USER MOD reduce.3.24.130724 H: found=0, std=0, add=1267, rem=0, adj=55 USER MOD reduce.3.24.130724 removed 1268 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 66 MET CE :methyl -109:sc= -3.52 (180deg=-8.49!) USER MOD Set 1.2: B 67 THR OG1 : rot 180:sc= -0.14 USER MOD Set 2.1: B 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.2: B 61 TYR OH : rot 15:sc= -0.0252 USER MOD Set 3.1: B 51 ASN :FLIP amide:sc= 0 X(o=-1.4,f=-1.2) USER MOD Set 3.2: B 54 GLN :FLIP amide:sc= -1.17 F(o=-1.8,f=-1.2) USER MOD Set 4.1: A 66 MET CE :methyl -119:sc= -5.13 (180deg=-10.1!) USER MOD Set 4.2: A 67 THR OG1 : rot 180:sc= -0.762 USER MOD Set 5.1: A 62 THR OG1 : rot -66:sc= 0.926 USER MOD Set 5.2: A 76 GLN : amide:sc= -0.587 K(o=0.34,f=-2.2!) USER MOD Set 6.1: A 51 ASN : amide:sc= -0.55 K(o=-2.1,f=-8.7!) USER MOD Set 6.2: A 54 GLN :FLIP amide:sc= -1.6 F(o=-3.1,f=-2.1) USER MOD Set 7.1: A 15 SER OG : rot -81:sc= 0.65 USER MOD Set 7.2: A 61 TYR OH : rot 180:sc= -0.41 USER MOD Set 8.1: A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 8.2: B 50 MET CE :methyl -130:sc= -1.86! (180deg=-2.19!) USER MOD Single : A 4 THR OG1 : rot 22:sc= 0.744 USER MOD Single : A 6 SER OG : rot 111:sc= 1.04 USER MOD Single : A 12 MET CE :methyl -156:sc= -0.613 (180deg=-1.9!) USER MOD Single : A 14 LYS NZ :NH3+ -170:sc= 0 (180deg=-0.0847) USER MOD Single : A 17 TYR OH : rot 180:sc= 0 USER MOD Single : A 19 SER OG : rot 180:sc= 0 USER MOD Single : A 21 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 22 GLN : amide:sc= -0.337 X(o=-0.34,f=-0.34) USER MOD Single : A 27 THR OG1 : rot 4:sc= 0.699! USER MOD Single : A 31 TYR OH : rot 180:sc= 0 USER MOD Single : A 33 THR OG1 : rot 180:sc= 0 USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 36 TYR OH : rot 180:sc= 0 USER MOD Single : A 37 TYR OH : rot 130:sc= 0 USER MOD Single : A 39 SER OG : rot 2:sc= 0.83! USER MOD Single : A 42 SER OG : rot 180:sc= 0 USER MOD Single : A 43 THR OG1 : rot 180:sc= 0.0633 USER MOD Single : A 46 THR OG1 : rot -160:sc= 0 USER MOD Single : A 49 MET CE :methyl 147:sc= -3.61 (180deg=-6.97!) USER MOD Single : A 50 MET CE :methyl -164:sc= -0.353 (180deg=-0.996) USER MOD Single : A 55 THR OG1 : rot -99:sc= -0.266 USER MOD Single : A 57 GLN : amide:sc= -3.49 K(o=-3.5,f=-5.2!) USER MOD Single : A 59 THR OG1 : rot 180:sc= 0 USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 ASN : amide:sc= -0.0143 X(o=-0.014,f=-0.014) USER MOD Single : A 69 GLN : amide:sc= 0 X(o=0,f=-0.015) USER MOD Single : A 74 SER OG : rot -130:sc= -0.164 USER MOD Single : A 83 HIS : no HD1:sc= 0 X(o=0,f=-0.12) USER MOD Single : B 4 THR OG1 : rot 20:sc= 0.61 USER MOD Single : B 6 SER OG : rot 98:sc= 0.975 USER MOD Single : B 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 12 MET CE :methyl 166:sc= -4.98! (180deg=-5.11!) USER MOD Single : B 14 LYS NZ :NH3+ -115:sc= 0.329 (180deg=-0.0103) USER MOD Single : B 15 SER OG : rot -130:sc= -0.36 USER MOD Single : B 17 TYR OH : rot 180:sc= 0 USER MOD Single : B 19 SER OG : rot 180:sc= 0 USER MOD Single : B 21 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 22 GLN : amide:sc= -0.0323 K(o=-0.032,f=-1.4) USER MOD Single : B 27 THR OG1 : rot -63:sc= 0.0337 USER MOD Single : B 31 TYR OH : rot 180:sc= 0 USER MOD Single : B 33 THR OG1 : rot 180:sc= 0 USER MOD Single : B 35 SER OG : rot 180:sc= 0 USER MOD Single : B 36 TYR OH : rot 180:sc= 0 USER MOD Single : B 37 TYR OH : rot 180:sc= 0 USER MOD Single : B 39 SER OG : rot 115:sc= 0.972 USER MOD Single : B 42 SER OG : rot 180:sc= 0 USER MOD Single : B 43 THR OG1 : rot 180:sc= 0.119 USER MOD Single : B 46 THR OG1 : rot 59:sc= 0.518 USER MOD Single : B 49 MET CE :methyl -142:sc= -2.65! (180deg=-4.77!) USER MOD Single : B 55 THR OG1 : rot -91:sc= 0.971 USER MOD Single : B 57 GLN : amide:sc= -0.833 K(o=-0.83,f=-2) USER MOD Single : B 59 THR OG1 : rot 5:sc= 0.26 USER MOD Single : B 62 THR OG1 : rot -75:sc= 0.645 USER MOD Single : B 68 ASN : amide:sc= -0.0615 X(o=-0.061,f=-0.061) USER MOD Single : B 69 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 74 SER OG : rot -120:sc= -0.312 USER MOD Single : B 76 GLN : amide:sc= -1.78 K(o=-1.8,f=-5.1!) USER MOD ----------------------------------------------------------------- ATOM 43 N THR A 4 5.220 5.809 -7.162 1.00 55.11 N ATOM 44 CA THR A 4 6.207 6.731 -7.709 1.00 61.02 C ATOM 45 C THR A 4 5.726 8.174 -7.607 1.00 34.12 C ATOM 46 O THR A 4 4.538 8.429 -7.410 1.00 24.32 O ATOM 47 CB THR A 4 6.522 6.409 -9.182 1.00 65.03 C ATOM 48 OG1 THR A 4 6.003 5.119 -9.524 1.00 41.45 O ATOM 49 CG2 THR A 4 8.022 6.440 -9.434 1.00 24.23 C ATOM 0 HA THR A 4 7.114 6.610 -7.117 1.00 61.02 H new ATOM 0 HB THR A 4 6.049 7.168 -9.805 1.00 65.03 H new ATOM 0 HG1 THR A 4 5.282 4.882 -8.904 1.00 41.45 H new ATOM 0 HG21 THR A 4 8.220 6.210 -10.481 1.00 24.23 H new ATOM 0 HG22 THR A 4 8.410 7.432 -9.201 1.00 24.23 H new ATOM 0 HG23 THR A 4 8.513 5.701 -8.801 1.00 24.23 H new ATOM 57 N ILE A 5 6.655 9.114 -7.746 1.00 21.33 N ATOM 58 CA ILE A 5 6.324 10.531 -7.671 1.00 1.35 C ATOM 59 C ILE A 5 5.180 10.879 -8.617 1.00 62.20 C ATOM 60 O ILE A 5 4.227 11.555 -8.231 1.00 53.40 O ATOM 61 CB ILE A 5 7.542 11.412 -8.011 1.00 73.54 C ATOM 62 CG1 ILE A 5 8.725 11.053 -7.109 1.00 25.20 C ATOM 63 CG2 ILE A 5 7.187 12.884 -7.867 1.00 34.15 C ATOM 64 CD1 ILE A 5 10.009 10.801 -7.869 1.00 64.05 C ATOM 0 H ILE A 5 7.643 8.919 -7.911 1.00 21.33 H new ATOM 0 HA ILE A 5 6.017 10.730 -6.644 1.00 1.35 H new ATOM 0 HB ILE A 5 7.829 11.227 -9.046 1.00 73.54 H new ATOM 0 HG12 ILE A 5 8.887 11.862 -6.396 1.00 25.20 H new ATOM 0 HG13 ILE A 5 8.474 10.164 -6.531 1.00 25.20 H new ATOM 0 HG21 ILE A 5 8.057 13.494 -8.110 1.00 34.15 H new ATOM 0 HG22 ILE A 5 6.371 13.129 -8.546 1.00 34.15 H new ATOM 0 HG23 ILE A 5 6.879 13.085 -6.841 1.00 34.15 H new ATOM 0 HD11 ILE A 5 10.805 10.552 -7.167 1.00 64.05 H new ATOM 0 HD12 ILE A 5 9.865 9.973 -8.563 1.00 64.05 H new ATOM 0 HD13 ILE A 5 10.284 11.697 -8.426 1.00 64.05 H new ATOM 76 N SER A 6 5.282 10.410 -9.857 1.00 63.44 N ATOM 77 CA SER A 6 4.255 10.673 -10.859 1.00 34.41 C ATOM 78 C SER A 6 2.872 10.313 -10.328 1.00 2.22 C ATOM 79 O SER A 6 1.911 11.059 -10.511 1.00 53.23 O ATOM 80 CB SER A 6 4.546 9.884 -12.137 1.00 71.40 C ATOM 81 OG SER A 6 3.768 8.700 -12.192 1.00 42.32 O ATOM 0 H SER A 6 6.064 9.847 -10.191 1.00 63.44 H new ATOM 0 HA SER A 6 4.270 11.739 -11.087 1.00 34.41 H new ATOM 0 HB2 SER A 6 4.333 10.504 -13.008 1.00 71.40 H new ATOM 0 HB3 SER A 6 5.605 9.630 -12.178 1.00 71.40 H new ATOM 0 HG SER A 6 3.100 8.781 -12.904 1.00 42.32 H new ATOM 87 N GLU A 7 2.779 9.162 -9.668 1.00 61.11 N ATOM 88 CA GLU A 7 1.512 8.701 -9.111 1.00 23.42 C ATOM 89 C GLU A 7 0.978 9.693 -8.082 1.00 40.04 C ATOM 90 O GLU A 7 -0.232 9.884 -7.958 1.00 33.31 O ATOM 91 CB GLU A 7 1.685 7.324 -8.466 1.00 72.32 C ATOM 92 CG GLU A 7 1.989 6.219 -9.464 1.00 53.22 C ATOM 93 CD GLU A 7 0.976 6.154 -10.590 1.00 62.25 C ATOM 94 OE1 GLU A 7 -0.150 5.672 -10.348 1.00 43.33 O ATOM 95 OE2 GLU A 7 1.310 6.586 -11.714 1.00 50.32 O ATOM 0 H GLU A 7 3.565 8.532 -9.506 1.00 61.11 H new ATOM 0 HA GLU A 7 0.792 8.625 -9.925 1.00 23.42 H new ATOM 0 HB2 GLU A 7 2.491 7.373 -7.734 1.00 72.32 H new ATOM 0 HB3 GLU A 7 0.776 7.070 -7.921 1.00 72.32 H new ATOM 0 HG2 GLU A 7 2.983 6.377 -9.883 1.00 53.22 H new ATOM 0 HG3 GLU A 7 2.011 5.261 -8.944 1.00 53.22 H new ATOM 102 N LYS A 8 1.889 10.322 -7.347 1.00 33.13 N ATOM 103 CA LYS A 8 1.511 11.295 -6.329 1.00 4.14 C ATOM 104 C LYS A 8 0.953 12.563 -6.969 1.00 74.14 C ATOM 105 O LYS A 8 0.396 13.420 -6.283 1.00 64.53 O ATOM 106 CB LYS A 8 2.717 11.642 -5.453 1.00 75.53 C ATOM 107 CG LYS A 8 3.557 10.436 -5.071 1.00 22.34 C ATOM 108 CD LYS A 8 4.464 10.740 -3.890 1.00 11.10 C ATOM 109 CE LYS A 8 4.087 9.912 -2.671 1.00 11.21 C ATOM 110 NZ LYS A 8 5.288 9.463 -1.912 1.00 5.33 N ATOM 0 H LYS A 8 2.894 10.175 -7.437 1.00 33.13 H new ATOM 0 HA LYS A 8 0.734 10.850 -5.707 1.00 4.14 H new ATOM 0 HB2 LYS A 8 3.345 12.359 -5.981 1.00 75.53 H new ATOM 0 HB3 LYS A 8 2.367 12.133 -4.545 1.00 75.53 H new ATOM 0 HG2 LYS A 8 2.903 9.600 -4.823 1.00 22.34 H new ATOM 0 HG3 LYS A 8 4.161 10.127 -5.924 1.00 22.34 H new ATOM 0 HD2 LYS A 8 5.499 10.537 -4.163 1.00 11.10 H new ATOM 0 HD3 LYS A 8 4.401 11.800 -3.645 1.00 11.10 H new ATOM 0 HE2 LYS A 8 3.443 10.500 -2.017 1.00 11.21 H new ATOM 0 HE3 LYS A 8 3.511 9.042 -2.987 1.00 11.21 H new ATOM 0 HZ1 LYS A 8 4.989 8.902 -1.089 1.00 5.33 H new ATOM 0 HZ2 LYS A 8 5.890 8.880 -2.528 1.00 5.33 H new ATOM 0 HZ3 LYS A 8 5.825 10.293 -1.588 1.00 5.33 H new ATOM 124 N ILE A 9 1.105 12.672 -8.283 1.00 15.20 N ATOM 125 CA ILE A 9 0.614 13.834 -9.014 1.00 41.10 C ATOM 126 C ILE A 9 -0.565 13.464 -9.907 1.00 71.21 C ATOM 127 O ILE A 9 -1.162 14.324 -10.555 1.00 5.21 O ATOM 128 CB ILE A 9 1.721 14.464 -9.880 1.00 42.44 C ATOM 129 CG1 ILE A 9 3.019 14.585 -9.080 1.00 3.22 C ATOM 130 CG2 ILE A 9 1.281 15.826 -10.395 1.00 73.14 C ATOM 131 CD1 ILE A 9 4.162 15.184 -9.868 1.00 55.24 C ATOM 0 H ILE A 9 1.564 11.971 -8.864 1.00 15.20 H new ATOM 0 HA ILE A 9 0.289 14.560 -8.269 1.00 41.10 H new ATOM 0 HB ILE A 9 1.904 13.815 -10.737 1.00 42.44 H new ATOM 0 HG12 ILE A 9 2.836 15.198 -8.198 1.00 3.22 H new ATOM 0 HG13 ILE A 9 3.311 13.596 -8.726 1.00 3.22 H new ATOM 0 HG21 ILE A 9 2.074 16.258 -11.005 1.00 73.14 H new ATOM 0 HG22 ILE A 9 0.380 15.713 -10.998 1.00 73.14 H new ATOM 0 HG23 ILE A 9 1.073 16.484 -9.551 1.00 73.14 H new ATOM 0 HD11 ILE A 9 5.049 15.239 -9.237 1.00 55.24 H new ATOM 0 HD12 ILE A 9 4.372 14.559 -10.736 1.00 55.24 H new ATOM 0 HD13 ILE A 9 3.890 16.186 -10.199 1.00 55.24 H new ATOM 143 N VAL A 10 -0.897 12.177 -9.936 1.00 4.30 N ATOM 144 CA VAL A 10 -2.008 11.691 -10.746 1.00 43.34 C ATOM 145 C VAL A 10 -3.276 11.550 -9.912 1.00 34.04 C ATOM 146 O VAL A 10 -4.333 12.070 -10.276 1.00 71.51 O ATOM 147 CB VAL A 10 -1.678 10.334 -11.394 1.00 22.34 C ATOM 148 CG1 VAL A 10 -2.823 9.875 -12.285 1.00 23.30 C ATOM 149 CG2 VAL A 10 -0.381 10.421 -12.183 1.00 51.14 C ATOM 0 H VAL A 10 -0.412 11.452 -9.408 1.00 4.30 H new ATOM 0 HA VAL A 10 -2.174 12.429 -11.531 1.00 43.34 H new ATOM 0 HB VAL A 10 -1.546 9.596 -10.602 1.00 22.34 H new ATOM 0 HG11 VAL A 10 -2.572 8.914 -12.734 1.00 23.30 H new ATOM 0 HG12 VAL A 10 -3.729 9.771 -11.688 1.00 23.30 H new ATOM 0 HG13 VAL A 10 -2.989 10.611 -13.072 1.00 23.30 H new ATOM 0 HG21 VAL A 10 -0.164 9.453 -12.634 1.00 51.14 H new ATOM 0 HG22 VAL A 10 -0.482 11.172 -12.967 1.00 51.14 H new ATOM 0 HG23 VAL A 10 0.433 10.701 -11.515 1.00 51.14 H new ATOM 159 N LEU A 11 -3.166 10.843 -8.793 1.00 33.50 N ATOM 160 CA LEU A 11 -4.304 10.633 -7.905 1.00 22.11 C ATOM 161 C LEU A 11 -4.966 11.960 -7.545 1.00 23.40 C ATOM 162 O LEU A 11 -6.176 12.124 -7.706 1.00 73.14 O ATOM 163 CB LEU A 11 -3.857 9.912 -6.632 1.00 73.11 C ATOM 164 CG LEU A 11 -2.601 10.461 -5.956 1.00 24.02 C ATOM 165 CD1 LEU A 11 -2.972 11.328 -4.763 1.00 11.31 C ATOM 166 CD2 LEU A 11 -1.685 9.323 -5.526 1.00 62.13 C ATOM 0 H LEU A 11 -2.300 10.405 -8.479 1.00 33.50 H new ATOM 0 HA LEU A 11 -5.033 10.014 -8.429 1.00 22.11 H new ATOM 0 HB2 LEU A 11 -4.676 9.945 -5.913 1.00 73.11 H new ATOM 0 HB3 LEU A 11 -3.686 8.863 -6.873 1.00 73.11 H new ATOM 0 HG LEU A 11 -2.066 11.080 -6.676 1.00 24.02 H new ATOM 0 HD11 LEU A 11 -2.065 11.710 -4.295 1.00 11.31 H new ATOM 0 HD12 LEU A 11 -3.587 12.163 -5.098 1.00 11.31 H new ATOM 0 HD13 LEU A 11 -3.531 10.733 -4.040 1.00 11.31 H new ATOM 0 HD21 LEU A 11 -0.796 9.733 -5.047 1.00 62.13 H new ATOM 0 HD22 LEU A 11 -2.212 8.678 -4.823 1.00 62.13 H new ATOM 0 HD23 LEU A 11 -1.391 8.743 -6.400 1.00 62.13 H new ATOM 178 N MET A 12 -4.166 12.903 -7.061 1.00 51.31 N ATOM 179 CA MET A 12 -4.675 14.217 -6.682 1.00 35.35 C ATOM 180 C MET A 12 -5.251 14.946 -7.893 1.00 14.33 C ATOM 181 O MET A 12 -6.271 15.626 -7.790 1.00 15.55 O ATOM 182 CB MET A 12 -3.563 15.054 -6.048 1.00 43.44 C ATOM 183 CG MET A 12 -2.241 14.974 -6.795 1.00 42.04 C ATOM 184 SD MET A 12 -1.134 16.341 -6.396 1.00 23.34 S ATOM 185 CE MET A 12 -1.042 17.174 -7.979 1.00 1.34 C ATOM 0 H MET A 12 -3.163 12.783 -6.922 1.00 51.31 H new ATOM 0 HA MET A 12 -5.473 14.075 -5.953 1.00 35.35 H new ATOM 0 HB2 MET A 12 -3.883 16.095 -6.003 1.00 43.44 H new ATOM 0 HB3 MET A 12 -3.411 14.723 -5.021 1.00 43.44 H new ATOM 0 HG2 MET A 12 -1.749 14.031 -6.555 1.00 42.04 H new ATOM 0 HG3 MET A 12 -2.434 14.969 -7.868 1.00 42.04 H new ATOM 0 HE1 MET A 12 -0.117 17.748 -8.035 1.00 1.34 H new ATOM 0 HE2 MET A 12 -1.060 16.435 -8.780 1.00 1.34 H new ATOM 0 HE3 MET A 12 -1.893 17.846 -8.086 1.00 1.34 H new ATOM 195 N ARG A 13 -4.589 14.799 -9.035 1.00 72.22 N ATOM 196 CA ARG A 13 -5.035 15.446 -10.264 1.00 43.34 C ATOM 197 C ARG A 13 -6.398 14.913 -10.695 1.00 25.20 C ATOM 198 O ARG A 13 -7.255 15.668 -11.157 1.00 32.00 O ATOM 199 CB ARG A 13 -4.013 15.225 -11.381 1.00 43.40 C ATOM 200 CG ARG A 13 -4.436 15.813 -12.718 1.00 23.54 C ATOM 201 CD ARG A 13 -3.554 16.987 -13.113 1.00 1.24 C ATOM 202 NE ARG A 13 -2.150 16.602 -13.231 1.00 13.15 N ATOM 203 CZ ARG A 13 -1.655 15.937 -14.269 1.00 62.43 C ATOM 204 NH1 ARG A 13 -2.445 15.588 -15.275 1.00 34.04 N ATOM 205 NH2 ARG A 13 -0.366 15.622 -14.303 1.00 3.12 N ATOM 0 H ARG A 13 -3.743 14.238 -9.136 1.00 72.22 H new ATOM 0 HA ARG A 13 -5.127 16.515 -10.070 1.00 43.34 H new ATOM 0 HB2 ARG A 13 -3.062 15.666 -11.084 1.00 43.40 H new ATOM 0 HB3 ARG A 13 -3.844 14.155 -11.501 1.00 43.40 H new ATOM 0 HG2 ARG A 13 -4.385 15.043 -13.488 1.00 23.54 H new ATOM 0 HG3 ARG A 13 -5.474 16.139 -12.661 1.00 23.54 H new ATOM 0 HD2 ARG A 13 -3.899 17.396 -14.063 1.00 1.24 H new ATOM 0 HD3 ARG A 13 -3.651 17.779 -12.371 1.00 1.24 H new ATOM 0 HE ARG A 13 -1.515 16.858 -12.475 1.00 13.15 H new ATOM 0 HH11 ARG A 13 -3.436 15.830 -15.253 1.00 34.04 H new ATOM 0 HH12 ARG A 13 -2.062 15.077 -16.071 1.00 34.04 H new ATOM 0 HH21 ARG A 13 0.245 15.891 -13.532 1.00 3.12 H new ATOM 0 HH22 ARG A 13 0.013 15.111 -15.100 1.00 3.12 H new ATOM 219 N LYS A 14 -6.594 13.608 -10.540 1.00 43.14 N ATOM 220 CA LYS A 14 -7.853 12.973 -10.912 1.00 24.33 C ATOM 221 C LYS A 14 -8.954 13.324 -9.916 1.00 14.43 C ATOM 222 O LYS A 14 -10.141 13.217 -10.226 1.00 20.12 O ATOM 223 CB LYS A 14 -7.680 11.454 -10.983 1.00 73.54 C ATOM 224 CG LYS A 14 -7.559 10.922 -12.400 1.00 21.53 C ATOM 225 CD LYS A 14 -6.115 10.611 -12.757 1.00 2.42 C ATOM 226 CE LYS A 14 -5.438 11.799 -13.423 1.00 1.21 C ATOM 227 NZ LYS A 14 -4.933 11.460 -14.783 1.00 3.32 N ATOM 0 H LYS A 14 -5.896 12.969 -10.159 1.00 43.14 H new ATOM 0 HA LYS A 14 -8.143 13.346 -11.894 1.00 24.33 H new ATOM 0 HB2 LYS A 14 -6.790 11.171 -10.420 1.00 73.54 H new ATOM 0 HB3 LYS A 14 -8.530 10.977 -10.496 1.00 73.54 H new ATOM 0 HG2 LYS A 14 -8.163 10.021 -12.504 1.00 21.53 H new ATOM 0 HG3 LYS A 14 -7.958 11.656 -13.100 1.00 21.53 H new ATOM 0 HD2 LYS A 14 -5.567 10.337 -11.856 1.00 2.42 H new ATOM 0 HD3 LYS A 14 -6.081 9.750 -13.425 1.00 2.42 H new ATOM 0 HE2 LYS A 14 -6.144 12.626 -13.494 1.00 1.21 H new ATOM 0 HE3 LYS A 14 -4.609 12.139 -12.802 1.00 1.21 H new ATOM 0 HZ1 LYS A 14 -4.335 12.235 -15.134 1.00 3.32 H new ATOM 0 HZ2 LYS A 14 -4.374 10.584 -14.737 1.00 3.32 H new ATOM 0 HZ3 LYS A 14 -5.737 11.324 -15.428 1.00 3.32 H new ATOM 241 N SER A 15 -8.553 13.745 -8.721 1.00 0.52 N ATOM 242 CA SER A 15 -9.506 14.109 -7.679 1.00 34.52 C ATOM 243 C SER A 15 -10.252 15.387 -8.049 1.00 4.13 C ATOM 244 O SER A 15 -11.395 15.591 -7.642 1.00 42.32 O ATOM 245 CB SER A 15 -8.786 14.295 -6.342 1.00 23.33 C ATOM 246 OG SER A 15 -8.551 15.666 -6.075 1.00 1.04 O ATOM 0 H SER A 15 -7.574 13.843 -8.450 1.00 0.52 H new ATOM 0 HA SER A 15 -10.230 13.300 -7.584 1.00 34.52 H new ATOM 0 HB2 SER A 15 -9.384 13.863 -5.540 1.00 23.33 H new ATOM 0 HB3 SER A 15 -7.838 13.757 -6.358 1.00 23.33 H new ATOM 0 HG SER A 15 -7.759 15.964 -6.568 1.00 1.04 H new ATOM 252 N GLU A 16 -9.596 16.244 -8.825 1.00 24.43 N ATOM 253 CA GLU A 16 -10.197 17.504 -9.249 1.00 22.34 C ATOM 254 C GLU A 16 -11.042 17.308 -10.505 1.00 32.11 C ATOM 255 O GLU A 16 -11.751 18.216 -10.937 1.00 43.32 O ATOM 256 CB GLU A 16 -9.112 18.551 -9.509 1.00 13.35 C ATOM 257 CG GLU A 16 -9.645 19.970 -9.603 1.00 62.31 C ATOM 258 CD GLU A 16 -10.268 20.446 -8.304 1.00 2.34 C ATOM 259 OE1 GLU A 16 -10.154 19.724 -7.292 1.00 14.23 O ATOM 260 OE2 GLU A 16 -10.869 21.541 -8.302 1.00 72.53 O ATOM 0 H GLU A 16 -8.650 16.089 -9.173 1.00 24.43 H new ATOM 0 HA GLU A 16 -10.846 17.856 -8.447 1.00 22.34 H new ATOM 0 HB2 GLU A 16 -8.373 18.502 -8.710 1.00 13.35 H new ATOM 0 HB3 GLU A 16 -8.595 18.304 -10.436 1.00 13.35 H new ATOM 0 HG2 GLU A 16 -8.833 20.642 -9.880 1.00 62.31 H new ATOM 0 HG3 GLU A 16 -10.388 20.023 -10.399 1.00 62.31 H new ATOM 267 N TYR A 17 -10.960 16.115 -11.085 1.00 34.24 N ATOM 268 CA TYR A 17 -11.714 15.800 -12.293 1.00 3.21 C ATOM 269 C TYR A 17 -11.276 16.686 -13.455 1.00 63.52 C ATOM 270 O TYR A 17 -12.055 16.961 -14.369 1.00 30.34 O ATOM 271 CB TYR A 17 -13.213 15.970 -12.042 1.00 21.42 C ATOM 272 CG TYR A 17 -13.695 15.303 -10.774 1.00 23.24 C ATOM 273 CD1 TYR A 17 -13.887 13.928 -10.719 1.00 54.02 C ATOM 274 CD2 TYR A 17 -13.959 16.048 -9.631 1.00 22.22 C ATOM 275 CE1 TYR A 17 -14.327 13.315 -9.562 1.00 50.43 C ATOM 276 CE2 TYR A 17 -14.399 15.442 -8.470 1.00 21.13 C ATOM 277 CZ TYR A 17 -14.582 14.076 -8.440 1.00 22.22 C ATOM 278 OH TYR A 17 -15.021 13.468 -7.286 1.00 41.24 O ATOM 0 H TYR A 17 -10.380 15.351 -10.738 1.00 34.24 H new ATOM 0 HA TYR A 17 -11.513 14.762 -12.557 1.00 3.21 H new ATOM 0 HB2 TYR A 17 -13.446 17.034 -11.994 1.00 21.42 H new ATOM 0 HB3 TYR A 17 -13.763 15.561 -12.889 1.00 21.42 H new ATOM 0 HD1 TYR A 17 -13.689 13.329 -11.595 1.00 54.02 H new ATOM 0 HD2 TYR A 17 -13.818 17.119 -9.651 1.00 22.22 H new ATOM 0 HE1 TYR A 17 -14.471 12.245 -9.536 1.00 50.43 H new ATOM 0 HE2 TYR A 17 -14.599 16.036 -7.590 1.00 21.13 H new ATOM 0 HH TYR A 17 -15.152 14.145 -6.589 1.00 41.24 H new ATOM 288 N LEU A 18 -10.025 17.130 -13.414 1.00 50.01 N ATOM 289 CA LEU A 18 -9.481 17.984 -14.463 1.00 55.21 C ATOM 290 C LEU A 18 -8.593 17.185 -15.411 1.00 11.42 C ATOM 291 O LEU A 18 -8.207 16.055 -15.111 1.00 23.51 O ATOM 292 CB LEU A 18 -8.685 19.137 -13.848 1.00 71.45 C ATOM 293 CG LEU A 18 -7.464 18.740 -13.017 1.00 20.12 C ATOM 294 CD1 LEU A 18 -6.259 18.509 -13.917 1.00 2.31 C ATOM 295 CD2 LEU A 18 -7.157 19.806 -11.976 1.00 52.43 C ATOM 0 H LEU A 18 -9.368 16.912 -12.665 1.00 50.01 H new ATOM 0 HA LEU A 18 -10.315 18.391 -15.035 1.00 55.21 H new ATOM 0 HB2 LEU A 18 -8.354 19.794 -14.653 1.00 71.45 H new ATOM 0 HB3 LEU A 18 -9.356 19.719 -13.216 1.00 71.45 H new ATOM 0 HG LEU A 18 -7.689 17.808 -12.498 1.00 20.12 H new ATOM 0 HD11 LEU A 18 -5.399 18.227 -13.309 1.00 2.31 H new ATOM 0 HD12 LEU A 18 -6.481 17.710 -14.624 1.00 2.31 H new ATOM 0 HD13 LEU A 18 -6.032 19.424 -14.464 1.00 2.31 H new ATOM 0 HD21 LEU A 18 -6.285 19.506 -11.394 1.00 52.43 H new ATOM 0 HD22 LEU A 18 -6.952 20.753 -12.475 1.00 52.43 H new ATOM 0 HD23 LEU A 18 -8.013 19.923 -11.312 1.00 52.43 H new ATOM 307 N SER A 19 -8.270 17.781 -16.555 1.00 75.14 N ATOM 308 CA SER A 19 -7.427 17.124 -17.547 1.00 42.32 C ATOM 309 C SER A 19 -6.041 17.759 -17.589 1.00 72.22 C ATOM 310 O SER A 19 -5.826 18.841 -17.043 1.00 2.13 O ATOM 311 CB SER A 19 -8.079 17.200 -18.930 1.00 3.34 C ATOM 312 OG SER A 19 -7.803 18.441 -19.556 1.00 61.02 O ATOM 0 H SER A 19 -8.579 18.717 -16.817 1.00 75.14 H new ATOM 0 HA SER A 19 -7.318 16.078 -17.261 1.00 42.32 H new ATOM 0 HB2 SER A 19 -7.712 16.385 -19.554 1.00 3.34 H new ATOM 0 HB3 SER A 19 -9.157 17.069 -18.835 1.00 3.34 H new ATOM 0 HG SER A 19 -8.229 18.464 -20.438 1.00 61.02 H new ATOM 318 N ARG A 20 -5.105 17.079 -18.242 1.00 71.01 N ATOM 319 CA ARG A 20 -3.739 17.576 -18.356 1.00 24.20 C ATOM 320 C ARG A 20 -3.724 19.010 -18.878 1.00 73.30 C ATOM 321 O ARG A 20 -2.951 19.843 -18.404 1.00 23.14 O ATOM 322 CB ARG A 20 -2.922 16.675 -19.285 1.00 14.35 C ATOM 323 CG ARG A 20 -2.148 15.590 -18.555 1.00 64.12 C ATOM 324 CD ARG A 20 -1.231 14.829 -19.499 1.00 52.12 C ATOM 325 NE ARG A 20 -1.981 14.061 -20.489 1.00 31.03 N ATOM 326 CZ ARG A 20 -2.691 12.978 -20.195 1.00 33.21 C ATOM 327 NH1 ARG A 20 -2.750 12.539 -18.945 1.00 13.10 N ATOM 328 NH2 ARG A 20 -3.347 12.332 -21.152 1.00 51.12 N ATOM 0 H ARG A 20 -5.267 16.182 -18.700 1.00 71.01 H new ATOM 0 HA ARG A 20 -3.290 17.565 -17.363 1.00 24.20 H new ATOM 0 HB2 ARG A 20 -3.592 16.208 -20.007 1.00 14.35 H new ATOM 0 HB3 ARG A 20 -2.223 17.290 -19.851 1.00 14.35 H new ATOM 0 HG2 ARG A 20 -1.558 16.038 -17.755 1.00 64.12 H new ATOM 0 HG3 ARG A 20 -2.846 14.896 -18.086 1.00 64.12 H new ATOM 0 HD2 ARG A 20 -0.572 15.532 -20.009 1.00 52.12 H new ATOM 0 HD3 ARG A 20 -0.596 14.156 -18.923 1.00 52.12 H new ATOM 0 HE ARG A 20 -1.958 14.374 -21.460 1.00 31.03 H new ATOM 0 HH11 ARG A 20 -2.249 13.033 -18.207 1.00 13.10 H new ATOM 0 HH12 ARG A 20 -3.296 11.707 -18.722 1.00 13.10 H new ATOM 0 HH21 ARG A 20 -3.306 12.668 -22.114 1.00 51.12 H new ATOM 0 HH22 ARG A 20 -3.892 11.500 -20.925 1.00 51.12 H new ATOM 342 N GLN A 21 -4.580 19.289 -19.854 1.00 33.24 N ATOM 343 CA GLN A 21 -4.664 20.621 -20.439 1.00 62.13 C ATOM 344 C GLN A 21 -5.114 21.644 -19.402 1.00 32.54 C ATOM 345 O GLN A 21 -4.731 22.812 -19.463 1.00 15.25 O ATOM 346 CB GLN A 21 -5.629 20.620 -21.626 1.00 31.45 C ATOM 347 CG GLN A 21 -5.614 21.914 -22.424 1.00 12.41 C ATOM 348 CD GLN A 21 -4.664 21.861 -23.604 1.00 73.14 C ATOM 349 OE1 GLN A 21 -5.070 21.570 -24.730 1.00 3.42 O ATOM 350 NE2 GLN A 21 -3.391 22.141 -23.353 1.00 2.12 N ATOM 0 H GLN A 21 -5.226 18.610 -20.257 1.00 33.24 H new ATOM 0 HA GLN A 21 -3.670 20.900 -20.789 1.00 62.13 H new ATOM 0 HB2 GLN A 21 -5.376 19.792 -22.288 1.00 31.45 H new ATOM 0 HB3 GLN A 21 -6.640 20.440 -21.261 1.00 31.45 H new ATOM 0 HG2 GLN A 21 -6.621 22.127 -22.783 1.00 12.41 H new ATOM 0 HG3 GLN A 21 -5.328 22.737 -21.769 1.00 12.41 H new ATOM 0 HE21 GLN A 21 -3.098 22.377 -22.405 1.00 2.12 H new ATOM 0 HE22 GLN A 21 -2.706 22.120 -24.108 1.00 2.12 H new ATOM 359 N GLN A 22 -5.929 21.197 -18.452 1.00 51.23 N ATOM 360 CA GLN A 22 -6.431 22.076 -17.403 1.00 0.45 C ATOM 361 C GLN A 22 -5.287 22.621 -16.554 1.00 51.31 C ATOM 362 O GLN A 22 -5.004 23.819 -16.570 1.00 43.21 O ATOM 363 CB GLN A 22 -7.428 21.327 -16.516 1.00 11.44 C ATOM 364 CG GLN A 22 -8.400 22.241 -15.787 1.00 2.14 C ATOM 365 CD GLN A 22 -9.167 23.148 -16.730 1.00 62.24 C ATOM 366 OE1 GLN A 22 -9.748 22.691 -17.715 1.00 71.22 O ATOM 367 NE2 GLN A 22 -9.171 24.442 -16.433 1.00 62.52 N ATOM 0 H GLN A 22 -6.255 20.233 -18.387 1.00 51.23 H new ATOM 0 HA GLN A 22 -6.937 22.916 -17.879 1.00 0.45 H new ATOM 0 HB2 GLN A 22 -7.993 20.626 -17.130 1.00 11.44 H new ATOM 0 HB3 GLN A 22 -6.878 20.737 -15.783 1.00 11.44 H new ATOM 0 HG2 GLN A 22 -9.105 21.635 -15.218 1.00 2.14 H new ATOM 0 HG3 GLN A 22 -7.851 22.850 -15.069 1.00 2.14 H new ATOM 0 HE21 GLN A 22 -8.676 24.777 -15.606 1.00 62.52 H new ATOM 0 HE22 GLN A 22 -9.669 25.101 -17.031 1.00 62.52 H new ATOM 376 N LEU A 23 -4.633 21.733 -15.813 1.00 1.25 N ATOM 377 CA LEU A 23 -3.518 22.125 -14.957 1.00 22.42 C ATOM 378 C LEU A 23 -2.408 22.778 -15.773 1.00 63.10 C ATOM 379 O LEU A 23 -1.776 23.735 -15.327 1.00 73.44 O ATOM 380 CB LEU A 23 -2.970 20.907 -14.211 1.00 64.12 C ATOM 381 CG LEU A 23 -1.630 21.102 -13.501 1.00 63.23 C ATOM 382 CD1 LEU A 23 -1.555 20.234 -12.255 1.00 72.12 C ATOM 383 CD2 LEU A 23 -0.476 20.791 -14.442 1.00 24.14 C ATOM 0 H LEU A 23 -4.855 20.738 -15.787 1.00 1.25 H new ATOM 0 HA LEU A 23 -3.886 22.852 -14.233 1.00 22.42 H new ATOM 0 HB2 LEU A 23 -3.708 20.596 -13.472 1.00 64.12 H new ATOM 0 HB3 LEU A 23 -2.866 20.087 -14.922 1.00 64.12 H new ATOM 0 HG LEU A 23 -1.551 22.146 -13.196 1.00 63.23 H new ATOM 0 HD11 LEU A 23 -0.594 20.386 -11.763 1.00 72.12 H new ATOM 0 HD12 LEU A 23 -2.360 20.507 -11.572 1.00 72.12 H new ATOM 0 HD13 LEU A 23 -1.657 19.186 -12.535 1.00 72.12 H new ATOM 0 HD21 LEU A 23 0.469 20.935 -13.919 1.00 24.14 H new ATOM 0 HD22 LEU A 23 -0.550 19.757 -14.779 1.00 24.14 H new ATOM 0 HD23 LEU A 23 -0.519 21.457 -15.304 1.00 24.14 H new ATOM 395 N ALA A 24 -2.176 22.256 -16.974 1.00 40.14 N ATOM 396 CA ALA A 24 -1.146 22.791 -17.854 1.00 33.11 C ATOM 397 C ALA A 24 -1.320 24.292 -18.055 1.00 23.23 C ATOM 398 O ALA A 24 -0.354 25.010 -18.313 1.00 34.43 O ATOM 399 CB ALA A 24 -1.170 22.070 -19.195 1.00 43.12 C ATOM 0 H ALA A 24 -2.689 21.463 -17.359 1.00 40.14 H new ATOM 0 HA ALA A 24 -0.178 22.625 -17.382 1.00 33.11 H new ATOM 0 HB1 ALA A 24 -0.395 22.480 -19.843 1.00 43.12 H new ATOM 0 HB2 ALA A 24 -0.988 21.007 -19.040 1.00 43.12 H new ATOM 0 HB3 ALA A 24 -2.144 22.206 -19.664 1.00 43.12 H new ATOM 405 N ASP A 25 -2.557 24.760 -17.936 1.00 0.02 N ATOM 406 CA ASP A 25 -2.859 26.177 -18.105 1.00 72.22 C ATOM 407 C ASP A 25 -2.833 26.901 -16.762 1.00 62.10 C ATOM 408 O ASP A 25 -2.641 28.117 -16.704 1.00 11.21 O ATOM 409 CB ASP A 25 -4.226 26.355 -18.767 1.00 75.11 C ATOM 410 CG ASP A 25 -4.185 27.329 -19.928 1.00 52.02 C ATOM 411 OD1 ASP A 25 -3.878 28.516 -19.695 1.00 32.35 O ATOM 412 OD2 ASP A 25 -4.460 26.904 -21.069 1.00 73.30 O ATOM 0 H ASP A 25 -3.368 24.179 -17.723 1.00 0.02 H new ATOM 0 HA ASP A 25 -2.094 26.612 -18.748 1.00 72.22 H new ATOM 0 HB2 ASP A 25 -4.584 25.388 -19.120 1.00 75.11 H new ATOM 0 HB3 ASP A 25 -4.942 26.708 -18.025 1.00 75.11 H new ATOM 417 N LEU A 26 -3.028 26.148 -15.685 1.00 11.45 N ATOM 418 CA LEU A 26 -3.027 26.718 -14.343 1.00 42.33 C ATOM 419 C LEU A 26 -1.604 27.001 -13.871 1.00 31.40 C ATOM 420 O LEU A 26 -1.367 27.934 -13.103 1.00 63.25 O ATOM 421 CB LEU A 26 -3.721 25.769 -13.364 1.00 5.25 C ATOM 422 CG LEU A 26 -5.147 26.145 -12.961 1.00 72.31 C ATOM 423 CD1 LEU A 26 -6.139 25.120 -13.487 1.00 51.25 C ATOM 424 CD2 LEU A 26 -5.259 26.271 -11.449 1.00 64.15 C ATOM 0 H LEU A 26 -3.189 25.141 -15.715 1.00 11.45 H new ATOM 0 HA LEU A 26 -3.573 27.661 -14.376 1.00 42.33 H new ATOM 0 HB2 LEU A 26 -3.741 24.773 -13.807 1.00 5.25 H new ATOM 0 HB3 LEU A 26 -3.115 25.704 -12.461 1.00 5.25 H new ATOM 0 HG LEU A 26 -5.386 27.112 -13.405 1.00 72.31 H new ATOM 0 HD11 LEU A 26 -7.148 25.405 -13.190 1.00 51.25 H new ATOM 0 HD12 LEU A 26 -6.078 25.080 -14.575 1.00 51.25 H new ATOM 0 HD13 LEU A 26 -5.902 24.139 -13.074 1.00 51.25 H new ATOM 0 HD21 LEU A 26 -6.281 26.539 -11.181 1.00 64.15 H new ATOM 0 HD22 LEU A 26 -5.000 25.320 -10.984 1.00 64.15 H new ATOM 0 HD23 LEU A 26 -4.577 27.045 -11.097 1.00 64.15 H new ATOM 436 N THR A 27 -0.660 26.191 -14.339 1.00 4.14 N ATOM 437 CA THR A 27 0.740 26.354 -13.966 1.00 54.35 C ATOM 438 C THR A 27 1.578 26.799 -15.160 1.00 0.33 C ATOM 439 O THR A 27 2.756 27.122 -15.017 1.00 41.53 O ATOM 440 CB THR A 27 1.327 25.047 -13.400 1.00 71.31 C ATOM 441 OG1 THR A 27 2.756 25.130 -13.358 1.00 70.12 O ATOM 442 CG2 THR A 27 0.908 23.854 -14.245 1.00 31.12 C ATOM 0 H THR A 27 -0.839 25.416 -14.977 1.00 4.14 H new ATOM 0 HA THR A 27 0.774 27.123 -13.194 1.00 54.35 H new ATOM 0 HB THR A 27 0.941 24.909 -12.390 1.00 71.31 H new ATOM 0 HG1 THR A 27 3.040 26.027 -13.633 1.00 70.12 H new ATOM 0 HG21 THR A 27 1.335 22.943 -13.825 1.00 31.12 H new ATOM 0 HG22 THR A 27 -0.179 23.776 -14.251 1.00 31.12 H new ATOM 0 HG23 THR A 27 1.268 23.987 -15.265 1.00 31.12 H new ATOM 450 N GLY A 28 0.961 26.814 -16.338 1.00 71.14 N ATOM 451 CA GLY A 28 1.667 27.222 -17.539 1.00 55.42 C ATOM 452 C GLY A 28 2.701 26.204 -17.978 1.00 63.01 C ATOM 453 O GLY A 28 3.639 26.534 -18.703 1.00 24.43 O ATOM 0 H GLY A 28 -0.014 26.551 -16.482 1.00 71.14 H new ATOM 0 HA2 GLY A 28 0.949 27.376 -18.344 1.00 55.42 H new ATOM 0 HA3 GLY A 28 2.157 28.179 -17.361 1.00 55.42 H new ATOM 457 N VAL A 29 2.530 24.961 -17.537 1.00 50.12 N ATOM 458 CA VAL A 29 3.457 23.892 -17.888 1.00 54.03 C ATOM 459 C VAL A 29 3.206 23.391 -19.306 1.00 24.12 C ATOM 460 O VAL A 29 2.081 23.408 -19.807 1.00 11.23 O ATOM 461 CB VAL A 29 3.343 22.707 -16.910 1.00 3.24 C ATOM 462 CG1 VAL A 29 3.000 21.428 -17.657 1.00 14.34 C ATOM 463 CG2 VAL A 29 4.633 22.543 -16.121 1.00 50.23 C ATOM 0 H VAL A 29 1.758 24.670 -16.936 1.00 50.12 H new ATOM 0 HA VAL A 29 4.461 24.311 -17.825 1.00 54.03 H new ATOM 0 HB VAL A 29 2.537 22.915 -16.207 1.00 3.24 H new ATOM 0 HG11 VAL A 29 2.924 20.603 -16.949 1.00 14.34 H new ATOM 0 HG12 VAL A 29 2.048 21.552 -18.173 1.00 14.34 H new ATOM 0 HG13 VAL A 29 3.782 21.211 -18.385 1.00 14.34 H new ATOM 0 HG21 VAL A 29 4.535 21.702 -15.435 1.00 50.23 H new ATOM 0 HG22 VAL A 29 5.459 22.357 -16.808 1.00 50.23 H new ATOM 0 HG23 VAL A 29 4.831 23.453 -15.554 1.00 50.23 H new ATOM 473 N PRO A 30 4.278 22.934 -19.970 1.00 5.34 N ATOM 474 CA PRO A 30 4.200 22.419 -21.341 1.00 54.13 C ATOM 475 C PRO A 30 3.463 21.086 -21.418 1.00 3.43 C ATOM 476 O PRO A 30 3.958 20.064 -20.945 1.00 5.21 O ATOM 477 CB PRO A 30 5.668 22.241 -21.737 1.00 44.23 C ATOM 478 CG PRO A 30 6.389 22.055 -20.447 1.00 71.13 C ATOM 479 CD PRO A 30 5.649 22.886 -19.435 1.00 14.15 C ATOM 0 HA PRO A 30 3.645 23.089 -21.997 1.00 54.13 H new ATOM 0 HB2 PRO A 30 5.800 21.380 -22.392 1.00 44.23 H new ATOM 0 HB3 PRO A 30 6.041 23.112 -22.277 1.00 44.23 H new ATOM 0 HG2 PRO A 30 6.402 21.005 -20.155 1.00 71.13 H new ATOM 0 HG3 PRO A 30 7.427 22.375 -20.531 1.00 71.13 H new ATOM 0 HD2 PRO A 30 5.678 22.433 -18.444 1.00 14.15 H new ATOM 0 HD3 PRO A 30 6.079 23.883 -19.342 1.00 14.15 H new ATOM 487 N TYR A 31 2.276 21.106 -22.016 1.00 25.44 N ATOM 488 CA TYR A 31 1.470 19.899 -22.153 1.00 32.30 C ATOM 489 C TYR A 31 2.280 18.771 -22.785 1.00 14.22 C ATOM 490 O TYR A 31 2.154 17.610 -22.400 1.00 34.33 O ATOM 491 CB TYR A 31 0.227 20.184 -22.997 1.00 63.02 C ATOM 492 CG TYR A 31 -0.618 18.959 -23.263 1.00 1.51 C ATOM 493 CD1 TYR A 31 -1.562 18.527 -22.339 1.00 12.33 C ATOM 494 CD2 TYR A 31 -0.473 18.233 -24.439 1.00 32.10 C ATOM 495 CE1 TYR A 31 -2.336 17.409 -22.578 1.00 62.12 C ATOM 496 CE2 TYR A 31 -1.244 17.113 -24.687 1.00 35.12 C ATOM 497 CZ TYR A 31 -2.173 16.705 -23.753 1.00 32.41 C ATOM 498 OH TYR A 31 -2.942 15.589 -23.995 1.00 11.03 O ATOM 0 H TYR A 31 1.852 21.944 -22.413 1.00 25.44 H new ATOM 0 HA TYR A 31 1.160 19.585 -21.156 1.00 32.30 H new ATOM 0 HB2 TYR A 31 -0.382 20.932 -22.490 1.00 63.02 H new ATOM 0 HB3 TYR A 31 0.536 20.616 -23.949 1.00 63.02 H new ATOM 0 HD1 TYR A 31 -1.692 19.075 -21.418 1.00 12.33 H new ATOM 0 HD2 TYR A 31 0.255 18.549 -25.172 1.00 32.10 H new ATOM 0 HE1 TYR A 31 -3.065 17.087 -21.849 1.00 62.12 H new ATOM 0 HE2 TYR A 31 -1.120 16.561 -25.607 1.00 35.12 H new ATOM 0 HH TYR A 31 -2.704 15.210 -24.867 1.00 11.03 H new ATOM 508 N GLY A 32 3.113 19.124 -23.759 1.00 2.44 N ATOM 509 CA GLY A 32 3.933 18.131 -24.430 1.00 73.33 C ATOM 510 C GLY A 32 4.724 17.280 -23.456 1.00 15.40 C ATOM 511 O GLY A 32 4.867 16.072 -23.649 1.00 5.33 O ATOM 0 H GLY A 32 3.235 20.079 -24.096 1.00 2.44 H new ATOM 0 HA2 GLY A 32 3.296 17.487 -25.036 1.00 73.33 H new ATOM 0 HA3 GLY A 32 4.620 18.632 -25.112 1.00 73.33 H new ATOM 515 N THR A 33 5.245 17.910 -22.407 1.00 2.10 N ATOM 516 CA THR A 33 6.029 17.204 -21.403 1.00 33.22 C ATOM 517 C THR A 33 5.146 16.712 -20.262 1.00 41.20 C ATOM 518 O THR A 33 5.403 15.661 -19.672 1.00 25.30 O ATOM 519 CB THR A 33 7.141 18.101 -20.826 1.00 51.23 C ATOM 520 OG1 THR A 33 7.594 19.022 -21.824 1.00 63.51 O ATOM 521 CG2 THR A 33 8.311 17.262 -20.334 1.00 43.02 C ATOM 0 H THR A 33 5.137 18.909 -22.232 1.00 2.10 H new ATOM 0 HA THR A 33 6.484 16.348 -21.902 1.00 33.22 H new ATOM 0 HB THR A 33 6.730 18.654 -19.981 1.00 51.23 H new ATOM 0 HG1 THR A 33 8.299 19.590 -21.449 1.00 63.51 H new ATOM 0 HG21 THR A 33 9.084 17.916 -19.931 1.00 43.02 H new ATOM 0 HG22 THR A 33 7.968 16.582 -19.554 1.00 43.02 H new ATOM 0 HG23 THR A 33 8.720 16.686 -21.164 1.00 43.02 H new ATOM 529 N LEU A 34 4.104 17.477 -19.955 1.00 24.43 N ATOM 530 CA LEU A 34 3.181 17.118 -18.884 1.00 43.23 C ATOM 531 C LEU A 34 2.658 15.697 -19.068 1.00 50.10 C ATOM 532 O LEU A 34 2.369 15.000 -18.096 1.00 64.13 O ATOM 533 CB LEU A 34 2.009 18.102 -18.841 1.00 34.41 C ATOM 534 CG LEU A 34 0.871 17.750 -17.883 1.00 14.43 C ATOM 535 CD1 LEU A 34 1.240 18.126 -16.456 1.00 3.32 C ATOM 536 CD2 LEU A 34 -0.415 18.446 -18.305 1.00 12.32 C ATOM 0 H LEU A 34 3.877 18.349 -20.432 1.00 24.43 H new ATOM 0 HA LEU A 34 3.724 17.167 -17.940 1.00 43.23 H new ATOM 0 HB2 LEU A 34 2.395 19.084 -18.569 1.00 34.41 H new ATOM 0 HB3 LEU A 34 1.597 18.189 -19.846 1.00 34.41 H new ATOM 0 HG LEU A 34 0.707 16.673 -17.922 1.00 14.43 H new ATOM 0 HD11 LEU A 34 0.418 17.868 -15.788 1.00 3.32 H new ATOM 0 HD12 LEU A 34 2.136 17.582 -16.156 1.00 3.32 H new ATOM 0 HD13 LEU A 34 1.431 19.198 -16.400 1.00 3.32 H new ATOM 0 HD21 LEU A 34 -1.215 18.184 -17.612 1.00 12.32 H new ATOM 0 HD22 LEU A 34 -0.265 19.526 -18.295 1.00 12.32 H new ATOM 0 HD23 LEU A 34 -0.688 18.127 -19.311 1.00 12.32 H new ATOM 548 N SER A 35 2.542 15.273 -20.323 1.00 63.13 N ATOM 549 CA SER A 35 2.054 13.934 -20.635 1.00 73.31 C ATOM 550 C SER A 35 2.994 12.869 -20.079 1.00 51.22 C ATOM 551 O SER A 35 2.559 11.790 -19.677 1.00 50.40 O ATOM 552 CB SER A 35 1.907 13.762 -22.148 1.00 42.24 C ATOM 553 OG SER A 35 1.844 12.391 -22.502 1.00 24.01 O ATOM 0 H SER A 35 2.779 15.837 -21.139 1.00 63.13 H new ATOM 0 HA SER A 35 1.078 13.812 -20.166 1.00 73.31 H new ATOM 0 HB2 SER A 35 1.005 14.271 -22.489 1.00 42.24 H new ATOM 0 HB3 SER A 35 2.750 14.233 -22.654 1.00 42.24 H new ATOM 0 HG SER A 35 1.749 12.308 -23.474 1.00 24.01 H new ATOM 559 N TYR A 36 4.285 13.181 -20.060 1.00 24.31 N ATOM 560 CA TYR A 36 5.288 12.251 -19.555 1.00 24.32 C ATOM 561 C TYR A 36 5.471 12.410 -18.049 1.00 10.31 C ATOM 562 O TYR A 36 5.957 11.503 -17.372 1.00 72.52 O ATOM 563 CB TYR A 36 6.624 12.473 -20.269 1.00 60.32 C ATOM 564 CG TYR A 36 6.492 12.624 -21.768 1.00 21.33 C ATOM 565 CD1 TYR A 36 5.678 11.773 -22.503 1.00 21.51 C ATOM 566 CD2 TYR A 36 7.179 13.622 -22.447 1.00 33.34 C ATOM 567 CE1 TYR A 36 5.554 11.908 -23.873 1.00 11.33 C ATOM 568 CE2 TYR A 36 7.061 13.765 -23.816 1.00 14.13 C ATOM 569 CZ TYR A 36 6.248 12.906 -24.524 1.00 3.04 C ATOM 570 OH TYR A 36 6.127 13.044 -25.888 1.00 45.51 O ATOM 0 H TYR A 36 4.661 14.070 -20.388 1.00 24.31 H new ATOM 0 HA TYR A 36 4.940 11.238 -19.754 1.00 24.32 H new ATOM 0 HB2 TYR A 36 7.099 13.366 -19.863 1.00 60.32 H new ATOM 0 HB3 TYR A 36 7.285 11.634 -20.054 1.00 60.32 H new ATOM 0 HD1 TYR A 36 5.132 10.992 -21.995 1.00 21.51 H new ATOM 0 HD2 TYR A 36 7.816 14.298 -21.896 1.00 33.34 H new ATOM 0 HE1 TYR A 36 4.918 11.236 -24.430 1.00 11.33 H new ATOM 0 HE2 TYR A 36 7.603 14.546 -24.329 1.00 14.13 H new ATOM 0 HH TYR A 36 6.679 13.795 -26.191 1.00 45.51 H new ATOM 580 N TYR A 37 5.080 13.569 -17.532 1.00 54.21 N ATOM 581 CA TYR A 37 5.202 13.849 -16.106 1.00 5.01 C ATOM 582 C TYR A 37 4.414 12.835 -15.283 1.00 44.23 C ATOM 583 O TYR A 37 4.994 11.990 -14.601 1.00 51.30 O ATOM 584 CB TYR A 37 4.709 15.265 -15.801 1.00 11.33 C ATOM 585 CG TYR A 37 5.777 16.325 -15.954 1.00 63.44 C ATOM 586 CD1 TYR A 37 6.796 16.181 -16.887 1.00 74.01 C ATOM 587 CD2 TYR A 37 5.765 17.470 -15.167 1.00 44.14 C ATOM 588 CE1 TYR A 37 7.774 17.147 -17.029 1.00 44.51 C ATOM 589 CE2 TYR A 37 6.738 18.441 -15.305 1.00 1.34 C ATOM 590 CZ TYR A 37 7.740 18.274 -16.237 1.00 71.32 C ATOM 591 OH TYR A 37 8.712 19.239 -16.378 1.00 40.12 O ATOM 0 H TYR A 37 4.676 14.330 -18.078 1.00 54.21 H new ATOM 0 HA TYR A 37 6.254 13.771 -15.833 1.00 5.01 H new ATOM 0 HB2 TYR A 37 3.877 15.501 -16.464 1.00 11.33 H new ATOM 0 HB3 TYR A 37 4.323 15.295 -14.782 1.00 11.33 H new ATOM 0 HD1 TYR A 37 6.824 15.300 -17.511 1.00 74.01 H new ATOM 0 HD2 TYR A 37 4.982 17.603 -14.435 1.00 44.14 H new ATOM 0 HE1 TYR A 37 8.561 17.019 -17.757 1.00 44.51 H new ATOM 0 HE2 TYR A 37 6.714 19.326 -14.686 1.00 1.34 H new ATOM 0 HH TYR A 37 8.289 20.118 -16.469 1.00 40.12 H new ATOM 601 N GLU A 38 3.090 12.928 -15.352 1.00 3.11 N ATOM 602 CA GLU A 38 2.222 12.018 -14.611 1.00 5.14 C ATOM 603 C GLU A 38 2.501 10.568 -14.995 1.00 64.14 C ATOM 604 O GLU A 38 2.240 9.649 -14.219 1.00 41.42 O ATOM 605 CB GLU A 38 0.752 12.353 -14.875 1.00 45.31 C ATOM 606 CG GLU A 38 0.414 12.490 -16.349 1.00 24.31 C ATOM 607 CD GLU A 38 -0.636 11.494 -16.802 1.00 34.22 C ATOM 608 OE1 GLU A 38 -1.691 11.401 -16.141 1.00 25.54 O ATOM 609 OE2 GLU A 38 -0.400 10.805 -17.817 1.00 33.41 O ATOM 0 H GLU A 38 2.595 13.622 -15.912 1.00 3.11 H new ATOM 0 HA GLU A 38 2.431 12.141 -13.548 1.00 5.14 H new ATOM 0 HB2 GLU A 38 0.127 11.574 -14.438 1.00 45.31 H new ATOM 0 HB3 GLU A 38 0.503 13.284 -14.366 1.00 45.31 H new ATOM 0 HG2 GLU A 38 0.058 13.502 -16.544 1.00 24.31 H new ATOM 0 HG3 GLU A 38 1.319 12.352 -16.940 1.00 24.31 H new ATOM 616 N SER A 39 3.032 10.371 -16.197 1.00 60.13 N ATOM 617 CA SER A 39 3.343 9.034 -16.686 1.00 34.13 C ATOM 618 C SER A 39 4.582 8.475 -15.994 1.00 11.41 C ATOM 619 O SER A 39 4.924 7.305 -16.157 1.00 14.05 O ATOM 620 CB SER A 39 3.559 9.058 -18.201 1.00 51.23 C ATOM 621 OG SER A 39 4.219 7.885 -18.642 1.00 13.01 O ATOM 0 H SER A 39 3.256 11.121 -16.851 1.00 60.13 H new ATOM 0 HA SER A 39 2.497 8.386 -16.457 1.00 34.13 H new ATOM 0 HB2 SER A 39 2.598 9.150 -18.707 1.00 51.23 H new ATOM 0 HB3 SER A 39 4.148 9.934 -18.473 1.00 51.23 H new ATOM 0 HG SER A 39 4.374 7.290 -17.879 1.00 13.01 H new ATOM 627 N GLY A 40 5.251 9.324 -15.219 1.00 14.52 N ATOM 628 CA GLY A 40 6.445 8.899 -14.513 1.00 24.23 C ATOM 629 C GLY A 40 7.596 8.591 -15.450 1.00 45.11 C ATOM 630 O GLY A 40 8.590 7.988 -15.048 1.00 74.53 O ATOM 0 H GLY A 40 4.987 10.298 -15.068 1.00 14.52 H new ATOM 0 HA2 GLY A 40 6.748 9.680 -13.815 1.00 24.23 H new ATOM 0 HA3 GLY A 40 6.217 8.013 -13.920 1.00 24.23 H new ATOM 634 N ARG A 41 7.461 9.007 -16.706 1.00 4.24 N ATOM 635 CA ARG A 41 8.496 8.771 -17.705 1.00 13.35 C ATOM 636 C ARG A 41 9.835 9.337 -17.244 1.00 52.13 C ATOM 637 O ARG A 41 10.894 8.801 -17.573 1.00 61.34 O ATOM 638 CB ARG A 41 8.097 9.399 -19.041 1.00 40.30 C ATOM 639 CG ARG A 41 8.610 8.632 -20.251 1.00 52.51 C ATOM 640 CD ARG A 41 7.469 8.010 -21.040 1.00 42.11 C ATOM 641 NE ARG A 41 7.932 7.400 -22.283 1.00 62.55 N ATOM 642 CZ ARG A 41 7.125 7.061 -23.282 1.00 34.51 C ATOM 643 NH1 ARG A 41 5.820 7.274 -23.184 1.00 62.54 N ATOM 644 NH2 ARG A 41 7.623 6.510 -24.381 1.00 43.33 N ATOM 0 H ARG A 41 6.645 9.509 -17.055 1.00 4.24 H new ATOM 0 HA ARG A 41 8.602 7.694 -17.835 1.00 13.35 H new ATOM 0 HB2 ARG A 41 7.010 9.460 -19.094 1.00 40.30 H new ATOM 0 HB3 ARG A 41 8.476 10.420 -19.081 1.00 40.30 H new ATOM 0 HG2 ARG A 41 9.176 9.304 -20.896 1.00 52.51 H new ATOM 0 HG3 ARG A 41 9.296 7.851 -19.924 1.00 52.51 H new ATOM 0 HD2 ARG A 41 6.974 7.256 -20.428 1.00 42.11 H new ATOM 0 HD3 ARG A 41 6.726 8.774 -21.266 1.00 42.11 H new ATOM 0 HE ARG A 41 8.931 7.224 -22.390 1.00 62.55 H new ATOM 0 HH11 ARG A 41 5.435 7.699 -22.341 1.00 62.54 H new ATOM 0 HH12 ARG A 41 5.202 7.013 -23.952 1.00 62.54 H new ATOM 0 HH21 ARG A 41 8.627 6.346 -24.460 1.00 43.33 H new ATOM 0 HH22 ARG A 41 7.002 6.250 -25.147 1.00 43.33 H new ATOM 658 N SER A 42 9.781 10.424 -16.480 1.00 70.41 N ATOM 659 CA SER A 42 10.991 11.066 -15.978 1.00 61.23 C ATOM 660 C SER A 42 10.654 12.083 -14.892 1.00 5.23 C ATOM 661 O SER A 42 9.884 13.018 -15.117 1.00 13.14 O ATOM 662 CB SER A 42 11.743 11.751 -17.120 1.00 24.10 C ATOM 663 OG SER A 42 13.144 11.658 -16.936 1.00 12.30 O ATOM 0 H SER A 42 8.913 10.878 -16.195 1.00 70.41 H new ATOM 0 HA SER A 42 11.629 10.296 -15.545 1.00 61.23 H new ATOM 0 HB2 SER A 42 11.466 11.291 -18.069 1.00 24.10 H new ATOM 0 HB3 SER A 42 11.449 12.799 -17.176 1.00 24.10 H new ATOM 0 HG SER A 42 13.602 12.102 -17.680 1.00 12.30 H new ATOM 669 N THR A 43 11.236 11.895 -13.711 1.00 12.02 N ATOM 670 CA THR A 43 10.998 12.795 -12.590 1.00 14.23 C ATOM 671 C THR A 43 11.306 14.239 -12.968 1.00 53.01 C ATOM 672 O THR A 43 12.422 14.579 -13.362 1.00 0.33 O ATOM 673 CB THR A 43 11.849 12.405 -11.367 1.00 21.52 C ATOM 674 OG1 THR A 43 12.083 10.992 -11.364 1.00 2.04 O ATOM 675 CG2 THR A 43 11.158 12.813 -10.075 1.00 51.25 C ATOM 0 H THR A 43 11.876 11.127 -13.507 1.00 12.02 H new ATOM 0 HA THR A 43 9.942 12.707 -12.333 1.00 14.23 H new ATOM 0 HB THR A 43 12.802 12.930 -11.432 1.00 21.52 H new ATOM 0 HG1 THR A 43 12.626 10.752 -10.584 1.00 2.04 H new ATOM 0 HG21 THR A 43 11.778 12.527 -9.225 1.00 51.25 H new ATOM 0 HG22 THR A 43 11.008 13.893 -10.068 1.00 51.25 H new ATOM 0 HG23 THR A 43 10.193 12.312 -10.005 1.00 51.25 H new ATOM 683 N PRO A 44 10.294 15.111 -12.848 1.00 21.02 N ATOM 684 CA PRO A 44 10.433 16.535 -13.172 1.00 52.42 C ATOM 685 C PRO A 44 11.318 17.273 -12.173 1.00 70.25 C ATOM 686 O PRO A 44 11.649 16.760 -11.104 1.00 3.54 O ATOM 687 CB PRO A 44 8.995 17.057 -13.100 1.00 71.00 C ATOM 688 CG PRO A 44 8.298 16.121 -12.174 1.00 72.24 C ATOM 689 CD PRO A 44 8.937 14.776 -12.386 1.00 61.30 C ATOM 0 HA PRO A 44 10.909 16.688 -14.141 1.00 52.42 H new ATOM 0 HB2 PRO A 44 8.964 18.080 -12.726 1.00 71.00 H new ATOM 0 HB3 PRO A 44 8.526 17.063 -14.084 1.00 71.00 H new ATOM 0 HG2 PRO A 44 8.405 16.445 -11.139 1.00 72.24 H new ATOM 0 HG3 PRO A 44 7.230 16.084 -12.388 1.00 72.24 H new ATOM 0 HD2 PRO A 44 8.959 14.192 -11.466 1.00 61.30 H new ATOM 0 HD3 PRO A 44 8.395 14.186 -13.125 1.00 61.30 H new ATOM 697 N PRO A 45 11.710 18.505 -12.527 1.00 71.15 N ATOM 698 CA PRO A 45 12.561 19.340 -11.675 1.00 45.31 C ATOM 699 C PRO A 45 11.833 19.826 -10.426 1.00 45.42 C ATOM 700 O PRO A 45 10.666 19.497 -10.208 1.00 14.40 O ATOM 701 CB PRO A 45 12.917 20.523 -12.579 1.00 13.01 C ATOM 702 CG PRO A 45 11.802 20.596 -13.564 1.00 51.14 C ATOM 703 CD PRO A 45 11.353 19.179 -13.787 1.00 25.43 C ATOM 0 HA PRO A 45 13.428 18.792 -11.304 1.00 45.31 H new ATOM 0 HB2 PRO A 45 13.001 21.447 -12.007 1.00 13.01 H new ATOM 0 HB3 PRO A 45 13.875 20.367 -13.076 1.00 13.01 H new ATOM 0 HG2 PRO A 45 10.985 21.209 -13.184 1.00 51.14 H new ATOM 0 HG3 PRO A 45 12.135 21.051 -14.497 1.00 51.14 H new ATOM 0 HD2 PRO A 45 10.282 19.123 -13.983 1.00 25.43 H new ATOM 0 HD3 PRO A 45 11.858 18.727 -14.641 1.00 25.43 H new ATOM 711 N THR A 46 12.529 20.610 -9.607 1.00 13.11 N ATOM 712 CA THR A 46 11.948 21.138 -8.380 1.00 31.11 C ATOM 713 C THR A 46 11.221 22.453 -8.639 1.00 24.32 C ATOM 714 O THR A 46 10.237 22.771 -7.969 1.00 10.01 O ATOM 715 CB THR A 46 13.025 21.364 -7.301 1.00 23.32 C ATOM 716 OG1 THR A 46 13.865 20.209 -7.199 1.00 51.14 O ATOM 717 CG2 THR A 46 12.386 21.654 -5.951 1.00 20.13 C ATOM 0 H THR A 46 13.495 20.892 -9.772 1.00 13.11 H new ATOM 0 HA THR A 46 11.235 20.395 -8.022 1.00 31.11 H new ATOM 0 HB THR A 46 13.626 22.225 -7.593 1.00 23.32 H new ATOM 0 HG1 THR A 46 14.325 20.215 -6.334 1.00 51.14 H new ATOM 0 HG21 THR A 46 13.166 21.810 -5.205 1.00 20.13 H new ATOM 0 HG22 THR A 46 11.770 22.550 -6.025 1.00 20.13 H new ATOM 0 HG23 THR A 46 11.764 20.810 -5.654 1.00 20.13 H new ATOM 725 N ASP A 47 11.709 23.213 -9.613 1.00 42.22 N ATOM 726 CA ASP A 47 11.104 24.493 -9.960 1.00 11.00 C ATOM 727 C ASP A 47 9.713 24.292 -10.556 1.00 64.31 C ATOM 728 O ASP A 47 8.795 25.069 -10.291 1.00 65.11 O ATOM 729 CB ASP A 47 11.992 25.250 -10.950 1.00 53.22 C ATOM 730 CG ASP A 47 11.913 26.752 -10.766 1.00 65.03 C ATOM 731 OD1 ASP A 47 10.894 27.232 -10.225 1.00 21.44 O ATOM 732 OD2 ASP A 47 12.870 27.448 -11.164 1.00 61.13 O ATOM 0 H ASP A 47 12.522 22.965 -10.176 1.00 42.22 H new ATOM 0 HA ASP A 47 11.008 25.081 -9.047 1.00 11.00 H new ATOM 0 HB2 ASP A 47 13.025 24.926 -10.828 1.00 53.22 H new ATOM 0 HB3 ASP A 47 11.696 24.995 -11.968 1.00 53.22 H new ATOM 737 N VAL A 48 9.566 23.247 -11.363 1.00 60.11 N ATOM 738 CA VAL A 48 8.288 22.945 -11.996 1.00 45.24 C ATOM 739 C VAL A 48 7.377 22.167 -11.053 1.00 11.34 C ATOM 740 O VAL A 48 6.195 22.481 -10.917 1.00 1.53 O ATOM 741 CB VAL A 48 8.482 22.132 -13.291 1.00 14.52 C ATOM 742 CG1 VAL A 48 7.136 21.769 -13.900 1.00 74.34 C ATOM 743 CG2 VAL A 48 9.334 22.907 -14.284 1.00 62.30 C ATOM 0 H VAL A 48 10.316 22.595 -11.594 1.00 60.11 H new ATOM 0 HA VAL A 48 7.822 23.900 -12.240 1.00 45.24 H new ATOM 0 HB VAL A 48 9.004 21.207 -13.044 1.00 14.52 H new ATOM 0 HG11 VAL A 48 7.293 21.195 -14.813 1.00 74.34 H new ATOM 0 HG12 VAL A 48 6.565 21.171 -13.190 1.00 74.34 H new ATOM 0 HG13 VAL A 48 6.585 22.680 -14.134 1.00 74.34 H new ATOM 0 HG21 VAL A 48 9.461 22.318 -15.192 1.00 62.30 H new ATOM 0 HG22 VAL A 48 8.842 23.849 -14.528 1.00 62.30 H new ATOM 0 HG23 VAL A 48 10.310 23.111 -13.845 1.00 62.30 H new ATOM 753 N MET A 49 7.936 21.153 -10.402 1.00 23.51 N ATOM 754 CA MET A 49 7.174 20.332 -9.469 1.00 32.02 C ATOM 755 C MET A 49 6.390 21.203 -8.492 1.00 43.12 C ATOM 756 O MET A 49 5.191 21.008 -8.297 1.00 54.11 O ATOM 757 CB MET A 49 8.108 19.396 -8.698 1.00 51.33 C ATOM 758 CG MET A 49 7.411 18.610 -7.600 1.00 21.11 C ATOM 759 SD MET A 49 8.149 18.880 -5.977 1.00 71.53 S ATOM 760 CE MET A 49 7.270 20.348 -5.446 1.00 52.32 C ATOM 0 H MET A 49 8.914 20.880 -10.503 1.00 23.51 H new ATOM 0 HA MET A 49 6.467 19.735 -10.045 1.00 32.02 H new ATOM 0 HB2 MET A 49 8.567 18.698 -9.398 1.00 51.33 H new ATOM 0 HB3 MET A 49 8.914 19.983 -8.258 1.00 51.33 H new ATOM 0 HG2 MET A 49 6.359 18.893 -7.568 1.00 21.11 H new ATOM 0 HG3 MET A 49 7.448 17.547 -7.840 1.00 21.11 H new ATOM 0 HE1 MET A 49 7.137 20.321 -4.364 1.00 52.32 H new ATOM 0 HE2 MET A 49 7.843 21.234 -5.719 1.00 52.32 H new ATOM 0 HE3 MET A 49 6.294 20.383 -5.931 1.00 52.32 H new ATOM 770 N MET A 50 7.075 22.164 -7.883 1.00 13.33 N ATOM 771 CA MET A 50 6.442 23.066 -6.927 1.00 63.34 C ATOM 772 C MET A 50 5.416 23.958 -7.619 1.00 13.15 C ATOM 773 O MET A 50 4.428 24.371 -7.013 1.00 31.51 O ATOM 774 CB MET A 50 7.496 23.928 -6.230 1.00 63.11 C ATOM 775 CG MET A 50 8.135 24.963 -7.142 1.00 51.43 C ATOM 776 SD MET A 50 9.724 25.547 -6.523 1.00 41.12 S ATOM 777 CE MET A 50 9.380 25.670 -4.769 1.00 52.14 C ATOM 0 H MET A 50 8.068 22.339 -8.034 1.00 13.33 H new ATOM 0 HA MET A 50 5.927 22.461 -6.181 1.00 63.34 H new ATOM 0 HB2 MET A 50 7.035 24.437 -5.383 1.00 63.11 H new ATOM 0 HB3 MET A 50 8.275 23.280 -5.827 1.00 63.11 H new ATOM 0 HG2 MET A 50 8.272 24.532 -8.134 1.00 51.43 H new ATOM 0 HG3 MET A 50 7.459 25.811 -7.253 1.00 51.43 H new ATOM 0 HE1 MET A 50 10.149 26.276 -4.289 1.00 52.14 H new ATOM 0 HE2 MET A 50 8.406 26.136 -4.621 1.00 52.14 H new ATOM 0 HE3 MET A 50 9.376 24.673 -4.328 1.00 52.14 H new ATOM 787 N ASN A 51 5.658 24.252 -8.893 1.00 65.21 N ATOM 788 CA ASN A 51 4.754 25.095 -9.667 1.00 34.45 C ATOM 789 C ASN A 51 3.422 24.391 -9.905 1.00 20.22 C ATOM 790 O ASN A 51 2.445 25.015 -10.323 1.00 30.14 O ATOM 791 CB ASN A 51 5.393 25.468 -11.006 1.00 31.11 C ATOM 792 CG ASN A 51 6.022 26.848 -10.984 1.00 2.32 C ATOM 793 OD1 ASN A 51 5.443 27.797 -10.456 1.00 22.00 O ATOM 794 ND2 ASN A 51 7.213 26.964 -11.559 1.00 22.11 N ATOM 0 H ASN A 51 6.472 23.919 -9.410 1.00 65.21 H new ATOM 0 HA ASN A 51 4.566 26.004 -9.095 1.00 34.45 H new ATOM 0 HB2 ASN A 51 6.153 24.730 -11.260 1.00 31.11 H new ATOM 0 HB3 ASN A 51 4.636 25.429 -11.790 1.00 31.11 H new ATOM 0 HD21 ASN A 51 7.686 27.868 -11.575 1.00 22.11 H new ATOM 0 HD22 ASN A 51 7.655 26.149 -11.985 1.00 22.11 H new ATOM 801 N ILE A 52 3.390 23.091 -9.634 1.00 3.55 N ATOM 802 CA ILE A 52 2.177 22.303 -9.816 1.00 73.42 C ATOM 803 C ILE A 52 1.372 22.225 -8.524 1.00 71.13 C ATOM 804 O ILE A 52 0.141 22.215 -8.545 1.00 32.44 O ATOM 805 CB ILE A 52 2.499 20.875 -10.294 1.00 62.11 C ATOM 806 CG1 ILE A 52 3.459 20.917 -11.486 1.00 74.14 C ATOM 807 CG2 ILE A 52 1.220 20.139 -10.663 1.00 33.12 C ATOM 808 CD1 ILE A 52 3.154 22.026 -12.468 1.00 62.23 C ATOM 0 H ILE A 52 4.190 22.561 -9.288 1.00 3.55 H new ATOM 0 HA ILE A 52 1.585 22.808 -10.580 1.00 73.42 H new ATOM 0 HB ILE A 52 2.983 20.336 -9.480 1.00 62.11 H new ATOM 0 HG12 ILE A 52 4.478 21.039 -11.118 1.00 74.14 H new ATOM 0 HG13 ILE A 52 3.421 19.960 -12.007 1.00 74.14 H new ATOM 0 HG21 ILE A 52 1.464 19.131 -10.999 1.00 33.12 H new ATOM 0 HG22 ILE A 52 0.568 20.083 -9.791 1.00 33.12 H new ATOM 0 HG23 ILE A 52 0.710 20.675 -11.464 1.00 33.12 H new ATOM 0 HD11 ILE A 52 3.873 21.996 -13.286 1.00 62.23 H new ATOM 0 HD12 ILE A 52 2.147 21.894 -12.865 1.00 62.23 H new ATOM 0 HD13 ILE A 52 3.221 22.989 -11.962 1.00 62.23 H new ATOM 820 N LEU A 53 2.076 22.171 -7.398 1.00 51.45 N ATOM 821 CA LEU A 53 1.427 22.096 -6.093 1.00 74.54 C ATOM 822 C LEU A 53 1.111 23.490 -5.561 1.00 34.01 C ATOM 823 O LEU A 53 0.162 23.673 -4.799 1.00 42.22 O ATOM 824 CB LEU A 53 2.320 21.350 -5.101 1.00 74.22 C ATOM 825 CG LEU A 53 1.863 19.942 -4.714 1.00 41.43 C ATOM 826 CD1 LEU A 53 1.521 19.131 -5.954 1.00 53.22 C ATOM 827 CD2 LEU A 53 2.935 19.240 -3.893 1.00 13.23 C ATOM 0 H LEU A 53 3.095 22.178 -7.362 1.00 51.45 H new ATOM 0 HA LEU A 53 0.490 21.551 -6.211 1.00 74.54 H new ATOM 0 HB2 LEU A 53 3.322 21.282 -5.525 1.00 74.22 H new ATOM 0 HB3 LEU A 53 2.398 21.947 -4.193 1.00 74.22 H new ATOM 0 HG LEU A 53 0.964 20.028 -4.103 1.00 41.43 H new ATOM 0 HD11 LEU A 53 1.198 18.133 -5.658 1.00 53.22 H new ATOM 0 HD12 LEU A 53 0.718 19.625 -6.502 1.00 53.22 H new ATOM 0 HD13 LEU A 53 2.401 19.053 -6.592 1.00 53.22 H new ATOM 0 HD21 LEU A 53 2.593 18.240 -3.627 1.00 13.23 H new ATOM 0 HD22 LEU A 53 3.851 19.166 -4.478 1.00 13.23 H new ATOM 0 HD23 LEU A 53 3.130 19.811 -2.985 1.00 13.23 H new ATOM 839 N GLN A 54 1.912 24.470 -5.970 1.00 35.22 N ATOM 840 CA GLN A 54 1.715 25.847 -5.534 1.00 5.24 C ATOM 841 C GLN A 54 0.325 26.345 -5.915 1.00 40.02 C ATOM 842 O GLN A 54 -0.193 27.289 -5.317 1.00 11.30 O ATOM 843 CB GLN A 54 2.781 26.755 -6.150 1.00 13.40 C ATOM 844 CG GLN A 54 2.602 26.980 -7.642 1.00 75.21 C ATOM 845 CD GLN A 54 3.519 28.058 -8.186 1.00 20.35 C ATOM 846 OE1 GLN A 54 4.778 28.030 -7.768 1.00 45.45 O flip ATOM 847 NE2 GLN A 54 3.098 28.908 -8.972 1.00 73.44 N flip ATOM 0 H GLN A 54 2.702 24.336 -6.601 1.00 35.22 H new ATOM 0 HA GLN A 54 1.806 25.875 -4.448 1.00 5.24 H new ATOM 0 HB2 GLN A 54 2.763 27.719 -5.641 1.00 13.40 H new ATOM 0 HB3 GLN A 54 3.764 26.319 -5.972 1.00 13.40 H new ATOM 0 HG2 GLN A 54 2.792 26.046 -8.171 1.00 75.21 H new ATOM 0 HG3 GLN A 54 1.566 27.255 -7.842 1.00 75.21 H new ATOM 0 HE21 GLN A 54 2.122 28.891 -9.267 1.00 73.44 H new ATOM 0 HE22 GLN A 54 3.726 29.629 -9.328 1.00 73.44 H new ATOM 856 N THR A 55 -0.275 25.706 -6.914 1.00 23.53 N ATOM 857 CA THR A 55 -1.605 26.084 -7.376 1.00 24.25 C ATOM 858 C THR A 55 -2.607 26.077 -6.228 1.00 71.25 C ATOM 859 O THR A 55 -2.463 25.345 -5.249 1.00 30.33 O ATOM 860 CB THR A 55 -2.105 25.139 -8.485 1.00 54.30 C ATOM 861 OG1 THR A 55 -2.295 23.822 -7.956 1.00 42.52 O ATOM 862 CG2 THR A 55 -1.116 25.090 -9.640 1.00 51.14 C ATOM 0 H THR A 55 0.140 24.923 -7.419 1.00 23.53 H new ATOM 0 HA THR A 55 -1.525 27.094 -7.779 1.00 24.25 H new ATOM 0 HB THR A 55 -3.055 25.521 -8.858 1.00 54.30 H new ATOM 0 HG1 THR A 55 -1.523 23.263 -8.184 1.00 42.52 H new ATOM 0 HG21 THR A 55 -1.490 24.417 -10.411 1.00 51.14 H new ATOM 0 HG22 THR A 55 -0.995 26.089 -10.058 1.00 51.14 H new ATOM 0 HG23 THR A 55 -0.153 24.729 -9.279 1.00 51.14 H new ATOM 870 N PRO A 56 -3.651 26.912 -6.348 1.00 53.52 N ATOM 871 CA PRO A 56 -4.699 27.019 -5.328 1.00 12.33 C ATOM 872 C PRO A 56 -5.577 25.774 -5.267 1.00 31.34 C ATOM 873 O PRO A 56 -6.151 25.460 -4.225 1.00 43.31 O ATOM 874 CB PRO A 56 -5.518 28.229 -5.789 1.00 41.51 C ATOM 875 CG PRO A 56 -5.291 28.302 -7.259 1.00 31.12 C ATOM 876 CD PRO A 56 -3.886 27.815 -7.487 1.00 2.04 C ATOM 0 HA PRO A 56 -4.284 27.124 -4.325 1.00 12.33 H new ATOM 0 HB2 PRO A 56 -6.576 28.103 -5.558 1.00 41.51 H new ATOM 0 HB3 PRO A 56 -5.190 29.142 -5.292 1.00 41.51 H new ATOM 0 HG2 PRO A 56 -6.010 27.683 -7.796 1.00 31.12 H new ATOM 0 HG3 PRO A 56 -5.414 29.322 -7.622 1.00 31.12 H new ATOM 0 HD2 PRO A 56 -3.791 27.294 -8.440 1.00 2.04 H new ATOM 0 HD3 PRO A 56 -3.172 28.639 -7.501 1.00 2.04 H new ATOM 884 N GLN A 57 -5.677 25.070 -6.389 1.00 54.13 N ATOM 885 CA GLN A 57 -6.486 23.859 -6.462 1.00 35.45 C ATOM 886 C GLN A 57 -5.758 22.680 -5.825 1.00 15.23 C ATOM 887 O GLN A 57 -6.381 21.802 -5.226 1.00 55.15 O ATOM 888 CB GLN A 57 -6.830 23.536 -7.917 1.00 31.22 C ATOM 889 CG GLN A 57 -5.684 22.898 -8.686 1.00 70.00 C ATOM 890 CD GLN A 57 -5.933 22.864 -10.181 1.00 22.24 C ATOM 891 OE1 GLN A 57 -5.039 23.155 -10.977 1.00 74.05 O ATOM 892 NE2 GLN A 57 -7.150 22.508 -10.571 1.00 50.03 N ATOM 0 H GLN A 57 -5.208 25.317 -7.260 1.00 54.13 H new ATOM 0 HA GLN A 57 -7.409 24.035 -5.909 1.00 35.45 H new ATOM 0 HB2 GLN A 57 -7.689 22.865 -7.938 1.00 31.22 H new ATOM 0 HB3 GLN A 57 -7.130 24.454 -8.423 1.00 31.22 H new ATOM 0 HG2 GLN A 57 -4.766 23.450 -8.487 1.00 70.00 H new ATOM 0 HG3 GLN A 57 -5.530 21.882 -8.324 1.00 70.00 H new ATOM 0 HE21 GLN A 57 -7.860 22.275 -9.877 1.00 50.03 H new ATOM 0 HE22 GLN A 57 -7.375 22.467 -11.565 1.00 50.03 H new ATOM 901 N PHE A 58 -4.436 22.664 -5.958 1.00 44.33 N ATOM 902 CA PHE A 58 -3.623 21.592 -5.398 1.00 12.11 C ATOM 903 C PHE A 58 -2.843 22.080 -4.181 1.00 32.20 C ATOM 904 O PHE A 58 -1.725 21.632 -3.923 1.00 14.11 O ATOM 905 CB PHE A 58 -2.656 21.050 -6.453 1.00 65.32 C ATOM 906 CG PHE A 58 -3.345 20.419 -7.629 1.00 64.12 C ATOM 907 CD1 PHE A 58 -4.141 19.298 -7.463 1.00 14.53 C ATOM 908 CD2 PHE A 58 -3.197 20.949 -8.901 1.00 54.23 C ATOM 909 CE1 PHE A 58 -4.776 18.715 -8.545 1.00 51.05 C ATOM 910 CE2 PHE A 58 -3.830 20.371 -9.986 1.00 13.32 C ATOM 911 CZ PHE A 58 -4.620 19.253 -9.807 1.00 14.14 C ATOM 0 H PHE A 58 -3.905 23.383 -6.450 1.00 44.33 H new ATOM 0 HA PHE A 58 -4.292 20.791 -5.083 1.00 12.11 H new ATOM 0 HB2 PHE A 58 -2.023 21.864 -6.807 1.00 65.32 H new ATOM 0 HB3 PHE A 58 -1.999 20.314 -5.989 1.00 65.32 H new ATOM 0 HD1 PHE A 58 -4.267 18.874 -6.478 1.00 14.53 H new ATOM 0 HD2 PHE A 58 -2.580 21.824 -9.046 1.00 54.23 H new ATOM 0 HE1 PHE A 58 -5.393 17.840 -8.403 1.00 51.05 H new ATOM 0 HE2 PHE A 58 -3.707 20.794 -10.972 1.00 13.32 H new ATOM 0 HZ PHE A 58 -5.115 18.800 -10.653 1.00 14.14 H new ATOM 921 N THR A 59 -3.441 23.003 -3.433 1.00 4.20 N ATOM 922 CA THR A 59 -2.805 23.553 -2.244 1.00 22.31 C ATOM 923 C THR A 59 -2.943 22.608 -1.057 1.00 21.11 C ATOM 924 O THR A 59 -2.036 22.493 -0.232 1.00 21.14 O ATOM 925 CB THR A 59 -3.404 24.921 -1.868 1.00 62.34 C ATOM 926 OG1 THR A 59 -2.722 25.460 -0.730 1.00 4.22 O ATOM 927 CG2 THR A 59 -4.889 24.795 -1.562 1.00 32.12 C ATOM 0 H THR A 59 -4.366 23.385 -3.631 1.00 4.20 H new ATOM 0 HA THR A 59 -1.749 23.679 -2.482 1.00 22.31 H new ATOM 0 HB THR A 59 -3.279 25.593 -2.717 1.00 62.34 H new ATOM 0 HG1 THR A 59 -3.108 26.330 -0.499 1.00 4.22 H new ATOM 0 HG21 THR A 59 -5.291 25.774 -1.299 1.00 32.12 H new ATOM 0 HG22 THR A 59 -5.410 24.413 -2.440 1.00 32.12 H new ATOM 0 HG23 THR A 59 -5.032 24.108 -0.728 1.00 32.12 H new ATOM 935 N LYS A 60 -4.082 21.929 -0.976 1.00 35.52 N ATOM 936 CA LYS A 60 -4.340 20.990 0.108 1.00 52.53 C ATOM 937 C LYS A 60 -3.485 19.736 -0.043 1.00 41.24 C ATOM 938 O LYS A 60 -3.293 18.984 0.913 1.00 22.22 O ATOM 939 CB LYS A 60 -5.822 20.609 0.140 1.00 75.42 C ATOM 940 CG LYS A 60 -6.346 20.096 -1.190 1.00 41.34 C ATOM 941 CD LYS A 60 -7.846 19.855 -1.142 1.00 60.34 C ATOM 942 CE LYS A 60 -8.606 21.133 -0.822 1.00 4.52 C ATOM 943 NZ LYS A 60 -9.253 21.073 0.518 1.00 64.02 N ATOM 0 H LYS A 60 -4.843 22.012 -1.650 1.00 35.52 H new ATOM 0 HA LYS A 60 -4.077 21.477 1.047 1.00 52.53 H new ATOM 0 HB2 LYS A 60 -5.976 19.844 0.901 1.00 75.42 H new ATOM 0 HB3 LYS A 60 -6.406 21.479 0.440 1.00 75.42 H new ATOM 0 HG2 LYS A 60 -6.117 20.817 -1.975 1.00 41.34 H new ATOM 0 HG3 LYS A 60 -5.836 19.169 -1.450 1.00 41.34 H new ATOM 0 HD2 LYS A 60 -8.183 19.460 -2.101 1.00 60.34 H new ATOM 0 HD3 LYS A 60 -8.070 19.099 -0.389 1.00 60.34 H new ATOM 0 HE2 LYS A 60 -7.922 21.981 -0.857 1.00 4.52 H new ATOM 0 HE3 LYS A 60 -9.366 21.304 -1.585 1.00 4.52 H new ATOM 0 HZ1 LYS A 60 -9.761 21.963 0.699 1.00 64.02 H new ATOM 0 HZ2 LYS A 60 -9.925 20.280 0.544 1.00 64.02 H new ATOM 0 HZ3 LYS A 60 -8.526 20.935 1.249 1.00 64.02 H new ATOM 957 N TYR A 61 -2.972 19.518 -1.249 1.00 14.05 N ATOM 958 CA TYR A 61 -2.138 18.354 -1.525 1.00 71.14 C ATOM 959 C TYR A 61 -0.684 18.763 -1.737 1.00 30.13 C ATOM 960 O TYR A 61 -0.122 18.569 -2.816 1.00 60.54 O ATOM 961 CB TYR A 61 -2.655 17.610 -2.758 1.00 71.25 C ATOM 962 CG TYR A 61 -4.164 17.541 -2.835 1.00 2.03 C ATOM 963 CD1 TYR A 61 -4.884 16.699 -1.997 1.00 2.40 C ATOM 964 CD2 TYR A 61 -4.869 18.317 -3.747 1.00 71.04 C ATOM 965 CE1 TYR A 61 -6.262 16.631 -2.064 1.00 73.23 C ATOM 966 CE2 TYR A 61 -6.248 18.258 -3.819 1.00 44.31 C ATOM 967 CZ TYR A 61 -6.939 17.414 -2.976 1.00 4.15 C ATOM 968 OH TYR A 61 -8.312 17.350 -3.047 1.00 1.43 O ATOM 0 H TYR A 61 -3.119 20.132 -2.050 1.00 14.05 H new ATOM 0 HA TYR A 61 -2.188 17.691 -0.661 1.00 71.14 H new ATOM 0 HB2 TYR A 61 -2.276 18.101 -3.654 1.00 71.25 H new ATOM 0 HB3 TYR A 61 -2.253 16.597 -2.756 1.00 71.25 H new ATOM 0 HD1 TYR A 61 -4.357 16.087 -1.280 1.00 2.40 H new ATOM 0 HD2 TYR A 61 -4.330 18.977 -4.411 1.00 71.04 H new ATOM 0 HE1 TYR A 61 -6.806 15.969 -1.407 1.00 73.23 H new ATOM 0 HE2 TYR A 61 -6.781 18.870 -4.532 1.00 44.31 H new ATOM 0 HH TYR A 61 -8.633 17.965 -3.740 1.00 1.43 H new ATOM 978 N THR A 62 -0.079 19.331 -0.699 1.00 71.44 N ATOM 979 CA THR A 62 1.309 19.770 -0.770 1.00 10.10 C ATOM 980 C THR A 62 2.248 18.719 -0.189 1.00 71.52 C ATOM 981 O THR A 62 3.017 18.089 -0.917 1.00 70.23 O ATOM 982 CB THR A 62 1.517 21.099 -0.019 1.00 54.41 C ATOM 983 OG1 THR A 62 0.269 21.570 0.500 1.00 54.14 O ATOM 984 CG2 THR A 62 2.120 22.151 -0.938 1.00 32.11 C ATOM 0 H THR A 62 -0.529 19.498 0.201 1.00 71.44 H new ATOM 0 HA THR A 62 1.541 19.917 -1.825 1.00 10.10 H new ATOM 0 HB THR A 62 2.208 20.920 0.805 1.00 54.41 H new ATOM 0 HG1 THR A 62 -0.325 21.809 -0.242 1.00 54.14 H new ATOM 0 HG21 THR A 62 2.258 23.081 -0.386 1.00 32.11 H new ATOM 0 HG22 THR A 62 3.084 21.802 -1.307 1.00 32.11 H new ATOM 0 HG23 THR A 62 1.450 22.325 -1.780 1.00 32.11 H new ATOM 992 N LEU A 63 2.179 18.531 1.124 1.00 70.40 N ATOM 993 CA LEU A 63 3.023 17.554 1.803 1.00 22.45 C ATOM 994 C LEU A 63 2.219 16.321 2.197 1.00 21.32 C ATOM 995 O LEU A 63 2.744 15.397 2.819 1.00 24.35 O ATOM 996 CB LEU A 63 3.663 18.179 3.044 1.00 14.53 C ATOM 997 CG LEU A 63 2.866 18.057 4.343 1.00 33.33 C ATOM 998 CD1 LEU A 63 3.412 16.927 5.201 1.00 44.54 C ATOM 999 CD2 LEU A 63 2.891 19.371 5.110 1.00 34.14 C ATOM 0 H LEU A 63 1.547 19.042 1.740 1.00 70.40 H new ATOM 0 HA LEU A 63 3.809 17.247 1.113 1.00 22.45 H new ATOM 0 HB2 LEU A 63 4.639 17.719 3.196 1.00 14.53 H new ATOM 0 HB3 LEU A 63 3.836 19.237 2.845 1.00 14.53 H new ATOM 0 HG LEU A 63 1.831 17.826 4.091 1.00 33.33 H new ATOM 0 HD11 LEU A 63 2.832 16.856 6.121 1.00 44.54 H new ATOM 0 HD12 LEU A 63 3.341 15.987 4.653 1.00 44.54 H new ATOM 0 HD13 LEU A 63 4.456 17.127 5.445 1.00 44.54 H new ATOM 0 HD21 LEU A 63 2.319 19.265 6.032 1.00 34.14 H new ATOM 0 HD22 LEU A 63 3.921 19.632 5.351 1.00 34.14 H new ATOM 0 HD23 LEU A 63 2.451 20.158 4.498 1.00 34.14 H new ATOM 1011 N TRP A 64 0.942 16.311 1.831 1.00 4.53 N ATOM 1012 CA TRP A 64 0.065 15.190 2.145 1.00 50.12 C ATOM 1013 C TRP A 64 0.676 13.873 1.677 1.00 52.11 C ATOM 1014 O TRP A 64 0.377 12.810 2.221 1.00 52.14 O ATOM 1015 CB TRP A 64 -1.305 15.389 1.496 1.00 45.11 C ATOM 1016 CG TRP A 64 -1.458 14.663 0.194 1.00 5.32 C ATOM 1017 CD1 TRP A 64 -2.293 13.615 -0.067 1.00 25.31 C ATOM 1018 CD2 TRP A 64 -0.754 14.931 -1.024 1.00 40.31 C ATOM 1019 NE1 TRP A 64 -2.150 13.214 -1.374 1.00 23.33 N ATOM 1020 CE2 TRP A 64 -1.213 14.007 -1.982 1.00 24.22 C ATOM 1021 CE3 TRP A 64 0.218 15.862 -1.399 1.00 53.41 C ATOM 1022 CZ2 TRP A 64 -0.731 13.988 -3.289 1.00 70.32 C ATOM 1023 CZ3 TRP A 64 0.695 15.843 -2.696 1.00 55.11 C ATOM 1024 CH2 TRP A 64 0.219 14.911 -3.628 1.00 13.15 C ATOM 0 H TRP A 64 0.491 17.067 1.316 1.00 4.53 H new ATOM 0 HA TRP A 64 -0.056 15.149 3.227 1.00 50.12 H new ATOM 0 HB2 TRP A 64 -2.078 15.050 2.186 1.00 45.11 H new ATOM 0 HB3 TRP A 64 -1.470 16.454 1.331 1.00 45.11 H new ATOM 0 HD1 TRP A 64 -2.967 13.167 0.648 1.00 25.31 H new ATOM 0 HE1 TRP A 64 -2.659 12.450 -1.819 1.00 23.33 H new ATOM 0 HE3 TRP A 64 0.590 16.584 -0.687 1.00 53.41 H new ATOM 0 HZ2 TRP A 64 -1.095 13.270 -4.009 1.00 70.32 H new ATOM 0 HZ3 TRP A 64 1.447 16.558 -2.996 1.00 55.11 H new ATOM 0 HH2 TRP A 64 0.611 14.922 -4.634 1.00 13.15 H new ATOM 1035 N PHE A 65 1.534 13.951 0.665 1.00 21.42 N ATOM 1036 CA PHE A 65 2.187 12.765 0.122 1.00 54.41 C ATOM 1037 C PHE A 65 3.705 12.904 0.184 1.00 55.14 C ATOM 1038 O PHE A 65 4.425 11.912 0.292 1.00 43.01 O ATOM 1039 CB PHE A 65 1.742 12.528 -1.322 1.00 0.51 C ATOM 1040 CG PHE A 65 0.806 11.364 -1.479 1.00 35.13 C ATOM 1041 CD1 PHE A 65 -0.181 11.121 -0.536 1.00 1.23 C ATOM 1042 CD2 PHE A 65 0.913 10.513 -2.567 1.00 72.04 C ATOM 1043 CE1 PHE A 65 -1.045 10.050 -0.678 1.00 74.41 C ATOM 1044 CE2 PHE A 65 0.052 9.442 -2.712 1.00 63.43 C ATOM 1045 CZ PHE A 65 -0.926 9.210 -1.767 1.00 12.20 C ATOM 0 H PHE A 65 1.793 14.823 0.204 1.00 21.42 H new ATOM 0 HA PHE A 65 1.894 11.909 0.729 1.00 54.41 H new ATOM 0 HB2 PHE A 65 1.255 13.428 -1.696 1.00 0.51 H new ATOM 0 HB3 PHE A 65 2.623 12.362 -1.942 1.00 0.51 H new ATOM 0 HD1 PHE A 65 -0.276 11.775 0.318 1.00 1.23 H new ATOM 0 HD2 PHE A 65 1.677 10.689 -3.310 1.00 72.04 H new ATOM 0 HE1 PHE A 65 -1.811 9.871 0.062 1.00 74.41 H new ATOM 0 HE2 PHE A 65 0.145 8.786 -3.565 1.00 63.43 H new ATOM 0 HZ PHE A 65 -1.598 8.372 -1.879 1.00 12.20 H new ATOM 1055 N MET A 66 4.183 14.142 0.112 1.00 21.31 N ATOM 1056 CA MET A 66 5.615 14.411 0.161 1.00 54.24 C ATOM 1057 C MET A 66 6.257 13.729 1.365 1.00 62.12 C ATOM 1058 O MET A 66 7.355 13.180 1.269 1.00 43.23 O ATOM 1059 CB MET A 66 5.871 15.918 0.217 1.00 0.42 C ATOM 1060 CG MET A 66 7.126 16.350 -0.524 1.00 60.21 C ATOM 1061 SD MET A 66 8.228 17.347 0.498 1.00 74.33 S ATOM 1062 CE MET A 66 8.881 16.101 1.606 1.00 12.21 C ATOM 0 H MET A 66 3.600 14.974 0.020 1.00 21.31 H new ATOM 0 HA MET A 66 6.066 14.007 -0.745 1.00 54.24 H new ATOM 0 HB2 MET A 66 5.012 16.440 -0.205 1.00 0.42 H new ATOM 0 HB3 MET A 66 5.950 16.226 1.260 1.00 0.42 H new ATOM 0 HG2 MET A 66 7.660 15.466 -0.872 1.00 60.21 H new ATOM 0 HG3 MET A 66 6.843 16.920 -1.409 1.00 60.21 H new ATOM 0 HE1 MET A 66 8.615 16.352 2.633 1.00 12.21 H new ATOM 0 HE2 MET A 66 8.460 15.129 1.349 1.00 12.21 H new ATOM 0 HE3 MET A 66 9.966 16.063 1.512 1.00 12.21 H new ATOM 1072 N THR A 67 5.565 13.767 2.499 1.00 35.53 N ATOM 1073 CA THR A 67 6.068 13.155 3.722 1.00 25.30 C ATOM 1074 C THR A 67 5.045 12.195 4.317 1.00 54.02 C ATOM 1075 O THR A 67 5.240 11.663 5.409 1.00 4.44 O ATOM 1076 CB THR A 67 6.429 14.219 4.776 1.00 34.44 C ATOM 1077 OG1 THR A 67 7.103 15.318 4.152 1.00 54.41 O ATOM 1078 CG2 THR A 67 7.313 13.627 5.863 1.00 3.14 C ATOM 0 H THR A 67 4.654 14.216 2.596 1.00 35.53 H new ATOM 0 HA THR A 67 6.968 12.602 3.451 1.00 25.30 H new ATOM 0 HB THR A 67 5.505 14.572 5.234 1.00 34.44 H new ATOM 0 HG1 THR A 67 7.327 15.991 4.828 1.00 54.41 H new ATOM 0 HG21 THR A 67 7.554 14.397 6.595 1.00 3.14 H new ATOM 0 HG22 THR A 67 6.786 12.810 6.356 1.00 3.14 H new ATOM 0 HG23 THR A 67 8.233 13.249 5.418 1.00 3.14 H new ATOM 1086 N ASN A 68 3.954 11.975 3.590 1.00 30.33 N ATOM 1087 CA ASN A 68 2.899 11.078 4.047 1.00 74.32 C ATOM 1088 C ASN A 68 2.256 11.600 5.328 1.00 52.13 C ATOM 1089 O ASN A 68 2.002 10.838 6.261 1.00 64.53 O ATOM 1090 CB ASN A 68 3.461 9.674 4.280 1.00 33.53 C ATOM 1091 CG ASN A 68 4.345 9.208 3.140 1.00 60.54 C ATOM 1092 OD1 ASN A 68 3.866 8.944 2.037 1.00 41.20 O ATOM 1093 ND2 ASN A 68 5.643 9.105 3.400 1.00 22.32 N ATOM 0 H ASN A 68 3.778 12.406 2.682 1.00 30.33 H new ATOM 0 HA ASN A 68 2.134 11.033 3.272 1.00 74.32 H new ATOM 0 HB2 ASN A 68 4.034 9.664 5.207 1.00 33.53 H new ATOM 0 HB3 ASN A 68 2.637 8.972 4.407 1.00 33.53 H new ATOM 0 HD21 ASN A 68 6.286 8.797 2.671 1.00 22.32 H new ATOM 0 HD22 ASN A 68 5.997 9.334 4.329 1.00 22.32 H new ATOM 1100 N GLN A 69 1.998 12.903 5.365 1.00 44.34 N ATOM 1101 CA GLN A 69 1.385 13.526 6.533 1.00 22.34 C ATOM 1102 C GLN A 69 0.337 14.552 6.115 1.00 11.24 C ATOM 1103 O GLN A 69 0.663 15.586 5.532 1.00 12.43 O ATOM 1104 CB GLN A 69 2.453 14.196 7.398 1.00 24.40 C ATOM 1105 CG GLN A 69 1.898 14.847 8.656 1.00 53.41 C ATOM 1106 CD GLN A 69 1.700 13.856 9.786 1.00 3.24 C ATOM 1107 OE1 GLN A 69 2.652 13.234 10.256 1.00 30.13 O ATOM 1108 NE2 GLN A 69 0.456 13.705 10.229 1.00 3.22 N ATOM 0 H GLN A 69 2.203 13.547 4.601 1.00 44.34 H new ATOM 0 HA GLN A 69 0.893 12.746 7.114 1.00 22.34 H new ATOM 0 HB2 GLN A 69 3.198 13.452 7.682 1.00 24.40 H new ATOM 0 HB3 GLN A 69 2.968 14.952 6.805 1.00 24.40 H new ATOM 0 HG2 GLN A 69 2.577 15.634 8.983 1.00 53.41 H new ATOM 0 HG3 GLN A 69 0.945 15.323 8.424 1.00 53.41 H new ATOM 0 HE21 GLN A 69 -0.303 14.242 9.810 1.00 3.22 H new ATOM 0 HE22 GLN A 69 0.261 13.053 10.988 1.00 3.22 H new ATOM 1117 N ILE A 70 -0.924 14.257 6.414 1.00 53.02 N ATOM 1118 CA ILE A 70 -2.020 15.155 6.070 1.00 1.12 C ATOM 1119 C ILE A 70 -2.142 16.288 7.082 1.00 5.32 C ATOM 1120 O ILE A 70 -2.206 16.052 8.289 1.00 35.42 O ATOM 1121 CB ILE A 70 -3.362 14.401 5.995 1.00 22.12 C ATOM 1122 CG1 ILE A 70 -3.617 13.640 7.297 1.00 23.30 C ATOM 1123 CG2 ILE A 70 -3.370 13.450 4.808 1.00 74.23 C ATOM 1124 CD1 ILE A 70 -4.816 14.145 8.067 1.00 41.24 C ATOM 0 H ILE A 70 -1.212 13.404 6.893 1.00 53.02 H new ATOM 0 HA ILE A 70 -1.791 15.572 5.089 1.00 1.12 H new ATOM 0 HB ILE A 70 -4.163 15.127 5.858 1.00 22.12 H new ATOM 0 HG12 ILE A 70 -3.760 12.584 7.069 1.00 23.30 H new ATOM 0 HG13 ILE A 70 -2.732 13.712 7.930 1.00 23.30 H new ATOM 0 HG21 ILE A 70 -4.324 12.925 4.769 1.00 74.23 H new ATOM 0 HG22 ILE A 70 -3.229 14.016 3.887 1.00 74.23 H new ATOM 0 HG23 ILE A 70 -2.562 12.726 4.916 1.00 74.23 H new ATOM 0 HD11 ILE A 70 -4.936 13.559 8.978 1.00 41.24 H new ATOM 0 HD12 ILE A 70 -4.667 15.193 8.326 1.00 41.24 H new ATOM 0 HD13 ILE A 70 -5.711 14.047 7.452 1.00 41.24 H new ATOM 1136 N ALA A 71 -2.175 17.519 6.583 1.00 53.21 N ATOM 1137 CA ALA A 71 -2.293 18.690 7.443 1.00 71.32 C ATOM 1138 C ALA A 71 -3.634 19.386 7.242 1.00 23.44 C ATOM 1139 O ALA A 71 -3.729 20.431 6.599 1.00 55.01 O ATOM 1140 CB ALA A 71 -1.149 19.657 7.178 1.00 72.44 C ATOM 0 H ALA A 71 -2.122 17.731 5.587 1.00 53.21 H new ATOM 0 HA ALA A 71 -2.239 18.356 8.479 1.00 71.32 H new ATOM 0 HB1 ALA A 71 -1.250 20.527 7.827 1.00 72.44 H new ATOM 0 HB2 ALA A 71 -0.199 19.161 7.380 1.00 72.44 H new ATOM 0 HB3 ALA A 71 -1.177 19.977 6.136 1.00 72.44 H new ATOM 1146 N PRO A 72 -4.699 18.794 7.803 1.00 32.32 N ATOM 1147 CA PRO A 72 -6.056 19.340 7.699 1.00 40.23 C ATOM 1148 C PRO A 72 -6.226 20.627 8.500 1.00 33.14 C ATOM 1149 O PRO A 72 -7.131 21.417 8.235 1.00 11.03 O ATOM 1150 CB PRO A 72 -6.932 18.228 8.280 1.00 14.40 C ATOM 1151 CG PRO A 72 -6.032 17.478 9.199 1.00 21.53 C ATOM 1152 CD PRO A 72 -4.661 17.545 8.583 1.00 55.43 C ATOM 0 HA PRO A 72 -6.310 19.608 6.673 1.00 40.23 H new ATOM 0 HB2 PRO A 72 -7.790 18.638 8.813 1.00 14.40 H new ATOM 0 HB3 PRO A 72 -7.324 17.582 7.495 1.00 14.40 H new ATOM 0 HG2 PRO A 72 -6.034 17.921 10.195 1.00 21.53 H new ATOM 0 HG3 PRO A 72 -6.360 16.444 9.309 1.00 21.53 H new ATOM 0 HD2 PRO A 72 -3.880 17.569 9.343 1.00 55.43 H new ATOM 0 HD3 PRO A 72 -4.463 16.681 7.949 1.00 55.43 H new ATOM 1160 N GLU A 73 -5.350 20.828 9.479 1.00 23.32 N ATOM 1161 CA GLU A 73 -5.405 22.020 10.318 1.00 5.13 C ATOM 1162 C GLU A 73 -5.305 23.286 9.473 1.00 20.24 C ATOM 1163 O GLU A 73 -5.763 24.354 9.879 1.00 42.23 O ATOM 1164 CB GLU A 73 -4.279 21.993 11.354 1.00 31.42 C ATOM 1165 CG GLU A 73 -4.772 22.028 12.791 1.00 1.34 C ATOM 1166 CD GLU A 73 -5.742 20.904 13.102 1.00 12.40 C ATOM 1167 OE1 GLU A 73 -5.280 19.822 13.521 1.00 62.13 O ATOM 1168 OE2 GLU A 73 -6.961 21.106 12.925 1.00 50.44 O ATOM 0 H GLU A 73 -4.595 20.182 9.711 1.00 23.32 H new ATOM 0 HA GLU A 73 -6.365 22.026 10.835 1.00 5.13 H new ATOM 0 HB2 GLU A 73 -3.682 21.093 11.206 1.00 31.42 H new ATOM 0 HB3 GLU A 73 -3.620 22.845 11.184 1.00 31.42 H new ATOM 0 HG2 GLU A 73 -3.918 21.964 13.466 1.00 1.34 H new ATOM 0 HG3 GLU A 73 -5.257 22.985 12.982 1.00 1.34 H new ATOM 1175 N SER A 74 -4.701 23.158 8.296 1.00 3.44 N ATOM 1176 CA SER A 74 -4.536 24.292 7.394 1.00 51.31 C ATOM 1177 C SER A 74 -5.277 24.055 6.082 1.00 0.10 C ATOM 1178 O SER A 74 -5.130 24.818 5.127 1.00 72.23 O ATOM 1179 CB SER A 74 -3.051 24.539 7.118 1.00 74.54 C ATOM 1180 OG SER A 74 -2.367 24.912 8.301 1.00 24.41 O ATOM 0 H SER A 74 -4.318 22.280 7.945 1.00 3.44 H new ATOM 0 HA SER A 74 -4.960 25.173 7.876 1.00 51.31 H new ATOM 0 HB2 SER A 74 -2.600 23.638 6.703 1.00 74.54 H new ATOM 0 HB3 SER A 74 -2.943 25.324 6.369 1.00 74.54 H new ATOM 0 HG SER A 74 -1.839 25.720 8.133 1.00 24.41 H new ATOM 1186 N GLY A 75 -6.075 22.993 6.043 1.00 44.22 N ATOM 1187 CA GLY A 75 -6.828 22.673 4.845 1.00 41.33 C ATOM 1188 C GLY A 75 -6.042 21.805 3.881 1.00 61.32 C ATOM 1189 O GLY A 75 -6.044 22.050 2.674 1.00 21.02 O ATOM 0 H GLY A 75 -6.214 22.348 6.821 1.00 44.22 H new ATOM 0 HA2 GLY A 75 -7.748 22.160 5.124 1.00 41.33 H new ATOM 0 HA3 GLY A 75 -7.118 23.597 4.344 1.00 41.33 H new ATOM 1193 N GLN A 76 -5.370 20.791 4.414 1.00 43.44 N ATOM 1194 CA GLN A 76 -4.575 19.885 3.593 1.00 71.34 C ATOM 1195 C GLN A 76 -4.882 18.431 3.933 1.00 22.20 C ATOM 1196 O GLN A 76 -4.636 17.980 5.053 1.00 15.14 O ATOM 1197 CB GLN A 76 -3.084 20.163 3.786 1.00 1.44 C ATOM 1198 CG GLN A 76 -2.752 21.642 3.917 1.00 0.22 C ATOM 1199 CD GLN A 76 -1.512 22.032 3.137 1.00 70.30 C ATOM 1200 OE1 GLN A 76 -0.489 21.350 3.193 1.00 4.14 O ATOM 1201 NE2 GLN A 76 -1.596 23.136 2.403 1.00 55.24 N ATOM 0 H GLN A 76 -5.360 20.576 5.411 1.00 43.44 H new ATOM 0 HA GLN A 76 -4.837 20.057 2.549 1.00 71.34 H new ATOM 0 HB2 GLN A 76 -2.738 19.641 4.678 1.00 1.44 H new ATOM 0 HB3 GLN A 76 -2.533 19.749 2.941 1.00 1.44 H new ATOM 0 HG2 GLN A 76 -3.598 22.233 3.566 1.00 0.22 H new ATOM 0 HG3 GLN A 76 -2.607 21.886 4.969 1.00 0.22 H new ATOM 0 HE21 GLN A 76 -2.464 23.672 2.385 1.00 55.24 H new ATOM 0 HE22 GLN A 76 -0.793 23.448 1.857 1.00 55.24 H new ATOM 1210 N ILE A 77 -5.419 17.702 2.962 1.00 35.21 N ATOM 1211 CA ILE A 77 -5.758 16.298 3.158 1.00 50.55 C ATOM 1212 C ILE A 77 -5.531 15.493 1.883 1.00 25.22 C ATOM 1213 O ILE A 77 -5.136 16.040 0.854 1.00 5.00 O ATOM 1214 CB ILE A 77 -7.223 16.129 3.604 1.00 45.42 C ATOM 1215 CG1 ILE A 77 -8.164 16.289 2.408 1.00 11.52 C ATOM 1216 CG2 ILE A 77 -7.565 17.137 4.692 1.00 62.31 C ATOM 1217 CD1 ILE A 77 -8.060 17.638 1.733 1.00 65.21 C ATOM 0 H ILE A 77 -5.629 18.060 2.030 1.00 35.21 H new ATOM 0 HA ILE A 77 -5.102 15.923 3.943 1.00 50.55 H new ATOM 0 HB ILE A 77 -7.350 15.126 4.012 1.00 45.42 H new ATOM 0 HG12 ILE A 77 -7.947 15.509 1.678 1.00 11.52 H new ATOM 0 HG13 ILE A 77 -9.191 16.137 2.741 1.00 11.52 H new ATOM 0 HG21 ILE A 77 -8.603 17.005 4.997 1.00 62.31 H new ATOM 0 HG22 ILE A 77 -6.912 16.981 5.551 1.00 62.31 H new ATOM 0 HG23 ILE A 77 -7.425 18.148 4.309 1.00 62.31 H new ATOM 0 HD11 ILE A 77 -8.755 17.680 0.894 1.00 65.21 H new ATOM 0 HD12 ILE A 77 -8.306 18.423 2.448 1.00 65.21 H new ATOM 0 HD13 ILE A 77 -7.043 17.785 1.369 1.00 65.21 H new ATOM 1229 N ALA A 78 -5.785 14.191 1.959 1.00 44.32 N ATOM 1230 CA ALA A 78 -5.611 13.310 0.810 1.00 35.42 C ATOM 1231 C ALA A 78 -6.905 13.188 0.013 1.00 61.12 C ATOM 1232 O ALA A 78 -8.005 13.171 0.566 1.00 40.31 O ATOM 1233 CB ALA A 78 -5.137 11.938 1.263 1.00 72.54 C ATOM 0 H ALA A 78 -6.112 13.723 2.804 1.00 44.32 H new ATOM 0 HA ALA A 78 -4.853 13.747 0.160 1.00 35.42 H new ATOM 0 HB1 ALA A 78 -5.012 11.291 0.395 1.00 72.54 H new ATOM 0 HB2 ALA A 78 -4.184 12.036 1.783 1.00 72.54 H new ATOM 0 HB3 ALA A 78 -5.875 11.502 1.936 1.00 72.54 H new ATOM 1239 N PRO A 79 -6.774 13.103 -1.320 1.00 45.11 N ATOM 1240 CA PRO A 79 -7.923 12.982 -2.223 1.00 73.10 C ATOM 1241 C PRO A 79 -8.611 11.627 -2.105 1.00 74.34 C ATOM 1242 O PRO A 79 -8.323 10.850 -1.196 1.00 72.43 O ATOM 1243 CB PRO A 79 -7.301 13.148 -3.611 1.00 3.43 C ATOM 1244 CG PRO A 79 -5.884 12.725 -3.446 1.00 4.55 C ATOM 1245 CD PRO A 79 -5.494 13.120 -2.048 1.00 54.14 C ATOM 0 HA PRO A 79 -8.698 13.715 -1.998 1.00 73.10 H new ATOM 0 HB2 PRO A 79 -7.814 12.533 -4.350 1.00 3.43 H new ATOM 0 HB3 PRO A 79 -7.368 14.181 -3.954 1.00 3.43 H new ATOM 0 HG2 PRO A 79 -5.778 11.650 -3.592 1.00 4.55 H new ATOM 0 HG3 PRO A 79 -5.243 13.211 -4.182 1.00 4.55 H new ATOM 0 HD2 PRO A 79 -4.777 12.420 -1.618 1.00 54.14 H new ATOM 0 HD3 PRO A 79 -5.031 14.106 -2.023 1.00 54.14 H new ATOM 1253 N ALA A 80 -9.522 11.349 -3.033 1.00 1.11 N ATOM 1254 CA ALA A 80 -10.249 10.085 -3.034 1.00 34.34 C ATOM 1255 C ALA A 80 -9.486 9.013 -3.804 1.00 51.31 C ATOM 1256 O ALA A 80 -9.671 7.817 -3.573 1.00 70.35 O ATOM 1257 CB ALA A 80 -11.637 10.276 -3.626 1.00 63.50 C ATOM 0 H ALA A 80 -9.774 11.981 -3.793 1.00 1.11 H new ATOM 0 HA ALA A 80 -10.349 9.751 -2.001 1.00 34.34 H new ATOM 0 HB1 ALA A 80 -12.169 9.325 -3.621 1.00 63.50 H new ATOM 0 HB2 ALA A 80 -12.189 11.004 -3.031 1.00 63.50 H new ATOM 0 HB3 ALA A 80 -11.549 10.637 -4.651 1.00 63.50 H new ATOM 1263 N LEU A 81 -8.628 9.448 -4.721 1.00 5.22 N ATOM 1264 CA LEU A 81 -7.837 8.526 -5.528 1.00 2.43 C ATOM 1265 C LEU A 81 -6.546 8.144 -4.809 1.00 54.42 C ATOM 1266 O LEU A 81 -5.974 7.083 -5.059 1.00 41.41 O ATOM 1267 CB LEU A 81 -7.513 9.151 -6.884 1.00 34.21 C ATOM 1268 CG LEU A 81 -8.697 9.349 -7.832 1.00 32.21 C ATOM 1269 CD1 LEU A 81 -9.029 10.827 -7.969 1.00 11.43 C ATOM 1270 CD2 LEU A 81 -8.399 8.739 -9.194 1.00 41.44 C ATOM 0 H LEU A 81 -8.463 10.434 -4.924 1.00 5.22 H new ATOM 0 HA LEU A 81 -8.426 7.622 -5.684 1.00 2.43 H new ATOM 0 HB2 LEU A 81 -7.045 10.120 -6.712 1.00 34.21 H new ATOM 0 HB3 LEU A 81 -6.774 8.524 -7.383 1.00 34.21 H new ATOM 0 HG LEU A 81 -9.564 8.840 -7.411 1.00 32.21 H new ATOM 0 HD11 LEU A 81 -9.874 10.949 -8.647 1.00 11.43 H new ATOM 0 HD12 LEU A 81 -9.287 11.234 -6.991 1.00 11.43 H new ATOM 0 HD13 LEU A 81 -8.165 11.359 -8.367 1.00 11.43 H new ATOM 0 HD21 LEU A 81 -9.253 8.890 -9.855 1.00 41.44 H new ATOM 0 HD22 LEU A 81 -7.519 9.219 -9.623 1.00 41.44 H new ATOM 0 HD23 LEU A 81 -8.212 7.671 -9.081 1.00 41.44 H new ATOM 1282 N ALA A 82 -6.093 9.018 -3.915 1.00 61.40 N ATOM 1283 CA ALA A 82 -4.872 8.771 -3.157 1.00 42.42 C ATOM 1284 C ALA A 82 -4.900 7.392 -2.505 1.00 41.25 C ATOM 1285 O ALA A 82 -3.944 6.625 -2.612 1.00 1.31 O ATOM 1286 CB ALA A 82 -4.678 9.851 -2.104 1.00 60.33 C ATOM 0 H ALA A 82 -6.553 9.902 -3.698 1.00 61.40 H new ATOM 0 HA ALA A 82 -4.031 8.799 -3.850 1.00 42.42 H new ATOM 0 HB1 ALA A 82 -3.763 9.654 -1.545 1.00 60.33 H new ATOM 0 HB2 ALA A 82 -4.605 10.824 -2.590 1.00 60.33 H new ATOM 0 HB3 ALA A 82 -5.527 9.850 -1.421 1.00 60.33 H new ATOM 1292 N HIS A 83 -6.001 7.086 -1.827 1.00 52.44 N ATOM 1293 CA HIS A 83 -6.153 5.798 -1.157 1.00 62.14 C ATOM 1294 C HIS A 83 -5.056 5.595 -0.117 1.00 43.04 C ATOM 1295 O HIS A 83 -4.750 4.466 0.266 1.00 74.24 O ATOM 1296 CB HIS A 83 -6.121 4.661 -2.179 1.00 52.01 C ATOM 1297 CG HIS A 83 -7.462 4.342 -2.763 1.00 71.45 C ATOM 1298 ND1 HIS A 83 -8.534 3.925 -2.003 1.00 72.31 N ATOM 1299 CD2 HIS A 83 -7.903 4.383 -4.042 1.00 33.10 C ATOM 1300 CE1 HIS A 83 -9.576 3.721 -2.789 1.00 41.15 C ATOM 1301 NE2 HIS A 83 -9.220 3.993 -4.032 1.00 35.44 N ATOM 0 H HIS A 83 -6.801 7.711 -1.726 1.00 52.44 H new ATOM 0 HA HIS A 83 -7.117 5.792 -0.648 1.00 62.14 H new ATOM 0 HB2 HIS A 83 -5.437 4.927 -2.985 1.00 52.01 H new ATOM 0 HB3 HIS A 83 -5.719 3.767 -1.703 1.00 52.01 H new ATOM 0 HD2 HIS A 83 -7.326 4.669 -4.909 1.00 33.10 H new ATOM 0 HE1 HIS A 83 -10.553 3.388 -2.470 1.00 41.15 H new ATOM 0 HE2 HIS A 83 -9.825 3.925 -4.851 1.00 35.44 H new ATOM 1309 N PHE A 84 -4.466 6.697 0.336 1.00 61.54 N ATOM 1310 CA PHE A 84 -3.401 6.639 1.331 1.00 21.02 C ATOM 1311 C PHE A 84 -3.880 7.189 2.672 1.00 45.34 C ATOM 1312 O PHE A 84 -4.047 6.444 3.637 1.00 11.55 O ATOM 1313 CB PHE A 84 -2.181 7.427 0.850 1.00 72.42 C ATOM 1314 CG PHE A 84 -0.948 6.585 0.694 1.00 14.02 C ATOM 1315 CD1 PHE A 84 -0.194 6.225 1.799 1.00 20.34 C ATOM 1316 CD2 PHE A 84 -0.540 6.156 -0.560 1.00 43.32 C ATOM 1317 CE1 PHE A 84 0.942 5.450 1.659 1.00 14.32 C ATOM 1318 CE2 PHE A 84 0.595 5.380 -0.706 1.00 15.34 C ATOM 1319 CZ PHE A 84 1.337 5.028 0.404 1.00 4.42 C ATOM 0 H PHE A 84 -4.707 7.640 0.030 1.00 61.54 H new ATOM 0 HA PHE A 84 -3.120 5.595 1.466 1.00 21.02 H new ATOM 0 HB2 PHE A 84 -2.415 7.896 -0.106 1.00 72.42 H new ATOM 0 HB3 PHE A 84 -1.976 8.231 1.557 1.00 72.42 H new ATOM 0 HD1 PHE A 84 -0.497 6.554 2.782 1.00 20.34 H new ATOM 0 HD2 PHE A 84 -1.115 6.431 -1.432 1.00 43.32 H new ATOM 0 HE1 PHE A 84 1.520 5.175 2.529 1.00 14.32 H new ATOM 0 HE2 PHE A 84 0.901 5.049 -1.688 1.00 15.34 H new ATOM 0 HZ PHE A 84 2.225 4.424 0.291 1.00 4.42 H new ATOM 1573 N THR B 4 15.575 31.242 -5.233 1.00 72.34 N ATOM 1574 CA THR B 4 15.585 30.022 -6.029 1.00 42.42 C ATOM 1575 C THR B 4 15.406 28.791 -5.148 1.00 52.45 C ATOM 1576 O THR B 4 15.521 28.868 -3.925 1.00 62.33 O ATOM 1577 CB THR B 4 16.896 29.883 -6.827 1.00 14.31 C ATOM 1578 OG1 THR B 4 17.480 31.173 -7.039 1.00 24.44 O ATOM 1579 CG2 THR B 4 16.645 29.207 -8.166 1.00 44.11 C ATOM 0 HA THR B 4 14.750 30.091 -6.726 1.00 42.42 H new ATOM 0 HB THR B 4 17.583 29.265 -6.250 1.00 14.31 H new ATOM 0 HG1 THR B 4 17.122 31.806 -6.382 1.00 24.44 H new ATOM 0 HG21 THR B 4 17.585 29.120 -8.711 1.00 44.11 H new ATOM 0 HG22 THR B 4 16.229 28.214 -8.000 1.00 44.11 H new ATOM 0 HG23 THR B 4 15.942 29.802 -8.748 1.00 44.11 H new ATOM 1587 N ILE B 5 15.125 27.654 -5.778 1.00 72.43 N ATOM 1588 CA ILE B 5 14.933 26.406 -5.051 1.00 60.40 C ATOM 1589 C ILE B 5 16.097 26.136 -4.105 1.00 73.52 C ATOM 1590 O ILE B 5 15.898 25.875 -2.918 1.00 14.01 O ATOM 1591 CB ILE B 5 14.780 25.213 -6.013 1.00 41.35 C ATOM 1592 CG1 ILE B 5 13.652 25.477 -7.013 1.00 41.00 C ATOM 1593 CG2 ILE B 5 14.514 23.934 -5.232 1.00 64.43 C ATOM 1594 CD1 ILE B 5 14.065 25.275 -8.455 1.00 71.13 C ATOM 0 H ILE B 5 15.026 27.572 -6.790 1.00 72.43 H new ATOM 0 HA ILE B 5 14.016 26.516 -4.472 1.00 60.40 H new ATOM 0 HB ILE B 5 15.710 25.091 -6.568 1.00 41.35 H new ATOM 0 HG12 ILE B 5 12.815 24.817 -6.787 1.00 41.00 H new ATOM 0 HG13 ILE B 5 13.295 26.499 -6.885 1.00 41.00 H new ATOM 0 HG21 ILE B 5 14.408 23.100 -5.925 1.00 64.43 H new ATOM 0 HG22 ILE B 5 15.347 23.741 -4.556 1.00 64.43 H new ATOM 0 HG23 ILE B 5 13.596 24.045 -4.655 1.00 64.43 H new ATOM 0 HD11 ILE B 5 13.217 25.479 -9.108 1.00 71.13 H new ATOM 0 HD12 ILE B 5 14.882 25.954 -8.698 1.00 71.13 H new ATOM 0 HD13 ILE B 5 14.394 24.246 -8.598 1.00 71.13 H new ATOM 1606 N SER B 6 17.313 26.200 -4.637 1.00 1.32 N ATOM 1607 CA SER B 6 18.511 25.962 -3.840 1.00 35.53 C ATOM 1608 C SER B 6 18.585 26.932 -2.665 1.00 22.31 C ATOM 1609 O SER B 6 19.246 26.661 -1.664 1.00 0.21 O ATOM 1610 CB SER B 6 19.763 26.098 -4.708 1.00 41.32 C ATOM 1611 OG SER B 6 20.414 27.334 -4.473 1.00 21.35 O ATOM 0 H SER B 6 17.495 26.415 -5.617 1.00 1.32 H new ATOM 0 HA SER B 6 18.459 24.947 -3.447 1.00 35.53 H new ATOM 0 HB2 SER B 6 20.447 25.277 -4.496 1.00 41.32 H new ATOM 0 HB3 SER B 6 19.490 26.021 -5.760 1.00 41.32 H new ATOM 0 HG SER B 6 21.157 27.199 -3.849 1.00 21.35 H new ATOM 1617 N GLU B 7 17.901 28.064 -2.797 1.00 32.11 N ATOM 1618 CA GLU B 7 17.889 29.075 -1.747 1.00 62.35 C ATOM 1619 C GLU B 7 16.887 28.715 -0.654 1.00 42.41 C ATOM 1620 O GLU B 7 16.949 29.238 0.459 1.00 11.21 O ATOM 1621 CB GLU B 7 17.548 30.448 -2.333 1.00 23.21 C ATOM 1622 CG GLU B 7 18.345 30.791 -3.581 1.00 1.43 C ATOM 1623 CD GLU B 7 18.437 32.285 -3.821 1.00 1.34 C ATOM 1624 OE1 GLU B 7 17.965 33.055 -2.960 1.00 64.22 O ATOM 1625 OE2 GLU B 7 18.983 32.684 -4.871 1.00 2.32 O ATOM 0 H GLU B 7 17.348 28.304 -3.620 1.00 32.11 H new ATOM 0 HA GLU B 7 18.885 29.113 -1.305 1.00 62.35 H new ATOM 0 HB2 GLU B 7 16.485 30.478 -2.571 1.00 23.21 H new ATOM 0 HB3 GLU B 7 17.727 31.212 -1.576 1.00 23.21 H new ATOM 0 HG2 GLU B 7 19.350 30.379 -3.491 1.00 1.43 H new ATOM 0 HG3 GLU B 7 17.882 30.316 -4.446 1.00 1.43 H new ATOM 1632 N LYS B 8 15.963 27.817 -0.980 1.00 33.03 N ATOM 1633 CA LYS B 8 14.947 27.384 -0.028 1.00 74.20 C ATOM 1634 C LYS B 8 15.446 26.204 0.800 1.00 72.42 C ATOM 1635 O LYS B 8 14.778 25.765 1.737 1.00 55.43 O ATOM 1636 CB LYS B 8 13.662 26.997 -0.763 1.00 61.22 C ATOM 1637 CG LYS B 8 13.333 27.908 -1.933 1.00 10.12 C ATOM 1638 CD LYS B 8 11.875 27.785 -2.342 1.00 72.53 C ATOM 1639 CE LYS B 8 11.164 29.129 -2.285 1.00 74.45 C ATOM 1640 NZ LYS B 8 10.975 29.714 -3.641 1.00 44.13 N ATOM 0 H LYS B 8 15.897 27.375 -1.897 1.00 33.03 H new ATOM 0 HA LYS B 8 14.737 28.215 0.645 1.00 74.20 H new ATOM 0 HB2 LYS B 8 13.755 25.973 -1.125 1.00 61.22 H new ATOM 0 HB3 LYS B 8 12.831 27.011 -0.057 1.00 61.22 H new ATOM 0 HG2 LYS B 8 13.550 28.941 -1.663 1.00 10.12 H new ATOM 0 HG3 LYS B 8 13.972 27.659 -2.780 1.00 10.12 H new ATOM 0 HD2 LYS B 8 11.812 27.382 -3.353 1.00 72.53 H new ATOM 0 HD3 LYS B 8 11.370 27.077 -1.685 1.00 72.53 H new ATOM 0 HE2 LYS B 8 10.194 29.006 -1.804 1.00 74.45 H new ATOM 0 HE3 LYS B 8 11.740 29.819 -1.669 1.00 74.45 H new ATOM 0 HZ1 LYS B 8 10.487 30.629 -3.559 1.00 44.13 H new ATOM 0 HZ2 LYS B 8 11.902 29.855 -4.091 1.00 44.13 H new ATOM 0 HZ3 LYS B 8 10.403 29.068 -4.221 1.00 44.13 H new ATOM 1654 N ILE B 9 16.624 25.697 0.451 1.00 12.54 N ATOM 1655 CA ILE B 9 17.211 24.570 1.164 1.00 14.12 C ATOM 1656 C ILE B 9 18.492 24.982 1.884 1.00 2.44 C ATOM 1657 O ILE B 9 19.158 24.158 2.510 1.00 32.42 O ATOM 1658 CB ILE B 9 17.525 23.402 0.211 1.00 61.41 C ATOM 1659 CG1 ILE B 9 16.367 23.186 -0.765 1.00 2.42 C ATOM 1660 CG2 ILE B 9 17.801 22.132 1.002 1.00 21.54 C ATOM 1661 CD1 ILE B 9 16.617 22.078 -1.764 1.00 4.43 C ATOM 0 H ILE B 9 17.190 26.049 -0.321 1.00 12.54 H new ATOM 0 HA ILE B 9 16.474 24.242 1.897 1.00 14.12 H new ATOM 0 HB ILE B 9 18.418 23.651 -0.363 1.00 61.41 H new ATOM 0 HG12 ILE B 9 15.464 22.957 -0.199 1.00 2.42 H new ATOM 0 HG13 ILE B 9 16.179 24.115 -1.304 1.00 2.42 H new ATOM 0 HG21 ILE B 9 18.021 21.316 0.314 1.00 21.54 H new ATOM 0 HG22 ILE B 9 18.655 22.292 1.661 1.00 21.54 H new ATOM 0 HG23 ILE B 9 16.925 21.877 1.599 1.00 21.54 H new ATOM 0 HD11 ILE B 9 15.755 21.981 -2.424 1.00 4.43 H new ATOM 0 HD12 ILE B 9 17.502 22.314 -2.356 1.00 4.43 H new ATOM 0 HD13 ILE B 9 16.775 21.139 -1.234 1.00 4.43 H new ATOM 1673 N VAL B 10 18.829 26.265 1.790 1.00 31.43 N ATOM 1674 CA VAL B 10 20.029 26.788 2.435 1.00 4.14 C ATOM 1675 C VAL B 10 19.674 27.625 3.658 1.00 20.24 C ATOM 1676 O VAL B 10 20.363 27.577 4.678 1.00 25.00 O ATOM 1677 CB VAL B 10 20.858 27.647 1.462 1.00 14.00 C ATOM 1678 CG1 VAL B 10 21.367 26.804 0.304 1.00 0.51 C ATOM 1679 CG2 VAL B 10 20.035 28.823 0.956 1.00 13.31 C ATOM 0 H VAL B 10 18.289 26.960 1.275 1.00 31.43 H new ATOM 0 HA VAL B 10 20.623 25.928 2.746 1.00 4.14 H new ATOM 0 HB VAL B 10 21.721 28.041 1.998 1.00 14.00 H new ATOM 0 HG11 VAL B 10 21.950 27.429 -0.372 1.00 0.51 H new ATOM 0 HG12 VAL B 10 21.995 26.000 0.688 1.00 0.51 H new ATOM 0 HG13 VAL B 10 20.521 26.378 -0.235 1.00 0.51 H new ATOM 0 HG21 VAL B 10 20.636 29.419 0.270 1.00 13.31 H new ATOM 0 HG22 VAL B 10 19.152 28.452 0.436 1.00 13.31 H new ATOM 0 HG23 VAL B 10 19.727 29.441 1.799 1.00 13.31 H new ATOM 1689 N LEU B 11 18.594 28.391 3.552 1.00 4.44 N ATOM 1690 CA LEU B 11 18.146 29.239 4.652 1.00 2.34 C ATOM 1691 C LEU B 11 17.626 28.397 5.812 1.00 45.43 C ATOM 1692 O LEU B 11 17.817 28.744 6.978 1.00 75.44 O ATOM 1693 CB LEU B 11 17.053 30.195 4.171 1.00 4.21 C ATOM 1694 CG LEU B 11 15.865 29.552 3.457 1.00 62.10 C ATOM 1695 CD1 LEU B 11 14.802 29.132 4.460 1.00 1.11 C ATOM 1696 CD2 LEU B 11 15.279 30.507 2.427 1.00 42.24 C ATOM 0 H LEU B 11 18.012 28.443 2.716 1.00 4.44 H new ATOM 0 HA LEU B 11 19.000 29.819 5.003 1.00 2.34 H new ATOM 0 HB2 LEU B 11 16.678 30.748 5.032 1.00 4.21 H new ATOM 0 HB3 LEU B 11 17.506 30.923 3.497 1.00 4.21 H new ATOM 0 HG LEU B 11 16.219 28.661 2.938 1.00 62.10 H new ATOM 0 HD11 LEU B 11 13.964 28.676 3.933 1.00 1.11 H new ATOM 0 HD12 LEU B 11 15.226 28.411 5.159 1.00 1.11 H new ATOM 0 HD13 LEU B 11 14.453 30.007 5.008 1.00 1.11 H new ATOM 0 HD21 LEU B 11 14.434 30.031 1.929 1.00 42.24 H new ATOM 0 HD22 LEU B 11 14.942 31.416 2.924 1.00 42.24 H new ATOM 0 HD23 LEU B 11 16.041 30.758 1.689 1.00 42.24 H new ATOM 1708 N MET B 12 16.972 27.288 5.485 1.00 15.32 N ATOM 1709 CA MET B 12 16.428 26.394 6.501 1.00 4.44 C ATOM 1710 C MET B 12 17.493 25.419 6.993 1.00 75.53 C ATOM 1711 O MET B 12 17.580 25.130 8.187 1.00 31.24 O ATOM 1712 CB MET B 12 15.232 25.621 5.944 1.00 24.25 C ATOM 1713 CG MET B 12 15.531 24.891 4.644 1.00 13.14 C ATOM 1714 SD MET B 12 15.595 23.101 4.852 1.00 25.25 S ATOM 1715 CE MET B 12 14.966 22.553 3.267 1.00 64.33 C ATOM 0 H MET B 12 16.806 26.986 4.525 1.00 15.32 H new ATOM 0 HA MET B 12 16.098 27.001 7.344 1.00 4.44 H new ATOM 0 HB2 MET B 12 14.899 24.898 6.689 1.00 24.25 H new ATOM 0 HB3 MET B 12 14.407 26.314 5.780 1.00 24.25 H new ATOM 0 HG2 MET B 12 14.767 25.140 3.908 1.00 13.14 H new ATOM 0 HG3 MET B 12 16.483 25.241 4.246 1.00 13.14 H new ATOM 0 HE1 MET B 12 15.173 21.490 3.141 1.00 64.33 H new ATOM 0 HE2 MET B 12 13.890 22.721 3.225 1.00 64.33 H new ATOM 0 HE3 MET B 12 15.452 23.114 2.469 1.00 64.33 H new ATOM 1725 N ARG B 13 18.301 24.914 6.067 1.00 31.24 N ATOM 1726 CA ARG B 13 19.358 23.970 6.407 1.00 74.51 C ATOM 1727 C ARG B 13 20.317 24.573 7.430 1.00 20.12 C ATOM 1728 O ARG B 13 20.595 23.971 8.467 1.00 41.34 O ATOM 1729 CB ARG B 13 20.129 23.560 5.150 1.00 32.34 C ATOM 1730 CG ARG B 13 21.336 22.681 5.435 1.00 45.45 C ATOM 1731 CD ARG B 13 21.152 21.282 4.868 1.00 63.05 C ATOM 1732 NE ARG B 13 22.135 20.979 3.831 1.00 42.01 N ATOM 1733 CZ ARG B 13 22.006 21.352 2.563 1.00 41.31 C ATOM 1734 NH1 ARG B 13 20.939 22.038 2.177 1.00 23.35 N ATOM 1735 NH2 ARG B 13 22.943 21.038 1.679 1.00 12.23 N ATOM 0 H ARG B 13 18.244 25.143 5.075 1.00 31.24 H new ATOM 0 HA ARG B 13 18.894 23.086 6.845 1.00 74.51 H new ATOM 0 HB2 ARG B 13 19.455 23.030 4.477 1.00 32.34 H new ATOM 0 HB3 ARG B 13 20.459 24.458 4.628 1.00 32.34 H new ATOM 0 HG2 ARG B 13 22.228 23.135 5.004 1.00 45.45 H new ATOM 0 HG3 ARG B 13 21.497 22.620 6.511 1.00 45.45 H new ATOM 0 HD2 ARG B 13 21.236 20.551 5.672 1.00 63.05 H new ATOM 0 HD3 ARG B 13 20.148 21.187 4.455 1.00 63.05 H new ATOM 0 HE ARG B 13 22.967 20.451 4.096 1.00 42.01 H new ATOM 0 HH11 ARG B 13 20.216 22.280 2.854 1.00 23.35 H new ATOM 0 HH12 ARG B 13 20.841 22.324 1.203 1.00 23.35 H new ATOM 0 HH21 ARG B 13 23.764 20.509 1.973 1.00 12.23 H new ATOM 0 HH22 ARG B 13 22.842 21.325 0.705 1.00 12.23 H new ATOM 1749 N LYS B 14 20.820 25.767 7.131 1.00 12.22 N ATOM 1750 CA LYS B 14 21.747 26.453 8.023 1.00 65.30 C ATOM 1751 C LYS B 14 21.060 26.835 9.330 1.00 55.42 C ATOM 1752 O LYS B 14 21.720 27.116 10.330 1.00 72.04 O ATOM 1753 CB LYS B 14 22.308 27.704 7.344 1.00 13.55 C ATOM 1754 CG LYS B 14 23.704 27.514 6.778 1.00 13.50 C ATOM 1755 CD LYS B 14 23.706 27.589 5.260 1.00 31.23 C ATOM 1756 CE LYS B 14 23.272 26.272 4.636 1.00 22.12 C ATOM 1757 NZ LYS B 14 24.361 25.655 3.830 1.00 72.34 N ATOM 0 H LYS B 14 20.601 26.279 6.277 1.00 12.22 H new ATOM 0 HA LYS B 14 22.567 25.772 8.249 1.00 65.30 H new ATOM 0 HB2 LYS B 14 21.636 28.003 6.539 1.00 13.55 H new ATOM 0 HB3 LYS B 14 22.325 28.522 8.065 1.00 13.55 H new ATOM 0 HG2 LYS B 14 24.368 28.278 7.182 1.00 13.50 H new ATOM 0 HG3 LYS B 14 24.098 26.549 7.096 1.00 13.50 H new ATOM 0 HD2 LYS B 14 23.037 28.385 4.933 1.00 31.23 H new ATOM 0 HD3 LYS B 14 24.705 27.847 4.909 1.00 31.23 H new ATOM 0 HE2 LYS B 14 22.966 25.581 5.422 1.00 22.12 H new ATOM 0 HE3 LYS B 14 22.401 26.440 4.002 1.00 22.12 H new ATOM 0 HZ1 LYS B 14 24.080 25.629 2.829 1.00 72.34 H new ATOM 0 HZ2 LYS B 14 25.229 26.218 3.931 1.00 72.34 H new ATOM 0 HZ3 LYS B 14 24.535 24.686 4.166 1.00 72.34 H new ATOM 1771 N SER B 15 19.730 26.843 9.315 1.00 70.12 N ATOM 1772 CA SER B 15 18.955 27.194 10.499 1.00 60.13 C ATOM 1773 C SER B 15 19.098 26.126 11.578 1.00 64.13 C ATOM 1774 O SER B 15 19.026 26.420 12.771 1.00 73.31 O ATOM 1775 CB SER B 15 17.480 27.372 10.134 1.00 63.31 C ATOM 1776 OG SER B 15 16.931 28.513 10.772 1.00 42.11 O ATOM 0 H SER B 15 19.168 26.611 8.496 1.00 70.12 H new ATOM 0 HA SER B 15 19.342 28.135 10.890 1.00 60.13 H new ATOM 0 HB2 SER B 15 17.379 27.472 9.053 1.00 63.31 H new ATOM 0 HB3 SER B 15 16.920 26.484 10.426 1.00 63.31 H new ATOM 0 HG SER B 15 16.093 28.267 11.217 1.00 42.11 H new ATOM 1782 N GLU B 16 19.303 24.884 11.150 1.00 40.41 N ATOM 1783 CA GLU B 16 19.455 23.771 12.080 1.00 13.44 C ATOM 1784 C GLU B 16 20.862 23.745 12.671 1.00 32.01 C ATOM 1785 O GLU B 16 21.166 22.928 13.540 1.00 23.44 O ATOM 1786 CB GLU B 16 19.162 22.445 11.374 1.00 54.12 C ATOM 1787 CG GLU B 16 19.165 21.245 12.308 1.00 50.43 C ATOM 1788 CD GLU B 16 18.287 21.453 13.527 1.00 43.22 C ATOM 1789 OE1 GLU B 16 17.298 22.209 13.424 1.00 51.44 O ATOM 1790 OE2 GLU B 16 18.588 20.858 14.582 1.00 35.53 O ATOM 0 H GLU B 16 19.368 24.623 10.166 1.00 40.41 H new ATOM 0 HA GLU B 16 18.741 23.908 12.892 1.00 13.44 H new ATOM 0 HB2 GLU B 16 18.191 22.511 10.884 1.00 54.12 H new ATOM 0 HB3 GLU B 16 19.904 22.288 10.591 1.00 54.12 H new ATOM 0 HG2 GLU B 16 18.822 20.365 11.764 1.00 50.43 H new ATOM 0 HG3 GLU B 16 20.186 21.043 12.631 1.00 50.43 H new ATOM 1797 N TYR B 17 21.714 24.645 12.193 1.00 34.32 N ATOM 1798 CA TYR B 17 23.089 24.724 12.671 1.00 12.14 C ATOM 1799 C TYR B 17 23.862 23.455 12.322 1.00 53.41 C ATOM 1800 O TYR B 17 24.823 23.092 13.001 1.00 71.22 O ATOM 1801 CB TYR B 17 23.113 24.948 14.184 1.00 12.25 C ATOM 1802 CG TYR B 17 22.164 26.030 14.650 1.00 11.31 C ATOM 1803 CD1 TYR B 17 22.050 27.228 13.956 1.00 4.33 C ATOM 1804 CD2 TYR B 17 21.384 25.854 15.787 1.00 24.11 C ATOM 1805 CE1 TYR B 17 21.185 28.219 14.379 1.00 21.33 C ATOM 1806 CE2 TYR B 17 20.516 26.838 16.216 1.00 12.34 C ATOM 1807 CZ TYR B 17 20.420 28.019 15.509 1.00 21.44 C ATOM 1808 OH TYR B 17 19.556 29.002 15.934 1.00 40.42 O ATOM 0 H TYR B 17 21.477 25.330 11.475 1.00 34.32 H new ATOM 0 HA TYR B 17 23.570 25.568 12.177 1.00 12.14 H new ATOM 0 HB2 TYR B 17 22.860 24.014 14.685 1.00 12.25 H new ATOM 0 HB3 TYR B 17 24.127 25.209 14.488 1.00 12.25 H new ATOM 0 HD1 TYR B 17 22.648 27.388 13.071 1.00 4.33 H new ATOM 0 HD2 TYR B 17 21.458 24.932 16.344 1.00 24.11 H new ATOM 0 HE1 TYR B 17 21.108 29.145 13.828 1.00 21.33 H new ATOM 0 HE2 TYR B 17 19.915 26.684 17.100 1.00 12.34 H new ATOM 0 HH TYR B 17 19.092 28.702 16.743 1.00 40.42 H new ATOM 1818 N LEU B 18 23.435 22.785 11.258 1.00 12.20 N ATOM 1819 CA LEU B 18 24.086 21.556 10.816 1.00 24.40 C ATOM 1820 C LEU B 18 24.809 21.771 9.490 1.00 52.21 C ATOM 1821 O LEU B 18 24.430 22.631 8.695 1.00 53.11 O ATOM 1822 CB LEU B 18 23.056 20.434 10.672 1.00 20.43 C ATOM 1823 CG LEU B 18 22.057 20.582 9.524 1.00 13.14 C ATOM 1824 CD1 LEU B 18 22.634 20.010 8.238 1.00 73.11 C ATOM 1825 CD2 LEU B 18 20.742 19.900 9.871 1.00 4.13 C ATOM 0 H LEU B 18 22.641 23.071 10.685 1.00 12.20 H new ATOM 0 HA LEU B 18 24.821 21.271 11.569 1.00 24.40 H new ATOM 0 HB2 LEU B 18 23.590 19.492 10.543 1.00 20.43 H new ATOM 0 HB3 LEU B 18 22.498 20.359 11.605 1.00 20.43 H new ATOM 0 HG LEU B 18 21.863 21.644 9.370 1.00 13.14 H new ATOM 0 HD11 LEU B 18 21.909 20.124 7.432 1.00 73.11 H new ATOM 0 HD12 LEU B 18 23.549 20.543 7.981 1.00 73.11 H new ATOM 0 HD13 LEU B 18 22.857 18.952 8.378 1.00 73.11 H new ATOM 0 HD21 LEU B 18 20.043 20.015 9.043 1.00 4.13 H new ATOM 0 HD22 LEU B 18 20.919 18.840 10.052 1.00 4.13 H new ATOM 0 HD23 LEU B 18 20.321 20.356 10.767 1.00 4.13 H new ATOM 1837 N SER B 19 25.853 20.980 9.258 1.00 12.41 N ATOM 1838 CA SER B 19 26.631 21.084 8.028 1.00 64.34 C ATOM 1839 C SER B 19 26.021 20.225 6.925 1.00 33.32 C ATOM 1840 O SER B 19 25.262 19.295 7.195 1.00 1.23 O ATOM 1841 CB SER B 19 28.079 20.658 8.279 1.00 15.24 C ATOM 1842 OG SER B 19 28.816 21.699 8.898 1.00 63.44 O ATOM 0 H SER B 19 26.179 20.261 9.904 1.00 12.41 H new ATOM 0 HA SER B 19 26.616 22.125 7.704 1.00 64.34 H new ATOM 0 HB2 SER B 19 28.096 19.770 8.911 1.00 15.24 H new ATOM 0 HB3 SER B 19 28.550 20.386 7.335 1.00 15.24 H new ATOM 0 HG SER B 19 29.738 21.402 9.050 1.00 63.44 H new ATOM 1848 N ARG B 20 26.358 20.547 5.680 1.00 0.34 N ATOM 1849 CA ARG B 20 25.842 19.806 4.534 1.00 13.34 C ATOM 1850 C ARG B 20 26.056 18.306 4.715 1.00 61.45 C ATOM 1851 O ARG B 20 25.234 17.496 4.287 1.00 32.35 O ATOM 1852 CB ARG B 20 26.523 20.278 3.247 1.00 32.01 C ATOM 1853 CG ARG B 20 26.113 21.678 2.820 1.00 12.30 C ATOM 1854 CD ARG B 20 26.591 21.993 1.412 1.00 43.42 C ATOM 1855 NE ARG B 20 27.087 23.362 1.295 1.00 33.34 N ATOM 1856 CZ ARG B 20 28.198 23.793 1.881 1.00 13.22 C ATOM 1857 NH1 ARG B 20 28.925 22.968 2.621 1.00 45.34 N ATOM 1858 NH2 ARG B 20 28.583 25.054 1.728 1.00 44.43 N ATOM 0 H ARG B 20 26.985 21.315 5.439 1.00 0.34 H new ATOM 0 HA ARG B 20 24.771 19.996 4.462 1.00 13.34 H new ATOM 0 HB2 ARG B 20 27.604 20.252 3.387 1.00 32.01 H new ATOM 0 HB3 ARG B 20 26.288 19.579 2.444 1.00 32.01 H new ATOM 0 HG2 ARG B 20 25.028 21.771 2.866 1.00 12.30 H new ATOM 0 HG3 ARG B 20 26.525 22.408 3.517 1.00 12.30 H new ATOM 0 HD2 ARG B 20 27.381 21.296 1.133 1.00 43.42 H new ATOM 0 HD3 ARG B 20 25.772 21.843 0.709 1.00 43.42 H new ATOM 0 HE ARG B 20 26.551 24.023 0.733 1.00 33.34 H new ATOM 0 HH11 ARG B 20 28.632 21.999 2.742 1.00 45.34 H new ATOM 0 HH12 ARG B 20 29.778 23.303 3.070 1.00 45.34 H new ATOM 0 HH21 ARG B 20 28.025 25.692 1.160 1.00 44.43 H new ATOM 0 HH22 ARG B 20 29.436 25.385 2.178 1.00 44.43 H new ATOM 1872 N GLN B 21 27.166 17.944 5.350 1.00 14.43 N ATOM 1873 CA GLN B 21 27.488 16.542 5.586 1.00 43.34 C ATOM 1874 C GLN B 21 26.483 15.905 6.539 1.00 62.14 C ATOM 1875 O GLN B 21 26.121 14.740 6.385 1.00 41.54 O ATOM 1876 CB GLN B 21 28.903 16.410 6.155 1.00 2.32 C ATOM 1877 CG GLN B 21 29.096 17.132 7.479 1.00 23.52 C ATOM 1878 CD GLN B 21 30.556 17.249 7.872 1.00 53.34 C ATOM 1879 OE1 GLN B 21 31.243 16.244 8.058 1.00 14.14 O ATOM 1880 NE2 GLN B 21 31.037 18.479 8.001 1.00 71.20 N ATOM 0 H GLN B 21 27.857 18.602 5.710 1.00 14.43 H new ATOM 0 HA GLN B 21 27.437 16.019 4.631 1.00 43.34 H new ATOM 0 HB2 GLN B 21 29.134 15.353 6.290 1.00 2.32 H new ATOM 0 HB3 GLN B 21 29.616 16.802 5.429 1.00 2.32 H new ATOM 0 HG2 GLN B 21 28.661 18.129 7.412 1.00 23.52 H new ATOM 0 HG3 GLN B 21 28.555 16.600 8.261 1.00 23.52 H new ATOM 0 HE21 GLN B 21 30.431 19.283 7.837 1.00 71.20 H new ATOM 0 HE22 GLN B 21 32.012 18.620 8.264 1.00 71.20 H new ATOM 1889 N GLN B 22 26.038 16.679 7.525 1.00 33.40 N ATOM 1890 CA GLN B 22 25.075 16.189 8.504 1.00 53.02 C ATOM 1891 C GLN B 22 23.781 15.753 7.825 1.00 53.44 C ATOM 1892 O GLN B 22 23.341 14.613 7.977 1.00 72.23 O ATOM 1893 CB GLN B 22 24.780 17.270 9.546 1.00 4.03 C ATOM 1894 CG GLN B 22 25.072 16.836 10.972 1.00 5.22 C ATOM 1895 CD GLN B 22 26.552 16.629 11.229 1.00 40.14 C ATOM 1896 OE1 GLN B 22 27.396 17.084 10.456 1.00 24.31 O ATOM 1897 NE2 GLN B 22 26.874 15.940 12.316 1.00 70.34 N ATOM 0 H GLN B 22 26.329 17.646 7.666 1.00 33.40 H new ATOM 0 HA GLN B 22 25.511 15.323 9.003 1.00 53.02 H new ATOM 0 HB2 GLN B 22 25.372 18.156 9.316 1.00 4.03 H new ATOM 0 HB3 GLN B 22 23.732 17.559 9.471 1.00 4.03 H new ATOM 0 HG2 GLN B 22 24.689 17.588 11.662 1.00 5.22 H new ATOM 0 HG3 GLN B 22 24.538 15.909 11.182 1.00 5.22 H new ATOM 0 HE21 GLN B 22 26.141 15.582 12.928 1.00 70.34 H new ATOM 0 HE22 GLN B 22 27.854 15.769 12.539 1.00 70.34 H new ATOM 1906 N LEU B 23 23.176 16.668 7.076 1.00 15.24 N ATOM 1907 CA LEU B 23 21.931 16.379 6.372 1.00 60.42 C ATOM 1908 C LEU B 23 22.150 15.333 5.284 1.00 74.31 C ATOM 1909 O LEU B 23 21.303 14.471 5.058 1.00 34.01 O ATOM 1910 CB LEU B 23 21.359 17.659 5.758 1.00 62.13 C ATOM 1911 CG LEU B 23 20.326 17.467 4.649 1.00 44.52 C ATOM 1912 CD1 LEU B 23 19.113 18.353 4.890 1.00 33.53 C ATOM 1913 CD2 LEU B 23 20.941 17.763 3.289 1.00 12.23 C ATOM 0 H LEU B 23 23.527 17.616 6.940 1.00 15.24 H new ATOM 0 HA LEU B 23 21.219 15.981 7.095 1.00 60.42 H new ATOM 0 HB2 LEU B 23 20.903 18.248 6.554 1.00 62.13 H new ATOM 0 HB3 LEU B 23 22.185 18.248 5.360 1.00 62.13 H new ATOM 0 HG LEU B 23 20.000 16.427 4.660 1.00 44.52 H new ATOM 0 HD11 LEU B 23 18.388 18.203 4.090 1.00 33.53 H new ATOM 0 HD12 LEU B 23 18.658 18.094 5.846 1.00 33.53 H new ATOM 0 HD13 LEU B 23 19.423 19.398 4.907 1.00 33.53 H new ATOM 0 HD21 LEU B 23 20.190 17.621 2.512 1.00 12.23 H new ATOM 0 HD22 LEU B 23 21.296 18.793 3.267 1.00 12.23 H new ATOM 0 HD23 LEU B 23 21.778 17.087 3.113 1.00 12.23 H new ATOM 1925 N ALA B 24 23.296 15.416 4.613 1.00 31.24 N ATOM 1926 CA ALA B 24 23.629 14.474 3.552 1.00 75.43 C ATOM 1927 C ALA B 24 23.541 13.035 4.048 1.00 63.14 C ATOM 1928 O ALA B 24 23.326 12.110 3.263 1.00 31.23 O ATOM 1929 CB ALA B 24 25.020 14.763 3.008 1.00 65.45 C ATOM 0 H ALA B 24 24.008 16.126 4.786 1.00 31.24 H new ATOM 0 HA ALA B 24 22.903 14.598 2.748 1.00 75.43 H new ATOM 0 HB1 ALA B 24 25.256 14.052 2.216 1.00 65.45 H new ATOM 0 HB2 ALA B 24 25.051 15.776 2.607 1.00 65.45 H new ATOM 0 HB3 ALA B 24 25.751 14.668 3.811 1.00 65.45 H new ATOM 1935 N ASP B 25 23.707 12.852 5.353 1.00 53.33 N ATOM 1936 CA ASP B 25 23.646 11.524 5.952 1.00 63.20 C ATOM 1937 C ASP B 25 22.256 11.247 6.517 1.00 41.34 C ATOM 1938 O ASP B 25 21.837 10.094 6.624 1.00 55.50 O ATOM 1939 CB ASP B 25 24.695 11.392 7.058 1.00 35.03 C ATOM 1940 CG ASP B 25 25.801 10.422 6.693 1.00 31.34 C ATOM 1941 OD1 ASP B 25 25.654 9.217 6.986 1.00 43.25 O ATOM 1942 OD2 ASP B 25 26.815 10.868 6.114 1.00 75.51 O ATOM 0 H ASP B 25 23.885 13.606 6.016 1.00 53.33 H new ATOM 0 HA ASP B 25 23.855 10.790 5.173 1.00 63.20 H new ATOM 0 HB2 ASP B 25 25.127 12.371 7.263 1.00 35.03 H new ATOM 0 HB3 ASP B 25 24.211 11.058 7.976 1.00 35.03 H new ATOM 1947 N LEU B 26 21.547 12.311 6.878 1.00 71.41 N ATOM 1948 CA LEU B 26 20.204 12.182 7.433 1.00 64.24 C ATOM 1949 C LEU B 26 19.206 11.768 6.356 1.00 43.13 C ATOM 1950 O LEU B 26 18.151 11.207 6.654 1.00 10.22 O ATOM 1951 CB LEU B 26 19.765 13.502 8.069 1.00 4.31 C ATOM 1952 CG LEU B 26 19.949 13.611 9.584 1.00 10.30 C ATOM 1953 CD1 LEU B 26 21.082 14.569 9.917 1.00 61.54 C ATOM 1954 CD2 LEU B 26 18.655 14.060 10.247 1.00 62.25 C ATOM 0 H LEU B 26 21.879 13.272 6.796 1.00 71.41 H new ATOM 0 HA LEU B 26 20.228 11.406 8.198 1.00 64.24 H new ATOM 0 HB2 LEU B 26 20.320 14.312 7.596 1.00 4.31 H new ATOM 0 HB3 LEU B 26 18.711 13.661 7.839 1.00 4.31 H new ATOM 0 HG LEU B 26 20.209 12.626 9.971 1.00 10.30 H new ATOM 0 HD11 LEU B 26 21.198 14.634 10.999 1.00 61.54 H new ATOM 0 HD12 LEU B 26 22.009 14.204 9.474 1.00 61.54 H new ATOM 0 HD13 LEU B 26 20.853 15.557 9.517 1.00 61.54 H new ATOM 0 HD21 LEU B 26 18.804 14.132 11.324 1.00 62.25 H new ATOM 0 HD22 LEU B 26 18.364 15.035 9.855 1.00 62.25 H new ATOM 0 HD23 LEU B 26 17.868 13.335 10.037 1.00 62.25 H new ATOM 1966 N THR B 27 19.549 12.045 5.102 1.00 72.41 N ATOM 1967 CA THR B 27 18.685 11.700 3.980 1.00 53.05 C ATOM 1968 C THR B 27 19.354 10.685 3.061 1.00 51.22 C ATOM 1969 O THR B 27 18.710 10.100 2.192 1.00 32.24 O ATOM 1970 CB THR B 27 18.306 12.948 3.159 1.00 52.21 C ATOM 1971 OG1 THR B 27 19.470 13.485 2.521 1.00 2.43 O ATOM 1972 CG2 THR B 27 17.672 14.008 4.046 1.00 64.34 C ATOM 0 H THR B 27 20.419 12.507 4.838 1.00 72.41 H new ATOM 0 HA THR B 27 17.780 11.262 4.401 1.00 53.05 H new ATOM 0 HB THR B 27 17.581 12.652 2.401 1.00 52.21 H new ATOM 0 HG1 THR B 27 20.107 13.786 3.202 1.00 2.43 H new ATOM 0 HG21 THR B 27 17.413 14.879 3.444 1.00 64.34 H new ATOM 0 HG22 THR B 27 16.770 13.605 4.507 1.00 64.34 H new ATOM 0 HG23 THR B 27 18.377 14.301 4.824 1.00 64.34 H new ATOM 1980 N GLY B 28 20.653 10.481 3.260 1.00 31.12 N ATOM 1981 CA GLY B 28 21.389 9.534 2.441 1.00 0.51 C ATOM 1982 C GLY B 28 21.976 10.176 1.200 1.00 21.43 C ATOM 1983 O GLY B 28 22.748 9.549 0.474 1.00 31.15 O ATOM 0 H GLY B 28 21.209 10.954 3.973 1.00 31.12 H new ATOM 0 HA2 GLY B 28 22.191 9.093 3.033 1.00 0.51 H new ATOM 0 HA3 GLY B 28 20.726 8.720 2.147 1.00 0.51 H new ATOM 1987 N VAL B 29 21.609 11.430 0.954 1.00 41.33 N ATOM 1988 CA VAL B 29 22.105 12.156 -0.210 1.00 64.40 C ATOM 1989 C VAL B 29 23.628 12.237 -0.199 1.00 1.32 C ATOM 1990 O VAL B 29 24.253 12.476 0.834 1.00 12.41 O ATOM 1991 CB VAL B 29 21.525 13.582 -0.269 1.00 61.44 C ATOM 1992 CG1 VAL B 29 22.531 14.542 -0.886 1.00 50.43 C ATOM 1993 CG2 VAL B 29 20.218 13.594 -1.048 1.00 55.14 C ATOM 0 H VAL B 29 20.971 11.964 1.544 1.00 41.33 H new ATOM 0 HA VAL B 29 21.781 11.603 -1.092 1.00 64.40 H new ATOM 0 HB VAL B 29 21.318 13.914 0.748 1.00 61.44 H new ATOM 0 HG11 VAL B 29 22.104 15.544 -0.920 1.00 50.43 H new ATOM 0 HG12 VAL B 29 23.439 14.554 -0.283 1.00 50.43 H new ATOM 0 HG13 VAL B 29 22.772 14.216 -1.898 1.00 50.43 H new ATOM 0 HG21 VAL B 29 19.823 14.609 -1.080 1.00 55.14 H new ATOM 0 HG22 VAL B 29 20.397 13.243 -2.064 1.00 55.14 H new ATOM 0 HG23 VAL B 29 19.497 12.939 -0.559 1.00 55.14 H new ATOM 2003 N PRO B 30 24.239 12.036 -1.376 1.00 64.31 N ATOM 2004 CA PRO B 30 25.696 12.084 -1.530 1.00 44.21 C ATOM 2005 C PRO B 30 26.250 13.495 -1.371 1.00 55.44 C ATOM 2006 O PRO B 30 25.867 14.408 -2.103 1.00 52.10 O ATOM 2007 CB PRO B 30 25.919 11.578 -2.956 1.00 72.05 C ATOM 2008 CG PRO B 30 24.648 11.886 -3.670 1.00 25.14 C ATOM 2009 CD PRO B 30 23.554 11.748 -2.647 1.00 2.43 C ATOM 0 HA PRO B 30 26.206 11.493 -0.769 1.00 44.21 H new ATOM 0 HB2 PRO B 30 26.767 12.077 -3.425 1.00 72.05 H new ATOM 0 HB3 PRO B 30 26.131 10.509 -2.968 1.00 72.05 H new ATOM 0 HG2 PRO B 30 24.668 12.893 -4.086 1.00 25.14 H new ATOM 0 HG3 PRO B 30 24.492 11.200 -4.503 1.00 25.14 H new ATOM 0 HD2 PRO B 30 22.740 12.448 -2.832 1.00 2.43 H new ATOM 0 HD3 PRO B 30 23.122 10.747 -2.653 1.00 2.43 H new ATOM 2017 N TYR B 31 27.154 13.668 -0.413 1.00 55.04 N ATOM 2018 CA TYR B 31 27.759 14.968 -0.159 1.00 73.24 C ATOM 2019 C TYR B 31 28.512 15.469 -1.388 1.00 50.10 C ATOM 2020 O TYR B 31 28.618 16.674 -1.617 1.00 14.12 O ATOM 2021 CB TYR B 31 28.711 14.888 1.036 1.00 71.51 C ATOM 2022 CG TYR B 31 29.466 16.171 1.298 1.00 71.30 C ATOM 2023 CD1 TYR B 31 28.916 17.176 2.084 1.00 11.35 C ATOM 2024 CD2 TYR B 31 30.730 16.378 0.759 1.00 4.21 C ATOM 2025 CE1 TYR B 31 29.602 18.350 2.324 1.00 75.30 C ATOM 2026 CE2 TYR B 31 31.424 17.549 0.995 1.00 23.24 C ATOM 2027 CZ TYR B 31 30.856 18.531 1.778 1.00 13.24 C ATOM 2028 OH TYR B 31 31.544 19.700 2.017 1.00 2.20 O ATOM 0 H TYR B 31 27.484 12.923 0.200 1.00 55.04 H new ATOM 0 HA TYR B 31 26.959 15.673 0.068 1.00 73.24 H new ATOM 0 HB2 TYR B 31 28.141 14.624 1.927 1.00 71.51 H new ATOM 0 HB3 TYR B 31 29.427 14.084 0.866 1.00 71.51 H new ATOM 0 HD1 TYR B 31 27.935 17.037 2.515 1.00 11.35 H new ATOM 0 HD2 TYR B 31 31.177 15.610 0.145 1.00 4.21 H new ATOM 0 HE1 TYR B 31 29.159 19.122 2.936 1.00 75.30 H new ATOM 0 HE2 TYR B 31 32.406 17.694 0.569 1.00 23.24 H new ATOM 0 HH TYR B 31 32.411 19.668 1.562 1.00 2.20 H new ATOM 2038 N GLY B 32 29.031 14.534 -2.178 1.00 45.13 N ATOM 2039 CA GLY B 32 29.766 14.899 -3.376 1.00 74.01 C ATOM 2040 C GLY B 32 28.931 15.715 -4.343 1.00 73.43 C ATOM 2041 O GLY B 32 29.453 16.576 -5.051 1.00 1.33 O ATOM 0 H GLY B 32 28.956 13.531 -2.010 1.00 45.13 H new ATOM 0 HA2 GLY B 32 30.652 15.469 -3.095 1.00 74.01 H new ATOM 0 HA3 GLY B 32 30.114 13.994 -3.875 1.00 74.01 H new ATOM 2045 N THR B 33 27.630 15.443 -4.373 1.00 10.04 N ATOM 2046 CA THR B 33 26.723 16.156 -5.262 1.00 11.04 C ATOM 2047 C THR B 33 25.916 17.202 -4.501 1.00 2.51 C ATOM 2048 O THR B 33 25.546 18.239 -5.054 1.00 23.25 O ATOM 2049 CB THR B 33 25.752 15.189 -5.968 1.00 3.23 C ATOM 2050 OG1 THR B 33 26.405 13.942 -6.225 1.00 14.15 O ATOM 2051 CG2 THR B 33 25.251 15.784 -7.276 1.00 42.22 C ATOM 0 H THR B 33 27.182 14.734 -3.792 1.00 10.04 H new ATOM 0 HA THR B 33 27.340 16.652 -6.011 1.00 11.04 H new ATOM 0 HB THR B 33 24.897 15.023 -5.312 1.00 3.23 H new ATOM 0 HG1 THR B 33 25.781 13.332 -6.672 1.00 14.15 H new ATOM 0 HG21 THR B 33 24.567 15.084 -7.756 1.00 42.22 H new ATOM 0 HG22 THR B 33 24.729 16.719 -7.074 1.00 42.22 H new ATOM 0 HG23 THR B 33 26.097 15.976 -7.936 1.00 42.22 H new ATOM 2059 N LEU B 34 25.646 16.925 -3.230 1.00 5.42 N ATOM 2060 CA LEU B 34 24.883 17.843 -2.393 1.00 11.23 C ATOM 2061 C LEU B 34 25.473 19.249 -2.448 1.00 53.41 C ATOM 2062 O LEU B 34 24.741 20.238 -2.482 1.00 25.43 O ATOM 2063 CB LEU B 34 24.860 17.344 -0.946 1.00 44.11 C ATOM 2064 CG LEU B 34 24.198 18.272 0.073 1.00 20.43 C ATOM 2065 CD1 LEU B 34 22.687 18.253 -0.092 1.00 30.33 C ATOM 2066 CD2 LEU B 34 24.587 17.872 1.489 1.00 54.42 C ATOM 0 H LEU B 34 25.944 16.072 -2.757 1.00 5.42 H new ATOM 0 HA LEU B 34 23.863 17.882 -2.775 1.00 11.23 H new ATOM 0 HB2 LEU B 34 24.344 16.384 -0.922 1.00 44.11 H new ATOM 0 HB3 LEU B 34 25.887 17.162 -0.629 1.00 44.11 H new ATOM 0 HG LEU B 34 24.550 19.288 -0.106 1.00 20.43 H new ATOM 0 HD11 LEU B 34 22.233 18.919 0.641 1.00 30.33 H new ATOM 0 HD12 LEU B 34 22.426 18.587 -1.096 1.00 30.33 H new ATOM 0 HD13 LEU B 34 22.317 17.239 0.060 1.00 30.33 H new ATOM 0 HD21 LEU B 34 24.107 18.543 2.201 1.00 54.42 H new ATOM 0 HD22 LEU B 34 24.264 16.849 1.680 1.00 54.42 H new ATOM 0 HD23 LEU B 34 25.669 17.938 1.601 1.00 54.42 H new ATOM 2078 N SER B 35 26.799 19.328 -2.461 1.00 61.31 N ATOM 2079 CA SER B 35 27.486 20.614 -2.512 1.00 34.14 C ATOM 2080 C SER B 35 26.981 21.454 -3.681 1.00 4.52 C ATOM 2081 O SER B 35 26.993 22.684 -3.626 1.00 30.41 O ATOM 2082 CB SER B 35 28.997 20.403 -2.636 1.00 14.21 C ATOM 2083 OG SER B 35 29.622 21.529 -3.227 1.00 62.41 O ATOM 0 H SER B 35 27.419 18.518 -2.437 1.00 61.31 H new ATOM 0 HA SER B 35 27.275 21.148 -1.586 1.00 34.14 H new ATOM 0 HB2 SER B 35 29.424 20.222 -1.650 1.00 14.21 H new ATOM 0 HB3 SER B 35 29.195 19.516 -3.237 1.00 14.21 H new ATOM 0 HG SER B 35 30.587 21.370 -3.294 1.00 62.41 H new ATOM 2089 N TYR B 36 26.540 20.781 -4.738 1.00 41.34 N ATOM 2090 CA TYR B 36 26.033 21.465 -5.922 1.00 34.30 C ATOM 2091 C TYR B 36 24.514 21.599 -5.864 1.00 45.21 C ATOM 2092 O TYR B 36 23.927 22.434 -6.553 1.00 45.01 O ATOM 2093 CB TYR B 36 26.441 20.708 -7.187 1.00 40.31 C ATOM 2094 CG TYR B 36 27.889 20.270 -7.189 1.00 34.30 C ATOM 2095 CD1 TYR B 36 28.916 21.197 -7.065 1.00 32.43 C ATOM 2096 CD2 TYR B 36 28.228 18.929 -7.317 1.00 45.14 C ATOM 2097 CE1 TYR B 36 30.240 20.802 -7.068 1.00 62.53 C ATOM 2098 CE2 TYR B 36 29.550 18.525 -7.319 1.00 64.54 C ATOM 2099 CZ TYR B 36 30.551 19.465 -7.195 1.00 62.20 C ATOM 2100 OH TYR B 36 31.868 19.066 -7.198 1.00 51.03 O ATOM 0 H TYR B 36 26.523 19.763 -4.799 1.00 41.34 H new ATOM 0 HA TYR B 36 26.468 22.464 -5.948 1.00 34.30 H new ATOM 0 HB2 TYR B 36 25.804 19.830 -7.297 1.00 40.31 H new ATOM 0 HB3 TYR B 36 26.261 21.343 -8.055 1.00 40.31 H new ATOM 0 HD1 TYR B 36 28.675 22.245 -6.964 1.00 32.43 H new ATOM 0 HD2 TYR B 36 27.446 18.190 -7.417 1.00 45.14 H new ATOM 0 HE1 TYR B 36 31.026 21.536 -6.971 1.00 62.53 H new ATOM 0 HE2 TYR B 36 29.797 17.478 -7.417 1.00 64.54 H new ATOM 0 HH TYR B 36 31.914 18.092 -7.294 1.00 51.03 H new ATOM 2110 N TYR B 37 23.885 20.772 -5.038 1.00 23.03 N ATOM 2111 CA TYR B 37 22.434 20.796 -4.890 1.00 71.53 C ATOM 2112 C TYR B 37 21.970 22.119 -4.290 1.00 1.34 C ATOM 2113 O TYR B 37 21.363 22.943 -4.973 1.00 12.02 O ATOM 2114 CB TYR B 37 21.971 19.633 -4.011 1.00 44.25 C ATOM 2115 CG TYR B 37 21.717 18.356 -4.780 1.00 22.43 C ATOM 2116 CD1 TYR B 37 22.458 18.046 -5.915 1.00 52.14 C ATOM 2117 CD2 TYR B 37 20.737 17.459 -4.372 1.00 15.42 C ATOM 2118 CE1 TYR B 37 22.230 16.881 -6.620 1.00 2.53 C ATOM 2119 CE2 TYR B 37 20.503 16.291 -5.071 1.00 0.41 C ATOM 2120 CZ TYR B 37 21.251 16.006 -6.194 1.00 71.12 C ATOM 2121 OH TYR B 37 21.022 14.843 -6.894 1.00 2.50 O ATOM 0 H TYR B 37 24.356 20.076 -4.460 1.00 23.03 H new ATOM 0 HA TYR B 37 21.991 20.692 -5.880 1.00 71.53 H new ATOM 0 HB2 TYR B 37 22.725 19.443 -3.247 1.00 44.25 H new ATOM 0 HB3 TYR B 37 21.057 19.922 -3.492 1.00 44.25 H new ATOM 0 HD1 TYR B 37 23.225 18.728 -6.251 1.00 52.14 H new ATOM 0 HD2 TYR B 37 20.148 17.679 -3.494 1.00 15.42 H new ATOM 0 HE1 TYR B 37 22.814 16.656 -7.500 1.00 2.53 H new ATOM 0 HE2 TYR B 37 19.738 15.604 -4.740 1.00 0.41 H new ATOM 0 HH TYR B 37 20.302 14.338 -6.462 1.00 2.50 H new ATOM 2131 N GLU B 38 22.260 22.314 -3.008 1.00 43.22 N ATOM 2132 CA GLU B 38 21.872 23.536 -2.315 1.00 44.31 C ATOM 2133 C GLU B 38 22.467 24.763 -3.000 1.00 24.45 C ATOM 2134 O GLU B 38 21.968 25.878 -2.843 1.00 42.22 O ATOM 2135 CB GLU B 38 22.324 23.486 -0.853 1.00 11.21 C ATOM 2136 CG GLU B 38 23.833 23.435 -0.685 1.00 54.50 C ATOM 2137 CD GLU B 38 24.402 24.726 -0.128 1.00 35.11 C ATOM 2138 OE1 GLU B 38 24.524 25.701 -0.901 1.00 63.32 O ATOM 2139 OE2 GLU B 38 24.725 24.763 1.077 1.00 70.20 O ATOM 0 H GLU B 38 22.762 21.641 -2.428 1.00 43.22 H new ATOM 0 HA GLU B 38 20.785 23.613 -2.350 1.00 44.31 H new ATOM 0 HB2 GLU B 38 21.938 24.362 -0.332 1.00 11.21 H new ATOM 0 HB3 GLU B 38 21.884 22.611 -0.375 1.00 11.21 H new ATOM 0 HG2 GLU B 38 24.093 22.611 -0.020 1.00 54.50 H new ATOM 0 HG3 GLU B 38 24.295 23.225 -1.649 1.00 54.50 H new ATOM 2146 N SER B 39 23.537 24.549 -3.760 1.00 53.34 N ATOM 2147 CA SER B 39 24.203 25.636 -4.466 1.00 70.11 C ATOM 2148 C SER B 39 23.410 26.048 -5.703 1.00 24.54 C ATOM 2149 O SER B 39 23.671 27.088 -6.305 1.00 41.42 O ATOM 2150 CB SER B 39 25.618 25.219 -4.870 1.00 1.22 C ATOM 2151 OG SER B 39 26.529 25.404 -3.801 1.00 11.15 O ATOM 0 H SER B 39 23.961 23.632 -3.902 1.00 53.34 H new ATOM 0 HA SER B 39 24.262 26.491 -3.792 1.00 70.11 H new ATOM 0 HB2 SER B 39 25.619 24.173 -5.176 1.00 1.22 H new ATOM 0 HB3 SER B 39 25.940 25.803 -5.732 1.00 1.22 H new ATOM 0 HG SER B 39 26.877 24.534 -3.513 1.00 11.15 H new ATOM 2157 N GLY B 40 22.436 25.221 -6.076 1.00 41.23 N ATOM 2158 CA GLY B 40 21.619 25.515 -7.238 1.00 73.32 C ATOM 2159 C GLY B 40 22.368 25.309 -8.541 1.00 71.50 C ATOM 2160 O GLY B 40 21.975 25.836 -9.581 1.00 64.32 O ATOM 0 H GLY B 40 22.199 24.354 -5.594 1.00 41.23 H new ATOM 0 HA2 GLY B 40 20.734 24.879 -7.227 1.00 73.32 H new ATOM 0 HA3 GLY B 40 21.271 26.546 -7.182 1.00 73.32 H new ATOM 2164 N ARG B 41 23.450 24.540 -8.483 1.00 73.33 N ATOM 2165 CA ARG B 41 24.256 24.267 -9.667 1.00 73.31 C ATOM 2166 C ARG B 41 23.457 23.479 -10.700 1.00 30.24 C ATOM 2167 O ARG B 41 23.714 23.572 -11.902 1.00 23.15 O ATOM 2168 CB ARG B 41 25.517 23.490 -9.283 1.00 2.45 C ATOM 2169 CG ARG B 41 26.738 23.864 -10.109 1.00 71.20 C ATOM 2170 CD ARG B 41 27.344 25.178 -9.645 1.00 3.45 C ATOM 2171 NE ARG B 41 28.192 25.783 -10.669 1.00 73.34 N ATOM 2172 CZ ARG B 41 28.844 26.928 -10.503 1.00 44.45 C ATOM 2173 NH1 ARG B 41 28.746 27.589 -9.358 1.00 73.10 N ATOM 2174 NH2 ARG B 41 29.597 27.413 -11.482 1.00 72.43 N ATOM 0 H ARG B 41 23.789 24.095 -7.630 1.00 73.33 H new ATOM 0 HA ARG B 41 24.544 25.222 -10.107 1.00 73.31 H new ATOM 0 HB2 ARG B 41 25.734 23.664 -8.229 1.00 2.45 H new ATOM 0 HB3 ARG B 41 25.325 22.423 -9.396 1.00 2.45 H new ATOM 0 HG2 ARG B 41 27.484 23.073 -10.036 1.00 71.20 H new ATOM 0 HG3 ARG B 41 26.458 23.942 -11.159 1.00 71.20 H new ATOM 0 HD2 ARG B 41 26.546 25.871 -9.380 1.00 3.45 H new ATOM 0 HD3 ARG B 41 27.931 25.007 -8.743 1.00 3.45 H new ATOM 0 HE ARG B 41 28.289 25.299 -11.562 1.00 73.34 H new ATOM 0 HH11 ARG B 41 28.169 27.218 -8.603 1.00 73.10 H new ATOM 0 HH12 ARG B 41 29.247 28.468 -9.232 1.00 73.10 H new ATOM 0 HH21 ARG B 41 29.676 26.906 -12.364 1.00 72.43 H new ATOM 0 HH22 ARG B 41 30.097 28.293 -11.353 1.00 72.43 H new ATOM 2188 N SER B 42 22.487 22.704 -10.226 1.00 53.33 N ATOM 2189 CA SER B 42 21.653 21.898 -11.109 1.00 23.23 C ATOM 2190 C SER B 42 20.357 21.493 -10.411 1.00 3.44 C ATOM 2191 O SER B 42 20.376 20.819 -9.381 1.00 55.33 O ATOM 2192 CB SER B 42 22.412 20.650 -11.563 1.00 33.02 C ATOM 2193 OG SER B 42 22.539 20.616 -12.975 1.00 14.24 O ATOM 0 H SER B 42 22.259 22.617 -9.236 1.00 53.33 H new ATOM 0 HA SER B 42 21.403 22.500 -11.982 1.00 23.23 H new ATOM 0 HB2 SER B 42 23.401 20.635 -11.105 1.00 33.02 H new ATOM 0 HB3 SER B 42 21.889 19.757 -11.220 1.00 33.02 H new ATOM 0 HG SER B 42 23.029 19.810 -13.240 1.00 14.24 H new ATOM 2199 N THR B 43 19.231 21.911 -10.980 1.00 54.02 N ATOM 2200 CA THR B 43 17.925 21.594 -10.414 1.00 44.13 C ATOM 2201 C THR B 43 17.767 20.092 -10.204 1.00 62.42 C ATOM 2202 O THR B 43 17.663 19.315 -11.154 1.00 42.45 O ATOM 2203 CB THR B 43 16.784 22.097 -11.317 1.00 15.34 C ATOM 2204 OG1 THR B 43 17.265 23.130 -12.185 1.00 15.25 O ATOM 2205 CG2 THR B 43 15.627 22.626 -10.483 1.00 51.13 C ATOM 0 H THR B 43 19.197 22.470 -11.833 1.00 54.02 H new ATOM 0 HA THR B 43 17.866 22.101 -9.451 1.00 44.13 H new ATOM 0 HB THR B 43 16.427 21.258 -11.915 1.00 15.34 H new ATOM 0 HG1 THR B 43 16.534 23.443 -12.757 1.00 15.25 H new ATOM 0 HG21 THR B 43 14.833 22.976 -11.143 1.00 51.13 H new ATOM 0 HG22 THR B 43 15.244 21.829 -9.845 1.00 51.13 H new ATOM 0 HG23 THR B 43 15.974 23.453 -9.863 1.00 51.13 H new ATOM 2213 N PRO B 44 17.747 19.671 -8.931 1.00 34.10 N ATOM 2214 CA PRO B 44 17.601 18.258 -8.567 1.00 64.22 C ATOM 2215 C PRO B 44 16.205 17.724 -8.868 1.00 65.12 C ATOM 2216 O PRO B 44 15.262 18.481 -9.103 1.00 43.23 O ATOM 2217 CB PRO B 44 17.862 18.252 -7.059 1.00 42.35 C ATOM 2218 CG PRO B 44 17.512 19.628 -6.608 1.00 43.14 C ATOM 2219 CD PRO B 44 17.867 20.541 -7.749 1.00 4.14 C ATOM 0 HA PRO B 44 18.278 17.619 -9.133 1.00 64.22 H new ATOM 0 HB2 PRO B 44 17.252 17.503 -6.555 1.00 42.35 H new ATOM 0 HB3 PRO B 44 18.903 18.016 -6.838 1.00 42.35 H new ATOM 0 HG2 PRO B 44 16.452 19.701 -6.365 1.00 43.14 H new ATOM 0 HG3 PRO B 44 18.065 19.896 -5.707 1.00 43.14 H new ATOM 0 HD2 PRO B 44 17.190 21.394 -7.807 1.00 4.14 H new ATOM 0 HD3 PRO B 44 18.876 20.941 -7.645 1.00 4.14 H new ATOM 2227 N PRO B 45 16.066 16.390 -8.860 1.00 22.42 N ATOM 2228 CA PRO B 45 14.787 15.725 -9.130 1.00 43.51 C ATOM 2229 C PRO B 45 13.778 15.934 -8.007 1.00 62.05 C ATOM 2230 O PRO B 45 14.048 16.646 -7.039 1.00 14.40 O ATOM 2231 CB PRO B 45 15.172 14.248 -9.235 1.00 65.34 C ATOM 2232 CG PRO B 45 16.419 14.121 -8.431 1.00 42.52 C ATOM 2233 CD PRO B 45 17.147 15.428 -8.588 1.00 44.51 C ATOM 0 HA PRO B 45 14.303 16.118 -10.024 1.00 43.51 H new ATOM 0 HB2 PRO B 45 14.383 13.605 -8.845 1.00 65.34 H new ATOM 0 HB3 PRO B 45 15.338 13.955 -10.272 1.00 65.34 H new ATOM 0 HG2 PRO B 45 16.190 13.925 -7.384 1.00 42.52 H new ATOM 0 HG3 PRO B 45 17.029 13.290 -8.785 1.00 42.52 H new ATOM 0 HD2 PRO B 45 17.701 15.690 -7.687 1.00 44.51 H new ATOM 0 HD3 PRO B 45 17.867 15.391 -9.405 1.00 44.51 H new ATOM 2241 N THR B 46 12.612 15.309 -8.141 1.00 11.44 N ATOM 2242 CA THR B 46 11.561 15.426 -7.138 1.00 63.42 C ATOM 2243 C THR B 46 11.711 14.363 -6.058 1.00 5.13 C ATOM 2244 O THR B 46 11.451 14.617 -4.882 1.00 4.01 O ATOM 2245 CB THR B 46 10.163 15.305 -7.773 1.00 52.33 C ATOM 2246 OG1 THR B 46 9.970 16.344 -8.738 1.00 33.31 O ATOM 2247 CG2 THR B 46 9.078 15.386 -6.710 1.00 3.02 C ATOM 0 H THR B 46 12.372 14.716 -8.935 1.00 11.44 H new ATOM 0 HA THR B 46 11.662 16.413 -6.687 1.00 63.42 H new ATOM 0 HB THR B 46 10.096 14.336 -8.267 1.00 52.33 H new ATOM 0 HG1 THR B 46 10.658 16.277 -9.433 1.00 33.31 H new ATOM 0 HG21 THR B 46 8.099 15.298 -7.182 1.00 3.02 H new ATOM 0 HG22 THR B 46 9.209 14.575 -5.993 1.00 3.02 H new ATOM 0 HG23 THR B 46 9.147 16.343 -6.192 1.00 3.02 H new ATOM 2255 N ASP B 47 12.132 13.170 -6.462 1.00 1.43 N ATOM 2256 CA ASP B 47 12.319 12.066 -5.528 1.00 54.30 C ATOM 2257 C ASP B 47 13.321 12.439 -4.439 1.00 63.03 C ATOM 2258 O ASP B 47 13.211 11.989 -3.298 1.00 32.00 O ATOM 2259 CB ASP B 47 12.795 10.816 -6.269 1.00 61.00 C ATOM 2260 CG ASP B 47 12.159 9.548 -5.733 1.00 74.43 C ATOM 2261 OD1 ASP B 47 11.580 9.596 -4.628 1.00 53.32 O ATOM 2262 OD2 ASP B 47 12.241 8.508 -6.420 1.00 4.34 O ATOM 0 H ASP B 47 12.351 12.942 -7.432 1.00 1.43 H new ATOM 0 HA ASP B 47 11.359 11.855 -5.057 1.00 54.30 H new ATOM 0 HB2 ASP B 47 12.563 10.915 -7.329 1.00 61.00 H new ATOM 0 HB3 ASP B 47 13.879 10.739 -6.186 1.00 61.00 H new ATOM 2267 N VAL B 48 14.299 13.265 -4.800 1.00 74.22 N ATOM 2268 CA VAL B 48 15.320 13.699 -3.855 1.00 22.51 C ATOM 2269 C VAL B 48 14.862 14.926 -3.075 1.00 4.50 C ATOM 2270 O VAL B 48 14.970 14.972 -1.850 1.00 11.21 O ATOM 2271 CB VAL B 48 16.645 14.023 -4.570 1.00 0.11 C ATOM 2272 CG1 VAL B 48 17.679 14.529 -3.575 1.00 24.23 C ATOM 2273 CG2 VAL B 48 17.162 12.800 -5.314 1.00 54.21 C ATOM 0 H VAL B 48 14.405 13.646 -5.740 1.00 74.22 H new ATOM 0 HA VAL B 48 15.482 12.873 -3.163 1.00 22.51 H new ATOM 0 HB VAL B 48 16.461 14.812 -5.299 1.00 0.11 H new ATOM 0 HG11 VAL B 48 18.609 14.753 -4.098 1.00 24.23 H new ATOM 0 HG12 VAL B 48 17.308 15.433 -3.092 1.00 24.23 H new ATOM 0 HG13 VAL B 48 17.863 13.764 -2.820 1.00 24.23 H new ATOM 0 HG21 VAL B 48 18.099 13.047 -5.813 1.00 54.21 H new ATOM 0 HG22 VAL B 48 17.331 11.988 -4.606 1.00 54.21 H new ATOM 0 HG23 VAL B 48 16.427 12.488 -6.056 1.00 54.21 H new ATOM 2283 N MET B 49 14.350 15.919 -3.794 1.00 33.43 N ATOM 2284 CA MET B 49 13.873 17.147 -3.170 1.00 40.22 C ATOM 2285 C MET B 49 12.824 16.844 -2.105 1.00 4.22 C ATOM 2286 O MET B 49 12.603 17.640 -1.193 1.00 1.31 O ATOM 2287 CB MET B 49 13.288 18.088 -4.225 1.00 44.14 C ATOM 2288 CG MET B 49 11.804 17.872 -4.477 1.00 51.34 C ATOM 2289 SD MET B 49 10.767 18.988 -3.514 1.00 51.12 S ATOM 2290 CE MET B 49 9.568 17.840 -2.841 1.00 51.15 C ATOM 0 H MET B 49 14.255 15.897 -4.809 1.00 33.43 H new ATOM 0 HA MET B 49 14.722 17.634 -2.691 1.00 40.22 H new ATOM 0 HB2 MET B 49 13.448 19.119 -3.909 1.00 44.14 H new ATOM 0 HB3 MET B 49 13.830 17.953 -5.161 1.00 44.14 H new ATOM 0 HG2 MET B 49 11.595 18.013 -5.538 1.00 51.34 H new ATOM 0 HG3 MET B 49 11.544 16.841 -4.235 1.00 51.34 H new ATOM 0 HE1 MET B 49 8.584 18.308 -2.827 1.00 51.15 H new ATOM 0 HE2 MET B 49 9.535 16.944 -3.461 1.00 51.15 H new ATOM 0 HE3 MET B 49 9.855 17.568 -1.825 1.00 51.15 H new ATOM 2300 N MET B 50 12.179 15.688 -2.228 1.00 73.41 N ATOM 2301 CA MET B 50 11.153 15.281 -1.274 1.00 53.21 C ATOM 2302 C MET B 50 11.760 14.459 -0.142 1.00 3.12 C ATOM 2303 O MET B 50 11.184 14.355 0.940 1.00 20.05 O ATOM 2304 CB MET B 50 10.064 14.471 -1.981 1.00 34.20 C ATOM 2305 CG MET B 50 10.524 13.093 -2.427 1.00 34.23 C ATOM 2306 SD MET B 50 9.465 11.772 -1.807 1.00 14.43 S ATOM 2307 CE MET B 50 7.850 12.381 -2.287 1.00 65.11 C ATOM 0 H MET B 50 12.348 15.017 -2.978 1.00 73.41 H new ATOM 0 HA MET B 50 10.709 16.181 -0.848 1.00 53.21 H new ATOM 0 HB2 MET B 50 9.212 14.361 -1.311 1.00 34.20 H new ATOM 0 HB3 MET B 50 9.716 15.028 -2.851 1.00 34.20 H new ATOM 0 HG2 MET B 50 10.544 13.056 -3.516 1.00 34.23 H new ATOM 0 HG3 MET B 50 11.545 12.926 -2.083 1.00 34.23 H new ATOM 0 HE1 MET B 50 7.178 12.344 -1.430 1.00 65.11 H new ATOM 0 HE2 MET B 50 7.938 13.410 -2.635 1.00 65.11 H new ATOM 0 HE3 MET B 50 7.451 11.760 -3.089 1.00 65.11 H new ATOM 2317 N ASN B 51 12.926 13.875 -0.398 1.00 10.42 N ATOM 2318 CA ASN B 51 13.611 13.062 0.600 1.00 73.03 C ATOM 2319 C ASN B 51 14.327 13.941 1.621 1.00 51.31 C ATOM 2320 O ASN B 51 14.716 13.475 2.691 1.00 61.22 O ATOM 2321 CB ASN B 51 14.614 12.125 -0.076 1.00 41.34 C ATOM 2322 CG ASN B 51 14.072 10.719 -0.239 1.00 53.40 C ATOM 2323 OD1 ASN B 51 12.845 10.612 -0.735 1.00 40.12 O flip ATOM 2324 ND2 ASN B 51 14.750 9.740 0.075 1.00 25.24 N flip ATOM 0 H ASN B 51 13.417 13.950 -1.289 1.00 10.42 H new ATOM 0 HA ASN B 51 12.862 12.466 1.122 1.00 73.03 H new ATOM 0 HB2 ASN B 51 14.878 12.525 -1.055 1.00 41.34 H new ATOM 0 HB3 ASN B 51 15.530 12.092 0.513 1.00 41.34 H new ATOM 0 HD21 ASN B 51 15.689 9.870 0.453 1.00 25.24 H new ATOM 0 HD22 ASN B 51 14.373 8.800 -0.043 1.00 25.24 H new ATOM 2331 N ILE B 52 14.495 15.215 1.281 1.00 15.14 N ATOM 2332 CA ILE B 52 15.162 16.160 2.169 1.00 71.33 C ATOM 2333 C ILE B 52 14.163 16.836 3.103 1.00 63.34 C ATOM 2334 O ILE B 52 14.504 17.214 4.224 1.00 22.32 O ATOM 2335 CB ILE B 52 15.917 17.241 1.375 1.00 0.12 C ATOM 2336 CG1 ILE B 52 16.776 16.598 0.284 1.00 22.15 C ATOM 2337 CG2 ILE B 52 16.778 18.080 2.308 1.00 64.33 C ATOM 2338 CD1 ILE B 52 17.447 15.315 0.722 1.00 3.43 C ATOM 0 H ILE B 52 14.179 15.616 0.398 1.00 15.14 H new ATOM 0 HA ILE B 52 15.878 15.587 2.759 1.00 71.33 H new ATOM 0 HB ILE B 52 15.187 17.896 0.898 1.00 0.12 H new ATOM 0 HG12 ILE B 52 16.152 16.394 -0.586 1.00 22.15 H new ATOM 0 HG13 ILE B 52 17.540 17.309 -0.032 1.00 22.15 H new ATOM 0 HG21 ILE B 52 17.305 18.840 1.731 1.00 64.33 H new ATOM 0 HG22 ILE B 52 16.144 18.564 3.051 1.00 64.33 H new ATOM 0 HG23 ILE B 52 17.502 17.438 2.810 1.00 64.33 H new ATOM 0 HD11 ILE B 52 18.039 14.915 -0.101 1.00 3.43 H new ATOM 0 HD12 ILE B 52 18.098 15.517 1.573 1.00 3.43 H new ATOM 0 HD13 ILE B 52 16.688 14.588 1.010 1.00 3.43 H new ATOM 2350 N LEU B 53 12.929 16.982 2.635 1.00 63.51 N ATOM 2351 CA LEU B 53 11.879 17.610 3.429 1.00 30.02 C ATOM 2352 C LEU B 53 11.121 16.571 4.248 1.00 3.01 C ATOM 2353 O LEU B 53 10.619 16.868 5.332 1.00 32.54 O ATOM 2354 CB LEU B 53 10.909 18.367 2.520 1.00 71.32 C ATOM 2355 CG LEU B 53 11.059 19.888 2.497 1.00 24.34 C ATOM 2356 CD1 LEU B 53 12.521 20.278 2.348 1.00 64.42 C ATOM 2357 CD2 LEU B 53 10.229 20.489 1.372 1.00 70.41 C ATOM 0 H LEU B 53 12.631 16.674 1.710 1.00 63.51 H new ATOM 0 HA LEU B 53 12.349 18.314 4.116 1.00 30.02 H new ATOM 0 HB2 LEU B 53 11.030 17.995 1.503 1.00 71.32 H new ATOM 0 HB3 LEU B 53 9.891 18.127 2.828 1.00 71.32 H new ATOM 0 HG LEU B 53 10.693 20.284 3.444 1.00 24.34 H new ATOM 0 HD11 LEU B 53 12.608 21.364 2.334 1.00 64.42 H new ATOM 0 HD12 LEU B 53 13.091 19.879 3.187 1.00 64.42 H new ATOM 0 HD13 LEU B 53 12.913 19.870 1.416 1.00 64.42 H new ATOM 0 HD21 LEU B 53 10.348 21.572 1.371 1.00 70.41 H new ATOM 0 HD22 LEU B 53 10.565 20.086 0.417 1.00 70.41 H new ATOM 0 HD23 LEU B 53 9.179 20.240 1.522 1.00 70.41 H new ATOM 2369 N GLN B 54 11.043 15.352 3.723 1.00 45.30 N ATOM 2370 CA GLN B 54 10.348 14.269 4.407 1.00 4.44 C ATOM 2371 C GLN B 54 10.932 14.039 5.797 1.00 73.55 C ATOM 2372 O GLN B 54 10.263 13.507 6.684 1.00 22.03 O ATOM 2373 CB GLN B 54 10.431 12.981 3.586 1.00 31.43 C ATOM 2374 CG GLN B 54 11.824 12.375 3.547 1.00 54.24 C ATOM 2375 CD GLN B 54 11.846 11.004 2.900 1.00 53.44 C ATOM 2376 OE1 GLN B 54 11.149 10.868 1.779 1.00 62.11 O flip ATOM 2377 NE2 GLN B 54 12.484 10.078 3.403 1.00 32.34 N flip ATOM 0 H GLN B 54 11.453 15.090 2.826 1.00 45.30 H new ATOM 0 HA GLN B 54 9.302 14.555 4.515 1.00 4.44 H new ATOM 0 HB2 GLN B 54 9.737 12.250 4.001 1.00 31.43 H new ATOM 0 HB3 GLN B 54 10.105 13.188 2.567 1.00 31.43 H new ATOM 0 HG2 GLN B 54 12.491 13.041 3.000 1.00 54.24 H new ATOM 0 HG3 GLN B 54 12.212 12.299 4.563 1.00 54.24 H new ATOM 0 HE21 GLN B 54 13.006 10.228 4.266 1.00 32.34 H new ATOM 0 HE22 GLN B 54 12.490 9.161 2.956 1.00 32.34 H new ATOM 2386 N THR B 55 12.185 14.443 5.981 1.00 55.12 N ATOM 2387 CA THR B 55 12.860 14.279 7.263 1.00 13.51 C ATOM 2388 C THR B 55 12.060 14.920 8.391 1.00 42.11 C ATOM 2389 O THR B 55 11.356 15.911 8.200 1.00 72.25 O ATOM 2390 CB THR B 55 14.273 14.894 7.236 1.00 53.41 C ATOM 2391 OG1 THR B 55 14.239 16.170 6.588 1.00 50.54 O ATOM 2392 CG2 THR B 55 15.248 13.978 6.513 1.00 63.21 C ATOM 0 H THR B 55 12.753 14.886 5.259 1.00 55.12 H new ATOM 0 HA THR B 55 12.942 13.207 7.443 1.00 13.51 H new ATOM 0 HB THR B 55 14.611 15.018 8.265 1.00 53.41 H new ATOM 0 HG1 THR B 55 14.406 16.055 5.629 1.00 50.54 H new ATOM 0 HG21 THR B 55 16.238 14.433 6.507 1.00 63.21 H new ATOM 0 HG22 THR B 55 15.293 13.017 7.026 1.00 63.21 H new ATOM 0 HG23 THR B 55 14.912 13.826 5.487 1.00 63.21 H new ATOM 2400 N PRO B 56 12.170 14.343 9.596 1.00 31.25 N ATOM 2401 CA PRO B 56 11.465 14.842 10.781 1.00 41.22 C ATOM 2402 C PRO B 56 12.017 16.180 11.262 1.00 3.50 C ATOM 2403 O PRO B 56 11.333 16.927 11.962 1.00 61.54 O ATOM 2404 CB PRO B 56 11.714 13.754 11.828 1.00 43.23 C ATOM 2405 CG PRO B 56 12.982 13.100 11.400 1.00 22.11 C ATOM 2406 CD PRO B 56 12.992 13.158 9.898 1.00 60.25 C ATOM 0 HA PRO B 56 10.409 15.025 10.580 1.00 41.22 H new ATOM 0 HB2 PRO B 56 11.806 14.180 12.827 1.00 43.23 H new ATOM 0 HB3 PRO B 56 10.891 13.040 11.860 1.00 43.23 H new ATOM 0 HG2 PRO B 56 13.847 13.616 11.816 1.00 22.11 H new ATOM 0 HG3 PRO B 56 13.027 12.069 11.751 1.00 22.11 H new ATOM 0 HD2 PRO B 56 14.004 13.261 9.507 1.00 60.25 H new ATOM 0 HD3 PRO B 56 12.571 12.254 9.458 1.00 60.25 H new ATOM 2414 N GLN B 57 13.256 16.475 10.883 1.00 42.31 N ATOM 2415 CA GLN B 57 13.898 17.723 11.277 1.00 55.32 C ATOM 2416 C GLN B 57 13.402 18.885 10.421 1.00 1.51 C ATOM 2417 O GLN B 57 13.228 20.001 10.912 1.00 23.51 O ATOM 2418 CB GLN B 57 15.418 17.600 11.158 1.00 61.00 C ATOM 2419 CG GLN B 57 16.150 18.921 11.322 1.00 72.54 C ATOM 2420 CD GLN B 57 15.750 19.658 12.586 1.00 74.05 C ATOM 2421 OE1 GLN B 57 15.304 20.804 12.534 1.00 63.42 O ATOM 2422 NE2 GLN B 57 15.907 19.000 13.728 1.00 41.13 N ATOM 0 H GLN B 57 13.835 15.867 10.304 1.00 42.31 H new ATOM 0 HA GLN B 57 13.637 17.923 12.316 1.00 55.32 H new ATOM 0 HB2 GLN B 57 15.777 16.899 11.911 1.00 61.00 H new ATOM 0 HB3 GLN B 57 15.665 17.176 10.185 1.00 61.00 H new ATOM 0 HG2 GLN B 57 17.224 18.737 11.338 1.00 72.54 H new ATOM 0 HG3 GLN B 57 15.948 19.554 10.458 1.00 72.54 H new ATOM 0 HE21 GLN B 57 16.281 18.051 13.723 1.00 41.13 H new ATOM 0 HE22 GLN B 57 15.654 19.443 14.611 1.00 41.13 H new ATOM 2431 N PHE B 58 13.176 18.615 9.140 1.00 72.25 N ATOM 2432 CA PHE B 58 12.701 19.638 8.216 1.00 73.52 C ATOM 2433 C PHE B 58 11.245 19.389 7.831 1.00 1.21 C ATOM 2434 O PHE B 58 10.823 19.700 6.716 1.00 54.13 O ATOM 2435 CB PHE B 58 13.575 19.667 6.960 1.00 21.34 C ATOM 2436 CG PHE B 58 15.023 19.944 7.245 1.00 1.42 C ATOM 2437 CD1 PHE B 58 15.435 21.205 7.644 1.00 54.32 C ATOM 2438 CD2 PHE B 58 15.972 18.943 7.113 1.00 51.33 C ATOM 2439 CE1 PHE B 58 16.768 21.463 7.905 1.00 23.24 C ATOM 2440 CE2 PHE B 58 17.306 19.195 7.374 1.00 4.43 C ATOM 2441 CZ PHE B 58 17.704 20.456 7.771 1.00 13.33 C ATOM 0 H PHE B 58 13.314 17.697 8.718 1.00 72.25 H new ATOM 0 HA PHE B 58 12.766 20.604 8.717 1.00 73.52 H new ATOM 0 HB2 PHE B 58 13.491 18.710 6.446 1.00 21.34 H new ATOM 0 HB3 PHE B 58 13.194 20.429 6.280 1.00 21.34 H new ATOM 0 HD1 PHE B 58 14.707 21.995 7.752 1.00 54.32 H new ATOM 0 HD2 PHE B 58 15.666 17.955 6.803 1.00 51.33 H new ATOM 0 HE1 PHE B 58 17.077 22.451 8.213 1.00 23.24 H new ATOM 0 HE2 PHE B 58 18.036 18.406 7.267 1.00 4.43 H new ATOM 0 HZ PHE B 58 18.745 20.655 7.976 1.00 13.33 H new ATOM 2451 N THR B 59 10.481 18.825 8.761 1.00 3.42 N ATOM 2452 CA THR B 59 9.074 18.532 8.519 1.00 32.14 C ATOM 2453 C THR B 59 8.234 19.804 8.547 1.00 21.44 C ATOM 2454 O THR B 59 7.200 19.892 7.886 1.00 24.22 O ATOM 2455 CB THR B 59 8.519 17.541 9.561 1.00 53.35 C ATOM 2456 OG1 THR B 59 9.029 16.228 9.307 1.00 50.44 O ATOM 2457 CG2 THR B 59 6.999 17.516 9.528 1.00 63.52 C ATOM 0 H THR B 59 10.813 18.562 9.689 1.00 3.42 H new ATOM 0 HA THR B 59 9.011 18.080 7.529 1.00 32.14 H new ATOM 0 HB THR B 59 8.839 17.870 10.550 1.00 53.35 H new ATOM 0 HG1 THR B 59 9.684 16.267 8.579 1.00 50.44 H new ATOM 0 HG21 THR B 59 6.630 16.810 10.272 1.00 63.52 H new ATOM 0 HG22 THR B 59 6.614 18.511 9.750 1.00 63.52 H new ATOM 0 HG23 THR B 59 6.662 17.209 8.538 1.00 63.52 H new ATOM 2465 N LYS B 60 8.687 20.788 9.316 1.00 13.34 N ATOM 2466 CA LYS B 60 7.979 22.058 9.430 1.00 2.41 C ATOM 2467 C LYS B 60 8.238 22.936 8.210 1.00 33.42 C ATOM 2468 O LYS B 60 7.488 23.873 7.937 1.00 21.23 O ATOM 2469 CB LYS B 60 8.409 22.794 10.702 1.00 14.22 C ATOM 2470 CG LYS B 60 9.904 23.052 10.779 1.00 61.42 C ATOM 2471 CD LYS B 60 10.291 23.693 12.101 1.00 54.34 C ATOM 2472 CE LYS B 60 11.449 22.958 12.758 1.00 31.41 C ATOM 2473 NZ LYS B 60 11.884 23.623 14.018 1.00 31.11 N ATOM 0 H LYS B 60 9.542 20.731 9.870 1.00 13.34 H new ATOM 0 HA LYS B 60 6.911 21.846 9.484 1.00 2.41 H new ATOM 0 HB2 LYS B 60 7.881 23.746 10.757 1.00 14.22 H new ATOM 0 HB3 LYS B 60 8.104 22.210 11.570 1.00 14.22 H new ATOM 0 HG2 LYS B 60 10.443 22.113 10.657 1.00 61.42 H new ATOM 0 HG3 LYS B 60 10.205 23.701 9.957 1.00 61.42 H new ATOM 0 HD2 LYS B 60 10.567 24.734 11.935 1.00 54.34 H new ATOM 0 HD3 LYS B 60 9.432 23.694 12.772 1.00 54.34 H new ATOM 0 HE2 LYS B 60 11.153 21.931 12.973 1.00 31.41 H new ATOM 0 HE3 LYS B 60 12.289 22.909 12.065 1.00 31.41 H new ATOM 0 HZ1 LYS B 60 12.675 23.092 14.436 1.00 31.11 H new ATOM 0 HZ2 LYS B 60 12.191 24.595 13.810 1.00 31.11 H new ATOM 0 HZ3 LYS B 60 11.090 23.647 14.690 1.00 31.11 H new ATOM 2487 N TYR B 61 9.304 22.627 7.479 1.00 63.31 N ATOM 2488 CA TYR B 61 9.661 23.388 6.289 1.00 12.35 C ATOM 2489 C TYR B 61 9.362 22.593 5.022 1.00 43.03 C ATOM 2490 O TYR B 61 10.257 22.316 4.221 1.00 15.42 O ATOM 2491 CB TYR B 61 11.143 23.768 6.328 1.00 51.41 C ATOM 2492 CG TYR B 61 11.625 24.187 7.698 1.00 52.31 C ATOM 2493 CD1 TYR B 61 11.237 25.402 8.251 1.00 24.22 C ATOM 2494 CD2 TYR B 61 12.468 23.370 8.439 1.00 43.25 C ATOM 2495 CE1 TYR B 61 11.676 25.789 9.503 1.00 72.43 C ATOM 2496 CE2 TYR B 61 12.910 23.748 9.692 1.00 20.34 C ATOM 2497 CZ TYR B 61 12.511 24.958 10.220 1.00 62.03 C ATOM 2498 OH TYR B 61 12.950 25.340 11.467 1.00 73.32 O ATOM 0 H TYR B 61 9.935 21.854 7.691 1.00 63.31 H new ATOM 0 HA TYR B 61 9.059 24.296 6.276 1.00 12.35 H new ATOM 0 HB2 TYR B 61 11.736 22.919 5.987 1.00 51.41 H new ATOM 0 HB3 TYR B 61 11.319 24.582 5.625 1.00 51.41 H new ATOM 0 HD1 TYR B 61 10.582 26.054 7.693 1.00 24.22 H new ATOM 0 HD2 TYR B 61 12.784 22.422 8.029 1.00 43.25 H new ATOM 0 HE1 TYR B 61 11.367 26.737 9.918 1.00 72.43 H new ATOM 0 HE2 TYR B 61 13.565 23.099 10.255 1.00 20.34 H new ATOM 0 HH TYR B 61 12.405 26.088 11.791 1.00 73.32 H new ATOM 2508 N THR B 62 8.097 22.227 4.847 1.00 34.42 N ATOM 2509 CA THR B 62 7.677 21.461 3.679 1.00 72.42 C ATOM 2510 C THR B 62 7.131 22.378 2.589 1.00 31.24 C ATOM 2511 O THR B 62 7.754 22.555 1.542 1.00 31.52 O ATOM 2512 CB THR B 62 6.602 20.421 4.045 1.00 33.53 C ATOM 2513 OG1 THR B 62 6.313 20.487 5.446 1.00 23.01 O ATOM 2514 CG2 THR B 62 7.063 19.016 3.684 1.00 4.41 C ATOM 0 H THR B 62 7.344 22.448 5.499 1.00 34.42 H new ATOM 0 HA THR B 62 8.560 20.942 3.306 1.00 72.42 H new ATOM 0 HB THR B 62 5.700 20.648 3.477 1.00 33.53 H new ATOM 0 HG1 THR B 62 7.048 20.081 5.951 1.00 23.01 H new ATOM 0 HG21 THR B 62 6.287 18.299 3.952 1.00 4.41 H new ATOM 0 HG22 THR B 62 7.255 18.960 2.612 1.00 4.41 H new ATOM 0 HG23 THR B 62 7.977 18.782 4.229 1.00 4.41 H new ATOM 2522 N LEU B 63 5.963 22.958 2.842 1.00 12.13 N ATOM 2523 CA LEU B 63 5.332 23.857 1.882 1.00 1.11 C ATOM 2524 C LEU B 63 5.486 25.312 2.315 1.00 22.24 C ATOM 2525 O LEU B 63 5.019 26.225 1.636 1.00 42.13 O ATOM 2526 CB LEU B 63 3.850 23.513 1.729 1.00 73.21 C ATOM 2527 CG LEU B 63 2.891 24.243 2.669 1.00 75.31 C ATOM 2528 CD1 LEU B 63 2.256 25.434 1.967 1.00 21.21 C ATOM 2529 CD2 LEU B 63 1.819 23.292 3.182 1.00 54.43 C ATOM 0 H LEU B 63 5.434 22.822 3.703 1.00 12.13 H new ATOM 0 HA LEU B 63 5.830 23.729 0.921 1.00 1.11 H new ATOM 0 HB2 LEU B 63 3.552 23.726 0.702 1.00 73.21 H new ATOM 0 HB3 LEU B 63 3.729 22.440 1.880 1.00 73.21 H new ATOM 0 HG LEU B 63 3.461 24.612 3.522 1.00 75.31 H new ATOM 0 HD11 LEU B 63 1.577 25.941 2.653 1.00 21.21 H new ATOM 0 HD12 LEU B 63 3.035 26.127 1.650 1.00 21.21 H new ATOM 0 HD13 LEU B 63 1.701 25.089 1.095 1.00 21.21 H new ATOM 0 HD21 LEU B 63 1.145 23.829 3.850 1.00 54.43 H new ATOM 0 HD22 LEU B 63 1.253 22.893 2.340 1.00 54.43 H new ATOM 0 HD23 LEU B 63 2.289 22.472 3.724 1.00 54.43 H new ATOM 2541 N TRP B 64 6.145 25.519 3.451 1.00 1.21 N ATOM 2542 CA TRP B 64 6.363 26.862 3.974 1.00 43.23 C ATOM 2543 C TRP B 64 6.954 27.774 2.904 1.00 72.02 C ATOM 2544 O TRP B 64 6.772 28.991 2.942 1.00 64.33 O ATOM 2545 CB TRP B 64 7.289 26.815 5.190 1.00 62.22 C ATOM 2546 CG TRP B 64 8.710 27.163 4.868 1.00 4.30 C ATOM 2547 CD1 TRP B 64 9.391 28.279 5.266 1.00 74.40 C ATOM 2548 CD2 TRP B 64 9.624 26.393 4.080 1.00 4.15 C ATOM 2549 NE1 TRP B 64 10.673 28.247 4.772 1.00 54.00 N ATOM 2550 CE2 TRP B 64 10.842 27.101 4.042 1.00 33.35 C ATOM 2551 CE3 TRP B 64 9.534 25.173 3.404 1.00 30.31 C ATOM 2552 CZ2 TRP B 64 11.956 26.628 3.355 1.00 50.25 C ATOM 2553 CZ3 TRP B 64 10.641 24.706 2.722 1.00 42.23 C ATOM 2554 CH2 TRP B 64 11.839 25.432 2.701 1.00 30.42 C ATOM 0 H TRP B 64 6.537 24.774 4.026 1.00 1.21 H new ATOM 0 HA TRP B 64 5.398 27.267 4.277 1.00 43.23 H new ATOM 0 HB2 TRP B 64 6.917 27.504 5.948 1.00 62.22 H new ATOM 0 HB3 TRP B 64 7.257 25.816 5.624 1.00 62.22 H new ATOM 0 HD1 TRP B 64 8.982 29.069 5.878 1.00 74.40 H new ATOM 0 HE1 TRP B 64 11.384 28.962 4.925 1.00 54.00 H new ATOM 0 HE3 TRP B 64 8.615 24.605 3.415 1.00 30.31 H new ATOM 0 HZ2 TRP B 64 12.881 27.186 3.339 1.00 50.25 H new ATOM 0 HZ3 TRP B 64 10.582 23.765 2.196 1.00 42.23 H new ATOM 0 HH2 TRP B 64 12.686 25.040 2.158 1.00 30.42 H new ATOM 2565 N PHE B 65 7.663 27.177 1.950 1.00 3.22 N ATOM 2566 CA PHE B 65 8.281 27.937 0.870 1.00 51.24 C ATOM 2567 C PHE B 65 7.793 27.446 -0.490 1.00 44.13 C ATOM 2568 O PHE B 65 7.713 28.215 -1.447 1.00 61.53 O ATOM 2569 CB PHE B 65 9.805 27.826 0.948 1.00 33.14 C ATOM 2570 CG PHE B 65 10.475 29.085 1.421 1.00 11.11 C ATOM 2571 CD1 PHE B 65 9.890 29.871 2.401 1.00 22.30 C ATOM 2572 CD2 PHE B 65 11.690 29.482 0.886 1.00 2.15 C ATOM 2573 CE1 PHE B 65 10.503 31.029 2.837 1.00 2.32 C ATOM 2574 CE2 PHE B 65 12.308 30.639 1.320 1.00 4.54 C ATOM 2575 CZ PHE B 65 11.714 31.415 2.296 1.00 1.24 C ATOM 0 H PHE B 65 7.823 26.171 1.904 1.00 3.22 H new ATOM 0 HA PHE B 65 7.993 28.982 0.984 1.00 51.24 H new ATOM 0 HB2 PHE B 65 10.068 27.009 1.621 1.00 33.14 H new ATOM 0 HB3 PHE B 65 10.193 27.565 -0.037 1.00 33.14 H new ATOM 0 HD1 PHE B 65 8.944 29.574 2.829 1.00 22.30 H new ATOM 0 HD2 PHE B 65 12.159 28.880 0.121 1.00 2.15 H new ATOM 0 HE1 PHE B 65 10.036 31.633 3.601 1.00 2.32 H new ATOM 0 HE2 PHE B 65 13.256 30.937 0.896 1.00 4.54 H new ATOM 0 HZ PHE B 65 12.195 32.321 2.635 1.00 1.24 H new ATOM 2585 N MET B 66 7.469 26.159 -0.565 1.00 55.55 N ATOM 2586 CA MET B 66 6.988 25.565 -1.807 1.00 63.34 C ATOM 2587 C MET B 66 5.851 26.389 -2.400 1.00 2.10 C ATOM 2588 O MET B 66 5.737 26.523 -3.619 1.00 23.20 O ATOM 2589 CB MET B 66 6.518 24.129 -1.562 1.00 52.14 C ATOM 2590 CG MET B 66 6.836 23.182 -2.707 1.00 45.22 C ATOM 2591 SD MET B 66 5.401 22.228 -3.238 1.00 33.32 S ATOM 2592 CE MET B 66 4.428 23.500 -4.042 1.00 54.53 C ATOM 0 H MET B 66 7.531 25.509 0.218 1.00 55.55 H new ATOM 0 HA MET B 66 7.814 25.554 -2.518 1.00 63.34 H new ATOM 0 HB2 MET B 66 6.984 23.753 -0.651 1.00 52.14 H new ATOM 0 HB3 MET B 66 5.441 24.132 -1.392 1.00 52.14 H new ATOM 0 HG2 MET B 66 7.219 23.755 -3.551 1.00 45.22 H new ATOM 0 HG3 MET B 66 7.628 22.499 -2.399 1.00 45.22 H new ATOM 0 HE1 MET B 66 3.553 23.728 -3.434 1.00 54.53 H new ATOM 0 HE2 MET B 66 5.032 24.400 -4.160 1.00 54.53 H new ATOM 0 HE3 MET B 66 4.107 23.147 -5.022 1.00 54.53 H new ATOM 2602 N THR B 67 5.011 26.943 -1.531 1.00 4.01 N ATOM 2603 CA THR B 67 3.882 27.754 -1.969 1.00 64.01 C ATOM 2604 C THR B 67 3.833 29.080 -1.218 1.00 4.11 C ATOM 2605 O THR B 67 2.839 29.802 -1.278 1.00 25.32 O ATOM 2606 CB THR B 67 2.546 27.014 -1.768 1.00 50.32 C ATOM 2607 OG1 THR B 67 2.693 25.635 -2.125 1.00 43.04 O ATOM 2608 CG2 THR B 67 1.446 27.645 -2.605 1.00 73.01 C ATOM 0 H THR B 67 5.092 26.845 -0.519 1.00 4.01 H new ATOM 0 HA THR B 67 4.026 27.946 -3.032 1.00 64.01 H new ATOM 0 HB THR B 67 2.268 27.090 -0.717 1.00 50.32 H new ATOM 0 HG1 THR B 67 1.840 25.170 -1.993 1.00 43.04 H new ATOM 0 HG21 THR B 67 0.513 27.105 -2.446 1.00 73.01 H new ATOM 0 HG22 THR B 67 1.317 28.687 -2.311 1.00 73.01 H new ATOM 0 HG23 THR B 67 1.718 27.597 -3.659 1.00 73.01 H new ATOM 2616 N ASN B 68 4.914 29.394 -0.512 1.00 11.41 N ATOM 2617 CA ASN B 68 4.994 30.635 0.252 1.00 74.22 C ATOM 2618 C ASN B 68 3.830 30.746 1.232 1.00 14.40 C ATOM 2619 O ASN B 68 3.176 31.784 1.319 1.00 0.14 O ATOM 2620 CB ASN B 68 4.996 31.839 -0.692 1.00 72.14 C ATOM 2621 CG ASN B 68 5.763 31.568 -1.972 1.00 24.42 C ATOM 2622 OD1 ASN B 68 6.983 31.406 -1.956 1.00 31.00 O ATOM 2623 ND2 ASN B 68 5.048 31.517 -3.090 1.00 25.24 N ATOM 0 H ASN B 68 5.746 28.807 -0.453 1.00 11.41 H new ATOM 0 HA ASN B 68 5.924 30.624 0.820 1.00 74.22 H new ATOM 0 HB2 ASN B 68 3.968 32.107 -0.937 1.00 72.14 H new ATOM 0 HB3 ASN B 68 5.436 32.696 -0.182 1.00 72.14 H new ATOM 0 HD21 ASN B 68 5.509 31.338 -3.982 1.00 25.24 H new ATOM 0 HD22 ASN B 68 4.038 31.657 -3.056 1.00 25.24 H new ATOM 2630 N GLN B 69 3.579 29.668 1.968 1.00 42.21 N ATOM 2631 CA GLN B 69 2.494 29.645 2.943 1.00 70.13 C ATOM 2632 C GLN B 69 2.882 28.828 4.171 1.00 10.34 C ATOM 2633 O GLN B 69 3.074 27.614 4.085 1.00 41.40 O ATOM 2634 CB GLN B 69 1.225 29.068 2.312 1.00 35.41 C ATOM 2635 CG GLN B 69 -0.050 29.463 3.038 1.00 60.42 C ATOM 2636 CD GLN B 69 -0.595 30.800 2.576 1.00 22.34 C ATOM 2637 OE1 GLN B 69 -1.079 30.932 1.451 1.00 42.13 O ATOM 2638 NE2 GLN B 69 -0.518 31.803 3.444 1.00 14.11 N ATOM 0 H GLN B 69 4.111 28.800 1.908 1.00 42.21 H new ATOM 0 HA GLN B 69 2.301 30.671 3.258 1.00 70.13 H new ATOM 0 HB2 GLN B 69 1.161 29.401 1.276 1.00 35.41 H new ATOM 0 HB3 GLN B 69 1.301 27.981 2.294 1.00 35.41 H new ATOM 0 HG2 GLN B 69 -0.806 28.693 2.882 1.00 60.42 H new ATOM 0 HG3 GLN B 69 0.145 29.505 4.110 1.00 60.42 H new ATOM 0 HE21 GLN B 69 -0.109 31.649 4.366 1.00 14.11 H new ATOM 0 HE22 GLN B 69 -0.868 32.727 3.189 1.00 14.11 H new ATOM 2647 N ILE B 70 2.996 29.500 5.310 1.00 24.34 N ATOM 2648 CA ILE B 70 3.362 28.837 6.556 1.00 24.43 C ATOM 2649 C ILE B 70 2.143 28.203 7.218 1.00 41.10 C ATOM 2650 O ILE B 70 1.123 28.861 7.422 1.00 43.13 O ATOM 2651 CB ILE B 70 4.019 29.816 7.545 1.00 12.12 C ATOM 2652 CG1 ILE B 70 3.115 31.030 7.771 1.00 1.24 C ATOM 2653 CG2 ILE B 70 5.383 30.253 7.031 1.00 40.03 C ATOM 2654 CD1 ILE B 70 2.600 31.144 9.189 1.00 23.21 C ATOM 0 H ILE B 70 2.840 30.504 5.397 1.00 24.34 H new ATOM 0 HA ILE B 70 4.081 28.059 6.300 1.00 24.43 H new ATOM 0 HB ILE B 70 4.158 29.307 8.499 1.00 12.12 H new ATOM 0 HG12 ILE B 70 3.667 31.936 7.520 1.00 1.24 H new ATOM 0 HG13 ILE B 70 2.267 30.974 7.088 1.00 1.24 H new ATOM 0 HG21 ILE B 70 5.835 30.945 7.741 1.00 40.03 H new ATOM 0 HG22 ILE B 70 6.025 29.380 6.916 1.00 40.03 H new ATOM 0 HG23 ILE B 70 5.267 30.747 6.066 1.00 40.03 H new ATOM 0 HD11 ILE B 70 1.966 32.027 9.276 1.00 23.21 H new ATOM 0 HD12 ILE B 70 2.020 30.255 9.438 1.00 23.21 H new ATOM 0 HD13 ILE B 70 3.442 31.232 9.876 1.00 23.21 H new ATOM 2666 N ALA B 71 2.258 26.923 7.555 1.00 31.41 N ATOM 2667 CA ALA B 71 1.166 26.202 8.199 1.00 42.14 C ATOM 2668 C ALA B 71 1.533 25.813 9.628 1.00 13.21 C ATOM 2669 O ALA B 71 1.794 24.649 9.933 1.00 44.11 O ATOM 2670 CB ALA B 71 0.802 24.965 7.391 1.00 21.42 C ATOM 0 H ALA B 71 3.096 26.364 7.393 1.00 31.41 H new ATOM 0 HA ALA B 71 0.301 26.864 8.241 1.00 42.14 H new ATOM 0 HB1 ALA B 71 -0.014 24.436 7.883 1.00 21.42 H new ATOM 0 HB2 ALA B 71 0.490 25.263 6.390 1.00 21.42 H new ATOM 0 HB3 ALA B 71 1.669 24.308 7.320 1.00 21.42 H new ATOM 2676 N PRO B 72 1.554 26.809 10.526 1.00 64.10 N ATOM 2677 CA PRO B 72 1.887 26.595 11.937 1.00 11.04 C ATOM 2678 C PRO B 72 0.804 25.819 12.678 1.00 33.42 C ATOM 2679 O PRO B 72 1.067 25.198 13.707 1.00 25.43 O ATOM 2680 CB PRO B 72 2.001 28.017 12.494 1.00 2.43 C ATOM 2681 CG PRO B 72 1.147 28.845 11.597 1.00 51.11 C ATOM 2682 CD PRO B 72 1.253 28.221 10.233 1.00 31.23 C ATOM 0 HA PRO B 72 2.793 26.001 12.056 1.00 11.04 H new ATOM 0 HB2 PRO B 72 1.655 28.067 13.526 1.00 2.43 H new ATOM 0 HB3 PRO B 72 3.035 28.363 12.487 1.00 2.43 H new ATOM 0 HG2 PRO B 72 0.113 28.855 11.942 1.00 51.11 H new ATOM 0 HG3 PRO B 72 1.488 29.880 11.580 1.00 51.11 H new ATOM 0 HD2 PRO B 72 0.325 28.326 9.670 1.00 31.23 H new ATOM 0 HD3 PRO B 72 2.040 28.685 9.639 1.00 31.23 H new ATOM 2690 N GLU B 73 -0.414 25.859 12.147 1.00 4.23 N ATOM 2691 CA GLU B 73 -1.538 25.158 12.760 1.00 61.34 C ATOM 2692 C GLU B 73 -1.261 23.661 12.848 1.00 54.44 C ATOM 2693 O GLU B 73 -1.866 22.953 13.654 1.00 31.22 O ATOM 2694 CB GLU B 73 -2.819 25.406 11.960 1.00 60.13 C ATOM 2695 CG GLU B 73 -3.251 26.862 11.938 1.00 64.33 C ATOM 2696 CD GLU B 73 -3.350 27.462 13.328 1.00 11.13 C ATOM 2697 OE1 GLU B 73 -3.897 26.790 14.227 1.00 33.02 O ATOM 2698 OE2 GLU B 73 -2.881 28.604 13.515 1.00 41.10 O ATOM 0 H GLU B 73 -0.648 26.368 11.295 1.00 4.23 H new ATOM 0 HA GLU B 73 -1.669 25.545 13.770 1.00 61.34 H new ATOM 0 HB2 GLU B 73 -2.669 25.065 10.936 1.00 60.13 H new ATOM 0 HB3 GLU B 73 -3.623 24.804 12.382 1.00 60.13 H new ATOM 0 HG2 GLU B 73 -2.540 27.439 11.347 1.00 64.33 H new ATOM 0 HG3 GLU B 73 -4.218 26.943 11.442 1.00 64.33 H new ATOM 2705 N SER B 74 -0.343 23.184 12.012 1.00 3.13 N ATOM 2706 CA SER B 74 0.010 21.769 11.992 1.00 54.43 C ATOM 2707 C SER B 74 1.451 21.563 12.450 1.00 41.34 C ATOM 2708 O SER B 74 1.806 20.501 12.961 1.00 62.25 O ATOM 2709 CB SER B 74 -0.177 21.195 10.587 1.00 12.33 C ATOM 2710 OG SER B 74 -1.520 21.330 10.155 1.00 21.43 O ATOM 0 H SER B 74 0.169 23.756 11.341 1.00 3.13 H new ATOM 0 HA SER B 74 -0.651 21.245 12.682 1.00 54.43 H new ATOM 0 HB2 SER B 74 0.486 21.708 9.890 1.00 12.33 H new ATOM 0 HB3 SER B 74 0.106 20.143 10.580 1.00 12.33 H new ATOM 0 HG SER B 74 -1.894 20.444 9.968 1.00 21.43 H new ATOM 2716 N GLY B 75 2.277 22.588 12.262 1.00 32.12 N ATOM 2717 CA GLY B 75 3.670 22.500 12.660 1.00 40.12 C ATOM 2718 C GLY B 75 4.618 22.870 11.538 1.00 61.53 C ATOM 2719 O GLY B 75 5.659 22.237 11.364 1.00 74.03 O ATOM 0 H GLY B 75 2.007 23.477 11.841 1.00 32.12 H new ATOM 0 HA2 GLY B 75 3.844 23.159 13.511 1.00 40.12 H new ATOM 0 HA3 GLY B 75 3.886 21.485 12.994 1.00 40.12 H new ATOM 2723 N GLN B 76 4.259 23.897 10.775 1.00 5.14 N ATOM 2724 CA GLN B 76 5.085 24.347 9.662 1.00 30.43 C ATOM 2725 C GLN B 76 5.275 25.861 9.703 1.00 1.04 C ATOM 2726 O GLN B 76 4.307 26.619 9.638 1.00 20.13 O ATOM 2727 CB GLN B 76 4.454 23.936 8.330 1.00 34.10 C ATOM 2728 CG GLN B 76 4.722 22.489 7.952 1.00 32.22 C ATOM 2729 CD GLN B 76 4.102 21.507 8.926 1.00 51.40 C ATOM 2730 OE1 GLN B 76 3.044 21.767 9.500 1.00 11.02 O ATOM 2731 NE2 GLN B 76 4.758 20.368 9.118 1.00 72.22 N ATOM 0 H GLN B 76 3.401 24.433 10.908 1.00 5.14 H new ATOM 0 HA GLN B 76 6.062 23.873 9.753 1.00 30.43 H new ATOM 0 HB2 GLN B 76 3.377 24.096 8.383 1.00 34.10 H new ATOM 0 HB3 GLN B 76 4.834 24.585 7.541 1.00 34.10 H new ATOM 0 HG2 GLN B 76 4.330 22.300 6.953 1.00 32.22 H new ATOM 0 HG3 GLN B 76 5.798 22.322 7.909 1.00 32.22 H new ATOM 0 HE21 GLN B 76 5.632 20.193 8.622 1.00 72.22 H new ATOM 0 HE22 GLN B 76 4.388 19.669 9.762 1.00 72.22 H new ATOM 2740 N ILE B 77 6.527 26.292 9.810 1.00 41.52 N ATOM 2741 CA ILE B 77 6.842 27.715 9.857 1.00 50.31 C ATOM 2742 C ILE B 77 8.151 28.012 9.134 1.00 5.22 C ATOM 2743 O ILE B 77 8.856 27.100 8.704 1.00 61.33 O ATOM 2744 CB ILE B 77 6.945 28.219 11.309 1.00 44.11 C ATOM 2745 CG1 ILE B 77 8.291 27.823 11.917 1.00 70.24 C ATOM 2746 CG2 ILE B 77 5.798 27.668 12.144 1.00 64.41 C ATOM 2747 CD1 ILE B 77 8.531 26.330 11.931 1.00 2.32 C ATOM 0 H ILE B 77 7.339 25.677 9.866 1.00 41.52 H new ATOM 0 HA ILE B 77 6.027 28.237 9.356 1.00 50.31 H new ATOM 0 HB ILE B 77 6.876 29.307 11.305 1.00 44.11 H new ATOM 0 HG12 ILE B 77 9.091 28.306 11.355 1.00 70.24 H new ATOM 0 HG13 ILE B 77 8.345 28.201 12.938 1.00 70.24 H new ATOM 0 HG21 ILE B 77 5.885 28.033 13.167 1.00 64.41 H new ATOM 0 HG22 ILE B 77 4.849 27.997 11.721 1.00 64.41 H new ATOM 0 HG23 ILE B 77 5.838 26.579 12.143 1.00 64.41 H new ATOM 0 HD11 ILE B 77 9.504 26.122 12.376 1.00 2.32 H new ATOM 0 HD12 ILE B 77 7.752 25.842 12.517 1.00 2.32 H new ATOM 0 HD13 ILE B 77 8.510 25.948 10.910 1.00 2.32 H new ATOM 2759 N ALA B 78 8.472 29.295 9.006 1.00 60.23 N ATOM 2760 CA ALA B 78 9.697 29.713 8.339 1.00 30.33 C ATOM 2761 C ALA B 78 10.821 29.939 9.345 1.00 42.43 C ATOM 2762 O ALA B 78 10.617 30.496 10.424 1.00 1.45 O ATOM 2763 CB ALA B 78 9.452 30.977 7.527 1.00 22.31 C ATOM 0 H ALA B 78 7.899 30.063 9.356 1.00 60.23 H new ATOM 0 HA ALA B 78 10.004 28.914 7.664 1.00 30.33 H new ATOM 0 HB1 ALA B 78 10.376 31.278 7.034 1.00 22.31 H new ATOM 0 HB2 ALA B 78 8.686 30.784 6.776 1.00 22.31 H new ATOM 0 HB3 ALA B 78 9.118 31.776 8.189 1.00 22.31 H new ATOM 2769 N PRO B 79 12.035 29.497 8.987 1.00 54.52 N ATOM 2770 CA PRO B 79 13.215 29.640 9.845 1.00 53.33 C ATOM 2771 C PRO B 79 13.671 31.090 9.967 1.00 52.42 C ATOM 2772 O PRO B 79 12.971 32.008 9.545 1.00 11.10 O ATOM 2773 CB PRO B 79 14.279 28.802 9.130 1.00 0.21 C ATOM 2774 CG PRO B 79 13.854 28.793 7.702 1.00 1.12 C ATOM 2775 CD PRO B 79 12.351 28.824 7.715 1.00 63.55 C ATOM 0 HA PRO B 79 13.016 29.318 10.867 1.00 53.33 H new ATOM 0 HB2 PRO B 79 15.271 29.239 9.246 1.00 0.21 H new ATOM 0 HB3 PRO B 79 14.326 27.791 9.536 1.00 0.21 H new ATOM 0 HG2 PRO B 79 14.257 29.655 7.170 1.00 1.12 H new ATOM 0 HG3 PRO B 79 14.221 27.903 7.192 1.00 1.12 H new ATOM 0 HD2 PRO B 79 11.953 29.372 6.861 1.00 63.55 H new ATOM 0 HD3 PRO B 79 11.928 27.820 7.675 1.00 63.55 H new ATOM 2783 N ALA B 80 14.851 31.288 10.548 1.00 25.42 N ATOM 2784 CA ALA B 80 15.401 32.625 10.723 1.00 0.54 C ATOM 2785 C ALA B 80 15.919 33.183 9.401 1.00 35.22 C ATOM 2786 O ALA B 80 15.440 34.211 8.919 1.00 62.14 O ATOM 2787 CB ALA B 80 16.513 32.607 11.761 1.00 73.13 C ATOM 0 H ALA B 80 15.443 30.538 10.905 1.00 25.42 H new ATOM 0 HA ALA B 80 14.601 33.276 11.075 1.00 0.54 H new ATOM 0 HB1 ALA B 80 16.915 33.613 11.881 1.00 73.13 H new ATOM 0 HB2 ALA B 80 16.115 32.259 12.714 1.00 73.13 H new ATOM 0 HB3 ALA B 80 17.307 31.936 11.432 1.00 73.13 H new ATOM 2793 N LEU B 81 16.899 32.501 8.819 1.00 30.02 N ATOM 2794 CA LEU B 81 17.482 32.930 7.553 1.00 34.04 C ATOM 2795 C LEU B 81 16.401 33.124 6.494 1.00 42.43 C ATOM 2796 O LEU B 81 16.561 33.920 5.569 1.00 23.42 O ATOM 2797 CB LEU B 81 18.508 31.904 7.068 1.00 64.45 C ATOM 2798 CG LEU B 81 19.595 31.517 8.071 1.00 64.45 C ATOM 2799 CD1 LEU B 81 20.223 30.185 7.692 1.00 35.40 C ATOM 2800 CD2 LEU B 81 20.657 32.605 8.154 1.00 62.22 C ATOM 0 H LEU B 81 17.307 31.649 9.204 1.00 30.02 H new ATOM 0 HA LEU B 81 17.981 33.885 7.716 1.00 34.04 H new ATOM 0 HB2 LEU B 81 17.976 31.000 6.772 1.00 64.45 H new ATOM 0 HB3 LEU B 81 18.991 32.297 6.173 1.00 64.45 H new ATOM 0 HG LEU B 81 19.134 31.411 9.053 1.00 64.45 H new ATOM 0 HD11 LEU B 81 20.994 29.927 8.418 1.00 35.40 H new ATOM 0 HD12 LEU B 81 19.457 29.410 7.686 1.00 35.40 H new ATOM 0 HD13 LEU B 81 20.669 30.262 6.700 1.00 35.40 H new ATOM 0 HD21 LEU B 81 21.422 32.312 8.873 1.00 62.22 H new ATOM 0 HD22 LEU B 81 21.113 32.743 7.174 1.00 62.22 H new ATOM 0 HD23 LEU B 81 20.196 33.539 8.475 1.00 62.22 H new ATOM 2812 N ALA B 82 15.301 32.392 6.638 1.00 60.51 N ATOM 2813 CA ALA B 82 14.192 32.488 5.696 1.00 44.45 C ATOM 2814 C ALA B 82 13.790 33.940 5.466 1.00 20.32 C ATOM 2815 O ALA B 82 13.763 34.415 4.330 1.00 2.23 O ATOM 2816 CB ALA B 82 13.004 31.682 6.198 1.00 40.20 C ATOM 0 H ALA B 82 15.154 31.727 7.397 1.00 60.51 H new ATOM 0 HA ALA B 82 14.521 32.075 4.742 1.00 44.45 H new ATOM 0 HB1 ALA B 82 12.183 31.762 5.486 1.00 40.20 H new ATOM 0 HB2 ALA B 82 13.292 30.636 6.303 1.00 40.20 H new ATOM 0 HB3 ALA B 82 12.684 32.069 7.165 1.00 40.20 H new