0.00 C ATOM 64 CD ARG A 5 36.703 18.201 50.538 1.00 0.00 C ATOM 65 NE ARG A 5 36.282 16.847 50.903 1.00 0.00 N ATOM 66 CZ ARG A 5 36.004 15.849 50.101 1.00 0.00 C ATOM 67 NH1 ARG A 5 36.192 15.917 48.818 1.00 0.00 N ATOM 68 NH2 ARG A 5 35.524 14.765 50.610 1.00 0.00 N ATOM 0 H ARG A 5 35.220 20.388 53.776 1.00 0.00 H new ATOM 0 HA ARG A 5 34.616 21.763 51.337 1.00 0.00 H new ATOM 0 HB2 ARG A 5 36.639 20.824 50.605 1.00 0.00 H new ATOM 0 HB3 ARG A 5 36.863 21.122 52.318 1.00 0.00 H new ATOM 0 HG2 ARG A 5 37.751 19.037 52.203 1.00 0.00 H new ATOM 0 HG3 ARG A 5 36.087 18.606 52.545 1.00 0.00 H new ATOM 0 HD2 ARG A 5 36.013 18.628 49.811 1.00 0.00 H new ATOM 0 HD3 ARG A 5 37.686 18.177 50.068 1.00 0.00 H new ATOM 0 HE ARG A 5 36.195 16.658 51.902 1.00 0.00 H new ATOM 0 HH11 ARG A 5 36.568 16.769 48.402 1.00 0.00 H new ATOM 0 HH12 ARG A 5 35.963 15.118 48.226 1.00 0.00 H new ATOM 0 HH21 ARG A 5 35.369 14.699 51.616 1.00 0.00 H new ATOM 0 HH22 ARG A 5 35.300 13.974 50.006 1.00 0.00 H new ATOM 82 N ASP A 6 33.337 18.815 51.489 1.00 0.00 N ATOM 83 CA ASP A 6 32.340 17.972 50.816 1.00 0.00 C ATOM 84 C ASP A 6 31.015 18.689 50.553 1.00 0.00 C ATOM 85 O ASP A 6 30.318 18.388 49.583 1.00 0.00 O ATOM 86 CB ASP A 6 32.060 16.712 51.622 1.00 0.00 C ATOM 87 CG ASP A 6 31.420 15.646 50.730 1.00 0.00 C ATOM 88 OD1 ASP A 6 32.024 15.266 49.700 1.00 0.00 O ATOM 89 OD2 ASP A 6 30.282 15.229 51.035 1.00 0.00 O ATOM 0 H ASP A 6 33.549 18.521 52.442 1.00 0.00 H new ATOM 0 HA ASP A 6 32.779 17.718 49.851 1.00 0.00 H new ATOM 0 HB2 ASP A 6 32.988 16.331 52.049 1.00 0.00 H new ATOM 0 HB3 ASP A 6 31.398 16.945 52.456 1.00 0.00 H new ATOM 94 N LYS A 7 30.684 19.671 51.393 1.00 0.00 N ATOM 95 CA LYS A 7 29.564 20.578 51.143 1.00 0.00 C ATOM 96 C LYS A 7 29.961 21.643 50.122 1.00 0.00 C ATOM 97 O LYS A 7 29.220 21.878 49.175 1.00 0.00 O ATOM 98 CB LYS A 7 29.081 21.249 52.438 1.00 0.00 C ATOM 99 CG LYS A 7 28.647 20.259 53.525 1.00 0.00 C ATOM 100 CD LYS A 7 28.518 20.987 54.868 1.00 0.00 C ATOM 101 CE LYS A 7 28.313 19.965 55.985 1.00 0.00 C ATOM 102 NZ LYS A 7 28.188 20.626 57.298 1.00 0.00 N ATOM 0 H LYS A 7 31.183 19.859 52.262 1.00 0.00 H new ATOM 0 HA LYS A 7 28.742 19.984 50.744 1.00 0.00 H new ATOM 0 HB2 LYS A 7 29.881 21.877 52.830 1.00 0.00 H new ATOM 0 HB3 LYS A 7 28.244 21.907 52.205 1.00 0.00 H new ATOM 0 HG2 LYS A 7 27.695 19.803 53.255 1.00 0.00 H new ATOM 0 HG3 LYS A 7 29.375 19.452 53.607 1.00 0.00 H new ATOM 0 HD2 LYS A 7 29.414 21.577 55.061 1.00 0.00 H new ATOM 0 HD3 LYS A 7 27.679 21.682 54.838 1.00 0.00 H new ATOM 0 HE2 LYS A 7 27.417 19.378 55.784 1.00 0.00 H new ATOM 0 HE3 LYS A 7 29.152 19.270 56.004 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 28.050 19.907 58.037 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 29.054 21.166 57.498 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 27.372 21.271 57.286 1.00 0.00 H new ATOM 116 N ALA A 8 31.156 22.227 50.263 1.00 0.00 N ATOM 117 CA ALA A 8 31.658 23.297 49.399 1.00 0.00 C ATOM 118 C ALA A 8 31.675 22.901 47.914 1.00 0.00 C ATOM 119 O ALA A 8 31.254 23.673 47.052 1.00 0.00 O ATOM 120 CB ALA A 8 33.065 23.691 49.872 1.00 0.00 C ATOM 0 H ALA A 8 31.813 21.962 50.997 1.00 0.00 H new ATOM 0 HA ALA A 8 30.980 24.147 49.478 1.00 0.00 H new ATOM 0 HB1 ALA A 8 33.452 24.488 49.237 1.00 0.00 H new ATOM 0 HB2 ALA A 8 33.018 24.039 50.904 1.00 0.00 H new ATOM 0 HB3 ALA A 8 33.725 22.826 49.811 1.00 0.00 H new ATOM 126 N ARG A 9 32.098 21.663 47.610 1.00 0.00 N ATOM 127 CA ARG A 9 32.095 21.136 46.234 1.00 0.00 C ATOM 128 C ARG A 9 30.680 20.962 45.675 1.00 0.00 C ATOM 129 O ARG A 9 30.479 21.129 44.479 1.00 0.00 O ATOM 130 CB ARG A 9 32.902 19.824 46.151 1.00 0.00 C ATOM 131 CG ARG A 9 32.149 18.643 46.775 1.00 0.00 C ATOM 132 CD ARG A 9 33.011 17.501 47.321 1.00 0.00 C ATOM 133 NE ARG A 9 33.697 16.677 46.312 1.00 0.00 N ATOM 134 CZ ARG A 9 33.988 15.393 46.449 1.00 0.00 C ATOM 135 NH1 ARG A 9 33.558 14.657 47.438 1.00 0.00 N ATOM 136 NH2 ARG A 9 34.787 14.851 45.582 1.00 0.00 N ATOM 0 H ARG A 9 32.449 21.003 48.304 1.00 0.00 H new ATOM 0 HA ARG A 9 32.583 21.879 45.603 1.00 0.00 H new ATOM 0 HB2 ARG A 9 33.124 19.601 45.107 1.00 0.00 H new ATOM 0 HB3 ARG A 9 33.857 19.954 46.660 1.00 0.00 H new ATOM 0 HG2 ARG A 9 31.530 19.023 47.588 1.00 0.00 H new ATOM 0 HG3 ARG A 9 31.473 18.233 46.024 1.00 0.00 H new ATOM 0 HD2 ARG A 9 33.762 17.925 47.988 1.00 0.00 H new ATOM 0 HD3 ARG A 9 32.379 16.850 47.925 1.00 0.00 H new ATOM 0 HE ARG A 9 33.969 17.131 45.440 1.00 0.00 H new ATOM 0 HH11 ARG A 9 32.964 15.067 48.158 1.00 0.00 H new ATOM 0 HH12 ARG A 9 33.816 13.672 47.490 1.00 0.00 H new ATOM 0 HH21 ARG A 9 35.172 15.412 44.822 1.00 0.00 H new ATOM 0 HH22 ARG A 9 35.031 13.864 45.660 1.00 0.00 H new ATOM 150 N LYS A 10 29.707 20.644 46.535 1.00 0.00 N ATOM 151 CA LYS A 10 28.310 20.400 46.164 1.00 0.00 C ATOM 152 C LYS A 10 27.537 21.705 46.005 1.00 0.00 C ATOM 153 O LYS A 10 26.758 21.834 45.072 1.00 0.00 O ATOM 154 CB LYS A 10 27.677 19.453 47.203 1.00 0.00 C ATOM 155 CG LYS A 10 26.472 18.671 46.657 1.00 0.00 C ATOM 156 CD LYS A 10 26.916 17.566 45.682 1.00 0.00 C ATOM 157 CE LYS A 10 25.732 16.930 44.949 1.00 0.00 C ATOM 158 NZ LYS A 10 26.221 16.016 43.893 1.00 0.00 N ATOM 0 H LYS A 10 29.875 20.547 47.536 1.00 0.00 H new ATOM 0 HA LYS A 10 28.268 19.916 45.188 1.00 0.00 H new ATOM 0 HB2 LYS A 10 28.432 18.748 47.549 1.00 0.00 H new ATOM 0 HB3 LYS A 10 27.362 20.034 48.070 1.00 0.00 H new ATOM 0 HG2 LYS A 10 25.919 18.227 47.485 1.00 0.00 H new ATOM 0 HG3 LYS A 10 25.792 19.355 46.149 1.00 0.00 H new ATOM 0 HD2 LYS A 10 27.610 17.985 44.953 1.00 0.00 H new ATOM 0 HD3 LYS A 10 27.457 16.796 46.231 1.00 0.00 H new ATOM 0 HE2 LYS A 10 25.109 16.382 45.655 1.00 0.00 H new ATOM 0 HE3 LYS A 10 25.107 17.707 44.508 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 25.412 15.550 43.435 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 26.755 16.558 43.184 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 26.840 15.296 44.317 1.00 0.00 H new ATOM 172 N GLU A 11 27.828 22.707 46.827 1.00 0.00 N ATOM 173 CA GLU A 11 27.273 24.060 46.709 1.00 0.00 C ATOM 174 C GLU A 11 27.547 24.675 45.329 1.00 0.00 C ATOM 175 O GLU A 11 26.653 25.255 44.711 1.00 0.00 O ATOM 176 CB GLU A 11 27.892 24.917 47.824 1.00 0.00 C ATOM 177 CG GLU A 11 27.490 26.397 47.791 1.00 0.00 C ATOM 178 CD GLU A 11 26.012 26.663 48.090 1.00 0.00 C ATOM 179 OE1 GLU A 11 25.187 25.732 48.251 1.00 0.00 O ATOM 180 OE2 GLU A 11 25.646 27.858 48.189 1.00 0.00 O ATOM 0 H GLU A 11 28.470 22.604 47.613 1.00 0.00 H new ATOM 0 HA GLU A 11 26.189 24.019 46.814 1.00 0.00 H new ATOM 0 HB2 GLU A 11 27.605 24.498 48.788 1.00 0.00 H new ATOM 0 HB3 GLU A 11 28.978 24.848 47.757 1.00 0.00 H new ATOM 0 HG2 GLU A 11 28.097 26.941 48.515 1.00 0.00 H new ATOM 0 HG3 GLU A 11 27.727 26.802 46.807 1.00 0.00 H new ATOM 187 N VAL A 12 28.769 24.509 44.808 1.00 0.00 N ATOM 188 CA VAL A 12 29.108 24.988 43.458 1.00 0.00 C ATOM 189 C VAL A 12 28.464 24.144 42.346 1.00 0.00 C ATOM 190 O VAL A 12 28.118 24.698 41.300 1.00 0.00 O ATOM 191 CB VAL A 12 30.624 25.199 43.268 1.00 0.00 C ATOM 192 CG1 VAL A 12 31.170 26.180 44.310 1.00 0.00 C ATOM 193 CG2 VAL A 12 31.457 23.919 43.341 1.00 0.00 C ATOM 0 H VAL A 12 29.538 24.049 45.296 1.00 0.00 H new ATOM 0 HA VAL A 12 28.660 25.977 43.363 1.00 0.00 H new ATOM 0 HB VAL A 12 30.721 25.595 42.257 1.00 0.00 H new ATOM 0 HG11 VAL A 12 32.241 26.314 44.157 1.00 0.00 H new ATOM 0 HG12 VAL A 12 30.665 27.140 44.205 1.00 0.00 H new ATOM 0 HG13 VAL A 12 30.993 25.784 45.310 1.00 0.00 H new ATOM 0 HG21 VAL A 12 32.510 24.161 43.197 1.00 0.00 H new ATOM 0 HG22 VAL A 12 31.322 23.452 44.317 1.00 0.00 H new ATOM 0 HG23 VAL A 12 31.133 23.229 42.561 1.00 0.00 H new ATOM 203 N GLU A 13 28.177 22.853 42.579 1.00 0.00 N ATOM 204 CA GLU A 13 27.296 22.071 41.692 1.00 0.00 C ATOM 205 C GLU A 13 25.856 22.606 41.700 1.00 0.00 C ATOM 206 O GLU A 13 25.239 22.699 40.644 1.00 0.00 O ATOM 207 CB GLU A 13 27.247 20.570 42.038 1.00 0.00 C ATOM 208 CG GLU A 13 28.586 19.829 42.012 1.00 0.00 C ATOM 209 CD GLU A 13 28.393 18.377 41.566 1.00 0.00 C ATOM 210 OE1 GLU A 13 27.969 17.525 42.382 1.00 0.00 O ATOM 211 OE2 GLU A 13 28.678 18.077 40.382 1.00 0.00 O ATOM 0 H GLU A 13 28.541 22.327 43.374 1.00 0.00 H new ATOM 0 HA GLU A 13 27.739 22.185 40.702 1.00 0.00 H new ATOM 0 HB2 GLU A 13 26.814 20.461 43.032 1.00 0.00 H new ATOM 0 HB3 GLU A 13 26.569 20.079 41.340 1.00 0.00 H new ATOM 0 HG2 GLU A 13 29.274 20.334 41.334 1.00 0.00 H new ATOM 0 HG3 GLU A 13 29.040 19.853 43.003 1.00 0.00 H new ATOM 218 N GLU A 14 25.313 22.995 42.858 1.00 0.00 N ATOM 219 CA GLU A 14 23.958 23.551 42.990 1.00 0.00 C ATOM 220 C GLU A 14 23.811 24.978 42.429 1.00 0.00 C ATOM 221 O GLU A 14 22.690 25.425 42.152 1.00 0.00 O ATOM 222 CB GLU A 14 23.481 23.451 44.447 1.00 0.00 C ATOM 223 CG GLU A 14 23.352 21.985 44.892 1.00 0.00 C ATOM 224 CD GLU A 14 22.614 21.822 46.221 1.00 0.00 C ATOM 225 OE1 GLU A 14 22.616 22.753 47.059 1.00 0.00 O ATOM 226 OE2 GLU A 14 21.954 20.773 46.411 1.00 0.00 O ATOM 0 H GLU A 14 25.810 22.932 43.747 1.00 0.00 H new ATOM 0 HA GLU A 14 23.306 22.940 42.365 1.00 0.00 H new ATOM 0 HB2 GLU A 14 24.183 23.971 45.099 1.00 0.00 H new ATOM 0 HB3 GLU A 14 22.518 23.951 44.552 1.00 0.00 H new ATOM 0 HG2 GLU A 14 22.826 21.423 44.120 1.00 0.00 H new ATOM 0 HG3 GLU A 14 24.347 21.550 44.981 1.00 0.00 H new ATOM 233 N TYR A 15 24.922 25.671 42.161 1.00 0.00 N ATOM 234 CA TYR A 15 24.929 26.818 41.253 1.00 0.00 C ATOM 235 C TYR A 15 24.983 26.353 39.792 1.00 0.00 C ATOM 236 O TYR A 15 24.031 26.599 39.056 1.00 0.00 O ATOM 237 CB TYR A 15 26.013 27.845 41.629 1.00 0.00 C ATOM 238 CG TYR A 15 25.612 29.282 41.325 1.00 0.00 C ATOM 239 CD1 TYR A 15 24.482 29.826 41.962 1.00 0.00 C ATOM 240 CD2 TYR A 15 26.369 30.096 40.459 1.00 0.00 C ATOM 241 CE1 TYR A 15 24.110 31.164 41.739 1.00 0.00 C ATOM 242 CE2 TYR A 15 25.997 31.441 40.227 1.00 0.00 C ATOM 243 CZ TYR A 15 24.864 31.983 40.876 1.00 0.00 C ATOM 244 OH TYR A 15 24.493 33.290 40.758 1.00 0.00 O ATOM 0 H TYR A 15 25.833 25.454 42.564 1.00 0.00 H new ATOM 0 HA TYR A 15 23.988 27.356 41.365 1.00 0.00 H new ATOM 0 HB2 TYR A 15 26.236 27.755 42.692 1.00 0.00 H new ATOM 0 HB3 TYR A 15 26.930 27.609 41.089 1.00 0.00 H new ATOM 0 HD1 TYR A 15 23.895 29.211 42.628 1.00 0.00 H new ATOM 0 HD2 TYR A 15 27.241 29.689 39.968 1.00 0.00 H new ATOM 0 HE1 TYR A 15 23.239 31.567 42.234 1.00 0.00 H new ATOM 0 HE2 TYR A 15 26.579 32.054 39.554 1.00 0.00 H new ATOM 0 HH TYR A 15 24.830 33.651 39.911 1.00 0.00 H new ATOM 254 N VAL A 16 26.017 25.608 39.380 1.00 0.00 N ATOM 255 CA VAL A 16 26.219 25.167 37.981 1.00 0.00 C ATOM 256 C VAL A 16 25.007 24.426 37.403 1.00 0.00 C ATOM 257 O VAL A 16 24.513 24.840 36.359 1.00 0.00 O ATOM 258 CB VAL A 16 27.524 24.348 37.860 1.00 0.00 C ATOM 259 CG1 VAL A 16 27.590 23.466 36.605 1.00 0.00 C ATOM 260 CG2 VAL A 16 28.695 25.337 37.866 1.00 0.00 C ATOM 0 H VAL A 16 26.750 25.287 40.012 1.00 0.00 H new ATOM 0 HA VAL A 16 26.322 26.062 37.368 1.00 0.00 H new ATOM 0 HB VAL A 16 27.567 23.659 38.703 1.00 0.00 H new ATOM 0 HG11 VAL A 16 28.535 22.923 36.591 1.00 0.00 H new ATOM 0 HG12 VAL A 16 26.763 22.756 36.616 1.00 0.00 H new ATOM 0 HG13 VAL A 16 27.519 24.092 35.716 1.00 0.00 H new ATOM 0 HG21 VAL A 16 29.634 24.790 37.782 1.00 0.00 H new ATOM 0 HG22 VAL A 16 28.597 26.022 37.024 1.00 0.00 H new ATOM 0 HG23 VAL A 16 28.688 25.904 38.797 1.00 0.00 H new ATOM 270 N LYS A 17 24.462 23.396 38.064 1.00 0.00 N ATOM 271 CA LYS A 17 23.327 22.613 37.533 1.00 0.00 C ATOM 272 C LYS A 17 22.055 23.456 37.378 1.00 0.00 C ATOM 273 O LYS A 17 21.318 23.293 36.406 1.00 0.00 O ATOM 274 CB LYS A 17 23.101 21.342 38.382 1.00 0.00 C ATOM 275 CG LYS A 17 22.287 21.578 39.667 1.00 0.00 C ATOM 276 CD LYS A 17 22.238 20.339 40.568 1.00 0.00 C ATOM 277 CE LYS A 17 21.423 20.590 41.846 1.00 0.00 C ATOM 278 NZ LYS A 17 19.965 20.687 41.596 1.00 0.00 N ATOM 0 H LYS A 17 24.790 23.080 38.977 1.00 0.00 H new ATOM 0 HA LYS A 17 23.586 22.292 36.524 1.00 0.00 H new ATOM 0 HB2 LYS A 17 22.589 20.598 37.772 1.00 0.00 H new ATOM 0 HB3 LYS A 17 24.070 20.921 38.651 1.00 0.00 H new ATOM 0 HG2 LYS A 17 22.723 22.409 40.221 1.00 0.00 H new ATOM 0 HG3 LYS A 17 21.271 21.870 39.401 1.00 0.00 H new ATOM 0 HD2 LYS A 17 21.801 19.507 40.017 1.00 0.00 H new ATOM 0 HD3 LYS A 17 23.253 20.045 40.837 1.00 0.00 H new ATOM 0 HE2 LYS A 17 21.611 19.783 42.554 1.00 0.00 H new ATOM 0 HE3 LYS A 17 21.767 21.512 42.314 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 19.469 20.856 42.494 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 19.776 21.474 40.943 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 19.625 19.799 41.175 1.00 0.00 H new ATOM 292 N LYS A 18 21.837 24.413 38.289 1.00 0.00 N ATOM 293 CA LYS A 18 20.696 25.335 38.235 1.00 0.00 C ATOM 294 C LYS A 18 20.886 26.355 37.116 1.00 0.00 C ATOM 295 O LYS A 18 19.983 26.563 36.317 1.00 0.00 O ATOM 296 CB LYS A 18 20.505 25.994 39.608 1.00 0.00 C ATOM 297 CG LYS A 18 19.276 26.915 39.619 1.00 0.00 C ATOM 298 CD LYS A 18 18.984 27.512 41.000 1.00 0.00 C ATOM 299 CE LYS A 18 20.119 28.396 41.532 1.00 0.00 C ATOM 300 NZ LYS A 18 20.982 27.687 42.513 1.00 0.00 N ATOM 0 H LYS A 18 22.451 24.570 39.088 1.00 0.00 H new ATOM 0 HA LYS A 18 19.784 24.784 38.003 1.00 0.00 H new ATOM 0 HB2 LYS A 18 20.392 25.224 40.371 1.00 0.00 H new ATOM 0 HB3 LYS A 18 21.395 26.569 39.865 1.00 0.00 H new ATOM 0 HG2 LYS A 18 19.430 27.724 38.905 1.00 0.00 H new ATOM 0 HG3 LYS A 18 18.405 26.353 39.281 1.00 0.00 H new ATOM 0 HD2 LYS A 18 18.068 28.101 40.947 1.00 0.00 H new ATOM 0 HD3 LYS A 18 18.802 26.702 41.707 1.00 0.00 H new ATOM 0 HE2 LYS A 18 20.730 28.739 40.697 1.00 0.00 H new ATOM 0 HE3 LYS A 18 19.694 29.283 42.001 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 21.680 28.351 42.905 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 20.394 27.309 43.283 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 21.477 26.905 42.039 1.00 0.00 H new ATOM 314 N ILE A 19 22.079 26.934 37.010 1.00 0.00 N ATOM 315 CA ILE A 19 22.454 27.880 35.956 1.00 0.00 C ATOM 316 C ILE A 19 22.381 27.218 34.568 1.00 0.00 C ATOM 317 O ILE A 19 21.910 27.850 33.625 1.00 0.00 O ATOM 318 CB ILE A 19 23.839 28.473 36.295 1.00 0.00 C ATOM 319 CG1 ILE A 19 23.784 29.373 37.559 1.00 0.00 C ATOM 320 CG2 ILE A 19 24.420 29.244 35.108 1.00 0.00 C ATOM 321 CD1 ILE A 19 23.154 30.762 37.385 1.00 0.00 C ATOM 0 H ILE A 19 22.834 26.755 37.672 1.00 0.00 H new ATOM 0 HA ILE A 19 21.745 28.707 35.911 1.00 0.00 H new ATOM 0 HB ILE A 19 24.501 27.635 36.512 1.00 0.00 H new ATOM 0 HG12 ILE A 19 23.229 28.841 38.332 1.00 0.00 H new ATOM 0 HG13 ILE A 19 24.801 29.504 37.929 1.00 0.00 H new ATOM 0 HG21 ILE A 19 25.395 29.649 35.379 1.00 0.00 H new ATOM 0 HG22 ILE A 19 24.530 28.572 34.257 1.00 0.00 H new ATOM 0 HG23 ILE A 19 23.749 30.061 34.841 1.00 0.00 H new ATOM 0 HD11 ILE A 19 23.175 31.293 38.337 1.00 0.00 H new ATOM 0 HD12 ILE A 19 23.718 31.327 36.642 1.00 0.00 H new ATOM 0 HD13 ILE A 19 22.122 30.654 37.052 1.00 0.00 H new ATOM 333 N VAL A 20 22.730 25.932 34.442 1.00 0.00 N ATOM 334 CA VAL A 20 22.470 25.124 33.237 1.00 0.00 C ATOM 335 C VAL A 20 20.963 25.023 32.953 1.00 0.00 C ATOM 336 O VAL A 20 20.537 25.364 31.850 1.00 0.00 O ATOM 337 CB VAL A 20 23.134 23.730 33.352 1.00 0.00 C ATOM 338 CG1 VAL A 20 22.599 22.741 32.304 1.00 0.00 C ATOM 339 CG2 VAL A 20 24.654 23.822 33.185 1.00 0.00 C ATOM 0 H VAL A 20 23.206 25.414 35.180 1.00 0.00 H new ATOM 0 HA VAL A 20 22.923 25.628 32.384 1.00 0.00 H new ATOM 0 HB VAL A 20 22.886 23.365 34.349 1.00 0.00 H new ATOM 0 HG11 VAL A 20 23.095 21.778 32.426 1.00 0.00 H new ATOM 0 HG12 VAL A 20 21.525 22.615 32.438 1.00 0.00 H new ATOM 0 HG13 VAL A 20 22.797 23.128 31.304 1.00 0.00 H new ATOM 0 HG21 VAL A 20 25.090 22.827 33.271 1.00 0.00 H new ATOM 0 HG22 VAL A 20 24.888 24.237 32.205 1.00 0.00 H new ATOM 0 HG23 VAL A 20 25.067 24.467 33.960 1.00 0.00 H new ATOM 349 N GLY A 21 20.142 24.612 33.927 1.00 0.00 N ATOM 350 CA GLY A 21 18.687 24.479 33.756 1.00 0.00 C ATOM 351 C GLY A 21 17.981 25.793 33.387 1.00 0.00 C ATOM 352 O GLY A 21 17.122 25.819 32.501 1.00 0.00 O ATOM 0 H GLY A 21 20.468 24.361 34.860 1.00 0.00 H new ATOM 0 HA2 GLY A 21 18.488 23.741 32.979 1.00 0.00 H new ATOM 0 HA3 GLY A 21 18.256 24.093 34.680 1.00 0.00 H new ATOM 356 N GLU A 22 18.381 26.908 33.994 1.00 0.00 N ATOM 357 CA GLU A 22 17.865 28.243 33.677 1.00 0.00 C ATOM 358 C GLU A 22 18.429 28.785 32.349 1.00 0.00 C ATOM 359 O GLU A 22 17.712 29.452 31.602 1.00 0.00 O ATOM 360 CB GLU A 22 18.144 29.197 34.852 1.00 0.00 C ATOM 361 CG GLU A 22 17.460 28.785 36.171 1.00 0.00 C ATOM 362 CD GLU A 22 15.934 28.658 36.060 1.00 0.00 C ATOM 363 OE1 GLU A 22 15.274 29.580 35.529 1.00 0.00 O ATOM 364 OE2 GLU A 22 15.360 27.679 36.586 1.00 0.00 O ATOM 0 H GLU A 22 19.084 26.912 34.733 1.00 0.00 H new ATOM 0 HA GLU A 22 16.787 28.170 33.535 1.00 0.00 H new ATOM 0 HB2 GLU A 22 19.220 29.251 35.015 1.00 0.00 H new ATOM 0 HB3 GLU A 22 17.812 30.199 34.580 1.00 0.00 H new ATOM 0 HG2 GLU A 22 17.872 27.832 36.502 1.00 0.00 H new ATOM 0 HG3 GLU A 22 17.700 29.520 36.940 1.00 0.00 H new ATOM 371 N SER A 23 19.660 28.423 31.964 1.00 0.00 N ATOM 372 CA SER A 23 20.190 28.725 30.627 1.00 0.00 C ATOM 373 C SER A 23 19.656 27.807 29.520 1.00 0.00 C ATOM 374 O SER A 23 19.907 28.079 28.344 1.00 0.00 O ATOM 375 CB SER A 23 21.718 28.783 30.594 1.00 0.00 C ATOM 376 OG SER A 23 22.080 29.546 29.454 1.00 0.00 O ATOM 0 H SER A 23 20.312 27.917 32.564 1.00 0.00 H new ATOM 0 HA SER A 23 19.811 29.724 30.410 1.00 0.00 H new ATOM 0 HB2 SER A 23 22.106 29.241 31.504 1.00 0.00 H new ATOM 0 HB3 SER A 23 22.141 27.780 30.537 1.00 0.00 H new ATOM 0 HG SER A 23 21.488 29.319 28.707 1.00 0.00 H new ATOM 382 N TYR A 24 18.891 26.762 29.848 1.00 0.00 N ATOM 383 CA TYR A 24 17.960 26.129 28.909 1.00 0.00 C ATOM 384 C TYR A 24 16.601 26.847 28.881 1.00 0.00 C ATOM 385 O TYR A 24 15.998 26.930 27.813 1.00 0.00 O ATOM 386 CB TYR A 24 17.824 24.625 29.196 1.00 0.00 C ATOM 387 CG TYR A 24 18.933 23.794 28.573 1.00 0.00 C ATOM 388 CD1 TYR A 24 19.006 23.676 27.169 1.00 0.00 C ATOM 389 CD2 TYR A 24 19.896 23.156 29.379 1.00 0.00 C ATOM 390 CE1 TYR A 24 20.053 22.945 26.574 1.00 0.00 C ATOM 391 CE2 TYR A 24 20.936 22.410 28.788 1.00 0.00 C ATOM 392 CZ TYR A 24 21.019 22.312 27.381 1.00 0.00 C ATOM 393 OH TYR A 24 22.030 21.621 26.794 1.00 0.00 O ATOM 0 H TYR A 24 18.900 26.331 30.772 1.00 0.00 H new ATOM 0 HA TYR A 24 18.378 26.228 27.907 1.00 0.00 H new ATOM 0 HB2 TYR A 24 17.822 24.466 30.274 1.00 0.00 H new ATOM 0 HB3 TYR A 24 16.862 24.276 28.820 1.00 0.00 H new ATOM 0 HD1 TYR A 24 18.258 24.147 26.549 1.00 0.00 H new ATOM 0 HD2 TYR A 24 19.837 23.239 30.454 1.00 0.00 H new ATOM 0 HE1 TYR A 24 20.115 22.870 25.498 1.00 0.00 H new ATOM 0 HE2 TYR A 24 21.667 21.915 29.409 1.00 0.00 H new ATOM 0 HH TYR A 24 22.613 21.244 27.485 1.00 0.00 H new ATOM 403 N ALA A 25 16.143 27.436 29.991 1.00 0.00 N ATOM 404 CA ALA A 25 14.889 28.200 30.042 1.00 0.00 C ATOM 405 C ALA A 25 14.941 29.524 29.245 1.00 0.00 C ATOM 406 O ALA A 25 13.947 29.883 28.607 1.00 0.00 O ATOM 407 CB ALA A 25 14.500 28.426 31.507 1.00 0.00 C ATOM 0 H ALA A 25 16.633 27.397 30.884 1.00 0.00 H new ATOM 0 HA ALA A 25 14.117 27.610 29.547 1.00 0.00 H new ATOM 0 HB1 ALA A 25 13.570 28.993 31.553 1.00 0.00 H new ATOM 0 HB2 ALA A 25 14.363 27.463 32.000 1.00 0.00 H new ATOM 0 HB3 ALA A 25 15.290 28.983 32.011 1.00 0.00 H new ATOM 413 N LYS A 26 16.099 30.209 29.191 1.00 0.00 N ATOM 414 CA LYS A 26 16.328 31.373 28.299 1.00 0.00 C ATOM 415 C LYS A 26 16.831 31.035 26.882 1.00 0.00 C ATOM 416 O LYS A 26 17.336 31.910 26.180 1.00 0.00 O ATOM 417 CB LYS A 26 17.067 32.526 29.009 1.00 0.00 C ATOM 418 CG LYS A 26 18.567 32.325 29.282 1.00 0.00 C ATOM 419 CD LYS A 26 19.161 33.628 29.852 1.00 0.00 C ATOM 420 CE LYS A 26 20.653 33.551 30.211 1.00 0.00 C ATOM 421 NZ LYS A 26 21.516 33.388 29.015 1.00 0.00 N ATOM 0 H LYS A 26 16.908 29.973 29.765 1.00 0.00 H new ATOM 0 HA LYS A 26 15.334 31.764 28.083 1.00 0.00 H new ATOM 0 HB2 LYS A 26 16.949 33.427 28.407 1.00 0.00 H new ATOM 0 HB3 LYS A 26 16.570 32.712 29.961 1.00 0.00 H new ATOM 0 HG2 LYS A 26 18.713 31.506 29.987 1.00 0.00 H new ATOM 0 HG3 LYS A 26 19.082 32.049 28.362 1.00 0.00 H new ATOM 0 HD2 LYS A 26 19.017 34.426 29.123 1.00 0.00 H new ATOM 0 HD3 LYS A 26 18.601 33.907 30.744 1.00 0.00 H new ATOM 0 HE2 LYS A 26 20.943 34.457 30.744 1.00 0.00 H new ATOM 0 HE3 LYS A 26 20.817 32.715 30.891 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 22.512 33.341 29.310 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 21.260 32.510 28.519 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 21.381 34.198 28.377 1.00 0.00 H new ATOM 435 N SER A 27 16.656 29.785 26.447 1.00 0.00 N ATOM 436 CA SER A 27 17.016 29.274 25.112 1.00 0.00 C ATOM 437 C SER A 27 15.845 28.522 24.457 1.00 0.00 C ATOM 438 O SER A 27 14.777 28.359 25.047 1.00 0.00 O ATOM 439 CB SER A 27 18.250 28.363 25.227 1.00 0.00 C ATOM 440 OG SER A 27 19.408 29.139 25.431 1.00 0.00 O ATOM 0 H SER A 27 16.241 29.065 27.039 1.00 0.00 H new ATOM 0 HA SER A 27 17.251 30.123 24.471 1.00 0.00 H new ATOM 0 HB2 SER A 27 18.120 27.665 26.054 1.00 0.00 H new ATOM 0 HB3 SER A 27 18.357 27.767 24.321 1.00 0.00 H new ATOM 0 HG SER A 27 20.155 28.554 25.675 1.00 0.00 H new ATOM 446 N THR A 28 16.042 28.017 23.239 1.00 0.00 N ATOM 447 CA THR A 28 15.148 27.071 22.534 1.00 0.00 C ATOM 448 C THR A 28 15.979 25.889 22.030 1.00 0.00 C ATOM 449 O THR A 28 17.170 26.067 21.783 1.00 0.00 O ATOM 450 CB THR A 28 14.440 27.781 21.366 1.00 0.00 C ATOM 451 OG1 THR A 28 13.582 28.773 21.878 1.00 0.00 O ATOM 452 CG2 THR A 28 13.560 26.882 20.496 1.00 0.00 C ATOM 0 H THR A 28 16.863 28.261 22.684 1.00 0.00 H new ATOM 0 HA THR A 28 14.381 26.705 23.217 1.00 0.00 H new ATOM 0 HB THR A 28 15.250 28.166 20.747 1.00 0.00 H new ATOM 0 HG1 THR A 28 13.130 29.229 21.137 1.00 0.00 H new ATOM 0 HG21 THR A 28 13.106 27.475 19.702 1.00 0.00 H new ATOM 0 HG22 THR A 28 14.169 26.093 20.056 1.00 0.00 H new ATOM 0 HG23 THR A 28 12.777 26.437 21.109 1.00 0.00 H new ATOM 460 N LYS A 29 15.381 24.707 21.813 1.00 0.00 N ATOM 461 CA LYS A 29 16.037 23.518 21.221 1.00 0.00 C ATOM 462 C LYS A 29 16.879 23.830 19.970 1.00 0.00 C ATOM 463 O LYS A 29 18.053 23.467 19.918 1.00 0.00 O ATOM 464 CB LYS A 29 14.958 22.482 20.876 1.00 0.00 C ATOM 465 CG LYS A 29 14.474 21.687 22.096 1.00 0.00 C ATOM 466 CD LYS A 29 13.124 20.997 21.847 1.00 0.00 C ATOM 467 CE LYS A 29 13.043 20.253 20.504 1.00 0.00 C ATOM 468 NZ LYS A 29 11.757 19.530 20.386 1.00 0.00 N ATOM 0 H LYS A 29 14.402 24.542 22.049 1.00 0.00 H new ATOM 0 HA LYS A 29 16.735 23.133 21.964 1.00 0.00 H new ATOM 0 HB2 LYS A 29 14.108 22.990 20.420 1.00 0.00 H new ATOM 0 HB3 LYS A 29 15.352 21.790 20.132 1.00 0.00 H new ATOM 0 HG2 LYS A 29 15.220 20.936 22.356 1.00 0.00 H new ATOM 0 HG3 LYS A 29 14.384 22.357 22.951 1.00 0.00 H new ATOM 0 HD2 LYS A 29 12.934 20.290 22.655 1.00 0.00 H new ATOM 0 HD3 LYS A 29 12.332 21.745 21.885 1.00 0.00 H new ATOM 0 HE2 LYS A 29 13.144 20.962 19.682 1.00 0.00 H new ATOM 0 HE3 LYS A 29 13.871 19.549 20.421 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 11.720 19.034 19.473 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 11.675 18.839 21.159 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 10.971 20.208 20.443 1.00 0.00 H new ATOM 482 N LYS A 30 16.359 24.614 19.021 1.00 0.00 N ATOM 483 CA LYS A 30 17.122 25.087 17.849 1.00 0.00 C ATOM 484 C LYS A 30 18.420 25.831 18.217 1.00 0.00 C ATOM 485 O LYS A 30 19.434 25.669 17.549 1.00 0.00 O ATOM 486 CB LYS A 30 16.187 25.950 16.980 1.00 0.00 C ATOM 487 CG LYS A 30 16.663 26.113 15.528 1.00 0.00 C ATOM 488 CD LYS A 30 16.267 24.971 14.574 1.00 0.00 C ATOM 489 CE LYS A 30 16.817 23.579 14.912 1.00 0.00 C ATOM 490 NZ LYS A 30 16.757 22.670 13.743 1.00 0.00 N ATOM 0 H LYS A 30 15.394 24.943 19.039 1.00 0.00 H new ATOM 0 HA LYS A 30 17.460 24.218 17.285 1.00 0.00 H new ATOM 0 HB2 LYS A 30 15.193 25.503 16.978 1.00 0.00 H new ATOM 0 HB3 LYS A 30 16.092 26.936 17.434 1.00 0.00 H new ATOM 0 HG2 LYS A 30 16.264 27.048 15.135 1.00 0.00 H new ATOM 0 HG3 LYS A 30 17.749 26.205 15.527 1.00 0.00 H new ATOM 0 HD2 LYS A 30 15.179 24.911 14.546 1.00 0.00 H new ATOM 0 HD3 LYS A 30 16.598 25.235 13.569 1.00 0.00 H new ATOM 0 HE2 LYS A 30 17.849 23.668 15.252 1.00 0.00 H new ATOM 0 HE3 LYS A 30 16.245 23.151 15.736 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 17.137 21.739 14.008 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 15.769 22.566 13.434 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 17.323 23.066 12.966 1.00 0.00 H new ATOM 504 N ARG A 31 18.416 26.580 19.324 1.00 0.00 N ATOM 505 CA ARG A 31 19.563 27.314 19.899 1.00 0.00 C ATOM 506 C ARG A 31 20.334 26.523 20.974 1.00 0.00 C ATOM 507 O ARG A 31 21.192 27.105 21.636 1.00 0.00 O ATOM 508 CB ARG A 31 19.093 28.699 20.410 1.00 0.00 C ATOM 509 CG ARG A 31 19.102 29.808 19.344 1.00 0.00 C ATOM 510 CD ARG A 31 18.098 29.592 18.207 1.00 0.00 C ATOM 511 NE ARG A 31 18.134 30.721 17.263 1.00 0.00 N ATOM 512 CZ ARG A 31 17.137 31.249 16.581 1.00 0.00 C ATOM 513 NH1 ARG A 31 15.890 30.929 16.746 1.00 0.00 N ATOM 514 NH2 ARG A 31 17.405 32.142 15.682 1.00 0.00 N ATOM 0 H ARG A 31 17.569 26.701 19.879 1.00 0.00 H new ATOM 0 HA ARG A 31 20.289 27.459 19.099 1.00 0.00 H new ATOM 0 HB2 ARG A 31 18.083 28.602 20.807 1.00 0.00 H new ATOM 0 HB3 ARG A 31 19.733 29.003 21.238 1.00 0.00 H new ATOM 0 HG2 ARG A 31 18.889 30.762 19.826 1.00 0.00 H new ATOM 0 HG3 ARG A 31 20.104 29.882 18.921 1.00 0.00 H new ATOM 0 HD2 ARG A 31 18.328 28.665 17.682 1.00 0.00 H new ATOM 0 HD3 ARG A 31 17.094 29.485 18.617 1.00 0.00 H new ATOM 0 HE ARG A 31 19.048 31.150 17.118 1.00 0.00 H new ATOM 0 HH11 ARG A 31 15.631 30.228 17.440 1.00 0.00 H new ATOM 0 HH12 ARG A 31 15.169 31.379 16.182 1.00 0.00 H new ATOM 0 HH21 ARG A 31 18.371 32.423 15.514 1.00 0.00 H new ATOM 0 HH22 ARG A 31 16.650 32.564 15.142 1.00 0.00 H new ATOM 528 N HIS A 32 20.085 25.214 21.151 1.00 0.00 N ATOM 529 CA HIS A 32 20.771 24.386 22.162 1.00 0.00 C ATOM 530 C HIS A 32 22.299 24.508 22.083 1.00 0.00 C ATOM 531 O HIS A 32 22.954 24.479 23.115 1.00 0.00 O ATOM 532 CB HIS A 32 20.383 22.899 22.041 1.00 0.00 C ATOM 533 CG HIS A 32 21.026 22.197 20.865 1.00 0.00 C ATOM 534 ND1 HIS A 32 20.680 22.340 19.543 1.00 0.00 N ATOM 535 CD2 HIS A 32 22.162 21.433 20.900 1.00 0.00 C ATOM 536 CE1 HIS A 32 21.601 21.708 18.795 1.00 0.00 C ATOM 537 NE2 HIS A 32 22.516 21.112 19.583 1.00 0.00 N ATOM 0 H HIS A 32 19.402 24.698 20.597 1.00 0.00 H new ATOM 0 HA HIS A 32 20.441 24.770 23.127 1.00 0.00 H new ATOM 0 HB2 HIS A 32 20.665 22.383 22.959 1.00 0.00 H new ATOM 0 HB3 HIS A 32 19.299 22.821 21.951 1.00 0.00 H new ATOM 0 HD1 HIS A 32 19.864 22.840 19.190 1.00 0.00 H new ATOM 0 HD2 HIS A 32 22.694 21.130 21.790 1.00 0.00 H new ATOM 0 HE1 HIS A 32 21.606 21.682 17.715 1.00 0.00 H new ATOM 545 N THR A 33 22.848 24.710 20.884 1.00 0.00 N ATOM 546 CA THR A 33 24.260 24.960 20.567 1.00 0.00 C ATOM 547 C THR A 33 24.902 25.998 21.496 1.00 0.00 C ATOM 548 O THR A 33 26.006 25.785 21.995 1.00 0.00 O ATOM 549 CB THR A 33 24.359 25.466 19.109 1.00 0.00 C ATOM 550 OG1 THR A 33 23.296 24.960 18.322 1.00 0.00 O ATOM 551 CG2 THR A 33 25.669 25.055 18.445 1.00 0.00 C ATOM 0 H THR A 33 22.274 24.703 20.041 1.00 0.00 H new ATOM 0 HA THR A 33 24.799 24.022 20.703 1.00 0.00 H new ATOM 0 HB THR A 33 24.309 26.553 19.164 1.00 0.00 H new ATOM 0 HG1 THR A 33 23.380 25.295 17.405 1.00 0.00 H new ATOM 0 HG21 THR A 33 25.693 25.433 17.423 1.00 0.00 H new ATOM 0 HG22 THR A 33 26.507 25.470 19.005 1.00 0.00 H new ATOM 0 HG23 THR A 33 25.745 23.968 18.432 1.00 0.00 H new ATOM 559 N ILE A 34 24.186 27.092 21.794 1.00 0.00 N ATOM 560 CA ILE A 34 24.653 28.172 22.678 1.00 0.00 C ATOM 561 C ILE A 34 24.708 27.677 24.129 1.00 0.00 C ATOM 562 O ILE A 34 25.713 27.851 24.817 1.00 0.00 O ATOM 563 CB ILE A 34 23.745 29.426 22.562 1.00 0.00 C ATOM 564 CG1 ILE A 34 23.481 29.826 21.088 1.00 0.00 C ATOM 565 CG2 ILE A 34 24.381 30.593 23.339 1.00 0.00 C ATOM 566 CD1 ILE A 34 22.571 31.048 20.906 1.00 0.00 C ATOM 0 H ILE A 34 23.250 27.255 21.422 1.00 0.00 H new ATOM 0 HA ILE A 34 25.656 28.460 22.365 1.00 0.00 H new ATOM 0 HB ILE A 34 22.776 29.182 22.997 1.00 0.00 H new ATOM 0 HG12 ILE A 34 24.437 30.027 20.604 1.00 0.00 H new ATOM 0 HG13 ILE A 34 23.034 28.977 20.570 1.00 0.00 H new ATOM 0 HG21 ILE A 34 23.744 31.474 23.258 1.00 0.00 H new ATOM 0 HG22 ILE A 34 24.487 30.317 24.388 1.00 0.00 H new ATOM 0 HG23 ILE A 34 25.363 30.816 22.922 1.00 0.00 H new ATOM 0 HD11 ILE A 34 22.444 31.252 19.843 1.00 0.00 H new ATOM 0 HD12 ILE A 34 21.599 30.848 21.356 1.00 0.00 H new ATOM 0 HD13 ILE A 34 23.023 31.914 21.390 1.00 0.00 H new ATOM 578 N THR A 35 23.645 27.010 24.588 1.00 0.00 N ATOM 579 CA THR A 35 23.583 26.467 25.949 1.00 0.00 C ATOM 580 C THR A 35 24.568 25.313 26.146 1.00 0.00 C ATOM 581 O THR A 35 25.168 25.243 27.206 1.00 0.00 O ATOM 582 CB THR A 35 22.156 26.054 26.345 1.00 0.00 C ATOM 583 OG1 THR A 35 21.255 27.123 26.139 1.00 0.00 O ATOM 584 CG2 THR A 35 22.065 25.709 27.832 1.00 0.00 C ATOM 0 H THR A 35 22.809 26.832 24.032 1.00 0.00 H new ATOM 0 HA THR A 35 23.882 27.274 26.618 1.00 0.00 H new ATOM 0 HB THR A 35 21.906 25.190 25.730 1.00 0.00 H new ATOM 0 HG1 THR A 35 20.840 27.370 26.992 1.00 0.00 H new ATOM 0 HG21 THR A 35 21.043 25.422 28.077 1.00 0.00 H new ATOM 0 HG22 THR A 35 22.738 24.881 28.055 1.00 0.00 H new ATOM 0 HG23 THR A 35 22.350 26.578 28.425 1.00 0.00 H new ATOM 592 N VAL A 36 24.823 24.461 25.147 1.00 0.00 N ATOM 593 CA VAL A 36 25.845 23.397 25.201 1.00 0.00 C ATOM 594 C VAL A 36 27.249 23.990 25.324 1.00 0.00 C ATOM 595 O VAL A 36 28.027 23.544 26.167 1.00 0.00 O ATOM 596 CB VAL A 36 25.733 22.449 23.987 1.00 0.00 C ATOM 597 CG1 VAL A 36 26.933 21.500 23.845 1.00 0.00 C ATOM 598 CG2 VAL A 36 24.485 21.567 24.127 1.00 0.00 C ATOM 0 H VAL A 36 24.319 24.488 24.261 1.00 0.00 H new ATOM 0 HA VAL A 36 25.660 22.801 26.095 1.00 0.00 H new ATOM 0 HB VAL A 36 25.688 23.095 23.110 1.00 0.00 H new ATOM 0 HG11 VAL A 36 26.791 20.862 22.973 1.00 0.00 H new ATOM 0 HG12 VAL A 36 27.846 22.083 23.723 1.00 0.00 H new ATOM 0 HG13 VAL A 36 27.015 20.881 24.738 1.00 0.00 H new ATOM 0 HG21 VAL A 36 24.412 20.901 23.267 1.00 0.00 H new ATOM 0 HG22 VAL A 36 24.558 20.975 25.040 1.00 0.00 H new ATOM 0 HG23 VAL A 36 23.597 22.198 24.174 1.00 0.00 H new ATOM 608 N ALA A 37 27.565 25.040 24.560 1.00 0.00 N ATOM 609 CA ALA A 37 28.846 25.734 24.677 1.00 0.00 C ATOM 610 C ALA A 37 29.055 26.355 26.073 1.00 0.00 C ATOM 611 O ALA A 37 30.154 26.273 26.626 1.00 0.00 O ATOM 612 CB ALA A 37 28.930 26.772 23.554 1.00 0.00 C ATOM 0 H ALA A 37 26.944 25.428 23.850 1.00 0.00 H new ATOM 0 HA ALA A 37 29.659 25.016 24.568 1.00 0.00 H new ATOM 0 HB1 ALA A 37 29.879 27.304 23.620 1.00 0.00 H new ATOM 0 HB2 ALA A 37 28.862 26.270 22.589 1.00 0.00 H new ATOM 0 HB3 ALA A 37 28.109 27.482 23.652 1.00 0.00 H new ATOM 618 N LEU A 38 27.992 26.901 26.678 1.00 0.00 N ATOM 619 CA LEU A 38 28.012 27.403 28.054 1.00 0.00 C ATOM 620 C LEU A 38 28.015 26.271 29.103 1.00 0.00 C ATOM 621 O LEU A 38 28.705 26.393 30.106 1.00 0.00 O ATOM 622 CB LEU A 38 26.850 28.399 28.220 1.00 0.00 C ATOM 623 CG LEU A 38 26.723 29.035 29.617 1.00 0.00 C ATOM 624 CD1 LEU A 38 27.974 29.771 30.097 1.00 0.00 C ATOM 625 CD2 LEU A 38 25.569 30.035 29.617 1.00 0.00 C ATOM 0 H LEU A 38 27.087 27.007 26.220 1.00 0.00 H new ATOM 0 HA LEU A 38 28.949 27.928 28.240 1.00 0.00 H new ATOM 0 HB2 LEU A 38 26.968 29.196 27.486 1.00 0.00 H new ATOM 0 HB3 LEU A 38 25.917 27.886 27.986 1.00 0.00 H new ATOM 0 HG LEU A 38 26.556 28.202 30.300 1.00 0.00 H new ATOM 0 HD11 LEU A 38 27.794 30.186 31.088 1.00 0.00 H new ATOM 0 HD12 LEU A 38 28.811 29.074 30.142 1.00 0.00 H new ATOM 0 HD13 LEU A 38 28.210 30.578 29.403 1.00 0.00 H new ATOM 0 HD21 LEU A 38 25.478 30.486 30.605 1.00 0.00 H new ATOM 0 HD22 LEU A 38 25.762 30.814 28.879 1.00 0.00 H new ATOM 0 HD23 LEU A 38 24.641 29.520 29.366 1.00 0.00 H new ATOM 637 N VAL A 39 27.336 25.139 28.882 1.00 0.00 N ATOM 638 CA VAL A 39 27.385 23.935 29.744 1.00 0.00 C ATOM 639 C VAL A 39 28.809 23.398 29.843 1.00 0.00 C ATOM 640 O VAL A 39 29.276 23.085 30.937 1.00 0.00 O ATOM 641 CB VAL A 39 26.439 22.838 29.206 1.00 0.00 C ATOM 642 CG1 VAL A 39 26.701 21.430 29.766 1.00 0.00 C ATOM 643 CG2 VAL A 39 24.981 23.175 29.525 1.00 0.00 C ATOM 0 H VAL A 39 26.718 25.024 28.079 1.00 0.00 H new ATOM 0 HA VAL A 39 27.052 24.223 30.741 1.00 0.00 H new ATOM 0 HB VAL A 39 26.637 22.821 28.134 1.00 0.00 H new ATOM 0 HG11 VAL A 39 25.989 20.728 29.332 1.00 0.00 H new ATOM 0 HG12 VAL A 39 27.716 21.121 29.514 1.00 0.00 H new ATOM 0 HG13 VAL A 39 26.584 21.442 30.850 1.00 0.00 H new ATOM 0 HG21 VAL A 39 24.333 22.389 29.137 1.00 0.00 H new ATOM 0 HG22 VAL A 39 24.853 23.251 30.605 1.00 0.00 H new ATOM 0 HG23 VAL A 39 24.717 24.125 29.061 1.00 0.00 H new ATOM 653 N ASN A 40 29.521 23.342 28.716 1.00 0.00 N ATOM 654 CA ASN A 40 30.920 22.921 28.674 1.00 0.00 C ATOM 655 C ASN A 40 31.827 23.857 29.507 1.00 0.00 C ATOM 656 O ASN A 40 32.757 23.386 30.163 1.00 0.00 O ATOM 657 CB ASN A 40 31.368 22.860 27.201 1.00 0.00 C ATOM 658 CG ASN A 40 30.651 21.821 26.349 1.00 0.00 C ATOM 659 OD1 ASN A 40 30.079 20.839 26.814 1.00 0.00 O ATOM 660 ND2 ASN A 40 30.726 21.953 25.047 1.00 0.00 N ATOM 0 H ASN A 40 29.140 23.589 27.803 1.00 0.00 H new ATOM 0 HA ASN A 40 31.013 21.933 29.124 1.00 0.00 H new ATOM 0 HB2 ASN A 40 31.218 23.842 26.751 1.00 0.00 H new ATOM 0 HB3 ASN A 40 32.438 22.655 27.171 1.00 0.00 H new ATOM 0 HD21 ASN A 40 30.313 21.247 24.438 1.00 0.00 H new ATOM 0 HD22 ASN A 40 31.197 22.762 24.643 1.00 0.00 H new ATOM 667 N GLU A 41 31.530 25.162 29.548 1.00 0.00 N ATOM 668 CA GLU A 41 32.225 26.133 30.409 1.00 0.00 C ATOM 669 C GLU A 41 31.817 26.000 31.886 1.00 0.00 C ATOM 670 O GLU A 41 32.661 25.936 32.773 1.00 0.00 O ATOM 671 CB GLU A 41 31.932 27.555 29.908 1.00 0.00 C ATOM 672 CG GLU A 41 32.842 28.600 30.563 1.00 0.00 C ATOM 673 CD GLU A 41 34.232 28.575 29.924 1.00 0.00 C ATOM 674 OE1 GLU A 41 34.387 29.189 28.843 1.00 0.00 O ATOM 675 OE2 GLU A 41 35.169 27.931 30.450 1.00 0.00 O ATOM 0 H GLU A 41 30.793 25.580 28.979 1.00 0.00 H new ATOM 0 HA GLU A 41 33.294 25.926 30.352 1.00 0.00 H new ATOM 0 HB2 GLU A 41 32.061 27.591 28.826 1.00 0.00 H new ATOM 0 HB3 GLU A 41 30.891 27.803 30.113 1.00 0.00 H new ATOM 0 HG2 GLU A 41 32.403 29.592 30.455 1.00 0.00 H new ATOM 0 HG3 GLU A 41 32.923 28.402 31.632 1.00 0.00 H new ATOM 682 N LEU A 42 30.522 25.892 32.178 1.00 0.00 N ATOM 683 CA LEU A 42 30.000 25.705 33.534 1.00 0.00 C ATOM 684 C LEU A 42 30.586 24.439 34.183 1.00 0.00 C ATOM 685 O LEU A 42 30.987 24.467 35.348 1.00 0.00 O ATOM 686 CB LEU A 42 28.468 25.678 33.454 1.00 0.00 C ATOM 687 CG LEU A 42 27.835 27.049 33.146 1.00 0.00 C ATOM 688 CD1 LEU A 42 26.357 26.890 32.799 1.00 0.00 C ATOM 689 CD2 LEU A 42 27.931 28.010 34.321 1.00 0.00 C ATOM 0 H LEU A 42 29.792 25.933 31.467 1.00 0.00 H new ATOM 0 HA LEU A 42 30.303 26.531 34.178 1.00 0.00 H new ATOM 0 HB2 LEU A 42 28.167 24.968 32.684 1.00 0.00 H new ATOM 0 HB3 LEU A 42 28.071 25.310 34.400 1.00 0.00 H new ATOM 0 HG LEU A 42 28.394 27.458 32.304 1.00 0.00 H new ATOM 0 HD11 LEU A 42 25.926 27.868 32.584 1.00 0.00 H new ATOM 0 HD12 LEU A 42 26.256 26.249 31.923 1.00 0.00 H new ATOM 0 HD13 LEU A 42 25.832 26.439 33.641 1.00 0.00 H new ATOM 0 HD21 LEU A 42 27.471 28.961 34.052 1.00 0.00 H new ATOM 0 HD22 LEU A 42 27.413 27.586 35.181 1.00 0.00 H new ATOM 0 HD23 LEU A 42 28.979 28.173 34.573 1.00 0.00 H new ATOM 701 N ASN A 43 30.738 23.361 33.409 1.00 0.00 N ATOM 702 CA ASN A 43 31.435 22.149 33.831 1.00 0.00 C ATOM 703 C ASN A 43 32.952 22.330 33.988 1.00 0.00 C ATOM 704 O ASN A 43 33.512 21.701 34.877 1.00 0.00 O ATOM 705 CB ASN A 43 31.110 21.010 32.853 1.00 0.00 C ATOM 706 CG ASN A 43 29.729 20.421 33.070 1.00 0.00 C ATOM 707 OD1 ASN A 43 29.188 20.404 34.171 1.00 0.00 O ATOM 708 ND2 ASN A 43 29.147 19.871 32.033 1.00 0.00 N ATOM 0 H ASN A 43 30.374 23.308 32.458 1.00 0.00 H new ATOM 0 HA ASN A 43 31.073 21.899 34.828 1.00 0.00 H new ATOM 0 HB2 ASN A 43 31.184 21.383 31.831 1.00 0.00 H new ATOM 0 HB3 ASN A 43 31.856 20.223 32.960 1.00 0.00 H new ATOM 0 HD21 ASN A 43 28.236 19.424 32.137 1.00 0.00 H new ATOM 0 HD22 ASN A 43 29.605 19.890 31.122 1.00 0.00 H new ATOM 715 N ASN A 44 33.612 23.194 33.208 1.00 0.00 N ATOM 716 CA ASN A 44 35.032 23.537 33.335 1.00 0.00 C ATOM 717 C ASN A 44 35.304 24.204 34.693 1.00 0.00 C ATOM 718 O ASN A 44 36.149 23.719 35.447 1.00 0.00 O ATOM 719 CB ASN A 44 35.438 24.421 32.135 1.00 0.00 C ATOM 720 CG ASN A 44 36.843 24.983 32.204 1.00 0.00 C ATOM 721 OD1 ASN A 44 37.773 24.335 32.659 1.00 0.00 O ATOM 722 ND2 ASN A 44 37.033 26.196 31.745 1.00 0.00 N ATOM 0 H ASN A 44 33.155 23.691 32.444 1.00 0.00 H new ATOM 0 HA ASN A 44 35.648 22.638 33.312 1.00 0.00 H new ATOM 0 HB2 ASN A 44 35.341 23.835 31.221 1.00 0.00 H new ATOM 0 HB3 ASN A 44 34.734 25.250 32.058 1.00 0.00 H new ATOM 0 HD21 ASN A 44 37.966 26.609 31.765 1.00 0.00 H new ATOM 0 HD22 ASN A 44 36.248 26.727 31.367 1.00 0.00 H new ATOM 729 N ILE A 45 34.522 25.232 35.061 1.00 0.00 N ATOM 730 CA ILE A 45 34.636 25.881 36.381 1.00 0.00 C ATOM 731 C ILE A 45 34.312 24.878 37.495 1.00 0.00 C ATOM 732 O ILE A 45 35.095 24.737 38.434 1.00 0.00 O ATOM 733 CB ILE A 45 33.754 27.148 36.530 1.00 0.00 C ATOM 734 CG1 ILE A 45 33.794 28.058 35.283 1.00 0.00 C ATOM 735 CG2 ILE A 45 34.226 27.934 37.770 1.00 0.00 C ATOM 736 CD1 ILE A 45 32.894 29.294 35.383 1.00 0.00 C ATOM 0 H ILE A 45 33.801 25.634 34.462 1.00 0.00 H new ATOM 0 HA ILE A 45 35.670 26.215 36.468 1.00 0.00 H new ATOM 0 HB ILE A 45 32.720 26.824 36.644 1.00 0.00 H new ATOM 0 HG12 ILE A 45 34.821 28.382 35.115 1.00 0.00 H new ATOM 0 HG13 ILE A 45 33.497 27.475 34.411 1.00 0.00 H new ATOM 0 HG21 ILE A 45 33.615 28.829 37.888 1.00 0.00 H new ATOM 0 HG22 ILE A 45 34.128 27.308 38.657 1.00 0.00 H new ATOM 0 HG23 ILE A 45 35.270 28.222 37.643 1.00 0.00 H new ATOM 0 HD11 ILE A 45 32.979 29.881 34.468 1.00 0.00 H new ATOM 0 HD12 ILE A 45 31.859 28.980 35.518 1.00 0.00 H new ATOM 0 HD13 ILE A 45 33.203 29.901 36.234 1.00 0.00 H new ATOM 748 N LYS A 46 33.207 24.123 37.365 1.00 0.00 N ATOM 749 CA LYS A 46 32.812 23.077 38.325 1.00 0.00 C ATOM 750 C LYS A 46 33.938 22.069 38.555 1.00 0.00 C ATOM 751 O LYS A 46 34.249 21.763 39.696 1.00 0.00 O ATOM 752 CB LYS A 46 31.562 22.353 37.806 1.00 0.00 C ATOM 753 CG LYS A 46 30.879 21.468 38.860 1.00 0.00 C ATOM 754 CD LYS A 46 29.777 20.613 38.223 1.00 0.00 C ATOM 755 CE LYS A 46 30.376 19.501 37.351 1.00 0.00 C ATOM 756 NZ LYS A 46 29.351 18.819 36.535 1.00 0.00 N ATOM 0 H LYS A 46 32.558 24.222 36.585 1.00 0.00 H new ATOM 0 HA LYS A 46 32.596 23.556 39.280 1.00 0.00 H new ATOM 0 HB2 LYS A 46 30.847 23.093 37.447 1.00 0.00 H new ATOM 0 HB3 LYS A 46 31.839 21.736 36.951 1.00 0.00 H new ATOM 0 HG2 LYS A 46 31.619 20.822 39.333 1.00 0.00 H new ATOM 0 HG3 LYS A 46 30.453 22.093 39.645 1.00 0.00 H new ATOM 0 HD2 LYS A 46 29.157 20.173 39.004 1.00 0.00 H new ATOM 0 HD3 LYS A 46 29.127 21.244 37.617 1.00 0.00 H new ATOM 0 HE2 LYS A 46 31.137 19.925 36.696 1.00 0.00 H new ATOM 0 HE3 LYS A 46 30.876 18.771 37.988 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 29.659 17.847 36.332 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 28.451 18.796 37.056 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 29.220 19.334 35.641 1.00 0.00 H new ATOM 770 N ASN A 47 34.562 21.578 37.487 1.00 0.00 N ATOM 771 CA ASN A 47 35.658 20.611 37.506 1.00 0.00 C ATOM 772 C ASN A 47 36.938 21.189 38.137 1.00 0.00 C ATOM 773 O ASN A 47 37.534 20.551 39.007 1.00 0.00 O ATOM 774 CB ASN A 47 35.867 20.141 36.055 1.00 0.00 C ATOM 775 CG ASN A 47 37.237 19.566 35.798 1.00 0.00 C ATOM 776 OD1 ASN A 47 37.601 18.501 36.276 1.00 0.00 O ATOM 777 ND2 ASN A 47 38.049 20.303 35.087 1.00 0.00 N ATOM 0 H ASN A 47 34.305 21.856 36.540 1.00 0.00 H new ATOM 0 HA ASN A 47 35.406 19.761 38.140 1.00 0.00 H new ATOM 0 HB2 ASN A 47 35.116 19.389 35.814 1.00 0.00 H new ATOM 0 HB3 ASN A 47 35.703 20.983 35.382 1.00 0.00 H new ATOM 0 HD21 ASN A 47 39.007 19.993 34.922 1.00 0.00 H new ATOM 0 HD22 ASN A 47 37.725 21.188 34.697 1.00 0.00 H new ATOM 784 N GLU A 48 37.349 22.396 37.747 1.00 0.00 N ATOM 785 CA GLU A 48 38.513 23.067 38.333 1.00 0.00 C ATOM 786 C GLU A 48 38.323 23.298 39.838 1.00 0.00 C ATOM 787 O GLU A 48 39.234 23.050 40.631 1.00 0.00 O ATOM 788 CB GLU A 48 38.750 24.386 37.582 1.00 0.00 C ATOM 789 CG GLU A 48 39.882 25.220 38.195 1.00 0.00 C ATOM 790 CD GLU A 48 40.247 26.399 37.289 1.00 0.00 C ATOM 791 OE1 GLU A 48 40.700 26.177 36.150 1.00 0.00 O ATOM 792 OE2 GLU A 48 40.109 27.566 37.720 1.00 0.00 O ATOM 0 H GLU A 48 36.886 22.937 37.017 1.00 0.00 H new ATOM 0 HA GLU A 48 39.393 22.432 38.227 1.00 0.00 H new ATOM 0 HB2 GLU A 48 38.987 24.169 36.540 1.00 0.00 H new ATOM 0 HB3 GLU A 48 37.830 24.971 37.584 1.00 0.00 H new ATOM 0 HG2 GLU A 48 39.577 25.590 39.174 1.00 0.00 H new ATOM 0 HG3 GLU A 48 40.759 24.591 38.351 1.00 0.00 H new ATOM 799 N TYR A 49 37.122 23.716 40.241 1.00 0.00 N ATOM 800 CA TYR A 49 36.821 24.002 41.637 1.00 0.00 C ATOM 801 C TYR A 49 36.579 22.716 42.444 1.00 0.00 C ATOM 802 O TYR A 49 37.087 22.623 43.554 1.00 0.00 O ATOM 803 CB TYR A 49 35.716 25.065 41.743 1.00 0.00 C ATOM 804 CG TYR A 49 36.242 26.487 41.551 1.00 0.00 C ATOM 805 CD1 TYR A 49 36.892 26.876 40.358 1.00 0.00 C ATOM 806 CD2 TYR A 49 36.130 27.418 42.602 1.00 0.00 C ATOM 807 CE1 TYR A 49 37.494 28.146 40.245 1.00 0.00 C ATOM 808 CE2 TYR A 49 36.684 28.707 42.472 1.00 0.00 C ATOM 809 CZ TYR A 49 37.402 29.062 41.312 1.00 0.00 C ATOM 810 OH TYR A 49 38.021 30.271 41.250 1.00 0.00 O ATOM 0 H TYR A 49 36.336 23.864 39.608 1.00 0.00 H new ATOM 0 HA TYR A 49 37.695 24.447 42.113 1.00 0.00 H new ATOM 0 HB2 TYR A 49 34.950 24.862 40.995 1.00 0.00 H new ATOM 0 HB3 TYR A 49 35.237 24.988 42.719 1.00 0.00 H new ATOM 0 HD1 TYR A 49 36.928 26.192 39.523 1.00 0.00 H new ATOM 0 HD2 TYR A 49 35.617 27.143 43.512 1.00 0.00 H new ATOM 0 HE1 TYR A 49 38.024 28.416 39.344 1.00 0.00 H new ATOM 0 HE2 TYR A 49 36.558 29.428 43.266 1.00 0.00 H new ATOM 0 HH TYR A 49 38.828 30.198 40.699 1.00 0.00 H new ATOM 820 N LEU A 50 35.961 21.670 41.880 1.00 0.00 N ATOM 821 CA LEU A 50 35.925 20.313 42.457 1.00 0.00 C ATOM 822 C LEU A 50 37.334 19.832 42.834 1.00 0.00 C ATOM 823 O LEU A 50 37.537 19.333 43.945 1.00 0.00 O ATOM 824 CB LEU A 50 35.306 19.321 41.439 1.00 0.00 C ATOM 825 CG LEU A 50 33.779 19.143 41.527 1.00 0.00 C ATOM 826 CD1 LEU A 50 33.221 18.540 40.235 1.00 0.00 C ATOM 827 CD2 LEU A 50 33.416 18.174 42.654 1.00 0.00 C ATOM 0 H LEU A 50 35.462 21.741 40.993 1.00 0.00 H new ATOM 0 HA LEU A 50 35.315 20.350 43.359 1.00 0.00 H new ATOM 0 HB2 LEU A 50 35.557 19.657 40.433 1.00 0.00 H new ATOM 0 HB3 LEU A 50 35.776 18.347 41.576 1.00 0.00 H new ATOM 0 HG LEU A 50 33.356 20.132 41.705 1.00 0.00 H new ATOM 0 HD11 LEU A 50 32.141 18.425 40.324 1.00 0.00 H new ATOM 0 HD12 LEU A 50 33.448 19.200 39.398 1.00 0.00 H new ATOM 0 HD13 LEU A 50 33.677 17.565 40.062 1.00 0.00 H new ATOM 0 HD21 LEU A 50 32.333 18.060 42.701 1.00 0.00 H new ATOM 0 HD22 LEU A 50 33.875 17.204 42.462 1.00 0.00 H new ATOM 0 HD23 LEU A 50 33.782 18.566 43.603 1.00 0.00 H new ATOM 839 N ASN A 51 38.311 20.018 41.940 1.00 0.00 N ATOM 840 CA ASN A 51 39.692 19.598 42.168 1.00 0.00 C ATOM 841 C ASN A 51 40.393 20.481 43.222 1.00 0.00 C ATOM 842 O ASN A 51 41.060 19.960 44.114 1.00 0.00 O ATOM 843 CB ASN A 51 40.425 19.554 40.817 1.00 0.00 C ATOM 844 CG ASN A 51 41.599 18.592 40.846 1.00 0.00 C ATOM 845 OD1 ASN A 51 41.417 17.385 40.810 1.00 0.00 O ATOM 846 ND2 ASN A 51 42.813 19.086 40.900 1.00 0.00 N ATOM 0 H ASN A 51 38.163 20.466 41.036 1.00 0.00 H new ATOM 0 HA ASN A 51 39.709 18.594 42.593 1.00 0.00 H new ATOM 0 HB2 ASN A 51 39.728 19.254 40.034 1.00 0.00 H new ATOM 0 HB3 ASN A 51 40.779 20.553 40.563 1.00 0.00 H new ATOM 0 HD21 ASN A 51 43.618 18.460 40.912 1.00 0.00 H new ATOM 0 HD22 ASN A 51 42.952 20.096 40.930 1.00 0.00 H new ATOM 853 N LYS A 52 40.162 21.804 43.205 1.00 0.00 N ATOM 854 CA LYS A 52 40.628 22.721 44.263 1.00 0.00 C ATOM 855 C LYS A 52 40.049 22.374 45.631 1.00 0.00 C ATOM 856 O LYS A 52 40.729 22.517 46.637 1.00 0.00 O ATOM 857 CB LYS A 52 40.239 24.168 43.921 1.00 0.00 C ATOM 858 CG LYS A 52 41.206 24.828 42.936 1.00 0.00 C ATOM 859 CD LYS A 52 40.615 26.141 42.403 1.00 0.00 C ATOM 860 CE LYS A 52 41.680 27.097 41.858 1.00 0.00 C ATOM 861 NZ LYS A 52 42.561 26.468 40.851 1.00 0.00 N ATOM 0 H LYS A 52 39.647 22.270 42.458 1.00 0.00 H new ATOM 0 HA LYS A 52 41.712 22.615 44.312 1.00 0.00 H new ATOM 0 HB2 LYS A 52 39.234 24.178 43.498 1.00 0.00 H new ATOM 0 HB3 LYS A 52 40.205 24.756 44.838 1.00 0.00 H new ATOM 0 HG2 LYS A 52 42.159 25.024 43.428 1.00 0.00 H new ATOM 0 HG3 LYS A 52 41.409 24.150 42.107 1.00 0.00 H new ATOM 0 HD2 LYS A 52 39.898 25.916 41.614 1.00 0.00 H new ATOM 0 HD3 LYS A 52 40.064 26.637 43.203 1.00 0.00 H new ATOM 0 HE2 LYS A 52 41.189 27.963 41.413 1.00 0.00 H new ATOM 0 HE3 LYS A 52 42.287 27.465 42.685 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 43.182 27.190 40.433 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 43.141 25.735 41.307 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 41.981 26.036 40.104 1.00 0.00 H new ATOM 875 N ILE A 53 38.798 21.930 45.687 1.00 0.00 N ATOM 876 CA ILE A 53 38.066 21.725 46.938 1.00 0.00 C ATOM 877 C ILE A 53 38.419 20.384 47.601 1.00 0.00 C ATOM 878 O ILE A 53 38.406 20.294 48.824 1.00 0.00 O ATOM 879 CB ILE A 53 36.562 21.955 46.677 1.00 0.00 C ATOM 880 CG1 ILE A 53 36.313 23.460 46.413 1.00 0.00 C ATOM 881 CG2 ILE A 53 35.713 21.503 47.864 1.00 0.00 C ATOM 882 CD1 ILE A 53 34.957 23.771 45.766 1.00 0.00 C ATOM 0 H ILE A 53 38.254 21.699 44.856 1.00 0.00 H new ATOM 0 HA ILE A 53 38.374 22.459 47.683 1.00 0.00 H new ATOM 0 HB ILE A 53 36.273 21.364 45.808 1.00 0.00 H new ATOM 0 HG12 ILE A 53 36.384 23.999 47.358 1.00 0.00 H new ATOM 0 HG13 ILE A 53 37.106 23.840 45.769 1.00 0.00 H new ATOM 0 HG21 ILE A 53 34.660 21.679 47.646 1.00 0.00 H new ATOM 0 HG22 ILE A 53 35.874 20.440 48.042 1.00 0.00 H new ATOM 0 HG23 ILE A 53 35.999 22.067 48.752 1.00 0.00 H new ATOM 0 HD11 ILE A 53 34.864 24.847 45.616 1.00 0.00 H new ATOM 0 HD12 ILE A 53 34.888 23.263 44.804 1.00 0.00 H new ATOM 0 HD13 ILE A 53 34.155 23.425 46.418 1.00 0.00 H new ATOM 894 N VAL A 54 38.819 19.361 46.838 1.00 0.00 N ATOM 895 CA VAL A 54 39.471 18.169 47.423 1.00 0.00 C ATOM 896 C VAL A 54 40.941 18.427 47.788 1.00 0.00 C ATOM 897 O VAL A 54 41.402 17.974 48.838 1.00 0.00 O ATOM 898 CB VAL A 54 39.263 16.911 46.554 1.00 0.00 C ATOM 899 CG1 VAL A 54 39.969 16.958 45.197 1.00 0.00 C ATOM 900 CG2 VAL A 54 39.695 15.641 47.293 1.00 0.00 C ATOM 0 H VAL A 54 38.708 19.327 45.825 1.00 0.00 H new ATOM 0 HA VAL A 54 38.971 17.961 48.369 1.00 0.00 H new ATOM 0 HB VAL A 54 38.191 16.891 46.360 1.00 0.00 H new ATOM 0 HG11 VAL A 54 39.770 16.035 44.651 1.00 0.00 H new ATOM 0 HG12 VAL A 54 39.597 17.806 44.623 1.00 0.00 H new ATOM 0 HG13 VAL A 54 41.043 17.066 45.349 1.00 0.00 H new ATOM 0 HG21 VAL A 54 39.535 14.774 46.652 1.00 0.00 H new ATOM 0 HG22 VAL A 54 40.752 15.711 47.550 1.00 0.00 H new ATOM 0 HG23 VAL A 54 39.106 15.532 48.204 1.00 0.00 H new ATOM 910 N GLU A 55 41.680 19.198 46.982 1.00 0.00 N ATOM 911 CA GLU A 55 43.131 19.365 47.164 1.00 0.00 C ATOM 912 C GLU A 55 43.558 20.603 47.978 1.00 0.00 C ATOM 913 O GLU A 55 44.749 20.779 48.252 1.00 0.00 O ATOM 914 CB GLU A 55 43.845 19.226 45.802 1.00 0.00 C ATOM 915 CG GLU A 55 45.288 18.697 45.881 1.00 0.00 C ATOM 916 CD GLU A 55 45.354 17.310 46.534 1.00 0.00 C ATOM 917 OE1 GLU A 55 45.369 17.245 47.786 1.00 0.00 O ATOM 918 OE2 GLU A 55 45.338 16.291 45.812 1.00 0.00 O ATOM 0 H GLU A 55 41.297 19.719 46.193 1.00 0.00 H new ATOM 0 HA GLU A 55 43.465 18.554 47.811 1.00 0.00 H new ATOM 0 HB2 GLU A 55 43.262 18.557 45.169 1.00 0.00 H new ATOM 0 HB3 GLU A 55 43.856 20.200 45.312 1.00 0.00 H new ATOM 0 HG2 GLU A 55 45.712 18.647 44.878 1.00 0.00 H new ATOM 0 HG3 GLU A 55 45.900 19.396 46.451 1.00 0.00 H new ATOM 925 N SER A 56 42.617 21.440 48.426 1.00 0.00 N ATOM 926 CA SER A 56 42.890 22.590 49.292 1.00 0.00 C ATOM 927 C SER A 56 43.447 22.134 50.636 1.00 0.00 C ATOM 928 O SER A 56 43.044 21.108 51.187 1.00 0.00 O ATOM 929 CB SER A 56 41.636 23.440 49.543 1.00 0.00 C ATOM 930 OG SER A 56 41.943 24.523 50.411 1.00 0.00 O ATOM 0 H SER A 56 41.629 21.336 48.193 1.00 0.00 H new ATOM 0 HA SER A 56 43.625 23.201 48.769 1.00 0.00 H new ATOM 0 HB2 SER A 56 41.250 23.820 48.597 1.00 0.00 H new ATOM 0 HB3 SER A 56 40.852 22.823 49.982 1.00 0.00 H new ATOM 0 HG SER A 56 41.262 25.221 50.316 1.00 0.00 H new ATOM 936 N THR A 57 44.341 22.955 51.177 1.00 0.00 N ATOM 937 CA THR A 57 44.952 22.793 52.497 1.00 0.00 C ATOM 938 C THR A 57 44.556 23.936 53.459 1.00 0.00 C ATOM 939 O THR A 57 45.156 24.121 54.518 1.00 0.00 O ATOM 940 CB THR A 57 46.464 22.595 52.301 1.00 0.00 C ATOM 941 OG1 THR A 57 47.097 22.148 53.475 1.00 0.00 O ATOM 942 CG2 THR A 57 47.166 23.853 51.785 1.00 0.00 C ATOM 0 H THR A 57 44.675 23.787 50.690 1.00 0.00 H new ATOM 0 HA THR A 57 44.570 21.904 52.999 1.00 0.00 H new ATOM 0 HB THR A 57 46.555 21.822 51.538 1.00 0.00 H new ATOM 0 HG1 THR A 57 46.715 22.612 54.249 1.00 0.00 H new ATOM 0 HG21 THR A 57 48.231 23.653 51.666 1.00 0.00 H new ATOM 0 HG22 THR A 57 46.741 24.138 50.823 1.00 0.00 H new ATOM 0 HG23 THR A 57 47.027 24.666 52.498 1.00 0.00 H new ATOM 950 N SER A 58 43.530 24.717 53.090 1.00 0.00 N ATOM 951 CA SER A 58 43.073 25.923 53.796 1.00 0.00 C ATOM 952 C SER A 58 41.542 25.932 53.924 1.00 0.00 C ATOM 953 O SER A 58 40.829 26.064 52.928 1.00 0.00 O ATOM 954 CB SER A 58 43.518 27.177 53.027 1.00 0.00 C ATOM 955 OG SER A 58 44.909 27.199 52.760 1.00 0.00 O ATOM 0 H SER A 58 42.974 24.518 52.259 1.00 0.00 H new ATOM 0 HA SER A 58 43.513 25.921 54.793 1.00 0.00 H new ATOM 0 HB2 SER A 58 42.972 27.231 52.085 1.00 0.00 H new ATOM 0 HB3 SER A 58 43.250 28.063 53.602 1.00 0.00 H new ATOM 0 HG SER A 58 45.135 28.016 52.269 1.00 0.00 H new ATOM 961 N GLU A 59 41.014 25.810 55.147 1.00 0.00 N ATOM 962 CA GLU A 59 39.559 25.762 55.402 1.00 0.00 C ATOM 963 C GLU A 59 38.839 27.105 55.207 1.00 0.00 C ATOM 964 O GLU A 59 37.688 27.130 54.779 1.00 0.00 O ATOM 965 CB GLU A 59 39.270 25.148 56.781 1.00 0.00 C ATOM 966 CG GLU A 59 39.919 25.908 57.948 1.00 0.00 C ATOM 967 CD GLU A 59 39.484 25.357 59.311 1.00 0.00 C ATOM 968 OE1 GLU A 59 39.277 24.127 59.437 1.00 0.00 O ATOM 969 OE2 GLU A 59 39.382 26.169 60.262 1.00 0.00 O ATOM 0 H GLU A 59 41.579 25.741 55.993 1.00 0.00 H new ATOM 0 HA GLU A 59 39.139 25.111 54.635 1.00 0.00 H new ATOM 0 HB2 GLU A 59 38.191 25.117 56.935 1.00 0.00 H new ATOM 0 HB3 GLU A 59 39.623 24.117 56.790 1.00 0.00 H new ATOM 0 HG2 GLU A 59 41.004 25.845 57.862 1.00 0.00 H new ATOM 0 HG3 GLU A 59 39.655 26.964 57.884 1.00 0.00 H new ATOM 976 N SER A 60 39.540 28.220 55.412 1.00 0.00 N ATOM 977 CA SER A 60 39.076 29.563 55.055 1.00 0.00 C ATOM 978 C SER A 60 38.843 29.674 53.543 1.00 0.00 C ATOM 979 O SER A 60 37.726 29.936 53.096 1.00 0.00 O ATOM 980 CB SER A 60 40.111 30.584 55.546 1.00 0.00 C ATOM 981 OG SER A 60 41.425 30.155 55.210 1.00 0.00 O ATOM 0 H SER A 60 40.466 28.216 55.840 1.00 0.00 H new ATOM 0 HA SER A 60 38.119 29.767 55.536 1.00 0.00 H new ATOM 0 HB2 SER A 60 39.913 31.557 55.097 1.00 0.00 H new ATOM 0 HB3 SER A 60 40.026 30.708 56.626 1.00 0.00 H new ATOM 0 HG SER A 60 42.076 30.816 55.527 1.00 0.00 H new ATOM 987 N GLN A 61 39.874 29.372 52.745 1.00 0.00 N ATOM 988 CA GLN A 61 39.812 29.346 51.280 1.00 0.00 C ATOM 989 C GLN A 61 38.710 28.407 50.762 1.00 0.00 C ATOM 990 O GLN A 61 38.046 28.753 49.789 1.00 0.00 O ATOM 991 CB GLN A 61 41.182 28.901 50.740 1.00 0.00 C ATOM 992 CG GLN A 61 41.403 29.085 49.227 1.00 0.00 C ATOM 993 CD GLN A 61 41.701 30.526 48.817 1.00 0.00 C ATOM 994 OE1 GLN A 61 40.946 31.179 48.100 1.00 0.00 O ATOM 995 NE2 GLN A 61 42.826 31.065 49.226 1.00 0.00 N ATOM 0 H GLN A 61 40.796 29.133 53.109 1.00 0.00 H new ATOM 0 HA GLN A 61 39.567 30.348 50.927 1.00 0.00 H new ATOM 0 HB2 GLN A 61 41.957 29.455 51.270 1.00 0.00 H new ATOM 0 HB3 GLN A 61 41.321 27.847 50.982 1.00 0.00 H new ATOM 0 HG2 GLN A 61 42.230 28.449 48.910 1.00 0.00 H new ATOM 0 HG3 GLN A 61 40.515 28.742 48.695 1.00 0.00 H new ATOM 0 HE21 GLN A 61 43.460 30.532 49.821 1.00 0.00 H new ATOM 0 HE22 GLN A 61 43.066 32.017 48.948 1.00 0.00 H new ATOM 1004 N LEU A 62 38.467 27.257 51.409 1.00 0.00 N ATOM 1005 CA LEU A 62 37.396 26.326 51.022 1.00 0.00 C ATOM 1006 C LEU A 62 36.012 26.983 51.000 1.00 0.00 C ATOM 1007 O LEU A 62 35.249 26.734 50.067 1.00 0.00 O ATOM 1008 CB LEU A 62 37.380 25.100 51.953 1.00 0.00 C ATOM 1009 CG LEU A 62 38.443 24.042 51.603 1.00 0.00 C ATOM 1010 CD1 LEU A 62 38.649 23.039 52.737 1.00 0.00 C ATOM 1011 CD2 LEU A 62 38.030 23.325 50.322 1.00 0.00 C ATOM 0 H LEU A 62 39.008 26.946 52.216 1.00 0.00 H new ATOM 0 HA LEU A 62 37.618 26.009 50.003 1.00 0.00 H new ATOM 0 HB2 LEU A 62 37.535 25.432 52.979 1.00 0.00 H new ATOM 0 HB3 LEU A 62 36.394 24.638 51.913 1.00 0.00 H new ATOM 0 HG LEU A 62 39.396 24.549 51.454 1.00 0.00 H new ATOM 0 HD11 LEU A 62 39.407 22.312 52.446 1.00 0.00 H new ATOM 0 HD12 LEU A 62 38.976 23.566 53.634 1.00 0.00 H new ATOM 0 HD13 LEU A 62 37.711 22.523 52.941 1.00 0.00 H new ATOM 0 HD21 LEU A 62 38.778 22.574 50.068 1.00 0.00 H new ATOM 0 HD22 LEU A 62 37.065 22.840 50.471 1.00 0.00 H new ATOM 0 HD23 LEU A 62 37.951 24.048 49.510 1.00 0.00 H new ATOM 1023 N GLN A 63 35.700 27.849 51.969 1.00 0.00 N ATOM 1024 CA GLN A 63 34.426 28.561 51.963 1.00 0.00 C ATOM 1025 C GLN A 63 34.403 29.707 50.939 1.00 0.00 C ATOM 1026 O GLN A 63 33.380 29.922 50.285 1.00 0.00 O ATOM 1027 CB GLN A 63 34.037 29.025 53.375 1.00 0.00 C ATOM 1028 CG GLN A 63 33.861 27.830 54.330 1.00 0.00 C ATOM 1029 CD GLN A 63 32.939 28.124 55.512 1.00 0.00 C ATOM 1030 OE1 GLN A 63 32.846 29.229 56.034 1.00 0.00 O ATOM 1031 NE2 GLN A 63 32.192 27.156 55.983 1.00 0.00 N ATOM 0 H GLN A 63 36.307 28.070 52.758 1.00 0.00 H new ATOM 0 HA GLN A 63 33.662 27.854 51.639 1.00 0.00 H new ATOM 0 HB2 GLN A 63 34.805 29.694 53.764 1.00 0.00 H new ATOM 0 HB3 GLN A 63 33.110 29.596 53.329 1.00 0.00 H new ATOM 0 HG2 GLN A 63 33.462 26.984 53.770 1.00 0.00 H new ATOM 0 HG3 GLN A 63 34.838 27.530 54.708 1.00 0.00 H new ATOM 0 HE21 GLN A 63 32.245 26.224 55.571 1.00 0.00 H new ATOM 0 HE22 GLN A 63 31.557 27.334 56.761 1.00 0.00 H new ATOM 1040 N ILE A 64 35.520 30.410 50.713 1.00 0.00 N ATOM 1041 CA ILE A 64 35.551 31.476 49.702 1.00 0.00 C ATOM 1042 C ILE A 64 35.486 30.916 48.274 1.00 0.00 C ATOM 1043 O ILE A 64 34.859 31.527 47.411 1.00 0.00 O ATOM 1044 CB ILE A 64 36.768 32.402 49.874 1.00 0.00 C ATOM 1045 CG1 ILE A 64 37.054 32.848 51.324 1.00 0.00 C ATOM 1046 CG2 ILE A 64 36.536 33.637 48.987 1.00 0.00 C ATOM 1047 CD1 ILE A 64 35.862 33.411 52.111 1.00 0.00 C ATOM 0 H ILE A 64 36.401 30.264 51.207 1.00 0.00 H new ATOM 0 HA ILE A 64 34.656 32.077 49.862 1.00 0.00 H new ATOM 0 HB ILE A 64 37.649 31.831 49.582 1.00 0.00 H new ATOM 0 HG12 ILE A 64 37.453 31.994 51.872 1.00 0.00 H new ATOM 0 HG13 ILE A 64 37.837 33.606 51.301 1.00 0.00 H new ATOM 0 HG21 ILE A 64 37.381 34.318 49.084 1.00 0.00 H new ATOM 0 HG22 ILE A 64 36.438 33.325 47.947 1.00 0.00 H new ATOM 0 HG23 ILE A 64 35.624 34.144 49.301 1.00 0.00 H new ATOM 0 HD11 ILE A 64 36.187 33.689 53.114 1.00 0.00 H new ATOM 0 HD12 ILE A 64 35.471 34.290 51.599 1.00 0.00 H new ATOM 0 HD13 ILE A 64 35.081 32.654 52.180 1.00 0.00 H new ATOM 1059 N LEU A 65 36.054 29.731 48.023 1.00 0.00 N ATOM 1060 CA LEU A 65 35.976 29.037 46.732 1.00 0.00 C ATOM 1061 C LEU A 65 34.529 28.825 46.260 1.00 0.00 C ATOM 1062 O LEU A 65 34.292 28.835 45.054 1.00 0.00 O ATOM 1063 CB LEU A 65 36.726 27.693 46.814 1.00 0.00 C ATOM 1064 CG LEU A 65 38.254 27.823 46.671 1.00 0.00 C ATOM 1065 CD1 LEU A 65 38.925 26.495 47.035 1.00 0.00 C ATOM 1066 CD2 LEU A 65 38.689 28.180 45.249 1.00 0.00 C ATOM 0 H LEU A 65 36.590 29.218 48.723 1.00 0.00 H new ATOM 0 HA LEU A 65 36.454 29.675 45.989 1.00 0.00 H new ATOM 0 HB2 LEU A 65 36.499 27.219 47.769 1.00 0.00 H new ATOM 0 HB3 LEU A 65 36.353 27.031 46.033 1.00 0.00 H new ATOM 0 HG LEU A 65 38.556 28.627 47.342 1.00 0.00 H new ATOM 0 HD11 LEU A 65 40.006 26.593 46.932 1.00 0.00 H new ATOM 0 HD12 LEU A 65 38.681 26.234 48.065 1.00 0.00 H new ATOM 0 HD13 LEU A 65 38.567 25.711 46.368 1.00 0.00 H new ATOM 0 HD21 LEU A 65 39.775 28.258 45.210 1.00 0.00 H new ATOM 0 HD22 LEU A 65 38.356 27.403 44.561 1.00 0.00 H new ATOM 0 HD23 LEU A 65 38.246 29.134 44.962 1.00 0.00 H new ATOM 1078 N MET A 66 33.556 28.713 47.172 1.00 0.00 N ATOM 1079 CA MET A 66 32.132 28.688 46.814 1.00 0.00 C ATOM 1080 C MET A 66 31.672 30.009 46.182 1.00 0.00 C ATOM 1081 O MET A 66 31.024 30.006 45.136 1.00 0.00 O ATOM 1082 CB MET A 66 31.264 28.395 48.044 1.00 0.00 C ATOM 1083 CG MET A 66 31.652 27.115 48.791 1.00 0.00 C ATOM 1084 SD MET A 66 30.561 26.715 50.183 1.00 0.00 S ATOM 1085 CE MET A 66 30.722 28.221 51.173 1.00 0.00 C ATOM 0 H MET A 66 33.732 28.637 48.174 1.00 0.00 H new ATOM 0 HA MET A 66 32.011 27.892 46.079 1.00 0.00 H new ATOM 0 HB2 MET A 66 31.330 29.238 48.731 1.00 0.00 H new ATOM 0 HB3 MET A 66 30.223 28.319 47.731 1.00 0.00 H new ATOM 0 HG2 MET A 66 31.649 26.281 48.089 1.00 0.00 H new ATOM 0 HG3 MET A 66 32.673 27.217 49.160 1.00 0.00 H new ATOM 0 HE1 MET A 66 30.592 27.979 52.228 1.00 0.00 H new ATOM 0 HE2 MET A 66 31.711 28.654 51.019 1.00 0.00 H new ATOM 0 HE3 MET A 66 29.960 28.939 50.869 1.00 0.00 H new ATOM 1095 N MET A 67 32.032 31.139 46.797 1.00 0.00 N ATOM 1096 CA MET A 67 31.652 32.492 46.359 1.00 0.00 C ATOM 1097 C MET A 67 32.391 32.889 45.075 1.00 0.00 C ATOM 1098 O MET A 67 31.807 33.459 44.154 1.00 0.00 O ATOM 1099 CB MET A 67 31.945 33.519 47.471 1.00 0.00 C ATOM 1100 CG MET A 67 31.525 33.079 48.879 1.00 0.00 C ATOM 1101 SD MET A 67 29.816 32.499 49.053 1.00 0.00 S ATOM 1102 CE MET A 67 29.889 31.997 50.793 1.00 0.00 C ATOM 0 H MET A 67 32.612 31.142 47.636 1.00 0.00 H new ATOM 0 HA MET A 67 30.582 32.485 46.150 1.00 0.00 H new ATOM 0 HB2 MET A 67 33.014 33.733 47.476 1.00 0.00 H new ATOM 0 HB3 MET A 67 31.434 34.451 47.229 1.00 0.00 H new ATOM 0 HG2 MET A 67 32.193 32.281 49.203 1.00 0.00 H new ATOM 0 HG3 MET A 67 31.675 33.917 49.560 1.00 0.00 H new ATOM 0 HE1 MET A 67 28.919 31.605 51.100 1.00 0.00 H new ATOM 0 HE2 MET A 67 30.648 31.225 50.917 1.00 0.00 H new ATOM 0 HE3 MET A 67 30.144 32.859 51.410 1.00 0.00 H new ATOM 1112 N GLU A 68 33.665 32.507 44.979 1.00 0.00 N ATOM 1113 CA GLU A 68 34.470 32.637 43.769 1.00 0.00 C ATOM 1114 C GLU A 68 33.883 31.822 42.617 1.00 0.00 C ATOM 1115 O GLU A 68 33.606 32.401 41.570 1.00 0.00 O ATOM 1116 CB GLU A 68 35.918 32.221 44.063 1.00 0.00 C ATOM 1117 CG GLU A 68 36.728 33.372 44.668 1.00 0.00 C ATOM 1118 CD GLU A 68 37.101 34.389 43.585 1.00 0.00 C ATOM 1119 OE1 GLU A 68 37.842 34.025 42.645 1.00 0.00 O ATOM 1120 OE2 GLU A 68 36.619 35.546 43.638 1.00 0.00 O ATOM 0 H GLU A 68 34.175 32.090 45.758 1.00 0.00 H new ATOM 0 HA GLU A 68 34.461 33.681 43.457 1.00 0.00 H new ATOM 0 HB2 GLU A 68 35.921 31.374 44.749 1.00 0.00 H new ATOM 0 HB3 GLU A 68 36.394 31.886 43.142 1.00 0.00 H new ATOM 0 HG2 GLU A 68 36.148 33.861 45.451 1.00 0.00 H new ATOM 0 HG3 GLU A 68 37.632 32.982 45.137 1.00 0.00 H new ATOM 1127 N SER A 69 33.601 30.524 42.799 1.00 0.00 N ATOM 1128 CA SER A 69 32.993 29.725 41.721 1.00 0.00 C ATOM 1129 C SER A 69 31.619 30.270 41.324 1.00 0.00 C ATOM 1130 O SER A 69 31.333 30.384 40.133 1.00 0.00 O ATOM 1131 CB SER A 69 32.858 28.245 42.087 1.00 0.00 C ATOM 1132 OG SER A 69 33.261 27.429 41.013 1.00 0.00 O ATOM 0 H SER A 69 33.779 30.012 43.663 1.00 0.00 H new ATOM 0 HA SER A 69 33.675 29.806 40.875 1.00 0.00 H new ATOM 0 HB2 SER A 69 33.465 28.025 42.965 1.00 0.00 H new ATOM 0 HB3 SER A 69 31.824 28.023 42.351 1.00 0.00 H new ATOM 0 HG SER A 69 34.187 27.141 41.151 1.00 0.00 H new ATOM 1138 N ARG A 70 30.795 30.701 42.296 1.00 0.00 N ATOM 1139 CA ARG A 70 29.521 31.387 42.048 1.00 0.00 C ATOM 1140 C ARG A 70 29.722 32.616 41.160 1.00 0.00 C ATOM 1141 O ARG A 70 29.061 32.723 40.134 1.00 0.00 O ATOM 1142 CB ARG A 70 28.857 31.775 43.381 1.00 0.00 C ATOM 1143 CG ARG A 70 27.995 30.674 44.015 1.00 0.00 C ATOM 1144 CD ARG A 70 27.448 31.157 45.371 1.00 0.00 C ATOM 1145 NE ARG A 70 26.455 30.227 45.946 1.00 0.00 N ATOM 1146 CZ ARG A 70 25.163 30.178 45.675 1.00 0.00 C ATOM 1147 NH1 ARG A 70 24.565 30.999 44.863 1.00 0.00 N ATOM 1148 NH2 ARG A 70 24.430 29.267 46.232 1.00 0.00 N ATOM 0 H ARG A 70 31.001 30.579 43.288 1.00 0.00 H new ATOM 0 HA ARG A 70 28.859 30.701 41.518 1.00 0.00 H new ATOM 0 HB2 ARG A 70 29.635 32.061 44.089 1.00 0.00 H new ATOM 0 HB3 ARG A 70 28.235 32.655 43.218 1.00 0.00 H new ATOM 0 HG2 ARG A 70 27.170 30.417 43.350 1.00 0.00 H new ATOM 0 HG3 ARG A 70 28.587 29.769 44.153 1.00 0.00 H new ATOM 0 HD2 ARG A 70 28.275 31.277 46.070 1.00 0.00 H new ATOM 0 HD3 ARG A 70 26.991 32.139 45.246 1.00 0.00 H new ATOM 0 HE ARG A 70 26.804 29.550 46.625 1.00 0.00 H new ATOM 0 HH11 ARG A 70 25.098 31.732 44.395 1.00 0.00 H new ATOM 0 HH12 ARG A 70 23.563 30.910 44.694 1.00 0.00 H new ATOM 0 HH21 ARG A 70 24.851 28.595 46.874 1.00 0.00 H new ATOM 0 HH22 ARG A 70 23.431 29.221 46.029 1.00 0.00 H new ATOM 1162 N SER A 71 30.647 33.519 41.495 1.00 0.00 N ATOM 1163 CA SER A 71 30.897 34.724 40.690 1.00 0.00 C ATOM 1164 C SER A 71 31.543 34.435 39.330 1.00 0.00 C ATOM 1165 O SER A 71 31.225 35.133 38.369 1.00 0.00 O ATOM 1166 CB SER A 71 31.765 35.721 41.458 1.00 0.00 C ATOM 1167 OG SER A 71 31.835 36.939 40.731 1.00 0.00 O ATOM 0 H SER A 71 31.239 33.440 42.322 1.00 0.00 H new ATOM 0 HA SER A 71 29.913 35.151 40.495 1.00 0.00 H new ATOM 0 HB2 SER A 71 31.346 35.899 42.448 1.00 0.00 H new ATOM 0 HB3 SER A 71 32.765 35.313 41.604 1.00 0.00 H new ATOM 0 HG SER A 71 32.390 37.581 41.221 1.00 0.00 H new ATOM 1173 N LYS A 72 32.417 33.426 39.223 1.00 0.00 N ATOM 1174 CA LYS A 72 33.033 32.990 37.957 1.00 0.00 C ATOM 1175 C LYS A 72 31.973 32.413 37.003 1.00 0.00 C ATOM 1176 O LYS A 72 31.985 32.723 35.815 1.00 0.00 O ATOM 1177 CB LYS A 72 34.139 31.956 38.253 1.00 0.00 C ATOM 1178 CG LYS A 72 35.356 32.455 39.065 1.00 0.00 C ATOM 1179 CD LYS A 72 36.542 32.867 38.186 1.00 0.00 C ATOM 1180 CE LYS A 72 37.880 32.859 38.942 1.00 0.00 C ATOM 1181 NZ LYS A 72 38.063 33.969 39.906 1.00 0.00 N ATOM 0 H LYS A 72 32.723 32.878 40.027 1.00 0.00 H new ATOM 0 HA LYS A 72 33.481 33.851 37.462 1.00 0.00 H new ATOM 0 HB2 LYS A 72 33.690 31.122 38.791 1.00 0.00 H new ATOM 0 HB3 LYS A 72 34.501 31.564 37.303 1.00 0.00 H new ATOM 0 HG2 LYS A 72 35.053 33.305 39.676 1.00 0.00 H new ATOM 0 HG3 LYS A 72 35.675 31.669 39.749 1.00 0.00 H new ATOM 0 HD2 LYS A 72 36.608 32.190 37.334 1.00 0.00 H new ATOM 0 HD3 LYS A 72 36.362 33.865 37.787 1.00 0.00 H new ATOM 0 HE2 LYS A 72 37.971 31.914 39.478 1.00 0.00 H new ATOM 0 HE3 LYS A 72 38.691 32.893 38.214 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 39.033 34.336 39.833 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 37.388 34.730 39.691 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 37.896 33.621 40.872 1.00 0.00 H new ATOM 1195 N VAL A 73 31.025 31.633 37.535 1.00 0.00 N ATOM 1196 CA VAL A 73 29.841 31.118 36.822 1.00 0.00 C ATOM 1197 C VAL A 73 28.911 32.248 36.385 1.00 0.00 C ATOM 1198 O VAL A 73 28.489 32.278 35.233 1.00 0.00 O ATOM 1199 CB VAL A 73 29.080 30.114 37.715 1.00 0.00 C ATOM 1200 CG1 VAL A 73 27.639 29.849 37.266 1.00 0.00 C ATOM 1201 CG2 VAL A 73 29.823 28.776 37.766 1.00 0.00 C ATOM 0 H VAL A 73 31.059 31.330 38.508 1.00 0.00 H new ATOM 0 HA VAL A 73 30.188 30.609 35.923 1.00 0.00 H new ATOM 0 HB VAL A 73 29.036 30.580 38.699 1.00 0.00 H new ATOM 0 HG11 VAL A 73 27.172 29.134 37.944 1.00 0.00 H new ATOM 0 HG12 VAL A 73 27.076 30.782 37.280 1.00 0.00 H new ATOM 0 HG13 VAL A 73 27.642 29.442 36.255 1.00 0.00 H new ATOM 0 HG21 VAL A 73 29.274 28.079 38.399 1.00 0.00 H new ATOM 0 HG22 VAL A 73 29.903 28.366 36.759 1.00 0.00 H new ATOM 0 HG23 VAL A 73 30.821 28.930 38.176 1.00 0.00 H new ATOM 1211 N ASP A 74 28.602 33.182 37.284 1.00 0.00 N ATOM 1212 CA ASP A 74 27.699 34.303 37.003 1.00 0.00 C ATOM 1213 C ASP A 74 28.248 35.199 35.876 1.00 0.00 C ATOM 1214 O ASP A 74 27.530 35.554 34.937 1.00 0.00 O ATOM 1215 CB ASP A 74 27.484 35.078 38.311 1.00 0.00 C ATOM 1216 CG ASP A 74 26.107 35.721 38.365 1.00 0.00 C ATOM 1217 OD1 ASP A 74 25.189 35.034 38.869 1.00 0.00 O ATOM 1218 OD2 ASP A 74 25.994 36.891 37.930 1.00 0.00 O ATOM 0 H ASP A 74 28.972 33.184 38.234 1.00 0.00 H new ATOM 0 HA ASP A 74 26.739 33.932 36.643 1.00 0.00 H new ATOM 0 HB2 ASP A 74 27.603 34.402 39.158 1.00 0.00 H new ATOM 0 HB3 ASP A 74 28.249 35.848 38.407 1.00 0.00 H new ATOM 1223 N GLU A 75 29.561 35.457 35.893 1.00 0.00 N ATOM 1224 CA GLU A 75 30.242 36.153 34.804 1.00 0.00 C ATOM 1225 C GLU A 75 30.234 35.330 33.506 1.00 0.00 C ATOM 1226 O GLU A 75 30.005 35.896 32.442 1.00 0.00 O ATOM 1227 CB GLU A 75 31.684 36.488 35.212 1.00 0.00 C ATOM 1228 CG GLU A 75 32.319 37.524 34.269 1.00 0.00 C ATOM 1229 CD GLU A 75 33.805 37.236 34.066 1.00 0.00 C ATOM 1230 OE1 GLU A 75 34.638 37.751 34.843 1.00 0.00 O ATOM 1231 OE2 GLU A 75 34.156 36.481 33.128 1.00 0.00 O ATOM 0 H GLU A 75 30.176 35.189 36.661 1.00 0.00 H new ATOM 0 HA GLU A 75 29.698 37.077 34.610 1.00 0.00 H new ATOM 0 HB2 GLU A 75 31.693 36.872 36.232 1.00 0.00 H new ATOM 0 HB3 GLU A 75 32.283 35.578 35.208 1.00 0.00 H new ATOM 0 HG2 GLU A 75 31.807 37.509 33.307 1.00 0.00 H new ATOM 0 HG3 GLU A 75 32.191 38.525 34.682 1.00 0.00 H new ATOM 1238 N ALA A 76 30.424 34.004 33.563 1.00 0.00 N ATOM 1239 CA ALA A 76 30.381 33.149 32.375 1.00 0.00 C ATOM 1240 C ALA A 76 28.997 33.167 31.701 1.00 0.00 C ATOM 1241 O ALA A 76 28.922 33.207 30.474 1.00 0.00 O ATOM 1242 CB ALA A 76 30.820 31.728 32.751 1.00 0.00 C ATOM 0 H ALA A 76 30.610 33.500 34.430 1.00 0.00 H new ATOM 0 HA ALA A 76 31.078 33.544 31.636 1.00 0.00 H new ATOM 0 HB1 ALA A 76 30.788 31.091 31.867 1.00 0.00 H new ATOM 0 HB2 ALA A 76 31.837 31.753 33.144 1.00 0.00 H new ATOM 0 HB3 ALA A 76 30.148 31.328 33.510 1.00 0.00 H new ATOM 1248 N VAL A 77 27.907 33.233 32.475 1.00 0.00 N ATOM 1249 CA VAL A 77 26.555 33.476 31.939 1.00 0.00 C ATOM 1250 C VAL A 77 26.498 34.833 31.240 1.00 0.00 C ATOM 1251 O VAL A 77 26.098 34.902 30.080 1.00 0.00 O ATOM 1252 CB VAL A 77 25.482 33.398 33.043 1.00 0.00 C ATOM 1253 CG1 VAL A 77 24.074 33.738 32.532 1.00 0.00 C ATOM 1254 CG2 VAL A 77 25.404 31.994 33.638 1.00 0.00 C ATOM 0 H VAL A 77 27.933 33.120 33.488 1.00 0.00 H new ATOM 0 HA VAL A 77 26.341 32.691 31.214 1.00 0.00 H new ATOM 0 HB VAL A 77 25.789 34.131 33.789 1.00 0.00 H new ATOM 0 HG11 VAL A 77 23.362 33.666 33.354 1.00 0.00 H new ATOM 0 HG12 VAL A 77 24.067 34.752 32.133 1.00 0.00 H new ATOM 0 HG13 VAL A 77 23.793 33.037 31.746 1.00 0.00 H new ATOM 0 HG21 VAL A 77 24.639 31.970 34.414 1.00 0.00 H new ATOM 0 HG22 VAL A 77 25.149 31.280 32.854 1.00 0.00 H new ATOM 0 HG23 VAL A 77 26.368 31.728 34.071 1.00 0.00 H new ATOM 1264 N SER A 78 26.940 35.903 31.906 1.00 0.00 N ATOM 1265 CA SER A 78 26.934 37.266 31.351 1.00 0.00 C ATOM 1266 C SER A 78 27.779 37.395 30.070 1.00 0.00 C ATOM 1267 O SER A 78 27.381 38.060 29.112 1.00 0.00 O ATOM 1268 CB SER A 78 27.451 38.228 32.425 1.00 0.00 C ATOM 1269 OG SER A 78 27.047 39.545 32.123 1.00 0.00 O ATOM 0 H SER A 78 27.316 35.851 32.853 1.00 0.00 H new ATOM 0 HA SER A 78 25.911 37.512 31.068 1.00 0.00 H new ATOM 0 HB2 SER A 78 27.068 37.936 33.403 1.00 0.00 H new ATOM 0 HB3 SER A 78 28.538 38.175 32.480 1.00 0.00 H new ATOM 0 HG SER A 78 27.379 40.156 32.814 1.00 0.00 H new ATOM 1275 N LYS A 79 28.901 36.666 29.996 1.00 0.00 N ATOM 1276 CA LYS A 79 29.800 36.556 28.832 1.00 0.00 C ATOM 1277 C LYS A 79 29.155 35.850 27.629 1.00 0.00 C ATOM 1278 O LYS A 79 29.656 36.000 26.516 1.00 0.00 O ATOM 1279 CB LYS A 79 31.107 35.881 29.316 1.00 0.00 C ATOM 1280 CG LYS A 79 32.326 36.078 28.398 1.00 0.00 C ATOM 1281 CD LYS A 79 33.650 35.636 29.059 1.00 0.00 C ATOM 1282 CE LYS A 79 33.862 34.114 29.038 1.00 0.00 C ATOM 1283 NZ LYS A 79 35.012 33.694 29.880 1.00 0.00 N ATOM 0 H LYS A 79 29.225 36.107 30.785 1.00 0.00 H new ATOM 0 HA LYS A 79 30.024 37.550 28.446 1.00 0.00 H new ATOM 0 HB2 LYS A 79 31.351 36.267 30.305 1.00 0.00 H new ATOM 0 HB3 LYS A 79 30.925 34.812 29.427 1.00 0.00 H new ATOM 0 HG2 LYS A 79 32.178 35.512 27.478 1.00 0.00 H new ATOM 0 HG3 LYS A 79 32.398 37.129 28.118 1.00 0.00 H new ATOM 0 HD2 LYS A 79 34.482 36.119 28.547 1.00 0.00 H new ATOM 0 HD3 LYS A 79 33.666 35.984 30.092 1.00 0.00 H new ATOM 0 HE2 LYS A 79 32.957 33.618 29.389 1.00 0.00 H new ATOM 0 HE3 LYS A 79 34.027 33.786 28.012 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 35.116 32.660 29.835 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 35.881 34.145 29.530 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 34.845 33.982 30.865 1.00 0.00 H new ATOM 1297 N PHE A 80 28.030 35.157 27.833 1.00 0.00 N ATOM 1298 CA PHE A 80 27.152 34.585 26.800 1.00 0.00 C ATOM 1299 C PHE A 80 25.831 35.364 26.598 1.00 0.00 C ATOM 1300 O PHE A 80 25.134 35.134 25.608 1.00 0.00 O ATOM 1301 CB PHE A 80 26.878 33.109 27.140 1.00 0.00 C ATOM 1302 CG PHE A 80 27.934 32.125 26.661 1.00 0.00 C ATOM 1303 CD1 PHE A 80 29.178 32.025 27.312 1.00 0.00 C ATOM 1304 CD2 PHE A 80 27.655 31.275 25.573 1.00 0.00 C ATOM 1305 CE1 PHE A 80 30.120 31.063 26.905 1.00 0.00 C ATOM 1306 CE2 PHE A 80 28.599 30.319 25.158 1.00 0.00 C ATOM 1307 CZ PHE A 80 29.829 30.206 25.829 1.00 0.00 C ATOM 0 H PHE A 80 27.686 34.968 28.775 1.00 0.00 H new ATOM 0 HA PHE A 80 27.675 34.665 25.847 1.00 0.00 H new ATOM 0 HB2 PHE A 80 26.781 33.014 28.222 1.00 0.00 H new ATOM 0 HB3 PHE A 80 25.918 32.826 26.708 1.00 0.00 H new ATOM 0 HD1 PHE A 80 29.411 32.691 28.129 1.00 0.00 H new ATOM 0 HD2 PHE A 80 26.711 31.358 25.055 1.00 0.00 H new ATOM 0 HE1 PHE A 80 31.067 30.983 27.419 1.00 0.00 H new ATOM 0 HE2 PHE A 80 28.379 29.671 24.323 1.00 0.00 H new ATOM 0 HZ PHE A 80 30.549 29.463 25.519 1.00 0.00 H new ATOM 1317 N GLU A 81 25.448 36.292 27.489 1.00 0.00 N ATOM 1318 CA GLU A 81 24.199 37.068 27.348 1.00 0.00 C ATOM 1319 C GLU A 81 24.251 38.146 26.257 1.00 0.00 C ATOM 1320 O GLU A 81 23.188 38.596 25.810 1.00 0.00 O ATOM 1321 CB GLU A 81 23.771 37.731 28.672 1.00 0.00 C ATOM 1322 CG GLU A 81 23.164 36.736 29.668 1.00 0.00 C ATOM 1323 CD GLU A 81 22.380 37.403 30.806 1.00 0.00 C ATOM 1324 OE1 GLU A 81 22.488 38.638 31.021 1.00 0.00 O ATOM 1325 OE2 GLU A 81 21.677 36.663 31.533 1.00 0.00 O ATOM 0 H GLU A 81 25.988 36.527 28.322 1.00 0.00 H new ATOM 0 HA GLU A 81 23.461 36.323 27.049 1.00 0.00 H new ATOM 0 HB2 GLU A 81 24.636 38.212 29.128 1.00 0.00 H new ATOM 0 HB3 GLU A 81 23.044 38.516 28.461 1.00 0.00 H new ATOM 0 HG2 GLU A 81 22.501 36.057 29.131 1.00 0.00 H new ATOM 0 HG3 GLU A 81 23.963 36.130 30.095 1.00 0.00 H new ATOM 1332 N LYS A 82 25.445 38.568 25.829 1.00 0.00 N ATOM 1333 CA LYS A 82 25.668 39.634 24.850 1.00 0.00 C ATOM 1334 C LYS A 82 26.828 39.355 23.901 1.00 0.00 C ATOM 1335 O LYS A 82 26.835 39.964 22.813 1.00 0.00 O ATOM 1336 CB LYS A 82 25.793 40.979 25.593 1.00 0.00 C ATOM 1337 CG LYS A 82 26.583 41.028 26.913 1.00 0.00 C ATOM 1338 CD LYS A 82 28.041 40.568 26.790 1.00 0.00 C ATOM 1339 CE LYS A 82 28.818 40.847 28.079 1.00 0.00 C ATOM 1340 NZ LYS A 82 29.012 42.299 28.310 1.00 0.00 N ATOM 0 H LYS A 82 26.316 38.160 26.169 1.00 0.00 H new ATOM 0 HA LYS A 82 24.803 39.682 24.188 1.00 0.00 H new ATOM 0 HB2 LYS A 82 26.251 41.693 24.908 1.00 0.00 H new ATOM 0 HB3 LYS A 82 24.784 41.337 25.799 1.00 0.00 H new ATOM 0 HG2 LYS A 82 26.567 42.049 27.296 1.00 0.00 H new ATOM 0 HG3 LYS A 82 26.077 40.403 27.649 1.00 0.00 H new ATOM 0 HD2 LYS A 82 28.071 39.501 26.567 1.00 0.00 H new ATOM 0 HD3 LYS A 82 28.518 41.082 25.956 1.00 0.00 H new ATOM 0 HE2 LYS A 82 28.284 40.414 28.925 1.00 0.00 H new ATOM 0 HE3 LYS A 82 29.789 40.355 28.030 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 29.744 42.440 29.035 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 29.310 42.755 27.424 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 28.118 42.722 28.633 1.00 0.00 H new