USER MOD reduce.3.24.130724 H: found=0, std=0, add=923, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 920 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 27 TYR OH : rot 30:sc= 0 USER MOD Set 1.2: A 120 SER OG : rot -39:sc= -0.163 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 THR OG1 : rot 119:sc= 0.289 USER MOD Single : A 11 SER OG : rot 180:sc= 0 USER MOD Single : A 13 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 MET CE :methyl 158:sc= -1.21 (180deg=-1.59) USER MOD Single : A 19 HIS : no HD1:sc= -2.38! K(o=-2.4!,f=-0.54) USER MOD Single : A 21 THR OG1 : rot 71:sc= 0.516 USER MOD Single : A 24 GLN : amide:sc= -0.0538 K(o=-0.054,f=-0.61) USER MOD Single : A 30 THR OG1 : rot 180:sc= 0 USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 TYR OH : rot 180:sc= 0 USER MOD Single : A 52 THR OG1 : rot -130:sc= -0.238 USER MOD Single : A 54 GLN : amide:sc= -0.365 K(o=-0.37,f=-1.2) USER MOD Single : A 55 ASN : amide:sc= -0.0266 K(o=-0.027,f=-1.6) USER MOD Single : A 56 MET CE :methyl -165:sc= -0.302 (180deg=-0.657) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 70 GLN : amide:sc= -1.04 K(o=-1,f=-0.35) USER MOD Single : A 72 SER OG : rot -55:sc= 0.00513 USER MOD Single : A 74 TYR OH : rot 180:sc= 0 USER MOD Single : A 77 THR OG1 : rot 180:sc= -0.12 USER MOD Single : A 83 THR OG1 : rot -138:sc= -0.0319 USER MOD Single : A 84 THR OG1 : rot 180:sc= -0.0184 USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 THR OG1 : rot -130:sc= 0.0327 USER MOD Single : A 105 LYS NZ :NH3+ -176:sc= -0.492 (180deg=-0.548) USER MOD Single : A 118 THR OG1 : rot 180:sc= 0 USER MOD Single : A 125 ASN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 0.747 -1.488 -1.939 1.00 60.50 N ATOM 2 CA MET A 1 1.592 -0.317 -1.738 1.00 61.04 C ATOM 3 C MET A 1 3.032 -0.729 -1.450 1.00 44.32 C ATOM 4 O MET A 1 3.437 -0.834 -0.292 1.00 64.22 O ATOM 5 CB MET A 1 1.053 0.536 -0.588 1.00 44.15 C ATOM 6 CG MET A 1 1.794 1.851 -0.408 1.00 45.03 C ATOM 7 SD MET A 1 1.193 2.800 1.002 1.00 30.31 S ATOM 8 CE MET A 1 1.999 4.374 0.720 1.00 42.02 C ATOM 0 H1 MET A 1 -0.228 -1.183 -2.133 1.00 60.50 H new ATOM 0 H2 MET A 1 1.104 -2.040 -2.745 1.00 60.50 H new ATOM 0 H3 MET A 1 0.761 -2.077 -1.082 1.00 60.50 H new ATOM 0 HA MET A 1 1.578 0.272 -2.655 1.00 61.04 H new ATOM 0 HB2 MET A 1 -0.002 0.744 -0.764 1.00 44.15 H new ATOM 0 HB3 MET A 1 1.115 -0.036 0.338 1.00 44.15 H new ATOM 0 HG2 MET A 1 2.857 1.649 -0.279 1.00 45.03 H new ATOM 0 HG3 MET A 1 1.691 2.449 -1.314 1.00 45.03 H new ATOM 0 HE1 MET A 1 1.725 5.070 1.512 1.00 42.02 H new ATOM 0 HE2 MET A 1 3.080 4.234 0.718 1.00 42.02 H new ATOM 0 HE3 MET A 1 1.684 4.777 -0.242 1.00 42.02 H new ATOM 18 N ILE A 2 3.800 -0.960 -2.510 1.00 2.13 N ATOM 19 CA ILE A 2 5.195 -1.359 -2.369 1.00 70.11 C ATOM 20 C ILE A 2 6.019 -0.257 -1.712 1.00 53.21 C ATOM 21 O ILE A 2 6.333 0.755 -2.339 1.00 71.02 O ATOM 22 CB ILE A 2 5.821 -1.709 -3.732 1.00 54.33 C ATOM 23 CG1 ILE A 2 5.029 -2.830 -4.409 1.00 25.35 C ATOM 24 CG2 ILE A 2 7.278 -2.111 -3.559 1.00 14.01 C ATOM 25 CD1 ILE A 2 5.024 -4.124 -3.624 1.00 52.40 C ATOM 0 H ILE A 2 3.480 -0.878 -3.475 1.00 2.13 H new ATOM 0 HA ILE A 2 5.207 -2.245 -1.734 1.00 70.11 H new ATOM 0 HB ILE A 2 5.782 -0.826 -4.370 1.00 54.33 H new ATOM 0 HG12 ILE A 2 4.001 -2.500 -4.557 1.00 25.35 H new ATOM 0 HG13 ILE A 2 5.449 -3.015 -5.397 1.00 25.35 H new ATOM 0 HG21 ILE A 2 7.706 -2.355 -4.531 1.00 14.01 H new ATOM 0 HG22 ILE A 2 7.833 -1.285 -3.115 1.00 14.01 H new ATOM 0 HG23 ILE A 2 7.340 -2.982 -2.906 1.00 14.01 H new ATOM 0 HD11 ILE A 2 4.445 -4.874 -4.162 1.00 52.40 H new ATOM 0 HD12 ILE A 2 6.047 -4.477 -3.499 1.00 52.40 H new ATOM 0 HD13 ILE A 2 4.576 -3.954 -2.645 1.00 52.40 H new ATOM 37 N ARG A 3 6.367 -0.461 -0.446 1.00 12.32 N ATOM 38 CA ARG A 3 7.155 0.516 0.297 1.00 60.54 C ATOM 39 C ARG A 3 8.648 0.245 0.135 1.00 40.01 C ATOM 40 O ARG A 3 9.442 1.169 -0.049 1.00 33.42 O ATOM 41 CB ARG A 3 6.778 0.486 1.779 1.00 60.11 C ATOM 42 CG ARG A 3 6.872 1.842 2.459 1.00 45.24 C ATOM 43 CD ARG A 3 5.791 2.790 1.964 1.00 61.14 C ATOM 44 NE ARG A 3 4.584 2.719 2.783 1.00 62.01 N ATOM 45 CZ ARG A 3 4.514 3.174 4.029 1.00 41.01 C ATOM 46 NH1 ARG A 3 5.576 3.730 4.596 1.00 52.32 N ATOM 47 NH2 ARG A 3 3.380 3.074 4.710 1.00 30.44 N ATOM 0 H ARG A 3 6.116 -1.294 0.087 1.00 12.32 H new ATOM 0 HA ARG A 3 6.936 1.505 -0.106 1.00 60.54 H new ATOM 0 HB2 ARG A 3 5.760 0.109 1.879 1.00 60.11 H new ATOM 0 HB3 ARG A 3 7.431 -0.217 2.297 1.00 60.11 H new ATOM 0 HG2 ARG A 3 6.781 1.716 3.538 1.00 45.24 H new ATOM 0 HG3 ARG A 3 7.853 2.277 2.271 1.00 45.24 H new ATOM 0 HD2 ARG A 3 6.174 3.811 1.970 1.00 61.14 H new ATOM 0 HD3 ARG A 3 5.543 2.549 0.931 1.00 61.14 H new ATOM 0 HE ARG A 3 3.749 2.297 2.376 1.00 62.01 H new ATOM 0 HH11 ARG A 3 6.449 3.809 4.075 1.00 52.32 H new ATOM 0 HH12 ARG A 3 5.519 4.079 5.553 1.00 52.32 H new ATOM 0 HH21 ARG A 3 2.561 2.647 4.277 1.00 30.44 H new ATOM 0 HH22 ARG A 3 3.327 3.424 5.667 1.00 30.44 H new ATOM 61 N THR A 4 9.025 -1.028 0.205 1.00 34.11 N ATOM 62 CA THR A 4 10.422 -1.421 0.068 1.00 15.55 C ATOM 63 C THR A 4 10.545 -2.805 -0.557 1.00 70.04 C ATOM 64 O THR A 4 9.626 -3.620 -0.470 1.00 22.25 O ATOM 65 CB THR A 4 11.141 -1.419 1.430 1.00 22.23 C ATOM 66 OG1 THR A 4 10.366 -2.139 2.395 1.00 15.21 O ATOM 67 CG2 THR A 4 11.374 0.003 1.918 1.00 70.10 C ATOM 0 H THR A 4 8.382 -1.805 0.356 1.00 34.11 H new ATOM 0 HA THR A 4 10.895 -0.688 -0.585 1.00 15.55 H new ATOM 0 HB THR A 4 12.108 -1.906 1.305 1.00 22.23 H new ATOM 0 HG1 THR A 4 10.883 -2.902 2.726 1.00 15.21 H new ATOM 0 HG21 THR A 4 11.883 -0.022 2.882 1.00 70.10 H new ATOM 0 HG22 THR A 4 11.990 0.539 1.196 1.00 70.10 H new ATOM 0 HG23 THR A 4 10.416 0.512 2.027 1.00 70.10 H new ATOM 75 N ILE A 5 11.685 -3.065 -1.188 1.00 43.40 N ATOM 76 CA ILE A 5 11.929 -4.352 -1.827 1.00 14.03 C ATOM 77 C ILE A 5 13.324 -4.873 -1.500 1.00 42.44 C ATOM 78 O ILE A 5 14.270 -4.097 -1.355 1.00 10.11 O ATOM 79 CB ILE A 5 11.772 -4.260 -3.356 1.00 72.21 C ATOM 80 CG1 ILE A 5 10.409 -3.666 -3.716 1.00 53.31 C ATOM 81 CG2 ILE A 5 11.941 -5.633 -3.989 1.00 73.31 C ATOM 82 CD1 ILE A 5 10.258 -3.346 -5.187 1.00 23.01 C ATOM 0 H ILE A 5 12.455 -2.401 -1.270 1.00 43.40 H new ATOM 0 HA ILE A 5 11.185 -5.045 -1.435 1.00 14.03 H new ATOM 0 HB ILE A 5 12.548 -3.603 -3.747 1.00 72.21 H new ATOM 0 HG12 ILE A 5 9.627 -4.367 -3.423 1.00 53.31 H new ATOM 0 HG13 ILE A 5 10.254 -2.756 -3.137 1.00 53.31 H new ATOM 0 HG21 ILE A 5 11.827 -5.552 -5.070 1.00 73.31 H new ATOM 0 HG22 ILE A 5 12.933 -6.021 -3.757 1.00 73.31 H new ATOM 0 HG23 ILE A 5 11.184 -6.311 -3.595 1.00 73.31 H new ATOM 0 HD11 ILE A 5 9.268 -2.929 -5.369 1.00 23.01 H new ATOM 0 HD12 ILE A 5 11.017 -2.621 -5.481 1.00 23.01 H new ATOM 0 HD13 ILE A 5 10.381 -4.257 -5.772 1.00 23.01 H new ATOM 94 N LEU A 6 13.447 -6.191 -1.388 1.00 54.43 N ATOM 95 CA LEU A 6 14.728 -6.817 -1.081 1.00 40.41 C ATOM 96 C LEU A 6 15.094 -7.855 -2.137 1.00 34.24 C ATOM 97 O LEU A 6 14.288 -8.721 -2.475 1.00 35.33 O ATOM 98 CB LEU A 6 14.680 -7.472 0.300 1.00 14.23 C ATOM 99 CG LEU A 6 16.001 -7.516 1.069 1.00 13.40 C ATOM 100 CD1 LEU A 6 17.063 -8.247 0.263 1.00 20.35 C ATOM 101 CD2 LEU A 6 16.465 -6.108 1.413 1.00 52.35 C ATOM 0 H LEU A 6 12.675 -6.847 -1.505 1.00 54.43 H new ATOM 0 HA LEU A 6 15.493 -6.041 -1.081 1.00 40.41 H new ATOM 0 HB2 LEU A 6 13.947 -6.940 0.907 1.00 14.23 H new ATOM 0 HB3 LEU A 6 14.317 -8.493 0.183 1.00 14.23 H new ATOM 0 HG LEU A 6 15.840 -8.061 1.999 1.00 13.40 H new ATOM 0 HD11 LEU A 6 17.996 -8.269 0.826 1.00 20.35 H new ATOM 0 HD12 LEU A 6 16.733 -9.267 0.068 1.00 20.35 H new ATOM 0 HD13 LEU A 6 17.222 -7.730 -0.683 1.00 20.35 H new ATOM 0 HD21 LEU A 6 17.406 -6.159 1.960 1.00 52.35 H new ATOM 0 HD22 LEU A 6 16.609 -5.538 0.495 1.00 52.35 H new ATOM 0 HD23 LEU A 6 15.712 -5.618 2.031 1.00 52.35 H new ATOM 113 N ALA A 7 16.315 -7.763 -2.652 1.00 2.01 N ATOM 114 CA ALA A 7 16.789 -8.697 -3.666 1.00 3.05 C ATOM 115 C ALA A 7 18.130 -9.305 -3.268 1.00 10.12 C ATOM 116 O ALA A 7 19.086 -8.586 -2.976 1.00 11.32 O ATOM 117 CB ALA A 7 16.903 -8.000 -5.013 1.00 74.34 C ATOM 0 H ALA A 7 16.994 -7.051 -2.384 1.00 2.01 H new ATOM 0 HA ALA A 7 16.063 -9.506 -3.748 1.00 3.05 H new ATOM 0 HB1 ALA A 7 17.258 -8.709 -5.761 1.00 74.34 H new ATOM 0 HB2 ALA A 7 15.926 -7.619 -5.309 1.00 74.34 H new ATOM 0 HB3 ALA A 7 17.607 -7.172 -4.936 1.00 74.34 H new ATOM 123 N ILE A 8 18.193 -10.632 -3.258 1.00 32.12 N ATOM 124 CA ILE A 8 19.417 -11.336 -2.896 1.00 10.30 C ATOM 125 C ILE A 8 19.862 -12.275 -4.012 1.00 53.31 C ATOM 126 O ILE A 8 19.122 -13.173 -4.413 1.00 32.30 O ATOM 127 CB ILE A 8 19.238 -12.147 -1.599 1.00 11.30 C ATOM 128 CG1 ILE A 8 18.669 -11.258 -0.491 1.00 25.35 C ATOM 129 CG2 ILE A 8 20.563 -12.757 -1.169 1.00 23.13 C ATOM 130 CD1 ILE A 8 17.227 -11.564 -0.151 1.00 44.21 C ATOM 0 H ILE A 8 17.411 -11.241 -3.496 1.00 32.12 H new ATOM 0 HA ILE A 8 20.182 -10.576 -2.737 1.00 10.30 H new ATOM 0 HB ILE A 8 18.533 -12.956 -1.788 1.00 11.30 H new ATOM 0 HG12 ILE A 8 19.278 -11.374 0.406 1.00 25.35 H new ATOM 0 HG13 ILE A 8 18.748 -10.215 -0.797 1.00 25.35 H new ATOM 0 HG21 ILE A 8 20.420 -13.327 -0.251 1.00 23.13 H new ATOM 0 HG22 ILE A 8 20.931 -13.419 -1.953 1.00 23.13 H new ATOM 0 HG23 ILE A 8 21.289 -11.963 -0.994 1.00 23.13 H new ATOM 0 HD11 ILE A 8 16.890 -10.896 0.642 1.00 44.21 H new ATOM 0 HD12 ILE A 8 16.606 -11.420 -1.035 1.00 44.21 H new ATOM 0 HD13 ILE A 8 17.144 -12.597 0.186 1.00 44.21 H new ATOM 142 N ASP A 9 21.075 -12.061 -4.509 1.00 22.44 N ATOM 143 CA ASP A 9 21.621 -12.891 -5.577 1.00 51.50 C ATOM 144 C ASP A 9 23.122 -13.092 -5.396 1.00 1.02 C ATOM 145 O ASP A 9 23.757 -12.411 -4.590 1.00 70.20 O ATOM 146 CB ASP A 9 21.340 -12.254 -6.939 1.00 71.53 C ATOM 147 CG ASP A 9 21.416 -13.258 -8.073 1.00 43.44 C ATOM 148 OD1 ASP A 9 22.458 -13.298 -8.761 1.00 24.42 O ATOM 149 OD2 ASP A 9 20.434 -14.003 -8.273 1.00 43.52 O ATOM 0 H ASP A 9 21.699 -11.320 -4.190 1.00 22.44 H new ATOM 0 HA ASP A 9 21.135 -13.865 -5.532 1.00 51.50 H new ATOM 0 HB2 ASP A 9 20.350 -11.798 -6.927 1.00 71.53 H new ATOM 0 HB3 ASP A 9 22.058 -11.453 -7.118 1.00 71.53 H new ATOM 154 N ASP A 10 23.683 -14.031 -6.149 1.00 71.42 N ATOM 155 CA ASP A 10 25.110 -14.323 -6.072 1.00 13.11 C ATOM 156 C ASP A 10 25.902 -13.412 -7.004 1.00 53.34 C ATOM 157 O ASP A 10 26.851 -12.750 -6.584 1.00 32.33 O ATOM 158 CB ASP A 10 25.373 -15.788 -6.425 1.00 54.42 C ATOM 159 CG ASP A 10 24.975 -16.733 -5.309 1.00 12.23 C ATOM 160 OD1 ASP A 10 25.339 -16.463 -4.145 1.00 54.43 O ATOM 161 OD2 ASP A 10 24.300 -17.743 -5.598 1.00 63.45 O ATOM 0 H ASP A 10 23.171 -14.604 -6.820 1.00 71.42 H new ATOM 0 HA ASP A 10 25.438 -14.140 -5.049 1.00 13.11 H new ATOM 0 HB2 ASP A 10 24.821 -16.045 -7.329 1.00 54.42 H new ATOM 0 HB3 ASP A 10 26.432 -15.920 -6.649 1.00 54.42 H new ATOM 166 N SER A 11 25.506 -13.383 -8.273 1.00 34.31 N ATOM 167 CA SER A 11 26.182 -12.557 -9.266 1.00 75.25 C ATOM 168 C SER A 11 26.020 -11.075 -8.941 1.00 61.35 C ATOM 169 O SER A 11 24.905 -10.584 -8.770 1.00 32.32 O ATOM 170 CB SER A 11 25.629 -12.848 -10.663 1.00 42.23 C ATOM 171 OG SER A 11 26.164 -11.950 -11.620 1.00 43.12 O ATOM 0 H SER A 11 24.720 -13.922 -8.637 1.00 34.31 H new ATOM 0 HA SER A 11 27.244 -12.802 -9.245 1.00 75.25 H new ATOM 0 HB2 SER A 11 25.870 -13.873 -10.947 1.00 42.23 H new ATOM 0 HB3 SER A 11 24.542 -12.767 -10.651 1.00 42.23 H new ATOM 0 HG SER A 11 25.797 -12.158 -12.505 1.00 43.12 H new ATOM 177 N ALA A 12 27.142 -10.369 -8.859 1.00 5.54 N ATOM 178 CA ALA A 12 27.127 -8.943 -8.556 1.00 52.33 C ATOM 179 C ALA A 12 26.332 -8.168 -9.603 1.00 23.44 C ATOM 180 O ALA A 12 25.579 -7.251 -9.273 1.00 25.21 O ATOM 181 CB ALA A 12 28.548 -8.407 -8.467 1.00 11.53 C ATOM 0 H ALA A 12 28.073 -10.761 -8.998 1.00 5.54 H new ATOM 0 HA ALA A 12 26.638 -8.807 -7.591 1.00 52.33 H new ATOM 0 HB1 ALA A 12 28.521 -7.341 -8.240 1.00 11.53 H new ATOM 0 HB2 ALA A 12 29.086 -8.932 -7.678 1.00 11.53 H new ATOM 0 HB3 ALA A 12 29.056 -8.563 -9.419 1.00 11.53 H new ATOM 187 N THR A 13 26.505 -8.543 -10.867 1.00 13.34 N ATOM 188 CA THR A 13 25.805 -7.882 -11.961 1.00 64.34 C ATOM 189 C THR A 13 24.295 -7.952 -11.771 1.00 34.53 C ATOM 190 O THR A 13 23.590 -6.960 -11.953 1.00 20.14 O ATOM 191 CB THR A 13 26.170 -8.510 -13.320 1.00 55.23 C ATOM 192 OG1 THR A 13 27.589 -8.479 -13.510 1.00 15.13 O ATOM 193 CG2 THR A 13 25.485 -7.769 -14.459 1.00 74.51 C ATOM 0 H THR A 13 27.123 -9.300 -11.158 1.00 13.34 H new ATOM 0 HA THR A 13 26.120 -6.839 -11.953 1.00 64.34 H new ATOM 0 HB THR A 13 25.827 -9.545 -13.321 1.00 55.23 H new ATOM 0 HG1 THR A 13 27.812 -8.882 -14.375 1.00 15.13 H new ATOM 0 HG21 THR A 13 25.757 -8.230 -15.409 1.00 74.51 H new ATOM 0 HG22 THR A 13 24.404 -7.819 -14.328 1.00 74.51 H new ATOM 0 HG23 THR A 13 25.802 -6.726 -14.458 1.00 74.51 H new ATOM 201 N MET A 14 23.803 -9.131 -11.402 1.00 65.24 N ATOM 202 CA MET A 14 22.375 -9.329 -11.185 1.00 61.30 C ATOM 203 C MET A 14 21.853 -8.384 -10.108 1.00 52.42 C ATOM 204 O MET A 14 20.913 -7.622 -10.340 1.00 63.51 O ATOM 205 CB MET A 14 22.094 -10.779 -10.786 1.00 65.54 C ATOM 206 CG MET A 14 20.648 -11.197 -10.993 1.00 73.53 C ATOM 207 SD MET A 14 20.465 -12.976 -11.227 1.00 42.02 S ATOM 208 CE MET A 14 18.704 -13.173 -10.967 1.00 40.33 C ATOM 0 H MET A 14 24.372 -9.963 -11.247 1.00 65.24 H new ATOM 0 HA MET A 14 21.857 -9.110 -12.119 1.00 61.30 H new ATOM 0 HB2 MET A 14 22.741 -11.438 -11.365 1.00 65.54 H new ATOM 0 HB3 MET A 14 22.357 -10.916 -9.737 1.00 65.54 H new ATOM 0 HG2 MET A 14 20.057 -10.885 -10.132 1.00 73.53 H new ATOM 0 HG3 MET A 14 20.244 -10.677 -11.862 1.00 73.53 H new ATOM 0 HE1 MET A 14 18.367 -14.094 -11.443 1.00 40.33 H new ATOM 0 HE2 MET A 14 18.497 -13.220 -9.898 1.00 40.33 H new ATOM 0 HE3 MET A 14 18.175 -12.325 -11.402 1.00 40.33 H new ATOM 218 N ARG A 15 22.467 -8.437 -8.931 1.00 22.30 N ATOM 219 CA ARG A 15 22.063 -7.586 -7.818 1.00 74.45 C ATOM 220 C ARG A 15 22.062 -6.117 -8.230 1.00 74.12 C ATOM 221 O ARG A 15 21.213 -5.340 -7.793 1.00 61.30 O ATOM 222 CB ARG A 15 22.997 -7.792 -6.625 1.00 43.01 C ATOM 223 CG ARG A 15 22.838 -9.146 -5.952 1.00 54.45 C ATOM 224 CD ARG A 15 23.285 -9.102 -4.500 1.00 12.03 C ATOM 225 NE ARG A 15 24.604 -8.493 -4.351 1.00 61.41 N ATOM 226 CZ ARG A 15 25.735 -9.097 -4.699 1.00 22.03 C ATOM 227 NH1 ARG A 15 25.708 -10.319 -5.213 1.00 14.13 N ATOM 228 NH2 ARG A 15 26.897 -8.478 -4.533 1.00 1.01 N ATOM 0 H ARG A 15 23.247 -9.061 -8.723 1.00 22.30 H new ATOM 0 HA ARG A 15 21.050 -7.865 -7.529 1.00 74.45 H new ATOM 0 HB2 ARG A 15 24.029 -7.681 -6.959 1.00 43.01 H new ATOM 0 HB3 ARG A 15 22.813 -7.007 -5.891 1.00 43.01 H new ATOM 0 HG2 ARG A 15 21.795 -9.459 -6.003 1.00 54.45 H new ATOM 0 HG3 ARG A 15 23.422 -9.892 -6.491 1.00 54.45 H new ATOM 0 HD2 ARG A 15 22.558 -8.540 -3.914 1.00 12.03 H new ATOM 0 HD3 ARG A 15 23.306 -10.114 -4.096 1.00 12.03 H new ATOM 0 HE ARG A 15 24.660 -7.553 -3.959 1.00 61.41 H new ATOM 0 HH11 ARG A 15 24.817 -10.798 -5.342 1.00 14.13 H new ATOM 0 HH12 ARG A 15 26.578 -10.780 -5.479 1.00 14.13 H new ATOM 0 HH21 ARG A 15 26.922 -7.538 -4.138 1.00 1.01 H new ATOM 0 HH22 ARG A 15 27.765 -8.942 -4.800 1.00 1.01 H new ATOM 242 N ALA A 16 23.018 -5.744 -9.073 1.00 45.55 N ATOM 243 CA ALA A 16 23.127 -4.369 -9.545 1.00 41.32 C ATOM 244 C ALA A 16 22.020 -4.041 -10.542 1.00 22.23 C ATOM 245 O ALA A 16 21.439 -2.956 -10.505 1.00 50.31 O ATOM 246 CB ALA A 16 24.492 -4.133 -10.174 1.00 5.44 C ATOM 0 H ALA A 16 23.729 -6.375 -9.444 1.00 45.55 H new ATOM 0 HA ALA A 16 23.015 -3.707 -8.686 1.00 41.32 H new ATOM 0 HB1 ALA A 16 24.559 -3.102 -10.522 1.00 5.44 H new ATOM 0 HB2 ALA A 16 25.271 -4.317 -9.434 1.00 5.44 H new ATOM 0 HB3 ALA A 16 24.626 -4.810 -11.018 1.00 5.44 H new ATOM 252 N LEU A 17 21.733 -4.985 -11.431 1.00 64.04 N ATOM 253 CA LEU A 17 20.696 -4.796 -12.439 1.00 72.43 C ATOM 254 C LEU A 17 19.316 -4.728 -11.794 1.00 35.13 C ATOM 255 O LEU A 17 18.607 -3.729 -11.923 1.00 33.02 O ATOM 256 CB LEU A 17 20.737 -5.934 -13.462 1.00 5.35 C ATOM 257 CG LEU A 17 19.593 -5.967 -14.475 1.00 60.41 C ATOM 258 CD1 LEU A 17 19.777 -4.882 -15.524 1.00 61.14 C ATOM 259 CD2 LEU A 17 19.503 -7.337 -15.132 1.00 34.10 C ATOM 0 H LEU A 17 22.204 -5.889 -11.474 1.00 64.04 H new ATOM 0 HA LEU A 17 20.887 -3.851 -12.948 1.00 72.43 H new ATOM 0 HB2 LEU A 17 21.678 -5.871 -14.009 1.00 5.35 H new ATOM 0 HB3 LEU A 17 20.745 -6.881 -12.922 1.00 5.35 H new ATOM 0 HG LEU A 17 18.659 -5.777 -13.946 1.00 60.41 H new ATOM 0 HD11 LEU A 17 18.953 -4.921 -16.236 1.00 61.14 H new ATOM 0 HD12 LEU A 17 19.791 -3.906 -15.039 1.00 61.14 H new ATOM 0 HD13 LEU A 17 20.719 -5.040 -16.050 1.00 61.14 H new ATOM 0 HD21 LEU A 17 18.683 -7.343 -15.850 1.00 34.10 H new ATOM 0 HD22 LEU A 17 20.438 -7.556 -15.647 1.00 34.10 H new ATOM 0 HD23 LEU A 17 19.323 -8.095 -14.370 1.00 34.10 H new ATOM 271 N LEU A 18 18.941 -5.795 -11.097 1.00 34.20 N ATOM 272 CA LEU A 18 17.646 -5.856 -10.428 1.00 75.03 C ATOM 273 C LEU A 18 17.426 -4.626 -9.554 1.00 11.23 C ATOM 274 O LEU A 18 16.310 -4.116 -9.450 1.00 53.00 O ATOM 275 CB LEU A 18 17.547 -7.124 -9.578 1.00 64.14 C ATOM 276 CG LEU A 18 17.842 -8.440 -10.300 1.00 15.14 C ATOM 277 CD1 LEU A 18 17.977 -9.578 -9.300 1.00 4.21 C ATOM 278 CD2 LEU A 18 16.751 -8.747 -11.315 1.00 35.10 C ATOM 0 H LEU A 18 19.515 -6.630 -10.980 1.00 34.20 H new ATOM 0 HA LEU A 18 16.871 -5.878 -11.194 1.00 75.03 H new ATOM 0 HB2 LEU A 18 18.237 -7.030 -8.739 1.00 64.14 H new ATOM 0 HB3 LEU A 18 16.542 -7.179 -9.159 1.00 64.14 H new ATOM 0 HG LEU A 18 18.788 -8.337 -10.832 1.00 15.14 H new ATOM 0 HD11 LEU A 18 18.187 -10.506 -9.831 1.00 4.21 H new ATOM 0 HD12 LEU A 18 18.793 -9.362 -8.611 1.00 4.21 H new ATOM 0 HD13 LEU A 18 17.048 -9.682 -8.740 1.00 4.21 H new ATOM 0 HD21 LEU A 18 16.977 -9.687 -11.819 1.00 35.10 H new ATOM 0 HD22 LEU A 18 15.792 -8.831 -10.804 1.00 35.10 H new ATOM 0 HD23 LEU A 18 16.701 -7.944 -12.050 1.00 35.10 H new ATOM 290 N HIS A 19 18.499 -4.152 -8.928 1.00 15.04 N ATOM 291 CA HIS A 19 18.424 -2.979 -8.064 1.00 13.01 C ATOM 292 C HIS A 19 18.021 -1.742 -8.861 1.00 72.11 C ATOM 293 O HIS A 19 17.217 -0.931 -8.403 1.00 11.05 O ATOM 294 CB HIS A 19 19.767 -2.740 -7.375 1.00 24.44 C ATOM 295 CG HIS A 19 19.799 -1.499 -6.537 1.00 31.32 C ATOM 296 ND1 HIS A 19 20.779 -0.536 -6.655 1.00 33.32 N ATOM 297 CD2 HIS A 19 18.962 -1.066 -5.565 1.00 42.42 C ATOM 298 CE1 HIS A 19 20.544 0.435 -5.791 1.00 4.21 C ATOM 299 NE2 HIS A 19 19.447 0.139 -5.118 1.00 24.44 N ATOM 0 H HIS A 19 19.430 -4.562 -9.003 1.00 15.04 H new ATOM 0 HA HIS A 19 17.663 -3.165 -7.306 1.00 13.01 H new ATOM 0 HB2 HIS A 19 20.001 -3.599 -6.746 1.00 24.44 H new ATOM 0 HB3 HIS A 19 20.548 -2.677 -8.132 1.00 24.44 H new ATOM 0 HD2 HIS A 19 18.078 -1.573 -5.208 1.00 42.42 H new ATOM 0 HE1 HIS A 19 21.147 1.321 -5.658 1.00 4.21 H new ATOM 0 HE2 HIS A 19 19.028 0.712 -4.385 1.00 24.44 H new ATOM 307 N ALA A 20 18.586 -1.604 -10.056 1.00 75.52 N ATOM 308 CA ALA A 20 18.284 -0.468 -10.917 1.00 42.42 C ATOM 309 C ALA A 20 16.908 -0.614 -11.558 1.00 1.42 C ATOM 310 O ALA A 20 16.142 0.347 -11.634 1.00 54.33 O ATOM 311 CB ALA A 20 19.354 -0.319 -11.989 1.00 1.23 C ATOM 0 H ALA A 20 19.256 -2.265 -10.450 1.00 75.52 H new ATOM 0 HA ALA A 20 18.275 0.431 -10.300 1.00 42.42 H new ATOM 0 HB1 ALA A 20 19.116 0.534 -12.625 1.00 1.23 H new ATOM 0 HB2 ALA A 20 20.323 -0.159 -11.516 1.00 1.23 H new ATOM 0 HB3 ALA A 20 19.391 -1.224 -12.595 1.00 1.23 H new ATOM 317 N THR A 21 16.600 -1.822 -12.018 1.00 72.13 N ATOM 318 CA THR A 21 15.317 -2.093 -12.654 1.00 72.41 C ATOM 319 C THR A 21 14.160 -1.627 -11.778 1.00 54.03 C ATOM 320 O THR A 21 13.198 -1.031 -12.267 1.00 64.50 O ATOM 321 CB THR A 21 15.145 -3.594 -12.955 1.00 63.33 C ATOM 322 OG1 THR A 21 16.411 -4.174 -13.291 1.00 74.23 O ATOM 323 CG2 THR A 21 14.164 -3.808 -14.098 1.00 21.20 C ATOM 0 H THR A 21 17.222 -2.629 -11.962 1.00 72.13 H new ATOM 0 HA THR A 21 15.306 -1.538 -13.592 1.00 72.41 H new ATOM 0 HB THR A 21 14.749 -4.078 -12.062 1.00 63.33 H new ATOM 0 HG1 THR A 21 16.973 -4.219 -12.489 1.00 74.23 H new ATOM 0 HG21 THR A 21 14.059 -4.875 -14.292 1.00 21.20 H new ATOM 0 HG22 THR A 21 13.194 -3.391 -13.828 1.00 21.20 H new ATOM 0 HG23 THR A 21 14.535 -3.311 -14.994 1.00 21.20 H new ATOM 331 N LEU A 22 14.258 -1.900 -10.482 1.00 75.10 N ATOM 332 CA LEU A 22 13.218 -1.507 -9.537 1.00 22.33 C ATOM 333 C LEU A 22 13.411 -0.063 -9.084 1.00 62.51 C ATOM 334 O LEU A 22 12.443 0.666 -8.873 1.00 71.11 O ATOM 335 CB LEU A 22 13.226 -2.439 -8.324 1.00 33.32 C ATOM 336 CG LEU A 22 12.410 -3.726 -8.461 1.00 4.44 C ATOM 337 CD1 LEU A 22 12.799 -4.721 -7.379 1.00 30.51 C ATOM 338 CD2 LEU A 22 10.921 -3.422 -8.398 1.00 54.13 C ATOM 0 H LEU A 22 15.046 -2.392 -10.061 1.00 75.10 H new ATOM 0 HA LEU A 22 12.255 -1.584 -10.041 1.00 22.33 H new ATOM 0 HB2 LEU A 22 14.259 -2.709 -8.105 1.00 33.32 H new ATOM 0 HB3 LEU A 22 12.852 -1.885 -7.463 1.00 33.32 H new ATOM 0 HG LEU A 22 12.629 -4.171 -9.432 1.00 4.44 H new ATOM 0 HD11 LEU A 22 12.209 -5.630 -7.492 1.00 30.51 H new ATOM 0 HD12 LEU A 22 13.858 -4.962 -7.470 1.00 30.51 H new ATOM 0 HD13 LEU A 22 12.609 -4.285 -6.398 1.00 30.51 H new ATOM 0 HD21 LEU A 22 10.356 -4.349 -8.497 1.00 54.13 H new ATOM 0 HD22 LEU A 22 10.685 -2.954 -7.442 1.00 54.13 H new ATOM 0 HD23 LEU A 22 10.653 -2.745 -9.209 1.00 54.13 H new ATOM 350 N ALA A 23 14.668 0.343 -8.939 1.00 63.31 N ATOM 351 CA ALA A 23 14.988 1.700 -8.516 1.00 45.31 C ATOM 352 C ALA A 23 14.409 2.728 -9.483 1.00 65.40 C ATOM 353 O ALA A 23 13.707 3.651 -9.073 1.00 74.13 O ATOM 354 CB ALA A 23 16.495 1.875 -8.398 1.00 23.33 C ATOM 0 H ALA A 23 15.481 -0.249 -9.108 1.00 63.31 H new ATOM 0 HA ALA A 23 14.536 1.865 -7.538 1.00 45.31 H new ATOM 0 HB1 ALA A 23 16.719 2.894 -8.081 1.00 23.33 H new ATOM 0 HB2 ALA A 23 16.886 1.172 -7.663 1.00 23.33 H new ATOM 0 HB3 ALA A 23 16.960 1.685 -9.365 1.00 23.33 H new ATOM 360 N GLN A 24 14.710 2.560 -10.767 1.00 3.32 N ATOM 361 CA GLN A 24 14.220 3.475 -11.791 1.00 61.12 C ATOM 362 C GLN A 24 12.699 3.577 -11.747 1.00 0.22 C ATOM 363 O GLN A 24 12.131 4.637 -12.007 1.00 12.44 O ATOM 364 CB GLN A 24 14.672 3.011 -13.177 1.00 54.21 C ATOM 365 CG GLN A 24 16.180 3.041 -13.367 1.00 54.33 C ATOM 366 CD GLN A 24 16.740 4.450 -13.363 1.00 24.32 C ATOM 367 OE1 GLN A 24 16.115 5.381 -13.870 1.00 13.10 O ATOM 368 NE2 GLN A 24 17.926 4.613 -12.788 1.00 44.02 N ATOM 0 H GLN A 24 15.290 1.800 -11.122 1.00 3.32 H new ATOM 0 HA GLN A 24 14.638 4.462 -11.591 1.00 61.12 H new ATOM 0 HB2 GLN A 24 14.313 1.996 -13.346 1.00 54.21 H new ATOM 0 HB3 GLN A 24 14.206 3.644 -13.933 1.00 54.21 H new ATOM 0 HG2 GLN A 24 16.654 2.463 -12.574 1.00 54.33 H new ATOM 0 HG3 GLN A 24 16.434 2.556 -14.310 1.00 54.33 H new ATOM 0 HE21 GLN A 24 18.409 3.813 -12.380 1.00 44.02 H new ATOM 0 HE22 GLN A 24 18.354 5.538 -12.754 1.00 44.02 H new ATOM 377 N ALA A 25 12.046 2.468 -11.416 1.00 53.12 N ATOM 378 CA ALA A 25 10.591 2.434 -11.336 1.00 73.33 C ATOM 379 C ALA A 25 10.085 3.280 -10.173 1.00 54.45 C ATOM 380 O ALA A 25 8.925 3.690 -10.150 1.00 33.24 O ATOM 381 CB ALA A 25 10.104 0.999 -11.198 1.00 74.11 C ATOM 0 H ALA A 25 12.501 1.581 -11.199 1.00 53.12 H new ATOM 0 HA ALA A 25 10.191 2.855 -12.258 1.00 73.33 H new ATOM 0 HB1 ALA A 25 9.016 0.988 -11.139 1.00 74.11 H new ATOM 0 HB2 ALA A 25 10.426 0.420 -12.064 1.00 74.11 H new ATOM 0 HB3 ALA A 25 10.521 0.559 -10.292 1.00 74.11 H new ATOM 387 N GLY A 26 10.963 3.539 -9.209 1.00 51.22 N ATOM 388 CA GLY A 26 10.586 4.335 -8.056 1.00 55.31 C ATOM 389 C GLY A 26 10.629 3.542 -6.765 1.00 12.41 C ATOM 390 O GLY A 26 10.954 4.082 -5.707 1.00 44.33 O ATOM 0 H GLY A 26 11.929 3.212 -9.206 1.00 51.22 H new ATOM 0 HA2 GLY A 26 11.255 5.191 -7.975 1.00 55.31 H new ATOM 0 HA3 GLY A 26 9.580 4.729 -8.203 1.00 55.31 H new ATOM 394 N TYR A 27 10.298 2.259 -6.850 1.00 23.34 N ATOM 395 CA TYR A 27 10.297 1.391 -5.678 1.00 32.11 C ATOM 396 C TYR A 27 11.625 1.479 -4.933 1.00 65.22 C ATOM 397 O TYR A 27 12.656 1.812 -5.518 1.00 34.02 O ATOM 398 CB TYR A 27 10.025 -0.057 -6.090 1.00 1.11 C ATOM 399 CG TYR A 27 8.811 -0.216 -6.977 1.00 64.43 C ATOM 400 CD1 TYR A 27 8.939 -0.648 -8.292 1.00 10.22 C ATOM 401 CD2 TYR A 27 7.537 0.064 -6.501 1.00 35.44 C ATOM 402 CE1 TYR A 27 7.833 -0.794 -9.106 1.00 72.01 C ATOM 403 CE2 TYR A 27 6.424 -0.081 -7.307 1.00 65.24 C ATOM 404 CZ TYR A 27 6.578 -0.510 -8.609 1.00 52.24 C ATOM 405 OH TYR A 27 5.473 -0.656 -9.417 1.00 43.41 O ATOM 0 H TYR A 27 10.027 1.797 -7.718 1.00 23.34 H new ATOM 0 HA TYR A 27 9.504 1.727 -5.010 1.00 32.11 H new ATOM 0 HB2 TYR A 27 10.899 -0.448 -6.611 1.00 1.11 H new ATOM 0 HB3 TYR A 27 9.891 -0.662 -5.193 1.00 1.11 H new ATOM 0 HD1 TYR A 27 9.920 -0.873 -8.684 1.00 10.22 H new ATOM 0 HD2 TYR A 27 7.414 0.401 -5.482 1.00 35.44 H new ATOM 0 HE1 TYR A 27 7.950 -1.129 -10.126 1.00 72.01 H new ATOM 0 HE2 TYR A 27 5.440 0.140 -6.920 1.00 65.24 H new ATOM 0 HH TYR A 27 5.638 -1.367 -10.071 1.00 43.41 H new ATOM 415 N GLU A 28 11.592 1.176 -3.639 1.00 42.50 N ATOM 416 CA GLU A 28 12.793 1.221 -2.814 1.00 4.33 C ATOM 417 C GLU A 28 13.407 -0.169 -2.669 1.00 54.43 C ATOM 418 O GLU A 28 13.260 -0.820 -1.635 1.00 2.42 O ATOM 419 CB GLU A 28 12.469 1.794 -1.432 1.00 73.52 C ATOM 420 CG GLU A 28 13.699 2.196 -0.636 1.00 15.51 C ATOM 421 CD GLU A 28 14.257 3.540 -1.065 1.00 32.43 C ATOM 422 OE1 GLU A 28 13.492 4.343 -1.639 1.00 65.25 O ATOM 423 OE2 GLU A 28 15.457 3.787 -0.826 1.00 1.30 O ATOM 0 H GLU A 28 10.747 0.897 -3.140 1.00 42.50 H new ATOM 0 HA GLU A 28 13.517 1.869 -3.308 1.00 4.33 H new ATOM 0 HB2 GLU A 28 11.823 2.664 -1.551 1.00 73.52 H new ATOM 0 HB3 GLU A 28 11.905 1.054 -0.864 1.00 73.52 H new ATOM 0 HG2 GLU A 28 13.446 2.233 0.423 1.00 15.51 H new ATOM 0 HG3 GLU A 28 14.469 1.433 -0.753 1.00 15.51 H new ATOM 430 N VAL A 29 14.094 -0.617 -3.715 1.00 73.40 N ATOM 431 CA VAL A 29 14.730 -1.929 -3.706 1.00 31.22 C ATOM 432 C VAL A 29 16.138 -1.853 -3.127 1.00 1.13 C ATOM 433 O VAL A 29 16.856 -0.874 -3.335 1.00 54.11 O ATOM 434 CB VAL A 29 14.801 -2.528 -5.123 1.00 21.41 C ATOM 435 CG1 VAL A 29 15.496 -1.567 -6.075 1.00 53.11 C ATOM 436 CG2 VAL A 29 15.512 -3.873 -5.097 1.00 41.03 C ATOM 0 H VAL A 29 14.224 -0.091 -4.579 1.00 73.40 H new ATOM 0 HA VAL A 29 14.116 -2.574 -3.077 1.00 31.22 H new ATOM 0 HB VAL A 29 13.785 -2.686 -5.483 1.00 21.41 H new ATOM 0 HG11 VAL A 29 15.537 -2.008 -7.071 1.00 53.11 H new ATOM 0 HG12 VAL A 29 14.941 -0.630 -6.115 1.00 53.11 H new ATOM 0 HG13 VAL A 29 16.509 -1.374 -5.722 1.00 53.11 H new ATOM 0 HG21 VAL A 29 15.553 -4.282 -6.106 1.00 41.03 H new ATOM 0 HG22 VAL A 29 16.525 -3.742 -4.717 1.00 41.03 H new ATOM 0 HG23 VAL A 29 14.968 -4.560 -4.449 1.00 41.03 H new ATOM 446 N THR A 30 16.530 -2.894 -2.398 1.00 14.42 N ATOM 447 CA THR A 30 17.852 -2.945 -1.787 1.00 50.04 C ATOM 448 C THR A 30 18.441 -4.349 -1.868 1.00 54.22 C ATOM 449 O THR A 30 17.719 -5.342 -1.778 1.00 55.25 O ATOM 450 CB THR A 30 17.807 -2.503 -0.312 1.00 65.34 C ATOM 451 OG1 THR A 30 17.208 -1.207 -0.207 1.00 31.30 O ATOM 452 CG2 THR A 30 19.206 -2.471 0.285 1.00 1.22 C ATOM 0 H THR A 30 15.950 -3.713 -2.217 1.00 14.42 H new ATOM 0 HA THR A 30 18.485 -2.256 -2.345 1.00 50.04 H new ATOM 0 HB THR A 30 17.208 -3.225 0.243 1.00 65.34 H new ATOM 0 HG1 THR A 30 17.182 -0.934 0.734 1.00 31.30 H new ATOM 0 HG21 THR A 30 19.150 -2.156 1.327 1.00 1.22 H new ATOM 0 HG22 THR A 30 19.648 -3.466 0.230 1.00 1.22 H new ATOM 0 HG23 THR A 30 19.824 -1.768 -0.274 1.00 1.22 H new ATOM 460 N VAL A 31 19.757 -4.425 -2.037 1.00 51.25 N ATOM 461 CA VAL A 31 20.443 -5.708 -2.128 1.00 42.04 C ATOM 462 C VAL A 31 21.123 -6.062 -0.811 1.00 31.34 C ATOM 463 O VAL A 31 21.691 -5.199 -0.142 1.00 31.52 O ATOM 464 CB VAL A 31 21.497 -5.703 -3.252 1.00 0.53 C ATOM 465 CG1 VAL A 31 20.855 -5.347 -4.584 1.00 64.33 C ATOM 466 CG2 VAL A 31 22.624 -4.737 -2.919 1.00 45.12 C ATOM 0 H VAL A 31 20.369 -3.613 -2.114 1.00 51.25 H new ATOM 0 HA VAL A 31 19.684 -6.457 -2.355 1.00 42.04 H new ATOM 0 HB VAL A 31 21.919 -6.704 -3.336 1.00 0.53 H new ATOM 0 HG11 VAL A 31 21.614 -5.348 -5.366 1.00 64.33 H new ATOM 0 HG12 VAL A 31 20.085 -6.080 -4.824 1.00 64.33 H new ATOM 0 HG13 VAL A 31 20.404 -4.357 -4.518 1.00 64.33 H new ATOM 0 HG21 VAL A 31 23.360 -4.746 -3.723 1.00 45.12 H new ATOM 0 HG22 VAL A 31 22.220 -3.731 -2.808 1.00 45.12 H new ATOM 0 HG23 VAL A 31 23.101 -5.042 -1.987 1.00 45.12 H new ATOM 476 N ALA A 32 21.061 -7.338 -0.443 1.00 70.14 N ATOM 477 CA ALA A 32 21.673 -7.808 0.793 1.00 12.44 C ATOM 478 C ALA A 32 22.973 -8.553 0.514 1.00 5.11 C ATOM 479 O ALA A 32 23.420 -8.635 -0.630 1.00 15.21 O ATOM 480 CB ALA A 32 20.704 -8.700 1.556 1.00 43.32 C ATOM 0 H ALA A 32 20.593 -8.065 -0.984 1.00 70.14 H new ATOM 0 HA ALA A 32 21.909 -6.938 1.406 1.00 12.44 H new ATOM 0 HB1 ALA A 32 21.174 -9.044 2.477 1.00 43.32 H new ATOM 0 HB2 ALA A 32 19.803 -8.136 1.797 1.00 43.32 H new ATOM 0 HB3 ALA A 32 20.440 -9.560 0.941 1.00 43.32 H new ATOM 486 N ALA A 33 23.578 -9.094 1.567 1.00 73.22 N ATOM 487 CA ALA A 33 24.827 -9.834 1.434 1.00 13.20 C ATOM 488 C ALA A 33 24.564 -11.307 1.143 1.00 72.40 C ATOM 489 O ALA A 33 25.306 -11.944 0.396 1.00 65.43 O ATOM 490 CB ALA A 33 25.665 -9.684 2.695 1.00 62.22 C ATOM 0 H ALA A 33 23.223 -9.034 2.521 1.00 73.22 H new ATOM 0 HA ALA A 33 25.380 -9.418 0.592 1.00 13.20 H new ATOM 0 HB1 ALA A 33 26.595 -10.241 2.582 1.00 62.22 H new ATOM 0 HB2 ALA A 33 25.891 -8.630 2.858 1.00 62.22 H new ATOM 0 HB3 ALA A 33 25.110 -10.073 3.549 1.00 62.22 H new ATOM 496 N ASP A 34 23.504 -11.843 1.738 1.00 31.11 N ATOM 497 CA ASP A 34 23.143 -13.242 1.542 1.00 31.42 C ATOM 498 C ASP A 34 21.643 -13.448 1.729 1.00 52.22 C ATOM 499 O ASP A 34 20.946 -12.576 2.247 1.00 62.13 O ATOM 500 CB ASP A 34 23.917 -14.132 2.516 1.00 21.11 C ATOM 501 CG ASP A 34 24.129 -13.469 3.863 1.00 41.23 C ATOM 502 OD1 ASP A 34 23.409 -13.825 4.820 1.00 44.44 O ATOM 503 OD2 ASP A 34 25.015 -12.595 3.960 1.00 3.41 O ATOM 0 H ASP A 34 22.880 -11.330 2.360 1.00 31.11 H new ATOM 0 HA ASP A 34 23.405 -13.519 0.521 1.00 31.42 H new ATOM 0 HB2 ASP A 34 23.376 -15.068 2.656 1.00 21.11 H new ATOM 0 HB3 ASP A 34 24.885 -14.385 2.082 1.00 21.11 H new ATOM 508 N GLY A 35 21.152 -14.607 1.302 1.00 74.35 N ATOM 509 CA GLY A 35 19.737 -14.906 1.429 1.00 1.31 C ATOM 510 C GLY A 35 19.234 -14.733 2.848 1.00 12.34 C ATOM 511 O GLY A 35 18.094 -14.323 3.063 1.00 35.32 O ATOM 0 H GLY A 35 21.709 -15.345 0.870 1.00 74.35 H new ATOM 0 HA2 GLY A 35 19.170 -14.255 0.764 1.00 1.31 H new ATOM 0 HA3 GLY A 35 19.555 -15.930 1.104 1.00 1.31 H new ATOM 515 N GLU A 36 20.086 -15.047 3.819 1.00 12.14 N ATOM 516 CA GLU A 36 19.719 -14.926 5.225 1.00 11.14 C ATOM 517 C GLU A 36 19.783 -13.471 5.681 1.00 23.03 C ATOM 518 O GLU A 36 18.962 -13.023 6.481 1.00 23.32 O ATOM 519 CB GLU A 36 20.642 -15.785 6.092 1.00 3.31 C ATOM 520 CG GLU A 36 20.500 -15.520 7.581 1.00 15.45 C ATOM 521 CD GLU A 36 19.088 -15.756 8.083 1.00 23.04 C ATOM 522 OE1 GLU A 36 18.794 -15.362 9.231 1.00 31.05 O ATOM 523 OE2 GLU A 36 18.279 -16.335 7.329 1.00 11.22 O ATOM 0 H GLU A 36 21.034 -15.387 3.658 1.00 12.14 H new ATOM 0 HA GLU A 36 18.694 -15.279 5.338 1.00 11.14 H new ATOM 0 HB2 GLU A 36 20.434 -16.837 5.897 1.00 3.31 H new ATOM 0 HB3 GLU A 36 21.676 -15.605 5.797 1.00 3.31 H new ATOM 0 HG2 GLU A 36 21.189 -16.164 8.128 1.00 15.45 H new ATOM 0 HG3 GLU A 36 20.790 -14.491 7.792 1.00 15.45 H new ATOM 530 N ALA A 37 20.765 -12.739 5.166 1.00 5.33 N ATOM 531 CA ALA A 37 20.937 -11.335 5.519 1.00 50.35 C ATOM 532 C ALA A 37 19.711 -10.517 5.128 1.00 54.01 C ATOM 533 O ALA A 37 19.337 -9.570 5.820 1.00 65.45 O ATOM 534 CB ALA A 37 22.183 -10.772 4.852 1.00 44.22 C ATOM 0 H ALA A 37 21.454 -13.095 4.503 1.00 5.33 H new ATOM 0 HA ALA A 37 21.056 -11.270 6.601 1.00 50.35 H new ATOM 0 HB1 ALA A 37 22.299 -9.723 5.124 1.00 44.22 H new ATOM 0 HB2 ALA A 37 23.058 -11.332 5.183 1.00 44.22 H new ATOM 0 HB3 ALA A 37 22.086 -10.857 3.770 1.00 44.22 H new ATOM 540 N GLY A 38 19.087 -10.889 4.014 1.00 43.43 N ATOM 541 CA GLY A 38 17.910 -10.178 3.550 1.00 32.22 C ATOM 542 C GLY A 38 16.659 -10.571 4.311 1.00 52.03 C ATOM 543 O GLY A 38 15.895 -9.711 4.751 1.00 62.25 O ATOM 0 H GLY A 38 19.376 -11.670 3.425 1.00 43.43 H new ATOM 0 HA2 GLY A 38 18.073 -9.105 3.654 1.00 32.22 H new ATOM 0 HA3 GLY A 38 17.764 -10.377 2.488 1.00 32.22 H new ATOM 547 N PHE A 39 16.447 -11.874 4.465 1.00 13.31 N ATOM 548 CA PHE A 39 15.278 -12.379 5.175 1.00 34.04 C ATOM 549 C PHE A 39 15.319 -11.977 6.647 1.00 44.12 C ATOM 550 O PHE A 39 14.332 -11.489 7.196 1.00 11.42 O ATOM 551 CB PHE A 39 15.199 -13.902 5.053 1.00 23.23 C ATOM 552 CG PHE A 39 14.277 -14.370 3.964 1.00 50.41 C ATOM 553 CD1 PHE A 39 12.924 -14.073 4.009 1.00 63.24 C ATOM 554 CD2 PHE A 39 14.763 -15.106 2.895 1.00 13.04 C ATOM 555 CE1 PHE A 39 12.073 -14.502 3.008 1.00 52.54 C ATOM 556 CE2 PHE A 39 13.916 -15.537 1.891 1.00 2.53 C ATOM 557 CZ PHE A 39 12.569 -15.235 1.948 1.00 24.11 C ATOM 0 H PHE A 39 17.069 -12.599 4.108 1.00 13.31 H new ATOM 0 HA PHE A 39 14.390 -11.938 4.721 1.00 34.04 H new ATOM 0 HB2 PHE A 39 16.198 -14.296 4.866 1.00 23.23 H new ATOM 0 HB3 PHE A 39 14.865 -14.318 6.004 1.00 23.23 H new ATOM 0 HD1 PHE A 39 12.530 -13.500 4.835 1.00 63.24 H new ATOM 0 HD2 PHE A 39 15.815 -15.345 2.846 1.00 13.04 H new ATOM 0 HE1 PHE A 39 11.021 -14.264 3.055 1.00 52.54 H new ATOM 0 HE2 PHE A 39 14.307 -16.109 1.063 1.00 2.53 H new ATOM 0 HZ PHE A 39 11.905 -15.571 1.165 1.00 24.11 H new ATOM 567 N ASP A 40 16.469 -12.186 7.279 1.00 61.55 N ATOM 568 CA ASP A 40 16.641 -11.846 8.686 1.00 2.00 C ATOM 569 C ASP A 40 16.222 -10.403 8.951 1.00 32.43 C ATOM 570 O ASP A 40 15.601 -10.104 9.972 1.00 0.22 O ATOM 571 CB ASP A 40 18.096 -12.053 9.109 1.00 65.04 C ATOM 572 CG ASP A 40 18.351 -11.623 10.540 1.00 55.31 C ATOM 573 OD1 ASP A 40 17.826 -12.284 11.460 1.00 73.12 O ATOM 574 OD2 ASP A 40 19.073 -10.624 10.740 1.00 25.02 O ATOM 0 H ASP A 40 17.296 -12.589 6.839 1.00 61.55 H new ATOM 0 HA ASP A 40 16.003 -12.505 9.274 1.00 2.00 H new ATOM 0 HB2 ASP A 40 18.357 -13.105 8.997 1.00 65.04 H new ATOM 0 HB3 ASP A 40 18.749 -11.490 8.442 1.00 65.04 H new ATOM 579 N LEU A 41 16.566 -9.513 8.027 1.00 75.40 N ATOM 580 CA LEU A 41 16.226 -8.101 8.161 1.00 33.00 C ATOM 581 C LEU A 41 14.728 -7.881 7.975 1.00 32.32 C ATOM 582 O LEU A 41 14.135 -7.011 8.611 1.00 15.22 O ATOM 583 CB LEU A 41 17.005 -7.270 7.141 1.00 42.44 C ATOM 584 CG LEU A 41 18.507 -7.133 7.393 1.00 61.32 C ATOM 585 CD1 LEU A 41 19.196 -6.507 6.190 1.00 73.40 C ATOM 586 CD2 LEU A 41 18.765 -6.309 8.646 1.00 71.12 C ATOM 0 H LEU A 41 17.080 -9.744 7.177 1.00 75.40 H new ATOM 0 HA LEU A 41 16.499 -7.781 9.166 1.00 33.00 H new ATOM 0 HB2 LEU A 41 16.861 -7.713 6.156 1.00 42.44 H new ATOM 0 HB3 LEU A 41 16.570 -6.271 7.108 1.00 42.44 H new ATOM 0 HG LEU A 41 18.922 -8.129 7.546 1.00 61.32 H new ATOM 0 HD11 LEU A 41 20.264 -6.418 6.388 1.00 73.40 H new ATOM 0 HD12 LEU A 41 19.041 -7.136 5.314 1.00 73.40 H new ATOM 0 HD13 LEU A 41 18.777 -5.518 6.005 1.00 73.40 H new ATOM 0 HD21 LEU A 41 19.839 -6.222 8.810 1.00 71.12 H new ATOM 0 HD22 LEU A 41 18.335 -5.315 8.523 1.00 71.12 H new ATOM 0 HD23 LEU A 41 18.306 -6.799 9.505 1.00 71.12 H new ATOM 598 N ALA A 42 14.122 -8.678 7.101 1.00 62.13 N ATOM 599 CA ALA A 42 12.693 -8.574 6.834 1.00 11.45 C ATOM 600 C ALA A 42 11.877 -8.884 8.085 1.00 63.51 C ATOM 601 O ALA A 42 10.709 -8.511 8.184 1.00 1.22 O ATOM 602 CB ALA A 42 12.298 -9.506 5.699 1.00 30.20 C ATOM 0 H ALA A 42 14.599 -9.403 6.566 1.00 62.13 H new ATOM 0 HA ALA A 42 12.478 -7.548 6.537 1.00 11.45 H new ATOM 0 HB1 ALA A 42 11.228 -9.417 5.511 1.00 30.20 H new ATOM 0 HB2 ALA A 42 12.848 -9.236 4.798 1.00 30.20 H new ATOM 0 HB3 ALA A 42 12.534 -10.534 5.974 1.00 30.20 H new ATOM 608 N ALA A 43 12.501 -9.571 9.037 1.00 72.23 N ATOM 609 CA ALA A 43 11.833 -9.931 10.281 1.00 33.03 C ATOM 610 C ALA A 43 11.673 -8.717 11.190 1.00 41.33 C ATOM 611 O ALA A 43 10.806 -8.691 12.064 1.00 73.14 O ATOM 612 CB ALA A 43 12.605 -11.030 10.996 1.00 2.44 C ATOM 0 H ALA A 43 13.468 -9.889 8.970 1.00 72.23 H new ATOM 0 HA ALA A 43 10.838 -10.302 10.036 1.00 33.03 H new ATOM 0 HB1 ALA A 43 12.094 -11.289 11.924 1.00 2.44 H new ATOM 0 HB2 ALA A 43 12.662 -11.910 10.356 1.00 2.44 H new ATOM 0 HB3 ALA A 43 13.612 -10.679 11.222 1.00 2.44 H new ATOM 618 N THR A 44 12.516 -7.710 10.979 1.00 61.54 N ATOM 619 CA THR A 44 12.470 -6.494 11.780 1.00 53.24 C ATOM 620 C THR A 44 11.982 -5.309 10.953 1.00 64.43 C ATOM 621 O THR A 44 11.373 -4.378 11.481 1.00 63.35 O ATOM 622 CB THR A 44 13.851 -6.158 12.372 1.00 44.02 C ATOM 623 OG1 THR A 44 13.696 -5.494 13.631 1.00 45.11 O ATOM 624 CG2 THR A 44 14.647 -5.276 11.422 1.00 44.31 C ATOM 0 H THR A 44 13.239 -7.714 10.259 1.00 61.54 H new ATOM 0 HA THR A 44 11.769 -6.679 12.594 1.00 53.24 H new ATOM 0 HB THR A 44 14.396 -7.091 12.519 1.00 44.02 H new ATOM 0 HG1 THR A 44 14.579 -5.285 14.002 1.00 45.11 H new ATOM 0 HG21 THR A 44 15.619 -5.052 11.862 1.00 44.31 H new ATOM 0 HG22 THR A 44 14.789 -5.796 10.475 1.00 44.31 H new ATOM 0 HG23 THR A 44 14.105 -4.347 11.248 1.00 44.31 H new ATOM 632 N THR A 45 12.253 -5.350 9.652 1.00 65.33 N ATOM 633 CA THR A 45 11.843 -4.280 8.752 1.00 70.14 C ATOM 634 C THR A 45 10.565 -4.649 8.006 1.00 44.40 C ATOM 635 O THR A 45 9.662 -3.826 7.859 1.00 1.02 O ATOM 636 CB THR A 45 12.946 -3.954 7.727 1.00 51.10 C ATOM 637 OG1 THR A 45 13.967 -3.160 8.342 1.00 33.21 O ATOM 638 CG2 THR A 45 12.371 -3.211 6.531 1.00 55.32 C ATOM 0 H THR A 45 12.755 -6.113 9.198 1.00 65.33 H new ATOM 0 HA THR A 45 11.660 -3.401 9.369 1.00 70.14 H new ATOM 0 HB THR A 45 13.376 -4.893 7.379 1.00 51.10 H new ATOM 0 HG1 THR A 45 14.665 -2.958 7.684 1.00 33.21 H new ATOM 0 HG21 THR A 45 13.169 -2.992 5.821 1.00 55.32 H new ATOM 0 HG22 THR A 45 11.615 -3.830 6.048 1.00 55.32 H new ATOM 0 HG23 THR A 45 11.917 -2.278 6.866 1.00 55.32 H new ATOM 646 N ALA A 46 10.496 -5.890 7.537 1.00 25.34 N ATOM 647 CA ALA A 46 9.328 -6.368 6.809 1.00 33.32 C ATOM 648 C ALA A 46 9.164 -5.627 5.487 1.00 61.24 C ATOM 649 O ALA A 46 8.524 -4.577 5.427 1.00 3.14 O ATOM 650 CB ALA A 46 8.076 -6.215 7.661 1.00 42.22 C ATOM 0 H ALA A 46 11.236 -6.583 7.648 1.00 25.34 H new ATOM 0 HA ALA A 46 9.476 -7.425 6.587 1.00 33.32 H new ATOM 0 HB1 ALA A 46 7.211 -6.576 7.105 1.00 42.22 H new ATOM 0 HB2 ALA A 46 8.186 -6.795 8.577 1.00 42.22 H new ATOM 0 HB3 ALA A 46 7.933 -5.164 7.912 1.00 42.22 H new ATOM 656 N TYR A 47 9.746 -6.180 4.428 1.00 3.14 N ATOM 657 CA TYR A 47 9.668 -5.569 3.107 1.00 75.13 C ATOM 658 C TYR A 47 8.427 -6.047 2.359 1.00 55.01 C ATOM 659 O TYR A 47 7.826 -7.061 2.714 1.00 20.32 O ATOM 660 CB TYR A 47 10.923 -5.895 2.295 1.00 34.34 C ATOM 661 CG TYR A 47 12.190 -5.315 2.881 1.00 11.20 C ATOM 662 CD1 TYR A 47 12.718 -5.805 4.069 1.00 13.52 C ATOM 663 CD2 TYR A 47 12.860 -4.277 2.245 1.00 2.22 C ATOM 664 CE1 TYR A 47 13.875 -5.276 4.608 1.00 31.51 C ATOM 665 CE2 TYR A 47 14.019 -3.744 2.776 1.00 51.40 C ATOM 666 CZ TYR A 47 14.522 -4.246 3.958 1.00 71.52 C ATOM 667 OH TYR A 47 15.676 -3.719 4.491 1.00 53.34 O ATOM 0 H TYR A 47 10.277 -7.050 4.459 1.00 3.14 H new ATOM 0 HA TYR A 47 9.599 -4.489 3.238 1.00 75.13 H new ATOM 0 HB2 TYR A 47 11.028 -6.978 2.223 1.00 34.34 H new ATOM 0 HB3 TYR A 47 10.797 -5.519 1.280 1.00 34.34 H new ATOM 0 HD1 TYR A 47 12.216 -6.613 4.580 1.00 13.52 H new ATOM 0 HD2 TYR A 47 12.468 -3.880 1.320 1.00 2.22 H new ATOM 0 HE1 TYR A 47 14.271 -5.667 5.534 1.00 31.51 H new ATOM 0 HE2 TYR A 47 14.528 -2.938 2.268 1.00 51.40 H new ATOM 0 HH TYR A 47 16.007 -3.002 3.910 1.00 53.34 H new ATOM 677 N ASP A 48 8.049 -5.309 1.321 1.00 13.11 N ATOM 678 CA ASP A 48 6.880 -5.657 0.520 1.00 4.55 C ATOM 679 C ASP A 48 7.176 -6.850 -0.382 1.00 61.05 C ATOM 680 O ASP A 48 6.303 -7.681 -0.636 1.00 64.53 O ATOM 681 CB ASP A 48 6.439 -4.460 -0.323 1.00 44.45 C ATOM 682 CG ASP A 48 5.338 -3.658 0.341 1.00 54.44 C ATOM 683 OD1 ASP A 48 4.151 -3.944 0.074 1.00 24.53 O ATOM 684 OD2 ASP A 48 5.661 -2.744 1.127 1.00 3.42 O ATOM 0 H ASP A 48 8.535 -4.466 1.014 1.00 13.11 H new ATOM 0 HA ASP A 48 6.072 -5.930 1.199 1.00 4.55 H new ATOM 0 HB2 ASP A 48 7.297 -3.812 -0.506 1.00 44.45 H new ATOM 0 HB3 ASP A 48 6.093 -4.812 -1.295 1.00 44.45 H new ATOM 689 N LEU A 49 8.411 -6.928 -0.866 1.00 20.03 N ATOM 690 CA LEU A 49 8.822 -8.020 -1.742 1.00 2.51 C ATOM 691 C LEU A 49 10.246 -8.466 -1.424 1.00 34.41 C ATOM 692 O LEU A 49 11.119 -7.644 -1.149 1.00 10.43 O ATOM 693 CB LEU A 49 8.726 -7.588 -3.206 1.00 61.13 C ATOM 694 CG LEU A 49 8.020 -8.563 -4.148 1.00 73.45 C ATOM 695 CD1 LEU A 49 7.724 -7.897 -5.483 1.00 51.10 C ATOM 696 CD2 LEU A 49 8.862 -9.815 -4.350 1.00 51.32 C ATOM 0 H LEU A 49 9.145 -6.248 -0.667 1.00 20.03 H new ATOM 0 HA LEU A 49 8.151 -8.862 -1.573 1.00 2.51 H new ATOM 0 HB2 LEU A 49 8.205 -6.631 -3.248 1.00 61.13 H new ATOM 0 HB3 LEU A 49 9.735 -7.418 -3.581 1.00 61.13 H new ATOM 0 HG LEU A 49 7.073 -8.855 -3.693 1.00 73.45 H new ATOM 0 HD11 LEU A 49 7.221 -8.607 -6.140 1.00 51.10 H new ATOM 0 HD12 LEU A 49 7.081 -7.032 -5.323 1.00 51.10 H new ATOM 0 HD13 LEU A 49 8.658 -7.575 -5.944 1.00 51.10 H new ATOM 0 HD21 LEU A 49 8.343 -10.497 -5.023 1.00 51.32 H new ATOM 0 HD22 LEU A 49 9.824 -9.540 -4.782 1.00 51.32 H new ATOM 0 HD23 LEU A 49 9.022 -10.305 -3.389 1.00 51.32 H new ATOM 708 N VAL A 50 10.473 -9.775 -1.466 1.00 33.53 N ATOM 709 CA VAL A 50 11.791 -10.332 -1.185 1.00 72.04 C ATOM 710 C VAL A 50 12.150 -11.425 -2.185 1.00 72.25 C ATOM 711 O VAL A 50 11.306 -12.241 -2.560 1.00 22.13 O ATOM 712 CB VAL A 50 11.864 -10.911 0.240 1.00 70.20 C ATOM 713 CG1 VAL A 50 13.290 -11.319 0.578 1.00 12.44 C ATOM 714 CG2 VAL A 50 11.334 -9.906 1.251 1.00 13.10 C ATOM 0 H VAL A 50 9.761 -10.470 -1.692 1.00 33.53 H new ATOM 0 HA VAL A 50 12.506 -9.514 -1.273 1.00 72.04 H new ATOM 0 HB VAL A 50 11.237 -11.801 0.285 1.00 70.20 H new ATOM 0 HG11 VAL A 50 13.322 -11.726 1.589 1.00 12.44 H new ATOM 0 HG12 VAL A 50 13.629 -12.076 -0.129 1.00 12.44 H new ATOM 0 HG13 VAL A 50 13.942 -10.448 0.517 1.00 12.44 H new ATOM 0 HG21 VAL A 50 11.393 -10.332 2.253 1.00 13.10 H new ATOM 0 HG22 VAL A 50 11.933 -8.996 1.208 1.00 13.10 H new ATOM 0 HG23 VAL A 50 10.296 -9.669 1.018 1.00 13.10 H new ATOM 724 N LEU A 51 13.407 -11.437 -2.615 1.00 12.30 N ATOM 725 CA LEU A 51 13.879 -12.431 -3.572 1.00 41.14 C ATOM 726 C LEU A 51 15.128 -13.136 -3.053 1.00 71.44 C ATOM 727 O LEU A 51 16.095 -12.492 -2.646 1.00 41.12 O ATOM 728 CB LEU A 51 14.176 -11.770 -4.920 1.00 13.24 C ATOM 729 CG LEU A 51 14.426 -12.719 -6.092 1.00 44.42 C ATOM 730 CD1 LEU A 51 13.111 -13.247 -6.642 1.00 33.00 C ATOM 731 CD2 LEU A 51 15.220 -12.018 -7.185 1.00 42.30 C ATOM 0 H LEU A 51 14.118 -10.769 -2.316 1.00 12.30 H new ATOM 0 HA LEU A 51 13.093 -13.174 -3.704 1.00 41.14 H new ATOM 0 HB2 LEU A 51 13.338 -11.121 -5.176 1.00 13.24 H new ATOM 0 HB3 LEU A 51 15.051 -11.130 -4.803 1.00 13.24 H new ATOM 0 HG LEU A 51 15.010 -13.565 -5.731 1.00 44.42 H new ATOM 0 HD11 LEU A 51 13.310 -13.921 -7.476 1.00 33.00 H new ATOM 0 HD12 LEU A 51 12.579 -13.786 -5.858 1.00 33.00 H new ATOM 0 HD13 LEU A 51 12.500 -12.413 -6.987 1.00 33.00 H new ATOM 0 HD21 LEU A 51 15.389 -12.708 -8.012 1.00 42.30 H new ATOM 0 HD22 LEU A 51 14.661 -11.153 -7.543 1.00 42.30 H new ATOM 0 HD23 LEU A 51 16.179 -11.690 -6.784 1.00 42.30 H new ATOM 743 N THR A 52 15.102 -14.466 -3.072 1.00 54.55 N ATOM 744 CA THR A 52 16.231 -15.259 -2.605 1.00 61.11 C ATOM 745 C THR A 52 16.878 -16.024 -3.754 1.00 21.42 C ATOM 746 O THR A 52 16.252 -16.257 -4.788 1.00 33.43 O ATOM 747 CB THR A 52 15.802 -16.259 -1.514 1.00 44.43 C ATOM 748 OG1 THR A 52 16.876 -17.162 -1.228 1.00 41.22 O ATOM 749 CG2 THR A 52 14.575 -17.044 -1.952 1.00 44.01 C ATOM 0 H THR A 52 14.310 -15.016 -3.406 1.00 54.55 H new ATOM 0 HA THR A 52 16.955 -14.561 -2.184 1.00 61.11 H new ATOM 0 HB THR A 52 15.552 -15.697 -0.614 1.00 44.43 H new ATOM 0 HG1 THR A 52 16.544 -18.084 -1.255 1.00 41.22 H new ATOM 0 HG21 THR A 52 14.291 -17.743 -1.166 1.00 44.01 H new ATOM 0 HG22 THR A 52 13.751 -16.356 -2.141 1.00 44.01 H new ATOM 0 HG23 THR A 52 14.803 -17.596 -2.864 1.00 44.01 H new ATOM 757 N ASP A 53 18.134 -16.414 -3.566 1.00 2.33 N ATOM 758 CA ASP A 53 18.866 -17.155 -4.586 1.00 72.13 C ATOM 759 C ASP A 53 19.463 -18.433 -4.006 1.00 25.10 C ATOM 760 O ASP A 53 19.471 -19.477 -4.658 1.00 4.21 O ATOM 761 CB ASP A 53 19.973 -16.285 -5.184 1.00 31.22 C ATOM 762 CG ASP A 53 21.051 -15.946 -4.174 1.00 3.13 C ATOM 763 OD1 ASP A 53 20.770 -15.156 -3.248 1.00 74.53 O ATOM 764 OD2 ASP A 53 22.177 -16.469 -4.309 1.00 64.31 O ATOM 0 H ASP A 53 18.667 -16.229 -2.716 1.00 2.33 H new ATOM 0 HA ASP A 53 18.165 -17.429 -5.374 1.00 72.13 H new ATOM 0 HB2 ASP A 53 20.422 -16.805 -6.030 1.00 31.22 H new ATOM 0 HB3 ASP A 53 19.538 -15.363 -5.570 1.00 31.22 H new ATOM 769 N GLN A 54 19.963 -18.342 -2.778 1.00 5.11 N ATOM 770 CA GLN A 54 20.565 -19.491 -2.111 1.00 52.22 C ATOM 771 C GLN A 54 19.568 -20.640 -2.002 1.00 10.24 C ATOM 772 O GLN A 54 18.366 -20.450 -2.181 1.00 32.42 O ATOM 773 CB GLN A 54 21.062 -19.097 -0.719 1.00 50.23 C ATOM 774 CG GLN A 54 22.156 -20.007 -0.184 1.00 15.23 C ATOM 775 CD GLN A 54 23.326 -20.138 -1.139 1.00 15.13 C ATOM 776 OE1 GLN A 54 23.415 -21.101 -1.901 1.00 53.20 O ATOM 777 NE2 GLN A 54 24.231 -19.167 -1.103 1.00 21.34 N ATOM 0 H GLN A 54 19.963 -17.485 -2.225 1.00 5.11 H new ATOM 0 HA GLN A 54 21.412 -19.825 -2.710 1.00 52.22 H new ATOM 0 HB2 GLN A 54 21.436 -18.074 -0.752 1.00 50.23 H new ATOM 0 HB3 GLN A 54 20.221 -19.107 -0.026 1.00 50.23 H new ATOM 0 HG2 GLN A 54 22.512 -19.618 0.770 1.00 15.23 H new ATOM 0 HG3 GLN A 54 21.739 -20.995 0.011 1.00 15.23 H new ATOM 0 HE21 GLN A 54 24.117 -18.387 -0.455 1.00 21.34 H new ATOM 0 HE22 GLN A 54 25.040 -19.201 -1.723 1.00 21.34 H new ATOM 786 N ASN A 55 20.077 -21.832 -1.707 1.00 15.24 N ATOM 787 CA ASN A 55 19.230 -23.012 -1.574 1.00 64.31 C ATOM 788 C ASN A 55 19.091 -23.420 -0.111 1.00 30.24 C ATOM 789 O ASN A 55 19.530 -22.703 0.788 1.00 33.43 O ATOM 790 CB ASN A 55 19.808 -24.173 -2.386 1.00 23.30 C ATOM 791 CG ASN A 55 19.973 -23.827 -3.853 1.00 63.12 C ATOM 792 OD1 ASN A 55 19.439 -22.826 -4.330 1.00 3.50 O ATOM 793 ND2 ASN A 55 20.716 -24.657 -4.577 1.00 12.12 N ATOM 0 H ASN A 55 21.071 -22.006 -1.556 1.00 15.24 H new ATOM 0 HA ASN A 55 18.241 -22.764 -1.959 1.00 64.31 H new ATOM 0 HB2 ASN A 55 20.775 -24.457 -1.971 1.00 23.30 H new ATOM 0 HB3 ASN A 55 19.154 -25.040 -2.291 1.00 23.30 H new ATOM 0 HD21 ASN A 55 20.863 -24.476 -5.570 1.00 12.12 H new ATOM 0 HD22 ASN A 55 21.140 -25.475 -4.140 1.00 12.12 H new ATOM 800 N MET A 56 18.478 -24.576 0.120 1.00 73.52 N ATOM 801 CA MET A 56 18.282 -25.081 1.474 1.00 2.21 C ATOM 802 C MET A 56 18.697 -26.545 1.574 1.00 31.30 C ATOM 803 O MET A 56 17.863 -27.447 1.662 1.00 0.22 O ATOM 804 CB MET A 56 16.820 -24.923 1.894 1.00 75.02 C ATOM 805 CG MET A 56 16.336 -23.482 1.882 1.00 51.01 C ATOM 806 SD MET A 56 14.546 -23.349 2.054 1.00 50.45 S ATOM 807 CE MET A 56 14.004 -24.046 0.495 1.00 35.05 C ATOM 0 H MET A 56 18.108 -25.181 -0.613 1.00 73.52 H new ATOM 0 HA MET A 56 18.910 -24.497 2.147 1.00 2.21 H new ATOM 0 HB2 MET A 56 16.193 -25.514 1.226 1.00 75.02 H new ATOM 0 HB3 MET A 56 16.692 -25.332 2.896 1.00 75.02 H new ATOM 0 HG2 MET A 56 16.817 -22.935 2.693 1.00 51.01 H new ATOM 0 HG3 MET A 56 16.644 -23.007 0.950 1.00 51.01 H new ATOM 0 HE1 MET A 56 12.956 -23.797 0.330 1.00 35.05 H new ATOM 0 HE2 MET A 56 14.606 -23.636 -0.316 1.00 35.05 H new ATOM 0 HE3 MET A 56 14.120 -25.130 0.521 1.00 35.05 H new ATOM 817 N PRO A 57 20.016 -26.790 1.560 1.00 74.32 N ATOM 818 CA PRO A 57 20.570 -28.144 1.648 1.00 22.42 C ATOM 819 C PRO A 57 20.371 -28.764 3.027 1.00 13.43 C ATOM 820 O PRO A 57 20.166 -29.971 3.152 1.00 23.21 O ATOM 821 CB PRO A 57 22.060 -27.937 1.366 1.00 42.52 C ATOM 822 CG PRO A 57 22.327 -26.525 1.761 1.00 24.32 C ATOM 823 CD PRO A 57 21.067 -25.764 1.457 1.00 33.20 C ATOM 0 HA PRO A 57 20.082 -28.829 0.955 1.00 22.42 H new ATOM 0 HB2 PRO A 57 22.672 -28.632 1.941 1.00 42.52 H new ATOM 0 HB3 PRO A 57 22.291 -28.104 0.314 1.00 42.52 H new ATOM 0 HG2 PRO A 57 22.578 -26.457 2.819 1.00 24.32 H new ATOM 0 HG3 PRO A 57 23.172 -26.118 1.206 1.00 24.32 H new ATOM 0 HD2 PRO A 57 20.907 -24.952 2.166 1.00 33.20 H new ATOM 0 HD3 PRO A 57 21.097 -25.318 0.463 1.00 33.20 H new ATOM 831 N ARG A 58 20.431 -27.929 4.060 1.00 70.21 N ATOM 832 CA ARG A 58 20.258 -28.396 5.430 1.00 15.43 C ATOM 833 C ARG A 58 19.819 -27.253 6.342 1.00 24.31 C ATOM 834 O ARG A 58 18.663 -27.185 6.759 1.00 72.24 O ATOM 835 CB ARG A 58 21.559 -29.008 5.952 1.00 72.14 C ATOM 836 CG ARG A 58 21.518 -29.358 7.430 1.00 11.43 C ATOM 837 CD ARG A 58 22.873 -29.835 7.927 1.00 22.45 C ATOM 838 NE ARG A 58 23.907 -28.817 7.763 1.00 12.22 N ATOM 839 CZ ARG A 58 25.179 -28.999 8.100 1.00 34.24 C ATOM 840 NH1 ARG A 58 25.572 -30.155 8.617 1.00 34.22 N ATOM 841 NH2 ARG A 58 26.060 -28.024 7.920 1.00 24.14 N ATOM 0 H ARG A 58 20.598 -26.926 3.974 1.00 70.21 H new ATOM 0 HA ARG A 58 19.480 -29.159 5.431 1.00 15.43 H new ATOM 0 HB2 ARG A 58 21.782 -29.909 5.380 1.00 72.14 H new ATOM 0 HB3 ARG A 58 22.376 -28.308 5.776 1.00 72.14 H new ATOM 0 HG2 ARG A 58 21.206 -28.485 8.003 1.00 11.43 H new ATOM 0 HG3 ARG A 58 20.773 -30.135 7.601 1.00 11.43 H new ATOM 0 HD2 ARG A 58 22.797 -30.108 8.980 1.00 22.45 H new ATOM 0 HD3 ARG A 58 23.162 -30.735 7.384 1.00 22.45 H new ATOM 0 HE ARG A 58 23.638 -27.916 7.368 1.00 12.22 H new ATOM 0 HH11 ARG A 58 24.897 -30.907 8.757 1.00 34.22 H new ATOM 0 HH12 ARG A 58 26.549 -30.292 8.875 1.00 34.22 H new ATOM 0 HH21 ARG A 58 25.761 -27.133 7.523 1.00 24.14 H new ATOM 0 HH22 ARG A 58 27.036 -28.165 8.179 1.00 24.14 H new ATOM 855 N LYS A 59 20.752 -26.358 6.649 1.00 15.51 N ATOM 856 CA LYS A 59 20.463 -25.217 7.511 1.00 62.13 C ATOM 857 C LYS A 59 21.462 -24.089 7.273 1.00 70.13 C ATOM 858 O LYS A 59 22.669 -24.320 7.206 1.00 22.12 O ATOM 859 CB LYS A 59 20.497 -25.641 8.981 1.00 62.02 C ATOM 860 CG LYS A 59 19.203 -26.274 9.461 1.00 13.45 C ATOM 861 CD LYS A 59 19.074 -26.199 10.974 1.00 74.43 C ATOM 862 CE LYS A 59 18.054 -27.200 11.496 1.00 65.51 C ATOM 863 NZ LYS A 59 16.679 -26.629 11.523 1.00 64.55 N ATOM 0 H LYS A 59 21.714 -26.400 6.314 1.00 15.51 H new ATOM 0 HA LYS A 59 19.465 -24.852 7.267 1.00 62.13 H new ATOM 0 HB2 LYS A 59 21.314 -26.348 9.128 1.00 62.02 H new ATOM 0 HB3 LYS A 59 20.715 -24.769 9.597 1.00 62.02 H new ATOM 0 HG2 LYS A 59 18.356 -25.769 8.997 1.00 13.45 H new ATOM 0 HG3 LYS A 59 19.166 -27.316 9.143 1.00 13.45 H new ATOM 0 HD2 LYS A 59 20.043 -26.393 11.433 1.00 74.43 H new ATOM 0 HD3 LYS A 59 18.779 -25.191 11.266 1.00 74.43 H new ATOM 0 HE2 LYS A 59 18.065 -28.091 10.868 1.00 65.51 H new ATOM 0 HE3 LYS A 59 18.336 -27.515 12.501 1.00 65.51 H new ATOM 0 HZ1 LYS A 59 16.014 -27.342 11.885 1.00 64.55 H new ATOM 0 HZ2 LYS A 59 16.662 -25.794 12.143 1.00 64.55 H new ATOM 0 HZ3 LYS A 59 16.399 -26.352 10.560 1.00 64.55 H new ATOM 877 N SER A 60 20.951 -22.869 7.147 1.00 54.33 N ATOM 878 CA SER A 60 21.798 -21.705 6.914 1.00 20.10 C ATOM 879 C SER A 60 21.093 -20.424 7.349 1.00 2.13 C ATOM 880 O SER A 60 21.689 -19.563 7.996 1.00 72.31 O ATOM 881 CB SER A 60 22.180 -21.613 5.435 1.00 31.44 C ATOM 882 OG SER A 60 23.276 -20.735 5.245 1.00 32.41 O ATOM 0 H SER A 60 19.954 -22.661 7.202 1.00 54.33 H new ATOM 0 HA SER A 60 22.704 -21.821 7.509 1.00 20.10 H new ATOM 0 HB2 SER A 60 22.435 -22.604 5.060 1.00 31.44 H new ATOM 0 HB3 SER A 60 21.325 -21.263 4.856 1.00 31.44 H new ATOM 0 HG SER A 60 23.502 -20.695 4.292 1.00 32.41 H new ATOM 888 N GLY A 61 19.819 -20.305 6.989 1.00 72.20 N ATOM 889 CA GLY A 61 19.053 -19.127 7.350 1.00 15.20 C ATOM 890 C GLY A 61 17.697 -19.087 6.673 1.00 12.02 C ATOM 891 O GLY A 61 16.728 -18.577 7.237 1.00 34.22 O ATOM 0 H GLY A 61 19.304 -21.004 6.454 1.00 72.20 H new ATOM 0 HA2 GLY A 61 18.917 -19.103 8.431 1.00 15.20 H new ATOM 0 HA3 GLY A 61 19.617 -18.234 7.080 1.00 15.20 H new ATOM 895 N LEU A 62 17.627 -19.624 5.460 1.00 30.23 N ATOM 896 CA LEU A 62 16.380 -19.647 4.704 1.00 14.22 C ATOM 897 C LEU A 62 15.244 -20.222 5.544 1.00 11.04 C ATOM 898 O LEU A 62 14.090 -19.818 5.404 1.00 20.22 O ATOM 899 CB LEU A 62 16.550 -20.469 3.426 1.00 42.15 C ATOM 900 CG LEU A 62 16.808 -19.673 2.145 1.00 23.35 C ATOM 901 CD1 LEU A 62 15.550 -18.939 1.711 1.00 53.25 C ATOM 902 CD2 LEU A 62 17.956 -18.695 2.348 1.00 0.20 C ATOM 0 H LEU A 62 18.419 -20.049 4.979 1.00 30.23 H new ATOM 0 HA LEU A 62 16.127 -18.621 4.438 1.00 14.22 H new ATOM 0 HB2 LEU A 62 17.378 -21.163 3.572 1.00 42.15 H new ATOM 0 HB3 LEU A 62 15.652 -21.070 3.282 1.00 42.15 H new ATOM 0 HG LEU A 62 17.087 -20.371 1.355 1.00 23.35 H new ATOM 0 HD11 LEU A 62 15.752 -18.378 0.798 1.00 53.25 H new ATOM 0 HD12 LEU A 62 14.754 -19.660 1.525 1.00 53.25 H new ATOM 0 HD13 LEU A 62 15.240 -18.251 2.498 1.00 53.25 H new ATOM 0 HD21 LEU A 62 18.126 -18.137 1.427 1.00 0.20 H new ATOM 0 HD22 LEU A 62 17.706 -18.002 3.151 1.00 0.20 H new ATOM 0 HD23 LEU A 62 18.860 -19.244 2.611 1.00 0.20 H new ATOM 914 N GLU A 63 15.580 -21.165 6.419 1.00 63.34 N ATOM 915 CA GLU A 63 14.588 -21.794 7.282 1.00 30.33 C ATOM 916 C GLU A 63 13.767 -20.743 8.023 1.00 53.10 C ATOM 917 O GLU A 63 12.606 -20.973 8.365 1.00 52.23 O ATOM 918 CB GLU A 63 15.270 -22.725 8.287 1.00 64.01 C ATOM 919 CG GLU A 63 14.330 -23.744 8.908 1.00 23.24 C ATOM 920 CD GLU A 63 13.563 -24.539 7.870 1.00 33.00 C ATOM 921 OE1 GLU A 63 14.012 -25.651 7.522 1.00 14.00 O ATOM 922 OE2 GLU A 63 12.512 -24.048 7.406 1.00 61.43 O ATOM 0 H GLU A 63 16.531 -21.510 6.549 1.00 63.34 H new ATOM 0 HA GLU A 63 13.916 -22.379 6.654 1.00 30.33 H new ATOM 0 HB2 GLU A 63 16.084 -23.251 7.788 1.00 64.01 H new ATOM 0 HB3 GLU A 63 15.717 -22.125 9.080 1.00 64.01 H new ATOM 0 HG2 GLU A 63 14.904 -24.428 9.533 1.00 23.24 H new ATOM 0 HG3 GLU A 63 13.624 -23.231 9.561 1.00 23.24 H new ATOM 929 N LEU A 64 14.377 -19.589 8.268 1.00 3.04 N ATOM 930 CA LEU A 64 13.704 -18.501 8.969 1.00 10.11 C ATOM 931 C LEU A 64 12.329 -18.234 8.366 1.00 13.51 C ATOM 932 O LEU A 64 11.393 -17.856 9.072 1.00 22.35 O ATOM 933 CB LEU A 64 14.553 -17.230 8.914 1.00 3.14 C ATOM 934 CG LEU A 64 14.133 -16.101 9.855 1.00 12.55 C ATOM 935 CD1 LEU A 64 14.610 -16.381 11.272 1.00 12.41 C ATOM 936 CD2 LEU A 64 14.674 -14.766 9.363 1.00 73.34 C ATOM 0 H LEU A 64 15.337 -19.382 7.992 1.00 3.04 H new ATOM 0 HA LEU A 64 13.573 -18.798 10.010 1.00 10.11 H new ATOM 0 HB2 LEU A 64 15.586 -17.497 9.138 1.00 3.14 H new ATOM 0 HB3 LEU A 64 14.536 -16.850 7.893 1.00 3.14 H new ATOM 0 HG LEU A 64 13.044 -16.048 9.863 1.00 12.55 H new ATOM 0 HD11 LEU A 64 14.302 -15.566 11.927 1.00 12.41 H new ATOM 0 HD12 LEU A 64 14.174 -17.316 11.625 1.00 12.41 H new ATOM 0 HD13 LEU A 64 15.697 -16.462 11.281 1.00 12.41 H new ATOM 0 HD21 LEU A 64 14.365 -13.974 10.045 1.00 73.34 H new ATOM 0 HD22 LEU A 64 15.763 -14.807 9.324 1.00 73.34 H new ATOM 0 HD23 LEU A 64 14.283 -14.560 8.367 1.00 73.34 H new ATOM 948 N ILE A 65 12.213 -18.433 7.058 1.00 61.34 N ATOM 949 CA ILE A 65 10.951 -18.217 6.361 1.00 43.12 C ATOM 950 C ILE A 65 9.802 -18.923 7.073 1.00 42.24 C ATOM 951 O ILE A 65 8.699 -18.387 7.175 1.00 42.20 O ATOM 952 CB ILE A 65 11.020 -18.713 4.904 1.00 2.14 C ATOM 953 CG1 ILE A 65 12.126 -17.978 4.144 1.00 1.12 C ATOM 954 CG2 ILE A 65 9.678 -18.520 4.215 1.00 12.20 C ATOM 955 CD1 ILE A 65 12.555 -18.679 2.874 1.00 1.03 C ATOM 0 H ILE A 65 12.978 -18.744 6.459 1.00 61.34 H new ATOM 0 HA ILE A 65 10.770 -17.142 6.362 1.00 43.12 H new ATOM 0 HB ILE A 65 11.254 -19.778 4.909 1.00 2.14 H new ATOM 0 HG12 ILE A 65 11.780 -16.974 3.896 1.00 1.12 H new ATOM 0 HG13 ILE A 65 12.991 -17.865 4.797 1.00 1.12 H new ATOM 0 HG21 ILE A 65 9.743 -18.875 3.186 1.00 12.20 H new ATOM 0 HG22 ILE A 65 8.912 -19.085 4.746 1.00 12.20 H new ATOM 0 HG23 ILE A 65 9.416 -17.462 4.218 1.00 12.20 H new ATOM 0 HD11 ILE A 65 13.341 -18.102 2.388 1.00 1.03 H new ATOM 0 HD12 ILE A 65 12.931 -19.673 3.116 1.00 1.03 H new ATOM 0 HD13 ILE A 65 11.702 -18.768 2.202 1.00 1.03 H new ATOM 967 N ALA A 66 10.069 -20.128 7.564 1.00 23.24 N ATOM 968 CA ALA A 66 9.059 -20.906 8.270 1.00 30.34 C ATOM 969 C ALA A 66 8.484 -20.122 9.446 1.00 65.55 C ATOM 970 O ALA A 66 7.276 -20.134 9.680 1.00 45.41 O ATOM 971 CB ALA A 66 9.648 -22.225 8.750 1.00 1.53 C ATOM 0 H ALA A 66 10.977 -20.587 7.486 1.00 23.24 H new ATOM 0 HA ALA A 66 8.246 -21.115 7.575 1.00 30.34 H new ATOM 0 HB1 ALA A 66 8.882 -22.796 9.276 1.00 1.53 H new ATOM 0 HB2 ALA A 66 10.004 -22.798 7.894 1.00 1.53 H new ATOM 0 HB3 ALA A 66 10.481 -22.027 9.425 1.00 1.53 H new ATOM 977 N ALA A 67 9.358 -19.444 10.182 1.00 42.53 N ATOM 978 CA ALA A 67 8.937 -18.653 11.332 1.00 60.32 C ATOM 979 C ALA A 67 7.976 -17.545 10.914 1.00 24.03 C ATOM 980 O ALA A 67 7.049 -17.203 11.650 1.00 61.44 O ATOM 981 CB ALA A 67 10.148 -18.065 12.040 1.00 24.22 C ATOM 0 H ALA A 67 10.362 -19.426 10.003 1.00 42.53 H new ATOM 0 HA ALA A 67 8.411 -19.312 12.023 1.00 60.32 H new ATOM 0 HB1 ALA A 67 9.819 -17.477 12.897 1.00 24.22 H new ATOM 0 HB2 ALA A 67 10.797 -18.871 12.381 1.00 24.22 H new ATOM 0 HB3 ALA A 67 10.697 -17.425 11.350 1.00 24.22 H new ATOM 987 N LEU A 68 8.204 -16.986 9.731 1.00 71.22 N ATOM 988 CA LEU A 68 7.358 -15.915 9.215 1.00 23.03 C ATOM 989 C LEU A 68 6.037 -16.468 8.692 1.00 71.53 C ATOM 990 O LEU A 68 5.022 -15.772 8.680 1.00 32.05 O ATOM 991 CB LEU A 68 8.084 -15.157 8.102 1.00 13.11 C ATOM 992 CG LEU A 68 9.519 -14.728 8.407 1.00 23.03 C ATOM 993 CD1 LEU A 68 10.327 -14.616 7.124 1.00 63.12 C ATOM 994 CD2 LEU A 68 9.532 -13.408 9.165 1.00 61.14 C ATOM 0 H LEU A 68 8.967 -17.256 9.111 1.00 71.22 H new ATOM 0 HA LEU A 68 7.143 -15.228 10.034 1.00 23.03 H new ATOM 0 HB2 LEU A 68 8.095 -15.784 7.211 1.00 13.11 H new ATOM 0 HB3 LEU A 68 7.504 -14.267 7.858 1.00 13.11 H new ATOM 0 HG LEU A 68 9.979 -15.490 9.036 1.00 23.03 H new ATOM 0 HD11 LEU A 68 11.346 -14.310 7.361 1.00 63.12 H new ATOM 0 HD12 LEU A 68 10.347 -15.583 6.621 1.00 63.12 H new ATOM 0 HD13 LEU A 68 9.869 -13.875 6.469 1.00 63.12 H new ATOM 0 HD21 LEU A 68 10.562 -13.118 9.373 1.00 61.14 H new ATOM 0 HD22 LEU A 68 9.053 -12.637 8.561 1.00 61.14 H new ATOM 0 HD23 LEU A 68 8.990 -13.522 10.104 1.00 61.14 H new ATOM 1006 N ARG A 69 6.057 -17.726 8.261 1.00 41.52 N ATOM 1007 CA ARG A 69 4.860 -18.373 7.737 1.00 3.11 C ATOM 1008 C ARG A 69 3.749 -18.389 8.783 1.00 61.03 C ATOM 1009 O ARG A 69 2.583 -18.154 8.466 1.00 4.22 O ATOM 1010 CB ARG A 69 5.180 -19.802 7.295 1.00 71.11 C ATOM 1011 CG ARG A 69 4.081 -20.442 6.462 1.00 1.01 C ATOM 1012 CD ARG A 69 4.245 -21.952 6.389 1.00 22.02 C ATOM 1013 NE ARG A 69 4.176 -22.574 7.709 1.00 62.45 N ATOM 1014 CZ ARG A 69 3.054 -22.688 8.410 1.00 52.31 C ATOM 1015 NH1 ARG A 69 1.913 -22.223 7.920 1.00 35.33 N ATOM 1016 NH2 ARG A 69 3.072 -23.267 9.604 1.00 54.14 N ATOM 0 H ARG A 69 6.889 -18.317 8.265 1.00 41.52 H new ATOM 0 HA ARG A 69 4.515 -17.802 6.875 1.00 3.11 H new ATOM 0 HB2 ARG A 69 6.105 -19.796 6.718 1.00 71.11 H new ATOM 0 HB3 ARG A 69 5.359 -20.415 8.178 1.00 71.11 H new ATOM 0 HG2 ARG A 69 3.109 -20.201 6.893 1.00 1.01 H new ATOM 0 HG3 ARG A 69 4.096 -20.024 5.455 1.00 1.01 H new ATOM 0 HD2 ARG A 69 3.468 -22.371 5.750 1.00 22.02 H new ATOM 0 HD3 ARG A 69 5.202 -22.191 5.925 1.00 22.02 H new ATOM 0 HE ARG A 69 5.037 -22.941 8.114 1.00 62.45 H new ATOM 0 HH11 ARG A 69 1.896 -21.777 7.003 1.00 35.33 H new ATOM 0 HH12 ARG A 69 1.052 -22.312 8.460 1.00 35.33 H new ATOM 0 HH21 ARG A 69 3.948 -23.625 9.984 1.00 54.14 H new ATOM 0 HH22 ARG A 69 2.210 -23.354 10.142 1.00 54.14 H new ATOM 1030 N GLN A 70 4.120 -18.669 10.028 1.00 14.42 N ATOM 1031 CA GLN A 70 3.154 -18.716 11.119 1.00 33.54 C ATOM 1032 C GLN A 70 3.093 -17.380 11.852 1.00 60.12 C ATOM 1033 O GLN A 70 2.712 -17.318 13.022 1.00 42.04 O ATOM 1034 CB GLN A 70 3.516 -19.833 12.100 1.00 35.12 C ATOM 1035 CG GLN A 70 4.644 -19.466 13.050 1.00 31.25 C ATOM 1036 CD GLN A 70 5.550 -20.641 13.362 1.00 35.35 C ATOM 1037 OE1 GLN A 70 5.097 -21.783 13.446 1.00 62.52 O ATOM 1038 NE2 GLN A 70 6.837 -20.367 13.537 1.00 50.23 N ATOM 0 H GLN A 70 5.081 -18.867 10.306 1.00 14.42 H new ATOM 0 HA GLN A 70 2.172 -18.920 10.692 1.00 33.54 H new ATOM 0 HB2 GLN A 70 2.632 -20.094 12.682 1.00 35.12 H new ATOM 0 HB3 GLN A 70 3.801 -20.722 11.537 1.00 35.12 H new ATOM 0 HG2 GLN A 70 5.236 -18.662 12.612 1.00 31.25 H new ATOM 0 HG3 GLN A 70 4.221 -19.081 13.978 1.00 31.25 H new ATOM 0 HE21 GLN A 70 7.169 -19.406 13.458 1.00 50.23 H new ATOM 0 HE22 GLN A 70 7.494 -21.118 13.750 1.00 50.23 H new ATOM 1047 N LEU A 71 3.471 -16.313 11.157 1.00 10.21 N ATOM 1048 CA LEU A 71 3.460 -14.976 11.742 1.00 60.25 C ATOM 1049 C LEU A 71 2.223 -14.200 11.301 1.00 1.35 C ATOM 1050 O LEU A 71 1.809 -13.247 11.961 1.00 12.24 O ATOM 1051 CB LEU A 71 4.724 -14.213 11.342 1.00 22.11 C ATOM 1052 CG LEU A 71 5.580 -13.683 12.493 1.00 20.10 C ATOM 1053 CD1 LEU A 71 4.824 -12.620 13.274 1.00 2.44 C ATOM 1054 CD2 LEU A 71 6.004 -14.821 13.410 1.00 2.12 C ATOM 0 H LEU A 71 3.789 -16.347 10.188 1.00 10.21 H new ATOM 0 HA LEU A 71 3.434 -15.080 12.827 1.00 60.25 H new ATOM 0 HB2 LEU A 71 5.342 -14.869 10.728 1.00 22.11 H new ATOM 0 HB3 LEU A 71 4.433 -13.371 10.714 1.00 22.11 H new ATOM 0 HG LEU A 71 6.477 -13.227 12.074 1.00 20.10 H new ATOM 0 HD11 LEU A 71 5.448 -12.254 14.089 1.00 2.44 H new ATOM 0 HD12 LEU A 71 4.571 -11.792 12.611 1.00 2.44 H new ATOM 0 HD13 LEU A 71 3.910 -13.050 13.682 1.00 2.44 H new ATOM 0 HD21 LEU A 71 6.612 -14.425 14.223 1.00 2.12 H new ATOM 0 HD22 LEU A 71 5.119 -15.306 13.822 1.00 2.12 H new ATOM 0 HD23 LEU A 71 6.585 -15.548 12.843 1.00 2.12 H new ATOM 1066 N SER A 72 1.637 -14.615 10.183 1.00 34.14 N ATOM 1067 CA SER A 72 0.448 -13.958 9.654 1.00 15.41 C ATOM 1068 C SER A 72 0.758 -12.521 9.244 1.00 21.21 C ATOM 1069 O SER A 72 -0.109 -11.649 9.293 1.00 24.00 O ATOM 1070 CB SER A 72 -0.675 -13.972 10.694 1.00 45.11 C ATOM 1071 OG SER A 72 -1.945 -13.879 10.074 1.00 15.31 O ATOM 0 H SER A 72 1.966 -15.403 9.626 1.00 34.14 H new ATOM 0 HA SER A 72 0.123 -14.508 8.771 1.00 15.41 H new ATOM 0 HB2 SER A 72 -0.620 -14.889 11.281 1.00 45.11 H new ATOM 0 HB3 SER A 72 -0.543 -13.141 11.387 1.00 45.11 H new ATOM 0 HG SER A 72 -1.972 -13.085 9.501 1.00 15.31 H new ATOM 1077 N ALA A 73 2.002 -12.284 8.840 1.00 53.31 N ATOM 1078 CA ALA A 73 2.428 -10.955 8.419 1.00 15.44 C ATOM 1079 C ALA A 73 3.215 -11.018 7.115 1.00 4.43 C ATOM 1080 O ALA A 73 3.118 -10.122 6.276 1.00 74.43 O ATOM 1081 CB ALA A 73 3.260 -10.297 9.510 1.00 22.51 C ATOM 0 H ALA A 73 2.732 -12.995 8.795 1.00 53.31 H new ATOM 0 HA ALA A 73 1.536 -10.353 8.245 1.00 15.44 H new ATOM 0 HB1 ALA A 73 3.571 -9.305 9.182 1.00 22.51 H new ATOM 0 HB2 ALA A 73 2.664 -10.208 10.418 1.00 22.51 H new ATOM 0 HB3 ALA A 73 4.141 -10.905 9.712 1.00 22.51 H new ATOM 1087 N TYR A 74 3.996 -12.080 6.952 1.00 5.43 N ATOM 1088 CA TYR A 74 4.804 -12.257 5.751 1.00 31.43 C ATOM 1089 C TYR A 74 4.285 -13.422 4.914 1.00 62.24 C ATOM 1090 O TYR A 74 4.485 -13.466 3.700 1.00 14.21 O ATOM 1091 CB TYR A 74 6.268 -12.496 6.126 1.00 35.32 C ATOM 1092 CG TYR A 74 6.747 -11.636 7.273 1.00 1.32 C ATOM 1093 CD1 TYR A 74 6.487 -11.992 8.591 1.00 75.02 C ATOM 1094 CD2 TYR A 74 7.460 -10.466 7.040 1.00 74.13 C ATOM 1095 CE1 TYR A 74 6.922 -11.209 9.642 1.00 10.40 C ATOM 1096 CE2 TYR A 74 7.900 -9.677 8.085 1.00 62.43 C ATOM 1097 CZ TYR A 74 7.629 -10.053 9.384 1.00 52.31 C ATOM 1098 OH TYR A 74 8.065 -9.269 10.428 1.00 52.14 O ATOM 0 H TYR A 74 4.087 -12.831 7.636 1.00 5.43 H new ATOM 0 HA TYR A 74 4.733 -11.346 5.157 1.00 31.43 H new ATOM 0 HB2 TYR A 74 6.400 -13.545 6.390 1.00 35.32 H new ATOM 0 HB3 TYR A 74 6.894 -12.305 5.254 1.00 35.32 H new ATOM 0 HD1 TYR A 74 5.935 -12.897 8.797 1.00 75.02 H new ATOM 0 HD2 TYR A 74 7.674 -10.168 6.024 1.00 74.13 H new ATOM 0 HE1 TYR A 74 6.710 -11.500 10.660 1.00 10.40 H new ATOM 0 HE2 TYR A 74 8.453 -8.771 7.886 1.00 62.43 H new ATOM 0 HH TYR A 74 8.548 -8.493 10.075 1.00 52.14 H new ATOM 1108 N ALA A 75 3.618 -14.364 5.572 1.00 74.55 N ATOM 1109 CA ALA A 75 3.067 -15.529 4.889 1.00 42.33 C ATOM 1110 C ALA A 75 2.279 -15.117 3.650 1.00 13.22 C ATOM 1111 O ALA A 75 2.294 -15.811 2.633 1.00 3.15 O ATOM 1112 CB ALA A 75 2.185 -16.328 5.836 1.00 25.44 C ATOM 0 H ALA A 75 3.446 -14.344 6.577 1.00 74.55 H new ATOM 0 HA ALA A 75 3.898 -16.157 4.567 1.00 42.33 H new ATOM 0 HB1 ALA A 75 1.781 -17.194 5.313 1.00 25.44 H new ATOM 0 HB2 ALA A 75 2.776 -16.662 6.689 1.00 25.44 H new ATOM 0 HB3 ALA A 75 1.365 -15.701 6.186 1.00 25.44 H new ATOM 1118 N ASP A 76 1.590 -13.985 3.743 1.00 52.23 N ATOM 1119 CA ASP A 76 0.795 -13.480 2.629 1.00 31.30 C ATOM 1120 C ASP A 76 1.676 -12.756 1.616 1.00 4.25 C ATOM 1121 O ASP A 76 1.416 -12.789 0.413 1.00 14.13 O ATOM 1122 CB ASP A 76 -0.297 -12.539 3.139 1.00 0.43 C ATOM 1123 CG ASP A 76 -1.507 -13.286 3.664 1.00 53.22 C ATOM 1124 OD1 ASP A 76 -1.737 -13.257 4.891 1.00 23.23 O ATOM 1125 OD2 ASP A 76 -2.226 -13.899 2.847 1.00 43.42 O ATOM 0 H ASP A 76 1.566 -13.400 4.578 1.00 52.23 H new ATOM 0 HA ASP A 76 0.328 -14.331 2.134 1.00 31.30 H new ATOM 0 HB2 ASP A 76 0.110 -11.911 3.931 1.00 0.43 H new ATOM 0 HB3 ASP A 76 -0.606 -11.875 2.332 1.00 0.43 H new ATOM 1130 N THR A 77 2.722 -12.100 2.112 1.00 54.05 N ATOM 1131 CA THR A 77 3.640 -11.365 1.251 1.00 23.41 C ATOM 1132 C THR A 77 4.124 -12.233 0.095 1.00 30.51 C ATOM 1133 O THR A 77 4.506 -13.390 0.273 1.00 34.43 O ATOM 1134 CB THR A 77 4.861 -10.854 2.040 1.00 53.35 C ATOM 1135 OG1 THR A 77 4.431 -10.011 3.114 1.00 2.52 O ATOM 1136 CG2 THR A 77 5.808 -10.084 1.131 1.00 14.34 C ATOM 0 H THR A 77 2.954 -12.063 3.105 1.00 54.05 H new ATOM 0 HA THR A 77 3.088 -10.512 0.855 1.00 23.41 H new ATOM 0 HB THR A 77 5.392 -11.715 2.445 1.00 53.35 H new ATOM 0 HG1 THR A 77 5.212 -9.691 3.612 1.00 2.52 H new ATOM 0 HG21 THR A 77 6.662 -9.733 1.710 1.00 14.34 H new ATOM 0 HG22 THR A 77 6.155 -10.737 0.331 1.00 14.34 H new ATOM 0 HG23 THR A 77 5.285 -9.230 0.701 1.00 14.34 H new ATOM 1144 N PRO A 78 4.110 -11.665 -1.119 1.00 54.45 N ATOM 1145 CA PRO A 78 4.545 -12.369 -2.329 1.00 22.32 C ATOM 1146 C PRO A 78 6.051 -12.607 -2.350 1.00 62.24 C ATOM 1147 O PRO A 78 6.832 -11.682 -2.577 1.00 72.45 O ATOM 1148 CB PRO A 78 4.138 -11.420 -3.459 1.00 34.24 C ATOM 1149 CG PRO A 78 4.106 -10.071 -2.827 1.00 61.22 C ATOM 1150 CD PRO A 78 3.667 -10.289 -1.406 1.00 25.44 C ATOM 0 HA PRO A 78 4.099 -13.360 -2.406 1.00 22.32 H new ATOM 0 HB2 PRO A 78 4.852 -11.455 -4.282 1.00 34.24 H new ATOM 0 HB3 PRO A 78 3.165 -11.688 -3.870 1.00 34.24 H new ATOM 0 HG2 PRO A 78 5.088 -9.600 -2.864 1.00 61.22 H new ATOM 0 HG3 PRO A 78 3.416 -9.411 -3.352 1.00 61.22 H new ATOM 0 HD2 PRO A 78 4.127 -9.569 -0.729 1.00 25.44 H new ATOM 0 HD3 PRO A 78 2.587 -10.184 -1.298 1.00 25.44 H new ATOM 1158 N ILE A 79 6.452 -13.852 -2.113 1.00 43.43 N ATOM 1159 CA ILE A 79 7.865 -14.210 -2.107 1.00 61.24 C ATOM 1160 C ILE A 79 8.217 -15.078 -3.311 1.00 31.44 C ATOM 1161 O ILE A 79 7.490 -16.014 -3.649 1.00 5.12 O ATOM 1162 CB ILE A 79 8.250 -14.959 -0.818 1.00 24.01 C ATOM 1163 CG1 ILE A 79 7.997 -14.076 0.406 1.00 73.13 C ATOM 1164 CG2 ILE A 79 9.708 -15.392 -0.872 1.00 71.14 C ATOM 1165 CD1 ILE A 79 8.749 -12.764 0.371 1.00 63.41 C ATOM 0 H ILE A 79 5.819 -14.629 -1.923 1.00 43.43 H new ATOM 0 HA ILE A 79 8.427 -13.278 -2.157 1.00 61.24 H new ATOM 0 HB ILE A 79 7.629 -15.851 -0.735 1.00 24.01 H new ATOM 0 HG12 ILE A 79 6.929 -13.871 0.482 1.00 73.13 H new ATOM 0 HG13 ILE A 79 8.281 -14.624 1.304 1.00 73.13 H new ATOM 0 HG21 ILE A 79 9.965 -15.920 0.046 1.00 71.14 H new ATOM 0 HG22 ILE A 79 9.860 -16.053 -1.725 1.00 71.14 H new ATOM 0 HG23 ILE A 79 10.345 -14.513 -0.976 1.00 71.14 H new ATOM 0 HD11 ILE A 79 8.522 -12.190 1.270 1.00 63.41 H new ATOM 0 HD12 ILE A 79 9.820 -12.960 0.327 1.00 63.41 H new ATOM 0 HD13 ILE A 79 8.448 -12.195 -0.509 1.00 63.41 H new ATOM 1177 N LEU A 80 9.337 -14.764 -3.953 1.00 15.03 N ATOM 1178 CA LEU A 80 9.787 -15.517 -5.118 1.00 42.33 C ATOM 1179 C LEU A 80 11.188 -16.077 -4.896 1.00 62.41 C ATOM 1180 O LEU A 80 12.141 -15.328 -4.680 1.00 60.40 O ATOM 1181 CB LEU A 80 9.773 -14.626 -6.362 1.00 3.12 C ATOM 1182 CG LEU A 80 8.434 -13.973 -6.705 1.00 11.34 C ATOM 1183 CD1 LEU A 80 7.293 -14.959 -6.507 1.00 41.14 C ATOM 1184 CD2 LEU A 80 8.216 -12.727 -5.859 1.00 3.42 C ATOM 0 H LEU A 80 9.950 -13.993 -3.686 1.00 15.03 H new ATOM 0 HA LEU A 80 9.102 -16.351 -5.268 1.00 42.33 H new ATOM 0 HB2 LEU A 80 10.515 -13.839 -6.229 1.00 3.12 H new ATOM 0 HB3 LEU A 80 10.092 -15.224 -7.216 1.00 3.12 H new ATOM 0 HG LEU A 80 8.454 -13.677 -7.754 1.00 11.34 H new ATOM 0 HD11 LEU A 80 6.348 -14.476 -6.756 1.00 41.14 H new ATOM 0 HD12 LEU A 80 7.442 -15.822 -7.156 1.00 41.14 H new ATOM 0 HD13 LEU A 80 7.271 -15.286 -5.467 1.00 41.14 H new ATOM 0 HD21 LEU A 80 7.258 -12.275 -6.117 1.00 3.42 H new ATOM 0 HD22 LEU A 80 8.217 -12.999 -4.804 1.00 3.42 H new ATOM 0 HD23 LEU A 80 9.017 -12.013 -6.050 1.00 3.42 H new ATOM 1196 N VAL A 81 11.307 -17.400 -4.953 1.00 35.23 N ATOM 1197 CA VAL A 81 12.592 -18.062 -4.761 1.00 54.31 C ATOM 1198 C VAL A 81 13.163 -18.547 -6.088 1.00 45.45 C ATOM 1199 O VAL A 81 12.428 -19.008 -6.963 1.00 2.25 O ATOM 1200 CB VAL A 81 12.469 -19.259 -3.800 1.00 11.34 C ATOM 1201 CG1 VAL A 81 11.456 -20.264 -4.325 1.00 72.21 C ATOM 1202 CG2 VAL A 81 13.825 -19.915 -3.591 1.00 62.20 C ATOM 0 H VAL A 81 10.528 -18.035 -5.131 1.00 35.23 H new ATOM 0 HA VAL A 81 13.266 -17.324 -4.326 1.00 54.31 H new ATOM 0 HB VAL A 81 12.115 -18.894 -2.836 1.00 11.34 H new ATOM 0 HG11 VAL A 81 11.383 -21.103 -3.633 1.00 72.21 H new ATOM 0 HG12 VAL A 81 10.482 -19.784 -4.418 1.00 72.21 H new ATOM 0 HG13 VAL A 81 11.776 -20.627 -5.302 1.00 72.21 H new ATOM 0 HG21 VAL A 81 13.720 -20.759 -2.909 1.00 62.20 H new ATOM 0 HG22 VAL A 81 14.210 -20.267 -4.548 1.00 62.20 H new ATOM 0 HG23 VAL A 81 14.519 -19.189 -3.166 1.00 62.20 H new ATOM 1212 N LEU A 82 14.480 -18.440 -6.233 1.00 73.24 N ATOM 1213 CA LEU A 82 15.152 -18.869 -7.455 1.00 41.30 C ATOM 1214 C LEU A 82 15.439 -20.366 -7.422 1.00 71.41 C ATOM 1215 O LEU A 82 15.644 -20.948 -6.356 1.00 13.42 O ATOM 1216 CB LEU A 82 16.457 -18.092 -7.642 1.00 34.02 C ATOM 1217 CG LEU A 82 16.323 -16.573 -7.758 1.00 72.34 C ATOM 1218 CD1 LEU A 82 17.635 -15.893 -7.402 1.00 2.22 C ATOM 1219 CD2 LEU A 82 15.881 -16.183 -9.161 1.00 45.15 C ATOM 0 H LEU A 82 15.103 -18.060 -5.520 1.00 73.24 H new ATOM 0 HA LEU A 82 14.490 -18.663 -8.296 1.00 41.30 H new ATOM 0 HB2 LEU A 82 17.113 -18.316 -6.801 1.00 34.02 H new ATOM 0 HB3 LEU A 82 16.952 -18.463 -8.540 1.00 34.02 H new ATOM 0 HG LEU A 82 15.562 -16.239 -7.053 1.00 72.34 H new ATOM 0 HD11 LEU A 82 17.521 -14.813 -7.490 1.00 2.22 H new ATOM 0 HD12 LEU A 82 17.910 -16.146 -6.378 1.00 2.22 H new ATOM 0 HD13 LEU A 82 18.417 -16.232 -8.082 1.00 2.22 H new ATOM 0 HD21 LEU A 82 15.791 -15.099 -9.226 1.00 45.15 H new ATOM 0 HD22 LEU A 82 16.619 -16.530 -9.884 1.00 45.15 H new ATOM 0 HD23 LEU A 82 14.916 -16.641 -9.379 1.00 45.15 H new ATOM 1231 N THR A 83 15.454 -20.987 -8.598 1.00 2.12 N ATOM 1232 CA THR A 83 15.717 -22.416 -8.704 1.00 61.52 C ATOM 1233 C THR A 83 16.619 -22.723 -9.895 1.00 15.33 C ATOM 1234 O THR A 83 16.798 -21.888 -10.782 1.00 61.03 O ATOM 1235 CB THR A 83 14.410 -23.219 -8.845 1.00 31.13 C ATOM 1236 OG1 THR A 83 14.700 -24.619 -8.917 1.00 63.44 O ATOM 1237 CG2 THR A 83 13.642 -22.790 -10.086 1.00 22.11 C ATOM 0 H THR A 83 15.287 -20.522 -9.490 1.00 2.12 H new ATOM 0 HA THR A 83 16.220 -22.713 -7.784 1.00 61.52 H new ATOM 0 HB THR A 83 13.792 -23.021 -7.969 1.00 31.13 H new ATOM 0 HG1 THR A 83 14.141 -25.034 -9.607 1.00 63.44 H new ATOM 0 HG21 THR A 83 12.723 -23.371 -10.164 1.00 22.11 H new ATOM 0 HG22 THR A 83 13.396 -21.730 -10.014 1.00 22.11 H new ATOM 0 HG23 THR A 83 14.255 -22.961 -10.971 1.00 22.11 H new ATOM 1245 N THR A 84 17.184 -23.926 -9.909 1.00 41.21 N ATOM 1246 CA THR A 84 18.068 -24.342 -10.991 1.00 34.12 C ATOM 1247 C THR A 84 17.330 -25.219 -11.996 1.00 63.22 C ATOM 1248 O THR A 84 17.590 -25.154 -13.197 1.00 60.42 O ATOM 1249 CB THR A 84 19.289 -25.112 -10.454 1.00 10.12 C ATOM 1250 OG1 THR A 84 18.861 -26.300 -9.779 1.00 22.12 O ATOM 1251 CG2 THR A 84 20.099 -24.245 -9.501 1.00 70.34 C ATOM 0 H THR A 84 17.045 -24.629 -9.183 1.00 41.21 H new ATOM 0 HA THR A 84 18.410 -23.434 -11.487 1.00 34.12 H new ATOM 0 HB THR A 84 19.921 -25.383 -11.300 1.00 10.12 H new ATOM 0 HG1 THR A 84 19.643 -26.785 -9.442 1.00 22.12 H new ATOM 0 HG21 THR A 84 20.956 -24.810 -9.135 1.00 70.34 H new ATOM 0 HG22 THR A 84 20.448 -23.356 -10.026 1.00 70.34 H new ATOM 0 HG23 THR A 84 19.474 -23.948 -8.659 1.00 70.34 H new ATOM 1259 N GLU A 85 16.409 -26.038 -11.497 1.00 45.11 N ATOM 1260 CA GLU A 85 15.635 -26.928 -12.354 1.00 32.13 C ATOM 1261 C GLU A 85 14.140 -26.775 -12.087 1.00 41.35 C ATOM 1262 O GLU A 85 13.718 -26.582 -10.948 1.00 71.41 O ATOM 1263 CB GLU A 85 16.057 -28.382 -12.131 1.00 1.22 C ATOM 1264 CG GLU A 85 17.558 -28.600 -12.218 1.00 3.44 C ATOM 1265 CD GLU A 85 17.943 -30.062 -12.101 1.00 44.31 C ATOM 1266 OE1 GLU A 85 18.855 -30.373 -11.306 1.00 14.13 O ATOM 1267 OE2 GLU A 85 17.334 -30.894 -12.805 1.00 24.11 O ATOM 0 H GLU A 85 16.181 -26.103 -10.505 1.00 45.11 H new ATOM 0 HA GLU A 85 15.832 -26.655 -13.391 1.00 32.13 H new ATOM 0 HB2 GLU A 85 15.707 -28.707 -11.151 1.00 1.22 H new ATOM 0 HB3 GLU A 85 15.563 -29.012 -12.871 1.00 1.22 H new ATOM 0 HG2 GLU A 85 17.924 -28.207 -13.166 1.00 3.44 H new ATOM 0 HG3 GLU A 85 18.050 -28.034 -11.427 1.00 3.44 H new ATOM 1274 N GLY A 86 13.344 -26.861 -13.149 1.00 12.40 N ATOM 1275 CA GLY A 86 11.905 -26.729 -13.010 1.00 3.51 C ATOM 1276 C GLY A 86 11.243 -28.022 -12.577 1.00 45.32 C ATOM 1277 O GLY A 86 10.330 -28.511 -13.241 1.00 35.54 O ATOM 0 H GLY A 86 13.670 -27.020 -14.102 1.00 12.40 H new ATOM 0 HA2 GLY A 86 11.684 -25.949 -12.281 1.00 3.51 H new ATOM 0 HA3 GLY A 86 11.479 -26.407 -13.960 1.00 3.51 H new ATOM 1281 N SER A 87 11.707 -28.578 -11.462 1.00 54.51 N ATOM 1282 CA SER A 87 11.157 -29.825 -10.945 1.00 21.15 C ATOM 1283 C SER A 87 10.079 -29.552 -9.900 1.00 50.11 C ATOM 1284 O SER A 87 10.149 -28.569 -9.162 1.00 51.02 O ATOM 1285 CB SER A 87 12.268 -30.682 -10.335 1.00 21.31 C ATOM 1286 OG SER A 87 11.943 -32.060 -10.400 1.00 62.12 O ATOM 0 H SER A 87 12.462 -28.185 -10.900 1.00 54.51 H new ATOM 0 HA SER A 87 10.704 -30.366 -11.776 1.00 21.15 H new ATOM 0 HB2 SER A 87 13.204 -30.500 -10.864 1.00 21.31 H new ATOM 0 HB3 SER A 87 12.427 -30.391 -9.297 1.00 21.31 H new ATOM 0 HG SER A 87 12.669 -32.586 -10.005 1.00 62.12 H new ATOM 1292 N ASP A 88 9.083 -30.429 -9.844 1.00 53.25 N ATOM 1293 CA ASP A 88 7.989 -30.284 -8.890 1.00 63.34 C ATOM 1294 C ASP A 88 8.482 -30.498 -7.463 1.00 30.43 C ATOM 1295 O ASP A 88 8.025 -29.835 -6.532 1.00 61.50 O ATOM 1296 CB ASP A 88 6.870 -31.276 -9.211 1.00 71.00 C ATOM 1297 CG ASP A 88 5.535 -30.850 -8.631 1.00 25.20 C ATOM 1298 OD1 ASP A 88 5.211 -31.287 -7.507 1.00 42.30 O ATOM 1299 OD2 ASP A 88 4.815 -30.081 -9.301 1.00 70.24 O ATOM 0 H ASP A 88 9.010 -31.248 -10.448 1.00 53.25 H new ATOM 0 HA ASP A 88 7.599 -29.270 -8.972 1.00 63.34 H new ATOM 0 HB2 ASP A 88 6.777 -31.377 -10.292 1.00 71.00 H new ATOM 0 HB3 ASP A 88 7.136 -32.258 -8.820 1.00 71.00 H new ATOM 1304 N ALA A 89 9.416 -31.429 -7.298 1.00 30.42 N ATOM 1305 CA ALA A 89 9.971 -31.730 -5.984 1.00 62.21 C ATOM 1306 C ALA A 89 10.502 -30.469 -5.311 1.00 31.35 C ATOM 1307 O ALA A 89 10.383 -30.305 -4.096 1.00 53.12 O ATOM 1308 CB ALA A 89 11.074 -32.772 -6.103 1.00 41.51 C ATOM 0 H ALA A 89 9.804 -31.988 -8.058 1.00 30.42 H new ATOM 0 HA ALA A 89 9.171 -32.133 -5.362 1.00 62.21 H new ATOM 0 HB1 ALA A 89 11.479 -32.987 -5.114 1.00 41.51 H new ATOM 0 HB2 ALA A 89 10.666 -33.686 -6.535 1.00 41.51 H new ATOM 0 HB3 ALA A 89 11.868 -32.390 -6.745 1.00 41.51 H new ATOM 1314 N PHE A 90 11.089 -29.581 -6.106 1.00 71.42 N ATOM 1315 CA PHE A 90 11.640 -28.335 -5.586 1.00 72.41 C ATOM 1316 C PHE A 90 10.530 -27.422 -5.073 1.00 61.23 C ATOM 1317 O PHE A 90 10.659 -26.801 -4.018 1.00 41.33 O ATOM 1318 CB PHE A 90 12.446 -27.618 -6.671 1.00 10.44 C ATOM 1319 CG PHE A 90 13.558 -26.767 -6.127 1.00 23.33 C ATOM 1320 CD1 PHE A 90 13.282 -25.673 -5.323 1.00 51.11 C ATOM 1321 CD2 PHE A 90 14.880 -27.063 -6.419 1.00 1.44 C ATOM 1322 CE1 PHE A 90 14.304 -24.888 -4.822 1.00 75.51 C ATOM 1323 CE2 PHE A 90 15.906 -26.282 -5.920 1.00 41.11 C ATOM 1324 CZ PHE A 90 15.617 -25.194 -5.120 1.00 22.01 C ATOM 0 H PHE A 90 11.195 -29.701 -7.113 1.00 71.42 H new ATOM 0 HA PHE A 90 12.300 -28.577 -4.753 1.00 72.41 H new ATOM 0 HB2 PHE A 90 12.866 -28.360 -7.351 1.00 10.44 H new ATOM 0 HB3 PHE A 90 11.774 -26.992 -7.258 1.00 10.44 H new ATOM 0 HD1 PHE A 90 12.257 -25.431 -5.085 1.00 51.11 H new ATOM 0 HD2 PHE A 90 15.111 -27.913 -7.043 1.00 1.44 H new ATOM 0 HE1 PHE A 90 14.076 -24.036 -4.198 1.00 75.51 H new ATOM 0 HE2 PHE A 90 16.932 -26.522 -6.156 1.00 41.11 H new ATOM 0 HZ PHE A 90 16.417 -24.583 -4.728 1.00 22.01 H new ATOM 1334 N LYS A 91 9.439 -27.346 -5.828 1.00 2.40 N ATOM 1335 CA LYS A 91 8.305 -26.510 -5.452 1.00 2.12 C ATOM 1336 C LYS A 91 7.858 -26.810 -4.025 1.00 33.02 C ATOM 1337 O LYS A 91 7.449 -25.911 -3.291 1.00 33.14 O ATOM 1338 CB LYS A 91 7.140 -26.729 -6.420 1.00 22.43 C ATOM 1339 CG LYS A 91 7.499 -26.469 -7.872 1.00 62.35 C ATOM 1340 CD LYS A 91 6.335 -26.779 -8.799 1.00 22.44 C ATOM 1341 CE LYS A 91 5.202 -25.780 -8.624 1.00 1.14 C ATOM 1342 NZ LYS A 91 4.192 -25.890 -9.713 1.00 4.14 N ATOM 0 H LYS A 91 9.316 -27.854 -6.704 1.00 2.40 H new ATOM 0 HA LYS A 91 8.621 -25.468 -5.504 1.00 2.12 H new ATOM 0 HB2 LYS A 91 6.784 -27.754 -6.321 1.00 22.43 H new ATOM 0 HB3 LYS A 91 6.315 -26.076 -6.136 1.00 22.43 H new ATOM 0 HG2 LYS A 91 7.794 -25.427 -7.994 1.00 62.35 H new ATOM 0 HG3 LYS A 91 8.359 -27.079 -8.150 1.00 62.35 H new ATOM 0 HD2 LYS A 91 6.678 -26.764 -9.833 1.00 22.44 H new ATOM 0 HD3 LYS A 91 5.968 -27.786 -8.600 1.00 22.44 H new ATOM 0 HE2 LYS A 91 4.718 -25.945 -7.662 1.00 1.14 H new ATOM 0 HE3 LYS A 91 5.609 -24.769 -8.607 1.00 1.14 H new ATOM 0 HZ1 LYS A 91 3.436 -25.193 -9.557 1.00 4.14 H new ATOM 0 HZ2 LYS A 91 4.648 -25.707 -10.629 1.00 4.14 H new ATOM 0 HZ3 LYS A 91 3.785 -26.847 -9.714 1.00 4.14 H new ATOM 1356 N ALA A 92 7.940 -28.079 -3.638 1.00 54.04 N ATOM 1357 CA ALA A 92 7.546 -28.496 -2.298 1.00 64.33 C ATOM 1358 C ALA A 92 8.397 -27.806 -1.237 1.00 35.21 C ATOM 1359 O ALA A 92 7.904 -27.455 -0.165 1.00 72.32 O ATOM 1360 CB ALA A 92 7.655 -30.008 -2.163 1.00 53.12 C ATOM 0 H ALA A 92 8.276 -28.836 -4.234 1.00 54.04 H new ATOM 0 HA ALA A 92 6.508 -28.202 -2.142 1.00 64.33 H new ATOM 0 HB1 ALA A 92 7.358 -30.306 -1.157 1.00 53.12 H new ATOM 0 HB2 ALA A 92 7.000 -30.486 -2.892 1.00 53.12 H new ATOM 0 HB3 ALA A 92 8.685 -30.316 -2.343 1.00 53.12 H new ATOM 1366 N ALA A 93 9.676 -27.615 -1.542 1.00 72.40 N ATOM 1367 CA ALA A 93 10.594 -26.966 -0.614 1.00 72.15 C ATOM 1368 C ALA A 93 10.174 -25.525 -0.345 1.00 61.12 C ATOM 1369 O ALA A 93 9.894 -25.153 0.794 1.00 41.22 O ATOM 1370 CB ALA A 93 12.014 -27.011 -1.159 1.00 31.31 C ATOM 0 H ALA A 93 10.100 -27.900 -2.425 1.00 72.40 H new ATOM 0 HA ALA A 93 10.562 -27.509 0.331 1.00 72.15 H new ATOM 0 HB1 ALA A 93 12.689 -26.523 -0.456 1.00 31.31 H new ATOM 0 HB2 ALA A 93 12.319 -28.049 -1.294 1.00 31.31 H new ATOM 0 HB3 ALA A 93 12.052 -26.494 -2.118 1.00 31.31 H new ATOM 1376 N ALA A 94 10.133 -24.718 -1.401 1.00 25.44 N ATOM 1377 CA ALA A 94 9.747 -23.318 -1.278 1.00 33.44 C ATOM 1378 C ALA A 94 8.399 -23.181 -0.578 1.00 12.32 C ATOM 1379 O ALA A 94 8.220 -22.316 0.280 1.00 54.22 O ATOM 1380 CB ALA A 94 9.701 -22.661 -2.649 1.00 22.00 C ATOM 0 H ALA A 94 10.362 -25.010 -2.351 1.00 25.44 H new ATOM 0 HA ALA A 94 10.496 -22.811 -0.670 1.00 33.44 H new ATOM 0 HB1 ALA A 94 9.411 -21.616 -2.542 1.00 22.00 H new ATOM 0 HB2 ALA A 94 10.685 -22.719 -3.113 1.00 22.00 H new ATOM 0 HB3 ALA A 94 8.973 -23.177 -3.275 1.00 22.00 H new ATOM 1386 N ARG A 95 7.454 -24.038 -0.950 1.00 31.02 N ATOM 1387 CA ARG A 95 6.121 -24.010 -0.359 1.00 24.22 C ATOM 1388 C ARG A 95 6.169 -24.427 1.108 1.00 34.32 C ATOM 1389 O ARG A 95 5.428 -23.900 1.938 1.00 13.20 O ATOM 1390 CB ARG A 95 5.178 -24.933 -1.132 1.00 52.14 C ATOM 1391 CG ARG A 95 3.761 -24.954 -0.583 1.00 53.11 C ATOM 1392 CD ARG A 95 2.786 -25.561 -1.580 1.00 31.22 C ATOM 1393 NE ARG A 95 2.732 -27.017 -1.475 1.00 14.12 N ATOM 1394 CZ ARG A 95 2.113 -27.660 -0.491 1.00 21.21 C ATOM 1395 NH1 ARG A 95 1.499 -26.980 0.467 1.00 1.03 N ATOM 1396 NH2 ARG A 95 2.107 -28.987 -0.465 1.00 5.25 N ATOM 0 H ARG A 95 7.586 -24.760 -1.658 1.00 31.02 H new ATOM 0 HA ARG A 95 5.746 -22.988 -0.417 1.00 24.22 H new ATOM 0 HB2 ARG A 95 5.150 -24.618 -2.175 1.00 52.14 H new ATOM 0 HB3 ARG A 95 5.580 -25.946 -1.115 1.00 52.14 H new ATOM 0 HG2 ARG A 95 3.738 -25.526 0.345 1.00 53.11 H new ATOM 0 HG3 ARG A 95 3.449 -23.938 -0.339 1.00 53.11 H new ATOM 0 HD2 ARG A 95 1.791 -25.148 -1.412 1.00 31.22 H new ATOM 0 HD3 ARG A 95 3.080 -25.281 -2.591 1.00 31.22 H new ATOM 0 HE ARG A 95 3.195 -27.570 -2.196 1.00 14.12 H new ATOM 0 HH11 ARG A 95 1.501 -25.960 0.450 1.00 1.03 H new ATOM 0 HH12 ARG A 95 1.025 -27.477 1.221 1.00 1.03 H new ATOM 0 HH21 ARG A 95 2.578 -29.514 -1.201 1.00 5.25 H new ATOM 0 HH22 ARG A 95 1.632 -29.480 0.291 1.00 5.25 H new ATOM 1410 N ASP A 96 7.044 -25.377 1.420 1.00 75.01 N ATOM 1411 CA ASP A 96 7.188 -25.865 2.787 1.00 51.14 C ATOM 1412 C ASP A 96 7.837 -24.808 3.675 1.00 32.21 C ATOM 1413 O ASP A 96 7.437 -24.618 4.823 1.00 22.34 O ATOM 1414 CB ASP A 96 8.020 -27.148 2.808 1.00 44.25 C ATOM 1415 CG ASP A 96 8.369 -27.589 4.215 1.00 5.55 C ATOM 1416 OD1 ASP A 96 9.421 -28.240 4.390 1.00 12.12 O ATOM 1417 OD2 ASP A 96 7.592 -27.281 5.143 1.00 72.42 O ATOM 0 H ASP A 96 7.664 -25.824 0.745 1.00 75.01 H new ATOM 0 HA ASP A 96 6.193 -26.080 3.177 1.00 51.14 H new ATOM 0 HB2 ASP A 96 7.468 -27.944 2.308 1.00 44.25 H new ATOM 0 HB3 ASP A 96 8.938 -26.992 2.241 1.00 44.25 H new ATOM 1422 N ALA A 97 8.840 -24.124 3.136 1.00 64.12 N ATOM 1423 CA ALA A 97 9.544 -23.086 3.879 1.00 31.21 C ATOM 1424 C ALA A 97 8.621 -21.913 4.190 1.00 3.51 C ATOM 1425 O ALA A 97 8.700 -21.315 5.263 1.00 64.52 O ATOM 1426 CB ALA A 97 10.761 -22.611 3.099 1.00 32.20 C ATOM 0 H ALA A 97 9.184 -24.270 2.187 1.00 64.12 H new ATOM 0 HA ALA A 97 9.877 -23.513 4.825 1.00 31.21 H new ATOM 0 HB1 ALA A 97 11.277 -21.836 3.666 1.00 32.20 H new ATOM 0 HB2 ALA A 97 11.437 -23.450 2.933 1.00 32.20 H new ATOM 0 HB3 ALA A 97 10.442 -22.206 2.138 1.00 32.20 H new ATOM 1432 N GLY A 98 7.746 -21.586 3.243 1.00 24.34 N ATOM 1433 CA GLY A 98 6.822 -20.484 3.436 1.00 71.32 C ATOM 1434 C GLY A 98 6.922 -19.445 2.337 1.00 5.33 C ATOM 1435 O GLY A 98 6.743 -18.252 2.584 1.00 70.44 O ATOM 0 H GLY A 98 7.661 -22.065 2.346 1.00 24.34 H new ATOM 0 HA2 GLY A 98 5.804 -20.870 3.475 1.00 71.32 H new ATOM 0 HA3 GLY A 98 7.021 -20.011 4.398 1.00 71.32 H new ATOM 1439 N ALA A 99 7.212 -19.897 1.122 1.00 50.25 N ATOM 1440 CA ALA A 99 7.336 -18.997 -0.019 1.00 30.14 C ATOM 1441 C ALA A 99 6.098 -19.063 -0.907 1.00 64.01 C ATOM 1442 O ALA A 99 5.523 -20.133 -1.111 1.00 1.24 O ATOM 1443 CB ALA A 99 8.584 -19.332 -0.822 1.00 74.53 C ATOM 0 H ALA A 99 7.366 -20.881 0.902 1.00 50.25 H new ATOM 0 HA ALA A 99 7.424 -17.979 0.360 1.00 30.14 H new ATOM 0 HB1 ALA A 99 8.664 -18.653 -1.671 1.00 74.53 H new ATOM 0 HB2 ALA A 99 9.464 -19.226 -0.188 1.00 74.53 H new ATOM 0 HB3 ALA A 99 8.519 -20.358 -1.184 1.00 74.53 H new ATOM 1449 N THR A 100 5.692 -17.912 -1.434 1.00 71.34 N ATOM 1450 CA THR A 100 4.521 -17.839 -2.300 1.00 24.15 C ATOM 1451 C THR A 100 4.743 -18.617 -3.592 1.00 4.42 C ATOM 1452 O THR A 100 4.087 -19.627 -3.841 1.00 14.44 O ATOM 1453 CB THR A 100 4.169 -16.380 -2.646 1.00 31.13 C ATOM 1454 OG1 THR A 100 3.923 -15.638 -1.446 1.00 54.22 O ATOM 1455 CG2 THR A 100 2.945 -16.318 -3.547 1.00 32.33 C ATOM 0 H THR A 100 6.157 -17.018 -1.276 1.00 71.34 H new ATOM 0 HA THR A 100 3.692 -18.284 -1.750 1.00 24.15 H new ATOM 0 HB THR A 100 5.014 -15.941 -3.177 1.00 31.13 H new ATOM 0 HG1 THR A 100 3.075 -15.154 -1.529 1.00 54.22 H new ATOM 0 HG21 THR A 100 2.716 -15.278 -3.778 1.00 32.33 H new ATOM 0 HG22 THR A 100 3.146 -16.859 -4.472 1.00 32.33 H new ATOM 0 HG23 THR A 100 2.095 -16.773 -3.038 1.00 32.33 H new ATOM 1463 N GLY A 101 5.675 -18.139 -4.412 1.00 33.20 N ATOM 1464 CA GLY A 101 5.967 -18.803 -5.669 1.00 50.20 C ATOM 1465 C GLY A 101 7.455 -18.904 -5.939 1.00 21.32 C ATOM 1466 O GLY A 101 8.271 -18.458 -5.132 1.00 33.43 O ATOM 0 H GLY A 101 6.232 -17.305 -4.228 1.00 33.20 H new ATOM 0 HA2 GLY A 101 5.534 -19.803 -5.657 1.00 50.20 H new ATOM 0 HA3 GLY A 101 5.489 -18.259 -6.484 1.00 50.20 H new ATOM 1470 N TRP A 102 7.810 -19.493 -7.075 1.00 73.21 N ATOM 1471 CA TRP A 102 9.211 -19.653 -7.448 1.00 34.41 C ATOM 1472 C TRP A 102 9.421 -19.334 -8.924 1.00 20.21 C ATOM 1473 O TRP A 102 8.467 -19.291 -9.701 1.00 14.32 O ATOM 1474 CB TRP A 102 9.679 -21.078 -7.150 1.00 23.52 C ATOM 1475 CG TRP A 102 9.262 -22.071 -8.192 1.00 35.52 C ATOM 1476 CD1 TRP A 102 8.113 -22.051 -8.930 1.00 14.51 C ATOM 1477 CD2 TRP A 102 9.988 -23.232 -8.609 1.00 70.34 C ATOM 1478 NE1 TRP A 102 8.081 -23.129 -9.781 1.00 42.43 N ATOM 1479 CE2 TRP A 102 9.220 -23.868 -9.605 1.00 24.42 C ATOM 1480 CE3 TRP A 102 11.213 -23.795 -8.241 1.00 72.32 C ATOM 1481 CZ2 TRP A 102 9.639 -25.038 -10.233 1.00 31.31 C ATOM 1482 CZ3 TRP A 102 11.627 -24.957 -8.865 1.00 54.44 C ATOM 1483 CH2 TRP A 102 10.842 -25.568 -9.853 1.00 2.43 C ATOM 0 H TRP A 102 7.147 -19.868 -7.754 1.00 73.21 H new ATOM 0 HA TRP A 102 9.801 -18.953 -6.857 1.00 34.41 H new ATOM 0 HB2 TRP A 102 10.766 -21.086 -7.066 1.00 23.52 H new ATOM 0 HB3 TRP A 102 9.282 -21.388 -6.183 1.00 23.52 H new ATOM 0 HD1 TRP A 102 7.342 -21.298 -8.855 1.00 14.51 H new ATOM 0 HE1 TRP A 102 7.330 -23.344 -10.437 1.00 42.43 H new ATOM 0 HE3 TRP A 102 11.825 -23.330 -7.482 1.00 72.32 H new ATOM 0 HZ2 TRP A 102 9.035 -25.511 -10.994 1.00 31.31 H new ATOM 0 HZ3 TRP A 102 12.571 -25.402 -8.587 1.00 54.44 H new ATOM 0 HH2 TRP A 102 11.194 -26.474 -10.323 1.00 2.43 H new ATOM 1494 N ILE A 103 10.675 -19.112 -9.304 1.00 33.01 N ATOM 1495 CA ILE A 103 11.009 -18.798 -10.688 1.00 33.24 C ATOM 1496 C ILE A 103 12.410 -19.287 -11.039 1.00 74.34 C ATOM 1497 O ILE A 103 13.169 -19.705 -10.166 1.00 33.40 O ATOM 1498 CB ILE A 103 10.923 -17.285 -10.958 1.00 54.52 C ATOM 1499 CG1 ILE A 103 11.351 -16.497 -9.718 1.00 32.51 C ATOM 1500 CG2 ILE A 103 9.511 -16.900 -11.375 1.00 33.43 C ATOM 1501 CD1 ILE A 103 12.751 -16.824 -9.248 1.00 61.44 C ATOM 0 H ILE A 103 11.476 -19.144 -8.673 1.00 33.01 H new ATOM 0 HA ILE A 103 10.280 -19.312 -11.314 1.00 33.24 H new ATOM 0 HB ILE A 103 11.602 -17.038 -11.774 1.00 54.52 H new ATOM 0 HG12 ILE A 103 11.289 -15.431 -9.936 1.00 32.51 H new ATOM 0 HG13 ILE A 103 10.649 -16.698 -8.909 1.00 32.51 H new ATOM 0 HG21 ILE A 103 9.467 -15.827 -11.562 1.00 33.43 H new ATOM 0 HG22 ILE A 103 9.240 -17.438 -12.283 1.00 33.43 H new ATOM 0 HG23 ILE A 103 8.813 -17.158 -10.579 1.00 33.43 H new ATOM 0 HD11 ILE A 103 12.987 -16.229 -8.366 1.00 61.44 H new ATOM 0 HD12 ILE A 103 12.813 -17.883 -8.998 1.00 61.44 H new ATOM 0 HD13 ILE A 103 13.463 -16.596 -10.041 1.00 61.44 H new ATOM 1513 N GLU A 104 12.745 -19.230 -12.324 1.00 42.15 N ATOM 1514 CA GLU A 104 14.056 -19.666 -12.791 1.00 71.42 C ATOM 1515 C GLU A 104 14.974 -18.471 -13.032 1.00 35.11 C ATOM 1516 O GLU A 104 14.550 -17.447 -13.568 1.00 44.31 O ATOM 1517 CB GLU A 104 13.918 -20.484 -14.077 1.00 32.31 C ATOM 1518 CG GLU A 104 13.541 -21.937 -13.837 1.00 2.32 C ATOM 1519 CD GLU A 104 14.743 -22.807 -13.524 1.00 51.10 C ATOM 1520 OE1 GLU A 104 15.883 -22.340 -13.725 1.00 42.45 O ATOM 1521 OE2 GLU A 104 14.542 -23.956 -13.077 1.00 44.13 O ATOM 0 H GLU A 104 12.127 -18.887 -13.060 1.00 42.15 H new ATOM 0 HA GLU A 104 14.499 -20.292 -12.016 1.00 71.42 H new ATOM 0 HB2 GLU A 104 13.163 -20.022 -14.712 1.00 32.31 H new ATOM 0 HB3 GLU A 104 14.860 -20.447 -14.624 1.00 32.31 H new ATOM 0 HG2 GLU A 104 12.832 -21.993 -13.011 1.00 2.32 H new ATOM 0 HG3 GLU A 104 13.034 -22.328 -14.719 1.00 2.32 H new ATOM 1528 N LYS A 105 16.233 -18.609 -12.631 1.00 72.30 N ATOM 1529 CA LYS A 105 17.212 -17.543 -12.803 1.00 3.14 C ATOM 1530 C LYS A 105 18.148 -17.846 -13.968 1.00 62.32 C ATOM 1531 O LYS A 105 18.312 -18.994 -14.381 1.00 64.53 O ATOM 1532 CB LYS A 105 18.024 -17.356 -11.519 1.00 34.15 C ATOM 1533 CG LYS A 105 19.302 -18.175 -11.482 1.00 43.05 C ATOM 1534 CD LYS A 105 19.683 -18.553 -10.061 1.00 14.13 C ATOM 1535 CE LYS A 105 20.471 -17.444 -9.381 1.00 63.02 C ATOM 1536 NZ LYS A 105 21.145 -17.922 -8.142 1.00 50.20 N ATOM 0 H LYS A 105 16.599 -19.450 -12.184 1.00 72.30 H new ATOM 0 HA LYS A 105 16.673 -16.622 -13.023 1.00 3.14 H new ATOM 0 HB2 LYS A 105 18.275 -16.301 -11.409 1.00 34.15 H new ATOM 0 HB3 LYS A 105 17.404 -17.627 -10.664 1.00 34.15 H new ATOM 0 HG2 LYS A 105 19.173 -19.079 -12.077 1.00 43.05 H new ATOM 0 HG3 LYS A 105 20.113 -17.606 -11.938 1.00 43.05 H new ATOM 0 HD2 LYS A 105 18.782 -18.766 -9.486 1.00 14.13 H new ATOM 0 HD3 LYS A 105 20.276 -19.467 -10.073 1.00 14.13 H new ATOM 0 HE2 LYS A 105 21.217 -17.052 -10.072 1.00 63.02 H new ATOM 0 HE3 LYS A 105 19.801 -16.620 -9.135 1.00 63.02 H new ATOM 0 HZ1 LYS A 105 21.615 -17.122 -7.672 1.00 50.20 H new ATOM 0 HZ2 LYS A 105 20.439 -18.335 -7.500 1.00 50.20 H new ATOM 0 HZ3 LYS A 105 21.853 -18.643 -8.388 1.00 50.20 H new ATOM 1550 N PRO A 106 18.779 -16.794 -14.511 1.00 75.35 N ATOM 1551 CA PRO A 106 18.591 -15.423 -14.029 1.00 35.04 C ATOM 1552 C PRO A 106 17.202 -14.881 -14.349 1.00 12.10 C ATOM 1553 O PRO A 106 16.407 -15.542 -15.018 1.00 14.41 O ATOM 1554 CB PRO A 106 19.661 -14.631 -14.784 1.00 30.22 C ATOM 1555 CG PRO A 106 19.913 -15.421 -16.022 1.00 4.34 C ATOM 1556 CD PRO A 106 19.723 -16.862 -15.639 1.00 72.44 C ATOM 0 HA PRO A 106 18.679 -15.357 -12.945 1.00 35.04 H new ATOM 0 HB2 PRO A 106 19.316 -13.624 -15.020 1.00 30.22 H new ATOM 0 HB3 PRO A 106 20.569 -14.526 -14.190 1.00 30.22 H new ATOM 0 HG2 PRO A 106 19.223 -15.134 -16.815 1.00 4.34 H new ATOM 0 HG3 PRO A 106 20.921 -15.247 -16.398 1.00 4.34 H new ATOM 0 HD2 PRO A 106 19.320 -17.448 -16.465 1.00 72.44 H new ATOM 0 HD3 PRO A 106 20.664 -17.328 -15.348 1.00 72.44 H new ATOM 1564 N ILE A 107 16.917 -13.675 -13.868 1.00 71.43 N ATOM 1565 CA ILE A 107 15.624 -13.045 -14.105 1.00 44.25 C ATOM 1566 C ILE A 107 15.761 -11.846 -15.038 1.00 15.33 C ATOM 1567 O ILE A 107 16.795 -11.179 -15.061 1.00 1.32 O ATOM 1568 CB ILE A 107 14.972 -12.585 -12.788 1.00 70.22 C ATOM 1569 CG1 ILE A 107 14.986 -13.721 -11.763 1.00 61.12 C ATOM 1570 CG2 ILE A 107 13.549 -12.109 -13.040 1.00 21.12 C ATOM 1571 CD1 ILE A 107 14.161 -14.919 -12.178 1.00 33.25 C ATOM 0 H ILE A 107 17.564 -13.115 -13.312 1.00 71.43 H new ATOM 0 HA ILE A 107 14.987 -13.796 -14.572 1.00 44.25 H new ATOM 0 HB ILE A 107 15.548 -11.751 -12.386 1.00 70.22 H new ATOM 0 HG12 ILE A 107 16.016 -14.038 -11.598 1.00 61.12 H new ATOM 0 HG13 ILE A 107 14.612 -13.345 -10.811 1.00 61.12 H new ATOM 0 HG21 ILE A 107 13.101 -11.787 -12.100 1.00 21.12 H new ATOM 0 HG22 ILE A 107 13.563 -11.274 -13.740 1.00 21.12 H new ATOM 0 HG23 ILE A 107 12.962 -12.925 -13.461 1.00 21.12 H new ATOM 0 HD11 ILE A 107 14.217 -15.685 -11.404 1.00 33.25 H new ATOM 0 HD12 ILE A 107 13.123 -14.616 -12.315 1.00 33.25 H new ATOM 0 HD13 ILE A 107 14.548 -15.320 -13.115 1.00 33.25 H new ATOM 1583 N ASP A 108 14.709 -11.577 -15.804 1.00 1.54 N ATOM 1584 CA ASP A 108 14.709 -10.455 -16.736 1.00 64.52 C ATOM 1585 C ASP A 108 14.162 -9.196 -16.072 1.00 51.11 C ATOM 1586 O ASP A 108 13.437 -9.253 -15.078 1.00 65.43 O ATOM 1587 CB ASP A 108 13.880 -10.795 -17.976 1.00 21.24 C ATOM 1588 CG ASP A 108 14.734 -10.952 -19.218 1.00 70.34 C ATOM 1589 OD1 ASP A 108 15.819 -11.562 -19.119 1.00 70.10 O ATOM 1590 OD2 ASP A 108 14.318 -10.465 -20.290 1.00 54.33 O ATOM 0 H ASP A 108 13.846 -12.120 -15.798 1.00 1.54 H new ATOM 0 HA ASP A 108 15.739 -10.265 -17.038 1.00 64.52 H new ATOM 0 HB2 ASP A 108 13.329 -11.718 -17.799 1.00 21.24 H new ATOM 0 HB3 ASP A 108 13.142 -10.010 -18.143 1.00 21.24 H new ATOM 1595 N PRO A 109 14.516 -8.030 -16.632 1.00 1.30 N ATOM 1596 CA PRO A 109 14.072 -6.734 -16.110 1.00 51.21 C ATOM 1597 C PRO A 109 12.581 -6.500 -16.332 1.00 5.23 C ATOM 1598 O PRO A 109 11.903 -5.916 -15.488 1.00 13.10 O ATOM 1599 CB PRO A 109 14.897 -5.726 -16.914 1.00 52.13 C ATOM 1600 CG PRO A 109 15.230 -6.435 -18.182 1.00 2.44 C ATOM 1601 CD PRO A 109 15.377 -7.886 -17.818 1.00 22.21 C ATOM 0 HA PRO A 109 14.214 -6.658 -15.032 1.00 51.21 H new ATOM 0 HB2 PRO A 109 14.331 -4.815 -17.107 1.00 52.13 H new ATOM 0 HB3 PRO A 109 15.798 -5.433 -16.376 1.00 52.13 H new ATOM 0 HG2 PRO A 109 14.444 -6.297 -18.925 1.00 2.44 H new ATOM 0 HG3 PRO A 109 16.151 -6.046 -18.616 1.00 2.44 H new ATOM 0 HD2 PRO A 109 15.055 -8.538 -18.630 1.00 22.21 H new ATOM 0 HD3 PRO A 109 16.413 -8.141 -17.596 1.00 22.21 H new ATOM 1609 N GLY A 110 12.078 -6.960 -17.473 1.00 32.10 N ATOM 1610 CA GLY A 110 10.671 -6.791 -17.784 1.00 75.23 C ATOM 1611 C GLY A 110 9.784 -7.729 -16.989 1.00 61.12 C ATOM 1612 O GLY A 110 8.657 -7.381 -16.637 1.00 40.22 O ATOM 0 H GLY A 110 12.620 -7.447 -18.187 1.00 32.10 H new ATOM 0 HA2 GLY A 110 10.379 -5.761 -17.581 1.00 75.23 H new ATOM 0 HA3 GLY A 110 10.514 -6.963 -18.849 1.00 75.23 H new ATOM 1616 N VAL A 111 10.293 -8.924 -16.706 1.00 60.12 N ATOM 1617 CA VAL A 111 9.540 -9.916 -15.948 1.00 53.20 C ATOM 1618 C VAL A 111 9.578 -9.611 -14.455 1.00 14.02 C ATOM 1619 O VAL A 111 8.611 -9.862 -13.734 1.00 31.22 O ATOM 1620 CB VAL A 111 10.085 -11.337 -16.185 1.00 4.52 C ATOM 1621 CG1 VAL A 111 9.304 -12.352 -15.366 1.00 33.31 C ATOM 1622 CG2 VAL A 111 10.040 -11.684 -17.665 1.00 61.31 C ATOM 0 H VAL A 111 11.224 -9.228 -16.990 1.00 60.12 H new ATOM 0 HA VAL A 111 8.509 -9.868 -16.300 1.00 53.20 H new ATOM 0 HB VAL A 111 11.125 -11.368 -15.860 1.00 4.52 H new ATOM 0 HG11 VAL A 111 9.703 -13.350 -15.547 1.00 33.31 H new ATOM 0 HG12 VAL A 111 9.394 -12.111 -14.307 1.00 33.31 H new ATOM 0 HG13 VAL A 111 8.254 -12.323 -15.657 1.00 33.31 H new ATOM 0 HG21 VAL A 111 10.429 -12.691 -17.815 1.00 61.31 H new ATOM 0 HG22 VAL A 111 9.010 -11.636 -18.019 1.00 61.31 H new ATOM 0 HG23 VAL A 111 10.649 -10.973 -18.224 1.00 61.31 H new ATOM 1632 N LEU A 112 10.700 -9.068 -13.996 1.00 14.41 N ATOM 1633 CA LEU A 112 10.864 -8.727 -12.587 1.00 63.00 C ATOM 1634 C LEU A 112 9.992 -7.534 -12.210 1.00 4.33 C ATOM 1635 O LEU A 112 9.384 -7.509 -11.139 1.00 64.35 O ATOM 1636 CB LEU A 112 12.331 -8.417 -12.285 1.00 45.11 C ATOM 1637 CG LEU A 112 12.670 -8.133 -10.821 1.00 41.13 C ATOM 1638 CD1 LEU A 112 12.903 -9.432 -10.066 1.00 12.15 C ATOM 1639 CD2 LEU A 112 13.891 -7.230 -10.722 1.00 13.32 C ATOM 0 H LEU A 112 11.510 -8.854 -14.579 1.00 14.41 H new ATOM 0 HA LEU A 112 10.550 -9.585 -11.992 1.00 63.00 H new ATOM 0 HB2 LEU A 112 12.936 -9.259 -12.620 1.00 45.11 H new ATOM 0 HB3 LEU A 112 12.629 -7.554 -12.880 1.00 45.11 H new ATOM 0 HG LEU A 112 11.824 -7.618 -10.365 1.00 41.13 H new ATOM 0 HD11 LEU A 112 13.143 -9.210 -9.026 1.00 12.15 H new ATOM 0 HD12 LEU A 112 12.002 -10.044 -10.108 1.00 12.15 H new ATOM 0 HD13 LEU A 112 13.731 -9.974 -10.522 1.00 12.15 H new ATOM 0 HD21 LEU A 112 14.118 -7.038 -9.673 1.00 13.32 H new ATOM 0 HD22 LEU A 112 14.744 -7.718 -11.194 1.00 13.32 H new ATOM 0 HD23 LEU A 112 13.687 -6.286 -11.227 1.00 13.32 H new ATOM 1651 N VAL A 113 9.934 -6.546 -13.097 1.00 43.31 N ATOM 1652 CA VAL A 113 9.134 -5.350 -12.859 1.00 60.40 C ATOM 1653 C VAL A 113 7.645 -5.652 -12.984 1.00 31.20 C ATOM 1654 O VAL A 113 6.855 -5.301 -12.108 1.00 23.41 O ATOM 1655 CB VAL A 113 9.502 -4.223 -13.842 1.00 25.30 C ATOM 1656 CG1 VAL A 113 8.608 -3.012 -13.625 1.00 62.13 C ATOM 1657 CG2 VAL A 113 10.969 -3.847 -13.695 1.00 10.23 C ATOM 0 H VAL A 113 10.432 -6.550 -13.987 1.00 43.31 H new ATOM 0 HA VAL A 113 9.352 -5.021 -11.843 1.00 60.40 H new ATOM 0 HB VAL A 113 9.343 -4.584 -14.858 1.00 25.30 H new ATOM 0 HG11 VAL A 113 8.883 -2.226 -14.328 1.00 62.13 H new ATOM 0 HG12 VAL A 113 7.567 -3.295 -13.785 1.00 62.13 H new ATOM 0 HG13 VAL A 113 8.732 -2.646 -12.606 1.00 62.13 H new ATOM 0 HG21 VAL A 113 11.212 -3.049 -14.397 1.00 10.23 H new ATOM 0 HG22 VAL A 113 11.157 -3.505 -12.677 1.00 10.23 H new ATOM 0 HG23 VAL A 113 11.591 -4.717 -13.905 1.00 10.23 H new ATOM 1667 N GLU A 114 7.269 -6.305 -14.079 1.00 72.41 N ATOM 1668 CA GLU A 114 5.873 -6.654 -14.318 1.00 63.13 C ATOM 1669 C GLU A 114 5.328 -7.524 -13.189 1.00 5.31 C ATOM 1670 O GLU A 114 4.148 -7.447 -12.845 1.00 61.11 O ATOM 1671 CB GLU A 114 5.729 -7.385 -15.655 1.00 21.23 C ATOM 1672 CG GLU A 114 6.164 -8.840 -15.603 1.00 23.14 C ATOM 1673 CD GLU A 114 6.138 -9.506 -16.965 1.00 34.14 C ATOM 1674 OE1 GLU A 114 5.788 -10.703 -17.034 1.00 12.23 O ATOM 1675 OE2 GLU A 114 6.466 -8.830 -17.962 1.00 4.34 O ATOM 0 H GLU A 114 7.910 -6.603 -14.814 1.00 72.41 H new ATOM 0 HA GLU A 114 5.295 -5.730 -14.352 1.00 63.13 H new ATOM 0 HB2 GLU A 114 4.688 -7.337 -15.976 1.00 21.23 H new ATOM 0 HB3 GLU A 114 6.319 -6.865 -16.409 1.00 21.23 H new ATOM 0 HG2 GLU A 114 7.172 -8.899 -15.193 1.00 23.14 H new ATOM 0 HG3 GLU A 114 5.511 -9.387 -14.923 1.00 23.14 H new ATOM 1682 N LEU A 115 6.196 -8.351 -12.616 1.00 10.40 N ATOM 1683 CA LEU A 115 5.803 -9.236 -11.525 1.00 61.12 C ATOM 1684 C LEU A 115 5.448 -8.437 -10.276 1.00 4.44 C ATOM 1685 O LEU A 115 4.546 -8.807 -9.524 1.00 43.21 O ATOM 1686 CB LEU A 115 6.930 -10.222 -11.211 1.00 51.32 C ATOM 1687 CG LEU A 115 6.908 -11.537 -11.990 1.00 74.24 C ATOM 1688 CD1 LEU A 115 8.251 -12.243 -11.885 1.00 14.02 C ATOM 1689 CD2 LEU A 115 5.789 -12.437 -11.486 1.00 21.13 C ATOM 0 H LEU A 115 7.176 -8.427 -12.889 1.00 10.40 H new ATOM 0 HA LEU A 115 4.920 -9.791 -11.841 1.00 61.12 H new ATOM 0 HB2 LEU A 115 7.882 -9.727 -11.401 1.00 51.32 H new ATOM 0 HB3 LEU A 115 6.897 -10.453 -10.146 1.00 51.32 H new ATOM 0 HG LEU A 115 6.721 -11.312 -13.040 1.00 74.24 H new ATOM 0 HD11 LEU A 115 8.216 -13.177 -12.446 1.00 14.02 H new ATOM 0 HD12 LEU A 115 9.032 -11.603 -12.295 1.00 14.02 H new ATOM 0 HD13 LEU A 115 8.469 -12.456 -10.839 1.00 14.02 H new ATOM 0 HD21 LEU A 115 5.788 -13.369 -12.052 1.00 21.13 H new ATOM 0 HD22 LEU A 115 5.945 -12.654 -10.429 1.00 21.13 H new ATOM 0 HD23 LEU A 115 4.831 -11.933 -11.615 1.00 21.13 H new ATOM 1701 N VAL A 116 6.163 -7.337 -10.060 1.00 40.44 N ATOM 1702 CA VAL A 116 5.922 -6.482 -8.904 1.00 32.21 C ATOM 1703 C VAL A 116 4.794 -5.494 -9.177 1.00 12.53 C ATOM 1704 O VAL A 116 4.028 -5.147 -8.278 1.00 40.51 O ATOM 1705 CB VAL A 116 7.189 -5.702 -8.508 1.00 44.35 C ATOM 1706 CG1 VAL A 116 6.958 -4.923 -7.223 1.00 13.33 C ATOM 1707 CG2 VAL A 116 8.373 -6.647 -8.363 1.00 53.53 C ATOM 0 H VAL A 116 6.914 -7.017 -10.671 1.00 40.44 H new ATOM 0 HA VAL A 116 5.636 -7.137 -8.081 1.00 32.21 H new ATOM 0 HB VAL A 116 7.417 -4.989 -9.300 1.00 44.35 H new ATOM 0 HG11 VAL A 116 7.865 -4.378 -6.960 1.00 13.33 H new ATOM 0 HG12 VAL A 116 6.140 -4.217 -7.367 1.00 13.33 H new ATOM 0 HG13 VAL A 116 6.703 -5.614 -6.419 1.00 13.33 H new ATOM 0 HG21 VAL A 116 9.260 -6.079 -8.083 1.00 53.53 H new ATOM 0 HG22 VAL A 116 8.157 -7.386 -7.591 1.00 53.53 H new ATOM 0 HG23 VAL A 116 8.552 -7.154 -9.311 1.00 53.53 H new ATOM 1717 N ALA A 117 4.697 -5.044 -10.424 1.00 4.35 N ATOM 1718 CA ALA A 117 3.661 -4.097 -10.816 1.00 2.41 C ATOM 1719 C ALA A 117 2.283 -4.578 -10.377 1.00 14.15 C ATOM 1720 O ALA A 117 1.518 -3.831 -9.764 1.00 63.30 O ATOM 1721 CB ALA A 117 3.690 -3.876 -12.321 1.00 44.01 C ATOM 0 H ALA A 117 5.324 -5.320 -11.180 1.00 4.35 H new ATOM 0 HA ALA A 117 3.862 -3.149 -10.317 1.00 2.41 H new ATOM 0 HB1 ALA A 117 2.911 -3.166 -12.600 1.00 44.01 H new ATOM 0 HB2 ALA A 117 4.663 -3.479 -12.612 1.00 44.01 H new ATOM 0 HB3 ALA A 117 3.517 -4.824 -12.831 1.00 44.01 H new ATOM 1727 N THR A 118 1.969 -5.830 -10.694 1.00 22.54 N ATOM 1728 CA THR A 118 0.682 -6.411 -10.333 1.00 51.23 C ATOM 1729 C THR A 118 0.388 -6.219 -8.850 1.00 10.21 C ATOM 1730 O THR A 118 -0.766 -6.054 -8.451 1.00 42.12 O ATOM 1731 CB THR A 118 0.631 -7.914 -10.665 1.00 30.34 C ATOM 1732 OG1 THR A 118 -0.684 -8.426 -10.420 1.00 0.41 O ATOM 1733 CG2 THR A 118 1.644 -8.686 -9.833 1.00 32.45 C ATOM 0 H THR A 118 2.589 -6.462 -11.201 1.00 22.54 H new ATOM 0 HA THR A 118 -0.075 -5.891 -10.920 1.00 51.23 H new ATOM 0 HB THR A 118 0.878 -8.039 -11.719 1.00 30.34 H new ATOM 0 HG1 THR A 118 -0.708 -9.382 -10.635 1.00 0.41 H new ATOM 0 HG21 THR A 118 1.590 -9.745 -10.085 1.00 32.45 H new ATOM 0 HG22 THR A 118 2.647 -8.314 -10.043 1.00 32.45 H new ATOM 0 HG23 THR A 118 1.422 -8.553 -8.774 1.00 32.45 H new ATOM 1741 N LEU A 119 1.438 -6.240 -8.036 1.00 73.31 N ATOM 1742 CA LEU A 119 1.292 -6.067 -6.595 1.00 22.41 C ATOM 1743 C LEU A 119 1.255 -4.588 -6.225 1.00 21.12 C ATOM 1744 O LEU A 119 0.551 -4.187 -5.298 1.00 70.32 O ATOM 1745 CB LEU A 119 2.441 -6.760 -5.860 1.00 30.13 C ATOM 1746 CG LEU A 119 2.873 -8.117 -6.417 1.00 44.31 C ATOM 1747 CD1 LEU A 119 4.121 -8.614 -5.703 1.00 73.11 C ATOM 1748 CD2 LEU A 119 1.745 -9.130 -6.291 1.00 13.51 C ATOM 0 H LEU A 119 2.399 -6.375 -8.349 1.00 73.31 H new ATOM 0 HA LEU A 119 0.348 -6.521 -6.293 1.00 22.41 H new ATOM 0 HB2 LEU A 119 3.305 -6.095 -5.868 1.00 30.13 H new ATOM 0 HB3 LEU A 119 2.151 -6.893 -4.818 1.00 30.13 H new ATOM 0 HG LEU A 119 3.108 -7.996 -7.474 1.00 44.31 H new ATOM 0 HD11 LEU A 119 4.414 -9.581 -6.112 1.00 73.11 H new ATOM 0 HD12 LEU A 119 4.931 -7.899 -5.846 1.00 73.11 H new ATOM 0 HD13 LEU A 119 3.914 -8.719 -4.638 1.00 73.11 H new ATOM 0 HD21 LEU A 119 2.071 -10.089 -6.693 1.00 13.51 H new ATOM 0 HD22 LEU A 119 1.478 -9.248 -5.241 1.00 13.51 H new ATOM 0 HD23 LEU A 119 0.877 -8.779 -6.849 1.00 13.51 H new ATOM 1760 N SER A 120 2.016 -3.781 -6.957 1.00 24.02 N ATOM 1761 CA SER A 120 2.072 -2.346 -6.705 1.00 11.13 C ATOM 1762 C SER A 120 0.729 -1.689 -7.007 1.00 53.35 C ATOM 1763 O SER A 120 0.205 -0.922 -6.200 1.00 5.21 O ATOM 1764 CB SER A 120 3.171 -1.700 -7.551 1.00 33.11 C ATOM 1765 OG SER A 120 2.800 -1.653 -8.918 1.00 24.20 O ATOM 0 H SER A 120 2.602 -4.097 -7.730 1.00 24.02 H new ATOM 0 HA SER A 120 2.301 -2.196 -5.650 1.00 11.13 H new ATOM 0 HB2 SER A 120 3.367 -0.691 -7.189 1.00 33.11 H new ATOM 0 HB3 SER A 120 4.098 -2.264 -7.441 1.00 33.11 H new ATOM 0 HG SER A 120 2.336 -2.482 -9.160 1.00 24.20 H new ATOM 1771 N GLU A 121 0.177 -1.996 -8.177 1.00 41.14 N ATOM 1772 CA GLU A 121 -1.105 -1.435 -8.588 1.00 3.44 C ATOM 1773 C GLU A 121 -1.020 0.084 -8.708 1.00 11.45 C ATOM 1774 O GLU A 121 -0.126 0.727 -8.157 1.00 64.13 O ATOM 1775 CB GLU A 121 -2.198 -1.818 -7.588 1.00 61.11 C ATOM 1776 CG GLU A 121 -3.154 -2.878 -8.109 1.00 14.50 C ATOM 1777 CD GLU A 121 -4.448 -2.935 -7.320 1.00 1.54 C ATOM 1778 OE1 GLU A 121 -4.632 -3.901 -6.550 1.00 40.52 O ATOM 1779 OE2 GLU A 121 -5.276 -2.012 -7.472 1.00 31.13 O ATOM 0 H GLU A 121 0.597 -2.630 -8.857 1.00 41.14 H new ATOM 0 HA GLU A 121 -1.356 -1.846 -9.566 1.00 3.44 H new ATOM 0 HB2 GLU A 121 -1.731 -2.181 -6.673 1.00 61.11 H new ATOM 0 HB3 GLU A 121 -2.766 -0.926 -7.324 1.00 61.11 H new ATOM 0 HG2 GLU A 121 -3.380 -2.675 -9.156 1.00 14.50 H new ATOM 0 HG3 GLU A 121 -2.666 -3.852 -8.071 1.00 14.50 H new ATOM 1786 N PRO A 122 -1.973 0.673 -9.445 1.00 12.20 N ATOM 1787 CA PRO A 122 -2.029 2.123 -9.655 1.00 61.12 C ATOM 1788 C PRO A 122 -2.407 2.879 -8.386 1.00 22.42 C ATOM 1789 O PRO A 122 -2.909 2.291 -7.428 1.00 63.34 O ATOM 1790 CB PRO A 122 -3.118 2.286 -10.718 1.00 60.45 C ATOM 1791 CG PRO A 122 -3.984 1.083 -10.561 1.00 45.32 C ATOM 1792 CD PRO A 122 -3.070 -0.031 -10.130 1.00 13.21 C ATOM 0 HA PRO A 122 -1.061 2.529 -9.950 1.00 61.12 H new ATOM 0 HB2 PRO A 122 -3.685 3.204 -10.566 1.00 60.45 H new ATOM 0 HB3 PRO A 122 -2.690 2.338 -11.719 1.00 60.45 H new ATOM 0 HG2 PRO A 122 -4.764 1.257 -9.819 1.00 45.32 H new ATOM 0 HG3 PRO A 122 -4.484 0.837 -11.498 1.00 45.32 H new ATOM 0 HD2 PRO A 122 -3.576 -0.731 -9.465 1.00 13.21 H new ATOM 0 HD3 PRO A 122 -2.708 -0.606 -10.982 1.00 13.21 H new ATOM 1800 N ALA A 123 -2.163 4.185 -8.386 1.00 5.05 N ATOM 1801 CA ALA A 123 -2.480 5.021 -7.235 1.00 3.24 C ATOM 1802 C ALA A 123 -1.871 4.452 -5.958 1.00 20.43 C ATOM 1803 O ALA A 123 -2.471 4.525 -4.886 1.00 55.21 O ATOM 1804 CB ALA A 123 -3.987 5.164 -7.085 1.00 72.40 C ATOM 0 H ALA A 123 -1.747 4.687 -9.170 1.00 5.05 H new ATOM 0 HA ALA A 123 -2.048 6.007 -7.404 1.00 3.24 H new ATOM 0 HB1 ALA A 123 -4.209 5.791 -6.221 1.00 72.40 H new ATOM 0 HB2 ALA A 123 -4.400 5.624 -7.983 1.00 72.40 H new ATOM 0 HB3 ALA A 123 -4.434 4.180 -6.943 1.00 72.40 H new ATOM 1810 N ALA A 124 -0.676 3.883 -6.080 1.00 1.11 N ATOM 1811 CA ALA A 124 0.014 3.302 -4.935 1.00 43.11 C ATOM 1812 C ALA A 124 1.425 2.862 -5.310 1.00 61.53 C ATOM 1813 O ALA A 124 1.726 1.669 -5.339 1.00 52.15 O ATOM 1814 CB ALA A 124 -0.778 2.127 -4.382 1.00 31.12 C ATOM 0 H ALA A 124 -0.166 3.812 -6.960 1.00 1.11 H new ATOM 0 HA ALA A 124 0.093 4.068 -4.163 1.00 43.11 H new ATOM 0 HB1 ALA A 124 -0.251 1.703 -3.527 1.00 31.12 H new ATOM 0 HB2 ALA A 124 -1.764 2.469 -4.067 1.00 31.12 H new ATOM 0 HB3 ALA A 124 -0.887 1.366 -5.155 1.00 31.12 H new ATOM 1820 N ASN A 125 2.286 3.832 -5.597 1.00 45.24 N ATOM 1821 CA ASN A 125 3.666 3.544 -5.972 1.00 60.33 C ATOM 1822 C ASN A 125 4.355 2.700 -4.904 1.00 71.31 C ATOM 1823 O ASN A 125 4.616 3.173 -3.799 1.00 1.05 O ATOM 1824 CB ASN A 125 4.441 4.845 -6.188 1.00 12.32 C ATOM 1825 CG ASN A 125 5.552 4.694 -7.208 1.00 43.34 C ATOM 1826 OD1 ASN A 125 6.658 4.266 -6.879 1.00 64.42 O ATOM 1827 ND2 ASN A 125 5.262 5.047 -8.455 1.00 43.33 N ATOM 0 H ASN A 125 2.053 4.825 -5.577 1.00 45.24 H new ATOM 0 HA ASN A 125 3.652 2.979 -6.904 1.00 60.33 H new ATOM 0 HB2 ASN A 125 3.753 5.624 -6.517 1.00 12.32 H new ATOM 0 HB3 ASN A 125 4.865 5.174 -5.239 1.00 12.32 H new ATOM 0 HD21 ASN A 125 5.970 4.968 -9.185 1.00 43.33 H new ATOM 0 HD22 ASN A 125 4.331 5.397 -8.683 1.00 43.33 H new TER 1834 ASN A 125