USER MOD reduce.3.24.130724 H: found=0, std=0, add=813, rem=0, adj=23 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 92 LYS NZ :NH3+ 174:sc= 1.4 (180deg=0.0932) USER MOD Set 1.2: A 99 TYR OH : rot -136:sc= 0.0951! USER MOD Set 2.1: A 64 TYR OH : rot 180:sc= 0.546 USER MOD Set 2.2: A 68 ASN : amide:sc= 0.233 X(o=0.78,f=0.86) USER MOD Single : A 39 MET CE :methyl 151:sc= 0 (180deg=-0.156) USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 44 GLN : amide:sc= 0.371 K(o=0.37,f=-1.4) USER MOD Single : A 46 LYS NZ :NH3+ -164:sc= -0.0508 (180deg=-0.283) USER MOD Single : A 48 THR OG1 : rot 180:sc= 0 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 65 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.00437) USER MOD Single : A 71 TYR OH : rot 180:sc= 0 USER MOD Single : A 73 SER OG : rot 171:sc= -0.0453 USER MOD Single : A 74 THR OG1 : rot 83:sc= 0.514 USER MOD Single : A 75 GLN : amide:sc= -0.162 X(o=-0.16,f=-0.33) USER MOD Single : A 76 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 83 LYS NZ :NH3+ 144:sc= 1.25 (180deg=0.939) USER MOD Single : A 84 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 THR OG1 : rot 180:sc= 0.00622 USER MOD Single : A 88 ASN : amide:sc= -0.163 X(o=-0.16,f=-0.038) USER MOD Single : A 90 GLN :FLIP amide:sc= 0 F(o=-0.78,f=0) USER MOD Single : A 93 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 95 ASN : amide:sc= -0.625 K(o=-0.62,f=-8!) USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 LYS NZ :NH3+ 163:sc= -0.0242 (180deg=-0.26) USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 ASN : amide:sc= -5.83! C(o=-5.8!,f=-8.6!) USER MOD Single : A 112 TYR OH : rot 61:sc= 0.576 USER MOD Single : A 113 GLN : amide:sc= -3.92! C(o=-3.9!,f=-9.6!) USER MOD Single : A 114 TYR OH : rot -156:sc= 1.21 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= -0.0254 USER MOD Single : A 133 LYS NZ :NH3+ -152:sc= 1.25 (180deg=1.14) USER MOD Single : A 137 SER OG : rot -1:sc= 1.01 USER MOD Single : A 139 ASN :FLIP amide:sc= 0.637 F(o=-1.9,f=0.64) USER MOD Single : A 145 ASN : amide:sc= -3.41! C(o=-3.4!,f=-3.7!) USER MOD Single : A 148 ASN : amide:sc= -0.0385 X(o=-0.038,f=-0.12) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 39 2.857 5.969 -0.608 1.00 31.01 N ATOM 2 CA MET A 39 4.043 5.248 -1.063 1.00 54.52 C ATOM 3 C MET A 39 3.724 3.766 -1.028 1.00 43.30 C ATOM 4 O MET A 39 3.924 3.101 -0.029 1.00 73.13 O ATOM 5 CB MET A 39 5.264 5.586 -0.170 1.00 43.31 C ATOM 6 CG MET A 39 6.606 5.341 -0.828 1.00 43.31 C ATOM 7 SD MET A 39 7.962 6.016 0.154 1.00 41.44 S ATOM 8 CE MET A 39 9.372 5.624 -0.881 1.00 71.04 C ATOM 0 HA MET A 39 4.305 5.544 -2.079 1.00 54.52 H new ATOM 0 HB2 MET A 39 5.204 6.633 0.126 1.00 43.31 H new ATOM 0 HB3 MET A 39 5.207 4.993 0.743 1.00 43.31 H new ATOM 0 HG2 MET A 39 6.754 4.270 -0.966 1.00 43.31 H new ATOM 0 HG3 MET A 39 6.614 5.794 -1.819 1.00 43.31 H new ATOM 0 HE1 MET A 39 10.157 6.364 -0.722 1.00 71.04 H new ATOM 0 HE2 MET A 39 9.749 4.634 -0.623 1.00 71.04 H new ATOM 0 HE3 MET A 39 9.069 5.635 -1.928 1.00 71.04 H new ATOM 20 N SER A 40 3.176 3.266 -2.096 1.00 23.53 N ATOM 21 CA SER A 40 2.680 1.925 -2.128 1.00 11.43 C ATOM 22 C SER A 40 3.557 1.054 -3.023 1.00 15.34 C ATOM 23 O SER A 40 3.373 0.974 -4.246 1.00 32.43 O ATOM 24 CB SER A 40 1.234 1.945 -2.604 1.00 11.21 C ATOM 25 OG SER A 40 0.546 0.722 -2.334 1.00 22.42 O ATOM 0 H SER A 40 3.061 3.779 -2.970 1.00 23.53 H new ATOM 0 HA SER A 40 2.712 1.492 -1.128 1.00 11.43 H new ATOM 0 HB2 SER A 40 0.708 2.767 -2.119 1.00 11.21 H new ATOM 0 HB3 SER A 40 1.212 2.140 -3.676 1.00 11.21 H new ATOM 0 HG SER A 40 -0.377 0.788 -2.657 1.00 22.42 H new ATOM 31 N ARG A 41 4.549 0.486 -2.408 1.00 12.33 N ATOM 32 CA ARG A 41 5.521 -0.378 -3.030 1.00 70.20 C ATOM 33 C ARG A 41 6.080 -1.262 -1.916 1.00 11.22 C ATOM 34 O ARG A 41 5.880 -0.909 -0.754 1.00 61.11 O ATOM 35 CB ARG A 41 6.601 0.483 -3.733 1.00 62.31 C ATOM 36 CG ARG A 41 7.159 1.592 -2.873 1.00 11.22 C ATOM 37 CD ARG A 41 8.119 2.500 -3.637 1.00 31.24 C ATOM 38 NE ARG A 41 9.281 1.786 -4.184 1.00 65.42 N ATOM 39 CZ ARG A 41 10.376 2.369 -4.702 1.00 41.10 C ATOM 40 NH1 ARG A 41 10.499 3.703 -4.716 1.00 5.33 N ATOM 41 NH2 ARG A 41 11.337 1.615 -5.213 1.00 43.21 N ATOM 0 H ARG A 41 4.716 0.615 -1.410 1.00 12.33 H new ATOM 0 HA ARG A 41 5.094 -1.012 -3.807 1.00 70.20 H new ATOM 0 HB2 ARG A 41 7.419 -0.165 -4.048 1.00 62.31 H new ATOM 0 HB3 ARG A 41 6.173 0.918 -4.636 1.00 62.31 H new ATOM 0 HG2 ARG A 41 6.337 2.189 -2.478 1.00 11.22 H new ATOM 0 HG3 ARG A 41 7.678 1.158 -2.018 1.00 11.22 H new ATOM 0 HD2 ARG A 41 7.581 2.983 -4.453 1.00 31.24 H new ATOM 0 HD3 ARG A 41 8.467 3.291 -2.973 1.00 31.24 H new ATOM 0 HE ARG A 41 9.255 0.766 -4.170 1.00 65.42 H new ATOM 0 HH11 ARG A 41 9.757 4.288 -4.331 1.00 5.33 H new ATOM 0 HH12 ARG A 41 11.335 4.134 -5.112 1.00 5.33 H new ATOM 0 HH21 ARG A 41 11.243 0.599 -5.212 1.00 43.21 H new ATOM 0 HH22 ARG A 41 12.171 2.050 -5.608 1.00 43.21 H new ATOM 55 N PRO A 42 6.724 -2.421 -2.227 1.00 5.54 N ATOM 56 CA PRO A 42 7.260 -3.371 -1.219 1.00 64.50 C ATOM 57 C PRO A 42 7.908 -2.705 0.014 1.00 12.20 C ATOM 58 O PRO A 42 8.837 -1.892 -0.104 1.00 51.33 O ATOM 59 CB PRO A 42 8.298 -4.188 -2.009 1.00 74.34 C ATOM 60 CG PRO A 42 8.279 -3.638 -3.410 1.00 44.45 C ATOM 61 CD PRO A 42 6.968 -2.935 -3.575 1.00 73.21 C ATOM 0 HA PRO A 42 6.454 -3.965 -0.787 1.00 64.50 H new ATOM 0 HB2 PRO A 42 9.289 -4.093 -1.566 1.00 74.34 H new ATOM 0 HB3 PRO A 42 8.047 -5.249 -2.003 1.00 74.34 H new ATOM 0 HG2 PRO A 42 9.110 -2.950 -3.568 1.00 44.45 H new ATOM 0 HG3 PRO A 42 8.384 -4.439 -4.142 1.00 44.45 H new ATOM 0 HD2 PRO A 42 7.025 -2.134 -4.312 1.00 73.21 H new ATOM 0 HD3 PRO A 42 6.180 -3.614 -3.901 1.00 73.21 H new ATOM 69 N ASP A 43 7.341 -3.026 1.186 1.00 24.14 N ATOM 70 CA ASP A 43 7.750 -2.543 2.542 1.00 30.04 C ATOM 71 C ASP A 43 7.340 -1.099 2.785 1.00 42.24 C ATOM 72 O ASP A 43 6.917 -0.748 3.875 1.00 12.43 O ATOM 73 CB ASP A 43 9.233 -2.742 2.827 1.00 14.04 C ATOM 74 CG ASP A 43 9.601 -2.534 4.289 1.00 64.14 C ATOM 75 OD1 ASP A 43 8.861 -3.007 5.191 1.00 62.32 O ATOM 76 OD2 ASP A 43 10.688 -2.000 4.549 1.00 35.30 O ATOM 0 H ASP A 43 6.544 -3.660 1.232 1.00 24.14 H new ATOM 0 HA ASP A 43 7.206 -3.170 3.249 1.00 30.04 H new ATOM 0 HB2 ASP A 43 9.521 -3.750 2.527 1.00 14.04 H new ATOM 0 HB3 ASP A 43 9.809 -2.050 2.213 1.00 14.04 H new ATOM 81 N GLN A 44 7.396 -0.282 1.742 1.00 44.34 N ATOM 82 CA GLN A 44 6.965 1.111 1.817 1.00 72.02 C ATOM 83 C GLN A 44 5.464 1.167 1.991 1.00 21.12 C ATOM 84 O GLN A 44 4.914 2.130 2.524 1.00 32.53 O ATOM 85 CB GLN A 44 7.367 1.878 0.575 1.00 22.00 C ATOM 86 CG GLN A 44 8.864 1.901 0.326 1.00 1.34 C ATOM 87 CD GLN A 44 9.645 2.591 1.430 1.00 60.24 C ATOM 88 OE1 GLN A 44 9.156 3.503 2.081 1.00 63.34 O ATOM 89 NE2 GLN A 44 10.844 2.152 1.646 1.00 72.45 N ATOM 0 H GLN A 44 7.739 -0.562 0.823 1.00 44.34 H new ATOM 0 HA GLN A 44 7.454 1.576 2.673 1.00 72.02 H new ATOM 0 HB2 GLN A 44 6.871 1.436 -0.290 1.00 22.00 H new ATOM 0 HB3 GLN A 44 7.007 2.903 0.660 1.00 22.00 H new ATOM 0 HG2 GLN A 44 9.224 0.877 0.221 1.00 1.34 H new ATOM 0 HG3 GLN A 44 9.061 2.407 -0.619 1.00 1.34 H new ATOM 0 HE21 GLN A 44 11.217 1.389 1.081 1.00 72.45 H new ATOM 0 HE22 GLN A 44 11.415 2.569 2.381 1.00 72.45 H new ATOM 98 N ALA A 45 4.808 0.104 1.548 1.00 42.22 N ATOM 99 CA ALA A 45 3.389 -0.073 1.731 1.00 21.14 C ATOM 100 C ALA A 45 3.077 -0.139 3.221 1.00 54.11 C ATOM 101 O ALA A 45 2.030 0.284 3.667 1.00 34.43 O ATOM 102 CB ALA A 45 2.919 -1.336 1.030 1.00 61.31 C ATOM 0 H ALA A 45 5.257 -0.663 1.048 1.00 42.22 H new ATOM 0 HA ALA A 45 2.860 0.773 1.293 1.00 21.14 H new ATOM 0 HB1 ALA A 45 1.846 -1.456 1.177 1.00 61.31 H new ATOM 0 HB2 ALA A 45 3.133 -1.261 -0.036 1.00 61.31 H new ATOM 0 HB3 ALA A 45 3.441 -2.198 1.445 1.00 61.31 H new ATOM 108 N LYS A 46 4.028 -0.616 3.990 1.00 52.45 N ATOM 109 CA LYS A 46 3.870 -0.680 5.413 1.00 33.40 C ATOM 110 C LYS A 46 4.156 0.685 6.039 1.00 30.44 C ATOM 111 O LYS A 46 3.634 1.009 7.086 1.00 21.31 O ATOM 112 CB LYS A 46 4.752 -1.773 6.004 1.00 74.33 C ATOM 113 CG LYS A 46 4.342 -3.176 5.583 1.00 11.32 C ATOM 114 CD LYS A 46 5.227 -4.226 6.226 1.00 33.55 C ATOM 115 CE LYS A 46 4.766 -5.636 5.889 1.00 21.30 C ATOM 116 NZ LYS A 46 3.387 -5.913 6.372 1.00 71.21 N ATOM 0 H LYS A 46 4.922 -0.966 3.646 1.00 52.45 H new ATOM 0 HA LYS A 46 2.837 -0.940 5.644 1.00 33.40 H new ATOM 0 HB2 LYS A 46 5.785 -1.599 5.702 1.00 74.33 H new ATOM 0 HB3 LYS A 46 4.722 -1.705 7.091 1.00 74.33 H new ATOM 0 HG2 LYS A 46 3.303 -3.353 5.862 1.00 11.32 H new ATOM 0 HG3 LYS A 46 4.400 -3.264 4.498 1.00 11.32 H new ATOM 0 HD2 LYS A 46 6.255 -4.090 5.891 1.00 33.55 H new ATOM 0 HD3 LYS A 46 5.224 -4.091 7.308 1.00 33.55 H new ATOM 0 HE2 LYS A 46 4.805 -5.780 4.809 1.00 21.30 H new ATOM 0 HE3 LYS A 46 5.454 -6.356 6.332 1.00 21.30 H new ATOM 0 HZ1 LYS A 46 3.217 -6.939 6.367 1.00 71.21 H new ATOM 0 HZ2 LYS A 46 3.278 -5.548 7.340 1.00 71.21 H new ATOM 0 HZ3 LYS A 46 2.700 -5.445 5.747 1.00 71.21 H new ATOM 130 N VAL A 47 4.931 1.507 5.341 1.00 41.02 N ATOM 131 CA VAL A 47 5.230 2.856 5.805 1.00 21.20 C ATOM 132 C VAL A 47 3.991 3.718 5.592 1.00 30.44 C ATOM 133 O VAL A 47 3.569 4.466 6.471 1.00 21.43 O ATOM 134 CB VAL A 47 6.399 3.508 4.995 1.00 35.40 C ATOM 135 CG1 VAL A 47 6.782 4.869 5.566 1.00 11.01 C ATOM 136 CG2 VAL A 47 7.615 2.610 4.926 1.00 52.42 C ATOM 0 H VAL A 47 5.364 1.262 4.451 1.00 41.02 H new ATOM 0 HA VAL A 47 5.521 2.795 6.854 1.00 21.20 H new ATOM 0 HB VAL A 47 6.030 3.649 3.979 1.00 35.40 H new ATOM 0 HG11 VAL A 47 7.597 5.293 4.979 1.00 11.01 H new ATOM 0 HG12 VAL A 47 5.921 5.536 5.526 1.00 11.01 H new ATOM 0 HG13 VAL A 47 7.103 4.752 6.601 1.00 11.01 H new ATOM 0 HG21 VAL A 47 8.400 3.104 4.354 1.00 52.42 H new ATOM 0 HG22 VAL A 47 7.974 2.406 5.935 1.00 52.42 H new ATOM 0 HG23 VAL A 47 7.348 1.672 4.439 1.00 52.42 H new ATOM 146 N THR A 48 3.382 3.564 4.425 1.00 14.31 N ATOM 147 CA THR A 48 2.237 4.353 4.067 1.00 31.12 C ATOM 148 C THR A 48 1.016 4.003 4.936 1.00 40.34 C ATOM 149 O THR A 48 0.241 4.903 5.288 1.00 2.11 O ATOM 150 CB THR A 48 1.923 4.278 2.532 1.00 54.33 C ATOM 151 OG1 THR A 48 0.918 5.228 2.154 1.00 44.12 O ATOM 152 CG2 THR A 48 1.457 2.905 2.122 1.00 33.55 C ATOM 0 H THR A 48 3.672 2.893 3.714 1.00 14.31 H new ATOM 0 HA THR A 48 2.485 5.394 4.275 1.00 31.12 H new ATOM 0 HB THR A 48 2.858 4.510 2.021 1.00 54.33 H new ATOM 0 HG1 THR A 48 0.746 5.157 1.192 1.00 44.12 H new ATOM 0 HG21 THR A 48 1.250 2.895 1.052 1.00 33.55 H new ATOM 0 HG22 THR A 48 2.234 2.175 2.348 1.00 33.55 H new ATOM 0 HG23 THR A 48 0.549 2.650 2.669 1.00 33.55 H new ATOM 160 N VAL A 49 0.869 2.721 5.332 1.00 32.24 N ATOM 161 CA VAL A 49 -0.242 2.364 6.200 1.00 71.45 C ATOM 162 C VAL A 49 -0.026 2.966 7.575 1.00 32.34 C ATOM 163 O VAL A 49 -0.911 3.618 8.104 1.00 34.05 O ATOM 164 CB VAL A 49 -0.542 0.813 6.304 1.00 53.41 C ATOM 165 CG1 VAL A 49 -0.794 0.192 4.943 1.00 51.14 C ATOM 166 CG2 VAL A 49 0.525 0.035 7.080 1.00 74.13 C ATOM 0 H VAL A 49 1.486 1.952 5.070 1.00 32.24 H new ATOM 0 HA VAL A 49 -1.133 2.783 5.733 1.00 71.45 H new ATOM 0 HB VAL A 49 -1.460 0.733 6.886 1.00 53.41 H new ATOM 0 HG11 VAL A 49 -0.996 -0.873 5.061 1.00 51.14 H new ATOM 0 HG12 VAL A 49 -1.653 0.675 4.476 1.00 51.14 H new ATOM 0 HG13 VAL A 49 0.085 0.327 4.313 1.00 51.14 H new ATOM 0 HG21 VAL A 49 0.255 -1.020 7.112 1.00 74.13 H new ATOM 0 HG22 VAL A 49 1.490 0.148 6.585 1.00 74.13 H new ATOM 0 HG23 VAL A 49 0.591 0.423 8.096 1.00 74.13 H new ATOM 176 N ALA A 50 1.213 2.863 8.055 1.00 11.22 N ATOM 177 CA ALA A 50 1.613 3.309 9.372 1.00 20.22 C ATOM 178 C ALA A 50 1.361 4.789 9.541 1.00 51.33 C ATOM 179 O ALA A 50 0.852 5.243 10.565 1.00 41.25 O ATOM 180 CB ALA A 50 3.075 3.016 9.552 1.00 3.11 C ATOM 0 H ALA A 50 1.979 2.456 7.519 1.00 11.22 H new ATOM 0 HA ALA A 50 1.026 2.781 10.124 1.00 20.22 H new ATOM 0 HB1 ALA A 50 3.393 3.346 10.541 1.00 3.11 H new ATOM 0 HB2 ALA A 50 3.246 1.944 9.455 1.00 3.11 H new ATOM 0 HB3 ALA A 50 3.648 3.545 8.791 1.00 3.11 H new ATOM 186 N LYS A 51 1.674 5.545 8.502 1.00 42.31 N ATOM 187 CA LYS A 51 1.479 6.980 8.516 1.00 42.44 C ATOM 188 C LYS A 51 -0.013 7.357 8.569 1.00 74.31 C ATOM 189 O LYS A 51 -0.386 8.447 9.032 1.00 13.11 O ATOM 190 CB LYS A 51 2.216 7.633 7.350 1.00 42.12 C ATOM 191 CG LYS A 51 3.722 7.398 7.437 1.00 24.23 C ATOM 192 CD LYS A 51 4.496 7.979 6.263 1.00 51.00 C ATOM 193 CE LYS A 51 4.370 9.486 6.179 1.00 23.05 C ATOM 194 NZ LYS A 51 5.258 10.056 5.143 1.00 43.50 N ATOM 0 H LYS A 51 2.067 5.183 7.633 1.00 42.31 H new ATOM 0 HA LYS A 51 1.915 7.375 9.434 1.00 42.44 H new ATOM 0 HB2 LYS A 51 1.838 7.232 6.409 1.00 42.12 H new ATOM 0 HB3 LYS A 51 2.014 8.704 7.345 1.00 42.12 H new ATOM 0 HG2 LYS A 51 4.097 7.836 8.362 1.00 24.23 H new ATOM 0 HG3 LYS A 51 3.912 6.326 7.492 1.00 24.23 H new ATOM 0 HD2 LYS A 51 5.548 7.709 6.356 1.00 51.00 H new ATOM 0 HD3 LYS A 51 4.133 7.534 5.336 1.00 51.00 H new ATOM 0 HE2 LYS A 51 3.336 9.752 5.958 1.00 23.05 H new ATOM 0 HE3 LYS A 51 4.612 9.925 7.147 1.00 23.05 H new ATOM 0 HZ1 LYS A 51 5.142 11.089 5.117 1.00 43.50 H new ATOM 0 HZ2 LYS A 51 6.247 9.824 5.367 1.00 43.50 H new ATOM 0 HZ3 LYS A 51 5.010 9.656 4.215 1.00 43.50 H new ATOM 208 N GLY A 52 -0.852 6.436 8.152 1.00 1.44 N ATOM 209 CA GLY A 52 -2.270 6.640 8.224 1.00 33.13 C ATOM 210 C GLY A 52 -2.787 6.225 9.585 1.00 72.22 C ATOM 211 O GLY A 52 -3.733 6.819 10.118 1.00 45.24 O ATOM 0 H GLY A 52 -0.570 5.538 7.759 1.00 1.44 H new ATOM 0 HA2 GLY A 52 -2.504 7.689 8.042 1.00 33.13 H new ATOM 0 HA3 GLY A 52 -2.768 6.062 7.445 1.00 33.13 H new ATOM 215 N ASP A 53 -2.143 5.235 10.170 1.00 12.35 N ATOM 216 CA ASP A 53 -2.514 4.724 11.487 1.00 24.25 C ATOM 217 C ASP A 53 -2.181 5.713 12.545 1.00 2.11 C ATOM 218 O ASP A 53 -2.957 5.946 13.469 1.00 50.34 O ATOM 219 CB ASP A 53 -1.873 3.387 11.778 1.00 72.31 C ATOM 220 CG ASP A 53 -2.470 2.286 10.954 1.00 31.23 C ATOM 221 OD1 ASP A 53 -3.623 1.879 11.214 1.00 60.04 O ATOM 222 OD2 ASP A 53 -1.829 1.815 10.007 1.00 31.13 O ATOM 0 H ASP A 53 -1.346 4.757 9.750 1.00 12.35 H new ATOM 0 HA ASP A 53 -3.593 4.568 11.484 1.00 24.25 H new ATOM 0 HB2 ASP A 53 -0.803 3.448 11.581 1.00 72.31 H new ATOM 0 HB3 ASP A 53 -1.989 3.152 12.836 1.00 72.31 H new ATOM 227 N ILE A 54 -1.054 6.356 12.392 1.00 54.31 N ATOM 228 CA ILE A 54 -0.669 7.399 13.306 1.00 12.24 C ATOM 229 C ILE A 54 -1.555 8.628 13.125 1.00 12.34 C ATOM 230 O ILE A 54 -1.765 9.383 14.053 1.00 14.34 O ATOM 231 CB ILE A 54 0.817 7.769 13.208 1.00 41.13 C ATOM 232 CG1 ILE A 54 1.164 8.195 11.783 1.00 21.35 C ATOM 233 CG2 ILE A 54 1.680 6.615 13.695 1.00 35.44 C ATOM 234 CD1 ILE A 54 2.617 8.490 11.536 1.00 32.23 C ATOM 0 H ILE A 54 -0.386 6.176 11.643 1.00 54.31 H new ATOM 0 HA ILE A 54 -0.817 7.003 14.311 1.00 12.24 H new ATOM 0 HB ILE A 54 1.022 8.621 13.857 1.00 41.13 H new ATOM 0 HG12 ILE A 54 0.849 7.407 11.099 1.00 21.35 H new ATOM 0 HG13 ILE A 54 0.583 9.083 11.535 1.00 21.35 H new ATOM 0 HG21 ILE A 54 2.732 6.891 13.620 1.00 35.44 H new ATOM 0 HG22 ILE A 54 1.436 6.392 14.734 1.00 35.44 H new ATOM 0 HG23 ILE A 54 1.491 5.735 13.081 1.00 35.44 H new ATOM 0 HD11 ILE A 54 2.757 8.783 10.496 1.00 32.23 H new ATOM 0 HD12 ILE A 54 2.939 9.302 12.188 1.00 32.23 H new ATOM 0 HD13 ILE A 54 3.210 7.599 11.745 1.00 32.23 H new ATOM 246 N LYS A 55 -2.120 8.799 11.940 1.00 40.44 N ATOM 247 CA LYS A 55 -3.048 9.901 11.719 1.00 22.31 C ATOM 248 C LYS A 55 -4.332 9.638 12.532 1.00 25.13 C ATOM 249 O LYS A 55 -4.988 10.571 13.032 1.00 61.13 O ATOM 250 CB LYS A 55 -3.384 10.037 10.240 1.00 40.14 C ATOM 251 CG LYS A 55 -3.376 11.467 9.732 1.00 63.30 C ATOM 252 CD LYS A 55 -1.977 12.041 9.822 1.00 10.21 C ATOM 253 CE LYS A 55 -1.859 13.384 9.130 1.00 54.54 C ATOM 254 NZ LYS A 55 -0.466 13.878 9.153 1.00 52.02 N ATOM 0 H LYS A 55 -1.958 8.202 11.129 1.00 40.44 H new ATOM 0 HA LYS A 55 -2.585 10.832 12.044 1.00 22.31 H new ATOM 0 HB2 LYS A 55 -2.669 9.453 9.661 1.00 40.14 H new ATOM 0 HB3 LYS A 55 -4.368 9.605 10.061 1.00 40.14 H new ATOM 0 HG2 LYS A 55 -3.724 11.497 8.700 1.00 63.30 H new ATOM 0 HG3 LYS A 55 -4.065 12.074 10.319 1.00 63.30 H new ATOM 0 HD2 LYS A 55 -1.698 12.149 10.870 1.00 10.21 H new ATOM 0 HD3 LYS A 55 -1.271 11.342 9.375 1.00 10.21 H new ATOM 0 HE2 LYS A 55 -2.199 13.295 8.098 1.00 54.54 H new ATOM 0 HE3 LYS A 55 -2.512 14.107 9.620 1.00 54.54 H new ATOM 0 HZ1 LYS A 55 -0.416 14.799 8.672 1.00 52.02 H new ATOM 0 HZ2 LYS A 55 -0.152 13.985 10.139 1.00 52.02 H new ATOM 0 HZ3 LYS A 55 0.151 13.199 8.664 1.00 52.02 H new ATOM 268 N ALA A 56 -4.657 8.354 12.683 1.00 10.25 N ATOM 269 CA ALA A 56 -5.799 7.915 13.484 1.00 34.32 C ATOM 270 C ALA A 56 -5.504 8.124 14.955 1.00 11.21 C ATOM 271 O ALA A 56 -6.411 8.356 15.761 1.00 63.24 O ATOM 272 CB ALA A 56 -6.090 6.456 13.236 1.00 32.52 C ATOM 0 H ALA A 56 -4.136 7.589 12.254 1.00 10.25 H new ATOM 0 HA ALA A 56 -6.670 8.504 13.196 1.00 34.32 H new ATOM 0 HB1 ALA A 56 -6.943 6.147 13.841 1.00 32.52 H new ATOM 0 HB2 ALA A 56 -6.319 6.305 12.181 1.00 32.52 H new ATOM 0 HB3 ALA A 56 -5.218 5.860 13.507 1.00 32.52 H new ATOM 278 N ILE A 57 -4.221 8.047 15.287 1.00 3.21 N ATOM 279 CA ILE A 57 -3.734 8.304 16.629 1.00 33.32 C ATOM 280 C ILE A 57 -4.099 9.725 17.016 1.00 11.14 C ATOM 281 O ILE A 57 -4.663 9.942 18.054 1.00 43.01 O ATOM 282 CB ILE A 57 -2.183 8.167 16.710 1.00 32.11 C ATOM 283 CG1 ILE A 57 -1.697 6.712 16.530 1.00 0.34 C ATOM 284 CG2 ILE A 57 -1.645 8.764 17.991 1.00 0.31 C ATOM 285 CD1 ILE A 57 -1.962 5.799 17.701 1.00 61.12 C ATOM 0 H ILE A 57 -3.486 7.802 14.624 1.00 3.21 H new ATOM 0 HA ILE A 57 -4.188 7.575 17.300 1.00 33.32 H new ATOM 0 HB ILE A 57 -1.782 8.735 15.871 1.00 32.11 H new ATOM 0 HG12 ILE A 57 -2.177 6.292 15.646 1.00 0.34 H new ATOM 0 HG13 ILE A 57 -0.625 6.725 16.335 1.00 0.34 H new ATOM 0 HG21 ILE A 57 -0.561 8.653 18.017 1.00 0.31 H new ATOM 0 HG22 ILE A 57 -1.902 9.822 18.035 1.00 0.31 H new ATOM 0 HG23 ILE A 57 -2.083 8.248 18.845 1.00 0.31 H new ATOM 0 HD11 ILE A 57 -1.584 4.801 17.477 1.00 61.12 H new ATOM 0 HD12 ILE A 57 -1.459 6.187 18.586 1.00 61.12 H new ATOM 0 HD13 ILE A 57 -3.035 5.748 17.887 1.00 61.12 H new ATOM 297 N ALA A 58 -3.818 10.683 16.128 1.00 22.14 N ATOM 298 CA ALA A 58 -4.109 12.096 16.395 1.00 51.34 C ATOM 299 C ALA A 58 -5.578 12.311 16.673 1.00 53.32 C ATOM 300 O ALA A 58 -5.946 13.130 17.504 1.00 4.42 O ATOM 301 CB ALA A 58 -3.676 12.971 15.239 1.00 54.34 C ATOM 0 H ALA A 58 -3.390 10.507 15.219 1.00 22.14 H new ATOM 0 HA ALA A 58 -3.541 12.378 17.282 1.00 51.34 H new ATOM 0 HB1 ALA A 58 -3.904 14.012 15.466 1.00 54.34 H new ATOM 0 HB2 ALA A 58 -2.603 12.861 15.081 1.00 54.34 H new ATOM 0 HB3 ALA A 58 -4.208 12.671 14.336 1.00 54.34 H new ATOM 307 N ALA A 59 -6.403 11.533 16.012 1.00 43.40 N ATOM 308 CA ALA A 59 -7.834 11.641 16.166 1.00 33.21 C ATOM 309 C ALA A 59 -8.282 11.115 17.537 1.00 71.21 C ATOM 310 O ALA A 59 -9.099 11.739 18.222 1.00 75.25 O ATOM 311 CB ALA A 59 -8.533 10.886 15.048 1.00 62.52 C ATOM 0 H ALA A 59 -6.103 10.812 15.356 1.00 43.40 H new ATOM 0 HA ALA A 59 -8.110 12.694 16.108 1.00 33.21 H new ATOM 0 HB1 ALA A 59 -9.613 10.972 15.171 1.00 62.52 H new ATOM 0 HB2 ALA A 59 -8.242 11.309 14.086 1.00 62.52 H new ATOM 0 HB3 ALA A 59 -8.246 9.835 15.084 1.00 62.52 H new ATOM 317 N ALA A 60 -7.718 10.003 17.951 1.00 12.14 N ATOM 318 CA ALA A 60 -8.126 9.368 19.188 1.00 3.35 C ATOM 319 C ALA A 60 -7.398 9.942 20.409 1.00 34.52 C ATOM 320 O ALA A 60 -7.948 9.973 21.499 1.00 12.20 O ATOM 321 CB ALA A 60 -7.946 7.881 19.089 1.00 62.10 C ATOM 0 H ALA A 60 -6.974 9.517 17.450 1.00 12.14 H new ATOM 0 HA ALA A 60 -9.184 9.583 19.337 1.00 3.35 H new ATOM 0 HB1 ALA A 60 -8.256 7.414 20.024 1.00 62.10 H new ATOM 0 HB2 ALA A 60 -8.554 7.494 18.271 1.00 62.10 H new ATOM 0 HB3 ALA A 60 -6.897 7.653 18.900 1.00 62.10 H new ATOM 327 N LEU A 61 -6.196 10.435 20.218 1.00 13.02 N ATOM 328 CA LEU A 61 -5.427 11.062 21.286 1.00 73.12 C ATOM 329 C LEU A 61 -6.137 12.367 21.647 1.00 40.32 C ATOM 330 O LEU A 61 -6.159 12.795 22.800 1.00 51.31 O ATOM 331 CB LEU A 61 -3.980 11.286 20.776 1.00 4.33 C ATOM 332 CG LEU A 61 -2.836 11.383 21.809 1.00 24.24 C ATOM 333 CD1 LEU A 61 -2.890 12.652 22.597 1.00 34.23 C ATOM 334 CD2 LEU A 61 -2.858 10.204 22.755 1.00 74.42 C ATOM 0 H LEU A 61 -5.716 10.416 19.318 1.00 13.02 H new ATOM 0 HA LEU A 61 -5.363 10.445 22.182 1.00 73.12 H new ATOM 0 HB2 LEU A 61 -3.740 10.471 20.093 1.00 4.33 H new ATOM 0 HB3 LEU A 61 -3.975 12.205 20.190 1.00 4.33 H new ATOM 0 HG LEU A 61 -1.906 11.376 21.240 1.00 24.24 H new ATOM 0 HD11 LEU A 61 -2.065 12.673 23.310 1.00 34.23 H new ATOM 0 HD12 LEU A 61 -2.808 13.504 21.922 1.00 34.23 H new ATOM 0 HD13 LEU A 61 -3.836 12.706 23.135 1.00 34.23 H new ATOM 0 HD21 LEU A 61 -2.042 10.297 23.472 1.00 74.42 H new ATOM 0 HD22 LEU A 61 -3.809 10.183 23.288 1.00 74.42 H new ATOM 0 HD23 LEU A 61 -2.739 9.281 22.188 1.00 74.42 H new ATOM 346 N ASP A 62 -6.789 12.944 20.649 1.00 42.54 N ATOM 347 CA ASP A 62 -7.644 14.115 20.825 1.00 73.33 C ATOM 348 C ASP A 62 -8.914 13.716 21.604 1.00 13.33 C ATOM 349 O ASP A 62 -9.501 14.500 22.352 1.00 31.21 O ATOM 350 CB ASP A 62 -8.000 14.702 19.456 1.00 72.34 C ATOM 351 CG ASP A 62 -8.973 15.849 19.524 1.00 73.04 C ATOM 352 OD1 ASP A 62 -8.643 16.883 20.117 1.00 22.45 O ATOM 353 OD2 ASP A 62 -10.091 15.721 18.979 1.00 53.51 O ATOM 0 H ASP A 62 -6.741 12.612 19.686 1.00 42.54 H new ATOM 0 HA ASP A 62 -7.115 14.877 21.398 1.00 73.33 H new ATOM 0 HB2 ASP A 62 -7.087 15.040 18.967 1.00 72.34 H new ATOM 0 HB3 ASP A 62 -8.423 13.915 18.832 1.00 72.34 H new ATOM 358 N MET A 63 -9.292 12.468 21.474 1.00 23.41 N ATOM 359 CA MET A 63 -10.438 11.942 22.193 1.00 72.42 C ATOM 360 C MET A 63 -10.064 11.645 23.642 1.00 12.41 C ATOM 361 O MET A 63 -10.899 11.730 24.515 1.00 43.53 O ATOM 362 CB MET A 63 -11.026 10.712 21.504 1.00 43.34 C ATOM 363 CG MET A 63 -11.597 11.003 20.131 1.00 35.12 C ATOM 364 SD MET A 63 -12.113 9.518 19.258 1.00 3.21 S ATOM 365 CE MET A 63 -12.772 10.237 17.757 1.00 22.01 C ATOM 0 H MET A 63 -8.823 11.790 20.874 1.00 23.41 H new ATOM 0 HA MET A 63 -11.216 12.705 22.189 1.00 72.42 H new ATOM 0 HB2 MET A 63 -10.251 9.951 21.412 1.00 43.34 H new ATOM 0 HB3 MET A 63 -11.811 10.293 22.134 1.00 43.34 H new ATOM 0 HG2 MET A 63 -12.450 11.673 20.233 1.00 35.12 H new ATOM 0 HG3 MET A 63 -10.849 11.527 19.536 1.00 35.12 H new ATOM 0 HE1 MET A 63 -13.136 9.444 17.103 1.00 22.01 H new ATOM 0 HE2 MET A 63 -13.594 10.909 18.006 1.00 22.01 H new ATOM 0 HE3 MET A 63 -11.988 10.796 17.247 1.00 22.01 H new ATOM 375 N TYR A 64 -8.796 11.292 23.891 1.00 63.44 N ATOM 376 CA TYR A 64 -8.303 11.167 25.266 1.00 5.11 C ATOM 377 C TYR A 64 -8.193 12.571 25.858 1.00 34.33 C ATOM 378 O TYR A 64 -8.456 12.790 27.034 1.00 70.44 O ATOM 379 CB TYR A 64 -6.934 10.498 25.328 1.00 33.11 C ATOM 380 CG TYR A 64 -6.439 10.388 26.756 1.00 34.14 C ATOM 381 CD1 TYR A 64 -6.849 9.354 27.581 1.00 64.02 C ATOM 382 CD2 TYR A 64 -5.585 11.339 27.293 1.00 53.35 C ATOM 383 CE1 TYR A 64 -6.432 9.271 28.850 1.00 72.21 C ATOM 384 CE2 TYR A 64 -5.168 11.255 28.585 1.00 50.20 C ATOM 385 CZ TYR A 64 -5.591 10.218 29.357 1.00 32.42 C ATOM 386 OH TYR A 64 -5.196 10.127 30.646 1.00 55.33 O ATOM 0 H TYR A 64 -8.103 11.091 23.170 1.00 63.44 H new ATOM 0 HA TYR A 64 -9.000 10.545 25.827 1.00 5.11 H new ATOM 0 HB2 TYR A 64 -6.992 9.504 24.883 1.00 33.11 H new ATOM 0 HB3 TYR A 64 -6.220 11.071 24.736 1.00 33.11 H new ATOM 0 HD1 TYR A 64 -7.518 8.600 27.193 1.00 64.02 H new ATOM 0 HD2 TYR A 64 -5.246 12.158 26.677 1.00 53.35 H new ATOM 0 HE1 TYR A 64 -6.762 8.453 29.474 1.00 72.21 H new ATOM 0 HE2 TYR A 64 -4.507 12.005 28.994 1.00 50.20 H new ATOM 0 HH TYR A 64 -4.598 10.874 30.858 1.00 55.33 H new ATOM 396 N LYS A 65 -7.804 13.517 25.009 1.00 61.32 N ATOM 397 CA LYS A 65 -7.769 14.934 25.359 1.00 72.30 C ATOM 398 C LYS A 65 -9.152 15.384 25.865 1.00 73.44 C ATOM 399 O LYS A 65 -9.269 16.255 26.715 1.00 23.13 O ATOM 400 CB LYS A 65 -7.329 15.749 24.134 1.00 64.13 C ATOM 401 CG LYS A 65 -7.573 17.238 24.226 1.00 5.13 C ATOM 402 CD LYS A 65 -7.066 17.960 22.992 1.00 55.13 C ATOM 403 CE LYS A 65 -7.546 19.404 22.944 1.00 10.13 C ATOM 404 NZ LYS A 65 -7.119 20.200 24.112 1.00 43.52 N ATOM 0 H LYS A 65 -7.503 13.322 24.054 1.00 61.32 H new ATOM 0 HA LYS A 65 -7.050 15.101 26.161 1.00 72.30 H new ATOM 0 HB2 LYS A 65 -6.264 15.582 23.970 1.00 64.13 H new ATOM 0 HB3 LYS A 65 -7.851 15.366 23.257 1.00 64.13 H new ATOM 0 HG2 LYS A 65 -8.640 17.426 24.347 1.00 5.13 H new ATOM 0 HG3 LYS A 65 -7.077 17.635 25.111 1.00 5.13 H new ATOM 0 HD2 LYS A 65 -5.976 17.939 22.981 1.00 55.13 H new ATOM 0 HD3 LYS A 65 -7.404 17.435 22.099 1.00 55.13 H new ATOM 0 HE2 LYS A 65 -7.170 19.875 22.035 1.00 10.13 H new ATOM 0 HE3 LYS A 65 -8.634 19.416 22.883 1.00 10.13 H new ATOM 0 HZ1 LYS A 65 -7.448 21.180 24.003 1.00 43.52 H new ATOM 0 HZ2 LYS A 65 -7.526 19.792 24.978 1.00 43.52 H new ATOM 0 HZ3 LYS A 65 -6.081 20.189 24.179 1.00 43.52 H new ATOM 418 N LEU A 66 -10.175 14.759 25.331 1.00 73.24 N ATOM 419 CA LEU A 66 -11.549 14.976 25.743 1.00 55.30 C ATOM 420 C LEU A 66 -11.902 14.095 26.967 1.00 11.14 C ATOM 421 O LEU A 66 -12.680 14.496 27.829 1.00 42.14 O ATOM 422 CB LEU A 66 -12.481 14.654 24.552 1.00 22.52 C ATOM 423 CG LEU A 66 -13.994 14.654 24.812 1.00 62.15 C ATOM 424 CD1 LEU A 66 -14.470 16.017 25.302 1.00 14.21 C ATOM 425 CD2 LEU A 66 -14.743 14.252 23.548 1.00 1.32 C ATOM 0 H LEU A 66 -10.078 14.072 24.584 1.00 73.24 H new ATOM 0 HA LEU A 66 -11.680 16.017 26.039 1.00 55.30 H new ATOM 0 HB2 LEU A 66 -12.276 15.375 23.761 1.00 22.52 H new ATOM 0 HB3 LEU A 66 -12.207 13.672 24.167 1.00 22.52 H new ATOM 0 HG LEU A 66 -14.204 13.926 25.595 1.00 62.15 H new ATOM 0 HD11 LEU A 66 -15.545 15.985 25.477 1.00 14.21 H new ATOM 0 HD12 LEU A 66 -13.958 16.269 26.231 1.00 14.21 H new ATOM 0 HD13 LEU A 66 -14.247 16.773 24.549 1.00 14.21 H new ATOM 0 HD21 LEU A 66 -15.815 14.255 23.744 1.00 1.32 H new ATOM 0 HD22 LEU A 66 -14.518 14.960 22.751 1.00 1.32 H new ATOM 0 HD23 LEU A 66 -14.433 13.252 23.244 1.00 1.32 H new ATOM 437 N ASP A 67 -11.280 12.933 27.055 1.00 74.23 N ATOM 438 CA ASP A 67 -11.607 11.931 28.093 1.00 61.33 C ATOM 439 C ASP A 67 -11.022 12.326 29.453 1.00 61.42 C ATOM 440 O ASP A 67 -11.620 12.072 30.495 1.00 13.13 O ATOM 441 CB ASP A 67 -10.927 10.615 27.634 1.00 30.34 C ATOM 442 CG ASP A 67 -11.133 9.391 28.505 1.00 43.15 C ATOM 443 OD1 ASP A 67 -10.562 9.316 29.609 1.00 24.12 O ATOM 444 OD2 ASP A 67 -11.802 8.441 28.037 1.00 13.54 O ATOM 0 H ASP A 67 -10.536 12.644 26.420 1.00 74.23 H new ATOM 0 HA ASP A 67 -12.687 11.841 28.207 1.00 61.33 H new ATOM 0 HB2 ASP A 67 -11.285 10.381 26.631 1.00 30.34 H new ATOM 0 HB3 ASP A 67 -9.855 10.798 27.555 1.00 30.34 H new ATOM 449 N ASN A 68 -9.946 13.075 29.432 1.00 43.25 N ATOM 450 CA ASN A 68 -9.338 13.541 30.672 1.00 22.54 C ATOM 451 C ASN A 68 -9.102 14.979 30.588 1.00 44.22 C ATOM 452 O ASN A 68 -8.224 15.487 31.279 1.00 34.53 O ATOM 453 CB ASN A 68 -8.018 12.903 30.913 1.00 54.53 C ATOM 454 CG ASN A 68 -7.774 12.505 32.371 1.00 62.25 C ATOM 455 OD1 ASN A 68 -8.299 13.111 33.314 1.00 42.32 O ATOM 456 ND2 ASN A 68 -6.963 11.502 32.563 1.00 22.12 N ATOM 0 H ASN A 68 -9.471 13.377 28.582 1.00 43.25 H new ATOM 0 HA ASN A 68 -10.023 13.285 31.480 1.00 22.54 H new ATOM 0 HB2 ASN A 68 -7.936 12.015 30.286 1.00 54.53 H new ATOM 0 HB3 ASN A 68 -7.232 13.589 30.598 1.00 54.53 H new ATOM 0 HD21 ASN A 68 -6.745 11.196 33.512 1.00 22.12 H new ATOM 0 HD22 ASN A 68 -6.546 11.023 31.765 1.00 22.12 H new ATOM 463 N PHE A 69 -9.874 15.657 29.731 1.00 0.05 N ATOM 464 CA PHE A 69 -9.837 17.134 29.553 1.00 40.21 C ATOM 465 C PHE A 69 -8.412 17.720 29.506 1.00 53.24 C ATOM 466 O PHE A 69 -8.199 18.897 29.861 1.00 1.42 O ATOM 467 CB PHE A 69 -10.688 17.808 30.654 1.00 44.13 C ATOM 468 CG PHE A 69 -10.442 17.283 32.049 1.00 1.22 C ATOM 469 CD1 PHE A 69 -9.403 17.723 32.789 1.00 23.05 C ATOM 470 CD2 PHE A 69 -11.267 16.349 32.578 1.00 4.11 C ATOM 471 CE1 PHE A 69 -9.175 17.251 34.052 1.00 64.33 C ATOM 472 CE2 PHE A 69 -11.083 15.859 33.836 1.00 42.53 C ATOM 473 CZ PHE A 69 -10.031 16.312 34.591 1.00 54.21 C ATOM 0 H PHE A 69 -10.556 15.198 29.127 1.00 0.05 H new ATOM 0 HA PHE A 69 -10.264 17.350 28.574 1.00 40.21 H new ATOM 0 HB2 PHE A 69 -10.490 18.880 30.643 1.00 44.13 H new ATOM 0 HB3 PHE A 69 -11.742 17.677 30.411 1.00 44.13 H new ATOM 0 HD1 PHE A 69 -8.736 18.465 32.374 1.00 23.05 H new ATOM 0 HD2 PHE A 69 -12.093 15.982 31.987 1.00 4.11 H new ATOM 0 HE1 PHE A 69 -8.332 17.610 34.623 1.00 64.33 H new ATOM 0 HE2 PHE A 69 -11.761 15.119 34.236 1.00 42.53 H new ATOM 0 HZ PHE A 69 -9.875 15.939 35.593 1.00 54.21 H new ATOM 483 N ALA A 70 -7.480 16.952 28.947 1.00 72.30 N ATOM 484 CA ALA A 70 -6.084 17.299 28.939 1.00 21.24 C ATOM 485 C ALA A 70 -5.310 16.216 28.232 1.00 42.11 C ATOM 486 O ALA A 70 -5.819 15.100 28.054 1.00 54.42 O ATOM 487 CB ALA A 70 -5.591 17.387 30.380 1.00 20.23 C ATOM 0 H ALA A 70 -7.687 16.066 28.486 1.00 72.30 H new ATOM 0 HA ALA A 70 -5.943 18.253 28.430 1.00 21.24 H new ATOM 0 HB1 ALA A 70 -4.533 17.650 30.387 1.00 20.23 H new ATOM 0 HB2 ALA A 70 -6.158 18.150 30.913 1.00 20.23 H new ATOM 0 HB3 ALA A 70 -5.729 16.424 30.871 1.00 20.23 H new ATOM 493 N TYR A 71 -4.125 16.548 27.786 1.00 32.21 N ATOM 494 CA TYR A 71 -3.228 15.566 27.261 1.00 50.54 C ATOM 495 C TYR A 71 -2.508 14.856 28.395 1.00 54.41 C ATOM 496 O TYR A 71 -2.297 15.442 29.470 1.00 31.12 O ATOM 497 CB TYR A 71 -2.224 16.170 26.283 1.00 3.30 C ATOM 498 CG TYR A 71 -2.808 16.496 24.945 1.00 32.31 C ATOM 499 CD1 TYR A 71 -3.492 15.529 24.226 1.00 21.45 C ATOM 500 CD2 TYR A 71 -2.646 17.740 24.379 1.00 60.25 C ATOM 501 CE1 TYR A 71 -3.994 15.790 22.985 1.00 62.43 C ATOM 502 CE2 TYR A 71 -3.154 18.020 23.133 1.00 12.21 C ATOM 503 CZ TYR A 71 -3.826 17.036 22.432 1.00 53.44 C ATOM 504 OH TYR A 71 -4.316 17.299 21.166 1.00 15.41 O ATOM 0 H TYR A 71 -3.762 17.501 27.779 1.00 32.21 H new ATOM 0 HA TYR A 71 -3.822 14.841 26.704 1.00 50.54 H new ATOM 0 HB2 TYR A 71 -1.807 17.078 26.719 1.00 3.30 H new ATOM 0 HB3 TYR A 71 -1.397 15.473 26.148 1.00 3.30 H new ATOM 0 HD1 TYR A 71 -3.630 14.549 24.657 1.00 21.45 H new ATOM 0 HD2 TYR A 71 -2.112 18.507 24.921 1.00 60.25 H new ATOM 0 HE1 TYR A 71 -4.521 15.021 22.440 1.00 62.43 H new ATOM 0 HE2 TYR A 71 -3.029 19.003 22.704 1.00 12.21 H new ATOM 0 HH TYR A 71 -4.115 18.227 20.923 1.00 15.41 H new ATOM 514 N PRO A 72 -2.130 13.594 28.171 1.00 34.13 N ATOM 515 CA PRO A 72 -1.453 12.757 29.173 1.00 35.51 C ATOM 516 C PRO A 72 -0.051 13.280 29.558 1.00 60.42 C ATOM 517 O PRO A 72 0.468 14.198 28.935 1.00 41.23 O ATOM 518 CB PRO A 72 -1.312 11.408 28.431 1.00 73.24 C ATOM 519 CG PRO A 72 -1.379 11.739 26.994 1.00 74.10 C ATOM 520 CD PRO A 72 -2.332 12.863 26.899 1.00 25.15 C ATOM 0 HA PRO A 72 -2.007 12.721 30.111 1.00 35.51 H new ATOM 0 HB2 PRO A 72 -0.369 10.921 28.678 1.00 73.24 H new ATOM 0 HB3 PRO A 72 -2.109 10.720 28.713 1.00 73.24 H new ATOM 0 HG2 PRO A 72 -0.399 12.020 26.609 1.00 74.10 H new ATOM 0 HG3 PRO A 72 -1.718 10.884 26.409 1.00 74.10 H new ATOM 0 HD2 PRO A 72 -2.123 13.494 26.035 1.00 25.15 H new ATOM 0 HD3 PRO A 72 -3.359 12.512 26.796 1.00 25.15 H new ATOM 528 N SER A 73 0.539 12.704 30.594 1.00 62.32 N ATOM 529 CA SER A 73 1.911 12.983 30.943 1.00 74.45 C ATOM 530 C SER A 73 2.678 11.748 30.630 1.00 5.51 C ATOM 531 O SER A 73 2.100 10.668 30.580 1.00 22.22 O ATOM 532 CB SER A 73 2.014 13.365 32.420 1.00 52.13 C ATOM 533 OG SER A 73 1.506 12.332 33.249 1.00 60.50 O ATOM 0 H SER A 73 0.078 12.034 31.210 1.00 62.32 H new ATOM 0 HA SER A 73 2.312 13.827 30.383 1.00 74.45 H new ATOM 0 HB2 SER A 73 3.055 13.563 32.676 1.00 52.13 H new ATOM 0 HB3 SER A 73 1.460 14.286 32.600 1.00 52.13 H new ATOM 0 HG SER A 73 1.713 12.533 34.186 1.00 60.50 H new ATOM 539 N THR A 74 3.929 11.882 30.363 1.00 61.42 N ATOM 540 CA THR A 74 4.749 10.764 30.010 1.00 25.30 C ATOM 541 C THR A 74 4.781 9.685 31.138 1.00 25.10 C ATOM 542 O THR A 74 5.053 8.508 30.894 1.00 25.03 O ATOM 543 CB THR A 74 6.138 11.274 29.570 1.00 3.24 C ATOM 544 OG1 THR A 74 6.281 11.225 28.123 1.00 42.21 O ATOM 545 CG2 THR A 74 7.257 10.575 30.285 1.00 72.21 C ATOM 0 H THR A 74 4.422 12.775 30.382 1.00 61.42 H new ATOM 0 HA THR A 74 4.317 10.240 29.158 1.00 25.30 H new ATOM 0 HB THR A 74 6.208 12.321 29.864 1.00 3.24 H new ATOM 0 HG1 THR A 74 5.869 12.021 27.726 1.00 42.21 H new ATOM 0 HG21 THR A 74 8.212 10.970 29.940 1.00 72.21 H new ATOM 0 HG22 THR A 74 7.163 10.740 31.358 1.00 72.21 H new ATOM 0 HG23 THR A 74 7.210 9.506 30.077 1.00 72.21 H new ATOM 553 N GLN A 75 4.459 10.088 32.339 1.00 73.14 N ATOM 554 CA GLN A 75 4.358 9.162 33.418 1.00 41.42 C ATOM 555 C GLN A 75 2.902 8.756 33.669 1.00 23.30 C ATOM 556 O GLN A 75 2.498 7.632 33.348 1.00 72.25 O ATOM 557 CB GLN A 75 4.954 9.774 34.668 1.00 45.42 C ATOM 558 CG GLN A 75 6.465 9.812 34.694 1.00 62.31 C ATOM 559 CD GLN A 75 7.060 8.429 34.717 1.00 4.35 C ATOM 560 OE1 GLN A 75 7.383 7.844 33.683 1.00 65.04 O ATOM 561 NE2 GLN A 75 7.128 7.868 35.882 1.00 64.24 N ATOM 0 H GLN A 75 4.263 11.058 32.588 1.00 73.14 H new ATOM 0 HA GLN A 75 4.912 8.262 33.153 1.00 41.42 H new ATOM 0 HB2 GLN A 75 4.577 10.791 34.774 1.00 45.42 H new ATOM 0 HB3 GLN A 75 4.603 9.212 35.534 1.00 45.42 H new ATOM 0 HG2 GLN A 75 6.830 10.350 33.819 1.00 62.31 H new ATOM 0 HG3 GLN A 75 6.799 10.366 35.571 1.00 62.31 H new ATOM 0 HE21 GLN A 75 6.851 8.387 36.715 1.00 64.24 H new ATOM 0 HE22 GLN A 75 7.459 6.907 35.967 1.00 64.24 H new ATOM 570 N GLN A 76 2.086 9.708 34.100 1.00 42.42 N ATOM 571 CA GLN A 76 0.718 9.402 34.513 1.00 21.32 C ATOM 572 C GLN A 76 -0.161 9.170 33.338 1.00 75.22 C ATOM 573 O GLN A 76 -0.997 8.291 33.367 1.00 32.10 O ATOM 574 CB GLN A 76 0.134 10.505 35.378 1.00 12.30 C ATOM 575 CG GLN A 76 0.947 10.831 36.602 1.00 1.55 C ATOM 576 CD GLN A 76 0.270 11.851 37.468 1.00 71.35 C ATOM 577 OE1 GLN A 76 0.465 13.060 37.304 1.00 75.13 O ATOM 578 NE2 GLN A 76 -0.539 11.389 38.375 1.00 11.01 N ATOM 0 H GLN A 76 2.342 10.693 34.174 1.00 42.42 H new ATOM 0 HA GLN A 76 0.765 8.487 35.104 1.00 21.32 H new ATOM 0 HB2 GLN A 76 0.030 11.407 34.775 1.00 12.30 H new ATOM 0 HB3 GLN A 76 -0.869 10.213 35.690 1.00 12.30 H new ATOM 0 HG2 GLN A 76 1.117 9.921 37.178 1.00 1.55 H new ATOM 0 HG3 GLN A 76 1.925 11.204 36.299 1.00 1.55 H new ATOM 0 HE21 GLN A 76 -0.671 10.383 38.476 1.00 11.01 H new ATOM 0 HE22 GLN A 76 -1.042 12.033 38.985 1.00 11.01 H new ATOM 587 N GLY A 77 0.049 9.921 32.283 1.00 75.31 N ATOM 588 CA GLY A 77 -0.783 9.742 31.155 1.00 32.34 C ATOM 589 C GLY A 77 -0.401 8.540 30.332 1.00 61.32 C ATOM 590 O GLY A 77 -1.225 8.019 29.628 1.00 34.13 O ATOM 0 H GLY A 77 0.770 10.637 32.197 1.00 75.31 H new ATOM 0 HA2 GLY A 77 -1.817 9.637 31.485 1.00 32.34 H new ATOM 0 HA3 GLY A 77 -0.737 10.634 30.530 1.00 32.34 H new ATOM 594 N LEU A 78 0.837 8.071 30.455 1.00 51.01 N ATOM 595 CA LEU A 78 1.247 6.876 29.724 1.00 72.11 C ATOM 596 C LEU A 78 0.533 5.715 30.374 1.00 11.33 C ATOM 597 O LEU A 78 -0.089 4.865 29.694 1.00 11.32 O ATOM 598 CB LEU A 78 2.787 6.716 29.750 1.00 4.42 C ATOM 599 CG LEU A 78 3.435 5.686 28.786 1.00 1.40 C ATOM 600 CD1 LEU A 78 4.931 5.914 28.721 1.00 60.52 C ATOM 601 CD2 LEU A 78 3.171 4.247 29.215 1.00 13.32 C ATOM 0 H LEU A 78 1.560 8.489 31.040 1.00 51.01 H new ATOM 0 HA LEU A 78 0.979 6.935 28.669 1.00 72.11 H new ATOM 0 HB2 LEU A 78 3.226 7.691 29.539 1.00 4.42 H new ATOM 0 HB3 LEU A 78 3.077 6.449 30.766 1.00 4.42 H new ATOM 0 HG LEU A 78 2.982 5.834 27.806 1.00 1.40 H new ATOM 0 HD11 LEU A 78 5.381 5.188 28.043 1.00 60.52 H new ATOM 0 HD12 LEU A 78 5.130 6.922 28.357 1.00 60.52 H new ATOM 0 HD13 LEU A 78 5.361 5.796 29.716 1.00 60.52 H new ATOM 0 HD21 LEU A 78 3.644 3.564 28.509 1.00 13.32 H new ATOM 0 HD22 LEU A 78 3.583 4.083 30.211 1.00 13.32 H new ATOM 0 HD23 LEU A 78 2.097 4.064 29.232 1.00 13.32 H new ATOM 613 N GLU A 79 0.552 5.725 31.704 1.00 11.41 N ATOM 614 CA GLU A 79 -0.202 4.773 32.460 1.00 2.10 C ATOM 615 C GLU A 79 -1.645 4.914 32.150 1.00 65.53 C ATOM 616 O GLU A 79 -2.283 3.969 31.926 1.00 63.42 O ATOM 617 CB GLU A 79 0.027 4.895 33.956 1.00 30.34 C ATOM 618 CG GLU A 79 1.314 4.278 34.413 1.00 34.44 C ATOM 619 CD GLU A 79 1.355 2.799 34.136 1.00 43.22 C ATOM 620 OE1 GLU A 79 1.727 2.389 33.014 1.00 42.44 O ATOM 621 OE2 GLU A 79 1.031 1.998 35.039 1.00 13.20 O ATOM 0 H GLU A 79 1.086 6.388 32.266 1.00 11.41 H new ATOM 0 HA GLU A 79 0.146 3.782 32.168 1.00 2.10 H new ATOM 0 HB2 GLU A 79 0.020 5.949 34.232 1.00 30.34 H new ATOM 0 HB3 GLU A 79 -0.802 4.422 34.483 1.00 30.34 H new ATOM 0 HG2 GLU A 79 2.149 4.765 33.910 1.00 34.44 H new ATOM 0 HG3 GLU A 79 1.441 4.451 35.482 1.00 34.44 H new ATOM 628 N ALA A 80 -2.110 6.123 32.040 1.00 54.51 N ATOM 629 CA ALA A 80 -3.505 6.394 31.757 1.00 31.34 C ATOM 630 C ALA A 80 -3.868 6.187 30.275 1.00 33.12 C ATOM 631 O ALA A 80 -4.991 6.471 29.857 1.00 13.23 O ATOM 632 CB ALA A 80 -3.847 7.785 32.196 1.00 5.32 C ATOM 0 H ALA A 80 -1.536 6.960 32.143 1.00 54.51 H new ATOM 0 HA ALA A 80 -4.097 5.673 32.320 1.00 31.34 H new ATOM 0 HB1 ALA A 80 -4.897 7.986 31.982 1.00 5.32 H new ATOM 0 HB2 ALA A 80 -3.670 7.882 33.267 1.00 5.32 H new ATOM 0 HB3 ALA A 80 -3.224 8.500 31.659 1.00 5.32 H new ATOM 638 N LEU A 81 -2.910 5.777 29.481 1.00 51.33 N ATOM 639 CA LEU A 81 -3.166 5.397 28.107 1.00 45.02 C ATOM 640 C LEU A 81 -3.210 3.885 27.959 1.00 64.13 C ATOM 641 O LEU A 81 -3.731 3.368 26.974 1.00 14.02 O ATOM 642 CB LEU A 81 -2.116 5.970 27.147 1.00 14.31 C ATOM 643 CG LEU A 81 -2.177 7.475 26.855 1.00 70.12 C ATOM 644 CD1 LEU A 81 -1.031 7.882 25.943 1.00 44.03 C ATOM 645 CD2 LEU A 81 -3.513 7.855 26.227 1.00 45.21 C ATOM 0 H LEU A 81 -1.933 5.696 29.764 1.00 51.33 H new ATOM 0 HA LEU A 81 -4.137 5.816 27.844 1.00 45.02 H new ATOM 0 HB2 LEU A 81 -1.130 5.745 27.552 1.00 14.31 H new ATOM 0 HB3 LEU A 81 -2.200 5.439 26.199 1.00 14.31 H new ATOM 0 HG LEU A 81 -2.082 8.009 27.801 1.00 70.12 H new ATOM 0 HD11 LEU A 81 -1.087 8.952 25.744 1.00 44.03 H new ATOM 0 HD12 LEU A 81 -0.082 7.652 26.427 1.00 44.03 H new ATOM 0 HD13 LEU A 81 -1.102 7.334 25.003 1.00 44.03 H new ATOM 0 HD21 LEU A 81 -3.531 8.927 26.030 1.00 45.21 H new ATOM 0 HD22 LEU A 81 -3.643 7.312 25.291 1.00 45.21 H new ATOM 0 HD23 LEU A 81 -4.322 7.598 26.910 1.00 45.21 H new ATOM 657 N VAL A 82 -2.617 3.179 28.901 1.00 65.42 N ATOM 658 CA VAL A 82 -2.610 1.712 28.849 1.00 52.51 C ATOM 659 C VAL A 82 -3.490 1.111 29.976 1.00 21.40 C ATOM 660 O VAL A 82 -4.063 0.020 29.846 1.00 31.43 O ATOM 661 CB VAL A 82 -1.153 1.172 28.941 1.00 74.41 C ATOM 662 CG1 VAL A 82 -1.109 -0.332 28.756 1.00 33.54 C ATOM 663 CG2 VAL A 82 -0.265 1.859 27.908 1.00 24.52 C ATOM 0 H VAL A 82 -2.137 3.581 29.706 1.00 65.42 H new ATOM 0 HA VAL A 82 -3.034 1.404 27.893 1.00 52.51 H new ATOM 0 HB VAL A 82 -0.775 1.398 29.938 1.00 74.41 H new ATOM 0 HG11 VAL A 82 -0.077 -0.677 28.826 1.00 33.54 H new ATOM 0 HG12 VAL A 82 -1.705 -0.812 29.532 1.00 33.54 H new ATOM 0 HG13 VAL A 82 -1.512 -0.590 27.777 1.00 33.54 H new ATOM 0 HG21 VAL A 82 0.750 1.470 27.985 1.00 24.52 H new ATOM 0 HG22 VAL A 82 -0.653 1.665 26.908 1.00 24.52 H new ATOM 0 HG23 VAL A 82 -0.257 2.933 28.092 1.00 24.52 H new ATOM 673 N LYS A 83 -3.615 1.865 31.020 1.00 63.35 N ATOM 674 CA LYS A 83 -4.354 1.564 32.228 1.00 21.53 C ATOM 675 C LYS A 83 -5.369 2.698 32.390 1.00 72.32 C ATOM 676 O LYS A 83 -5.085 3.806 31.978 1.00 51.24 O ATOM 677 CB LYS A 83 -3.335 1.553 33.394 1.00 11.35 C ATOM 678 CG LYS A 83 -3.893 1.365 34.796 1.00 23.11 C ATOM 679 CD LYS A 83 -2.771 1.463 35.830 1.00 32.44 C ATOM 680 CE LYS A 83 -1.756 0.339 35.664 1.00 22.40 C ATOM 681 NZ LYS A 83 -0.579 0.513 36.532 1.00 32.33 N ATOM 0 H LYS A 83 -3.172 2.783 31.065 1.00 63.35 H new ATOM 0 HA LYS A 83 -4.869 0.604 32.203 1.00 21.53 H new ATOM 0 HB2 LYS A 83 -2.614 0.757 33.207 1.00 11.35 H new ATOM 0 HB3 LYS A 83 -2.784 2.493 33.372 1.00 11.35 H new ATOM 0 HG2 LYS A 83 -4.650 2.122 34.998 1.00 23.11 H new ATOM 0 HG3 LYS A 83 -4.384 0.395 34.873 1.00 23.11 H new ATOM 0 HD2 LYS A 83 -2.268 2.425 35.732 1.00 32.44 H new ATOM 0 HD3 LYS A 83 -3.196 1.425 36.833 1.00 32.44 H new ATOM 0 HE2 LYS A 83 -2.233 -0.614 35.890 1.00 22.40 H new ATOM 0 HE3 LYS A 83 -1.434 0.295 34.624 1.00 22.40 H new ATOM 0 HZ1 LYS A 83 -0.254 -0.416 36.867 1.00 32.33 H new ATOM 0 HZ2 LYS A 83 0.183 0.973 35.995 1.00 32.33 H new ATOM 0 HZ3 LYS A 83 -0.834 1.105 37.348 1.00 32.33 H new ATOM 695 N LYS A 84 -6.552 2.419 32.930 1.00 5.43 N ATOM 696 CA LYS A 84 -7.609 3.457 33.033 1.00 4.12 C ATOM 697 C LYS A 84 -7.109 4.697 33.792 1.00 21.21 C ATOM 698 O LYS A 84 -6.354 4.559 34.773 1.00 43.20 O ATOM 699 CB LYS A 84 -8.929 2.934 33.651 1.00 42.43 C ATOM 700 CG LYS A 84 -9.675 1.866 32.831 1.00 65.21 C ATOM 701 CD LYS A 84 -9.121 0.453 33.019 1.00 65.21 C ATOM 702 CE LYS A 84 -9.364 -0.026 34.437 1.00 71.54 C ATOM 703 NZ LYS A 84 -8.912 -1.408 34.672 1.00 34.32 N ATOM 0 H LYS A 84 -6.814 1.505 33.301 1.00 5.43 H new ATOM 0 HA LYS A 84 -7.839 3.744 32.007 1.00 4.12 H new ATOM 0 HB2 LYS A 84 -8.709 2.521 34.635 1.00 42.43 H new ATOM 0 HB3 LYS A 84 -9.598 3.781 33.803 1.00 42.43 H new ATOM 0 HG2 LYS A 84 -10.728 1.875 33.111 1.00 65.21 H new ATOM 0 HG3 LYS A 84 -9.624 2.130 31.775 1.00 65.21 H new ATOM 0 HD2 LYS A 84 -9.596 -0.228 32.312 1.00 65.21 H new ATOM 0 HD3 LYS A 84 -8.053 0.443 32.803 1.00 65.21 H new ATOM 0 HE2 LYS A 84 -8.850 0.640 35.131 1.00 71.54 H new ATOM 0 HE3 LYS A 84 -10.429 0.043 34.659 1.00 71.54 H new ATOM 0 HZ1 LYS A 84 -9.107 -1.674 35.658 1.00 34.32 H new ATOM 0 HZ2 LYS A 84 -9.420 -2.053 34.033 1.00 34.32 H new ATOM 0 HZ3 LYS A 84 -7.890 -1.475 34.491 1.00 34.32 H new ATOM 717 N PRO A 85 -7.518 5.915 33.350 1.00 3.43 N ATOM 718 CA PRO A 85 -7.004 7.163 33.881 1.00 34.35 C ATOM 719 C PRO A 85 -7.303 7.329 35.351 1.00 1.05 C ATOM 720 O PRO A 85 -8.468 7.301 35.780 1.00 4.12 O ATOM 721 CB PRO A 85 -7.690 8.256 33.054 1.00 50.41 C ATOM 722 CG PRO A 85 -8.339 7.564 31.927 1.00 72.23 C ATOM 723 CD PRO A 85 -8.566 6.153 32.356 1.00 3.01 C ATOM 0 HA PRO A 85 -5.917 7.204 33.807 1.00 34.35 H new ATOM 0 HB2 PRO A 85 -8.422 8.797 33.653 1.00 50.41 H new ATOM 0 HB3 PRO A 85 -6.966 8.988 32.697 1.00 50.41 H new ATOM 0 HG2 PRO A 85 -9.282 8.046 31.670 1.00 72.23 H new ATOM 0 HG3 PRO A 85 -7.710 7.601 31.038 1.00 72.23 H new ATOM 0 HD2 PRO A 85 -9.560 6.020 32.784 1.00 3.01 H new ATOM 0 HD3 PRO A 85 -8.485 5.462 31.517 1.00 3.01 H new ATOM 731 N THR A 86 -6.251 7.497 36.096 1.00 45.24 N ATOM 732 CA THR A 86 -6.307 7.611 37.519 1.00 53.24 C ATOM 733 C THR A 86 -6.915 8.940 37.939 1.00 2.30 C ATOM 734 O THR A 86 -6.659 9.971 37.317 1.00 60.12 O ATOM 735 CB THR A 86 -4.894 7.478 38.101 1.00 33.51 C ATOM 736 OG1 THR A 86 -3.999 8.432 37.462 1.00 54.13 O ATOM 737 CG2 THR A 86 -4.368 6.070 37.890 1.00 13.33 C ATOM 0 H THR A 86 -5.306 7.560 35.718 1.00 45.24 H new ATOM 0 HA THR A 86 -6.940 6.812 37.904 1.00 53.24 H new ATOM 0 HB THR A 86 -4.939 7.685 39.170 1.00 33.51 H new ATOM 0 HG1 THR A 86 -3.100 8.341 37.841 1.00 54.13 H new ATOM 0 HG21 THR A 86 -3.364 5.990 38.308 1.00 13.33 H new ATOM 0 HG22 THR A 86 -5.026 5.357 38.387 1.00 13.33 H new ATOM 0 HG23 THR A 86 -4.335 5.850 36.823 1.00 13.33 H new ATOM 745 N GLY A 87 -7.715 8.914 38.960 1.00 75.11 N ATOM 746 CA GLY A 87 -8.313 10.114 39.432 1.00 51.40 C ATOM 747 C GLY A 87 -9.708 10.240 38.920 1.00 22.15 C ATOM 748 O GLY A 87 -10.558 9.376 39.196 1.00 11.45 O ATOM 0 H GLY A 87 -7.966 8.073 39.479 1.00 75.11 H new ATOM 0 HA2 GLY A 87 -8.318 10.120 40.522 1.00 51.40 H new ATOM 0 HA3 GLY A 87 -7.723 10.972 39.111 1.00 51.40 H new ATOM 752 N ASN A 88 -9.952 11.247 38.133 1.00 51.34 N ATOM 753 CA ASN A 88 -11.279 11.486 37.627 1.00 23.14 C ATOM 754 C ASN A 88 -11.283 11.983 36.186 1.00 52.10 C ATOM 755 O ASN A 88 -11.097 13.165 35.920 1.00 70.23 O ATOM 756 CB ASN A 88 -12.102 12.414 38.572 1.00 22.21 C ATOM 757 CG ASN A 88 -11.452 13.773 38.878 1.00 73.34 C ATOM 758 OD1 ASN A 88 -10.650 13.895 39.806 1.00 11.14 O ATOM 759 ND2 ASN A 88 -11.803 14.793 38.139 1.00 5.10 N ATOM 0 H ASN A 88 -9.250 11.920 37.825 1.00 51.34 H new ATOM 0 HA ASN A 88 -11.780 10.518 37.612 1.00 23.14 H new ATOM 0 HB2 ASN A 88 -13.080 12.589 38.123 1.00 22.21 H new ATOM 0 HB3 ASN A 88 -12.272 11.890 39.512 1.00 22.21 H new ATOM 0 HD21 ASN A 88 -11.411 15.716 38.325 1.00 5.10 H new ATOM 0 HD22 ASN A 88 -12.469 14.665 37.377 1.00 5.10 H new ATOM 766 N PRO A 89 -11.391 11.070 35.222 1.00 22.12 N ATOM 767 CA PRO A 89 -11.611 11.443 33.842 1.00 42.13 C ATOM 768 C PRO A 89 -13.123 11.664 33.645 1.00 34.21 C ATOM 769 O PRO A 89 -13.936 11.213 34.478 1.00 35.41 O ATOM 770 CB PRO A 89 -11.105 10.220 33.052 1.00 70.03 C ATOM 771 CG PRO A 89 -11.314 9.061 33.972 1.00 21.02 C ATOM 772 CD PRO A 89 -11.287 9.600 35.389 1.00 2.21 C ATOM 0 HA PRO A 89 -11.107 12.356 33.526 1.00 42.13 H new ATOM 0 HB2 PRO A 89 -11.659 10.092 32.122 1.00 70.03 H new ATOM 0 HB3 PRO A 89 -10.054 10.329 32.784 1.00 70.03 H new ATOM 0 HG2 PRO A 89 -12.266 8.573 33.765 1.00 21.02 H new ATOM 0 HG3 PRO A 89 -10.534 8.313 33.831 1.00 21.02 H new ATOM 0 HD2 PRO A 89 -12.114 9.207 35.980 1.00 2.21 H new ATOM 0 HD3 PRO A 89 -10.367 9.322 35.903 1.00 2.21 H new ATOM 780 N GLN A 90 -13.508 12.336 32.593 1.00 23.25 N ATOM 781 CA GLN A 90 -14.920 12.623 32.347 1.00 71.41 C ATOM 782 C GLN A 90 -15.613 11.364 31.866 1.00 53.52 C ATOM 783 O GLN A 90 -14.927 10.443 31.441 1.00 42.14 O ATOM 784 CB GLN A 90 -15.061 13.748 31.324 1.00 75.24 C ATOM 785 CG GLN A 90 -14.611 15.086 31.858 1.00 53.13 C ATOM 786 CD GLN A 90 -14.664 16.209 30.841 1.00 72.15 C ATOM 787 OE1 GLN A 90 -14.418 15.912 29.597 1.00 12.55 O flip ATOM 788 NE2 GLN A 90 -14.894 17.366 31.200 1.00 40.21 N flip ATOM 0 H GLN A 90 -12.872 12.701 31.884 1.00 23.25 H new ATOM 0 HA GLN A 90 -15.391 12.952 33.273 1.00 71.41 H new ATOM 0 HB2 GLN A 90 -14.477 13.501 30.437 1.00 75.24 H new ATOM 0 HB3 GLN A 90 -16.103 13.819 31.011 1.00 75.24 H new ATOM 0 HG2 GLN A 90 -15.235 15.353 32.711 1.00 53.13 H new ATOM 0 HG3 GLN A 90 -13.590 14.993 32.227 1.00 53.13 H new ATOM 0 HE21 GLN A 90 -15.083 17.567 32.182 1.00 40.21 H new ATOM 0 HE22 GLN A 90 -14.895 18.122 30.515 1.00 40.21 H new ATOM 797 N PRO A 91 -16.968 11.255 31.981 1.00 32.14 N ATOM 798 CA PRO A 91 -17.687 10.078 31.488 1.00 34.43 C ATOM 799 C PRO A 91 -17.460 9.898 29.993 1.00 63.44 C ATOM 800 O PRO A 91 -18.050 10.604 29.160 1.00 70.53 O ATOM 801 CB PRO A 91 -19.160 10.392 31.779 1.00 55.44 C ATOM 802 CG PRO A 91 -19.121 11.424 32.853 1.00 32.21 C ATOM 803 CD PRO A 91 -17.876 12.230 32.613 1.00 55.35 C ATOM 0 HA PRO A 91 -17.354 9.154 31.961 1.00 34.43 H new ATOM 0 HB2 PRO A 91 -19.669 10.765 30.890 1.00 55.44 H new ATOM 0 HB3 PRO A 91 -19.698 9.502 32.104 1.00 55.44 H new ATOM 0 HG2 PRO A 91 -20.008 12.057 32.817 1.00 32.21 H new ATOM 0 HG3 PRO A 91 -19.100 10.960 33.839 1.00 32.21 H new ATOM 0 HD2 PRO A 91 -18.067 13.084 31.963 1.00 55.35 H new ATOM 0 HD3 PRO A 91 -17.464 12.622 33.542 1.00 55.35 H new ATOM 811 N LYS A 92 -16.545 9.033 29.673 1.00 71.30 N ATOM 812 CA LYS A 92 -16.144 8.795 28.336 1.00 2.23 C ATOM 813 C LYS A 92 -15.633 7.341 28.293 1.00 45.33 C ATOM 814 O LYS A 92 -15.059 6.866 29.292 1.00 32.41 O ATOM 815 CB LYS A 92 -15.035 9.846 28.009 1.00 54.21 C ATOM 816 CG LYS A 92 -14.745 10.120 26.536 1.00 74.33 C ATOM 817 CD LYS A 92 -14.132 8.940 25.868 1.00 25.54 C ATOM 818 CE LYS A 92 -13.818 9.203 24.431 1.00 23.33 C ATOM 819 NZ LYS A 92 -13.325 7.971 23.800 1.00 22.35 N ATOM 0 H LYS A 92 -16.049 8.463 30.359 1.00 71.30 H new ATOM 0 HA LYS A 92 -16.937 8.902 27.596 1.00 2.23 H new ATOM 0 HB2 LYS A 92 -15.314 10.789 28.479 1.00 54.21 H new ATOM 0 HB3 LYS A 92 -14.109 9.517 28.480 1.00 54.21 H new ATOM 0 HG2 LYS A 92 -15.671 10.387 26.026 1.00 74.33 H new ATOM 0 HG3 LYS A 92 -14.075 10.976 26.450 1.00 74.33 H new ATOM 0 HD2 LYS A 92 -13.218 8.662 26.393 1.00 25.54 H new ATOM 0 HD3 LYS A 92 -14.811 8.091 25.940 1.00 25.54 H new ATOM 0 HE2 LYS A 92 -14.709 9.557 23.913 1.00 23.33 H new ATOM 0 HE3 LYS A 92 -13.068 9.990 24.350 1.00 23.33 H new ATOM 0 HZ1 LYS A 92 -13.204 8.128 22.779 1.00 22.35 H new ATOM 0 HZ2 LYS A 92 -12.411 7.707 24.221 1.00 22.35 H new ATOM 0 HZ3 LYS A 92 -14.011 7.204 23.953 1.00 22.35 H new ATOM 833 N ASN A 93 -15.868 6.624 27.199 1.00 71.43 N ATOM 834 CA ASN A 93 -15.361 5.250 27.077 1.00 2.51 C ATOM 835 C ASN A 93 -13.896 5.236 26.718 1.00 42.11 C ATOM 836 O ASN A 93 -13.524 5.363 25.539 1.00 23.34 O ATOM 837 CB ASN A 93 -16.156 4.384 26.081 1.00 45.53 C ATOM 838 CG ASN A 93 -17.485 3.906 26.616 1.00 34.24 C ATOM 839 OD1 ASN A 93 -17.579 2.821 27.209 1.00 63.31 O ATOM 840 ND2 ASN A 93 -18.512 4.674 26.415 1.00 12.42 N ATOM 0 H ASN A 93 -16.397 6.959 26.393 1.00 71.43 H new ATOM 0 HA ASN A 93 -15.497 4.803 28.062 1.00 2.51 H new ATOM 0 HB2 ASN A 93 -16.327 4.958 25.170 1.00 45.53 H new ATOM 0 HB3 ASN A 93 -15.554 3.519 25.804 1.00 45.53 H new ATOM 0 HD21 ASN A 93 -19.433 4.391 26.749 1.00 12.42 H new ATOM 0 HD22 ASN A 93 -18.398 5.560 25.923 1.00 12.42 H new ATOM 847 N TRP A 94 -13.084 5.134 27.741 1.00 74.04 N ATOM 848 CA TRP A 94 -11.650 5.075 27.654 1.00 53.00 C ATOM 849 C TRP A 94 -11.160 3.904 26.784 1.00 52.34 C ATOM 850 O TRP A 94 -11.768 2.821 26.738 1.00 21.03 O ATOM 851 CB TRP A 94 -11.071 5.002 29.067 1.00 51.50 C ATOM 852 CG TRP A 94 -9.593 4.919 29.108 1.00 34.15 C ATOM 853 CD1 TRP A 94 -8.702 5.950 29.031 1.00 31.23 C ATOM 854 CD2 TRP A 94 -8.828 3.728 29.228 1.00 43.32 C ATOM 855 NE1 TRP A 94 -7.429 5.454 29.102 1.00 52.30 N ATOM 856 CE2 TRP A 94 -7.483 4.097 29.218 1.00 50.12 C ATOM 857 CE3 TRP A 94 -9.162 2.377 29.343 1.00 31.21 C ATOM 858 CZ2 TRP A 94 -6.471 3.172 29.315 1.00 20.22 C ATOM 859 CZ3 TRP A 94 -8.152 1.459 29.443 1.00 41.31 C ATOM 860 CH2 TRP A 94 -6.823 1.860 29.429 1.00 5.45 C ATOM 0 H TRP A 94 -13.424 5.088 28.702 1.00 74.04 H new ATOM 0 HA TRP A 94 -11.296 5.980 27.160 1.00 53.00 H new ATOM 0 HB2 TRP A 94 -11.391 5.881 29.626 1.00 51.50 H new ATOM 0 HB3 TRP A 94 -11.488 4.132 29.575 1.00 51.50 H new ATOM 0 HD1 TRP A 94 -8.961 6.994 28.930 1.00 31.23 H new ATOM 0 HE1 TRP A 94 -6.575 6.011 29.073 1.00 52.30 H new ATOM 0 HE3 TRP A 94 -10.195 2.063 29.353 1.00 31.21 H new ATOM 0 HZ2 TRP A 94 -5.434 3.474 29.301 1.00 20.22 H new ATOM 0 HZ3 TRP A 94 -8.392 0.410 29.534 1.00 41.31 H new ATOM 0 HH2 TRP A 94 -6.047 1.113 29.511 1.00 5.45 H new ATOM 871 N ASN A 95 -10.099 4.155 26.081 1.00 4.23 N ATOM 872 CA ASN A 95 -9.455 3.204 25.216 1.00 62.30 C ATOM 873 C ASN A 95 -8.027 3.013 25.672 1.00 73.22 C ATOM 874 O ASN A 95 -7.339 3.988 25.960 1.00 4.23 O ATOM 875 CB ASN A 95 -9.435 3.738 23.793 1.00 21.11 C ATOM 876 CG ASN A 95 -8.651 2.883 22.806 1.00 43.04 C ATOM 877 OD1 ASN A 95 -8.076 3.411 21.892 1.00 61.24 O ATOM 878 ND2 ASN A 95 -8.663 1.586 22.933 1.00 12.11 N ATOM 0 H ASN A 95 -9.636 5.064 26.092 1.00 4.23 H new ATOM 0 HA ASN A 95 -9.999 2.260 25.251 1.00 62.30 H new ATOM 0 HB2 ASN A 95 -10.462 3.829 23.439 1.00 21.11 H new ATOM 0 HB3 ASN A 95 -9.010 4.742 23.801 1.00 21.11 H new ATOM 0 HD21 ASN A 95 -8.179 1.002 22.251 1.00 12.11 H new ATOM 0 HD22 ASN A 95 -9.156 1.155 23.715 1.00 12.11 H new ATOM 885 N LYS A 96 -7.584 1.782 25.733 1.00 63.41 N ATOM 886 CA LYS A 96 -6.220 1.508 26.090 1.00 54.23 C ATOM 887 C LYS A 96 -5.341 1.623 24.855 1.00 51.52 C ATOM 888 O LYS A 96 -5.802 2.030 23.791 1.00 14.30 O ATOM 889 CB LYS A 96 -6.089 0.110 26.688 1.00 42.30 C ATOM 890 CG LYS A 96 -6.289 -1.017 25.702 1.00 35.33 C ATOM 891 CD LYS A 96 -6.336 -2.352 26.404 1.00 75.03 C ATOM 892 CE LYS A 96 -5.043 -2.660 27.131 1.00 74.55 C ATOM 893 NZ LYS A 96 -5.099 -3.960 27.807 1.00 3.35 N ATOM 0 H LYS A 96 -8.150 0.956 25.540 1.00 63.41 H new ATOM 0 HA LYS A 96 -5.901 2.234 26.838 1.00 54.23 H new ATOM 0 HB2 LYS A 96 -5.100 0.012 27.136 1.00 42.30 H new ATOM 0 HB3 LYS A 96 -6.816 0.004 27.493 1.00 42.30 H new ATOM 0 HG2 LYS A 96 -7.215 -0.861 25.149 1.00 35.33 H new ATOM 0 HG3 LYS A 96 -5.479 -1.014 24.973 1.00 35.33 H new ATOM 0 HD2 LYS A 96 -7.162 -2.358 27.116 1.00 75.03 H new ATOM 0 HD3 LYS A 96 -6.538 -3.137 25.675 1.00 75.03 H new ATOM 0 HE2 LYS A 96 -4.216 -2.654 26.421 1.00 74.55 H new ATOM 0 HE3 LYS A 96 -4.841 -1.878 27.862 1.00 74.55 H new ATOM 0 HZ1 LYS A 96 -4.197 -4.137 28.294 1.00 3.35 H new ATOM 0 HZ2 LYS A 96 -5.873 -3.957 28.502 1.00 3.35 H new ATOM 0 HZ3 LYS A 96 -5.267 -4.709 27.105 1.00 3.35 H new ATOM 907 N ASP A 97 -4.082 1.284 25.010 1.00 74.24 N ATOM 908 CA ASP A 97 -3.130 1.260 23.950 1.00 55.33 C ATOM 909 C ASP A 97 -2.942 2.591 23.253 1.00 51.23 C ATOM 910 O ASP A 97 -2.706 2.654 22.048 1.00 64.30 O ATOM 911 CB ASP A 97 -3.365 0.112 22.988 1.00 2.02 C ATOM 912 CG ASP A 97 -2.925 -1.215 23.559 1.00 61.41 C ATOM 913 OD1 ASP A 97 -1.696 -1.410 23.748 1.00 5.04 O ATOM 914 OD2 ASP A 97 -3.777 -2.087 23.814 1.00 3.15 O ATOM 0 H ASP A 97 -3.690 1.010 25.911 1.00 74.24 H new ATOM 0 HA ASP A 97 -2.171 1.070 24.432 1.00 55.33 H new ATOM 0 HB2 ASP A 97 -4.424 0.063 22.736 1.00 2.02 H new ATOM 0 HB3 ASP A 97 -2.825 0.302 22.060 1.00 2.02 H new ATOM 919 N GLY A 98 -3.043 3.644 24.021 1.00 72.21 N ATOM 920 CA GLY A 98 -2.642 4.949 23.542 1.00 60.44 C ATOM 921 C GLY A 98 -3.726 5.717 22.875 1.00 22.44 C ATOM 922 O GLY A 98 -3.467 6.794 22.354 1.00 54.43 O ATOM 0 H GLY A 98 -3.397 3.629 24.977 1.00 72.21 H new ATOM 0 HA2 GLY A 98 -2.265 5.531 24.383 1.00 60.44 H new ATOM 0 HA3 GLY A 98 -1.815 4.828 22.842 1.00 60.44 H new ATOM 926 N TYR A 99 -4.940 5.181 22.920 1.00 24.12 N ATOM 927 CA TYR A 99 -6.077 5.776 22.260 1.00 4.12 C ATOM 928 C TYR A 99 -5.915 5.744 20.729 1.00 33.23 C ATOM 929 O TYR A 99 -5.318 6.626 20.112 1.00 11.04 O ATOM 930 CB TYR A 99 -6.441 7.184 22.822 1.00 11.24 C ATOM 931 CG TYR A 99 -7.725 7.224 23.570 1.00 43.33 C ATOM 932 CD1 TYR A 99 -8.902 7.485 22.913 1.00 11.54 C ATOM 933 CD2 TYR A 99 -7.768 7.012 24.933 1.00 62.35 C ATOM 934 CE1 TYR A 99 -10.081 7.532 23.575 1.00 41.04 C ATOM 935 CE2 TYR A 99 -8.952 7.060 25.606 1.00 22.40 C ATOM 936 CZ TYR A 99 -10.105 7.323 24.917 1.00 10.43 C ATOM 937 OH TYR A 99 -11.289 7.349 25.567 1.00 5.34 O ATOM 0 H TYR A 99 -5.156 4.318 23.419 1.00 24.12 H new ATOM 0 HA TYR A 99 -6.944 5.158 22.492 1.00 4.12 H new ATOM 0 HB2 TYR A 99 -5.639 7.520 23.479 1.00 11.24 H new ATOM 0 HB3 TYR A 99 -6.492 7.892 21.995 1.00 11.24 H new ATOM 0 HD1 TYR A 99 -8.886 7.656 21.847 1.00 11.54 H new ATOM 0 HD2 TYR A 99 -6.855 6.806 25.471 1.00 62.35 H new ATOM 0 HE1 TYR A 99 -10.997 7.734 23.040 1.00 41.04 H new ATOM 0 HE2 TYR A 99 -8.980 6.892 26.673 1.00 22.40 H new ATOM 0 HH TYR A 99 -11.194 7.857 26.400 1.00 5.34 H new ATOM 947 N LEU A 100 -6.431 4.683 20.145 1.00 43.22 N ATOM 948 CA LEU A 100 -6.397 4.442 18.720 1.00 24.44 C ATOM 949 C LEU A 100 -7.768 3.889 18.294 1.00 12.33 C ATOM 950 O LEU A 100 -8.610 3.586 19.138 1.00 51.05 O ATOM 951 CB LEU A 100 -5.253 3.448 18.380 1.00 33.21 C ATOM 952 CG LEU A 100 -5.046 3.084 16.893 1.00 20.14 C ATOM 953 CD1 LEU A 100 -4.758 4.315 16.050 1.00 64.51 C ATOM 954 CD2 LEU A 100 -3.931 2.065 16.738 1.00 71.43 C ATOM 0 H LEU A 100 -6.900 3.942 20.666 1.00 43.22 H new ATOM 0 HA LEU A 100 -6.199 5.366 18.176 1.00 24.44 H new ATOM 0 HB2 LEU A 100 -4.320 3.866 18.757 1.00 33.21 H new ATOM 0 HB3 LEU A 100 -5.434 2.525 18.931 1.00 33.21 H new ATOM 0 HG LEU A 100 -5.976 2.643 16.533 1.00 20.14 H new ATOM 0 HD11 LEU A 100 -4.618 4.019 15.010 1.00 64.51 H new ATOM 0 HD12 LEU A 100 -5.596 5.008 16.120 1.00 64.51 H new ATOM 0 HD13 LEU A 100 -3.853 4.801 16.414 1.00 64.51 H new ATOM 0 HD21 LEU A 100 -3.803 1.824 15.683 1.00 71.43 H new ATOM 0 HD22 LEU A 100 -3.002 2.479 17.131 1.00 71.43 H new ATOM 0 HD23 LEU A 100 -4.186 1.160 17.289 1.00 71.43 H new ATOM 966 N LYS A 101 -8.006 3.774 17.012 1.00 31.15 N ATOM 967 CA LYS A 101 -9.270 3.255 16.510 1.00 23.02 C ATOM 968 C LYS A 101 -9.219 1.719 16.473 1.00 54.13 C ATOM 969 O LYS A 101 -8.333 1.118 17.076 1.00 54.20 O ATOM 970 CB LYS A 101 -9.551 3.817 15.108 1.00 32.42 C ATOM 971 CG LYS A 101 -9.612 5.343 15.026 1.00 4.51 C ATOM 972 CD LYS A 101 -10.623 5.930 16.002 1.00 42.13 C ATOM 973 CE LYS A 101 -10.839 7.420 15.768 1.00 22.30 C ATOM 974 NZ LYS A 101 -11.487 7.682 14.461 1.00 61.52 N ATOM 0 H LYS A 101 -7.340 4.033 16.285 1.00 31.15 H new ATOM 0 HA LYS A 101 -10.077 3.566 17.174 1.00 23.02 H new ATOM 0 HB2 LYS A 101 -8.776 3.462 14.428 1.00 32.42 H new ATOM 0 HB3 LYS A 101 -10.498 3.410 14.753 1.00 32.42 H new ATOM 0 HG2 LYS A 101 -8.625 5.756 15.235 1.00 4.51 H new ATOM 0 HG3 LYS A 101 -9.874 5.641 14.011 1.00 4.51 H new ATOM 0 HD2 LYS A 101 -11.573 5.405 15.900 1.00 42.13 H new ATOM 0 HD3 LYS A 101 -10.278 5.769 17.023 1.00 42.13 H new ATOM 0 HE2 LYS A 101 -11.456 7.828 16.568 1.00 22.30 H new ATOM 0 HE3 LYS A 101 -9.881 7.937 15.809 1.00 22.30 H new ATOM 0 HZ1 LYS A 101 -11.876 8.646 14.454 1.00 61.52 H new ATOM 0 HZ2 LYS A 101 -10.785 7.586 13.700 1.00 61.52 H new ATOM 0 HZ3 LYS A 101 -12.255 6.997 14.311 1.00 61.52 H new ATOM 988 N LYS A 102 -10.161 1.087 15.774 1.00 34.44 N ATOM 989 CA LYS A 102 -10.210 -0.403 15.618 1.00 74.44 C ATOM 990 C LYS A 102 -9.054 -0.944 14.703 1.00 65.40 C ATOM 991 O LYS A 102 -9.215 -1.907 13.952 1.00 3.41 O ATOM 992 CB LYS A 102 -11.596 -0.883 15.066 1.00 30.11 C ATOM 993 CG LYS A 102 -11.928 -0.526 13.597 1.00 3.33 C ATOM 994 CD LYS A 102 -12.398 0.904 13.389 1.00 75.33 C ATOM 995 CE LYS A 102 -13.775 1.136 13.990 1.00 11.02 C ATOM 996 NZ LYS A 102 -14.224 2.524 13.807 1.00 72.11 N ATOM 0 H LYS A 102 -10.918 1.573 15.294 1.00 34.44 H new ATOM 0 HA LYS A 102 -10.071 -0.816 16.617 1.00 74.44 H new ATOM 0 HB2 LYS A 102 -11.646 -1.967 15.171 1.00 30.11 H new ATOM 0 HB3 LYS A 102 -12.377 -0.465 15.701 1.00 30.11 H new ATOM 0 HG2 LYS A 102 -11.042 -0.697 12.985 1.00 3.33 H new ATOM 0 HG3 LYS A 102 -12.700 -1.205 13.236 1.00 3.33 H new ATOM 0 HD2 LYS A 102 -11.683 1.591 13.841 1.00 75.33 H new ATOM 0 HD3 LYS A 102 -12.424 1.127 12.322 1.00 75.33 H new ATOM 0 HE2 LYS A 102 -14.492 0.458 13.528 1.00 11.02 H new ATOM 0 HE3 LYS A 102 -13.752 0.899 15.054 1.00 11.02 H new ATOM 0 HZ1 LYS A 102 -15.167 2.643 14.230 1.00 72.11 H new ATOM 0 HZ2 LYS A 102 -13.553 3.170 14.270 1.00 72.11 H new ATOM 0 HZ3 LYS A 102 -14.270 2.743 12.791 1.00 72.11 H new ATOM 1010 N LEU A 103 -7.902 -0.378 14.864 1.00 71.32 N ATOM 1011 CA LEU A 103 -6.741 -0.657 14.060 1.00 73.10 C ATOM 1012 C LEU A 103 -5.781 -1.576 14.819 1.00 24.43 C ATOM 1013 O LEU A 103 -5.775 -1.578 16.059 1.00 22.43 O ATOM 1014 CB LEU A 103 -6.072 0.667 13.688 1.00 1.01 C ATOM 1015 CG LEU A 103 -6.948 1.630 12.879 1.00 62.32 C ATOM 1016 CD1 LEU A 103 -6.263 2.961 12.711 1.00 32.44 C ATOM 1017 CD2 LEU A 103 -7.294 1.040 11.516 1.00 53.23 C ATOM 0 H LEU A 103 -7.730 0.321 15.587 1.00 71.32 H new ATOM 0 HA LEU A 103 -7.032 -1.174 13.146 1.00 73.10 H new ATOM 0 HB2 LEU A 103 -5.757 1.168 14.604 1.00 1.01 H new ATOM 0 HB3 LEU A 103 -5.169 0.453 13.116 1.00 1.01 H new ATOM 0 HG LEU A 103 -7.875 1.783 13.432 1.00 62.32 H new ATOM 0 HD11 LEU A 103 -6.902 3.629 12.134 1.00 32.44 H new ATOM 0 HD12 LEU A 103 -6.072 3.398 13.691 1.00 32.44 H new ATOM 0 HD13 LEU A 103 -5.318 2.820 12.186 1.00 32.44 H new ATOM 0 HD21 LEU A 103 -7.916 1.743 10.962 1.00 53.23 H new ATOM 0 HD22 LEU A 103 -6.377 0.850 10.958 1.00 53.23 H new ATOM 0 HD23 LEU A 103 -7.837 0.104 11.652 1.00 53.23 H new ATOM 1029 N PRO A 104 -5.042 -2.426 14.100 1.00 23.24 N ATOM 1030 CA PRO A 104 -4.061 -3.367 14.686 1.00 72.02 C ATOM 1031 C PRO A 104 -2.791 -2.649 15.187 1.00 4.14 C ATOM 1032 O PRO A 104 -2.786 -1.426 15.379 1.00 2.24 O ATOM 1033 CB PRO A 104 -3.720 -4.281 13.506 1.00 23.33 C ATOM 1034 CG PRO A 104 -3.903 -3.424 12.311 1.00 1.05 C ATOM 1035 CD PRO A 104 -5.069 -2.533 12.623 1.00 11.23 C ATOM 0 HA PRO A 104 -4.458 -3.889 15.557 1.00 72.02 H new ATOM 0 HB2 PRO A 104 -2.698 -4.654 13.575 1.00 23.33 H new ATOM 0 HB3 PRO A 104 -4.376 -5.151 13.475 1.00 23.33 H new ATOM 0 HG2 PRO A 104 -3.006 -2.838 12.109 1.00 1.05 H new ATOM 0 HG3 PRO A 104 -4.097 -4.026 11.424 1.00 1.05 H new ATOM 0 HD2 PRO A 104 -4.966 -1.557 12.149 1.00 11.23 H new ATOM 0 HD3 PRO A 104 -6.007 -2.962 12.269 1.00 11.23 H new ATOM 1043 N VAL A 105 -1.751 -3.413 15.479 1.00 34.35 N ATOM 1044 CA VAL A 105 -0.492 -2.813 15.859 1.00 22.51 C ATOM 1045 C VAL A 105 0.273 -2.480 14.555 1.00 24.50 C ATOM 1046 O VAL A 105 -0.170 -2.904 13.467 1.00 14.24 O ATOM 1047 CB VAL A 105 0.329 -3.740 16.804 1.00 71.13 C ATOM 1048 CG1 VAL A 105 1.064 -4.859 16.070 1.00 45.03 C ATOM 1049 CG2 VAL A 105 1.253 -2.940 17.701 1.00 33.33 C ATOM 0 H VAL A 105 -1.756 -4.433 15.460 1.00 34.35 H new ATOM 0 HA VAL A 105 -0.664 -1.901 16.431 1.00 22.51 H new ATOM 0 HB VAL A 105 -0.397 -4.242 17.443 1.00 71.13 H new ATOM 0 HG11 VAL A 105 1.615 -5.465 16.789 1.00 45.03 H new ATOM 0 HG12 VAL A 105 0.342 -5.485 15.545 1.00 45.03 H new ATOM 0 HG13 VAL A 105 1.760 -4.427 15.351 1.00 45.03 H new ATOM 0 HG21 VAL A 105 1.810 -3.618 18.347 1.00 33.33 H new ATOM 0 HG22 VAL A 105 1.950 -2.368 17.088 1.00 33.33 H new ATOM 0 HG23 VAL A 105 0.664 -2.257 18.314 1.00 33.33 H new ATOM 1059 N ASP A 106 1.391 -1.775 14.634 1.00 73.33 N ATOM 1060 CA ASP A 106 2.044 -1.310 13.409 1.00 4.10 C ATOM 1061 C ASP A 106 2.858 -2.447 12.791 1.00 73.22 C ATOM 1062 O ASP A 106 3.209 -3.418 13.506 1.00 63.33 O ATOM 1063 CB ASP A 106 2.926 -0.083 13.701 1.00 4.44 C ATOM 1064 CG ASP A 106 2.853 0.961 12.616 1.00 61.20 C ATOM 1065 OD1 ASP A 106 1.719 1.423 12.285 1.00 62.33 O ATOM 1066 OD2 ASP A 106 3.910 1.341 12.108 1.00 64.22 O ATOM 0 H ASP A 106 1.858 -1.516 15.503 1.00 73.33 H new ATOM 0 HA ASP A 106 1.283 -1.005 12.691 1.00 4.10 H new ATOM 0 HB2 ASP A 106 2.620 0.362 14.648 1.00 4.44 H new ATOM 0 HB3 ASP A 106 3.961 -0.405 13.820 1.00 4.44 H new ATOM 1071 N PRO A 107 3.125 -2.407 11.454 1.00 73.22 N ATOM 1072 CA PRO A 107 3.928 -3.403 10.765 1.00 55.14 C ATOM 1073 C PRO A 107 5.297 -3.603 11.385 1.00 2.40 C ATOM 1074 O PRO A 107 5.722 -2.868 12.263 1.00 22.32 O ATOM 1075 CB PRO A 107 4.104 -2.832 9.358 1.00 43.20 C ATOM 1076 CG PRO A 107 3.695 -1.413 9.465 1.00 72.31 C ATOM 1077 CD PRO A 107 2.643 -1.399 10.503 1.00 42.43 C ATOM 0 HA PRO A 107 3.439 -4.376 10.804 1.00 55.14 H new ATOM 0 HB2 PRO A 107 5.137 -2.920 9.023 1.00 43.20 H new ATOM 0 HB3 PRO A 107 3.488 -3.367 8.635 1.00 43.20 H new ATOM 0 HG2 PRO A 107 4.536 -0.779 9.746 1.00 72.31 H new ATOM 0 HG3 PRO A 107 3.317 -1.038 8.514 1.00 72.31 H new ATOM 0 HD2 PRO A 107 2.543 -0.418 10.967 1.00 42.43 H new ATOM 0 HD3 PRO A 107 1.666 -1.660 10.095 1.00 42.43 H new ATOM 1085 N TRP A 108 5.982 -4.621 10.893 1.00 32.00 N ATOM 1086 CA TRP A 108 7.328 -5.040 11.315 1.00 51.31 C ATOM 1087 C TRP A 108 7.285 -5.536 12.764 1.00 1.14 C ATOM 1088 O TRP A 108 8.321 -5.682 13.428 1.00 33.32 O ATOM 1089 CB TRP A 108 8.357 -3.899 11.197 1.00 64.23 C ATOM 1090 CG TRP A 108 8.179 -3.036 9.997 1.00 3.45 C ATOM 1091 CD1 TRP A 108 8.385 -3.367 8.707 1.00 41.11 C ATOM 1092 CD2 TRP A 108 7.727 -1.685 10.011 1.00 61.31 C ATOM 1093 NE1 TRP A 108 8.110 -2.294 7.898 1.00 52.22 N ATOM 1094 CE2 TRP A 108 7.695 -1.239 8.692 1.00 54.22 C ATOM 1095 CE3 TRP A 108 7.349 -0.816 11.040 1.00 3.02 C ATOM 1096 CZ2 TRP A 108 7.297 0.058 8.368 1.00 3.41 C ATOM 1097 CZ3 TRP A 108 6.948 0.446 10.730 1.00 1.35 C ATOM 1098 CH2 TRP A 108 6.922 0.885 9.420 1.00 1.44 C ATOM 0 H TRP A 108 5.606 -5.213 10.152 1.00 32.00 H new ATOM 0 HA TRP A 108 7.643 -5.843 10.648 1.00 51.31 H new ATOM 0 HB2 TRP A 108 8.296 -3.277 12.090 1.00 64.23 H new ATOM 0 HB3 TRP A 108 9.358 -4.329 11.176 1.00 64.23 H new ATOM 0 HD1 TRP A 108 8.718 -4.335 8.361 1.00 41.11 H new ATOM 0 HE1 TRP A 108 8.197 -2.277 6.882 1.00 52.22 H new ATOM 0 HE3 TRP A 108 7.375 -1.144 12.069 1.00 3.02 H new ATOM 0 HZ2 TRP A 108 7.281 0.404 7.345 1.00 3.41 H new ATOM 0 HZ3 TRP A 108 6.645 1.116 11.521 1.00 1.35 H new ATOM 0 HH2 TRP A 108 6.603 1.895 9.209 1.00 1.44 H new ATOM 1109 N GLY A 109 6.077 -5.803 13.225 1.00 73.43 N ATOM 1110 CA GLY A 109 5.835 -6.312 14.559 1.00 32.14 C ATOM 1111 C GLY A 109 6.199 -5.338 15.665 1.00 64.31 C ATOM 1112 O GLY A 109 6.590 -5.762 16.756 1.00 64.55 O ATOM 0 H GLY A 109 5.228 -5.670 12.676 1.00 73.43 H new ATOM 0 HA2 GLY A 109 4.781 -6.574 14.652 1.00 32.14 H new ATOM 0 HA3 GLY A 109 6.405 -7.231 14.696 1.00 32.14 H new ATOM 1116 N ASN A 110 6.102 -4.051 15.403 1.00 11.53 N ATOM 1117 CA ASN A 110 6.420 -3.065 16.407 1.00 23.22 C ATOM 1118 C ASN A 110 5.188 -2.657 17.163 1.00 40.41 C ATOM 1119 O ASN A 110 4.190 -2.216 16.555 1.00 24.41 O ATOM 1120 CB ASN A 110 7.095 -1.803 15.842 1.00 52.25 C ATOM 1121 CG ASN A 110 8.427 -2.059 15.183 1.00 54.11 C ATOM 1122 OD1 ASN A 110 9.466 -2.139 15.845 1.00 74.21 O ATOM 1123 ND2 ASN A 110 8.430 -2.152 13.891 1.00 34.31 N ATOM 0 H ASN A 110 5.806 -3.667 14.505 1.00 11.53 H new ATOM 0 HA ASN A 110 7.135 -3.550 17.072 1.00 23.22 H new ATOM 0 HB2 ASN A 110 6.426 -1.340 15.117 1.00 52.25 H new ATOM 0 HB3 ASN A 110 7.234 -1.085 16.651 1.00 52.25 H new ATOM 0 HD21 ASN A 110 9.308 -2.296 13.392 1.00 34.31 H new ATOM 0 HD22 ASN A 110 7.554 -2.082 13.373 1.00 34.31 H new ATOM 1130 N PRO A 111 5.185 -2.874 18.485 1.00 74.42 N ATOM 1131 CA PRO A 111 4.174 -2.311 19.350 1.00 1.21 C ATOM 1132 C PRO A 111 4.273 -0.802 19.299 1.00 63.45 C ATOM 1133 O PRO A 111 5.373 -0.267 19.220 1.00 42.12 O ATOM 1134 CB PRO A 111 4.566 -2.810 20.747 1.00 74.02 C ATOM 1135 CG PRO A 111 5.385 -4.019 20.494 1.00 44.34 C ATOM 1136 CD PRO A 111 6.119 -3.746 19.223 1.00 51.11 C ATOM 0 HA PRO A 111 3.158 -2.592 19.073 1.00 1.21 H new ATOM 0 HB2 PRO A 111 5.131 -2.055 21.294 1.00 74.02 H new ATOM 0 HB3 PRO A 111 3.686 -3.045 21.346 1.00 74.02 H new ATOM 0 HG2 PRO A 111 6.078 -4.202 21.315 1.00 44.34 H new ATOM 0 HG3 PRO A 111 4.758 -4.906 20.402 1.00 44.34 H new ATOM 0 HD2 PRO A 111 7.074 -3.253 19.406 1.00 51.11 H new ATOM 0 HD3 PRO A 111 6.334 -4.664 18.675 1.00 51.11 H new ATOM 1144 N TYR A 112 3.163 -0.128 19.344 1.00 41.14 N ATOM 1145 CA TYR A 112 3.166 1.316 19.297 1.00 31.35 C ATOM 1146 C TYR A 112 3.754 1.886 20.581 1.00 64.11 C ATOM 1147 O TYR A 112 3.562 1.332 21.678 1.00 70.01 O ATOM 1148 CB TYR A 112 1.774 1.901 19.062 1.00 33.43 C ATOM 1149 CG TYR A 112 1.208 1.825 17.658 1.00 64.45 C ATOM 1150 CD1 TYR A 112 1.558 2.769 16.695 1.00 14.41 C ATOM 1151 CD2 TYR A 112 0.281 0.855 17.312 1.00 52.32 C ATOM 1152 CE1 TYR A 112 1.006 2.736 15.424 1.00 30.22 C ATOM 1153 CE2 TYR A 112 -0.282 0.824 16.051 1.00 5.24 C ATOM 1154 CZ TYR A 112 0.082 1.760 15.113 1.00 40.30 C ATOM 1155 OH TYR A 112 -0.500 1.726 13.870 1.00 34.33 O ATOM 0 H TYR A 112 2.237 -0.550 19.413 1.00 41.14 H new ATOM 0 HA TYR A 112 3.786 1.601 18.447 1.00 31.35 H new ATOM 0 HB2 TYR A 112 1.079 1.394 19.732 1.00 33.43 H new ATOM 0 HB3 TYR A 112 1.796 2.950 19.359 1.00 33.43 H new ATOM 0 HD1 TYR A 112 2.272 3.540 16.943 1.00 14.41 H new ATOM 0 HD2 TYR A 112 -0.006 0.111 18.040 1.00 52.32 H new ATOM 0 HE1 TYR A 112 1.296 3.467 14.684 1.00 30.22 H new ATOM 0 HE2 TYR A 112 -1.008 0.064 15.802 1.00 5.24 H new ATOM 0 HH TYR A 112 0.193 1.603 13.188 1.00 34.33 H new ATOM 1165 N GLN A 113 4.460 2.970 20.450 1.00 3.52 N ATOM 1166 CA GLN A 113 5.111 3.599 21.586 1.00 42.44 C ATOM 1167 C GLN A 113 4.259 4.792 21.960 1.00 12.14 C ATOM 1168 O GLN A 113 4.121 5.738 21.164 1.00 51.42 O ATOM 1169 CB GLN A 113 6.524 4.162 21.229 1.00 33.34 C ATOM 1170 CG GLN A 113 7.177 3.674 19.931 1.00 31.00 C ATOM 1171 CD GLN A 113 7.541 2.217 19.880 1.00 53.41 C ATOM 1172 OE1 GLN A 113 7.520 1.608 18.798 1.00 12.03 O ATOM 1173 NE2 GLN A 113 7.949 1.662 20.996 1.00 44.30 N ATOM 0 H GLN A 113 4.607 3.450 19.562 1.00 3.52 H new ATOM 0 HA GLN A 113 5.222 2.857 22.377 1.00 42.44 H new ATOM 0 HB2 GLN A 113 6.450 5.248 21.179 1.00 33.34 H new ATOM 0 HB3 GLN A 113 7.197 3.926 22.053 1.00 33.34 H new ATOM 0 HG2 GLN A 113 6.499 3.887 19.105 1.00 31.00 H new ATOM 0 HG3 GLN A 113 8.081 4.259 19.761 1.00 31.00 H new ATOM 0 HE21 GLN A 113 7.949 2.200 21.863 1.00 44.30 H new ATOM 0 HE22 GLN A 113 8.266 0.692 20.997 1.00 44.30 H new ATOM 1182 N TYR A 114 3.667 4.759 23.137 1.00 63.34 N ATOM 1183 CA TYR A 114 2.804 5.843 23.538 1.00 5.23 C ATOM 1184 C TYR A 114 3.595 6.726 24.485 1.00 2.41 C ATOM 1185 O TYR A 114 4.034 6.263 25.531 1.00 73.45 O ATOM 1186 CB TYR A 114 1.546 5.281 24.286 1.00 54.40 C ATOM 1187 CG TYR A 114 1.020 3.951 23.733 1.00 72.33 C ATOM 1188 CD1 TYR A 114 0.750 3.792 22.392 1.00 42.15 C ATOM 1189 CD2 TYR A 114 0.833 2.845 24.569 1.00 60.52 C ATOM 1190 CE1 TYR A 114 0.335 2.585 21.889 1.00 33.04 C ATOM 1191 CE2 TYR A 114 0.399 1.626 24.065 1.00 63.35 C ATOM 1192 CZ TYR A 114 0.160 1.503 22.721 1.00 72.32 C ATOM 1193 OH TYR A 114 -0.238 0.278 22.186 1.00 1.45 O ATOM 0 H TYR A 114 3.767 4.007 23.819 1.00 63.34 H new ATOM 0 HA TYR A 114 2.468 6.403 22.665 1.00 5.23 H new ATOM 0 HB2 TYR A 114 1.794 5.150 25.339 1.00 54.40 H new ATOM 0 HB3 TYR A 114 0.748 6.022 24.236 1.00 54.40 H new ATOM 0 HD1 TYR A 114 0.867 4.633 21.724 1.00 42.15 H new ATOM 0 HD2 TYR A 114 1.030 2.941 25.627 1.00 60.52 H new ATOM 0 HE1 TYR A 114 0.144 2.483 20.831 1.00 33.04 H new ATOM 0 HE2 TYR A 114 0.251 0.784 24.725 1.00 63.35 H new ATOM 0 HH TYR A 114 -0.677 -0.255 22.881 1.00 1.45 H new ATOM 1203 N LEU A 115 3.814 7.957 24.101 1.00 32.21 N ATOM 1204 CA LEU A 115 4.476 8.934 24.933 1.00 62.01 C ATOM 1205 C LEU A 115 3.657 10.199 24.986 1.00 12.15 C ATOM 1206 O LEU A 115 2.882 10.501 24.069 1.00 72.15 O ATOM 1207 CB LEU A 115 5.914 9.242 24.470 1.00 42.51 C ATOM 1208 CG LEU A 115 6.940 8.105 24.553 1.00 63.42 C ATOM 1209 CD1 LEU A 115 8.289 8.588 24.052 1.00 43.21 C ATOM 1210 CD2 LEU A 115 7.069 7.594 25.985 1.00 45.13 C ATOM 0 H LEU A 115 3.534 8.316 23.188 1.00 32.21 H new ATOM 0 HA LEU A 115 4.558 8.504 25.931 1.00 62.01 H new ATOM 0 HB2 LEU A 115 5.869 9.581 23.435 1.00 42.51 H new ATOM 0 HB3 LEU A 115 6.287 10.077 25.063 1.00 42.51 H new ATOM 0 HG LEU A 115 6.595 7.284 23.925 1.00 63.42 H new ATOM 0 HD11 LEU A 115 9.012 7.775 24.114 1.00 43.21 H new ATOM 0 HD12 LEU A 115 8.197 8.914 23.016 1.00 43.21 H new ATOM 0 HD13 LEU A 115 8.628 9.423 24.666 1.00 43.21 H new ATOM 0 HD21 LEU A 115 7.802 6.788 26.019 1.00 45.13 H new ATOM 0 HD22 LEU A 115 7.394 8.408 26.634 1.00 45.13 H new ATOM 0 HD23 LEU A 115 6.103 7.221 26.327 1.00 45.13 H new ATOM 1222 N ALA A 116 3.809 10.926 26.025 1.00 30.24 N ATOM 1223 CA ALA A 116 3.123 12.137 26.188 1.00 32.00 C ATOM 1224 C ALA A 116 4.181 13.266 26.135 1.00 54.44 C ATOM 1225 O ALA A 116 5.349 12.907 26.000 1.00 34.23 O ATOM 1226 CB ALA A 116 2.324 12.039 27.435 1.00 42.34 C ATOM 0 H ALA A 116 4.428 10.687 26.800 1.00 30.24 H new ATOM 0 HA ALA A 116 2.401 12.366 25.404 1.00 32.00 H new ATOM 0 HB1 ALA A 116 1.777 12.969 27.591 1.00 42.34 H new ATOM 0 HB2 ALA A 116 1.618 11.212 27.351 1.00 42.34 H new ATOM 0 HB3 ALA A 116 2.989 11.864 28.281 1.00 42.34 H new ATOM 1232 N PRO A 117 3.837 14.609 26.294 1.00 23.32 N ATOM 1233 CA PRO A 117 4.737 15.726 25.920 1.00 72.32 C ATOM 1234 C PRO A 117 6.176 15.520 26.252 1.00 33.44 C ATOM 1235 O PRO A 117 6.579 15.482 27.428 1.00 53.45 O ATOM 1236 CB PRO A 117 4.158 16.969 26.616 1.00 63.40 C ATOM 1237 CG PRO A 117 3.135 16.443 27.555 1.00 3.21 C ATOM 1238 CD PRO A 117 2.655 15.140 26.966 1.00 0.02 C ATOM 0 HA PRO A 117 4.759 15.824 24.835 1.00 72.32 H new ATOM 0 HB2 PRO A 117 4.934 17.521 27.147 1.00 63.40 H new ATOM 0 HB3 PRO A 117 3.715 17.655 25.894 1.00 63.40 H new ATOM 0 HG2 PRO A 117 3.560 16.289 28.547 1.00 3.21 H new ATOM 0 HG3 PRO A 117 2.310 17.147 27.667 1.00 3.21 H new ATOM 0 HD2 PRO A 117 2.294 14.460 27.738 1.00 0.02 H new ATOM 0 HD3 PRO A 117 1.833 15.295 26.267 1.00 0.02 H new ATOM 1246 N GLY A 118 6.941 15.337 25.210 1.00 21.24 N ATOM 1247 CA GLY A 118 8.326 15.064 25.361 1.00 32.20 C ATOM 1248 C GLY A 118 9.105 16.313 25.554 1.00 65.33 C ATOM 1249 O GLY A 118 9.303 16.772 26.680 1.00 42.22 O ATOM 0 H GLY A 118 6.616 15.374 24.244 1.00 21.24 H new ATOM 0 HA2 GLY A 118 8.477 14.403 26.214 1.00 32.20 H new ATOM 0 HA3 GLY A 118 8.693 14.537 24.480 1.00 32.20 H new ATOM 1253 N THR A 119 9.535 16.880 24.484 1.00 12.02 N ATOM 1254 CA THR A 119 10.303 18.075 24.552 1.00 4.12 C ATOM 1255 C THR A 119 9.504 19.205 23.963 1.00 44.43 C ATOM 1256 O THR A 119 9.440 19.339 22.753 1.00 33.31 O ATOM 1257 CB THR A 119 11.585 17.930 23.748 1.00 3.24 C ATOM 1258 OG1 THR A 119 12.097 16.599 23.930 1.00 30.41 O ATOM 1259 CG2 THR A 119 12.633 18.909 24.233 1.00 21.35 C ATOM 0 H THR A 119 9.367 16.532 23.540 1.00 12.02 H new ATOM 0 HA THR A 119 10.549 18.274 25.595 1.00 4.12 H new ATOM 0 HB THR A 119 11.365 18.128 22.699 1.00 3.24 H new ATOM 0 HG1 THR A 119 12.924 16.493 23.414 1.00 30.41 H new ATOM 0 HG21 THR A 119 13.543 18.789 23.645 1.00 21.35 H new ATOM 0 HG22 THR A 119 12.260 19.927 24.121 1.00 21.35 H new ATOM 0 HG23 THR A 119 12.852 18.717 25.283 1.00 21.35 H new ATOM 1267 N LYS A 120 8.832 19.955 24.826 1.00 71.53 N ATOM 1268 CA LYS A 120 8.097 21.174 24.444 1.00 54.42 C ATOM 1269 C LYS A 120 6.885 20.891 23.541 1.00 4.42 C ATOM 1270 O LYS A 120 6.261 21.821 23.036 1.00 62.51 O ATOM 1271 CB LYS A 120 9.050 22.174 23.759 1.00 24.01 C ATOM 1272 CG LYS A 120 10.300 22.500 24.569 1.00 12.43 C ATOM 1273 CD LYS A 120 9.931 23.146 25.905 1.00 10.11 C ATOM 1274 CE LYS A 120 11.153 23.556 26.716 1.00 11.11 C ATOM 1275 NZ LYS A 120 10.768 24.178 28.008 1.00 71.11 N ATOM 0 H LYS A 120 8.775 19.741 25.822 1.00 71.53 H new ATOM 0 HA LYS A 120 7.705 21.606 25.365 1.00 54.42 H new ATOM 0 HB2 LYS A 120 9.352 21.768 22.793 1.00 24.01 H new ATOM 0 HB3 LYS A 120 8.508 23.098 23.561 1.00 24.01 H new ATOM 0 HG2 LYS A 120 10.871 21.589 24.747 1.00 12.43 H new ATOM 0 HG3 LYS A 120 10.942 23.173 24.000 1.00 12.43 H new ATOM 0 HD2 LYS A 120 9.311 24.023 25.721 1.00 10.11 H new ATOM 0 HD3 LYS A 120 9.330 22.448 26.488 1.00 10.11 H new ATOM 0 HE2 LYS A 120 11.776 22.681 26.904 1.00 11.11 H new ATOM 0 HE3 LYS A 120 11.755 24.258 26.139 1.00 11.11 H new ATOM 0 HZ1 LYS A 120 11.625 24.445 28.534 1.00 71.11 H new ATOM 0 HZ2 LYS A 120 10.194 25.026 27.828 1.00 71.11 H new ATOM 0 HZ3 LYS A 120 10.215 23.499 28.569 1.00 71.11 H new ATOM 1289 N GLY A 121 6.531 19.640 23.380 1.00 40.43 N ATOM 1290 CA GLY A 121 5.460 19.307 22.492 1.00 41.42 C ATOM 1291 C GLY A 121 4.407 18.478 23.135 1.00 65.55 C ATOM 1292 O GLY A 121 4.744 17.504 23.767 1.00 71.23 O ATOM 0 H GLY A 121 6.968 18.847 23.850 1.00 40.43 H new ATOM 0 HA2 GLY A 121 5.011 20.225 22.114 1.00 41.42 H new ATOM 0 HA3 GLY A 121 5.862 18.771 21.632 1.00 41.42 H new ATOM 1296 N PRO A 122 3.104 18.867 22.951 1.00 74.32 N ATOM 1297 CA PRO A 122 1.895 18.221 23.528 1.00 62.12 C ATOM 1298 C PRO A 122 1.878 16.684 23.660 1.00 30.03 C ATOM 1299 O PRO A 122 1.196 16.179 24.546 1.00 71.12 O ATOM 1300 CB PRO A 122 0.793 18.670 22.589 1.00 53.04 C ATOM 1301 CG PRO A 122 1.193 20.040 22.190 1.00 55.13 C ATOM 1302 CD PRO A 122 2.703 20.057 22.154 1.00 62.12 C ATOM 0 HA PRO A 122 1.810 18.522 24.572 1.00 62.12 H new ATOM 0 HB2 PRO A 122 0.713 18.011 21.725 1.00 53.04 H new ATOM 0 HB3 PRO A 122 -0.178 18.667 23.084 1.00 53.04 H new ATOM 0 HG2 PRO A 122 0.780 20.295 21.214 1.00 55.13 H new ATOM 0 HG3 PRO A 122 0.814 20.776 22.899 1.00 55.13 H new ATOM 0 HD2 PRO A 122 3.077 19.996 21.132 1.00 62.12 H new ATOM 0 HD3 PRO A 122 3.101 20.976 22.584 1.00 62.12 H new ATOM 1310 N PHE A 123 2.571 15.947 22.782 1.00 23.00 N ATOM 1311 CA PHE A 123 2.630 14.470 22.883 1.00 23.25 C ATOM 1312 C PHE A 123 3.621 13.893 21.899 1.00 44.40 C ATOM 1313 O PHE A 123 4.101 14.618 21.033 1.00 32.34 O ATOM 1314 CB PHE A 123 1.226 13.778 22.747 1.00 41.50 C ATOM 1315 CG PHE A 123 0.423 14.077 21.488 1.00 73.52 C ATOM 1316 CD1 PHE A 123 -0.439 15.170 21.438 1.00 70.44 C ATOM 1317 CD2 PHE A 123 0.502 13.252 20.372 1.00 45.23 C ATOM 1318 CE1 PHE A 123 -1.187 15.429 20.314 1.00 30.11 C ATOM 1319 CE2 PHE A 123 -0.253 13.512 19.247 1.00 25.44 C ATOM 1320 CZ PHE A 123 -1.096 14.603 19.217 1.00 53.12 C ATOM 0 H PHE A 123 3.096 16.337 21.999 1.00 23.00 H new ATOM 0 HA PHE A 123 2.978 14.251 23.893 1.00 23.25 H new ATOM 0 HB2 PHE A 123 1.374 12.700 22.806 1.00 41.50 H new ATOM 0 HB3 PHE A 123 0.623 14.065 23.609 1.00 41.50 H new ATOM 0 HD1 PHE A 123 -0.521 15.823 22.294 1.00 70.44 H new ATOM 0 HD2 PHE A 123 1.162 12.397 20.386 1.00 45.23 H new ATOM 0 HE1 PHE A 123 -1.848 16.283 20.292 1.00 30.11 H new ATOM 0 HE2 PHE A 123 -0.184 12.860 18.389 1.00 25.44 H new ATOM 0 HZ PHE A 123 -1.684 14.809 18.334 1.00 53.12 H new ATOM 1330 N ASP A 124 3.940 12.610 22.057 1.00 55.33 N ATOM 1331 CA ASP A 124 4.826 11.867 21.145 1.00 25.41 C ATOM 1332 C ASP A 124 4.257 10.492 20.915 1.00 42.11 C ATOM 1333 O ASP A 124 4.316 9.635 21.778 1.00 21.11 O ATOM 1334 CB ASP A 124 6.268 11.711 21.685 1.00 42.34 C ATOM 1335 CG ASP A 124 7.174 12.890 21.439 1.00 51.21 C ATOM 1336 OD1 ASP A 124 7.748 12.993 20.340 1.00 10.42 O ATOM 1337 OD2 ASP A 124 7.399 13.707 22.363 1.00 75.33 O ATOM 0 H ASP A 124 3.589 12.044 22.830 1.00 55.33 H new ATOM 0 HA ASP A 124 4.880 12.444 20.222 1.00 25.41 H new ATOM 0 HB2 ASP A 124 6.220 11.528 22.758 1.00 42.34 H new ATOM 0 HB3 ASP A 124 6.716 10.827 21.231 1.00 42.34 H new ATOM 1342 N LEU A 125 3.717 10.269 19.774 1.00 1.41 N ATOM 1343 CA LEU A 125 3.117 8.994 19.479 1.00 71.05 C ATOM 1344 C LEU A 125 3.731 8.457 18.225 1.00 73.13 C ATOM 1345 O LEU A 125 3.739 9.140 17.207 1.00 1.34 O ATOM 1346 CB LEU A 125 1.618 9.156 19.316 1.00 3.10 C ATOM 1347 CG LEU A 125 0.728 8.367 20.281 1.00 60.40 C ATOM 1348 CD1 LEU A 125 0.955 6.871 20.132 1.00 33.24 C ATOM 1349 CD2 LEU A 125 0.943 8.811 21.722 1.00 52.45 C ATOM 0 H LEU A 125 3.671 10.949 19.015 1.00 1.41 H new ATOM 0 HA LEU A 125 3.295 8.295 20.296 1.00 71.05 H new ATOM 0 HB2 LEU A 125 1.378 10.214 19.420 1.00 3.10 H new ATOM 0 HB3 LEU A 125 1.354 8.868 18.298 1.00 3.10 H new ATOM 0 HG LEU A 125 -0.309 8.578 20.021 1.00 60.40 H new ATOM 0 HD11 LEU A 125 0.311 6.334 20.828 1.00 33.24 H new ATOM 0 HD12 LEU A 125 0.720 6.567 19.112 1.00 33.24 H new ATOM 0 HD13 LEU A 125 1.998 6.638 20.349 1.00 33.24 H new ATOM 0 HD21 LEU A 125 0.297 8.232 22.381 1.00 52.45 H new ATOM 0 HD22 LEU A 125 1.984 8.650 22.001 1.00 52.45 H new ATOM 0 HD23 LEU A 125 0.702 9.870 21.816 1.00 52.45 H new ATOM 1361 N TYR A 126 4.223 7.242 18.272 1.00 51.43 N ATOM 1362 CA TYR A 126 4.976 6.714 17.149 1.00 52.33 C ATOM 1363 C TYR A 126 5.178 5.227 17.246 1.00 5.21 C ATOM 1364 O TYR A 126 4.825 4.612 18.246 1.00 71.14 O ATOM 1365 CB TYR A 126 6.343 7.439 16.984 1.00 60.43 C ATOM 1366 CG TYR A 126 7.362 7.247 18.091 1.00 62.11 C ATOM 1367 CD1 TYR A 126 7.260 7.933 19.293 1.00 11.34 C ATOM 1368 CD2 TYR A 126 8.449 6.399 17.911 1.00 22.01 C ATOM 1369 CE1 TYR A 126 8.206 7.775 20.281 1.00 30.22 C ATOM 1370 CE2 TYR A 126 9.396 6.233 18.897 1.00 40.45 C ATOM 1371 CZ TYR A 126 9.271 6.923 20.079 1.00 12.21 C ATOM 1372 OH TYR A 126 10.225 6.765 21.069 1.00 20.34 O ATOM 0 H TYR A 126 4.120 6.605 19.062 1.00 51.43 H new ATOM 0 HA TYR A 126 4.376 6.907 16.260 1.00 52.33 H new ATOM 0 HB2 TYR A 126 6.792 7.106 16.048 1.00 60.43 H new ATOM 0 HB3 TYR A 126 6.150 8.507 16.883 1.00 60.43 H new ATOM 0 HD1 TYR A 126 6.427 8.600 19.456 1.00 11.34 H new ATOM 0 HD2 TYR A 126 8.553 5.860 16.981 1.00 22.01 H new ATOM 0 HE1 TYR A 126 8.114 8.317 21.211 1.00 30.22 H new ATOM 0 HE2 TYR A 126 10.231 5.565 18.743 1.00 40.45 H new ATOM 0 HH TYR A 126 10.907 6.129 20.768 1.00 20.34 H new ATOM 1382 N SER A 127 5.650 4.664 16.183 1.00 55.24 N ATOM 1383 CA SER A 127 6.052 3.290 16.121 1.00 13.02 C ATOM 1384 C SER A 127 7.501 3.251 15.624 1.00 10.12 C ATOM 1385 O SER A 127 7.945 4.176 14.909 1.00 11.23 O ATOM 1386 CB SER A 127 5.132 2.514 15.178 1.00 32.32 C ATOM 1387 OG SER A 127 5.462 1.146 15.125 1.00 21.15 O ATOM 0 H SER A 127 5.772 5.162 15.301 1.00 55.24 H new ATOM 0 HA SER A 127 5.983 2.824 17.104 1.00 13.02 H new ATOM 0 HB2 SER A 127 4.099 2.625 15.507 1.00 32.32 H new ATOM 0 HB3 SER A 127 5.195 2.941 14.177 1.00 32.32 H new ATOM 0 HG SER A 127 5.694 0.901 14.205 1.00 21.15 H new ATOM 1393 N LEU A 128 8.251 2.259 16.057 1.00 42.44 N ATOM 1394 CA LEU A 128 9.622 2.065 15.593 1.00 23.53 C ATOM 1395 C LEU A 128 9.631 1.627 14.112 1.00 13.15 C ATOM 1396 O LEU A 128 8.668 1.049 13.633 1.00 31.00 O ATOM 1397 CB LEU A 128 10.321 1.012 16.454 1.00 31.11 C ATOM 1398 CG LEU A 128 10.375 1.300 17.958 1.00 4.53 C ATOM 1399 CD1 LEU A 128 11.007 0.151 18.705 1.00 13.35 C ATOM 1400 CD2 LEU A 128 11.111 2.597 18.251 1.00 52.23 C ATOM 0 H LEU A 128 7.937 1.565 16.736 1.00 42.44 H new ATOM 0 HA LEU A 128 10.158 3.010 15.681 1.00 23.53 H new ATOM 0 HB2 LEU A 128 9.817 0.057 16.305 1.00 31.11 H new ATOM 0 HB3 LEU A 128 11.342 0.894 16.090 1.00 31.11 H new ATOM 0 HG LEU A 128 9.348 1.413 18.306 1.00 4.53 H new ATOM 0 HD11 LEU A 128 11.033 0.380 19.770 1.00 13.35 H new ATOM 0 HD12 LEU A 128 10.422 -0.754 18.543 1.00 13.35 H new ATOM 0 HD13 LEU A 128 12.023 -0.004 18.342 1.00 13.35 H new ATOM 0 HD21 LEU A 128 11.130 2.769 19.327 1.00 52.23 H new ATOM 0 HD22 LEU A 128 12.132 2.528 17.876 1.00 52.23 H new ATOM 0 HD23 LEU A 128 10.599 3.425 17.760 1.00 52.23 H new ATOM 1412 N GLY A 129 10.729 1.907 13.411 1.00 24.52 N ATOM 1413 CA GLY A 129 10.835 1.570 11.998 1.00 52.34 C ATOM 1414 C GLY A 129 10.996 0.094 11.733 1.00 40.01 C ATOM 1415 O GLY A 129 10.993 -0.728 12.658 1.00 1.12 O ATOM 0 H GLY A 129 11.553 2.365 13.800 1.00 24.52 H new ATOM 0 HA2 GLY A 129 9.944 1.927 11.481 1.00 52.34 H new ATOM 0 HA3 GLY A 129 11.686 2.101 11.571 1.00 52.34 H new ATOM 1419 N ALA A 130 11.203 -0.233 10.471 1.00 44.10 N ATOM 1420 CA ALA A 130 11.307 -1.610 9.989 1.00 0.11 C ATOM 1421 C ALA A 130 12.369 -2.464 10.696 1.00 72.14 C ATOM 1422 O ALA A 130 12.253 -3.695 10.730 1.00 33.32 O ATOM 1423 CB ALA A 130 11.532 -1.616 8.501 1.00 11.44 C ATOM 0 H ALA A 130 11.307 0.462 9.731 1.00 44.10 H new ATOM 0 HA ALA A 130 10.355 -2.081 10.235 1.00 0.11 H new ATOM 0 HB1 ALA A 130 11.609 -2.645 8.149 1.00 11.44 H new ATOM 0 HB2 ALA A 130 10.696 -1.124 8.005 1.00 11.44 H new ATOM 0 HB3 ALA A 130 12.455 -1.084 8.270 1.00 11.44 H new ATOM 1429 N ASP A 131 13.383 -1.841 11.270 1.00 23.22 N ATOM 1430 CA ASP A 131 14.429 -2.608 11.952 1.00 43.25 C ATOM 1431 C ASP A 131 14.130 -2.734 13.435 1.00 31.31 C ATOM 1432 O ASP A 131 14.817 -3.460 14.151 1.00 35.10 O ATOM 1433 CB ASP A 131 15.827 -2.000 11.755 1.00 31.42 C ATOM 1434 CG ASP A 131 16.022 -0.669 12.453 1.00 72.33 C ATOM 1435 OD1 ASP A 131 15.664 0.368 11.877 1.00 11.04 O ATOM 1436 OD2 ASP A 131 16.563 -0.641 13.565 1.00 12.40 O ATOM 0 H ASP A 131 13.511 -0.829 11.283 1.00 23.22 H new ATOM 0 HA ASP A 131 14.431 -3.599 11.498 1.00 43.25 H new ATOM 0 HB2 ASP A 131 16.574 -2.704 12.122 1.00 31.42 H new ATOM 0 HB3 ASP A 131 16.009 -1.870 10.688 1.00 31.42 H new ATOM 1441 N GLY A 132 13.098 -2.063 13.888 1.00 64.12 N ATOM 1442 CA GLY A 132 12.716 -2.152 15.276 1.00 21.00 C ATOM 1443 C GLY A 132 13.365 -1.099 16.136 1.00 22.45 C ATOM 1444 O GLY A 132 13.458 -1.256 17.351 1.00 63.24 O ATOM 0 H GLY A 132 12.511 -1.453 13.319 1.00 64.12 H new ATOM 0 HA2 GLY A 132 11.633 -2.060 15.355 1.00 21.00 H new ATOM 0 HA3 GLY A 132 12.981 -3.138 15.657 1.00 21.00 H new ATOM 1448 N LYS A 133 13.845 -0.046 15.520 1.00 71.53 N ATOM 1449 CA LYS A 133 14.437 1.043 16.248 1.00 63.21 C ATOM 1450 C LYS A 133 14.031 2.358 15.604 1.00 13.21 C ATOM 1451 O LYS A 133 13.761 2.402 14.395 1.00 14.24 O ATOM 1452 CB LYS A 133 15.961 0.910 16.321 1.00 4.41 C ATOM 1453 CG LYS A 133 16.593 1.854 17.322 1.00 21.42 C ATOM 1454 CD LYS A 133 18.089 1.682 17.409 1.00 64.43 C ATOM 1455 CE LYS A 133 18.666 2.542 18.520 1.00 13.40 C ATOM 1456 NZ LYS A 133 18.388 3.985 18.332 1.00 71.54 N ATOM 0 H LYS A 133 13.835 0.077 14.508 1.00 71.53 H new ATOM 0 HA LYS A 133 14.070 1.019 17.274 1.00 63.21 H new ATOM 0 HB2 LYS A 133 16.218 -0.116 16.586 1.00 4.41 H new ATOM 0 HB3 LYS A 133 16.384 1.100 15.334 1.00 4.41 H new ATOM 0 HG2 LYS A 133 16.364 2.882 17.042 1.00 21.42 H new ATOM 0 HG3 LYS A 133 16.153 1.685 18.305 1.00 21.42 H new ATOM 0 HD2 LYS A 133 18.329 0.635 17.591 1.00 64.43 H new ATOM 0 HD3 LYS A 133 18.547 1.953 16.458 1.00 64.43 H new ATOM 0 HE2 LYS A 133 18.253 2.219 19.475 1.00 13.40 H new ATOM 0 HE3 LYS A 133 19.744 2.388 18.570 1.00 13.40 H new ATOM 0 HZ1 LYS A 133 19.139 4.545 18.783 1.00 71.54 H new ATOM 0 HZ2 LYS A 133 18.357 4.203 17.316 1.00 71.54 H new ATOM 0 HZ3 LYS A 133 17.473 4.222 18.765 1.00 71.54 H new ATOM 1470 N GLU A 134 13.912 3.396 16.400 1.00 31.53 N ATOM 1471 CA GLU A 134 13.560 4.709 15.903 1.00 22.10 C ATOM 1472 C GLU A 134 14.761 5.359 15.199 1.00 50.10 C ATOM 1473 O GLU A 134 15.862 5.438 15.756 1.00 52.41 O ATOM 1474 CB GLU A 134 12.989 5.625 17.028 1.00 22.31 C ATOM 1475 CG GLU A 134 13.965 6.066 18.131 1.00 13.21 C ATOM 1476 CD GLU A 134 14.611 4.926 18.865 1.00 63.02 C ATOM 1477 OE1 GLU A 134 13.920 4.221 19.603 1.00 13.33 O ATOM 1478 OE2 GLU A 134 15.841 4.723 18.719 1.00 23.24 O ATOM 0 H GLU A 134 14.056 3.355 17.409 1.00 31.53 H new ATOM 0 HA GLU A 134 12.764 4.584 15.169 1.00 22.10 H new ATOM 0 HB2 GLU A 134 12.579 6.520 16.561 1.00 22.31 H new ATOM 0 HB3 GLU A 134 12.157 5.103 17.501 1.00 22.31 H new ATOM 0 HG2 GLU A 134 14.743 6.686 17.687 1.00 13.21 H new ATOM 0 HG3 GLU A 134 13.430 6.690 18.847 1.00 13.21 H new ATOM 1485 N GLY A 135 14.578 5.712 13.960 1.00 72.31 N ATOM 1486 CA GLY A 135 15.609 6.374 13.205 1.00 44.41 C ATOM 1487 C GLY A 135 15.004 7.267 12.170 1.00 54.33 C ATOM 1488 O GLY A 135 13.782 7.395 12.117 1.00 53.31 O ATOM 0 H GLY A 135 13.714 5.551 13.443 1.00 72.31 H new ATOM 0 HA2 GLY A 135 16.241 6.958 13.874 1.00 44.41 H new ATOM 0 HA3 GLY A 135 16.250 5.634 12.726 1.00 44.41 H new ATOM 1492 N GLY A 136 15.822 7.860 11.340 1.00 0.45 N ATOM 1493 CA GLY A 136 15.312 8.654 10.260 1.00 33.31 C ATOM 1494 C GLY A 136 15.698 7.992 8.973 1.00 45.20 C ATOM 1495 O GLY A 136 16.882 7.740 8.747 1.00 32.31 O ATOM 0 H GLY A 136 16.839 7.807 11.393 1.00 0.45 H new ATOM 0 HA2 GLY A 136 14.228 8.743 10.332 1.00 33.31 H new ATOM 0 HA3 GLY A 136 15.719 9.664 10.305 1.00 33.31 H new ATOM 1499 N SER A 137 14.734 7.758 8.117 1.00 24.30 N ATOM 1500 CA SER A 137 14.870 6.933 6.919 1.00 12.31 C ATOM 1501 C SER A 137 13.521 6.907 6.201 1.00 72.44 C ATOM 1502 O SER A 137 12.611 7.630 6.591 1.00 10.32 O ATOM 1503 CB SER A 137 15.249 5.477 7.289 1.00 71.34 C ATOM 1504 OG SER A 137 16.548 5.344 7.857 1.00 33.51 O ATOM 0 H SER A 137 13.797 8.145 8.230 1.00 24.30 H new ATOM 0 HA SER A 137 15.653 7.353 6.288 1.00 12.31 H new ATOM 0 HB2 SER A 137 14.514 5.089 7.994 1.00 71.34 H new ATOM 0 HB3 SER A 137 15.190 4.858 6.394 1.00 71.34 H new ATOM 0 HG SER A 137 16.980 6.223 7.896 1.00 33.51 H new ATOM 1510 N ASP A 138 13.430 6.164 5.125 1.00 2.12 N ATOM 1511 CA ASP A 138 12.145 5.915 4.478 1.00 40.50 C ATOM 1512 C ASP A 138 11.369 4.817 5.218 1.00 70.21 C ATOM 1513 O ASP A 138 10.366 5.103 5.849 1.00 12.25 O ATOM 1514 CB ASP A 138 12.283 5.642 2.950 1.00 5.12 C ATOM 1515 CG ASP A 138 13.315 4.595 2.579 1.00 4.53 C ATOM 1516 OD1 ASP A 138 13.060 3.405 2.721 1.00 62.04 O ATOM 1517 OD2 ASP A 138 14.428 4.965 2.134 1.00 75.25 O ATOM 0 H ASP A 138 14.226 5.716 4.671 1.00 2.12 H new ATOM 0 HA ASP A 138 11.557 6.830 4.548 1.00 40.50 H new ATOM 0 HB2 ASP A 138 11.313 5.329 2.563 1.00 5.12 H new ATOM 0 HB3 ASP A 138 12.539 6.576 2.450 1.00 5.12 H new ATOM 1522 N ASN A 139 11.845 3.588 5.183 1.00 61.21 N ATOM 1523 CA ASN A 139 11.160 2.496 5.886 1.00 73.14 C ATOM 1524 C ASN A 139 11.771 2.243 7.264 1.00 24.14 C ATOM 1525 O ASN A 139 11.138 1.662 8.143 1.00 34.53 O ATOM 1526 CB ASN A 139 11.176 1.186 5.069 1.00 30.11 C ATOM 1527 CG ASN A 139 12.565 0.570 4.916 1.00 62.41 C ATOM 1528 OD1 ASN A 139 12.935 -0.278 5.827 1.00 75.40 O flip ATOM 1529 ND2 ASN A 139 13.288 0.852 3.966 1.00 41.52 N flip ATOM 0 H ASN A 139 12.691 3.312 4.685 1.00 61.21 H new ATOM 0 HA ASN A 139 10.125 2.815 6.012 1.00 73.14 H new ATOM 0 HB2 ASN A 139 10.519 0.461 5.550 1.00 30.11 H new ATOM 0 HB3 ASN A 139 10.765 1.382 4.079 1.00 30.11 H new ATOM 0 HD21 ASN A 139 12.971 1.522 3.265 1.00 41.52 H new ATOM 0 HD22 ASN A 139 14.206 0.417 3.877 1.00 41.52 H new ATOM 1536 N ASP A 140 13.001 2.667 7.452 1.00 33.10 N ATOM 1537 CA ASP A 140 13.706 2.436 8.724 1.00 11.45 C ATOM 1538 C ASP A 140 13.532 3.616 9.668 1.00 45.44 C ATOM 1539 O ASP A 140 14.258 3.757 10.651 1.00 34.10 O ATOM 1540 CB ASP A 140 15.203 2.173 8.495 1.00 32.10 C ATOM 1541 CG ASP A 140 15.500 0.893 7.750 1.00 74.23 C ATOM 1542 OD1 ASP A 140 15.517 -0.176 8.371 1.00 0.04 O ATOM 1543 OD2 ASP A 140 15.762 0.937 6.526 1.00 73.53 O ATOM 0 H ASP A 140 13.544 3.173 6.753 1.00 33.10 H new ATOM 0 HA ASP A 140 13.263 1.551 9.180 1.00 11.45 H new ATOM 0 HB2 ASP A 140 15.627 3.010 7.940 1.00 32.10 H new ATOM 0 HB3 ASP A 140 15.707 2.143 9.461 1.00 32.10 H new ATOM 1548 N ALA A 141 12.585 4.459 9.361 1.00 62.04 N ATOM 1549 CA ALA A 141 12.296 5.622 10.167 1.00 41.21 C ATOM 1550 C ALA A 141 11.256 5.323 11.188 1.00 41.54 C ATOM 1551 O ALA A 141 10.470 4.405 11.016 1.00 64.11 O ATOM 1552 CB ALA A 141 11.788 6.746 9.315 1.00 25.01 C ATOM 0 H ALA A 141 11.986 4.362 8.541 1.00 62.04 H new ATOM 0 HA ALA A 141 13.227 5.907 10.656 1.00 41.21 H new ATOM 0 HB1 ALA A 141 11.577 7.612 9.943 1.00 25.01 H new ATOM 0 HB2 ALA A 141 12.542 7.011 8.574 1.00 25.01 H new ATOM 0 HB3 ALA A 141 10.875 6.434 8.808 1.00 25.01 H new ATOM 1558 N ASP A 142 11.256 6.085 12.249 1.00 22.34 N ATOM 1559 CA ASP A 142 10.200 5.992 13.212 1.00 31.34 C ATOM 1560 C ASP A 142 9.045 6.760 12.643 1.00 41.23 C ATOM 1561 O ASP A 142 9.209 7.896 12.172 1.00 12.30 O ATOM 1562 CB ASP A 142 10.599 6.554 14.603 1.00 43.15 C ATOM 1563 CG ASP A 142 10.897 8.055 14.647 1.00 73.51 C ATOM 1564 OD1 ASP A 142 11.992 8.476 14.208 1.00 64.43 O ATOM 1565 OD2 ASP A 142 10.072 8.838 15.165 1.00 34.12 O ATOM 0 H ASP A 142 11.976 6.775 12.465 1.00 22.34 H new ATOM 0 HA ASP A 142 9.950 4.945 13.386 1.00 31.34 H new ATOM 0 HB2 ASP A 142 9.794 6.340 15.306 1.00 43.15 H new ATOM 0 HB3 ASP A 142 11.480 6.016 14.954 1.00 43.15 H new ATOM 1570 N ILE A 143 7.925 6.152 12.593 1.00 14.05 N ATOM 1571 CA ILE A 143 6.783 6.807 12.058 1.00 52.34 C ATOM 1572 C ILE A 143 5.982 7.375 13.203 1.00 2.41 C ATOM 1573 O ILE A 143 5.618 6.656 14.130 1.00 11.10 O ATOM 1574 CB ILE A 143 5.982 5.888 11.058 1.00 50.53 C ATOM 1575 CG1 ILE A 143 5.516 4.547 11.674 1.00 63.54 C ATOM 1576 CG2 ILE A 143 6.834 5.600 9.830 1.00 4.22 C ATOM 1577 CD1 ILE A 143 4.227 4.615 12.459 1.00 44.54 C ATOM 0 H ILE A 143 7.766 5.197 12.916 1.00 14.05 H new ATOM 0 HA ILE A 143 7.079 7.646 11.428 1.00 52.34 H new ATOM 0 HB ILE A 143 5.082 6.443 10.793 1.00 50.53 H new ATOM 0 HG12 ILE A 143 5.397 3.819 10.872 1.00 63.54 H new ATOM 0 HG13 ILE A 143 6.303 4.173 12.329 1.00 63.54 H new ATOM 0 HG21 ILE A 143 6.277 4.965 9.141 1.00 4.22 H new ATOM 0 HG22 ILE A 143 7.087 6.537 9.335 1.00 4.22 H new ATOM 0 HG23 ILE A 143 7.749 5.091 10.133 1.00 4.22 H new ATOM 0 HD11 ILE A 143 3.986 3.626 12.849 1.00 44.54 H new ATOM 0 HD12 ILE A 143 4.342 5.314 13.287 1.00 44.54 H new ATOM 0 HD13 ILE A 143 3.422 4.954 11.807 1.00 44.54 H new ATOM 1589 N GLY A 144 5.779 8.662 13.197 1.00 34.23 N ATOM 1590 CA GLY A 144 5.180 9.275 14.332 1.00 32.45 C ATOM 1591 C GLY A 144 4.230 10.375 14.018 1.00 51.44 C ATOM 1592 O GLY A 144 4.343 11.055 13.001 1.00 22.14 O ATOM 0 H GLY A 144 6.017 9.292 12.430 1.00 34.23 H new ATOM 0 HA2 GLY A 144 4.653 8.511 14.904 1.00 32.45 H new ATOM 0 HA3 GLY A 144 5.969 9.667 14.974 1.00 32.45 H new ATOM 1596 N ASN A 145 3.309 10.545 14.907 1.00 63.11 N ATOM 1597 CA ASN A 145 2.297 11.552 14.845 1.00 44.11 C ATOM 1598 C ASN A 145 2.279 12.248 16.153 1.00 61.25 C ATOM 1599 O ASN A 145 2.033 11.618 17.192 1.00 34.31 O ATOM 1600 CB ASN A 145 0.932 10.927 14.606 1.00 10.41 C ATOM 1601 CG ASN A 145 -0.223 11.890 14.847 1.00 3.23 C ATOM 1602 OD1 ASN A 145 -0.671 12.588 13.941 1.00 32.13 O ATOM 1603 ND2 ASN A 145 -0.713 11.915 16.074 1.00 30.41 N ATOM 0 H ASN A 145 3.236 9.958 15.738 1.00 63.11 H new ATOM 0 HA ASN A 145 2.512 12.239 14.027 1.00 44.11 H new ATOM 0 HB2 ASN A 145 0.882 10.561 13.581 1.00 10.41 H new ATOM 0 HB3 ASN A 145 0.817 10.062 15.259 1.00 10.41 H new ATOM 0 HD21 ASN A 145 -1.494 12.531 16.299 1.00 30.41 H new ATOM 0 HD22 ASN A 145 -0.310 11.318 16.796 1.00 30.41 H new ATOM 1610 N TRP A 146 2.515 13.507 16.142 1.00 62.00 N ATOM 1611 CA TRP A 146 2.548 14.240 17.350 1.00 11.44 C ATOM 1612 C TRP A 146 2.364 15.696 17.121 1.00 51.14 C ATOM 1613 O TRP A 146 2.206 16.160 15.988 1.00 24.21 O ATOM 1614 CB TRP A 146 3.842 13.974 18.140 1.00 53.52 C ATOM 1615 CG TRP A 146 5.129 14.149 17.386 1.00 71.34 C ATOM 1616 CD1 TRP A 146 5.642 15.296 16.848 1.00 61.11 C ATOM 1617 CD2 TRP A 146 6.085 13.129 17.138 1.00 71.21 C ATOM 1618 NE1 TRP A 146 6.852 15.033 16.259 1.00 11.02 N ATOM 1619 CE2 TRP A 146 7.145 13.707 16.426 1.00 42.32 C ATOM 1620 CE3 TRP A 146 6.138 11.774 17.446 1.00 75.03 C ATOM 1621 CZ2 TRP A 146 8.249 12.975 16.019 1.00 42.21 C ATOM 1622 CZ3 TRP A 146 7.235 11.049 17.045 1.00 71.32 C ATOM 1623 CH2 TRP A 146 8.277 11.650 16.339 1.00 74.20 C ATOM 0 H TRP A 146 2.690 14.056 15.300 1.00 62.00 H new ATOM 0 HA TRP A 146 1.708 13.890 17.950 1.00 11.44 H new ATOM 0 HB2 TRP A 146 3.858 14.639 19.004 1.00 53.52 H new ATOM 0 HB3 TRP A 146 3.806 12.954 18.523 1.00 53.52 H new ATOM 0 HD1 TRP A 146 5.166 16.265 16.882 1.00 61.11 H new ATOM 0 HE1 TRP A 146 7.438 15.714 15.776 1.00 11.02 H new ATOM 0 HE3 TRP A 146 5.334 11.301 17.989 1.00 75.03 H new ATOM 0 HZ2 TRP A 146 9.056 13.436 15.469 1.00 42.21 H new ATOM 0 HZ3 TRP A 146 7.291 9.996 17.281 1.00 71.32 H new ATOM 0 HH2 TRP A 146 9.125 11.052 16.039 1.00 74.20 H new ATOM 1634 N ASP A 147 2.337 16.397 18.181 1.00 33.33 N ATOM 1635 CA ASP A 147 2.329 17.808 18.162 1.00 74.53 C ATOM 1636 C ASP A 147 3.514 18.239 18.915 1.00 60.32 C ATOM 1637 O ASP A 147 3.666 17.876 20.086 1.00 15.42 O ATOM 1638 CB ASP A 147 1.041 18.417 18.721 1.00 42.24 C ATOM 1639 CG ASP A 147 -0.044 18.522 17.677 1.00 11.11 C ATOM 1640 OD1 ASP A 147 -0.045 19.518 16.914 1.00 53.12 O ATOM 1641 OD2 ASP A 147 -0.904 17.630 17.582 1.00 40.40 O ATOM 0 H ASP A 147 2.319 15.996 19.119 1.00 33.33 H new ATOM 0 HA ASP A 147 2.363 18.164 17.132 1.00 74.53 H new ATOM 0 HB2 ASP A 147 0.685 17.808 19.552 1.00 42.24 H new ATOM 0 HB3 ASP A 147 1.254 19.408 19.121 1.00 42.24 H new ATOM 1646 N ASN A 148 4.390 18.910 18.231 1.00 21.21 N ATOM 1647 CA ASN A 148 5.639 19.358 18.779 1.00 71.23 C ATOM 1648 C ASN A 148 6.108 20.502 17.924 1.00 3.32 C ATOM 1649 O ASN A 148 5.875 21.671 18.288 1.00 44.31 O ATOM 1650 CB ASN A 148 6.684 18.229 18.738 1.00 44.20 C ATOM 1651 CG ASN A 148 7.979 18.618 19.415 1.00 22.40 C ATOM 1652 OD1 ASN A 148 8.858 19.208 18.812 1.00 3.25 O ATOM 1653 ND2 ASN A 148 8.126 18.232 20.640 1.00 51.34 N ATOM 1654 OXT ASN A 148 6.620 20.238 16.814 1.00 0.00 O ATOM 0 H ASN A 148 4.255 19.168 17.254 1.00 21.21 H new ATOM 0 HA ASN A 148 5.510 19.661 19.818 1.00 71.23 H new ATOM 0 HB2 ASN A 148 6.276 17.342 19.223 1.00 44.20 H new ATOM 0 HB3 ASN A 148 6.885 17.961 17.701 1.00 44.20 H new ATOM 0 HD21 ASN A 148 8.999 18.419 21.132 1.00 51.34 H new ATOM 0 HD22 ASN A 148 7.369 17.740 21.114 1.00 51.34 H new TER 1661 ASN A 148