USER MOD reduce.3.24.130724 H: found=0, std=0, add=813, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 816 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 1.2: A 71 TYR OH : rot 180:sc= -0.149 USER MOD Set 2.1: A 64 TYR OH : rot 180:sc= -0.374 USER MOD Set 2.2: A 68 ASN : amide:sc= -0.215 K(o=-0.59,f=-3.4!) USER MOD Set 3.1: A 39 MET CE :methyl -171:sc= 0 (180deg=0) USER MOD Set 3.2: A 44 GLN : amide:sc= -2.01 K(o=-2,f=-3.9!) USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 46 LYS NZ :NH3+ -169:sc= -0.0135 (180deg=-0.211) USER MOD Single : A 48 THR OG1 : rot 110:sc= 1.32 USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 73 SER OG : rot 170:sc= -0.438 USER MOD Single : A 74 THR OG1 : rot -41:sc= 0.0116 USER MOD Single : A 75 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 76 GLN : amide:sc= -0.0107 K(o=-0.011,f=-1.1) USER MOD Single : A 83 LYS NZ :NH3+ -149:sc= -0.476 (180deg=-2.08!) USER MOD Single : A 84 LYS NZ :NH3+ -132:sc= -0.331 (180deg=-1.88!) USER MOD Single : A 86 THR OG1 : rot 180:sc= 0.0022 USER MOD Single : A 88 ASN : amide:sc= -0.0233 X(o=-0.023,f=-0.023) USER MOD Single : A 90 GLN : amide:sc= -0.614 X(o=-0.61,f=-0.72) USER MOD Single : A 92 LYS NZ :NH3+ -171:sc=-0.000927 (180deg=-0.0664) USER MOD Single : A 93 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 95 ASN : amide:sc= 0.707 K(o=0.71,f=-5.9!) USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 TYR OH : rot 31:sc= -2.8! USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 ASN :FLIP amide:sc= -1.75 F(o=-3.8!,f=-1.7) USER MOD Single : A 112 TYR OH : rot 180:sc= 0 USER MOD Single : A 113 GLN : amide:sc= -1.62! C(o=-1.6!,f=-7.8!) USER MOD Single : A 114 TYR OH : rot 180:sc= 0 USER MOD Single : A 119 THR OG1 : rot 180:sc= 0 USER MOD Single : A 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 TYR OH : rot 180:sc= 0 USER MOD Single : A 127 SER OG : rot -120:sc= 0.325 USER MOD Single : A 133 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 137 SER OG : rot 7:sc= 1.16 USER MOD Single : A 139 ASN :FLIP amide:sc=-0.00282 F(o=-0.5,f=-0.0028) USER MOD Single : A 145 ASN : amide:sc= -0.403! K(o=-0.4!,f=-2) USER MOD Single : A 148 ASN : amide:sc= 0.00525 K(o=0.0052,f=-0.53) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 39 2.933 6.131 -0.294 1.00 4.14 N ATOM 2 CA MET A 39 4.368 5.815 -0.402 1.00 51.33 C ATOM 3 C MET A 39 4.473 4.389 -0.934 1.00 55.10 C ATOM 4 O MET A 39 4.268 3.441 -0.188 1.00 30.34 O ATOM 5 CB MET A 39 5.044 5.908 0.992 1.00 52.23 C ATOM 6 CG MET A 39 6.538 6.133 0.961 1.00 54.42 C ATOM 7 SD MET A 39 6.963 7.724 0.241 1.00 0.21 S ATOM 8 CE MET A 39 8.733 7.749 0.497 1.00 65.22 C ATOM 0 HA MET A 39 4.869 6.519 -1.066 1.00 51.33 H new ATOM 0 HB2 MET A 39 4.580 6.721 1.551 1.00 52.23 H new ATOM 0 HB3 MET A 39 4.841 4.988 1.540 1.00 52.23 H new ATOM 0 HG2 MET A 39 6.935 6.076 1.975 1.00 54.42 H new ATOM 0 HG3 MET A 39 7.013 5.337 0.388 1.00 54.42 H new ATOM 0 HE1 MET A 39 9.122 8.737 0.250 1.00 65.22 H new ATOM 0 HE2 MET A 39 8.953 7.523 1.540 1.00 65.22 H new ATOM 0 HE3 MET A 39 9.204 7.003 -0.143 1.00 65.22 H new ATOM 20 N SER A 40 4.753 4.228 -2.205 1.00 73.32 N ATOM 21 CA SER A 40 4.737 2.912 -2.793 1.00 34.02 C ATOM 22 C SER A 40 6.101 2.493 -3.347 1.00 23.30 C ATOM 23 O SER A 40 6.513 2.913 -4.443 1.00 23.52 O ATOM 24 CB SER A 40 3.642 2.813 -3.868 1.00 54.11 C ATOM 25 OG SER A 40 3.532 1.498 -4.392 1.00 50.14 O ATOM 0 H SER A 40 4.992 4.984 -2.846 1.00 73.32 H new ATOM 0 HA SER A 40 4.504 2.208 -1.994 1.00 34.02 H new ATOM 0 HB2 SER A 40 2.686 3.115 -3.441 1.00 54.11 H new ATOM 0 HB3 SER A 40 3.864 3.509 -4.677 1.00 54.11 H new ATOM 0 HG SER A 40 2.825 1.474 -5.071 1.00 50.14 H new ATOM 31 N ARG A 41 6.798 1.720 -2.537 1.00 61.11 N ATOM 32 CA ARG A 41 8.051 1.044 -2.851 1.00 63.22 C ATOM 33 C ARG A 41 8.107 -0.137 -1.898 1.00 30.31 C ATOM 34 O ARG A 41 7.309 -0.157 -0.933 1.00 74.32 O ATOM 35 CB ARG A 41 9.295 1.925 -2.604 1.00 1.00 C ATOM 36 CG ARG A 41 9.459 3.132 -3.496 1.00 5.40 C ATOM 37 CD ARG A 41 10.738 3.851 -3.149 1.00 71.23 C ATOM 38 NE ARG A 41 10.818 5.163 -3.754 1.00 71.31 N ATOM 39 CZ ARG A 41 11.485 6.191 -3.239 1.00 74.51 C ATOM 40 NH1 ARG A 41 12.286 6.013 -2.185 1.00 34.54 N ATOM 41 NH2 ARG A 41 11.372 7.386 -3.793 1.00 50.33 N ATOM 0 H ARG A 41 6.489 1.533 -1.583 1.00 61.11 H new ATOM 0 HA ARG A 41 8.069 0.774 -3.907 1.00 63.22 H new ATOM 0 HB2 ARG A 41 9.269 2.267 -1.569 1.00 1.00 H new ATOM 0 HB3 ARG A 41 10.181 1.300 -2.711 1.00 1.00 H new ATOM 0 HG2 ARG A 41 9.476 2.824 -4.541 1.00 5.40 H new ATOM 0 HG3 ARG A 41 8.609 3.803 -3.375 1.00 5.40 H new ATOM 0 HD2 ARG A 41 10.814 3.949 -2.066 1.00 71.23 H new ATOM 0 HD3 ARG A 41 11.588 3.252 -3.475 1.00 71.23 H new ATOM 0 HE ARG A 41 10.329 5.309 -4.637 1.00 71.31 H new ATOM 0 HH11 ARG A 41 12.388 5.086 -1.772 1.00 34.54 H new ATOM 0 HH12 ARG A 41 12.796 6.804 -1.793 1.00 34.54 H new ATOM 0 HH21 ARG A 41 10.776 7.515 -4.611 1.00 50.33 H new ATOM 0 HH22 ARG A 41 11.881 8.179 -3.403 1.00 50.33 H new ATOM 55 N PRO A 42 8.996 -1.136 -2.123 1.00 12.11 N ATOM 56 CA PRO A 42 9.173 -2.265 -1.200 1.00 42.02 C ATOM 57 C PRO A 42 9.358 -1.796 0.250 1.00 2.30 C ATOM 58 O PRO A 42 10.192 -0.916 0.541 1.00 74.31 O ATOM 59 CB PRO A 42 10.441 -2.940 -1.711 1.00 34.34 C ATOM 60 CG PRO A 42 10.440 -2.662 -3.165 1.00 0.43 C ATOM 61 CD PRO A 42 9.860 -1.286 -3.320 1.00 24.01 C ATOM 0 HA PRO A 42 8.305 -2.924 -1.180 1.00 42.02 H new ATOM 0 HB2 PRO A 42 11.330 -2.534 -1.229 1.00 34.34 H new ATOM 0 HB3 PRO A 42 10.430 -4.011 -1.510 1.00 34.34 H new ATOM 0 HG2 PRO A 42 11.450 -2.708 -3.572 1.00 0.43 H new ATOM 0 HG3 PRO A 42 9.845 -3.400 -3.703 1.00 0.43 H new ATOM 0 HD2 PRO A 42 10.638 -0.524 -3.351 1.00 24.01 H new ATOM 0 HD3 PRO A 42 9.287 -1.194 -4.243 1.00 24.01 H new ATOM 69 N ASP A 43 8.497 -2.320 1.112 1.00 35.51 N ATOM 70 CA ASP A 43 8.419 -2.052 2.576 1.00 1.35 C ATOM 71 C ASP A 43 7.803 -0.679 2.871 1.00 41.45 C ATOM 72 O ASP A 43 7.139 -0.483 3.887 1.00 35.21 O ATOM 73 CB ASP A 43 9.754 -2.246 3.312 1.00 30.13 C ATOM 74 CG ASP A 43 9.565 -2.420 4.814 1.00 62.35 C ATOM 75 OD1 ASP A 43 9.559 -1.447 5.544 1.00 20.40 O ATOM 76 OD2 ASP A 43 9.433 -3.580 5.275 1.00 43.22 O ATOM 0 H ASP A 43 7.785 -2.985 0.809 1.00 35.51 H new ATOM 0 HA ASP A 43 7.749 -2.812 2.977 1.00 1.35 H new ATOM 0 HB2 ASP A 43 10.265 -3.120 2.909 1.00 30.13 H new ATOM 0 HB3 ASP A 43 10.397 -1.386 3.126 1.00 30.13 H new ATOM 81 N GLN A 44 7.930 0.256 1.925 1.00 21.52 N ATOM 82 CA GLN A 44 7.306 1.565 2.074 1.00 44.40 C ATOM 83 C GLN A 44 5.807 1.420 1.989 1.00 74.41 C ATOM 84 O GLN A 44 5.055 2.281 2.452 1.00 73.12 O ATOM 85 CB GLN A 44 7.775 2.581 1.049 1.00 10.21 C ATOM 86 CG GLN A 44 9.261 2.858 1.050 1.00 40.23 C ATOM 87 CD GLN A 44 9.588 4.121 0.282 1.00 64.41 C ATOM 88 OE1 GLN A 44 8.872 4.511 -0.637 1.00 2.22 O ATOM 89 NE2 GLN A 44 10.664 4.749 0.629 1.00 21.45 N ATOM 0 H GLN A 44 8.454 0.129 1.059 1.00 21.52 H new ATOM 0 HA GLN A 44 7.606 1.945 3.050 1.00 44.40 H new ATOM 0 HB2 GLN A 44 7.487 2.232 0.057 1.00 10.21 H new ATOM 0 HB3 GLN A 44 7.247 3.519 1.222 1.00 10.21 H new ATOM 0 HG2 GLN A 44 9.614 2.953 2.077 1.00 40.23 H new ATOM 0 HG3 GLN A 44 9.790 2.014 0.608 1.00 40.23 H new ATOM 0 HE21 GLN A 44 11.235 4.397 1.397 1.00 21.45 H new ATOM 0 HE22 GLN A 44 10.942 5.597 0.134 1.00 21.45 H new ATOM 98 N ALA A 45 5.380 0.300 1.420 1.00 62.52 N ATOM 99 CA ALA A 45 3.984 -0.075 1.364 1.00 32.35 C ATOM 100 C ALA A 45 3.431 -0.276 2.785 1.00 75.33 C ATOM 101 O ALA A 45 2.225 -0.198 3.013 1.00 73.31 O ATOM 102 CB ALA A 45 3.821 -1.342 0.548 1.00 50.41 C ATOM 0 H ALA A 45 6.004 -0.377 0.981 1.00 62.52 H new ATOM 0 HA ALA A 45 3.421 0.725 0.884 1.00 32.35 H new ATOM 0 HB1 ALA A 45 2.767 -1.618 0.511 1.00 50.41 H new ATOM 0 HB2 ALA A 45 4.188 -1.173 -0.464 1.00 50.41 H new ATOM 0 HB3 ALA A 45 4.391 -2.148 1.010 1.00 50.41 H new ATOM 108 N LYS A 46 4.325 -0.515 3.740 1.00 34.35 N ATOM 109 CA LYS A 46 3.931 -0.651 5.121 1.00 41.44 C ATOM 110 C LYS A 46 3.980 0.726 5.793 1.00 30.13 C ATOM 111 O LYS A 46 3.205 1.027 6.693 1.00 71.13 O ATOM 112 CB LYS A 46 4.902 -1.578 5.848 1.00 51.02 C ATOM 113 CG LYS A 46 5.034 -2.977 5.278 1.00 53.34 C ATOM 114 CD LYS A 46 5.933 -3.813 6.177 1.00 41.31 C ATOM 115 CE LYS A 46 6.085 -5.238 5.696 1.00 5.00 C ATOM 116 NZ LYS A 46 4.788 -5.923 5.542 1.00 22.23 N ATOM 0 H LYS A 46 5.326 -0.617 3.573 1.00 34.35 H new ATOM 0 HA LYS A 46 2.923 -1.064 5.167 1.00 41.44 H new ATOM 0 HB2 LYS A 46 5.887 -1.112 5.848 1.00 51.02 H new ATOM 0 HB3 LYS A 46 4.587 -1.659 6.888 1.00 51.02 H new ATOM 0 HG2 LYS A 46 4.051 -3.441 5.197 1.00 53.34 H new ATOM 0 HG3 LYS A 46 5.450 -2.933 4.271 1.00 53.34 H new ATOM 0 HD2 LYS A 46 6.917 -3.347 6.233 1.00 41.31 H new ATOM 0 HD3 LYS A 46 5.525 -3.818 7.188 1.00 41.31 H new ATOM 0 HE2 LYS A 46 6.610 -5.242 4.741 1.00 5.00 H new ATOM 0 HE3 LYS A 46 6.704 -5.792 6.402 1.00 5.00 H new ATOM 0 HZ1 LYS A 46 4.948 -6.940 5.393 1.00 22.23 H new ATOM 0 HZ2 LYS A 46 4.218 -5.784 6.401 1.00 22.23 H new ATOM 0 HZ3 LYS A 46 4.282 -5.529 4.723 1.00 22.23 H new ATOM 130 N VAL A 47 4.810 1.598 5.251 1.00 63.33 N ATOM 131 CA VAL A 47 4.991 2.947 5.799 1.00 42.31 C ATOM 132 C VAL A 47 3.779 3.781 5.463 1.00 34.31 C ATOM 133 O VAL A 47 3.260 4.524 6.286 1.00 74.21 O ATOM 134 CB VAL A 47 6.252 3.640 5.197 1.00 45.22 C ATOM 135 CG1 VAL A 47 6.467 5.043 5.766 1.00 11.52 C ATOM 136 CG2 VAL A 47 7.473 2.802 5.424 1.00 31.10 C ATOM 0 H VAL A 47 5.377 1.403 4.426 1.00 63.33 H new ATOM 0 HA VAL A 47 5.121 2.862 6.878 1.00 42.31 H new ATOM 0 HB VAL A 47 6.079 3.741 4.126 1.00 45.22 H new ATOM 0 HG11 VAL A 47 7.356 5.485 5.317 1.00 11.52 H new ATOM 0 HG12 VAL A 47 5.600 5.664 5.541 1.00 11.52 H new ATOM 0 HG13 VAL A 47 6.598 4.981 6.846 1.00 11.52 H new ATOM 0 HG21 VAL A 47 8.342 3.302 4.997 1.00 31.10 H new ATOM 0 HG22 VAL A 47 7.624 2.662 6.494 1.00 31.10 H new ATOM 0 HG23 VAL A 47 7.342 1.831 4.946 1.00 31.10 H new ATOM 146 N THR A 48 3.312 3.607 4.256 1.00 42.04 N ATOM 147 CA THR A 48 2.205 4.353 3.745 1.00 4.12 C ATOM 148 C THR A 48 0.896 4.032 4.511 1.00 61.43 C ATOM 149 O THR A 48 0.004 4.881 4.591 1.00 1.31 O ATOM 150 CB THR A 48 2.062 4.125 2.214 1.00 50.32 C ATOM 151 OG1 THR A 48 1.156 5.056 1.615 1.00 4.53 O ATOM 152 CG2 THR A 48 1.626 2.715 1.897 1.00 74.22 C ATOM 0 H THR A 48 3.698 2.933 3.595 1.00 42.04 H new ATOM 0 HA THR A 48 2.401 5.413 3.906 1.00 4.12 H new ATOM 0 HB THR A 48 3.052 4.288 1.789 1.00 50.32 H new ATOM 0 HG1 THR A 48 1.656 5.683 1.052 1.00 4.53 H new ATOM 0 HG21 THR A 48 1.537 2.596 0.817 1.00 74.22 H new ATOM 0 HG22 THR A 48 2.364 2.011 2.281 1.00 74.22 H new ATOM 0 HG23 THR A 48 0.661 2.519 2.364 1.00 74.22 H new ATOM 160 N VAL A 49 0.795 2.830 5.109 1.00 72.22 N ATOM 161 CA VAL A 49 -0.396 2.507 5.885 1.00 62.43 C ATOM 162 C VAL A 49 -0.246 3.092 7.272 1.00 11.43 C ATOM 163 O VAL A 49 -1.210 3.594 7.855 1.00 73.53 O ATOM 164 CB VAL A 49 -0.720 0.968 5.977 1.00 23.35 C ATOM 165 CG1 VAL A 49 -0.708 0.328 4.616 1.00 42.22 C ATOM 166 CG2 VAL A 49 0.176 0.204 6.963 1.00 44.03 C ATOM 0 H VAL A 49 1.502 2.096 5.068 1.00 72.22 H new ATOM 0 HA VAL A 49 -1.243 2.946 5.357 1.00 62.43 H new ATOM 0 HB VAL A 49 -1.729 0.900 6.384 1.00 23.35 H new ATOM 0 HG11 VAL A 49 -0.935 -0.734 4.711 1.00 42.22 H new ATOM 0 HG12 VAL A 49 -1.457 0.804 3.984 1.00 42.22 H new ATOM 0 HG13 VAL A 49 0.277 0.450 4.165 1.00 42.22 H new ATOM 0 HG21 VAL A 49 -0.107 -0.849 6.971 1.00 44.03 H new ATOM 0 HG22 VAL A 49 1.218 0.297 6.656 1.00 44.03 H new ATOM 0 HG23 VAL A 49 0.054 0.620 7.963 1.00 44.03 H new ATOM 176 N ALA A 50 0.995 3.098 7.751 1.00 22.21 N ATOM 177 CA ALA A 50 1.334 3.596 9.063 1.00 65.03 C ATOM 178 C ALA A 50 0.999 5.060 9.183 1.00 43.11 C ATOM 179 O ALA A 50 0.577 5.513 10.228 1.00 2.05 O ATOM 180 CB ALA A 50 2.800 3.384 9.327 1.00 34.22 C ATOM 0 H ALA A 50 1.797 2.751 7.225 1.00 22.21 H new ATOM 0 HA ALA A 50 0.750 3.047 9.801 1.00 65.03 H new ATOM 0 HB1 ALA A 50 3.050 3.762 10.318 1.00 34.22 H new ATOM 0 HB2 ALA A 50 3.029 2.319 9.276 1.00 34.22 H new ATOM 0 HB3 ALA A 50 3.385 3.917 8.578 1.00 34.22 H new ATOM 186 N LYS A 51 1.114 5.777 8.068 1.00 52.13 N ATOM 187 CA LYS A 51 0.849 7.214 8.042 1.00 34.54 C ATOM 188 C LYS A 51 -0.631 7.490 8.342 1.00 51.33 C ATOM 189 O LYS A 51 -0.988 8.539 8.881 1.00 34.44 O ATOM 190 CB LYS A 51 1.185 7.788 6.659 1.00 32.42 C ATOM 191 CG LYS A 51 2.627 7.583 6.195 1.00 54.11 C ATOM 192 CD LYS A 51 3.645 8.341 7.037 1.00 44.24 C ATOM 193 CE LYS A 51 3.474 9.850 6.914 1.00 3.53 C ATOM 194 NZ LYS A 51 4.532 10.575 7.633 1.00 21.52 N ATOM 0 H LYS A 51 1.390 5.385 7.168 1.00 52.13 H new ATOM 0 HA LYS A 51 1.471 7.688 8.801 1.00 34.54 H new ATOM 0 HB2 LYS A 51 0.518 7.336 5.925 1.00 32.42 H new ATOM 0 HB3 LYS A 51 0.973 8.857 6.667 1.00 32.42 H new ATOM 0 HG2 LYS A 51 2.863 6.519 6.223 1.00 54.11 H new ATOM 0 HG3 LYS A 51 2.716 7.902 5.156 1.00 54.11 H new ATOM 0 HD2 LYS A 51 3.542 8.048 8.082 1.00 44.24 H new ATOM 0 HD3 LYS A 51 4.652 8.063 6.726 1.00 44.24 H new ATOM 0 HE2 LYS A 51 3.488 10.134 5.862 1.00 3.53 H new ATOM 0 HE3 LYS A 51 2.500 10.140 7.309 1.00 3.53 H new ATOM 0 HZ1 LYS A 51 4.384 11.599 7.528 1.00 21.52 H new ATOM 0 HZ2 LYS A 51 4.502 10.323 8.641 1.00 21.52 H new ATOM 0 HZ3 LYS A 51 5.459 10.317 7.239 1.00 21.52 H new ATOM 208 N GLY A 52 -1.462 6.514 8.060 1.00 52.02 N ATOM 209 CA GLY A 52 -2.866 6.643 8.309 1.00 45.13 C ATOM 210 C GLY A 52 -3.224 6.133 9.679 1.00 11.52 C ATOM 211 O GLY A 52 -4.170 6.614 10.308 1.00 23.25 O ATOM 0 H GLY A 52 -1.182 5.620 7.656 1.00 52.02 H new ATOM 0 HA2 GLY A 52 -3.160 7.689 8.219 1.00 45.13 H new ATOM 0 HA3 GLY A 52 -3.424 6.089 7.554 1.00 45.13 H new ATOM 215 N ASP A 53 -2.436 5.201 10.178 1.00 10.34 N ATOM 216 CA ASP A 53 -2.711 4.606 11.477 1.00 13.42 C ATOM 217 C ASP A 53 -2.249 5.535 12.573 1.00 64.24 C ATOM 218 O ASP A 53 -2.908 5.676 13.601 1.00 24.13 O ATOM 219 CB ASP A 53 -2.113 3.191 11.632 1.00 33.43 C ATOM 220 CG ASP A 53 -2.703 2.182 10.649 1.00 23.41 C ATOM 221 OD1 ASP A 53 -3.927 2.258 10.340 1.00 51.21 O ATOM 222 OD2 ASP A 53 -1.966 1.299 10.156 1.00 24.51 O ATOM 0 H ASP A 53 -1.605 4.839 9.710 1.00 10.34 H new ATOM 0 HA ASP A 53 -3.790 4.474 11.558 1.00 13.42 H new ATOM 0 HB2 ASP A 53 -1.034 3.241 11.488 1.00 33.43 H new ATOM 0 HB3 ASP A 53 -2.283 2.840 12.650 1.00 33.43 H new ATOM 227 N ILE A 54 -1.140 6.219 12.336 1.00 31.22 N ATOM 228 CA ILE A 54 -0.670 7.240 13.264 1.00 64.42 C ATOM 229 C ILE A 54 -1.620 8.436 13.234 1.00 34.34 C ATOM 230 O ILE A 54 -1.836 9.104 14.257 1.00 73.22 O ATOM 231 CB ILE A 54 0.785 7.710 12.969 1.00 11.33 C ATOM 232 CG1 ILE A 54 0.911 8.281 11.547 1.00 53.31 C ATOM 233 CG2 ILE A 54 1.770 6.576 13.197 1.00 23.23 C ATOM 234 CD1 ILE A 54 2.295 8.750 11.174 1.00 64.32 C ATOM 0 H ILE A 54 -0.550 6.088 11.514 1.00 31.22 H new ATOM 0 HA ILE A 54 -0.658 6.789 14.256 1.00 64.42 H new ATOM 0 HB ILE A 54 1.027 8.514 13.664 1.00 11.33 H new ATOM 0 HG12 ILE A 54 0.597 7.518 10.835 1.00 53.31 H new ATOM 0 HG13 ILE A 54 0.219 9.117 11.444 1.00 53.31 H new ATOM 0 HG21 ILE A 54 2.781 6.924 12.986 1.00 23.23 H new ATOM 0 HG22 ILE A 54 1.710 6.245 14.234 1.00 23.23 H new ATOM 0 HG23 ILE A 54 1.527 5.744 12.536 1.00 23.23 H new ATOM 0 HD11 ILE A 54 2.286 9.136 10.155 1.00 64.32 H new ATOM 0 HD12 ILE A 54 2.608 9.539 11.858 1.00 64.32 H new ATOM 0 HD13 ILE A 54 2.992 7.915 11.240 1.00 64.32 H new ATOM 246 N LYS A 55 -2.227 8.667 12.059 1.00 23.12 N ATOM 247 CA LYS A 55 -3.181 9.731 11.860 1.00 13.32 C ATOM 248 C LYS A 55 -4.425 9.451 12.702 1.00 33.24 C ATOM 249 O LYS A 55 -5.086 10.372 13.198 1.00 11.21 O ATOM 250 CB LYS A 55 -3.572 9.776 10.388 1.00 23.13 C ATOM 251 CG LYS A 55 -3.907 11.145 9.873 1.00 22.31 C ATOM 252 CD LYS A 55 -2.663 12.001 9.878 1.00 4.14 C ATOM 253 CE LYS A 55 -2.935 13.382 9.327 1.00 53.33 C ATOM 254 NZ LYS A 55 -1.729 14.225 9.340 1.00 72.33 N ATOM 0 H LYS A 55 -2.057 8.107 11.223 1.00 23.12 H new ATOM 0 HA LYS A 55 -2.743 10.684 12.156 1.00 13.32 H new ATOM 0 HB2 LYS A 55 -2.753 9.369 9.795 1.00 23.13 H new ATOM 0 HB3 LYS A 55 -4.431 9.124 10.234 1.00 23.13 H new ATOM 0 HG2 LYS A 55 -4.311 11.077 8.863 1.00 22.31 H new ATOM 0 HG3 LYS A 55 -4.678 11.601 10.494 1.00 22.31 H new ATOM 0 HD2 LYS A 55 -2.282 12.083 10.896 1.00 4.14 H new ATOM 0 HD3 LYS A 55 -1.886 11.518 9.285 1.00 4.14 H new ATOM 0 HE2 LYS A 55 -3.309 13.299 8.306 1.00 53.33 H new ATOM 0 HE3 LYS A 55 -3.718 13.860 9.915 1.00 53.33 H new ATOM 0 HZ1 LYS A 55 -1.957 15.164 8.954 1.00 72.33 H new ATOM 0 HZ2 LYS A 55 -1.386 14.326 10.317 1.00 72.33 H new ATOM 0 HZ3 LYS A 55 -0.990 13.782 8.758 1.00 72.33 H new ATOM 268 N ALA A 56 -4.730 8.172 12.854 1.00 74.00 N ATOM 269 CA ALA A 56 -5.847 7.725 13.662 1.00 13.23 C ATOM 270 C ALA A 56 -5.581 8.020 15.124 1.00 53.55 C ATOM 271 O ALA A 56 -6.450 8.515 15.838 1.00 53.51 O ATOM 272 CB ALA A 56 -6.057 6.236 13.483 1.00 73.15 C ATOM 0 H ALA A 56 -4.206 7.414 12.417 1.00 74.00 H new ATOM 0 HA ALA A 56 -6.742 8.257 13.341 1.00 13.23 H new ATOM 0 HB1 ALA A 56 -6.899 5.911 14.095 1.00 73.15 H new ATOM 0 HB2 ALA A 56 -6.266 6.021 12.435 1.00 73.15 H new ATOM 0 HB3 ALA A 56 -5.158 5.702 13.790 1.00 73.15 H new ATOM 278 N ILE A 57 -4.366 7.743 15.554 1.00 24.41 N ATOM 279 CA ILE A 57 -3.976 7.944 16.940 1.00 21.44 C ATOM 280 C ILE A 57 -3.937 9.427 17.265 1.00 13.25 C ATOM 281 O ILE A 57 -4.337 9.836 18.329 1.00 42.14 O ATOM 282 CB ILE A 57 -2.609 7.310 17.245 1.00 13.40 C ATOM 283 CG1 ILE A 57 -2.612 5.859 16.806 1.00 63.40 C ATOM 284 CG2 ILE A 57 -2.348 7.387 18.739 1.00 71.44 C ATOM 285 CD1 ILE A 57 -1.272 5.179 16.872 1.00 72.10 C ATOM 0 H ILE A 57 -3.624 7.375 14.959 1.00 24.41 H new ATOM 0 HA ILE A 57 -4.722 7.453 17.564 1.00 21.44 H new ATOM 0 HB ILE A 57 -1.828 7.847 16.706 1.00 13.40 H new ATOM 0 HG12 ILE A 57 -3.315 5.307 17.429 1.00 63.40 H new ATOM 0 HG13 ILE A 57 -2.982 5.804 15.782 1.00 63.40 H new ATOM 0 HG21 ILE A 57 -1.380 6.939 18.963 1.00 71.44 H new ATOM 0 HG22 ILE A 57 -2.347 8.430 19.055 1.00 71.44 H new ATOM 0 HG23 ILE A 57 -3.130 6.847 19.273 1.00 71.44 H new ATOM 0 HD11 ILE A 57 -1.372 4.146 16.540 1.00 72.10 H new ATOM 0 HD12 ILE A 57 -0.567 5.702 16.226 1.00 72.10 H new ATOM 0 HD13 ILE A 57 -0.905 5.196 17.898 1.00 72.10 H new ATOM 297 N ALA A 58 -3.500 10.230 16.309 1.00 43.25 N ATOM 298 CA ALA A 58 -3.458 11.688 16.470 1.00 25.35 C ATOM 299 C ALA A 58 -4.863 12.247 16.736 1.00 44.35 C ATOM 300 O ALA A 58 -5.025 13.277 17.410 1.00 62.14 O ATOM 301 CB ALA A 58 -2.857 12.339 15.236 1.00 50.23 C ATOM 0 H ALA A 58 -3.165 9.901 15.404 1.00 43.25 H new ATOM 0 HA ALA A 58 -2.829 11.919 17.330 1.00 25.35 H new ATOM 0 HB1 ALA A 58 -2.833 13.420 15.370 1.00 50.23 H new ATOM 0 HB2 ALA A 58 -1.843 11.969 15.087 1.00 50.23 H new ATOM 0 HB3 ALA A 58 -3.464 12.095 14.364 1.00 50.23 H new ATOM 307 N ALA A 59 -5.863 11.535 16.239 1.00 52.51 N ATOM 308 CA ALA A 59 -7.246 11.910 16.412 1.00 40.43 C ATOM 309 C ALA A 59 -7.797 11.310 17.701 1.00 44.13 C ATOM 310 O ALA A 59 -8.581 11.928 18.387 1.00 54.43 O ATOM 311 CB ALA A 59 -8.067 11.443 15.223 1.00 41.24 C ATOM 0 H ALA A 59 -5.730 10.678 15.703 1.00 52.51 H new ATOM 0 HA ALA A 59 -7.310 12.996 16.477 1.00 40.43 H new ATOM 0 HB1 ALA A 59 -9.109 11.731 15.364 1.00 41.24 H new ATOM 0 HB2 ALA A 59 -7.683 11.903 14.313 1.00 41.24 H new ATOM 0 HB3 ALA A 59 -7.999 10.358 15.137 1.00 41.24 H new ATOM 317 N ALA A 60 -7.362 10.105 18.032 1.00 72.05 N ATOM 318 CA ALA A 60 -7.822 9.426 19.242 1.00 42.03 C ATOM 319 C ALA A 60 -7.178 10.023 20.487 1.00 31.13 C ATOM 320 O ALA A 60 -7.767 10.026 21.564 1.00 2.15 O ATOM 321 CB ALA A 60 -7.553 7.943 19.165 1.00 33.22 C ATOM 0 H ALA A 60 -6.689 9.572 17.481 1.00 72.05 H new ATOM 0 HA ALA A 60 -8.899 9.575 19.314 1.00 42.03 H new ATOM 0 HB1 ALA A 60 -7.905 7.462 20.077 1.00 33.22 H new ATOM 0 HB2 ALA A 60 -8.078 7.522 18.307 1.00 33.22 H new ATOM 0 HB3 ALA A 60 -6.482 7.773 19.055 1.00 33.22 H new ATOM 327 N LEU A 61 -5.992 10.566 20.331 1.00 24.33 N ATOM 328 CA LEU A 61 -5.294 11.222 21.418 1.00 21.40 C ATOM 329 C LEU A 61 -6.074 12.497 21.768 1.00 75.44 C ATOM 330 O LEU A 61 -6.134 12.922 22.915 1.00 64.50 O ATOM 331 CB LEU A 61 -3.848 11.535 20.974 1.00 65.02 C ATOM 332 CG LEU A 61 -2.727 11.398 22.027 1.00 14.33 C ATOM 333 CD1 LEU A 61 -2.864 12.399 23.136 1.00 33.05 C ATOM 334 CD2 LEU A 61 -2.709 10.009 22.608 1.00 4.32 C ATOM 0 H LEU A 61 -5.482 10.566 19.448 1.00 24.33 H new ATOM 0 HA LEU A 61 -5.235 10.588 22.303 1.00 21.40 H new ATOM 0 HB2 LEU A 61 -3.605 10.879 20.138 1.00 65.02 H new ATOM 0 HB3 LEU A 61 -3.828 12.556 20.594 1.00 65.02 H new ATOM 0 HG LEU A 61 -1.787 11.592 21.510 1.00 14.33 H new ATOM 0 HD11 LEU A 61 -2.053 12.263 23.851 1.00 33.05 H new ATOM 0 HD12 LEU A 61 -2.819 13.407 22.724 1.00 33.05 H new ATOM 0 HD13 LEU A 61 -3.820 12.255 23.640 1.00 33.05 H new ATOM 0 HD21 LEU A 61 -1.912 9.934 23.348 1.00 4.32 H new ATOM 0 HD22 LEU A 61 -3.667 9.802 23.085 1.00 4.32 H new ATOM 0 HD23 LEU A 61 -2.535 9.284 21.813 1.00 4.32 H new ATOM 346 N ASP A 62 -6.734 13.044 20.754 1.00 24.43 N ATOM 347 CA ASP A 62 -7.626 14.198 20.897 1.00 52.21 C ATOM 348 C ASP A 62 -8.923 13.760 21.601 1.00 53.13 C ATOM 349 O ASP A 62 -9.606 14.543 22.269 1.00 51.24 O ATOM 350 CB ASP A 62 -7.934 14.786 19.509 1.00 14.41 C ATOM 351 CG ASP A 62 -8.982 15.882 19.514 1.00 54.12 C ATOM 352 OD1 ASP A 62 -8.633 17.066 19.721 1.00 24.30 O ATOM 353 OD2 ASP A 62 -10.161 15.584 19.261 1.00 5.34 O ATOM 0 H ASP A 62 -6.667 12.698 19.797 1.00 24.43 H new ATOM 0 HA ASP A 62 -7.143 14.966 21.501 1.00 52.21 H new ATOM 0 HB2 ASP A 62 -7.013 15.183 19.083 1.00 14.41 H new ATOM 0 HB3 ASP A 62 -8.269 13.982 18.853 1.00 14.41 H new ATOM 358 N MET A 63 -9.214 12.494 21.513 1.00 42.00 N ATOM 359 CA MET A 63 -10.400 11.955 22.123 1.00 75.25 C ATOM 360 C MET A 63 -10.134 11.721 23.585 1.00 62.04 C ATOM 361 O MET A 63 -10.976 12.020 24.410 1.00 30.42 O ATOM 362 CB MET A 63 -10.899 10.696 21.403 1.00 44.03 C ATOM 363 CG MET A 63 -11.226 10.934 19.935 1.00 2.33 C ATOM 364 SD MET A 63 -11.693 9.431 19.046 1.00 55.44 S ATOM 365 CE MET A 63 -11.888 10.090 17.385 1.00 23.22 C ATOM 0 H MET A 63 -8.642 11.808 21.020 1.00 42.00 H new ATOM 0 HA MET A 63 -11.211 12.677 22.029 1.00 75.25 H new ATOM 0 HB2 MET A 63 -10.140 9.918 21.478 1.00 44.03 H new ATOM 0 HB3 MET A 63 -11.789 10.323 21.911 1.00 44.03 H new ATOM 0 HG2 MET A 63 -12.040 11.656 19.865 1.00 2.33 H new ATOM 0 HG3 MET A 63 -10.360 11.381 19.446 1.00 2.33 H new ATOM 0 HE1 MET A 63 -12.177 9.287 16.707 1.00 23.22 H new ATOM 0 HE2 MET A 63 -12.660 10.859 17.387 1.00 23.22 H new ATOM 0 HE3 MET A 63 -10.945 10.524 17.053 1.00 23.22 H new ATOM 375 N TYR A 64 -8.929 11.236 23.911 1.00 74.52 N ATOM 376 CA TYR A 64 -8.506 11.141 25.301 1.00 32.31 C ATOM 377 C TYR A 64 -8.413 12.562 25.868 1.00 21.45 C ATOM 378 O TYR A 64 -8.724 12.815 27.029 1.00 63.13 O ATOM 379 CB TYR A 64 -7.146 10.472 25.423 1.00 4.53 C ATOM 380 CG TYR A 64 -6.701 10.362 26.861 1.00 41.15 C ATOM 381 CD1 TYR A 64 -7.177 9.355 27.684 1.00 5.03 C ATOM 382 CD2 TYR A 64 -5.811 11.264 27.400 1.00 55.23 C ATOM 383 CE1 TYR A 64 -6.787 9.259 28.959 1.00 42.22 C ATOM 384 CE2 TYR A 64 -5.417 11.168 28.694 1.00 41.33 C ATOM 385 CZ TYR A 64 -5.908 10.164 29.468 1.00 22.23 C ATOM 386 OH TYR A 64 -5.520 10.053 30.750 1.00 1.51 O ATOM 0 H TYR A 64 -8.241 10.908 23.234 1.00 74.52 H new ATOM 0 HA TYR A 64 -9.230 10.539 25.851 1.00 32.31 H new ATOM 0 HB2 TYR A 64 -7.189 9.477 24.979 1.00 4.53 H new ATOM 0 HB3 TYR A 64 -6.409 11.042 24.857 1.00 4.53 H new ATOM 0 HD1 TYR A 64 -7.877 8.634 27.288 1.00 5.03 H new ATOM 0 HD2 TYR A 64 -5.421 12.060 26.783 1.00 55.23 H new ATOM 0 HE1 TYR A 64 -7.169 8.465 29.584 1.00 42.22 H new ATOM 0 HE2 TYR A 64 -4.720 11.882 29.106 1.00 41.33 H new ATOM 0 HH TYR A 64 -4.890 10.772 30.965 1.00 1.51 H new ATOM 396 N LYS A 65 -7.984 13.486 25.008 1.00 64.13 N ATOM 397 CA LYS A 65 -7.928 14.905 25.317 1.00 52.12 C ATOM 398 C LYS A 65 -9.296 15.427 25.783 1.00 61.42 C ATOM 399 O LYS A 65 -9.375 16.366 26.547 1.00 15.45 O ATOM 400 CB LYS A 65 -7.438 15.675 24.094 1.00 52.41 C ATOM 401 CG LYS A 65 -7.530 17.175 24.187 1.00 33.34 C ATOM 402 CD LYS A 65 -7.009 17.821 22.923 1.00 65.43 C ATOM 403 CE LYS A 65 -7.053 19.334 23.006 1.00 5.44 C ATOM 404 NZ LYS A 65 -6.580 19.961 21.759 1.00 30.12 N ATOM 0 H LYS A 65 -7.663 13.262 24.066 1.00 64.13 H new ATOM 0 HA LYS A 65 -7.227 15.057 26.137 1.00 52.12 H new ATOM 0 HB2 LYS A 65 -6.399 15.404 23.909 1.00 52.41 H new ATOM 0 HB3 LYS A 65 -8.012 15.347 23.227 1.00 52.41 H new ATOM 0 HG2 LYS A 65 -8.566 17.471 24.353 1.00 33.34 H new ATOM 0 HG3 LYS A 65 -6.957 17.527 25.044 1.00 33.34 H new ATOM 0 HD2 LYS A 65 -5.984 17.496 22.744 1.00 65.43 H new ATOM 0 HD3 LYS A 65 -7.602 17.486 22.072 1.00 65.43 H new ATOM 0 HE2 LYS A 65 -8.073 19.658 23.212 1.00 5.44 H new ATOM 0 HE3 LYS A 65 -6.437 19.671 23.840 1.00 5.44 H new ATOM 0 HZ1 LYS A 65 -6.624 20.996 21.852 1.00 30.12 H new ATOM 0 HZ2 LYS A 65 -5.598 19.671 21.576 1.00 30.12 H new ATOM 0 HZ3 LYS A 65 -7.184 19.659 20.968 1.00 30.12 H new ATOM 418 N LEU A 66 -10.357 14.860 25.278 1.00 24.43 N ATOM 419 CA LEU A 66 -11.678 15.191 25.783 1.00 31.24 C ATOM 420 C LEU A 66 -12.130 14.256 26.908 1.00 55.44 C ATOM 421 O LEU A 66 -12.860 14.664 27.800 1.00 1.03 O ATOM 422 CB LEU A 66 -12.727 15.286 24.675 1.00 11.23 C ATOM 423 CG LEU A 66 -12.804 16.621 23.911 1.00 52.24 C ATOM 424 CD1 LEU A 66 -13.132 17.770 24.856 1.00 71.31 C ATOM 425 CD2 LEU A 66 -11.529 16.920 23.137 1.00 70.53 C ATOM 0 H LEU A 66 -10.343 14.172 24.525 1.00 24.43 H new ATOM 0 HA LEU A 66 -11.586 16.187 26.216 1.00 31.24 H new ATOM 0 HB2 LEU A 66 -12.534 14.492 23.954 1.00 11.23 H new ATOM 0 HB3 LEU A 66 -13.705 15.088 25.114 1.00 11.23 H new ATOM 0 HG LEU A 66 -13.610 16.521 23.184 1.00 52.24 H new ATOM 0 HD11 LEU A 66 -13.181 18.702 24.293 1.00 71.31 H new ATOM 0 HD12 LEU A 66 -14.094 17.584 25.334 1.00 71.31 H new ATOM 0 HD13 LEU A 66 -12.357 17.847 25.618 1.00 71.31 H new ATOM 0 HD21 LEU A 66 -11.634 17.872 22.616 1.00 70.53 H new ATOM 0 HD22 LEU A 66 -10.688 16.976 23.828 1.00 70.53 H new ATOM 0 HD23 LEU A 66 -11.350 16.127 22.411 1.00 70.53 H new ATOM 437 N ASP A 67 -11.650 13.023 26.884 1.00 73.03 N ATOM 438 CA ASP A 67 -12.040 11.981 27.876 1.00 62.42 C ATOM 439 C ASP A 67 -11.430 12.260 29.238 1.00 12.35 C ATOM 440 O ASP A 67 -11.990 11.921 30.250 1.00 23.11 O ATOM 441 CB ASP A 67 -11.567 10.607 27.347 1.00 14.51 C ATOM 442 CG ASP A 67 -11.752 9.421 28.284 1.00 2.52 C ATOM 443 OD1 ASP A 67 -12.868 9.190 28.755 1.00 21.14 O ATOM 444 OD2 ASP A 67 -10.773 8.657 28.472 1.00 25.01 O ATOM 0 H ASP A 67 -10.980 12.697 26.187 1.00 73.03 H new ATOM 0 HA ASP A 67 -13.123 11.987 27.999 1.00 62.42 H new ATOM 0 HB2 ASP A 67 -12.100 10.396 26.420 1.00 14.51 H new ATOM 0 HB3 ASP A 67 -10.509 10.683 27.097 1.00 14.51 H new ATOM 449 N ASN A 68 -10.348 12.979 29.263 1.00 15.03 N ATOM 450 CA ASN A 68 -9.750 13.392 30.518 1.00 0.42 C ATOM 451 C ASN A 68 -9.540 14.831 30.466 1.00 12.23 C ATOM 452 O ASN A 68 -8.739 15.371 31.235 1.00 43.12 O ATOM 453 CB ASN A 68 -8.433 12.793 30.668 1.00 73.24 C ATOM 454 CG ASN A 68 -8.044 12.531 32.095 1.00 21.15 C ATOM 455 OD1 ASN A 68 -8.882 12.294 32.963 1.00 34.15 O ATOM 456 ND2 ASN A 68 -6.774 12.573 32.352 1.00 51.11 N ATOM 0 H ASN A 68 -9.852 13.298 28.431 1.00 15.03 H new ATOM 0 HA ASN A 68 -10.404 13.092 31.337 1.00 0.42 H new ATOM 0 HB2 ASN A 68 -8.407 11.854 30.116 1.00 73.24 H new ATOM 0 HB3 ASN A 68 -7.691 13.450 30.214 1.00 73.24 H new ATOM 0 HD21 ASN A 68 -6.440 12.406 33.301 1.00 51.11 H new ATOM 0 HD22 ASN A 68 -6.109 12.773 31.605 1.00 51.11 H new ATOM 463 N PHE A 69 -10.258 15.467 29.541 1.00 52.30 N ATOM 464 CA PHE A 69 -10.255 16.918 29.309 1.00 10.21 C ATOM 465 C PHE A 69 -8.864 17.551 29.328 1.00 1.31 C ATOM 466 O PHE A 69 -8.718 18.746 29.619 1.00 64.21 O ATOM 467 CB PHE A 69 -11.189 17.603 30.291 1.00 72.11 C ATOM 468 CG PHE A 69 -11.031 17.187 31.722 1.00 5.40 C ATOM 469 CD1 PHE A 69 -10.061 17.710 32.500 1.00 43.43 C ATOM 470 CD2 PHE A 69 -11.885 16.300 32.258 1.00 50.41 C ATOM 471 CE1 PHE A 69 -9.937 17.363 33.810 1.00 72.15 C ATOM 472 CE2 PHE A 69 -11.810 15.938 33.560 1.00 63.42 C ATOM 473 CZ PHE A 69 -10.827 16.478 34.356 1.00 61.34 C ATOM 0 H PHE A 69 -10.883 14.970 28.906 1.00 52.30 H new ATOM 0 HA PHE A 69 -10.619 17.070 28.293 1.00 10.21 H new ATOM 0 HB2 PHE A 69 -11.034 18.680 30.224 1.00 72.11 H new ATOM 0 HB3 PHE A 69 -12.217 17.409 29.985 1.00 72.11 H new ATOM 0 HD1 PHE A 69 -9.367 18.420 32.074 1.00 43.43 H new ATOM 0 HD2 PHE A 69 -12.651 15.864 31.634 1.00 50.41 H new ATOM 0 HE1 PHE A 69 -9.145 17.782 34.413 1.00 72.15 H new ATOM 0 HE2 PHE A 69 -12.516 15.231 33.970 1.00 63.42 H new ATOM 0 HZ PHE A 69 -10.758 16.207 35.399 1.00 61.34 H new ATOM 483 N ALA A 70 -7.885 16.800 28.882 1.00 71.30 N ATOM 484 CA ALA A 70 -6.518 17.193 28.932 1.00 13.04 C ATOM 485 C ALA A 70 -5.689 16.111 28.323 1.00 23.32 C ATOM 486 O ALA A 70 -6.163 14.981 28.159 1.00 34.13 O ATOM 487 CB ALA A 70 -6.107 17.361 30.379 1.00 4.43 C ATOM 0 H ALA A 70 -8.032 15.880 28.467 1.00 71.30 H new ATOM 0 HA ALA A 70 -6.377 18.129 28.392 1.00 13.04 H new ATOM 0 HB1 ALA A 70 -5.061 17.662 30.427 1.00 4.43 H new ATOM 0 HB2 ALA A 70 -6.727 18.126 30.847 1.00 4.43 H new ATOM 0 HB3 ALA A 70 -6.237 16.416 30.906 1.00 4.43 H new ATOM 493 N TYR A 71 -4.494 16.454 27.944 1.00 42.12 N ATOM 494 CA TYR A 71 -3.548 15.487 27.491 1.00 53.21 C ATOM 495 C TYR A 71 -2.918 14.739 28.653 1.00 54.41 C ATOM 496 O TYR A 71 -2.861 15.248 29.776 1.00 54.32 O ATOM 497 CB TYR A 71 -2.476 16.122 26.615 1.00 43.14 C ATOM 498 CG TYR A 71 -2.937 16.378 25.223 1.00 52.45 C ATOM 499 CD1 TYR A 71 -3.536 15.370 24.495 1.00 65.53 C ATOM 500 CD2 TYR A 71 -2.773 17.599 24.633 1.00 32.21 C ATOM 501 CE1 TYR A 71 -3.958 15.566 23.214 1.00 62.34 C ATOM 502 CE2 TYR A 71 -3.185 17.816 23.341 1.00 24.51 C ATOM 503 CZ TYR A 71 -3.780 16.794 22.632 1.00 13.33 C ATOM 504 OH TYR A 71 -4.185 17.006 21.332 1.00 41.11 O ATOM 0 H TYR A 71 -4.150 17.414 27.941 1.00 42.12 H new ATOM 0 HA TYR A 71 -4.094 14.765 26.883 1.00 53.21 H new ATOM 0 HB2 TYR A 71 -2.157 17.062 27.065 1.00 43.14 H new ATOM 0 HB3 TYR A 71 -1.603 15.470 26.588 1.00 43.14 H new ATOM 0 HD1 TYR A 71 -3.674 14.401 24.952 1.00 65.53 H new ATOM 0 HD2 TYR A 71 -2.314 18.403 25.189 1.00 32.21 H new ATOM 0 HE1 TYR A 71 -4.427 14.763 22.664 1.00 62.34 H new ATOM 0 HE2 TYR A 71 -3.044 18.783 22.882 1.00 24.51 H new ATOM 0 HH TYR A 71 -3.987 17.930 21.074 1.00 41.11 H new ATOM 514 N PRO A 72 -2.459 13.514 28.402 1.00 64.01 N ATOM 515 CA PRO A 72 -1.798 12.685 29.412 1.00 63.43 C ATOM 516 C PRO A 72 -0.439 13.280 29.840 1.00 72.31 C ATOM 517 O PRO A 72 0.047 14.197 29.206 1.00 0.03 O ATOM 518 CB PRO A 72 -1.569 11.364 28.653 1.00 71.54 C ATOM 519 CG PRO A 72 -1.611 11.705 27.214 1.00 24.12 C ATOM 520 CD PRO A 72 -2.559 12.824 27.094 1.00 50.21 C ATOM 0 HA PRO A 72 -2.382 12.590 30.327 1.00 63.43 H new ATOM 0 HB2 PRO A 72 -0.609 10.922 28.921 1.00 71.54 H new ATOM 0 HB3 PRO A 72 -2.338 10.633 28.903 1.00 71.54 H new ATOM 0 HG2 PRO A 72 -0.623 11.989 26.851 1.00 24.12 H new ATOM 0 HG3 PRO A 72 -1.936 10.851 26.619 1.00 24.12 H new ATOM 0 HD2 PRO A 72 -2.293 13.487 26.271 1.00 50.21 H new ATOM 0 HD3 PRO A 72 -3.573 12.471 26.904 1.00 50.21 H new ATOM 528 N SER A 73 0.139 12.812 30.934 1.00 13.12 N ATOM 529 CA SER A 73 1.492 13.196 31.263 1.00 44.32 C ATOM 530 C SER A 73 2.363 12.041 30.829 1.00 11.41 C ATOM 531 O SER A 73 1.865 10.930 30.732 1.00 5.40 O ATOM 532 CB SER A 73 1.619 13.461 32.759 1.00 30.30 C ATOM 533 OG SER A 73 1.158 12.356 33.504 1.00 70.23 O ATOM 0 H SER A 73 -0.303 12.176 31.597 1.00 13.12 H new ATOM 0 HA SER A 73 1.789 14.117 30.762 1.00 44.32 H new ATOM 0 HB2 SER A 73 2.660 13.666 33.010 1.00 30.30 H new ATOM 0 HB3 SER A 73 1.046 14.349 33.025 1.00 30.30 H new ATOM 0 HG SER A 73 1.394 12.476 34.447 1.00 70.23 H new ATOM 539 N THR A 74 3.620 12.249 30.545 1.00 33.21 N ATOM 540 CA THR A 74 4.428 11.154 30.039 1.00 61.51 C ATOM 541 C THR A 74 4.640 10.056 31.112 1.00 62.12 C ATOM 542 O THR A 74 5.103 8.958 30.814 1.00 2.01 O ATOM 543 CB THR A 74 5.762 11.643 29.420 1.00 34.11 C ATOM 544 OG1 THR A 74 6.207 10.680 28.435 1.00 3.44 O ATOM 545 CG2 THR A 74 6.841 11.826 30.497 1.00 2.31 C ATOM 0 H THR A 74 4.105 13.140 30.649 1.00 33.21 H new ATOM 0 HA THR A 74 3.868 10.695 29.224 1.00 61.51 H new ATOM 0 HB THR A 74 5.594 12.611 28.948 1.00 34.11 H new ATOM 0 HG1 THR A 74 6.063 9.773 28.776 1.00 3.44 H new ATOM 0 HG21 THR A 74 7.765 12.170 30.032 1.00 2.31 H new ATOM 0 HG22 THR A 74 6.506 12.564 31.226 1.00 2.31 H new ATOM 0 HG23 THR A 74 7.019 10.875 30.999 1.00 2.31 H new ATOM 553 N GLN A 75 4.296 10.371 32.345 1.00 65.10 N ATOM 554 CA GLN A 75 4.336 9.404 33.395 1.00 43.20 C ATOM 555 C GLN A 75 2.922 8.888 33.727 1.00 44.04 C ATOM 556 O GLN A 75 2.583 7.741 33.425 1.00 44.23 O ATOM 557 CB GLN A 75 5.012 9.979 34.623 1.00 54.04 C ATOM 558 CG GLN A 75 6.469 10.331 34.416 1.00 33.04 C ATOM 559 CD GLN A 75 7.114 10.825 35.682 1.00 34.41 C ATOM 560 OE1 GLN A 75 7.656 10.051 36.453 1.00 74.04 O ATOM 561 NE2 GLN A 75 7.050 12.097 35.918 1.00 73.05 N ATOM 0 H GLN A 75 3.985 11.299 32.634 1.00 65.10 H new ATOM 0 HA GLN A 75 4.925 8.553 33.052 1.00 43.20 H new ATOM 0 HB2 GLN A 75 4.474 10.874 34.936 1.00 54.04 H new ATOM 0 HB3 GLN A 75 4.935 9.259 35.438 1.00 54.04 H new ATOM 0 HG2 GLN A 75 7.006 9.454 34.054 1.00 33.04 H new ATOM 0 HG3 GLN A 75 6.551 11.097 33.644 1.00 33.04 H new ATOM 0 HE21 GLN A 75 6.589 12.717 35.252 1.00 73.05 H new ATOM 0 HE22 GLN A 75 7.461 12.479 36.770 1.00 73.05 H new ATOM 570 N GLN A 76 2.060 9.773 34.229 1.00 43.25 N ATOM 571 CA GLN A 76 0.733 9.362 34.698 1.00 21.50 C ATOM 572 C GLN A 76 -0.183 9.164 33.551 1.00 25.25 C ATOM 573 O GLN A 76 -1.008 8.282 33.577 1.00 3.05 O ATOM 574 CB GLN A 76 0.149 10.381 35.658 1.00 54.05 C ATOM 575 CG GLN A 76 0.984 10.619 36.896 1.00 35.04 C ATOM 576 CD GLN A 76 0.447 11.754 37.727 1.00 2.04 C ATOM 577 OE1 GLN A 76 -0.153 12.694 37.204 1.00 63.42 O ATOM 578 NE2 GLN A 76 0.642 11.689 39.010 1.00 74.42 N ATOM 0 H GLN A 76 2.253 10.770 34.322 1.00 43.25 H new ATOM 0 HA GLN A 76 0.847 8.418 35.230 1.00 21.50 H new ATOM 0 HB2 GLN A 76 0.022 11.327 35.132 1.00 54.05 H new ATOM 0 HB3 GLN A 76 -0.844 10.049 35.962 1.00 54.05 H new ATOM 0 HG2 GLN A 76 1.009 9.710 37.497 1.00 35.04 H new ATOM 0 HG3 GLN A 76 2.011 10.837 36.604 1.00 35.04 H new ATOM 0 HE21 GLN A 76 1.143 10.896 39.410 1.00 74.42 H new ATOM 0 HE22 GLN A 76 0.294 12.431 39.617 1.00 74.42 H new ATOM 587 N GLY A 77 -0.020 9.966 32.522 1.00 52.43 N ATOM 588 CA GLY A 77 -0.845 9.804 31.387 1.00 13.42 C ATOM 589 C GLY A 77 -0.411 8.653 30.508 1.00 63.14 C ATOM 590 O GLY A 77 -1.201 8.151 29.752 1.00 14.13 O ATOM 0 H GLY A 77 0.667 10.717 32.464 1.00 52.43 H new ATOM 0 HA2 GLY A 77 -1.873 9.641 31.711 1.00 13.42 H new ATOM 0 HA3 GLY A 77 -0.837 10.724 30.803 1.00 13.42 H new ATOM 594 N LEU A 78 0.837 8.220 30.617 1.00 45.40 N ATOM 595 CA LEU A 78 1.267 7.039 29.873 1.00 34.52 C ATOM 596 C LEU A 78 0.573 5.869 30.541 1.00 65.31 C ATOM 597 O LEU A 78 -0.079 5.033 29.893 1.00 14.54 O ATOM 598 CB LEU A 78 2.806 6.904 29.906 1.00 33.13 C ATOM 599 CG LEU A 78 3.469 5.932 28.896 1.00 74.55 C ATOM 600 CD1 LEU A 78 4.968 6.143 28.888 1.00 20.44 C ATOM 601 CD2 LEU A 78 3.170 4.471 29.217 1.00 22.02 C ATOM 0 H LEU A 78 1.555 8.654 31.197 1.00 45.40 H new ATOM 0 HA LEU A 78 1.002 7.094 28.817 1.00 34.52 H new ATOM 0 HB2 LEU A 78 3.232 7.894 29.747 1.00 33.13 H new ATOM 0 HB3 LEU A 78 3.093 6.591 30.910 1.00 33.13 H new ATOM 0 HG LEU A 78 3.049 6.151 27.914 1.00 74.55 H new ATOM 0 HD11 LEU A 78 5.428 5.457 28.177 1.00 20.44 H new ATOM 0 HD12 LEU A 78 5.189 7.170 28.597 1.00 20.44 H new ATOM 0 HD13 LEU A 78 5.367 5.954 29.884 1.00 20.44 H new ATOM 0 HD21 LEU A 78 3.656 3.830 28.482 1.00 22.02 H new ATOM 0 HD22 LEU A 78 3.547 4.233 30.212 1.00 22.02 H new ATOM 0 HD23 LEU A 78 2.093 4.305 29.188 1.00 22.02 H new ATOM 613 N GLU A 79 0.613 5.899 31.858 1.00 2.00 N ATOM 614 CA GLU A 79 -0.106 4.963 32.669 1.00 73.51 C ATOM 615 C GLU A 79 -1.602 5.131 32.514 1.00 33.03 C ATOM 616 O GLU A 79 -2.335 4.266 32.873 1.00 22.01 O ATOM 617 CB GLU A 79 0.282 5.092 34.133 1.00 11.04 C ATOM 618 CG GLU A 79 1.379 4.152 34.549 1.00 31.53 C ATOM 619 CD GLU A 79 0.935 2.721 34.430 1.00 2.41 C ATOM 620 OE1 GLU A 79 0.169 2.259 35.307 1.00 41.20 O ATOM 621 OE2 GLU A 79 1.299 2.045 33.463 1.00 13.41 O ATOM 0 H GLU A 79 1.152 6.582 32.390 1.00 2.00 H new ATOM 0 HA GLU A 79 0.165 3.966 32.323 1.00 73.51 H new ATOM 0 HB2 GLU A 79 0.599 6.116 34.327 1.00 11.04 H new ATOM 0 HB3 GLU A 79 -0.597 4.908 34.751 1.00 11.04 H new ATOM 0 HG2 GLU A 79 2.259 4.316 33.927 1.00 31.53 H new ATOM 0 HG3 GLU A 79 1.672 4.361 35.578 1.00 31.53 H new ATOM 628 N ALA A 80 -2.034 6.249 31.981 1.00 61.52 N ATOM 629 CA ALA A 80 -3.441 6.522 31.762 1.00 10.34 C ATOM 630 C ALA A 80 -3.843 6.237 30.328 1.00 35.31 C ATOM 631 O ALA A 80 -4.993 6.414 29.940 1.00 74.41 O ATOM 632 CB ALA A 80 -3.777 7.934 32.143 1.00 52.43 C ATOM 0 H ALA A 80 -1.416 7.004 31.683 1.00 61.52 H new ATOM 0 HA ALA A 80 -4.012 5.852 32.404 1.00 10.34 H new ATOM 0 HB1 ALA A 80 -4.838 8.115 31.970 1.00 52.43 H new ATOM 0 HB2 ALA A 80 -3.550 8.090 33.198 1.00 52.43 H new ATOM 0 HB3 ALA A 80 -3.188 8.624 31.539 1.00 52.43 H new ATOM 638 N LEU A 81 -2.869 5.874 29.543 1.00 55.03 N ATOM 639 CA LEU A 81 -3.076 5.429 28.184 1.00 53.30 C ATOM 640 C LEU A 81 -3.065 3.918 28.160 1.00 45.51 C ATOM 641 O LEU A 81 -3.452 3.294 27.177 1.00 61.31 O ATOM 642 CB LEU A 81 -1.977 5.990 27.265 1.00 34.50 C ATOM 643 CG LEU A 81 -2.357 7.175 26.350 1.00 23.31 C ATOM 644 CD1 LEU A 81 -3.035 8.294 27.121 1.00 24.43 C ATOM 645 CD2 LEU A 81 -1.112 7.702 25.638 1.00 3.41 C ATOM 0 H LEU A 81 -1.890 5.877 29.829 1.00 55.03 H new ATOM 0 HA LEU A 81 -4.037 5.793 27.820 1.00 53.30 H new ATOM 0 HB2 LEU A 81 -1.140 6.301 27.890 1.00 34.50 H new ATOM 0 HB3 LEU A 81 -1.618 5.177 26.633 1.00 34.50 H new ATOM 0 HG LEU A 81 -3.071 6.809 25.613 1.00 23.31 H new ATOM 0 HD11 LEU A 81 -3.285 9.107 26.439 1.00 24.43 H new ATOM 0 HD12 LEU A 81 -3.946 7.916 27.585 1.00 24.43 H new ATOM 0 HD13 LEU A 81 -2.361 8.664 27.894 1.00 24.43 H new ATOM 0 HD21 LEU A 81 -1.387 8.538 24.994 1.00 3.41 H new ATOM 0 HD22 LEU A 81 -0.385 8.038 26.377 1.00 3.41 H new ATOM 0 HD23 LEU A 81 -0.675 6.907 25.034 1.00 3.41 H new ATOM 657 N VAL A 82 -2.569 3.334 29.235 1.00 72.02 N ATOM 658 CA VAL A 82 -2.545 1.887 29.368 1.00 50.21 C ATOM 659 C VAL A 82 -3.508 1.422 30.477 1.00 32.22 C ATOM 660 O VAL A 82 -4.208 0.421 30.328 1.00 32.51 O ATOM 661 CB VAL A 82 -1.115 1.369 29.658 1.00 50.51 C ATOM 662 CG1 VAL A 82 -1.070 -0.151 29.626 1.00 75.15 C ATOM 663 CG2 VAL A 82 -0.127 1.953 28.665 1.00 73.44 C ATOM 0 H VAL A 82 -2.177 3.839 30.030 1.00 72.02 H new ATOM 0 HA VAL A 82 -2.874 1.468 28.417 1.00 50.21 H new ATOM 0 HB VAL A 82 -0.833 1.694 30.659 1.00 50.51 H new ATOM 0 HG11 VAL A 82 -0.055 -0.489 29.833 1.00 75.15 H new ATOM 0 HG12 VAL A 82 -1.747 -0.551 30.381 1.00 75.15 H new ATOM 0 HG13 VAL A 82 -1.376 -0.503 28.641 1.00 75.15 H new ATOM 0 HG21 VAL A 82 0.873 1.578 28.884 1.00 73.44 H new ATOM 0 HG22 VAL A 82 -0.411 1.661 27.654 1.00 73.44 H new ATOM 0 HG23 VAL A 82 -0.132 3.040 28.743 1.00 73.44 H new ATOM 673 N LYS A 83 -3.545 2.160 31.561 1.00 71.43 N ATOM 674 CA LYS A 83 -4.401 1.877 32.706 1.00 20.50 C ATOM 675 C LYS A 83 -5.385 3.049 32.833 1.00 74.45 C ATOM 676 O LYS A 83 -5.048 4.151 32.431 1.00 34.31 O ATOM 677 CB LYS A 83 -3.516 1.746 33.980 1.00 14.02 C ATOM 678 CG LYS A 83 -4.269 1.421 35.263 1.00 5.53 C ATOM 679 CD LYS A 83 -3.358 1.355 36.502 1.00 34.15 C ATOM 680 CE LYS A 83 -2.933 2.734 37.052 1.00 74.31 C ATOM 681 NZ LYS A 83 -2.042 3.514 36.155 1.00 34.52 N ATOM 0 H LYS A 83 -2.971 2.994 31.682 1.00 71.43 H new ATOM 0 HA LYS A 83 -4.951 0.944 32.583 1.00 20.50 H new ATOM 0 HB2 LYS A 83 -2.772 0.968 33.808 1.00 14.02 H new ATOM 0 HB3 LYS A 83 -2.973 2.680 34.123 1.00 14.02 H new ATOM 0 HG2 LYS A 83 -5.038 2.176 35.426 1.00 5.53 H new ATOM 0 HG3 LYS A 83 -4.780 0.465 35.145 1.00 5.53 H new ATOM 0 HD2 LYS A 83 -3.874 0.806 37.290 1.00 34.15 H new ATOM 0 HD3 LYS A 83 -2.463 0.786 36.251 1.00 34.15 H new ATOM 0 HE2 LYS A 83 -3.829 3.322 37.252 1.00 74.31 H new ATOM 0 HE3 LYS A 83 -2.427 2.589 38.007 1.00 74.31 H new ATOM 0 HZ1 LYS A 83 -1.408 4.108 36.727 1.00 34.52 H new ATOM 0 HZ2 LYS A 83 -1.476 2.862 35.575 1.00 34.52 H new ATOM 0 HZ3 LYS A 83 -2.617 4.119 35.535 1.00 34.52 H new ATOM 695 N LYS A 84 -6.585 2.811 33.346 1.00 45.34 N ATOM 696 CA LYS A 84 -7.613 3.863 33.460 1.00 32.13 C ATOM 697 C LYS A 84 -7.084 5.084 34.218 1.00 33.01 C ATOM 698 O LYS A 84 -6.388 4.944 35.234 1.00 62.13 O ATOM 699 CB LYS A 84 -8.858 3.315 34.161 1.00 41.44 C ATOM 700 CG LYS A 84 -9.634 2.294 33.352 1.00 64.51 C ATOM 701 CD LYS A 84 -10.792 1.638 34.129 1.00 35.31 C ATOM 702 CE LYS A 84 -11.857 2.624 34.638 1.00 53.00 C ATOM 703 NZ LYS A 84 -11.463 3.342 35.886 1.00 61.32 N ATOM 0 H LYS A 84 -6.881 1.899 33.694 1.00 45.34 H new ATOM 0 HA LYS A 84 -7.877 4.179 32.451 1.00 32.13 H new ATOM 0 HB2 LYS A 84 -8.558 2.860 35.105 1.00 41.44 H new ATOM 0 HB3 LYS A 84 -9.519 4.147 34.404 1.00 41.44 H new ATOM 0 HG2 LYS A 84 -10.034 2.778 32.461 1.00 64.51 H new ATOM 0 HG3 LYS A 84 -8.950 1.517 33.012 1.00 64.51 H new ATOM 0 HD2 LYS A 84 -11.274 0.902 33.485 1.00 35.31 H new ATOM 0 HD3 LYS A 84 -10.381 1.096 34.980 1.00 35.31 H new ATOM 0 HE2 LYS A 84 -12.063 3.357 33.858 1.00 53.00 H new ATOM 0 HE3 LYS A 84 -12.785 2.081 34.819 1.00 53.00 H new ATOM 0 HZ1 LYS A 84 -12.243 3.299 36.572 1.00 61.32 H new ATOM 0 HZ2 LYS A 84 -10.619 2.892 36.294 1.00 61.32 H new ATOM 0 HZ3 LYS A 84 -11.252 4.336 35.663 1.00 61.32 H new ATOM 717 N PRO A 85 -7.392 6.288 33.720 1.00 32.10 N ATOM 718 CA PRO A 85 -6.904 7.542 34.285 1.00 51.42 C ATOM 719 C PRO A 85 -7.400 7.757 35.716 1.00 4.50 C ATOM 720 O PRO A 85 -8.542 7.412 36.062 1.00 74.34 O ATOM 721 CB PRO A 85 -7.478 8.610 33.327 1.00 41.12 C ATOM 722 CG PRO A 85 -8.657 7.961 32.730 1.00 10.25 C ATOM 723 CD PRO A 85 -8.273 6.529 32.569 1.00 42.21 C ATOM 0 HA PRO A 85 -5.817 7.571 34.361 1.00 51.42 H new ATOM 0 HB2 PRO A 85 -7.752 9.519 33.862 1.00 41.12 H new ATOM 0 HB3 PRO A 85 -6.751 8.894 32.566 1.00 41.12 H new ATOM 0 HG2 PRO A 85 -9.532 8.065 33.372 1.00 10.25 H new ATOM 0 HG3 PRO A 85 -8.911 8.411 31.770 1.00 10.25 H new ATOM 0 HD2 PRO A 85 -9.144 5.874 32.584 1.00 42.21 H new ATOM 0 HD3 PRO A 85 -7.759 6.353 31.624 1.00 42.21 H new ATOM 731 N THR A 86 -6.541 8.272 36.546 1.00 75.34 N ATOM 732 CA THR A 86 -6.880 8.548 37.915 1.00 3.21 C ATOM 733 C THR A 86 -7.594 9.899 38.025 1.00 61.22 C ATOM 734 O THR A 86 -7.788 10.587 37.012 1.00 32.34 O ATOM 735 CB THR A 86 -5.617 8.519 38.811 1.00 74.15 C ATOM 736 OG1 THR A 86 -4.590 9.378 38.270 1.00 1.14 O ATOM 737 CG2 THR A 86 -5.079 7.100 38.945 1.00 42.34 C ATOM 0 H THR A 86 -5.583 8.514 36.294 1.00 75.34 H new ATOM 0 HA THR A 86 -7.558 7.770 38.265 1.00 3.21 H new ATOM 0 HB THR A 86 -5.901 8.882 39.799 1.00 74.15 H new ATOM 0 HG1 THR A 86 -3.800 9.349 38.850 1.00 1.14 H new ATOM 0 HG21 THR A 86 -4.192 7.105 39.579 1.00 42.34 H new ATOM 0 HG22 THR A 86 -5.841 6.463 39.393 1.00 42.34 H new ATOM 0 HG23 THR A 86 -4.818 6.715 37.959 1.00 42.34 H new ATOM 745 N GLY A 87 -7.998 10.265 39.217 1.00 73.35 N ATOM 746 CA GLY A 87 -8.661 11.525 39.416 1.00 53.32 C ATOM 747 C GLY A 87 -10.068 11.484 38.895 1.00 14.44 C ATOM 748 O GLY A 87 -10.907 10.727 39.406 1.00 2.54 O ATOM 0 H GLY A 87 -7.878 9.707 40.062 1.00 73.35 H new ATOM 0 HA2 GLY A 87 -8.670 11.771 40.478 1.00 53.32 H new ATOM 0 HA3 GLY A 87 -8.106 12.315 38.911 1.00 53.32 H new ATOM 752 N ASN A 88 -10.339 12.259 37.880 1.00 33.40 N ATOM 753 CA ASN A 88 -11.658 12.282 37.308 1.00 23.31 C ATOM 754 C ASN A 88 -11.598 12.574 35.808 1.00 60.22 C ATOM 755 O ASN A 88 -11.041 13.581 35.397 1.00 74.53 O ATOM 756 CB ASN A 88 -12.594 13.283 38.062 1.00 1.21 C ATOM 757 CG ASN A 88 -12.219 14.756 37.920 1.00 12.20 C ATOM 758 OD1 ASN A 88 -11.410 15.286 38.692 1.00 52.23 O ATOM 759 ND2 ASN A 88 -12.841 15.433 36.984 1.00 22.12 N ATOM 0 H ASN A 88 -9.666 12.882 37.433 1.00 33.40 H new ATOM 0 HA ASN A 88 -12.094 11.290 37.431 1.00 23.31 H new ATOM 0 HB2 ASN A 88 -13.613 13.147 37.699 1.00 1.21 H new ATOM 0 HB3 ASN A 88 -12.597 13.026 39.121 1.00 1.21 H new ATOM 0 HD21 ASN A 88 -12.664 16.432 36.874 1.00 22.12 H new ATOM 0 HD22 ASN A 88 -13.501 14.961 36.366 1.00 22.12 H new ATOM 766 N PRO A 89 -12.033 11.617 34.979 1.00 64.12 N ATOM 767 CA PRO A 89 -12.192 11.799 33.539 1.00 42.24 C ATOM 768 C PRO A 89 -13.700 11.980 33.157 1.00 3.44 C ATOM 769 O PRO A 89 -14.603 11.673 33.960 1.00 73.54 O ATOM 770 CB PRO A 89 -11.645 10.466 33.003 1.00 42.42 C ATOM 771 CG PRO A 89 -12.044 9.454 34.051 1.00 1.52 C ATOM 772 CD PRO A 89 -12.308 10.214 35.346 1.00 73.23 C ATOM 0 HA PRO A 89 -11.690 12.682 33.142 1.00 42.24 H new ATOM 0 HB2 PRO A 89 -12.073 10.222 32.031 1.00 42.42 H new ATOM 0 HB3 PRO A 89 -10.563 10.502 32.875 1.00 42.42 H new ATOM 0 HG2 PRO A 89 -12.935 8.909 33.738 1.00 1.52 H new ATOM 0 HG3 PRO A 89 -11.253 8.717 34.193 1.00 1.52 H new ATOM 0 HD2 PRO A 89 -13.334 10.082 35.688 1.00 73.23 H new ATOM 0 HD3 PRO A 89 -11.657 9.874 36.152 1.00 73.23 H new ATOM 780 N GLN A 90 -13.970 12.487 31.977 1.00 65.44 N ATOM 781 CA GLN A 90 -15.346 12.664 31.501 1.00 54.03 C ATOM 782 C GLN A 90 -15.909 11.324 31.065 1.00 71.34 C ATOM 783 O GLN A 90 -15.155 10.408 30.844 1.00 24.10 O ATOM 784 CB GLN A 90 -15.411 13.646 30.332 1.00 34.10 C ATOM 785 CG GLN A 90 -15.243 15.091 30.721 1.00 42.34 C ATOM 786 CD GLN A 90 -15.315 16.015 29.531 1.00 32.52 C ATOM 787 OE1 GLN A 90 -15.983 15.722 28.530 1.00 34.10 O ATOM 788 NE2 GLN A 90 -14.684 17.145 29.628 1.00 31.32 N ATOM 0 H GLN A 90 -13.256 12.790 31.314 1.00 65.44 H new ATOM 0 HA GLN A 90 -15.937 13.071 32.321 1.00 54.03 H new ATOM 0 HB2 GLN A 90 -14.637 13.385 29.611 1.00 34.10 H new ATOM 0 HB3 GLN A 90 -16.370 13.528 29.827 1.00 34.10 H new ATOM 0 HG2 GLN A 90 -16.017 15.364 31.438 1.00 42.34 H new ATOM 0 HG3 GLN A 90 -14.284 15.221 31.222 1.00 42.34 H new ATOM 0 HE21 GLN A 90 -14.142 17.356 30.466 1.00 31.32 H new ATOM 0 HE22 GLN A 90 -14.730 17.822 28.866 1.00 31.32 H new ATOM 797 N PRO A 91 -17.236 11.154 30.992 1.00 52.31 N ATOM 798 CA PRO A 91 -17.814 9.898 30.540 1.00 61.11 C ATOM 799 C PRO A 91 -17.607 9.660 29.030 1.00 35.25 C ATOM 800 O PRO A 91 -18.295 10.252 28.173 1.00 23.50 O ATOM 801 CB PRO A 91 -19.309 10.025 30.887 1.00 60.13 C ATOM 802 CG PRO A 91 -19.389 11.201 31.806 1.00 22.15 C ATOM 803 CD PRO A 91 -18.277 12.110 31.393 1.00 21.55 C ATOM 0 HA PRO A 91 -17.339 9.042 31.019 1.00 61.11 H new ATOM 0 HB2 PRO A 91 -19.911 10.181 29.992 1.00 60.13 H new ATOM 0 HB3 PRO A 91 -19.682 9.121 31.368 1.00 60.13 H new ATOM 0 HG2 PRO A 91 -20.355 11.699 31.722 1.00 22.15 H new ATOM 0 HG3 PRO A 91 -19.279 10.894 32.846 1.00 22.15 H new ATOM 0 HD2 PRO A 91 -18.568 12.765 30.572 1.00 21.55 H new ATOM 0 HD3 PRO A 91 -17.949 12.752 32.211 1.00 21.55 H new ATOM 811 N LYS A 92 -16.613 8.867 28.738 1.00 61.54 N ATOM 812 CA LYS A 92 -16.261 8.378 27.422 1.00 12.54 C ATOM 813 C LYS A 92 -15.708 7.004 27.632 1.00 42.20 C ATOM 814 O LYS A 92 -15.205 6.706 28.722 1.00 74.43 O ATOM 815 CB LYS A 92 -15.195 9.230 26.693 1.00 5.21 C ATOM 816 CG LYS A 92 -15.640 10.584 26.169 1.00 73.14 C ATOM 817 CD LYS A 92 -14.513 11.246 25.400 1.00 63.30 C ATOM 818 CE LYS A 92 -14.928 12.559 24.779 1.00 51.11 C ATOM 819 NZ LYS A 92 -15.918 12.390 23.703 1.00 5.32 N ATOM 0 H LYS A 92 -15.981 8.518 29.459 1.00 61.54 H new ATOM 0 HA LYS A 92 -17.150 8.411 26.792 1.00 12.54 H new ATOM 0 HB2 LYS A 92 -14.361 9.388 27.377 1.00 5.21 H new ATOM 0 HB3 LYS A 92 -14.813 8.650 25.853 1.00 5.21 H new ATOM 0 HG2 LYS A 92 -16.509 10.464 25.522 1.00 73.14 H new ATOM 0 HG3 LYS A 92 -15.946 11.220 26.999 1.00 73.14 H new ATOM 0 HD2 LYS A 92 -13.671 11.415 26.071 1.00 63.30 H new ATOM 0 HD3 LYS A 92 -14.166 10.571 24.617 1.00 63.30 H new ATOM 0 HE2 LYS A 92 -15.344 13.206 25.551 1.00 51.11 H new ATOM 0 HE3 LYS A 92 -14.047 13.063 24.381 1.00 51.11 H new ATOM 0 HZ1 LYS A 92 -16.054 13.296 23.211 1.00 5.32 H new ATOM 0 HZ2 LYS A 92 -15.578 11.677 23.027 1.00 5.32 H new ATOM 0 HZ3 LYS A 92 -16.823 12.078 24.110 1.00 5.32 H new ATOM 833 N ASN A 93 -15.889 6.128 26.690 1.00 31.32 N ATOM 834 CA ASN A 93 -15.327 4.808 26.827 1.00 62.54 C ATOM 835 C ASN A 93 -13.841 4.838 26.554 1.00 54.14 C ATOM 836 O ASN A 93 -13.400 4.785 25.387 1.00 65.35 O ATOM 837 CB ASN A 93 -16.036 3.742 25.973 1.00 70.41 C ATOM 838 CG ASN A 93 -17.448 3.446 26.446 1.00 51.02 C ATOM 839 OD1 ASN A 93 -17.662 2.600 27.322 1.00 12.22 O ATOM 840 ND2 ASN A 93 -18.415 4.104 25.869 1.00 32.23 N ATOM 0 H ASN A 93 -16.412 6.293 25.830 1.00 31.32 H new ATOM 0 HA ASN A 93 -15.492 4.505 27.861 1.00 62.54 H new ATOM 0 HB2 ASN A 93 -16.069 4.078 24.936 1.00 70.41 H new ATOM 0 HB3 ASN A 93 -15.452 2.822 25.992 1.00 70.41 H new ATOM 0 HD21 ASN A 93 -19.383 3.927 26.137 1.00 32.23 H new ATOM 0 HD22 ASN A 93 -18.203 4.795 25.150 1.00 32.23 H new ATOM 847 N TRP A 94 -13.089 4.998 27.636 1.00 15.23 N ATOM 848 CA TRP A 94 -11.656 5.029 27.650 1.00 43.21 C ATOM 849 C TRP A 94 -11.062 3.798 26.975 1.00 23.52 C ATOM 850 O TRP A 94 -11.594 2.678 27.071 1.00 33.31 O ATOM 851 CB TRP A 94 -11.187 5.152 29.112 1.00 23.31 C ATOM 852 CG TRP A 94 -9.714 5.053 29.295 1.00 53.40 C ATOM 853 CD1 TRP A 94 -8.804 6.064 29.256 1.00 21.12 C ATOM 854 CD2 TRP A 94 -8.981 3.855 29.541 1.00 34.43 C ATOM 855 NE1 TRP A 94 -7.545 5.549 29.440 1.00 32.22 N ATOM 856 CE2 TRP A 94 -7.634 4.199 29.617 1.00 12.15 C ATOM 857 CE3 TRP A 94 -9.348 2.514 29.694 1.00 70.31 C ATOM 858 CZ2 TRP A 94 -6.647 3.263 29.837 1.00 23.10 C ATOM 859 CZ3 TRP A 94 -8.367 1.585 29.918 1.00 20.12 C ATOM 860 CH2 TRP A 94 -7.033 1.961 29.988 1.00 52.53 C ATOM 0 H TRP A 94 -13.494 5.114 28.565 1.00 15.23 H new ATOM 0 HA TRP A 94 -11.305 5.889 27.080 1.00 43.21 H new ATOM 0 HB2 TRP A 94 -11.527 6.108 29.511 1.00 23.31 H new ATOM 0 HB3 TRP A 94 -11.667 4.371 29.702 1.00 23.31 H new ATOM 0 HD1 TRP A 94 -9.036 7.108 29.104 1.00 21.12 H new ATOM 0 HE1 TRP A 94 -6.680 6.090 29.444 1.00 32.22 H new ATOM 0 HE3 TRP A 94 -10.385 2.217 29.637 1.00 70.31 H new ATOM 0 HZ2 TRP A 94 -5.607 3.548 29.888 1.00 23.10 H new ATOM 0 HZ3 TRP A 94 -8.635 0.546 30.042 1.00 20.12 H new ATOM 0 HH2 TRP A 94 -6.282 1.206 30.166 1.00 52.53 H new ATOM 871 N ASN A 95 -9.978 4.019 26.295 1.00 25.22 N ATOM 872 CA ASN A 95 -9.297 3.003 25.561 1.00 13.02 C ATOM 873 C ASN A 95 -7.846 2.918 26.021 1.00 33.44 C ATOM 874 O ASN A 95 -7.206 3.943 26.222 1.00 15.31 O ATOM 875 CB ASN A 95 -9.315 3.345 24.068 1.00 54.23 C ATOM 876 CG ASN A 95 -8.549 2.339 23.208 1.00 4.23 C ATOM 877 OD1 ASN A 95 -7.887 2.718 22.245 1.00 71.11 O ATOM 878 ND2 ASN A 95 -8.677 1.061 23.488 1.00 11.33 N ATOM 0 H ASN A 95 -9.534 4.935 26.236 1.00 25.22 H new ATOM 0 HA ASN A 95 -9.798 2.050 25.733 1.00 13.02 H new ATOM 0 HB2 ASN A 95 -10.349 3.392 23.726 1.00 54.23 H new ATOM 0 HB3 ASN A 95 -8.886 4.337 23.924 1.00 54.23 H new ATOM 0 HD21 ASN A 95 -8.222 0.362 22.901 1.00 11.33 H new ATOM 0 HD22 ASN A 95 -9.231 0.768 24.293 1.00 11.33 H new ATOM 885 N LYS A 96 -7.332 1.721 26.202 1.00 13.53 N ATOM 886 CA LYS A 96 -5.927 1.572 26.513 1.00 52.45 C ATOM 887 C LYS A 96 -5.146 1.488 25.208 1.00 22.22 C ATOM 888 O LYS A 96 -5.678 1.810 24.146 1.00 74.11 O ATOM 889 CB LYS A 96 -5.644 0.323 27.371 1.00 4.21 C ATOM 890 CG LYS A 96 -5.803 -1.014 26.668 1.00 75.25 C ATOM 891 CD LYS A 96 -5.443 -2.149 27.609 1.00 4.54 C ATOM 892 CE LYS A 96 -5.569 -3.495 26.933 1.00 35.24 C ATOM 893 NZ LYS A 96 -5.158 -4.592 27.827 1.00 44.33 N ATOM 0 H LYS A 96 -7.857 0.848 26.141 1.00 13.53 H new ATOM 0 HA LYS A 96 -5.615 2.437 27.098 1.00 52.45 H new ATOM 0 HB2 LYS A 96 -4.626 0.392 27.754 1.00 4.21 H new ATOM 0 HB3 LYS A 96 -6.310 0.340 28.233 1.00 4.21 H new ATOM 0 HG2 LYS A 96 -6.830 -1.131 26.322 1.00 75.25 H new ATOM 0 HG3 LYS A 96 -5.164 -1.047 25.786 1.00 75.25 H new ATOM 0 HD2 LYS A 96 -4.422 -2.015 27.967 1.00 4.54 H new ATOM 0 HD3 LYS A 96 -6.094 -2.118 28.483 1.00 4.54 H new ATOM 0 HE2 LYS A 96 -6.601 -3.649 26.618 1.00 35.24 H new ATOM 0 HE3 LYS A 96 -4.955 -3.509 26.032 1.00 35.24 H new ATOM 0 HZ1 LYS A 96 -5.257 -5.500 27.330 1.00 44.33 H new ATOM 0 HZ2 LYS A 96 -4.166 -4.458 28.108 1.00 44.33 H new ATOM 0 HZ3 LYS A 96 -5.760 -4.593 28.675 1.00 44.33 H new ATOM 907 N ASP A 97 -3.871 1.119 25.301 1.00 23.10 N ATOM 908 CA ASP A 97 -3.009 0.889 24.130 1.00 71.22 C ATOM 909 C ASP A 97 -2.686 2.219 23.441 1.00 41.14 C ATOM 910 O ASP A 97 -2.218 2.282 22.318 1.00 10.53 O ATOM 911 CB ASP A 97 -3.643 -0.163 23.191 1.00 63.44 C ATOM 912 CG ASP A 97 -2.780 -0.589 22.028 1.00 21.32 C ATOM 913 OD1 ASP A 97 -1.681 -1.163 22.262 1.00 53.25 O ATOM 914 OD2 ASP A 97 -3.218 -0.437 20.864 1.00 20.31 O ATOM 0 H ASP A 97 -3.398 0.969 26.192 1.00 23.10 H new ATOM 0 HA ASP A 97 -2.054 0.471 24.448 1.00 71.22 H new ATOM 0 HB2 ASP A 97 -3.895 -1.046 23.778 1.00 63.44 H new ATOM 0 HB3 ASP A 97 -4.578 0.238 22.801 1.00 63.44 H new ATOM 919 N GLY A 98 -2.928 3.281 24.177 1.00 31.22 N ATOM 920 CA GLY A 98 -2.509 4.597 23.770 1.00 41.33 C ATOM 921 C GLY A 98 -3.585 5.400 23.104 1.00 73.15 C ATOM 922 O GLY A 98 -3.300 6.454 22.553 1.00 21.12 O ATOM 0 H GLY A 98 -3.419 3.254 25.071 1.00 31.22 H new ATOM 0 HA2 GLY A 98 -2.153 5.141 24.645 1.00 41.33 H new ATOM 0 HA3 GLY A 98 -1.664 4.503 23.087 1.00 41.33 H new ATOM 926 N TYR A 99 -4.820 4.912 23.188 1.00 61.43 N ATOM 927 CA TYR A 99 -5.969 5.531 22.540 1.00 25.35 C ATOM 928 C TYR A 99 -5.859 5.442 21.018 1.00 10.11 C ATOM 929 O TYR A 99 -5.255 6.277 20.356 1.00 41.41 O ATOM 930 CB TYR A 99 -6.268 6.976 23.044 1.00 2.33 C ATOM 931 CG TYR A 99 -7.555 7.091 23.782 1.00 11.34 C ATOM 932 CD1 TYR A 99 -7.618 6.816 25.127 1.00 2.43 C ATOM 933 CD2 TYR A 99 -8.714 7.475 23.136 1.00 3.51 C ATOM 934 CE1 TYR A 99 -8.790 6.918 25.809 1.00 22.44 C ATOM 935 CE2 TYR A 99 -9.896 7.580 23.816 1.00 4.32 C ATOM 936 CZ TYR A 99 -9.923 7.300 25.156 1.00 70.43 C ATOM 937 OH TYR A 99 -11.086 7.376 25.841 1.00 20.54 O ATOM 0 H TYR A 99 -5.051 4.068 23.713 1.00 61.43 H new ATOM 0 HA TYR A 99 -6.843 4.951 22.838 1.00 25.35 H new ATOM 0 HB2 TYR A 99 -5.455 7.302 23.693 1.00 2.33 H new ATOM 0 HB3 TYR A 99 -6.285 7.654 22.191 1.00 2.33 H new ATOM 0 HD1 TYR A 99 -6.723 6.514 25.650 1.00 2.43 H new ATOM 0 HD2 TYR A 99 -8.686 7.695 22.079 1.00 3.51 H new ATOM 0 HE1 TYR A 99 -8.823 6.697 26.866 1.00 22.44 H new ATOM 0 HE2 TYR A 99 -10.797 7.880 23.302 1.00 4.32 H new ATOM 0 HH TYR A 99 -10.902 7.618 26.772 1.00 20.54 H new ATOM 947 N LEU A 100 -6.415 4.386 20.496 1.00 4.22 N ATOM 948 CA LEU A 100 -6.405 4.087 19.087 1.00 44.14 C ATOM 949 C LEU A 100 -7.772 3.558 18.700 1.00 41.41 C ATOM 950 O LEU A 100 -8.506 3.064 19.541 1.00 71.25 O ATOM 951 CB LEU A 100 -5.304 3.036 18.786 1.00 40.34 C ATOM 952 CG LEU A 100 -5.277 2.419 17.368 1.00 52.21 C ATOM 953 CD1 LEU A 100 -4.989 3.447 16.286 1.00 54.43 C ATOM 954 CD2 LEU A 100 -4.292 1.271 17.299 1.00 62.24 C ATOM 0 H LEU A 100 -6.904 3.686 21.054 1.00 4.22 H new ATOM 0 HA LEU A 100 -6.187 4.984 18.507 1.00 44.14 H new ATOM 0 HB2 LEU A 100 -4.335 3.501 18.969 1.00 40.34 H new ATOM 0 HB3 LEU A 100 -5.409 2.223 19.505 1.00 40.34 H new ATOM 0 HG LEU A 100 -6.278 2.033 17.174 1.00 52.21 H new ATOM 0 HD11 LEU A 100 -4.982 2.958 15.312 1.00 54.43 H new ATOM 0 HD12 LEU A 100 -5.761 4.216 16.300 1.00 54.43 H new ATOM 0 HD13 LEU A 100 -4.017 3.905 16.469 1.00 54.43 H new ATOM 0 HD21 LEU A 100 -4.290 0.853 16.292 1.00 62.24 H new ATOM 0 HD22 LEU A 100 -3.293 1.633 17.543 1.00 62.24 H new ATOM 0 HD23 LEU A 100 -4.582 0.499 18.012 1.00 62.24 H new ATOM 966 N LYS A 101 -8.121 3.682 17.449 1.00 75.22 N ATOM 967 CA LYS A 101 -9.359 3.127 16.940 1.00 14.01 C ATOM 968 C LYS A 101 -9.172 1.622 16.749 1.00 1.24 C ATOM 969 O LYS A 101 -8.107 1.083 17.063 1.00 10.54 O ATOM 970 CB LYS A 101 -9.715 3.803 15.608 1.00 44.30 C ATOM 971 CG LYS A 101 -9.988 5.300 15.725 1.00 33.33 C ATOM 972 CD LYS A 101 -11.250 5.594 16.537 1.00 13.21 C ATOM 973 CE LYS A 101 -12.512 5.160 15.809 1.00 2.41 C ATOM 974 NZ LYS A 101 -13.743 5.556 16.534 1.00 72.40 N ATOM 0 H LYS A 101 -7.561 4.169 16.749 1.00 75.22 H new ATOM 0 HA LYS A 101 -10.174 3.304 17.642 1.00 14.01 H new ATOM 0 HB2 LYS A 101 -8.898 3.647 14.903 1.00 44.30 H new ATOM 0 HB3 LYS A 101 -10.595 3.315 15.189 1.00 44.30 H new ATOM 0 HG2 LYS A 101 -9.134 5.788 16.194 1.00 33.33 H new ATOM 0 HG3 LYS A 101 -10.091 5.728 14.728 1.00 33.33 H new ATOM 0 HD2 LYS A 101 -11.191 5.081 17.497 1.00 13.21 H new ATOM 0 HD3 LYS A 101 -11.303 6.662 16.749 1.00 13.21 H new ATOM 0 HE2 LYS A 101 -12.523 5.599 14.812 1.00 2.41 H new ATOM 0 HE3 LYS A 101 -12.501 4.078 15.680 1.00 2.41 H new ATOM 0 HZ1 LYS A 101 -14.577 5.239 16.000 1.00 72.40 H new ATOM 0 HZ2 LYS A 101 -13.747 5.116 17.476 1.00 72.40 H new ATOM 0 HZ3 LYS A 101 -13.769 6.591 16.635 1.00 72.40 H new ATOM 988 N LYS A 102 -10.162 0.940 16.251 1.00 23.54 N ATOM 989 CA LYS A 102 -10.001 -0.494 16.013 1.00 35.11 C ATOM 990 C LYS A 102 -9.295 -0.747 14.693 1.00 23.55 C ATOM 991 O LYS A 102 -9.917 -1.085 13.684 1.00 32.44 O ATOM 992 CB LYS A 102 -11.308 -1.314 16.126 1.00 32.30 C ATOM 993 CG LYS A 102 -11.799 -1.592 17.556 1.00 12.32 C ATOM 994 CD LYS A 102 -12.285 -0.355 18.303 1.00 11.03 C ATOM 995 CE LYS A 102 -13.518 0.247 17.659 1.00 44.51 C ATOM 996 NZ LYS A 102 -14.095 1.336 18.473 1.00 12.11 N ATOM 0 H LYS A 102 -11.073 1.326 16.002 1.00 23.54 H new ATOM 0 HA LYS A 102 -9.373 -0.858 16.826 1.00 35.11 H new ATOM 0 HB2 LYS A 102 -12.095 -0.785 15.588 1.00 32.30 H new ATOM 0 HB3 LYS A 102 -11.161 -2.268 15.620 1.00 32.30 H new ATOM 0 HG2 LYS A 102 -12.610 -2.319 17.514 1.00 12.32 H new ATOM 0 HG3 LYS A 102 -10.989 -2.050 18.123 1.00 12.32 H new ATOM 0 HD2 LYS A 102 -12.508 -0.620 19.337 1.00 11.03 H new ATOM 0 HD3 LYS A 102 -11.489 0.389 18.329 1.00 11.03 H new ATOM 0 HE2 LYS A 102 -13.260 0.631 16.672 1.00 44.51 H new ATOM 0 HE3 LYS A 102 -14.267 -0.531 17.513 1.00 44.51 H new ATOM 0 HZ1 LYS A 102 -14.936 1.719 17.995 1.00 12.11 H new ATOM 0 HZ2 LYS A 102 -14.366 0.966 19.406 1.00 12.11 H new ATOM 0 HZ3 LYS A 102 -13.390 2.092 18.591 1.00 12.11 H new ATOM 1010 N LEU A 103 -8.010 -0.492 14.712 1.00 33.52 N ATOM 1011 CA LEU A 103 -7.118 -0.631 13.584 1.00 44.32 C ATOM 1012 C LEU A 103 -5.908 -1.425 14.058 1.00 5.21 C ATOM 1013 O LEU A 103 -5.561 -1.336 15.235 1.00 63.24 O ATOM 1014 CB LEU A 103 -6.671 0.757 13.097 1.00 31.03 C ATOM 1015 CG LEU A 103 -7.783 1.714 12.642 1.00 13.55 C ATOM 1016 CD1 LEU A 103 -7.200 3.061 12.288 1.00 2.20 C ATOM 1017 CD2 LEU A 103 -8.542 1.146 11.454 1.00 12.25 C ATOM 0 H LEU A 103 -7.534 -0.167 15.553 1.00 33.52 H new ATOM 0 HA LEU A 103 -7.616 -1.140 12.759 1.00 44.32 H new ATOM 0 HB2 LEU A 103 -6.115 1.238 13.901 1.00 31.03 H new ATOM 0 HB3 LEU A 103 -5.978 0.621 12.267 1.00 31.03 H new ATOM 0 HG LEU A 103 -8.484 1.834 13.468 1.00 13.55 H new ATOM 0 HD11 LEU A 103 -7.998 3.730 11.967 1.00 2.20 H new ATOM 0 HD12 LEU A 103 -6.702 3.483 13.161 1.00 2.20 H new ATOM 0 HD13 LEU A 103 -6.478 2.944 11.480 1.00 2.20 H new ATOM 0 HD21 LEU A 103 -9.323 1.845 11.153 1.00 12.25 H new ATOM 0 HD22 LEU A 103 -7.854 0.991 10.623 1.00 12.25 H new ATOM 0 HD23 LEU A 103 -8.994 0.194 11.733 1.00 12.25 H new ATOM 1029 N PRO A 104 -5.282 -2.234 13.190 1.00 55.35 N ATOM 1030 CA PRO A 104 -4.119 -3.060 13.563 1.00 21.01 C ATOM 1031 C PRO A 104 -2.894 -2.237 14.022 1.00 4.32 C ATOM 1032 O PRO A 104 -2.816 -1.020 13.814 1.00 54.43 O ATOM 1033 CB PRO A 104 -3.792 -3.820 12.269 1.00 31.55 C ATOM 1034 CG PRO A 104 -4.387 -2.990 11.191 1.00 3.33 C ATOM 1035 CD PRO A 104 -5.638 -2.415 11.778 1.00 72.44 C ATOM 0 HA PRO A 104 -4.350 -3.698 14.416 1.00 21.01 H new ATOM 0 HB2 PRO A 104 -2.716 -3.932 12.136 1.00 31.55 H new ATOM 0 HB3 PRO A 104 -4.218 -4.823 12.279 1.00 31.55 H new ATOM 0 HG2 PRO A 104 -3.702 -2.202 10.878 1.00 3.33 H new ATOM 0 HG3 PRO A 104 -4.607 -3.591 10.308 1.00 3.33 H new ATOM 0 HD2 PRO A 104 -5.910 -1.471 11.305 1.00 72.44 H new ATOM 0 HD3 PRO A 104 -6.487 -3.088 11.658 1.00 72.44 H new ATOM 1043 N VAL A 105 -1.943 -2.925 14.622 1.00 13.45 N ATOM 1044 CA VAL A 105 -0.724 -2.317 15.128 1.00 33.44 C ATOM 1045 C VAL A 105 0.259 -2.086 13.946 1.00 40.13 C ATOM 1046 O VAL A 105 -0.060 -2.459 12.803 1.00 1.20 O ATOM 1047 CB VAL A 105 -0.096 -3.207 16.249 1.00 72.13 C ATOM 1048 CG1 VAL A 105 0.591 -4.460 15.710 1.00 70.44 C ATOM 1049 CG2 VAL A 105 0.800 -2.420 17.191 1.00 70.44 C ATOM 0 H VAL A 105 -1.993 -3.932 14.775 1.00 13.45 H new ATOM 0 HA VAL A 105 -0.949 -1.350 15.579 1.00 33.44 H new ATOM 0 HB VAL A 105 -0.939 -3.560 16.844 1.00 72.13 H new ATOM 0 HG11 VAL A 105 1.005 -5.033 16.539 1.00 70.44 H new ATOM 0 HG12 VAL A 105 -0.135 -5.071 15.174 1.00 70.44 H new ATOM 0 HG13 VAL A 105 1.394 -4.171 15.031 1.00 70.44 H new ATOM 0 HG21 VAL A 105 1.208 -3.089 17.949 1.00 70.44 H new ATOM 0 HG22 VAL A 105 1.617 -1.971 16.626 1.00 70.44 H new ATOM 0 HG23 VAL A 105 0.219 -1.635 17.675 1.00 70.44 H new ATOM 1059 N ASP A 106 1.402 -1.474 14.199 1.00 65.31 N ATOM 1060 CA ASP A 106 2.351 -1.127 13.141 1.00 43.42 C ATOM 1061 C ASP A 106 3.019 -2.360 12.525 1.00 24.41 C ATOM 1062 O ASP A 106 3.132 -3.423 13.186 1.00 74.32 O ATOM 1063 CB ASP A 106 3.379 -0.090 13.672 1.00 50.22 C ATOM 1064 CG ASP A 106 4.705 -0.083 13.004 1.00 2.43 C ATOM 1065 OD1 ASP A 106 4.793 0.461 11.911 1.00 75.32 O ATOM 1066 OD2 ASP A 106 5.686 -0.550 13.640 1.00 63.22 O ATOM 0 H ASP A 106 1.703 -1.202 15.135 1.00 65.31 H new ATOM 0 HA ASP A 106 1.797 -0.665 12.324 1.00 43.42 H new ATOM 0 HB2 ASP A 106 2.943 0.904 13.578 1.00 50.22 H new ATOM 0 HB3 ASP A 106 3.532 -0.272 14.736 1.00 50.22 H new ATOM 1071 N PRO A 107 3.314 -2.295 11.197 1.00 73.23 N ATOM 1072 CA PRO A 107 4.081 -3.308 10.478 1.00 44.14 C ATOM 1073 C PRO A 107 5.390 -3.658 11.166 1.00 74.22 C ATOM 1074 O PRO A 107 5.788 -3.046 12.115 1.00 52.24 O ATOM 1075 CB PRO A 107 4.393 -2.656 9.137 1.00 12.31 C ATOM 1076 CG PRO A 107 3.955 -1.234 9.261 1.00 31.14 C ATOM 1077 CD PRO A 107 2.883 -1.226 10.285 1.00 34.01 C ATOM 0 HA PRO A 107 3.517 -4.238 10.410 1.00 44.14 H new ATOM 0 HB2 PRO A 107 5.457 -2.718 8.911 1.00 12.31 H new ATOM 0 HB3 PRO A 107 3.865 -3.158 8.326 1.00 12.31 H new ATOM 0 HG2 PRO A 107 4.785 -0.594 9.560 1.00 31.14 H new ATOM 0 HG3 PRO A 107 3.587 -0.854 8.308 1.00 31.14 H new ATOM 0 HD2 PRO A 107 2.811 -0.263 10.791 1.00 34.01 H new ATOM 0 HD3 PRO A 107 1.904 -1.431 9.851 1.00 34.01 H new ATOM 1085 N TRP A 108 6.040 -4.686 10.662 1.00 1.11 N ATOM 1086 CA TRP A 108 7.306 -5.237 11.200 1.00 45.54 C ATOM 1087 C TRP A 108 7.066 -5.759 12.649 1.00 42.53 C ATOM 1088 O TRP A 108 8.006 -6.051 13.398 1.00 31.41 O ATOM 1089 CB TRP A 108 8.457 -4.184 11.227 1.00 33.43 C ATOM 1090 CG TRP A 108 8.460 -3.252 10.062 1.00 71.10 C ATOM 1091 CD1 TRP A 108 8.740 -3.538 8.777 1.00 41.41 C ATOM 1092 CD2 TRP A 108 8.127 -1.872 10.115 1.00 75.05 C ATOM 1093 NE1 TRP A 108 8.595 -2.405 8.012 1.00 2.15 N ATOM 1094 CE2 TRP A 108 8.210 -1.361 8.828 1.00 14.50 C ATOM 1095 CE3 TRP A 108 7.762 -1.034 11.148 1.00 65.12 C ATOM 1096 CZ2 TRP A 108 7.922 -0.014 8.548 1.00 70.22 C ATOM 1097 CZ3 TRP A 108 7.479 0.265 10.890 1.00 40.35 C ATOM 1098 CH2 TRP A 108 7.551 0.778 9.623 1.00 23.30 C ATOM 0 H TRP A 108 5.707 -5.190 9.840 1.00 1.11 H new ATOM 0 HA TRP A 108 7.613 -6.046 10.537 1.00 45.54 H new ATOM 0 HB2 TRP A 108 8.379 -3.601 12.145 1.00 33.43 H new ATOM 0 HB3 TRP A 108 9.412 -4.707 11.262 1.00 33.43 H new ATOM 0 HD1 TRP A 108 9.033 -4.508 8.404 1.00 41.41 H new ATOM 0 HE1 TRP A 108 8.747 -2.346 7.005 1.00 2.15 H new ATOM 0 HE3 TRP A 108 7.702 -1.412 12.158 1.00 65.12 H new ATOM 0 HZ2 TRP A 108 7.987 0.384 7.546 1.00 70.22 H new ATOM 0 HZ3 TRP A 108 7.189 0.912 11.704 1.00 40.35 H new ATOM 0 HH2 TRP A 108 7.314 1.819 9.458 1.00 23.30 H new ATOM 1109 N GLY A 109 5.790 -5.904 12.986 1.00 44.11 N ATOM 1110 CA GLY A 109 5.332 -6.393 14.279 1.00 13.41 C ATOM 1111 C GLY A 109 5.669 -5.508 15.485 1.00 42.04 C ATOM 1112 O GLY A 109 5.853 -6.033 16.593 1.00 61.23 O ATOM 0 H GLY A 109 5.025 -5.678 12.350 1.00 44.11 H new ATOM 0 HA2 GLY A 109 4.250 -6.519 14.236 1.00 13.41 H new ATOM 0 HA3 GLY A 109 5.762 -7.381 14.446 1.00 13.41 H new ATOM 1116 N ASN A 110 5.767 -4.198 15.315 1.00 25.13 N ATOM 1117 CA ASN A 110 6.072 -3.347 16.443 1.00 73.15 C ATOM 1118 C ASN A 110 4.807 -2.828 17.087 1.00 14.45 C ATOM 1119 O ASN A 110 3.871 -2.374 16.384 1.00 64.21 O ATOM 1120 CB ASN A 110 6.937 -2.144 16.065 1.00 72.11 C ATOM 1121 CG ASN A 110 8.125 -2.493 15.233 1.00 35.11 C ATOM 1122 OD1 ASN A 110 7.996 -2.294 13.972 1.00 4.01 O flip ATOM 1123 ND2 ASN A 110 9.191 -2.886 15.745 1.00 62.24 N flip ATOM 0 H ASN A 110 5.642 -3.714 14.426 1.00 25.13 H new ATOM 0 HA ASN A 110 6.630 -3.973 17.139 1.00 73.15 H new ATOM 0 HB2 ASN A 110 6.324 -1.424 15.522 1.00 72.11 H new ATOM 0 HB3 ASN A 110 7.276 -1.651 16.976 1.00 72.11 H new ATOM 0 HD21 ASN A 110 9.250 -3.031 16.753 1.00 62.24 H new ATOM 0 HD22 ASN A 110 10.005 -3.062 15.156 1.00 62.24 H new ATOM 1130 N PRO A 111 4.702 -2.950 18.421 1.00 24.52 N ATOM 1131 CA PRO A 111 3.667 -2.270 19.159 1.00 72.10 C ATOM 1132 C PRO A 111 3.965 -0.779 19.179 1.00 15.23 C ATOM 1133 O PRO A 111 5.141 -0.384 19.190 1.00 20.13 O ATOM 1134 CB PRO A 111 3.760 -2.846 20.571 1.00 55.31 C ATOM 1135 CG PRO A 111 5.125 -3.423 20.678 1.00 2.23 C ATOM 1136 CD PRO A 111 5.539 -3.807 19.288 1.00 54.35 C ATOM 0 HA PRO A 111 2.676 -2.404 18.726 1.00 72.10 H new ATOM 0 HB2 PRO A 111 3.602 -2.071 21.321 1.00 55.31 H new ATOM 0 HB3 PRO A 111 2.998 -3.608 20.734 1.00 55.31 H new ATOM 0 HG2 PRO A 111 5.820 -2.698 21.103 1.00 2.23 H new ATOM 0 HG3 PRO A 111 5.128 -4.291 21.337 1.00 2.23 H new ATOM 0 HD2 PRO A 111 6.601 -3.627 19.123 1.00 54.35 H new ATOM 0 HD3 PRO A 111 5.362 -4.865 19.096 1.00 54.35 H new ATOM 1144 N TYR A 112 2.933 0.032 19.209 1.00 63.02 N ATOM 1145 CA TYR A 112 3.100 1.471 19.186 1.00 50.11 C ATOM 1146 C TYR A 112 3.703 1.990 20.469 1.00 14.45 C ATOM 1147 O TYR A 112 3.419 1.476 21.566 1.00 45.24 O ATOM 1148 CB TYR A 112 1.795 2.216 18.843 1.00 4.23 C ATOM 1149 CG TYR A 112 1.503 2.294 17.355 1.00 20.21 C ATOM 1150 CD1 TYR A 112 2.027 3.334 16.597 1.00 71.31 C ATOM 1151 CD2 TYR A 112 0.722 1.344 16.709 1.00 51.04 C ATOM 1152 CE1 TYR A 112 1.788 3.426 15.241 1.00 33.51 C ATOM 1153 CE2 TYR A 112 0.480 1.429 15.344 1.00 10.41 C ATOM 1154 CZ TYR A 112 1.020 2.474 14.616 1.00 3.53 C ATOM 1155 OH TYR A 112 0.796 2.565 13.253 1.00 55.52 O ATOM 0 H TYR A 112 1.963 -0.280 19.250 1.00 63.02 H new ATOM 0 HA TYR A 112 3.804 1.679 18.381 1.00 50.11 H new ATOM 0 HB2 TYR A 112 0.963 1.718 19.341 1.00 4.23 H new ATOM 0 HB3 TYR A 112 1.849 3.227 19.246 1.00 4.23 H new ATOM 0 HD1 TYR A 112 2.634 4.086 17.079 1.00 71.31 H new ATOM 0 HD2 TYR A 112 0.297 0.529 17.276 1.00 51.04 H new ATOM 0 HE1 TYR A 112 2.204 4.245 14.672 1.00 33.51 H new ATOM 0 HE2 TYR A 112 -0.127 0.683 14.853 1.00 10.41 H new ATOM 0 HH TYR A 112 0.235 1.816 12.963 1.00 55.52 H new ATOM 1165 N GLN A 113 4.530 2.993 20.339 1.00 13.31 N ATOM 1166 CA GLN A 113 5.180 3.580 21.483 1.00 20.45 C ATOM 1167 C GLN A 113 4.438 4.857 21.765 1.00 52.44 C ATOM 1168 O GLN A 113 4.432 5.797 20.952 1.00 33.42 O ATOM 1169 CB GLN A 113 6.669 3.984 21.234 1.00 4.14 C ATOM 1170 CG GLN A 113 7.413 3.363 20.048 1.00 34.11 C ATOM 1171 CD GLN A 113 7.554 1.858 20.054 1.00 22.14 C ATOM 1172 OE1 GLN A 113 7.619 1.244 18.989 1.00 5.35 O ATOM 1173 NE2 GLN A 113 7.655 1.255 21.213 1.00 34.12 N ATOM 0 H GLN A 113 4.771 3.424 19.446 1.00 13.31 H new ATOM 0 HA GLN A 113 5.171 2.844 22.287 1.00 20.45 H new ATOM 0 HB2 GLN A 113 6.702 5.067 21.114 1.00 4.14 H new ATOM 0 HB3 GLN A 113 7.231 3.747 22.137 1.00 4.14 H new ATOM 0 HG2 GLN A 113 6.898 3.654 19.132 1.00 34.11 H new ATOM 0 HG3 GLN A 113 8.411 3.799 20.005 1.00 34.11 H new ATOM 0 HE21 GLN A 113 7.597 1.796 22.076 1.00 34.12 H new ATOM 0 HE22 GLN A 113 7.792 0.245 21.252 1.00 34.12 H new ATOM 1182 N TYR A 114 3.802 4.885 22.874 1.00 21.41 N ATOM 1183 CA TYR A 114 3.026 6.012 23.266 1.00 12.33 C ATOM 1184 C TYR A 114 3.698 6.781 24.372 1.00 11.42 C ATOM 1185 O TYR A 114 3.995 6.236 25.437 1.00 1.22 O ATOM 1186 CB TYR A 114 1.584 5.597 23.638 1.00 23.42 C ATOM 1187 CG TYR A 114 1.426 4.191 24.228 1.00 42.24 C ATOM 1188 CD1 TYR A 114 2.030 3.814 25.422 1.00 62.55 C ATOM 1189 CD2 TYR A 114 0.649 3.248 23.577 1.00 70.52 C ATOM 1190 CE1 TYR A 114 1.859 2.540 25.931 1.00 61.44 C ATOM 1191 CE2 TYR A 114 0.475 1.981 24.086 1.00 41.24 C ATOM 1192 CZ TYR A 114 1.075 1.634 25.250 1.00 31.40 C ATOM 1193 OH TYR A 114 0.883 0.372 25.749 1.00 31.05 O ATOM 0 H TYR A 114 3.801 4.120 23.548 1.00 21.41 H new ATOM 0 HA TYR A 114 2.954 6.684 22.410 1.00 12.33 H new ATOM 0 HB2 TYR A 114 1.192 6.318 24.356 1.00 23.42 H new ATOM 0 HB3 TYR A 114 0.964 5.667 22.744 1.00 23.42 H new ATOM 0 HD1 TYR A 114 2.640 4.525 25.959 1.00 62.55 H new ATOM 0 HD2 TYR A 114 0.168 3.513 22.647 1.00 70.52 H new ATOM 0 HE1 TYR A 114 2.337 2.256 26.857 1.00 61.44 H new ATOM 0 HE2 TYR A 114 -0.138 1.265 23.559 1.00 41.24 H new ATOM 0 HH TYR A 114 0.303 -0.135 25.143 1.00 31.05 H new ATOM 1203 N LEU A 115 3.980 8.018 24.097 1.00 44.01 N ATOM 1204 CA LEU A 115 4.568 8.915 25.052 1.00 21.03 C ATOM 1205 C LEU A 115 3.730 10.164 25.118 1.00 64.43 C ATOM 1206 O LEU A 115 3.045 10.520 24.152 1.00 54.03 O ATOM 1207 CB LEU A 115 6.028 9.252 24.705 1.00 45.30 C ATOM 1208 CG LEU A 115 7.054 8.115 24.797 1.00 75.11 C ATOM 1209 CD1 LEU A 115 8.416 8.598 24.322 1.00 63.34 C ATOM 1210 CD2 LEU A 115 7.157 7.604 26.227 1.00 13.23 C ATOM 0 H LEU A 115 3.806 8.443 23.186 1.00 44.01 H new ATOM 0 HA LEU A 115 4.587 8.427 26.026 1.00 21.03 H new ATOM 0 HB2 LEU A 115 6.051 9.645 23.689 1.00 45.30 H new ATOM 0 HB3 LEU A 115 6.355 10.055 25.365 1.00 45.30 H new ATOM 0 HG LEU A 115 6.722 7.298 24.156 1.00 75.11 H new ATOM 0 HD11 LEU A 115 9.136 7.783 24.392 1.00 63.34 H new ATOM 0 HD12 LEU A 115 8.343 8.930 23.286 1.00 63.34 H new ATOM 0 HD13 LEU A 115 8.746 9.428 24.947 1.00 63.34 H new ATOM 0 HD21 LEU A 115 7.889 6.798 26.273 1.00 13.23 H new ATOM 0 HD22 LEU A 115 7.470 8.417 26.882 1.00 13.23 H new ATOM 0 HD23 LEU A 115 6.185 7.231 26.551 1.00 13.23 H new ATOM 1222 N ALA A 116 3.766 10.820 26.221 1.00 42.40 N ATOM 1223 CA ALA A 116 2.974 11.965 26.415 1.00 53.53 C ATOM 1224 C ALA A 116 3.922 13.172 26.564 1.00 61.40 C ATOM 1225 O ALA A 116 5.129 12.952 26.459 1.00 13.13 O ATOM 1226 CB ALA A 116 2.044 11.705 27.571 1.00 73.20 C ATOM 0 H ALA A 116 4.353 10.570 27.017 1.00 42.40 H new ATOM 0 HA ALA A 116 2.324 12.202 25.573 1.00 53.53 H new ATOM 0 HB1 ALA A 116 1.419 12.582 27.740 1.00 73.20 H new ATOM 0 HB2 ALA A 116 1.412 10.847 27.343 1.00 73.20 H new ATOM 0 HB3 ALA A 116 2.628 11.498 28.468 1.00 73.20 H new ATOM 1232 N PRO A 117 3.445 14.437 26.793 1.00 32.44 N ATOM 1233 CA PRO A 117 4.295 15.617 26.731 1.00 71.41 C ATOM 1234 C PRO A 117 5.533 15.544 27.543 1.00 44.50 C ATOM 1235 O PRO A 117 5.509 15.370 28.774 1.00 51.43 O ATOM 1236 CB PRO A 117 3.414 16.784 27.165 1.00 43.03 C ATOM 1237 CG PRO A 117 2.278 16.151 27.858 1.00 2.03 C ATOM 1238 CD PRO A 117 2.103 14.810 27.197 1.00 54.31 C ATOM 0 HA PRO A 117 4.674 15.727 25.715 1.00 71.41 H new ATOM 0 HB2 PRO A 117 3.953 17.464 27.825 1.00 43.03 H new ATOM 0 HB3 PRO A 117 3.080 17.369 26.308 1.00 43.03 H new ATOM 0 HG2 PRO A 117 2.480 16.040 28.923 1.00 2.03 H new ATOM 0 HG3 PRO A 117 1.375 16.755 27.766 1.00 2.03 H new ATOM 0 HD2 PRO A 117 1.676 14.080 27.884 1.00 54.31 H new ATOM 0 HD3 PRO A 117 1.432 14.872 26.341 1.00 54.31 H new ATOM 1246 N GLY A 118 6.612 15.637 26.848 1.00 61.22 N ATOM 1247 CA GLY A 118 7.875 15.621 27.469 1.00 52.32 C ATOM 1248 C GLY A 118 8.320 17.013 27.725 1.00 64.20 C ATOM 1249 O GLY A 118 7.921 17.639 28.712 1.00 44.15 O ATOM 0 H GLY A 118 6.636 15.726 25.832 1.00 61.22 H new ATOM 0 HA2 GLY A 118 7.824 15.066 28.406 1.00 52.32 H new ATOM 0 HA3 GLY A 118 8.597 15.108 26.834 1.00 52.32 H new ATOM 1253 N THR A 119 9.059 17.532 26.816 1.00 14.33 N ATOM 1254 CA THR A 119 9.593 18.842 26.961 1.00 70.03 C ATOM 1255 C THR A 119 8.950 19.757 25.932 1.00 63.12 C ATOM 1256 O THR A 119 9.277 19.683 24.745 1.00 64.31 O ATOM 1257 CB THR A 119 11.110 18.833 26.751 1.00 54.22 C ATOM 1258 OG1 THR A 119 11.633 17.543 27.160 1.00 60.22 O ATOM 1259 CG2 THR A 119 11.760 19.916 27.605 1.00 62.02 C ATOM 0 H THR A 119 9.314 17.063 25.947 1.00 14.33 H new ATOM 0 HA THR A 119 9.382 19.199 27.969 1.00 70.03 H new ATOM 0 HB THR A 119 11.329 19.019 25.699 1.00 54.22 H new ATOM 0 HG1 THR A 119 12.604 17.527 27.028 1.00 60.22 H new ATOM 0 HG21 THR A 119 12.839 19.903 27.450 1.00 62.02 H new ATOM 0 HG22 THR A 119 11.364 20.891 27.320 1.00 62.02 H new ATOM 0 HG23 THR A 119 11.542 19.730 28.657 1.00 62.02 H new ATOM 1267 N LYS A 120 7.973 20.541 26.380 1.00 63.42 N ATOM 1268 CA LYS A 120 7.278 21.559 25.568 1.00 4.55 C ATOM 1269 C LYS A 120 6.443 20.959 24.426 1.00 41.11 C ATOM 1270 O LYS A 120 5.925 21.692 23.583 1.00 20.41 O ATOM 1271 CB LYS A 120 8.279 22.600 25.016 1.00 44.25 C ATOM 1272 CG LYS A 120 9.151 23.248 26.086 1.00 34.32 C ATOM 1273 CD LYS A 120 8.310 23.944 27.144 1.00 21.11 C ATOM 1274 CE LYS A 120 9.174 24.576 28.220 1.00 25.34 C ATOM 1275 NZ LYS A 120 8.361 25.255 29.247 1.00 3.10 N ATOM 0 H LYS A 120 7.628 20.492 27.339 1.00 63.42 H new ATOM 0 HA LYS A 120 6.577 22.055 26.239 1.00 4.55 H new ATOM 0 HB2 LYS A 120 8.922 22.116 24.281 1.00 44.25 H new ATOM 0 HB3 LYS A 120 7.726 23.379 24.492 1.00 44.25 H new ATOM 0 HG2 LYS A 120 9.775 22.489 26.557 1.00 34.32 H new ATOM 0 HG3 LYS A 120 9.823 23.969 25.621 1.00 34.32 H new ATOM 0 HD2 LYS A 120 7.695 24.711 26.674 1.00 21.11 H new ATOM 0 HD3 LYS A 120 7.629 23.225 27.599 1.00 21.11 H new ATOM 0 HE2 LYS A 120 9.787 23.808 28.691 1.00 25.34 H new ATOM 0 HE3 LYS A 120 9.856 25.293 27.764 1.00 25.34 H new ATOM 0 HZ1 LYS A 120 8.987 25.674 29.964 1.00 3.10 H new ATOM 0 HZ2 LYS A 120 7.794 26.005 28.801 1.00 3.10 H new ATOM 0 HZ3 LYS A 120 7.728 24.566 29.700 1.00 3.10 H new ATOM 1289 N GLY A 121 6.275 19.660 24.425 1.00 72.42 N ATOM 1290 CA GLY A 121 5.550 19.029 23.363 1.00 60.31 C ATOM 1291 C GLY A 121 4.413 18.198 23.861 1.00 14.01 C ATOM 1292 O GLY A 121 4.667 17.191 24.487 1.00 45.12 O ATOM 0 H GLY A 121 6.629 19.028 25.143 1.00 72.42 H new ATOM 0 HA2 GLY A 121 5.168 19.792 22.685 1.00 60.31 H new ATOM 0 HA3 GLY A 121 6.229 18.401 22.787 1.00 60.31 H new ATOM 1296 N PRO A 122 3.144 18.623 23.559 1.00 34.21 N ATOM 1297 CA PRO A 122 1.851 17.997 24.004 1.00 74.32 C ATOM 1298 C PRO A 122 1.730 16.458 24.005 1.00 32.01 C ATOM 1299 O PRO A 122 0.893 15.936 24.739 1.00 25.44 O ATOM 1300 CB PRO A 122 0.854 18.586 23.028 1.00 31.54 C ATOM 1301 CG PRO A 122 1.355 19.957 22.816 1.00 21.32 C ATOM 1302 CD PRO A 122 2.852 19.828 22.739 1.00 70.54 C ATOM 0 HA PRO A 122 1.712 18.213 25.063 1.00 74.32 H new ATOM 0 HB2 PRO A 122 0.822 18.021 22.096 1.00 31.54 H new ATOM 0 HB3 PRO A 122 -0.157 18.586 23.436 1.00 31.54 H new ATOM 0 HG2 PRO A 122 0.950 20.386 21.899 1.00 21.32 H new ATOM 0 HG3 PRO A 122 1.059 20.614 23.634 1.00 21.32 H new ATOM 0 HD2 PRO A 122 3.191 19.704 21.710 1.00 70.54 H new ATOM 0 HD3 PRO A 122 3.351 20.712 23.135 1.00 70.54 H new ATOM 1310 N PHE A 123 2.505 15.748 23.184 1.00 20.05 N ATOM 1311 CA PHE A 123 2.514 14.259 23.166 1.00 31.41 C ATOM 1312 C PHE A 123 3.460 13.768 22.101 1.00 2.24 C ATOM 1313 O PHE A 123 3.877 14.557 21.263 1.00 35.45 O ATOM 1314 CB PHE A 123 1.099 13.615 22.961 1.00 35.45 C ATOM 1315 CG PHE A 123 0.415 13.886 21.634 1.00 61.04 C ATOM 1316 CD1 PHE A 123 -0.375 15.013 21.452 1.00 24.04 C ATOM 1317 CD2 PHE A 123 0.548 12.991 20.578 1.00 2.44 C ATOM 1318 CE1 PHE A 123 -1.010 15.241 20.248 1.00 33.14 C ATOM 1319 CE2 PHE A 123 -0.088 13.216 19.376 1.00 71.52 C ATOM 1320 CZ PHE A 123 -0.866 14.342 19.208 1.00 30.13 C ATOM 0 H PHE A 123 3.145 16.172 22.512 1.00 20.05 H new ATOM 0 HA PHE A 123 2.850 13.944 24.154 1.00 31.41 H new ATOM 0 HB2 PHE A 123 1.195 12.536 23.080 1.00 35.45 H new ATOM 0 HB3 PHE A 123 0.446 13.967 23.759 1.00 35.45 H new ATOM 0 HD1 PHE A 123 -0.494 15.719 22.261 1.00 24.04 H new ATOM 0 HD2 PHE A 123 1.158 12.108 20.701 1.00 2.44 H new ATOM 0 HE1 PHE A 123 -1.620 16.123 20.118 1.00 33.14 H new ATOM 0 HE2 PHE A 123 0.023 12.510 18.566 1.00 71.52 H new ATOM 0 HZ PHE A 123 -1.362 14.521 18.265 1.00 30.13 H new ATOM 1330 N ASP A 124 3.803 12.482 22.142 1.00 54.14 N ATOM 1331 CA ASP A 124 4.680 11.846 21.146 1.00 73.11 C ATOM 1332 C ASP A 124 4.145 10.468 20.810 1.00 34.32 C ATOM 1333 O ASP A 124 4.149 9.578 21.662 1.00 5.21 O ATOM 1334 CB ASP A 124 6.125 11.676 21.655 1.00 52.13 C ATOM 1335 CG ASP A 124 6.916 12.950 21.826 1.00 42.24 C ATOM 1336 OD1 ASP A 124 6.651 13.727 22.776 1.00 30.23 O ATOM 1337 OD2 ASP A 124 7.890 13.155 21.084 1.00 33.14 O ATOM 0 H ASP A 124 3.481 11.843 22.869 1.00 54.14 H new ATOM 0 HA ASP A 124 4.693 12.499 20.273 1.00 73.11 H new ATOM 0 HB2 ASP A 124 6.094 11.159 22.614 1.00 52.13 H new ATOM 0 HB3 ASP A 124 6.661 11.029 20.961 1.00 52.13 H new ATOM 1342 N LEU A 125 3.685 10.264 19.596 1.00 73.45 N ATOM 1343 CA LEU A 125 3.161 8.965 19.235 1.00 42.44 C ATOM 1344 C LEU A 125 3.863 8.438 18.007 1.00 1.21 C ATOM 1345 O LEU A 125 3.871 9.094 16.975 1.00 44.31 O ATOM 1346 CB LEU A 125 1.659 9.043 18.996 1.00 65.33 C ATOM 1347 CG LEU A 125 0.790 8.158 19.885 1.00 33.22 C ATOM 1348 CD1 LEU A 125 1.153 6.685 19.724 1.00 63.41 C ATOM 1349 CD2 LEU A 125 0.871 8.586 21.341 1.00 32.24 C ATOM 0 H LEU A 125 3.662 10.965 18.855 1.00 73.45 H new ATOM 0 HA LEU A 125 3.343 8.277 20.061 1.00 42.44 H new ATOM 0 HB2 LEU A 125 1.344 10.078 19.130 1.00 65.33 H new ATOM 0 HB3 LEU A 125 1.463 8.782 17.956 1.00 65.33 H new ATOM 0 HG LEU A 125 -0.243 8.283 19.561 1.00 33.22 H new ATOM 0 HD11 LEU A 125 0.516 6.081 20.370 1.00 63.41 H new ATOM 0 HD12 LEU A 125 1.006 6.385 18.686 1.00 63.41 H new ATOM 0 HD13 LEU A 125 2.197 6.535 20.000 1.00 63.41 H new ATOM 0 HD21 LEU A 125 0.241 7.935 21.947 1.00 32.24 H new ATOM 0 HD22 LEU A 125 1.903 8.514 21.685 1.00 32.24 H new ATOM 0 HD23 LEU A 125 0.528 9.616 21.437 1.00 32.24 H new ATOM 1361 N TYR A 126 4.432 7.250 18.111 1.00 0.40 N ATOM 1362 CA TYR A 126 5.184 6.658 17.013 1.00 22.32 C ATOM 1363 C TYR A 126 5.391 5.182 17.254 1.00 10.55 C ATOM 1364 O TYR A 126 5.110 4.697 18.324 1.00 32.44 O ATOM 1365 CB TYR A 126 6.558 7.359 16.862 1.00 32.21 C ATOM 1366 CG TYR A 126 7.480 7.250 18.070 1.00 1.53 C ATOM 1367 CD1 TYR A 126 7.251 8.003 19.216 1.00 15.44 C ATOM 1368 CD2 TYR A 126 8.590 6.414 18.049 1.00 40.12 C ATOM 1369 CE1 TYR A 126 8.089 7.922 20.300 1.00 64.04 C ATOM 1370 CE2 TYR A 126 9.435 6.326 19.133 1.00 52.31 C ATOM 1371 CZ TYR A 126 9.177 7.084 20.257 1.00 44.54 C ATOM 1372 OH TYR A 126 10.020 7.014 21.338 1.00 63.43 O ATOM 0 H TYR A 126 4.388 6.671 18.950 1.00 0.40 H new ATOM 0 HA TYR A 126 4.613 6.792 16.094 1.00 22.32 H new ATOM 0 HB2 TYR A 126 7.069 6.938 15.996 1.00 32.21 H new ATOM 0 HB3 TYR A 126 6.388 8.414 16.650 1.00 32.21 H new ATOM 0 HD1 TYR A 126 6.398 8.664 19.254 1.00 15.44 H new ATOM 0 HD2 TYR A 126 8.793 5.823 17.168 1.00 40.12 H new ATOM 0 HE1 TYR A 126 7.894 8.514 21.182 1.00 64.04 H new ATOM 0 HE2 TYR A 126 10.292 5.670 19.104 1.00 52.31 H new ATOM 0 HH TYR A 126 10.740 6.376 21.151 1.00 63.43 H new ATOM 1382 N SER A 127 5.800 4.478 16.250 1.00 45.22 N ATOM 1383 CA SER A 127 6.204 3.107 16.386 1.00 71.54 C ATOM 1384 C SER A 127 7.603 2.988 15.813 1.00 20.22 C ATOM 1385 O SER A 127 8.000 3.810 14.973 1.00 12.33 O ATOM 1386 CB SER A 127 5.238 2.167 15.676 1.00 62.13 C ATOM 1387 OG SER A 127 5.519 0.815 15.980 1.00 4.33 O ATOM 0 H SER A 127 5.866 4.838 15.298 1.00 45.22 H new ATOM 0 HA SER A 127 6.196 2.817 17.437 1.00 71.54 H new ATOM 0 HB2 SER A 127 4.215 2.403 15.970 1.00 62.13 H new ATOM 0 HB3 SER A 127 5.303 2.321 14.599 1.00 62.13 H new ATOM 0 HG SER A 127 5.725 0.330 15.154 1.00 4.33 H new ATOM 1393 N LEU A 128 8.356 2.031 16.291 1.00 11.13 N ATOM 1394 CA LEU A 128 9.709 1.796 15.817 1.00 70.11 C ATOM 1395 C LEU A 128 9.721 1.329 14.363 1.00 71.22 C ATOM 1396 O LEU A 128 9.049 0.390 14.022 1.00 13.20 O ATOM 1397 CB LEU A 128 10.398 0.753 16.699 1.00 44.01 C ATOM 1398 CG LEU A 128 10.677 1.169 18.149 1.00 20.42 C ATOM 1399 CD1 LEU A 128 11.320 0.028 18.920 1.00 14.43 C ATOM 1400 CD2 LEU A 128 11.563 2.413 18.200 1.00 73.13 C ATOM 0 H LEU A 128 8.054 1.387 17.022 1.00 11.13 H new ATOM 0 HA LEU A 128 10.250 2.741 15.873 1.00 70.11 H new ATOM 0 HB2 LEU A 128 9.781 -0.145 16.713 1.00 44.01 H new ATOM 0 HB3 LEU A 128 11.345 0.482 16.232 1.00 44.01 H new ATOM 0 HG LEU A 128 9.724 1.410 18.619 1.00 20.42 H new ATOM 0 HD11 LEU A 128 11.510 0.344 19.946 1.00 14.43 H new ATOM 0 HD12 LEU A 128 10.650 -0.832 18.923 1.00 14.43 H new ATOM 0 HD13 LEU A 128 12.262 -0.247 18.445 1.00 14.43 H new ATOM 0 HD21 LEU A 128 11.746 2.687 19.239 1.00 73.13 H new ATOM 0 HD22 LEU A 128 12.513 2.204 17.707 1.00 73.13 H new ATOM 0 HD23 LEU A 128 11.063 3.237 17.690 1.00 73.13 H new ATOM 1412 N GLY A 129 10.521 1.990 13.527 1.00 34.31 N ATOM 1413 CA GLY A 129 10.626 1.600 12.121 1.00 40.23 C ATOM 1414 C GLY A 129 11.301 0.267 11.949 1.00 63.53 C ATOM 1415 O GLY A 129 11.735 -0.336 12.926 1.00 61.41 O ATOM 0 H GLY A 129 11.099 2.787 13.793 1.00 34.31 H new ATOM 0 HA2 GLY A 129 9.629 1.560 11.682 1.00 40.23 H new ATOM 0 HA3 GLY A 129 11.184 2.361 11.576 1.00 40.23 H new ATOM 1419 N ALA A 130 11.466 -0.151 10.714 1.00 22.23 N ATOM 1420 CA ALA A 130 12.002 -1.478 10.361 1.00 1.45 C ATOM 1421 C ALA A 130 13.397 -1.786 10.937 1.00 71.01 C ATOM 1422 O ALA A 130 13.800 -2.944 10.992 1.00 74.33 O ATOM 1423 CB ALA A 130 12.014 -1.648 8.861 1.00 44.25 C ATOM 0 H ALA A 130 11.232 0.420 9.902 1.00 22.23 H new ATOM 0 HA ALA A 130 11.329 -2.198 10.827 1.00 1.45 H new ATOM 0 HB1 ALA A 130 12.412 -2.631 8.609 1.00 44.25 H new ATOM 0 HB2 ALA A 130 10.998 -1.558 8.477 1.00 44.25 H new ATOM 0 HB3 ALA A 130 12.641 -0.877 8.413 1.00 44.25 H new ATOM 1429 N ASP A 131 14.116 -0.772 11.380 1.00 63.52 N ATOM 1430 CA ASP A 131 15.463 -0.981 11.935 1.00 52.41 C ATOM 1431 C ASP A 131 15.381 -1.117 13.462 1.00 53.21 C ATOM 1432 O ASP A 131 16.337 -1.496 14.138 1.00 45.42 O ATOM 1433 CB ASP A 131 16.371 0.195 11.546 1.00 32.54 C ATOM 1434 CG ASP A 131 17.838 -0.014 11.891 1.00 72.33 C ATOM 1435 OD1 ASP A 131 18.528 -0.754 11.158 1.00 52.04 O ATOM 1436 OD2 ASP A 131 18.337 0.590 12.869 1.00 11.31 O ATOM 0 H ASP A 131 13.805 0.199 11.372 1.00 63.52 H new ATOM 0 HA ASP A 131 15.886 -1.899 11.527 1.00 52.41 H new ATOM 0 HB2 ASP A 131 16.282 0.370 10.474 1.00 32.54 H new ATOM 0 HB3 ASP A 131 16.016 1.096 12.046 1.00 32.54 H new ATOM 1441 N GLY A 132 14.203 -0.834 13.993 1.00 53.03 N ATOM 1442 CA GLY A 132 13.968 -0.921 15.419 1.00 54.53 C ATOM 1443 C GLY A 132 14.508 0.272 16.160 1.00 72.13 C ATOM 1444 O GLY A 132 14.571 0.274 17.386 1.00 2.11 O ATOM 0 H GLY A 132 13.391 -0.540 13.450 1.00 53.03 H new ATOM 0 HA2 GLY A 132 12.897 -1.007 15.604 1.00 54.53 H new ATOM 0 HA3 GLY A 132 14.432 -1.828 15.807 1.00 54.53 H new ATOM 1448 N LYS A 133 14.903 1.276 15.418 1.00 65.11 N ATOM 1449 CA LYS A 133 15.465 2.476 15.975 1.00 32.21 C ATOM 1450 C LYS A 133 14.700 3.677 15.505 1.00 5.22 C ATOM 1451 O LYS A 133 14.139 3.677 14.402 1.00 1.34 O ATOM 1452 CB LYS A 133 16.969 2.620 15.638 1.00 24.12 C ATOM 1453 CG LYS A 133 17.913 1.579 16.279 1.00 53.21 C ATOM 1454 CD LYS A 133 18.272 1.865 17.763 1.00 22.12 C ATOM 1455 CE LYS A 133 17.060 1.921 18.674 1.00 74.42 C ATOM 1456 NZ LYS A 133 17.405 2.034 20.093 1.00 13.30 N ATOM 0 H LYS A 133 14.842 1.281 14.400 1.00 65.11 H new ATOM 0 HA LYS A 133 15.382 2.406 17.060 1.00 32.21 H new ATOM 0 HB2 LYS A 133 17.084 2.567 14.555 1.00 24.12 H new ATOM 0 HB3 LYS A 133 17.295 3.614 15.945 1.00 24.12 H new ATOM 0 HG2 LYS A 133 17.447 0.596 16.214 1.00 53.21 H new ATOM 0 HG3 LYS A 133 18.834 1.535 15.697 1.00 53.21 H new ATOM 0 HD2 LYS A 133 18.951 1.091 18.121 1.00 22.12 H new ATOM 0 HD3 LYS A 133 18.808 2.812 17.824 1.00 22.12 H new ATOM 0 HE2 LYS A 133 16.440 2.771 18.390 1.00 74.42 H new ATOM 0 HE3 LYS A 133 16.460 1.024 18.524 1.00 74.42 H new ATOM 0 HZ1 LYS A 133 16.534 2.068 20.660 1.00 13.30 H new ATOM 0 HZ2 LYS A 133 17.973 1.211 20.379 1.00 13.30 H new ATOM 0 HZ3 LYS A 133 17.953 2.904 20.249 1.00 13.30 H new ATOM 1470 N GLU A 134 14.638 4.661 16.347 1.00 21.04 N ATOM 1471 CA GLU A 134 13.987 5.883 16.040 1.00 51.32 C ATOM 1472 C GLU A 134 15.000 6.828 15.371 1.00 13.15 C ATOM 1473 O GLU A 134 15.911 7.384 16.014 1.00 74.22 O ATOM 1474 CB GLU A 134 13.339 6.503 17.316 1.00 42.12 C ATOM 1475 CG GLU A 134 14.284 6.783 18.504 1.00 21.25 C ATOM 1476 CD GLU A 134 14.745 5.547 19.250 1.00 51.24 C ATOM 1477 OE1 GLU A 134 15.661 4.854 18.785 1.00 23.45 O ATOM 1478 OE2 GLU A 134 14.209 5.258 20.336 1.00 32.14 O ATOM 0 H GLU A 134 15.047 4.631 17.281 1.00 21.04 H new ATOM 0 HA GLU A 134 13.169 5.708 15.341 1.00 51.32 H new ATOM 0 HB2 GLU A 134 12.860 7.440 17.034 1.00 42.12 H new ATOM 0 HB3 GLU A 134 12.551 5.832 17.658 1.00 42.12 H new ATOM 0 HG2 GLU A 134 15.160 7.317 18.136 1.00 21.25 H new ATOM 0 HG3 GLU A 134 13.778 7.446 19.205 1.00 21.25 H new ATOM 1485 N GLY A 135 14.861 6.970 14.089 1.00 1.13 N ATOM 1486 CA GLY A 135 15.774 7.754 13.314 1.00 10.12 C ATOM 1487 C GLY A 135 15.099 8.343 12.118 1.00 21.50 C ATOM 1488 O GLY A 135 13.879 8.221 11.979 1.00 63.22 O ATOM 0 H GLY A 135 14.108 6.544 13.548 1.00 1.13 H new ATOM 0 HA2 GLY A 135 16.187 8.552 13.931 1.00 10.12 H new ATOM 0 HA3 GLY A 135 16.610 7.133 12.994 1.00 10.12 H new ATOM 1492 N GLY A 136 15.862 8.977 11.260 1.00 53.34 N ATOM 1493 CA GLY A 136 15.312 9.519 10.064 1.00 52.43 C ATOM 1494 C GLY A 136 15.712 8.654 8.922 1.00 52.14 C ATOM 1495 O GLY A 136 16.894 8.397 8.726 1.00 31.31 O ATOM 0 H GLY A 136 16.864 9.125 11.377 1.00 53.34 H new ATOM 0 HA2 GLY A 136 14.226 9.571 10.137 1.00 52.43 H new ATOM 0 HA3 GLY A 136 15.670 10.537 9.911 1.00 52.43 H new ATOM 1499 N SER A 137 14.741 8.245 8.165 1.00 3.23 N ATOM 1500 CA SER A 137 14.847 7.277 7.092 1.00 44.33 C ATOM 1501 C SER A 137 13.444 7.126 6.515 1.00 24.25 C ATOM 1502 O SER A 137 12.534 7.847 6.942 1.00 24.30 O ATOM 1503 CB SER A 137 15.359 5.901 7.623 1.00 40.24 C ATOM 1504 OG SER A 137 16.737 5.916 7.978 1.00 44.22 O ATOM 0 H SER A 137 13.789 8.594 8.279 1.00 3.23 H new ATOM 0 HA SER A 137 15.561 7.612 6.339 1.00 44.33 H new ATOM 0 HB2 SER A 137 14.769 5.612 8.493 1.00 40.24 H new ATOM 0 HB3 SER A 137 15.195 5.140 6.860 1.00 40.24 H new ATOM 0 HG SER A 137 17.079 6.833 7.923 1.00 44.22 H new ATOM 1510 N ASP A 138 13.262 6.270 5.551 1.00 41.43 N ATOM 1511 CA ASP A 138 11.927 6.026 5.018 1.00 22.41 C ATOM 1512 C ASP A 138 11.195 5.018 5.876 1.00 51.15 C ATOM 1513 O ASP A 138 10.353 5.381 6.702 1.00 62.41 O ATOM 1514 CB ASP A 138 11.966 5.533 3.569 1.00 23.14 C ATOM 1515 CG ASP A 138 12.479 6.555 2.593 1.00 44.52 C ATOM 1516 OD1 ASP A 138 11.678 7.317 2.045 1.00 42.42 O ATOM 1517 OD2 ASP A 138 13.684 6.570 2.316 1.00 25.42 O ATOM 0 H ASP A 138 14.006 5.727 5.112 1.00 41.43 H new ATOM 0 HA ASP A 138 11.397 6.978 5.034 1.00 22.41 H new ATOM 0 HB2 ASP A 138 12.595 4.645 3.514 1.00 23.14 H new ATOM 0 HB3 ASP A 138 10.962 5.232 3.271 1.00 23.14 H new ATOM 1522 N ASN A 139 11.568 3.768 5.735 1.00 71.34 N ATOM 1523 CA ASN A 139 10.889 2.679 6.432 1.00 21.11 C ATOM 1524 C ASN A 139 11.666 2.260 7.663 1.00 44.43 C ATOM 1525 O ASN A 139 11.143 1.610 8.553 1.00 73.42 O ATOM 1526 CB ASN A 139 10.689 1.473 5.495 1.00 13.42 C ATOM 1527 CG ASN A 139 11.982 0.783 5.119 1.00 63.41 C ATOM 1528 OD1 ASN A 139 12.330 -0.241 5.843 1.00 33.34 O flip ATOM 1529 ND2 ASN A 139 12.641 1.158 4.149 1.00 61.12 N flip ATOM 0 H ASN A 139 12.342 3.469 5.142 1.00 71.34 H new ATOM 0 HA ASN A 139 9.910 3.041 6.747 1.00 21.11 H new ATOM 0 HB2 ASN A 139 10.029 0.753 5.978 1.00 13.42 H new ATOM 0 HB3 ASN A 139 10.187 1.807 4.587 1.00 13.42 H new ATOM 0 HD21 ASN A 139 12.335 1.966 3.606 1.00 61.12 H new ATOM 0 HD22 ASN A 139 13.493 0.661 3.888 1.00 61.12 H new ATOM 1536 N ASP A 140 12.925 2.636 7.707 1.00 14.13 N ATOM 1537 CA ASP A 140 13.784 2.304 8.846 1.00 41.33 C ATOM 1538 C ASP A 140 13.602 3.319 9.940 1.00 50.54 C ATOM 1539 O ASP A 140 14.090 3.155 11.053 1.00 55.13 O ATOM 1540 CB ASP A 140 15.257 2.238 8.435 1.00 70.23 C ATOM 1541 CG ASP A 140 15.543 1.139 7.450 1.00 12.52 C ATOM 1542 OD1 ASP A 140 15.353 1.348 6.245 1.00 53.41 O ATOM 1543 OD2 ASP A 140 15.970 0.046 7.862 1.00 50.24 O ATOM 0 H ASP A 140 13.386 3.172 6.972 1.00 14.13 H new ATOM 0 HA ASP A 140 13.492 1.319 9.211 1.00 41.33 H new ATOM 0 HB2 ASP A 140 15.550 3.194 8.000 1.00 70.23 H new ATOM 0 HB3 ASP A 140 15.870 2.090 9.324 1.00 70.23 H new ATOM 1548 N ALA A 141 12.876 4.354 9.612 1.00 35.41 N ATOM 1549 CA ALA A 141 12.579 5.434 10.514 1.00 14.12 C ATOM 1550 C ALA A 141 11.368 5.096 11.293 1.00 31.34 C ATOM 1551 O ALA A 141 10.546 4.308 10.839 1.00 62.44 O ATOM 1552 CB ALA A 141 12.309 6.696 9.758 1.00 23.14 C ATOM 0 H ALA A 141 12.464 4.472 8.686 1.00 35.41 H new ATOM 0 HA ALA A 141 13.437 5.581 11.170 1.00 14.12 H new ATOM 0 HB1 ALA A 141 12.087 7.500 10.460 1.00 23.14 H new ATOM 0 HB2 ALA A 141 13.186 6.962 9.168 1.00 23.14 H new ATOM 0 HB3 ALA A 141 11.457 6.547 9.095 1.00 23.14 H new ATOM 1558 N ASP A 142 11.229 5.702 12.422 1.00 43.50 N ATOM 1559 CA ASP A 142 10.093 5.470 13.247 1.00 65.51 C ATOM 1560 C ASP A 142 8.941 6.234 12.657 1.00 11.11 C ATOM 1561 O ASP A 142 9.096 7.377 12.199 1.00 34.42 O ATOM 1562 CB ASP A 142 10.359 5.938 14.692 1.00 24.04 C ATOM 1563 CG ASP A 142 10.649 7.429 14.808 1.00 30.04 C ATOM 1564 OD1 ASP A 142 11.731 7.873 14.353 1.00 73.03 O ATOM 1565 OD2 ASP A 142 9.809 8.182 15.355 1.00 3.45 O ATOM 0 H ASP A 142 11.899 6.372 12.799 1.00 43.50 H new ATOM 0 HA ASP A 142 9.870 4.404 13.286 1.00 65.51 H new ATOM 0 HB2 ASP A 142 9.493 5.696 15.308 1.00 24.04 H new ATOM 0 HB3 ASP A 142 11.204 5.380 15.096 1.00 24.04 H new ATOM 1570 N ILE A 143 7.827 5.594 12.571 1.00 65.04 N ATOM 1571 CA ILE A 143 6.671 6.207 12.016 1.00 5.24 C ATOM 1572 C ILE A 143 5.790 6.757 13.099 1.00 51.21 C ATOM 1573 O ILE A 143 5.391 6.052 14.009 1.00 52.42 O ATOM 1574 CB ILE A 143 5.911 5.299 10.976 1.00 44.32 C ATOM 1575 CG1 ILE A 143 5.700 3.836 11.450 1.00 60.42 C ATOM 1576 CG2 ILE A 143 6.618 5.313 9.636 1.00 12.33 C ATOM 1577 CD1 ILE A 143 4.634 3.634 12.501 1.00 13.23 C ATOM 0 H ILE A 143 7.692 4.632 12.883 1.00 65.04 H new ATOM 0 HA ILE A 143 7.009 7.054 11.419 1.00 5.24 H new ATOM 0 HB ILE A 143 4.917 5.736 10.877 1.00 44.32 H new ATOM 0 HG12 ILE A 143 5.449 3.225 10.583 1.00 60.42 H new ATOM 0 HG13 ILE A 143 6.646 3.461 11.841 1.00 60.42 H new ATOM 0 HG21 ILE A 143 6.077 4.680 8.933 1.00 12.33 H new ATOM 0 HG22 ILE A 143 6.653 6.333 9.254 1.00 12.33 H new ATOM 0 HG23 ILE A 143 7.634 4.936 9.757 1.00 12.33 H new ATOM 0 HD11 ILE A 143 4.572 2.576 12.758 1.00 13.23 H new ATOM 0 HD12 ILE A 143 4.887 4.209 13.391 1.00 13.23 H new ATOM 0 HD13 ILE A 143 3.672 3.970 12.113 1.00 13.23 H new ATOM 1589 N GLY A 144 5.574 8.029 13.068 1.00 61.14 N ATOM 1590 CA GLY A 144 4.764 8.605 14.067 1.00 65.31 C ATOM 1591 C GLY A 144 4.492 10.035 13.838 1.00 5.45 C ATOM 1592 O GLY A 144 5.146 10.691 13.010 1.00 72.13 O ATOM 0 H GLY A 144 5.944 8.675 12.370 1.00 61.14 H new ATOM 0 HA2 GLY A 144 3.819 8.065 14.116 1.00 65.31 H new ATOM 0 HA3 GLY A 144 5.250 8.484 15.035 1.00 65.31 H new ATOM 1596 N ASN A 145 3.562 10.528 14.570 1.00 75.43 N ATOM 1597 CA ASN A 145 3.168 11.890 14.503 1.00 33.31 C ATOM 1598 C ASN A 145 2.798 12.355 15.869 1.00 60.32 C ATOM 1599 O ASN A 145 2.340 11.554 16.713 1.00 25.02 O ATOM 1600 CB ASN A 145 2.033 12.170 13.481 1.00 41.12 C ATOM 1601 CG ASN A 145 0.714 11.382 13.647 1.00 12.21 C ATOM 1602 OD1 ASN A 145 -0.008 11.211 12.676 1.00 33.54 O ATOM 1603 ND2 ASN A 145 0.390 10.898 14.827 1.00 13.53 N ATOM 0 H ASN A 145 3.038 9.981 15.253 1.00 75.43 H new ATOM 0 HA ASN A 145 4.021 12.458 14.131 1.00 33.31 H new ATOM 0 HB2 ASN A 145 1.797 13.233 13.523 1.00 41.12 H new ATOM 0 HB3 ASN A 145 2.422 11.969 12.483 1.00 41.12 H new ATOM 0 HD21 ASN A 145 -0.476 10.371 14.942 1.00 13.53 H new ATOM 0 HD22 ASN A 145 1.004 11.050 15.627 1.00 13.53 H new ATOM 1610 N TRP A 146 2.995 13.595 16.106 1.00 14.32 N ATOM 1611 CA TRP A 146 2.732 14.173 17.370 1.00 44.54 C ATOM 1612 C TRP A 146 2.707 15.650 17.252 1.00 23.32 C ATOM 1613 O TRP A 146 2.880 16.195 16.161 1.00 4.03 O ATOM 1614 CB TRP A 146 3.752 13.731 18.416 1.00 14.11 C ATOM 1615 CG TRP A 146 5.185 14.059 18.113 1.00 51.22 C ATOM 1616 CD1 TRP A 146 5.790 15.275 18.182 1.00 5.32 C ATOM 1617 CD2 TRP A 146 6.192 13.135 17.742 1.00 74.42 C ATOM 1618 NE1 TRP A 146 7.103 15.168 17.834 1.00 43.21 N ATOM 1619 CE2 TRP A 146 7.382 13.859 17.568 1.00 75.41 C ATOM 1620 CE3 TRP A 146 6.198 11.768 17.532 1.00 31.14 C ATOM 1621 CZ2 TRP A 146 8.570 13.252 17.192 1.00 25.23 C ATOM 1622 CZ3 TRP A 146 7.377 11.161 17.163 1.00 61.32 C ATOM 1623 CH2 TRP A 146 8.550 11.904 16.996 1.00 61.25 C ATOM 0 H TRP A 146 3.351 14.253 15.413 1.00 14.32 H new ATOM 0 HA TRP A 146 1.755 13.825 17.706 1.00 44.54 H new ATOM 0 HB2 TRP A 146 3.488 14.189 19.369 1.00 14.11 H new ATOM 0 HB3 TRP A 146 3.666 12.652 18.546 1.00 14.11 H new ATOM 0 HD1 TRP A 146 5.300 16.193 18.471 1.00 5.32 H new ATOM 0 HE1 TRP A 146 7.768 15.940 17.781 1.00 43.21 H new ATOM 0 HE3 TRP A 146 5.295 11.188 17.655 1.00 31.14 H new ATOM 0 HZ2 TRP A 146 9.476 13.825 17.060 1.00 25.23 H new ATOM 0 HZ3 TRP A 146 7.397 10.094 17.000 1.00 61.32 H new ATOM 0 HH2 TRP A 146 9.459 11.398 16.706 1.00 61.25 H new ATOM 1634 N ASP A 147 2.460 16.287 18.341 1.00 1.14 N ATOM 1635 CA ASP A 147 2.451 17.712 18.390 1.00 14.15 C ATOM 1636 C ASP A 147 3.510 18.139 19.370 1.00 14.34 C ATOM 1637 O ASP A 147 3.511 17.678 20.518 1.00 21.01 O ATOM 1638 CB ASP A 147 1.087 18.236 18.830 1.00 50.24 C ATOM 1639 CG ASP A 147 0.999 19.740 18.738 1.00 31.43 C ATOM 1640 OD1 ASP A 147 1.360 20.433 19.688 1.00 43.52 O ATOM 1641 OD2 ASP A 147 0.556 20.248 17.684 1.00 4.21 O ATOM 0 H ASP A 147 2.256 15.834 19.232 1.00 1.14 H new ATOM 0 HA ASP A 147 2.652 18.119 17.399 1.00 14.15 H new ATOM 0 HB2 ASP A 147 0.310 17.789 18.209 1.00 50.24 H new ATOM 0 HB3 ASP A 147 0.893 17.924 19.856 1.00 50.24 H new ATOM 1646 N ASN A 148 4.439 18.929 18.912 1.00 13.35 N ATOM 1647 CA ASN A 148 5.491 19.455 19.743 1.00 12.23 C ATOM 1648 C ASN A 148 5.690 20.905 19.383 1.00 50.34 C ATOM 1649 O ASN A 148 5.514 21.772 20.254 1.00 54.12 O ATOM 1650 CB ASN A 148 6.818 18.640 19.640 1.00 62.24 C ATOM 1651 CG ASN A 148 7.590 18.787 18.328 1.00 40.31 C ATOM 1652 OD1 ASN A 148 7.336 18.078 17.357 1.00 71.33 O ATOM 1653 ND2 ASN A 148 8.589 19.646 18.320 1.00 44.40 N ATOM 1654 OXT ASN A 148 5.894 21.199 18.198 1.00 0.00 O ATOM 0 H ASN A 148 4.490 19.231 17.939 1.00 13.35 H new ATOM 0 HA ASN A 148 5.193 19.367 20.788 1.00 12.23 H new ATOM 0 HB2 ASN A 148 7.471 18.940 20.459 1.00 62.24 H new ATOM 0 HB3 ASN A 148 6.587 17.585 19.787 1.00 62.24 H new ATOM 0 HD21 ASN A 148 9.177 19.736 17.492 1.00 44.40 H new ATOM 0 HD22 ASN A 148 8.774 20.221 19.142 1.00 44.40 H new TER 1661 ASN A 148