USER MOD reduce.3.24.130724 H: found=0, std=0, add=1155, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 1158 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 Single : A 1 ALA N :NH3+ 142:sc= 0.00851 (180deg=0) USER MOD Single : A 9 THR OG1 : rot 100:sc= -2.86 USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 38 THR OG1 : rot 160:sc= -0.671 USER MOD Single : A 45 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 48 ASN : amide:sc= -0.281 K(o=-0.28,f=-2.6!) USER MOD Single : A 49 TYR OH : rot 180:sc= 0 USER MOD Single : A 52 SER OG : rot -73:sc= -1.46! USER MOD Single : A 55 GLN : amide:sc= -0.0847 K(o=-0.085,f=-1.2!) USER MOD Single : A 56 SER OG : rot 139:sc= -4.51! USER MOD Single : A 58 GLN : amide:sc= -3.89! C(o=-3.9!,f=-4.7!) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 SER OG : rot 180:sc= 0 USER MOD Single : A 75 SER OG : rot 180:sc= -0.0891 USER MOD Single : A 80 HIS : no HD1:sc= -5.6! C(o=-5.6!,f=-8!) USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : B 109 THR OG1 : rot 100:sc= -2.85 USER MOD Single : B 118 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 125 SER OG : rot 180:sc= 0 USER MOD Single : B 138 THR OG1 : rot 162:sc= -0.722 USER MOD Single : B 145 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 148 ASN : amide:sc= -0.296 K(o=-0.3,f=-2.6!) USER MOD Single : B 149 TYR OH : rot 180:sc= 0 USER MOD Single : B 152 SER OG : rot -77:sc= 1.18 USER MOD Single : B 155 GLN : amide:sc= -0.0969 K(o=-0.097,f=-1.2!) USER MOD Single : B 156 SER OG : rot -35:sc= -4.15! USER MOD Single : B 158 GLN : amide:sc= -4.01! C(o=-4!,f=-4.6!) USER MOD Single : B 159 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 163 SER OG : rot 180:sc= 0 USER MOD Single : B 175 SER OG : rot 180:sc= -0.0512 USER MOD Single : B 180 HIS : no HD1:sc= -5.39! C(o=-5.4!,f=-7.5!) USER MOD Single : B 192 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 18.376 39.638 -1.907 1.00 9.95 N ATOM 2 CA ALA A 1 18.029 38.695 -0.806 1.00 9.34 C ATOM 3 C ALA A 1 18.820 37.404 -0.952 1.00 8.30 C ATOM 4 O ALA A 1 18.909 36.858 -2.054 1.00 8.16 O ATOM 5 CB ALA A 1 16.536 38.410 -0.820 1.00 9.73 C ATOM 0 H1 ALA A 1 17.521 40.144 -2.213 1.00 9.95 H new ATOM 0 H2 ALA A 1 19.081 40.323 -1.568 1.00 9.95 H new ATOM 0 H3 ALA A 1 18.769 39.105 -2.709 1.00 9.95 H new ATOM 0 HA ALA A 1 18.289 39.152 0.149 1.00 9.34 H new ATOM 0 HB1 ALA A 1 16.290 37.720 -0.013 1.00 9.73 H new ATOM 0 HB2 ALA A 1 15.987 39.341 -0.682 1.00 9.73 H new ATOM 0 HB3 ALA A 1 16.260 37.964 -1.775 1.00 9.73 H new ATOM 13 N VAL A 2 19.453 36.936 0.132 1.00 7.83 N ATOM 14 CA VAL A 2 20.282 35.735 0.029 1.00 7.06 C ATOM 15 C VAL A 2 19.468 34.528 -0.446 1.00 5.87 C ATOM 16 O VAL A 2 18.806 33.884 0.374 1.00 5.74 O ATOM 17 CB VAL A 2 20.968 35.441 1.387 1.00 7.48 C ATOM 18 CG1 VAL A 2 19.938 35.330 2.500 1.00 8.02 C ATOM 19 CG2 VAL A 2 21.839 34.193 1.323 1.00 7.83 C ATOM 0 H VAL A 2 19.409 37.356 1.060 1.00 7.83 H new ATOM 0 HA VAL A 2 21.053 35.920 -0.719 1.00 7.06 H new ATOM 0 HB VAL A 2 21.624 36.282 1.610 1.00 7.48 H new ATOM 0 HG11 VAL A 2 20.443 35.123 3.444 1.00 8.02 H new ATOM 0 HG12 VAL A 2 19.387 36.267 2.581 1.00 8.02 H new ATOM 0 HG13 VAL A 2 19.245 34.520 2.275 1.00 8.02 H new ATOM 0 HG21 VAL A 2 22.302 34.022 2.295 1.00 7.83 H new ATOM 0 HG22 VAL A 2 21.224 33.333 1.058 1.00 7.83 H new ATOM 0 HG23 VAL A 2 22.616 34.329 0.570 1.00 7.83 H new ATOM 29 N LEU A 3 19.501 34.203 -1.736 1.00 5.32 N ATOM 30 CA LEU A 3 18.732 33.045 -2.218 1.00 4.36 C ATOM 31 C LEU A 3 19.268 32.492 -3.533 1.00 4.03 C ATOM 32 O LEU A 3 19.390 33.203 -4.529 1.00 4.40 O ATOM 33 CB LEU A 3 17.227 33.387 -2.300 1.00 4.40 C ATOM 34 CG LEU A 3 16.714 33.988 -3.610 1.00 5.00 C ATOM 35 CD1 LEU A 3 15.497 33.214 -4.098 1.00 5.26 C ATOM 36 CD2 LEU A 3 16.367 35.455 -3.418 1.00 5.86 C ATOM 0 H LEU A 3 20.031 34.702 -2.450 1.00 5.32 H new ATOM 0 HA LEU A 3 18.855 32.245 -1.488 1.00 4.36 H new ATOM 0 HB2 LEU A 3 16.663 32.475 -2.104 1.00 4.40 H new ATOM 0 HB3 LEU A 3 16.995 34.085 -1.495 1.00 4.40 H new ATOM 0 HG LEU A 3 17.500 33.915 -4.362 1.00 5.00 H new ATOM 0 HD11 LEU A 3 15.139 33.649 -5.031 1.00 5.26 H new ATOM 0 HD12 LEU A 3 15.771 32.172 -4.265 1.00 5.26 H new ATOM 0 HD13 LEU A 3 14.708 33.265 -3.348 1.00 5.26 H new ATOM 0 HD21 LEU A 3 16.003 35.869 -4.359 1.00 5.86 H new ATOM 0 HD22 LEU A 3 15.593 35.549 -2.657 1.00 5.86 H new ATOM 0 HD23 LEU A 3 17.256 36.001 -3.101 1.00 5.86 H new ATOM 48 N ASP A 4 19.490 31.192 -3.521 1.00 3.91 N ATOM 49 CA ASP A 4 19.901 30.422 -4.672 1.00 4.19 C ATOM 50 C ASP A 4 18.613 29.997 -5.364 1.00 3.97 C ATOM 51 O ASP A 4 18.052 28.931 -5.131 1.00 4.06 O ATOM 52 CB ASP A 4 20.745 29.213 -4.266 1.00 4.92 C ATOM 53 CG ASP A 4 21.930 29.002 -5.189 1.00 5.74 C ATOM 54 OD1 ASP A 4 21.737 28.434 -6.284 1.00 6.22 O ATOM 55 OD2 ASP A 4 23.053 29.407 -4.818 1.00 6.19 O ATOM 0 H ASP A 4 19.385 30.626 -2.679 1.00 3.91 H new ATOM 0 HA ASP A 4 20.534 31.009 -5.337 1.00 4.19 H new ATOM 0 HB2 ASP A 4 21.102 29.348 -3.245 1.00 4.92 H new ATOM 0 HB3 ASP A 4 20.121 28.319 -4.270 1.00 4.92 H new ATOM 60 N LEU A 5 18.204 30.897 -6.256 1.00 4.28 N ATOM 61 CA LEU A 5 17.099 30.823 -7.071 1.00 4.71 C ATOM 62 C LEU A 5 17.390 31.826 -8.247 1.00 5.46 C ATOM 63 O LEU A 5 18.356 31.688 -8.997 1.00 6.27 O ATOM 64 CB LEU A 5 15.885 31.122 -6.206 1.00 5.36 C ATOM 65 CG LEU A 5 14.541 30.604 -6.752 1.00 6.10 C ATOM 66 CD1 LEU A 5 14.125 31.328 -8.019 1.00 5.79 C ATOM 67 CD2 LEU A 5 14.628 29.104 -7.019 1.00 7.09 C ATOM 0 H LEU A 5 18.722 31.763 -6.403 1.00 4.28 H new ATOM 0 HA LEU A 5 16.891 29.853 -7.523 1.00 4.71 H new ATOM 0 HB2 LEU A 5 16.048 30.689 -5.219 1.00 5.36 H new ATOM 0 HB3 LEU A 5 15.812 32.201 -6.073 1.00 5.36 H new ATOM 0 HG LEU A 5 13.783 30.800 -5.994 1.00 6.10 H new ATOM 0 HD11 LEU A 5 13.172 30.931 -8.369 1.00 5.79 H new ATOM 0 HD12 LEU A 5 14.020 32.393 -7.812 1.00 5.79 H new ATOM 0 HD13 LEU A 5 14.884 31.181 -8.788 1.00 5.79 H new ATOM 0 HD21 LEU A 5 13.673 28.747 -7.405 1.00 7.09 H new ATOM 0 HD22 LEU A 5 15.411 28.910 -7.752 1.00 7.09 H new ATOM 0 HD23 LEU A 5 14.862 28.582 -6.091 1.00 7.09 H new ATOM 79 N ASP A 6 16.510 32.772 -8.358 1.00 5.46 N ATOM 80 CA ASP A 6 16.520 33.852 -9.394 1.00 6.41 C ATOM 81 C ASP A 6 15.429 34.938 -9.079 1.00 6.28 C ATOM 82 O ASP A 6 15.619 36.144 -9.222 1.00 6.48 O ATOM 83 CB ASP A 6 16.326 33.171 -10.732 1.00 7.20 C ATOM 84 CG ASP A 6 17.060 33.864 -11.865 1.00 8.21 C ATOM 85 OD1 ASP A 6 16.546 34.886 -12.368 1.00 8.78 O ATOM 86 OD2 ASP A 6 18.146 33.382 -12.251 1.00 8.64 O ATOM 0 H ASP A 6 15.717 32.849 -7.721 1.00 5.46 H new ATOM 0 HA ASP A 6 17.463 34.398 -9.404 1.00 6.41 H new ATOM 0 HB2 ASP A 6 16.671 32.139 -10.661 1.00 7.20 H new ATOM 0 HB3 ASP A 6 15.262 33.136 -10.964 1.00 7.20 H new ATOM 91 N VAL A 7 14.375 34.395 -8.520 1.00 6.22 N ATOM 92 CA VAL A 7 13.271 35.110 -7.982 1.00 6.28 C ATOM 93 C VAL A 7 12.780 34.281 -6.822 1.00 5.52 C ATOM 94 O VAL A 7 12.370 33.139 -6.993 1.00 5.69 O ATOM 95 CB VAL A 7 12.192 35.386 -9.049 1.00 7.22 C ATOM 96 CG1 VAL A 7 11.588 34.096 -9.572 1.00 7.36 C ATOM 97 CG2 VAL A 7 11.126 36.319 -8.502 1.00 7.51 C ATOM 0 H VAL A 7 14.271 33.384 -8.429 1.00 6.22 H new ATOM 0 HA VAL A 7 13.554 36.105 -7.639 1.00 6.28 H new ATOM 0 HB VAL A 7 12.670 35.881 -9.894 1.00 7.22 H new ATOM 0 HG11 VAL A 7 10.831 34.326 -10.322 1.00 7.36 H new ATOM 0 HG12 VAL A 7 12.370 33.484 -10.021 1.00 7.36 H new ATOM 0 HG13 VAL A 7 11.128 33.550 -8.749 1.00 7.36 H new ATOM 0 HG21 VAL A 7 10.374 36.502 -9.269 1.00 7.51 H new ATOM 0 HG22 VAL A 7 10.654 35.862 -7.633 1.00 7.51 H new ATOM 0 HG23 VAL A 7 11.584 37.264 -8.211 1.00 7.51 H new ATOM 107 N ARG A 8 12.845 34.875 -5.630 1.00 5.09 N ATOM 108 CA ARG A 8 12.460 34.184 -4.489 1.00 4.80 C ATOM 109 C ARG A 8 11.003 34.168 -4.340 1.00 4.48 C ATOM 110 O ARG A 8 10.428 35.122 -3.789 1.00 4.96 O ATOM 111 CB ARG A 8 13.093 34.807 -3.221 1.00 5.24 C ATOM 112 CG ARG A 8 13.400 36.308 -3.306 1.00 6.15 C ATOM 113 CD ARG A 8 12.151 37.163 -3.131 1.00 6.93 C ATOM 114 NE ARG A 8 11.638 37.652 -4.414 1.00 7.61 N ATOM 115 CZ ARG A 8 10.411 38.150 -4.590 1.00 8.32 C ATOM 116 NH1 ARG A 8 9.566 38.247 -3.571 1.00 8.49 N ATOM 117 NH2 ARG A 8 10.033 38.558 -5.795 1.00 9.08 N ATOM 0 H ARG A 8 13.165 35.831 -5.472 1.00 5.09 H new ATOM 0 HA ARG A 8 12.815 33.160 -4.603 1.00 4.80 H new ATOM 0 HB2 ARG A 8 12.420 34.638 -2.380 1.00 5.24 H new ATOM 0 HB3 ARG A 8 14.019 34.276 -3.000 1.00 5.24 H new ATOM 0 HG2 ARG A 8 14.129 36.572 -2.540 1.00 6.15 H new ATOM 0 HG3 ARG A 8 13.857 36.529 -4.270 1.00 6.15 H new ATOM 0 HD2 ARG A 8 11.379 36.579 -2.630 1.00 6.93 H new ATOM 0 HD3 ARG A 8 12.379 38.011 -2.485 1.00 6.93 H new ATOM 0 HE ARG A 8 12.257 37.609 -5.224 1.00 7.61 H new ATOM 0 HH11 ARG A 8 9.851 37.940 -2.641 1.00 8.49 H new ATOM 0 HH12 ARG A 8 8.632 38.629 -3.718 1.00 8.49 H new ATOM 0 HH21 ARG A 8 10.678 38.491 -6.582 1.00 9.08 H new ATOM 0 HH22 ARG A 8 9.097 38.939 -5.934 1.00 9.08 H new ATOM 131 N THR A 9 10.424 33.023 -4.623 1.00 4.05 N ATOM 132 CA THR A 9 9.068 32.912 -4.245 1.00 4.08 C ATOM 133 C THR A 9 9.241 32.083 -3.019 1.00 3.18 C ATOM 134 O THR A 9 9.203 30.855 -3.046 1.00 3.47 O ATOM 135 CB THR A 9 8.216 32.216 -5.310 1.00 4.95 C ATOM 136 OG1 THR A 9 6.957 31.844 -4.778 1.00 5.55 O ATOM 137 CG2 THR A 9 8.861 30.974 -5.880 1.00 5.66 C ATOM 0 H THR A 9 10.848 32.217 -5.082 1.00 4.05 H new ATOM 0 HA THR A 9 8.542 33.856 -4.103 1.00 4.08 H new ATOM 0 HB THR A 9 8.107 32.945 -6.113 1.00 4.95 H new ATOM 0 HG1 THR A 9 6.281 32.501 -5.047 1.00 5.55 H new ATOM 0 HG21 THR A 9 8.202 30.533 -6.628 1.00 5.66 H new ATOM 0 HG22 THR A 9 9.812 31.238 -6.344 1.00 5.66 H new ATOM 0 HG23 THR A 9 9.035 30.254 -5.080 1.00 5.66 H new ATOM 145 N CYS A 10 9.486 32.794 -1.947 1.00 2.54 N ATOM 146 CA CYS A 10 9.750 32.144 -0.669 1.00 1.93 C ATOM 147 C CYS A 10 8.476 31.580 -0.028 1.00 1.72 C ATOM 148 O CYS A 10 8.130 31.922 1.103 1.00 1.97 O ATOM 149 CB CYS A 10 10.499 33.086 0.269 1.00 2.28 C ATOM 150 SG CYS A 10 12.286 32.706 0.424 1.00 2.68 S ATOM 0 H CYS A 10 9.510 33.813 -1.923 1.00 2.54 H new ATOM 0 HA CYS A 10 10.393 31.285 -0.862 1.00 1.93 H new ATOM 0 HB2 CYS A 10 10.384 34.109 -0.090 1.00 2.28 H new ATOM 0 HB3 CYS A 10 10.040 33.041 1.257 1.00 2.28 H new ATOM 155 N LEU A 11 7.784 30.719 -0.779 1.00 1.49 N ATOM 156 CA LEU A 11 6.542 30.055 -0.336 1.00 1.39 C ATOM 157 C LEU A 11 6.535 29.667 1.153 1.00 1.20 C ATOM 158 O LEU A 11 7.307 28.805 1.573 1.00 1.16 O ATOM 159 CB LEU A 11 6.287 28.810 -1.180 1.00 1.55 C ATOM 160 CG LEU A 11 4.847 28.300 -1.150 1.00 1.91 C ATOM 161 CD1 LEU A 11 3.908 29.319 -1.776 1.00 2.48 C ATOM 162 CD2 LEU A 11 4.741 26.963 -1.866 1.00 2.29 C ATOM 0 H LEU A 11 8.068 30.456 -1.723 1.00 1.49 H new ATOM 0 HA LEU A 11 5.748 30.789 -0.472 1.00 1.39 H new ATOM 0 HB2 LEU A 11 6.560 29.026 -2.213 1.00 1.55 H new ATOM 0 HB3 LEU A 11 6.947 28.014 -0.836 1.00 1.55 H new ATOM 0 HG LEU A 11 4.553 28.156 -0.110 1.00 1.91 H new ATOM 0 HD11 LEU A 11 2.887 28.939 -1.746 1.00 2.48 H new ATOM 0 HD12 LEU A 11 3.964 30.255 -1.220 1.00 2.48 H new ATOM 0 HD13 LEU A 11 4.200 29.495 -2.811 1.00 2.48 H new ATOM 0 HD21 LEU A 11 3.709 26.615 -1.835 1.00 2.29 H new ATOM 0 HD22 LEU A 11 5.053 27.080 -2.904 1.00 2.29 H new ATOM 0 HD23 LEU A 11 5.385 26.234 -1.373 1.00 2.29 H new ATOM 174 N PRO A 12 5.662 30.274 1.975 1.00 1.19 N ATOM 175 CA PRO A 12 5.584 29.956 3.398 1.00 1.11 C ATOM 176 C PRO A 12 4.512 28.927 3.780 1.00 1.01 C ATOM 177 O PRO A 12 3.420 28.950 3.217 1.00 1.05 O ATOM 178 CB PRO A 12 5.155 31.305 3.980 1.00 1.29 C ATOM 179 CG PRO A 12 4.248 31.894 2.941 1.00 1.49 C ATOM 180 CD PRO A 12 4.691 31.330 1.607 1.00 1.39 C ATOM 0 HA PRO A 12 6.521 29.522 3.748 1.00 1.11 H new ATOM 0 HB2 PRO A 12 4.639 31.180 4.932 1.00 1.29 H new ATOM 0 HB3 PRO A 12 6.015 31.948 4.166 1.00 1.29 H new ATOM 0 HG2 PRO A 12 3.208 31.637 3.144 1.00 1.49 H new ATOM 0 HG3 PRO A 12 4.313 32.982 2.942 1.00 1.49 H new ATOM 0 HD2 PRO A 12 3.850 30.922 1.046 1.00 1.39 H new ATOM 0 HD3 PRO A 12 5.150 32.096 0.982 1.00 1.39 H new ATOM 188 N CYS A 13 4.851 27.944 4.632 1.00 0.93 N ATOM 189 CA CYS A 13 3.863 26.928 4.988 1.00 0.89 C ATOM 190 C CYS A 13 3.913 26.517 6.476 1.00 0.90 C ATOM 191 O CYS A 13 4.610 27.118 7.294 1.00 1.00 O ATOM 192 CB CYS A 13 3.989 25.729 4.028 1.00 0.82 C ATOM 193 SG CYS A 13 5.024 24.326 4.582 1.00 0.86 S ATOM 0 H CYS A 13 5.766 27.837 5.069 1.00 0.93 H new ATOM 0 HA CYS A 13 2.872 27.365 4.867 1.00 0.89 H new ATOM 0 HB2 CYS A 13 2.987 25.351 3.825 1.00 0.82 H new ATOM 0 HB3 CYS A 13 4.390 26.093 3.082 1.00 0.82 H new ATOM 198 N GLY A 14 3.189 25.437 6.787 1.00 0.91 N ATOM 199 CA GLY A 14 3.159 24.916 8.143 1.00 0.98 C ATOM 200 C GLY A 14 2.269 25.743 9.046 1.00 1.10 C ATOM 201 O GLY A 14 1.407 26.470 8.553 1.00 1.15 O ATOM 0 H GLY A 14 2.622 24.915 6.119 1.00 0.91 H new ATOM 0 HA2 GLY A 14 2.804 23.886 8.128 1.00 0.98 H new ATOM 0 HA3 GLY A 14 4.171 24.899 8.548 1.00 0.98 H new ATOM 205 N PRO A 15 2.487 25.722 10.378 1.00 1.19 N ATOM 206 CA PRO A 15 1.723 26.560 11.328 1.00 1.33 C ATOM 207 C PRO A 15 2.032 28.000 10.965 1.00 1.40 C ATOM 208 O PRO A 15 3.110 28.491 11.262 1.00 1.57 O ATOM 209 CB PRO A 15 2.353 26.172 12.664 1.00 1.46 C ATOM 210 CG PRO A 15 3.721 26.011 12.200 1.00 1.39 C ATOM 211 CD PRO A 15 3.566 25.026 11.089 1.00 1.21 C ATOM 0 HA PRO A 15 0.640 26.437 11.334 1.00 1.33 H new ATOM 0 HB2 PRO A 15 2.250 26.946 13.424 1.00 1.46 H new ATOM 0 HB3 PRO A 15 1.935 25.256 13.082 1.00 1.46 H new ATOM 0 HG2 PRO A 15 4.146 26.953 11.852 1.00 1.39 H new ATOM 0 HG3 PRO A 15 4.376 25.637 12.987 1.00 1.39 H new ATOM 0 HD2 PRO A 15 4.469 24.909 10.490 1.00 1.21 H new ATOM 0 HD3 PRO A 15 3.281 24.032 11.434 1.00 1.21 H new ATOM 219 N GLY A 16 1.073 28.703 10.502 1.00 1.34 N ATOM 220 CA GLY A 16 1.219 30.081 10.213 1.00 1.47 C ATOM 221 C GLY A 16 2.021 30.327 9.000 1.00 1.43 C ATOM 222 O GLY A 16 2.131 31.488 8.575 1.00 1.68 O ATOM 0 H GLY A 16 0.143 28.332 10.308 1.00 1.34 H new ATOM 0 HA2 GLY A 16 0.233 30.528 10.088 1.00 1.47 H new ATOM 0 HA3 GLY A 16 1.689 30.578 11.061 1.00 1.47 H new ATOM 226 N GLY A 17 2.620 29.279 8.421 1.00 1.28 N ATOM 227 CA GLY A 17 3.384 29.503 7.290 1.00 1.25 C ATOM 228 C GLY A 17 4.736 30.086 7.640 1.00 1.24 C ATOM 229 O GLY A 17 5.236 31.019 7.018 1.00 1.36 O ATOM 0 H GLY A 17 2.566 28.312 8.740 1.00 1.28 H new ATOM 0 HA2 GLY A 17 3.520 28.566 6.750 1.00 1.25 H new ATOM 0 HA3 GLY A 17 2.856 30.183 6.622 1.00 1.25 H new ATOM 233 N LYS A 18 5.366 29.399 8.606 1.00 1.18 N ATOM 234 CA LYS A 18 6.718 29.700 9.059 1.00 1.23 C ATOM 235 C LYS A 18 7.748 28.768 8.435 1.00 1.13 C ATOM 236 O LYS A 18 8.919 28.835 8.810 1.00 1.22 O ATOM 237 CB LYS A 18 6.859 29.594 10.590 1.00 1.28 C ATOM 238 CG LYS A 18 5.549 29.559 11.352 1.00 1.34 C ATOM 239 CD LYS A 18 5.536 30.547 12.505 1.00 1.73 C ATOM 240 CE LYS A 18 5.152 29.880 13.816 1.00 1.91 C ATOM 241 NZ LYS A 18 6.163 30.126 14.882 1.00 2.50 N ATOM 0 H LYS A 18 4.940 28.612 9.095 1.00 1.18 H new ATOM 0 HA LYS A 18 6.903 30.727 8.743 1.00 1.23 H new ATOM 0 HB2 LYS A 18 7.424 28.692 10.826 1.00 1.28 H new ATOM 0 HB3 LYS A 18 7.446 30.441 10.945 1.00 1.28 H new ATOM 0 HG2 LYS A 18 4.728 29.785 10.672 1.00 1.34 H new ATOM 0 HG3 LYS A 18 5.379 28.553 11.735 1.00 1.34 H new ATOM 0 HD2 LYS A 18 6.521 31.003 12.604 1.00 1.73 H new ATOM 0 HD3 LYS A 18 4.833 31.351 12.287 1.00 1.73 H new ATOM 0 HE2 LYS A 18 4.182 30.254 14.143 1.00 1.91 H new ATOM 0 HE3 LYS A 18 5.044 28.807 13.659 1.00 1.91 H new ATOM 0 HZ1 LYS A 18 5.864 29.655 15.759 1.00 2.50 H new ATOM 0 HZ2 LYS A 18 7.084 29.747 14.582 1.00 2.50 H new ATOM 0 HZ3 LYS A 18 6.248 31.149 15.050 1.00 2.50 H new ATOM 255 N GLY A 19 7.398 27.944 7.447 1.00 1.02 N ATOM 256 CA GLY A 19 8.337 27.053 6.789 1.00 0.95 C ATOM 257 C GLY A 19 8.258 27.363 5.310 1.00 0.91 C ATOM 258 O GLY A 19 7.719 28.419 4.961 1.00 1.00 O ATOM 0 H GLY A 19 6.447 27.880 7.083 1.00 1.02 H new ATOM 0 HA2 GLY A 19 9.348 27.209 7.165 1.00 0.95 H new ATOM 0 HA3 GLY A 19 8.083 26.011 6.981 1.00 0.95 H new ATOM 262 N ARG A 20 8.822 26.555 4.404 1.00 0.86 N ATOM 263 CA ARG A 20 8.745 26.858 2.981 1.00 0.86 C ATOM 264 C ARG A 20 8.403 25.553 2.228 1.00 0.80 C ATOM 265 O ARG A 20 8.612 24.462 2.766 1.00 0.78 O ATOM 266 CB ARG A 20 10.086 27.412 2.510 1.00 0.94 C ATOM 267 CG ARG A 20 10.093 28.917 2.313 1.00 1.13 C ATOM 268 CD ARG A 20 11.370 29.541 2.850 1.00 1.55 C ATOM 269 NE ARG A 20 11.134 30.302 4.077 1.00 1.82 N ATOM 270 CZ ARG A 20 11.951 30.296 5.131 1.00 2.25 C ATOM 271 NH1 ARG A 20 13.063 29.569 5.122 1.00 2.59 N ATOM 272 NH2 ARG A 20 11.654 31.021 6.201 1.00 2.92 N ATOM 0 H ARG A 20 9.329 25.700 4.632 1.00 0.86 H new ATOM 0 HA ARG A 20 7.975 27.605 2.785 1.00 0.86 H new ATOM 0 HB2 ARG A 20 10.853 27.147 3.237 1.00 0.94 H new ATOM 0 HB3 ARG A 20 10.357 26.931 1.570 1.00 0.94 H new ATOM 0 HG2 ARG A 20 9.992 29.147 1.252 1.00 1.13 H new ATOM 0 HG3 ARG A 20 9.232 29.355 2.818 1.00 1.13 H new ATOM 0 HD2 ARG A 20 12.102 28.758 3.044 1.00 1.55 H new ATOM 0 HD3 ARG A 20 11.799 30.198 2.093 1.00 1.55 H new ATOM 0 HE ARG A 20 10.291 30.874 4.130 1.00 1.82 H new ATOM 0 HH11 ARG A 20 13.299 29.008 4.303 1.00 2.59 H new ATOM 0 HH12 ARG A 20 13.681 29.572 5.934 1.00 2.59 H new ATOM 0 HH21 ARG A 20 10.802 31.582 6.217 1.00 2.92 H new ATOM 0 HH22 ARG A 20 12.277 31.018 7.008 1.00 2.92 H new ATOM 286 N CYS A 21 7.861 25.643 1.007 1.00 0.82 N ATOM 287 CA CYS A 21 7.480 24.427 0.261 1.00 0.81 C ATOM 288 C CYS A 21 8.413 24.132 -0.908 1.00 0.84 C ATOM 289 O CYS A 21 9.128 25.012 -1.391 1.00 1.04 O ATOM 290 CB CYS A 21 6.043 24.544 -0.263 1.00 0.91 C ATOM 291 SG CYS A 21 5.163 22.952 -0.387 1.00 1.10 S ATOM 0 H CYS A 21 7.678 26.520 0.520 1.00 0.82 H new ATOM 0 HA CYS A 21 7.558 23.600 0.967 1.00 0.81 H new ATOM 0 HB2 CYS A 21 5.481 25.207 0.395 1.00 0.91 H new ATOM 0 HB3 CYS A 21 6.064 25.013 -1.247 1.00 0.91 H new ATOM 296 N PHE A 22 8.387 22.873 -1.364 1.00 0.76 N ATOM 297 CA PHE A 22 9.220 22.445 -2.484 1.00 0.83 C ATOM 298 C PHE A 22 8.360 21.790 -3.559 1.00 0.94 C ATOM 299 O PHE A 22 8.471 22.108 -4.743 1.00 1.43 O ATOM 300 CB PHE A 22 10.300 21.469 -2.006 1.00 0.85 C ATOM 301 CG PHE A 22 11.340 22.104 -1.127 1.00 0.84 C ATOM 302 CD1 PHE A 22 11.067 22.376 0.205 1.00 1.40 C ATOM 303 CD2 PHE A 22 12.590 22.427 -1.631 1.00 1.42 C ATOM 304 CE1 PHE A 22 12.023 22.959 1.016 1.00 1.51 C ATOM 305 CE2 PHE A 22 13.549 23.009 -0.824 1.00 1.50 C ATOM 306 CZ PHE A 22 13.265 23.275 0.502 1.00 1.14 C ATOM 0 H PHE A 22 7.798 22.138 -0.972 1.00 0.76 H new ATOM 0 HA PHE A 22 9.708 23.323 -2.908 1.00 0.83 H new ATOM 0 HB2 PHE A 22 9.825 20.653 -1.461 1.00 0.85 H new ATOM 0 HB3 PHE A 22 10.790 21.029 -2.875 1.00 0.85 H new ATOM 0 HD1 PHE A 22 10.098 22.130 0.613 1.00 1.40 H new ATOM 0 HD2 PHE A 22 12.817 22.221 -2.667 1.00 1.42 H new ATOM 0 HE1 PHE A 22 11.798 23.167 2.052 1.00 1.51 H new ATOM 0 HE2 PHE A 22 14.519 23.256 -1.229 1.00 1.50 H new ATOM 0 HZ PHE A 22 14.013 23.729 1.135 1.00 1.14 H new ATOM 316 N GLY A 23 7.490 20.882 -3.128 1.00 0.83 N ATOM 317 CA GLY A 23 6.600 20.198 -4.050 1.00 0.88 C ATOM 318 C GLY A 23 5.141 20.500 -3.746 1.00 0.88 C ATOM 319 O GLY A 23 4.849 21.498 -3.086 1.00 0.90 O ATOM 0 H GLY A 23 7.385 20.606 -2.152 1.00 0.83 H new ATOM 0 HA2 GLY A 23 6.830 20.501 -5.071 1.00 0.88 H new ATOM 0 HA3 GLY A 23 6.770 19.123 -3.991 1.00 0.88 H new ATOM 323 N PRO A 24 4.187 19.663 -4.202 1.00 1.01 N ATOM 324 CA PRO A 24 2.769 19.884 -3.946 1.00 1.07 C ATOM 325 C PRO A 24 2.348 19.328 -2.586 1.00 0.96 C ATOM 326 O PRO A 24 2.035 20.088 -1.670 1.00 1.03 O ATOM 327 CB PRO A 24 2.069 19.128 -5.089 1.00 1.32 C ATOM 328 CG PRO A 24 3.147 18.392 -5.836 1.00 1.50 C ATOM 329 CD PRO A 24 4.391 18.446 -4.990 1.00 1.24 C ATOM 0 HA PRO A 24 2.514 20.943 -3.916 1.00 1.07 H new ATOM 0 HB2 PRO A 24 1.325 18.434 -4.697 1.00 1.32 H new ATOM 0 HB3 PRO A 24 1.544 19.820 -5.747 1.00 1.32 H new ATOM 0 HG2 PRO A 24 2.851 17.359 -6.020 1.00 1.50 H new ATOM 0 HG3 PRO A 24 3.323 18.851 -6.809 1.00 1.50 H new ATOM 0 HD2 PRO A 24 4.489 17.564 -4.357 1.00 1.24 H new ATOM 0 HD3 PRO A 24 5.293 18.503 -5.599 1.00 1.24 H new ATOM 337 N SER A 25 2.363 18.001 -2.450 1.00 0.97 N ATOM 338 CA SER A 25 2.005 17.359 -1.183 1.00 0.92 C ATOM 339 C SER A 25 3.241 17.204 -0.316 1.00 0.78 C ATOM 340 O SER A 25 3.319 16.287 0.492 1.00 0.81 O ATOM 341 CB SER A 25 1.371 15.969 -1.410 1.00 1.12 C ATOM 342 OG SER A 25 -0.044 16.044 -1.359 1.00 1.26 O ATOM 0 H SER A 25 2.617 17.353 -3.196 1.00 0.97 H new ATOM 0 HA SER A 25 1.273 17.995 -0.686 1.00 0.92 H new ATOM 0 HB2 SER A 25 1.684 15.576 -2.377 1.00 1.12 H new ATOM 0 HB3 SER A 25 1.730 15.273 -0.652 1.00 1.12 H new ATOM 0 HG SER A 25 -0.424 15.153 -1.507 1.00 1.26 H new ATOM 348 N ILE A 26 4.234 18.072 -0.509 1.00 0.70 N ATOM 349 CA ILE A 26 5.458 17.970 0.249 1.00 0.61 C ATOM 350 C ILE A 26 6.048 19.352 0.567 1.00 0.58 C ATOM 351 O ILE A 26 6.502 20.091 -0.321 1.00 0.73 O ATOM 352 CB ILE A 26 6.482 17.075 -0.486 1.00 0.60 C ATOM 353 CG1 ILE A 26 5.789 15.888 -1.163 1.00 0.79 C ATOM 354 CG2 ILE A 26 7.504 16.578 0.490 1.00 0.74 C ATOM 355 CD1 ILE A 26 6.706 15.075 -2.055 1.00 0.83 C ATOM 0 H ILE A 26 4.206 18.841 -1.178 1.00 0.70 H new ATOM 0 HA ILE A 26 5.219 17.499 1.203 1.00 0.61 H new ATOM 0 HB ILE A 26 6.970 17.670 -1.258 1.00 0.60 H new ATOM 0 HG12 ILE A 26 5.372 15.236 -0.395 1.00 0.79 H new ATOM 0 HG13 ILE A 26 4.953 16.257 -1.757 1.00 0.79 H new ATOM 0 HG21 ILE A 26 8.226 15.947 -0.029 1.00 0.74 H new ATOM 0 HG22 ILE A 26 8.020 17.426 0.940 1.00 0.74 H new ATOM 0 HG23 ILE A 26 7.010 15.999 1.270 1.00 0.74 H new ATOM 0 HD11 ILE A 26 6.146 14.252 -2.499 1.00 0.83 H new ATOM 0 HD12 ILE A 26 7.104 15.712 -2.845 1.00 0.83 H new ATOM 0 HD13 ILE A 26 7.529 14.675 -1.463 1.00 0.83 H new ATOM 367 N CYS A 27 6.036 19.686 1.857 1.00 0.56 N ATOM 368 CA CYS A 27 6.558 20.966 2.336 1.00 0.56 C ATOM 369 C CYS A 27 7.579 20.717 3.436 1.00 0.55 C ATOM 370 O CYS A 27 7.338 19.923 4.342 1.00 0.59 O ATOM 371 CB CYS A 27 5.420 21.851 2.851 1.00 0.60 C ATOM 372 SG CYS A 27 5.815 23.629 2.850 1.00 0.92 S ATOM 0 H CYS A 27 5.668 19.084 2.593 1.00 0.56 H new ATOM 0 HA CYS A 27 7.042 21.486 1.509 1.00 0.56 H new ATOM 0 HB2 CYS A 27 4.536 21.684 2.236 1.00 0.60 H new ATOM 0 HB3 CYS A 27 5.165 21.545 3.866 1.00 0.60 H new ATOM 377 N CYS A 28 8.737 21.355 3.328 1.00 0.56 N ATOM 378 CA CYS A 28 9.796 21.143 4.291 1.00 0.58 C ATOM 379 C CYS A 28 10.624 22.412 4.665 1.00 0.61 C ATOM 380 O CYS A 28 11.258 23.014 3.802 1.00 0.76 O ATOM 381 CB CYS A 28 10.802 20.069 3.790 1.00 0.65 C ATOM 382 SG CYS A 28 10.281 19.052 2.351 1.00 1.28 S ATOM 0 H CYS A 28 8.961 22.018 2.586 1.00 0.56 H new ATOM 0 HA CYS A 28 9.263 20.822 5.186 1.00 0.58 H new ATOM 0 HB2 CYS A 28 11.734 20.571 3.531 1.00 0.65 H new ATOM 0 HB3 CYS A 28 11.022 19.397 4.619 1.00 0.65 H new ATOM 387 N GLY A 29 10.673 22.751 5.989 1.00 0.62 N ATOM 388 CA GLY A 29 11.472 23.839 6.475 1.00 0.65 C ATOM 389 C GLY A 29 12.641 23.283 7.263 1.00 0.67 C ATOM 390 O GLY A 29 12.890 22.074 7.260 1.00 0.66 O ATOM 0 H GLY A 29 10.152 22.261 6.716 1.00 0.62 H new ATOM 0 HA2 GLY A 29 11.833 24.442 5.642 1.00 0.65 H new ATOM 0 HA3 GLY A 29 10.871 24.494 7.106 1.00 0.65 H new ATOM 394 N ASP A 30 13.351 24.153 7.934 1.00 0.72 N ATOM 395 CA ASP A 30 14.523 23.774 8.701 1.00 0.76 C ATOM 396 C ASP A 30 14.236 22.890 9.890 1.00 0.77 C ATOM 397 O ASP A 30 14.818 21.815 10.037 1.00 0.80 O ATOM 398 CB ASP A 30 15.249 25.028 9.184 1.00 0.84 C ATOM 399 CG ASP A 30 16.682 24.749 9.598 1.00 1.41 C ATOM 400 OD1 ASP A 30 16.895 24.316 10.751 1.00 1.92 O ATOM 401 OD2 ASP A 30 17.590 24.963 8.769 1.00 2.27 O ATOM 0 H ASP A 30 13.137 25.150 7.968 1.00 0.72 H new ATOM 0 HA ASP A 30 15.141 23.187 8.021 1.00 0.76 H new ATOM 0 HB2 ASP A 30 15.243 25.775 8.391 1.00 0.84 H new ATOM 0 HB3 ASP A 30 14.707 25.455 10.028 1.00 0.84 H new ATOM 406 N GLU A 31 13.380 23.363 10.746 1.00 0.78 N ATOM 407 CA GLU A 31 13.049 22.638 11.987 1.00 0.83 C ATOM 408 C GLU A 31 11.635 22.121 11.956 1.00 0.87 C ATOM 409 O GLU A 31 11.137 21.526 12.906 1.00 1.00 O ATOM 410 CB GLU A 31 13.240 23.499 13.237 1.00 0.90 C ATOM 411 CG GLU A 31 13.747 24.912 12.996 1.00 0.99 C ATOM 412 CD GLU A 31 14.415 25.500 14.221 1.00 1.14 C ATOM 413 OE1 GLU A 31 13.688 26.008 15.101 1.00 1.66 O ATOM 414 OE2 GLU A 31 15.659 25.452 14.302 1.00 1.64 O ATOM 0 H GLU A 31 12.885 24.247 10.629 1.00 0.78 H new ATOM 0 HA GLU A 31 13.744 21.800 12.040 1.00 0.83 H new ATOM 0 HB2 GLU A 31 12.287 23.560 13.762 1.00 0.90 H new ATOM 0 HB3 GLU A 31 13.939 22.991 13.902 1.00 0.90 H new ATOM 0 HG2 GLU A 31 14.455 24.905 12.167 1.00 0.99 H new ATOM 0 HG3 GLU A 31 12.914 25.549 12.698 1.00 0.99 H new ATOM 421 N LEU A 32 10.984 22.428 10.871 1.00 0.82 N ATOM 422 CA LEU A 32 9.652 22.060 10.605 1.00 0.88 C ATOM 423 C LEU A 32 9.713 20.809 9.732 1.00 0.82 C ATOM 424 O LEU A 32 8.735 20.071 9.591 1.00 0.90 O ATOM 425 CB LEU A 32 9.011 23.233 9.902 1.00 0.93 C ATOM 426 CG LEU A 32 7.816 23.863 10.617 1.00 1.15 C ATOM 427 CD1 LEU A 32 7.496 25.222 10.016 1.00 1.24 C ATOM 428 CD2 LEU A 32 6.605 22.946 10.565 1.00 1.37 C ATOM 0 H LEU A 32 11.405 22.971 10.117 1.00 0.82 H new ATOM 0 HA LEU A 32 9.063 21.831 11.493 1.00 0.88 H new ATOM 0 HB2 LEU A 32 9.769 24.002 9.754 1.00 0.93 H new ATOM 0 HB3 LEU A 32 8.689 22.908 8.913 1.00 0.93 H new ATOM 0 HG LEU A 32 8.079 24.005 11.665 1.00 1.15 H new ATOM 0 HD11 LEU A 32 6.643 25.658 10.536 1.00 1.24 H new ATOM 0 HD12 LEU A 32 8.359 25.879 10.121 1.00 1.24 H new ATOM 0 HD13 LEU A 32 7.256 25.105 8.959 1.00 1.24 H new ATOM 0 HD21 LEU A 32 5.769 23.418 11.081 1.00 1.37 H new ATOM 0 HD22 LEU A 32 6.333 22.761 9.526 1.00 1.37 H new ATOM 0 HD23 LEU A 32 6.844 22.000 11.051 1.00 1.37 H new ATOM 440 N GLY A 33 10.930 20.544 9.219 1.00 0.73 N ATOM 441 CA GLY A 33 11.189 19.369 8.452 1.00 0.71 C ATOM 442 C GLY A 33 10.325 19.281 7.248 1.00 0.67 C ATOM 443 O GLY A 33 10.215 20.254 6.559 1.00 0.65 O ATOM 0 H GLY A 33 11.740 21.152 9.339 1.00 0.73 H new ATOM 0 HA2 GLY A 33 12.235 19.360 8.147 1.00 0.71 H new ATOM 0 HA3 GLY A 33 11.031 18.489 9.075 1.00 0.71 H new ATOM 447 N CYS A 34 9.710 18.132 6.992 1.00 0.70 N ATOM 448 CA CYS A 34 8.860 17.997 5.814 1.00 0.69 C ATOM 449 C CYS A 34 7.569 17.313 6.083 1.00 0.65 C ATOM 450 O CYS A 34 7.563 16.160 6.489 1.00 0.62 O ATOM 451 CB CYS A 34 9.549 17.217 4.711 1.00 0.73 C ATOM 452 SG CYS A 34 8.954 17.688 3.062 1.00 1.08 S ATOM 0 H CYS A 34 9.781 17.295 7.571 1.00 0.70 H new ATOM 0 HA CYS A 34 8.664 19.025 5.510 1.00 0.69 H new ATOM 0 HB2 CYS A 34 10.625 17.383 4.768 1.00 0.73 H new ATOM 0 HB3 CYS A 34 9.383 16.151 4.864 1.00 0.73 H new ATOM 457 N PHE A 35 6.459 17.987 5.789 1.00 0.68 N ATOM 458 CA PHE A 35 5.188 17.354 5.930 1.00 0.67 C ATOM 459 C PHE A 35 4.873 16.900 4.538 1.00 0.64 C ATOM 460 O PHE A 35 4.439 17.690 3.694 1.00 0.63 O ATOM 461 CB PHE A 35 4.078 18.309 6.435 1.00 0.69 C ATOM 462 CG PHE A 35 4.554 19.646 6.947 1.00 0.73 C ATOM 463 CD1 PHE A 35 5.510 19.719 7.945 1.00 0.98 C ATOM 464 CD2 PHE A 35 4.040 20.826 6.428 1.00 1.16 C ATOM 465 CE1 PHE A 35 5.947 20.941 8.418 1.00 1.21 C ATOM 466 CE2 PHE A 35 4.473 22.052 6.898 1.00 1.38 C ATOM 467 CZ PHE A 35 5.428 22.109 7.894 1.00 1.26 C ATOM 0 H PHE A 35 6.432 18.952 5.459 1.00 0.68 H new ATOM 0 HA PHE A 35 5.226 16.555 6.671 1.00 0.67 H new ATOM 0 HB2 PHE A 35 3.373 18.481 5.621 1.00 0.69 H new ATOM 0 HB3 PHE A 35 3.528 17.809 7.232 1.00 0.69 H new ATOM 0 HD1 PHE A 35 5.919 18.809 8.359 1.00 0.98 H new ATOM 0 HD2 PHE A 35 3.294 20.786 5.648 1.00 1.16 H new ATOM 0 HE1 PHE A 35 6.694 20.983 9.197 1.00 1.21 H new ATOM 0 HE2 PHE A 35 4.065 22.964 6.487 1.00 1.38 H new ATOM 0 HZ PHE A 35 5.769 23.065 8.263 1.00 1.26 H new ATOM 477 N VAL A 36 5.094 15.631 4.295 1.00 0.67 N ATOM 478 CA VAL A 36 4.839 15.087 2.997 1.00 0.68 C ATOM 479 C VAL A 36 3.420 14.557 3.006 1.00 0.71 C ATOM 480 O VAL A 36 3.137 13.378 3.247 1.00 0.74 O ATOM 481 CB VAL A 36 5.889 14.009 2.579 1.00 0.74 C ATOM 482 CG1 VAL A 36 5.946 13.897 1.060 1.00 0.75 C ATOM 483 CG2 VAL A 36 7.287 14.345 3.144 1.00 0.76 C ATOM 0 H VAL A 36 5.448 14.964 4.980 1.00 0.67 H new ATOM 0 HA VAL A 36 4.940 15.863 2.238 1.00 0.68 H new ATOM 0 HB VAL A 36 5.579 13.051 2.996 1.00 0.74 H new ATOM 0 HG11 VAL A 36 6.681 13.143 0.778 1.00 0.75 H new ATOM 0 HG12 VAL A 36 4.966 13.609 0.679 1.00 0.75 H new ATOM 0 HG13 VAL A 36 6.232 14.859 0.635 1.00 0.75 H new ATOM 0 HG21 VAL A 36 7.998 13.578 2.837 1.00 0.76 H new ATOM 0 HG22 VAL A 36 7.611 15.313 2.762 1.00 0.76 H new ATOM 0 HG23 VAL A 36 7.240 14.382 4.232 1.00 0.76 H new ATOM 493 N GLY A 37 2.528 15.501 2.764 1.00 0.71 N ATOM 494 CA GLY A 37 1.099 15.213 2.738 1.00 0.76 C ATOM 495 C GLY A 37 0.372 15.605 4.020 1.00 0.72 C ATOM 496 O GLY A 37 0.174 14.775 4.908 1.00 0.81 O ATOM 0 H GLY A 37 2.765 16.476 2.582 1.00 0.71 H new ATOM 0 HA2 GLY A 37 0.646 15.740 1.898 1.00 0.76 H new ATOM 0 HA3 GLY A 37 0.955 14.147 2.560 1.00 0.76 H new ATOM 500 N THR A 38 -0.042 16.870 4.099 1.00 0.68 N ATOM 501 CA THR A 38 -0.768 17.394 5.260 1.00 0.68 C ATOM 502 C THR A 38 -1.486 18.684 4.876 1.00 0.72 C ATOM 503 O THR A 38 -1.125 19.306 3.878 1.00 0.77 O ATOM 504 CB THR A 38 0.203 17.696 6.409 1.00 0.72 C ATOM 505 OG1 THR A 38 1.119 18.711 6.033 1.00 0.77 O ATOM 506 CG2 THR A 38 1.011 16.500 6.860 1.00 0.76 C ATOM 0 H THR A 38 0.115 17.559 3.364 1.00 0.68 H new ATOM 0 HA THR A 38 -1.489 16.643 5.583 1.00 0.68 H new ATOM 0 HB THR A 38 -0.431 18.011 7.238 1.00 0.72 H new ATOM 0 HG1 THR A 38 1.507 19.115 6.837 1.00 0.77 H new ATOM 0 HG21 THR A 38 1.673 16.794 7.674 1.00 0.76 H new ATOM 0 HG22 THR A 38 0.338 15.715 7.205 1.00 0.76 H new ATOM 0 HG23 THR A 38 1.605 16.127 6.026 1.00 0.76 H new ATOM 514 N ALA A 39 -2.513 19.095 5.628 1.00 0.77 N ATOM 515 CA ALA A 39 -3.235 20.327 5.311 1.00 0.86 C ATOM 516 C ALA A 39 -2.317 21.543 5.395 1.00 0.82 C ATOM 517 O ALA A 39 -2.541 22.554 4.727 1.00 0.86 O ATOM 518 CB ALA A 39 -4.398 20.506 6.279 1.00 1.02 C ATOM 0 H ALA A 39 -2.858 18.598 6.450 1.00 0.77 H new ATOM 0 HA ALA A 39 -3.609 20.246 4.290 1.00 0.86 H new ATOM 0 HB1 ALA A 39 -4.933 21.425 6.039 1.00 1.02 H new ATOM 0 HB2 ALA A 39 -5.077 19.658 6.193 1.00 1.02 H new ATOM 0 HB3 ALA A 39 -4.017 20.564 7.299 1.00 1.02 H new ATOM 524 N GLU A 40 -1.239 21.402 6.159 1.00 0.78 N ATOM 525 CA GLU A 40 -0.245 22.460 6.277 1.00 0.79 C ATOM 526 C GLU A 40 0.501 22.618 4.949 1.00 0.74 C ATOM 527 O GLU A 40 1.205 23.605 4.732 1.00 0.79 O ATOM 528 CB GLU A 40 0.730 22.164 7.418 1.00 0.82 C ATOM 529 CG GLU A 40 0.059 22.083 8.783 1.00 1.25 C ATOM 530 CD GLU A 40 0.241 23.346 9.603 1.00 1.55 C ATOM 531 OE1 GLU A 40 -0.448 24.347 9.313 1.00 1.91 O ATOM 532 OE2 GLU A 40 1.071 23.334 10.536 1.00 2.32 O ATOM 0 H GLU A 40 -1.032 20.566 6.705 1.00 0.78 H new ATOM 0 HA GLU A 40 -0.752 23.397 6.509 1.00 0.79 H new ATOM 0 HB2 GLU A 40 1.239 21.222 7.215 1.00 0.82 H new ATOM 0 HB3 GLU A 40 1.495 22.940 7.443 1.00 0.82 H new ATOM 0 HG2 GLU A 40 -1.006 21.893 8.649 1.00 1.25 H new ATOM 0 HG3 GLU A 40 0.467 21.236 9.334 1.00 1.25 H new ATOM 539 N ALA A 41 0.325 21.634 4.057 1.00 0.70 N ATOM 540 CA ALA A 41 0.930 21.633 2.752 1.00 0.71 C ATOM 541 C ALA A 41 -0.097 22.082 1.726 1.00 0.78 C ATOM 542 O ALA A 41 0.261 22.540 0.670 1.00 0.87 O ATOM 543 CB ALA A 41 1.443 20.243 2.408 1.00 0.77 C ATOM 0 H ALA A 41 -0.252 20.813 4.240 1.00 0.70 H new ATOM 0 HA ALA A 41 1.776 22.321 2.745 1.00 0.71 H new ATOM 0 HB1 ALA A 41 1.898 20.258 1.418 1.00 0.77 H new ATOM 0 HB2 ALA A 41 2.186 19.937 3.144 1.00 0.77 H new ATOM 0 HB3 ALA A 41 0.613 19.537 2.415 1.00 0.77 H new ATOM 549 N LEU A 42 -1.390 21.907 2.039 1.00 0.81 N ATOM 550 CA LEU A 42 -2.486 22.292 1.133 1.00 0.94 C ATOM 551 C LEU A 42 -2.242 23.656 0.469 1.00 1.05 C ATOM 552 O LEU A 42 -2.546 23.840 -0.709 1.00 1.23 O ATOM 553 CB LEU A 42 -3.812 22.336 1.900 1.00 0.98 C ATOM 554 CG LEU A 42 -4.457 20.977 2.181 1.00 1.02 C ATOM 555 CD1 LEU A 42 -5.472 21.092 3.308 1.00 1.11 C ATOM 556 CD2 LEU A 42 -5.117 20.432 0.924 1.00 1.16 C ATOM 0 H LEU A 42 -1.705 21.498 2.919 1.00 0.81 H new ATOM 0 HA LEU A 42 -2.529 21.538 0.347 1.00 0.94 H new ATOM 0 HB2 LEU A 42 -3.645 22.843 2.851 1.00 0.98 H new ATOM 0 HB3 LEU A 42 -4.518 22.944 1.335 1.00 0.98 H new ATOM 0 HG LEU A 42 -3.676 20.282 2.490 1.00 1.02 H new ATOM 0 HD11 LEU A 42 -5.921 20.116 3.494 1.00 1.11 H new ATOM 0 HD12 LEU A 42 -4.974 21.441 4.212 1.00 1.11 H new ATOM 0 HD13 LEU A 42 -6.250 21.801 3.026 1.00 1.11 H new ATOM 0 HD21 LEU A 42 -5.571 19.465 1.141 1.00 1.16 H new ATOM 0 HD22 LEU A 42 -5.887 21.126 0.587 1.00 1.16 H new ATOM 0 HD23 LEU A 42 -4.367 20.313 0.142 1.00 1.16 H new ATOM 568 N ARG A 43 -1.682 24.602 1.229 1.00 1.04 N ATOM 569 CA ARG A 43 -1.388 25.943 0.696 1.00 1.23 C ATOM 570 C ARG A 43 -0.233 25.881 -0.345 1.00 1.24 C ATOM 571 O ARG A 43 0.076 26.852 -1.026 1.00 1.46 O ATOM 572 CB ARG A 43 -1.114 26.920 1.870 1.00 1.32 C ATOM 573 CG ARG A 43 0.342 27.320 2.097 1.00 1.34 C ATOM 574 CD ARG A 43 0.727 28.504 1.224 1.00 1.50 C ATOM 575 NE ARG A 43 -0.016 29.713 1.581 1.00 1.88 N ATOM 576 CZ ARG A 43 -0.818 30.375 0.744 1.00 2.20 C ATOM 577 NH1 ARG A 43 -0.987 29.957 -0.505 1.00 2.39 N ATOM 578 NH2 ARG A 43 -1.452 31.463 1.161 1.00 2.92 N ATOM 0 H ARG A 43 -1.424 24.470 2.207 1.00 1.04 H new ATOM 0 HA ARG A 43 -2.253 26.329 0.156 1.00 1.23 H new ATOM 0 HB2 ARG A 43 -1.695 27.827 1.702 1.00 1.32 H new ATOM 0 HB3 ARG A 43 -1.490 26.466 2.787 1.00 1.32 H new ATOM 0 HG2 ARG A 43 0.493 27.573 3.146 1.00 1.34 H new ATOM 0 HG3 ARG A 43 0.993 26.474 1.876 1.00 1.34 H new ATOM 0 HD2 ARG A 43 1.796 28.694 1.321 1.00 1.50 H new ATOM 0 HD3 ARG A 43 0.540 28.259 0.178 1.00 1.50 H new ATOM 0 HE ARG A 43 0.085 30.073 2.530 1.00 1.88 H new ATOM 0 HH11 ARG A 43 -0.502 29.122 -0.834 1.00 2.39 H new ATOM 0 HH12 ARG A 43 -1.602 30.471 -1.136 1.00 2.39 H new ATOM 0 HH21 ARG A 43 -1.326 31.791 2.118 1.00 2.92 H new ATOM 0 HH22 ARG A 43 -2.066 31.971 0.524 1.00 2.92 H new ATOM 592 N CYS A 44 0.331 24.693 -0.445 1.00 1.08 N ATOM 593 CA CYS A 44 1.410 24.427 -1.416 1.00 1.15 C ATOM 594 C CYS A 44 0.827 24.377 -2.839 1.00 1.41 C ATOM 595 O CYS A 44 1.552 24.472 -3.830 1.00 1.57 O ATOM 596 CB CYS A 44 2.206 23.168 -1.095 1.00 1.04 C ATOM 597 SG CYS A 44 3.312 23.357 0.343 1.00 1.28 S ATOM 0 H CYS A 44 0.071 23.889 0.126 1.00 1.08 H new ATOM 0 HA CYS A 44 2.122 25.249 -1.348 1.00 1.15 H new ATOM 0 HB2 CYS A 44 1.514 22.348 -0.906 1.00 1.04 H new ATOM 0 HB3 CYS A 44 2.799 22.890 -1.966 1.00 1.04 H new ATOM 602 N GLN A 45 -0.494 24.194 -2.917 1.00 1.55 N ATOM 603 CA GLN A 45 -1.199 24.116 -4.195 1.00 1.86 C ATOM 604 C GLN A 45 -0.933 25.352 -5.058 1.00 2.09 C ATOM 605 O GLN A 45 -1.138 25.330 -6.276 1.00 2.35 O ATOM 606 CB GLN A 45 -2.702 23.951 -3.967 1.00 1.97 C ATOM 607 CG GLN A 45 -3.329 22.872 -4.835 1.00 2.40 C ATOM 608 CD GLN A 45 -3.342 21.515 -4.159 1.00 2.73 C ATOM 609 OE1 GLN A 45 -4.290 21.167 -3.455 1.00 3.31 O ATOM 610 NE2 GLN A 45 -2.286 20.738 -4.370 1.00 3.02 N ATOM 0 H GLN A 45 -1.099 24.097 -2.102 1.00 1.55 H new ATOM 0 HA GLN A 45 -0.820 23.244 -4.728 1.00 1.86 H new ATOM 0 HB2 GLN A 45 -2.879 23.712 -2.918 1.00 1.97 H new ATOM 0 HB3 GLN A 45 -3.199 24.901 -4.165 1.00 1.97 H new ATOM 0 HG2 GLN A 45 -4.350 23.159 -5.084 1.00 2.40 H new ATOM 0 HG3 GLN A 45 -2.780 22.801 -5.774 1.00 2.40 H new ATOM 0 HE21 GLN A 45 -1.522 21.066 -4.961 1.00 3.02 H new ATOM 0 HE22 GLN A 45 -2.239 19.814 -3.941 1.00 3.02 H new ATOM 619 N GLU A 46 -0.440 26.423 -4.439 1.00 2.07 N ATOM 620 CA GLU A 46 -0.140 27.639 -5.190 1.00 2.35 C ATOM 621 C GLU A 46 1.252 27.540 -5.814 1.00 2.34 C ATOM 622 O GLU A 46 1.730 28.477 -6.458 1.00 2.50 O ATOM 623 CB GLU A 46 -0.222 28.869 -4.281 1.00 2.41 C ATOM 624 CG GLU A 46 -0.460 30.170 -5.035 1.00 2.80 C ATOM 625 CD GLU A 46 -0.203 31.396 -4.180 1.00 3.19 C ATOM 626 OE1 GLU A 46 0.981 31.729 -3.959 1.00 3.69 O ATOM 627 OE2 GLU A 46 -1.185 32.025 -3.733 1.00 3.53 O ATOM 0 H GLU A 46 -0.243 26.474 -3.440 1.00 2.07 H new ATOM 0 HA GLU A 46 -0.879 27.746 -5.984 1.00 2.35 H new ATOM 0 HB2 GLU A 46 -1.027 28.724 -3.560 1.00 2.41 H new ATOM 0 HB3 GLU A 46 0.704 28.953 -3.713 1.00 2.41 H new ATOM 0 HG2 GLU A 46 0.187 30.201 -5.912 1.00 2.80 H new ATOM 0 HG3 GLU A 46 -1.488 30.193 -5.397 1.00 2.80 H new ATOM 634 N GLU A 47 1.871 26.368 -5.673 1.00 2.22 N ATOM 635 CA GLU A 47 3.177 26.124 -6.259 1.00 2.31 C ATOM 636 C GLU A 47 3.021 25.730 -7.728 1.00 2.34 C ATOM 637 O GLU A 47 4.008 25.534 -8.436 1.00 2.42 O ATOM 638 CB GLU A 47 3.903 25.017 -5.491 1.00 2.37 C ATOM 639 CG GLU A 47 5.416 25.075 -5.619 1.00 2.96 C ATOM 640 CD GLU A 47 6.098 23.870 -5.002 1.00 3.45 C ATOM 641 OE1 GLU A 47 6.208 22.833 -5.691 1.00 3.68 O ATOM 642 OE2 GLU A 47 6.521 23.960 -3.831 1.00 3.99 O ATOM 0 H GLU A 47 1.485 25.577 -5.158 1.00 2.22 H new ATOM 0 HA GLU A 47 3.769 27.037 -6.197 1.00 2.31 H new ATOM 0 HB2 GLU A 47 3.634 25.082 -4.437 1.00 2.37 H new ATOM 0 HB3 GLU A 47 3.554 24.049 -5.850 1.00 2.37 H new ATOM 0 HG2 GLU A 47 5.686 25.141 -6.673 1.00 2.96 H new ATOM 0 HG3 GLU A 47 5.783 25.982 -5.139 1.00 2.96 H new ATOM 649 N ASN A 48 1.768 25.661 -8.192 1.00 2.53 N ATOM 650 CA ASN A 48 1.488 25.346 -9.584 1.00 2.96 C ATOM 651 C ASN A 48 1.827 26.556 -10.454 1.00 3.29 C ATOM 652 O ASN A 48 2.176 26.417 -11.626 1.00 3.76 O ATOM 653 CB ASN A 48 0.020 24.957 -9.765 1.00 3.12 C ATOM 654 CG ASN A 48 -0.197 23.458 -9.691 1.00 3.42 C ATOM 655 OD1 ASN A 48 0.744 22.676 -9.824 1.00 3.86 O ATOM 656 ND2 ASN A 48 -1.442 23.050 -9.476 1.00 3.75 N ATOM 0 H ASN A 48 0.939 25.820 -7.620 1.00 2.53 H new ATOM 0 HA ASN A 48 2.102 24.498 -9.887 1.00 2.96 H new ATOM 0 HB2 ASN A 48 -0.579 25.446 -8.997 1.00 3.12 H new ATOM 0 HB3 ASN A 48 -0.334 25.325 -10.728 1.00 3.12 H new ATOM 0 HD21 ASN A 48 -1.649 22.053 -9.415 1.00 3.75 H new ATOM 0 HD22 ASN A 48 -2.192 23.734 -9.372 1.00 3.75 H new ATOM 663 N TYR A 49 1.729 27.747 -9.856 1.00 3.15 N ATOM 664 CA TYR A 49 2.032 28.991 -10.552 1.00 3.51 C ATOM 665 C TYR A 49 3.185 29.708 -9.850 1.00 3.62 C ATOM 666 O TYR A 49 3.161 30.926 -9.671 1.00 4.04 O ATOM 667 CB TYR A 49 0.790 29.887 -10.587 1.00 3.61 C ATOM 668 CG TYR A 49 0.418 30.379 -11.970 1.00 3.97 C ATOM 669 CD1 TYR A 49 -0.280 29.565 -12.857 1.00 4.19 C ATOM 670 CD2 TYR A 49 0.758 31.661 -12.386 1.00 4.52 C ATOM 671 CE1 TYR A 49 -0.626 30.016 -14.117 1.00 4.70 C ATOM 672 CE2 TYR A 49 0.414 32.117 -13.645 1.00 5.05 C ATOM 673 CZ TYR A 49 -0.276 31.292 -14.506 1.00 5.03 C ATOM 674 OH TYR A 49 -0.620 31.744 -15.759 1.00 5.68 O ATOM 0 H TYR A 49 1.440 27.871 -8.886 1.00 3.15 H new ATOM 0 HA TYR A 49 2.328 28.766 -11.577 1.00 3.51 H new ATOM 0 HB2 TYR A 49 -0.053 29.336 -10.171 1.00 3.61 H new ATOM 0 HB3 TYR A 49 0.959 30.748 -9.940 1.00 3.61 H new ATOM 0 HD1 TYR A 49 -0.556 28.565 -12.556 1.00 4.19 H new ATOM 0 HD2 TYR A 49 1.300 32.311 -11.715 1.00 4.52 H new ATOM 0 HE1 TYR A 49 -1.168 29.372 -14.794 1.00 4.70 H new ATOM 0 HE2 TYR A 49 0.685 33.116 -13.952 1.00 5.05 H new ATOM 0 HH TYR A 49 -0.300 32.663 -15.874 1.00 5.68 H new ATOM 684 N LEU A 50 4.187 28.931 -9.435 1.00 3.50 N ATOM 685 CA LEU A 50 5.347 29.474 -8.729 1.00 3.67 C ATOM 686 C LEU A 50 6.659 29.122 -9.442 1.00 3.63 C ATOM 687 O LEU A 50 6.817 28.009 -9.944 1.00 3.79 O ATOM 688 CB LEU A 50 5.380 28.937 -7.296 1.00 4.02 C ATOM 689 CG LEU A 50 5.267 29.997 -6.202 1.00 4.66 C ATOM 690 CD1 LEU A 50 3.864 30.583 -6.168 1.00 4.84 C ATOM 691 CD2 LEU A 50 5.630 29.403 -4.849 1.00 5.40 C ATOM 0 H LEU A 50 4.218 27.921 -9.576 1.00 3.50 H new ATOM 0 HA LEU A 50 5.252 30.560 -8.716 1.00 3.67 H new ATOM 0 HB2 LEU A 50 4.565 28.223 -7.174 1.00 4.02 H new ATOM 0 HB3 LEU A 50 6.310 28.387 -7.152 1.00 4.02 H new ATOM 0 HG LEU A 50 5.968 30.801 -6.427 1.00 4.66 H new ATOM 0 HD11 LEU A 50 3.803 31.336 -5.382 1.00 4.84 H new ATOM 0 HD12 LEU A 50 3.638 31.043 -7.130 1.00 4.84 H new ATOM 0 HD13 LEU A 50 3.143 29.790 -5.967 1.00 4.84 H new ATOM 0 HD21 LEU A 50 5.545 30.171 -4.080 1.00 5.40 H new ATOM 0 HD22 LEU A 50 4.952 28.581 -4.619 1.00 5.40 H new ATOM 0 HD23 LEU A 50 6.654 29.031 -4.878 1.00 5.40 H new ATOM 703 N PRO A 51 7.625 30.071 -9.504 1.00 3.88 N ATOM 704 CA PRO A 51 8.917 29.851 -10.164 1.00 4.25 C ATOM 705 C PRO A 51 9.878 28.994 -9.332 1.00 4.32 C ATOM 706 O PRO A 51 11.035 29.362 -9.126 1.00 4.70 O ATOM 707 CB PRO A 51 9.484 31.272 -10.349 1.00 4.88 C ATOM 708 CG PRO A 51 8.405 32.208 -9.904 1.00 4.92 C ATOM 709 CD PRO A 51 7.546 31.431 -8.953 1.00 4.30 C ATOM 0 HA PRO A 51 8.795 29.302 -11.098 1.00 4.25 H new ATOM 0 HB2 PRO A 51 10.389 31.411 -9.758 1.00 4.88 H new ATOM 0 HB3 PRO A 51 9.752 31.453 -11.390 1.00 4.88 H new ATOM 0 HG2 PRO A 51 8.828 33.087 -9.418 1.00 4.92 H new ATOM 0 HG3 PRO A 51 7.822 32.563 -10.754 1.00 4.92 H new ATOM 0 HD2 PRO A 51 7.923 31.479 -7.931 1.00 4.30 H new ATOM 0 HD3 PRO A 51 6.522 31.803 -8.932 1.00 4.30 H new ATOM 717 N SER A 52 9.390 27.841 -8.870 1.00 4.18 N ATOM 718 CA SER A 52 10.189 26.900 -8.070 1.00 4.35 C ATOM 719 C SER A 52 10.460 27.422 -6.649 1.00 3.79 C ATOM 720 O SER A 52 10.139 28.567 -6.329 1.00 3.48 O ATOM 721 CB SER A 52 11.507 26.556 -8.777 1.00 4.83 C ATOM 722 OG SER A 52 12.528 27.485 -8.457 1.00 5.64 O ATOM 0 H SER A 52 8.433 27.530 -9.037 1.00 4.18 H new ATOM 0 HA SER A 52 9.596 25.990 -7.973 1.00 4.35 H new ATOM 0 HB2 SER A 52 11.824 25.553 -8.490 1.00 4.83 H new ATOM 0 HB3 SER A 52 11.350 26.544 -9.856 1.00 4.83 H new ATOM 0 HG SER A 52 12.352 28.334 -8.913 1.00 5.64 H new ATOM 728 N PRO A 53 11.029 26.564 -5.759 1.00 3.98 N ATOM 729 CA PRO A 53 11.310 26.919 -4.353 1.00 3.75 C ATOM 730 C PRO A 53 12.205 28.147 -4.158 1.00 2.89 C ATOM 731 O PRO A 53 12.533 28.866 -5.101 1.00 2.99 O ATOM 732 CB PRO A 53 12.008 25.673 -3.786 1.00 4.57 C ATOM 733 CG PRO A 53 12.426 24.877 -4.974 1.00 5.04 C ATOM 734 CD PRO A 53 11.410 25.163 -6.037 1.00 4.80 C ATOM 0 HA PRO A 53 10.380 27.193 -3.854 1.00 3.75 H new ATOM 0 HB2 PRO A 53 12.868 25.948 -3.176 1.00 4.57 H new ATOM 0 HB3 PRO A 53 11.334 25.102 -3.148 1.00 4.57 H new ATOM 0 HG2 PRO A 53 13.426 25.161 -5.303 1.00 5.04 H new ATOM 0 HG3 PRO A 53 12.458 23.813 -4.740 1.00 5.04 H new ATOM 0 HD2 PRO A 53 11.828 25.049 -7.037 1.00 4.80 H new ATOM 0 HD3 PRO A 53 10.555 24.491 -5.970 1.00 4.80 H new ATOM 742 N CYS A 54 12.569 28.367 -2.891 1.00 2.53 N ATOM 743 CA CYS A 54 13.406 29.494 -2.463 1.00 2.00 C ATOM 744 C CYS A 54 14.706 28.975 -1.817 1.00 2.22 C ATOM 745 O CYS A 54 14.648 28.314 -0.778 1.00 2.72 O ATOM 746 CB CYS A 54 12.596 30.314 -1.438 1.00 2.36 C ATOM 747 SG CYS A 54 12.883 32.117 -1.438 1.00 2.74 S ATOM 0 H CYS A 54 12.287 27.759 -2.122 1.00 2.53 H new ATOM 0 HA CYS A 54 13.678 30.113 -3.318 1.00 2.00 H new ATOM 0 HB2 CYS A 54 11.536 30.136 -1.618 1.00 2.36 H new ATOM 0 HB3 CYS A 54 12.818 29.932 -0.442 1.00 2.36 H new ATOM 752 N GLN A 55 15.882 29.260 -2.421 1.00 2.24 N ATOM 753 CA GLN A 55 17.164 28.784 -1.854 1.00 2.74 C ATOM 754 C GLN A 55 17.276 27.246 -1.926 1.00 2.26 C ATOM 755 O GLN A 55 16.479 26.600 -2.602 1.00 2.47 O ATOM 756 CB GLN A 55 17.327 29.264 -0.404 1.00 3.51 C ATOM 757 CG GLN A 55 18.759 29.629 -0.042 1.00 4.44 C ATOM 758 CD GLN A 55 19.019 29.590 1.453 1.00 5.23 C ATOM 759 OE1 GLN A 55 18.435 28.782 2.176 1.00 5.71 O ATOM 760 NE2 GLN A 55 19.901 30.465 1.923 1.00 5.75 N ATOM 0 H GLN A 55 15.971 29.803 -3.280 1.00 2.24 H new ATOM 0 HA GLN A 55 17.968 29.208 -2.456 1.00 2.74 H new ATOM 0 HB2 GLN A 55 16.688 30.132 -0.243 1.00 3.51 H new ATOM 0 HB3 GLN A 55 16.978 28.482 0.270 1.00 3.51 H new ATOM 0 HG2 GLN A 55 19.441 28.942 -0.542 1.00 4.44 H new ATOM 0 HG3 GLN A 55 18.980 30.628 -0.418 1.00 4.44 H new ATOM 0 HE21 GLN A 55 20.361 31.116 1.287 1.00 5.75 H new ATOM 0 HE22 GLN A 55 20.118 30.485 2.919 1.00 5.75 H new ATOM 769 N SER A 56 18.271 26.659 -1.233 1.00 2.28 N ATOM 770 CA SER A 56 18.469 25.195 -1.233 1.00 2.07 C ATOM 771 C SER A 56 18.730 24.735 0.202 1.00 1.82 C ATOM 772 O SER A 56 17.960 23.944 0.729 1.00 2.22 O ATOM 773 CB SER A 56 19.584 24.802 -2.190 1.00 2.60 C ATOM 774 OG SER A 56 19.292 23.562 -2.806 1.00 3.12 O ATOM 0 H SER A 56 18.948 27.173 -0.668 1.00 2.28 H new ATOM 0 HA SER A 56 17.572 24.692 -1.593 1.00 2.07 H new ATOM 0 HB2 SER A 56 19.707 25.573 -2.951 1.00 2.60 H new ATOM 0 HB3 SER A 56 20.528 24.733 -1.650 1.00 2.60 H new ATOM 0 HG SER A 56 19.538 23.602 -3.754 1.00 3.12 H new ATOM 780 N GLY A 57 19.881 25.074 0.781 1.00 1.58 N ATOM 781 CA GLY A 57 20.199 24.630 2.129 1.00 1.86 C ATOM 782 C GLY A 57 21.181 23.524 2.100 1.00 1.68 C ATOM 783 O GLY A 57 22.330 23.717 1.714 1.00 2.10 O ATOM 0 H GLY A 57 20.599 25.649 0.340 1.00 1.58 H new ATOM 0 HA2 GLY A 57 20.600 25.463 2.706 1.00 1.86 H new ATOM 0 HA3 GLY A 57 19.290 24.302 2.633 1.00 1.86 H new ATOM 787 N GLN A 58 20.708 22.350 2.421 1.00 1.37 N ATOM 788 CA GLN A 58 21.518 21.184 2.341 1.00 1.46 C ATOM 789 C GLN A 58 20.889 20.420 1.241 1.00 1.08 C ATOM 790 O GLN A 58 19.732 20.013 1.359 1.00 1.00 O ATOM 791 CB GLN A 58 21.531 20.386 3.638 1.00 1.97 C ATOM 792 CG GLN A 58 22.078 21.164 4.824 1.00 2.80 C ATOM 793 CD GLN A 58 21.322 20.877 6.104 1.00 3.61 C ATOM 794 OE1 GLN A 58 21.872 20.318 7.052 1.00 3.96 O ATOM 795 NE2 GLN A 58 20.050 21.258 6.136 1.00 4.36 N ATOM 0 H GLN A 58 19.754 22.184 2.743 1.00 1.37 H new ATOM 0 HA GLN A 58 22.568 21.419 2.166 1.00 1.46 H new ATOM 0 HB2 GLN A 58 20.516 20.060 3.865 1.00 1.97 H new ATOM 0 HB3 GLN A 58 22.130 19.487 3.496 1.00 1.97 H new ATOM 0 HG2 GLN A 58 23.130 20.915 4.964 1.00 2.80 H new ATOM 0 HG3 GLN A 58 22.029 22.231 4.608 1.00 2.80 H new ATOM 0 HE21 GLN A 58 19.635 21.719 5.326 1.00 4.36 H new ATOM 0 HE22 GLN A 58 19.488 21.090 6.971 1.00 4.36 H new ATOM 804 N LYS A 59 21.602 20.225 0.165 1.00 1.17 N ATOM 805 CA LYS A 59 20.963 19.617 -0.966 1.00 1.13 C ATOM 806 C LYS A 59 21.306 18.126 -1.008 1.00 0.95 C ATOM 807 O LYS A 59 20.633 17.429 -0.265 1.00 0.88 O ATOM 808 CB LYS A 59 21.407 20.357 -2.259 1.00 1.54 C ATOM 809 CG LYS A 59 20.275 20.981 -3.063 1.00 1.90 C ATOM 810 CD LYS A 59 20.414 20.683 -4.551 1.00 2.17 C ATOM 811 CE LYS A 59 19.142 20.068 -5.115 1.00 2.82 C ATOM 812 NZ LYS A 59 18.371 21.042 -5.936 1.00 3.55 N ATOM 0 H LYS A 59 22.586 20.467 0.049 1.00 1.17 H new ATOM 0 HA LYS A 59 19.879 19.701 -0.886 1.00 1.13 H new ATOM 0 HB2 LYS A 59 22.114 21.141 -1.987 1.00 1.54 H new ATOM 0 HB3 LYS A 59 21.941 19.653 -2.897 1.00 1.54 H new ATOM 0 HG2 LYS A 59 19.319 20.600 -2.703 1.00 1.90 H new ATOM 0 HG3 LYS A 59 20.268 22.060 -2.906 1.00 1.90 H new ATOM 0 HD2 LYS A 59 20.644 21.603 -5.088 1.00 2.17 H new ATOM 0 HD3 LYS A 59 21.251 20.003 -4.711 1.00 2.17 H new ATOM 0 HE2 LYS A 59 19.397 19.201 -5.725 1.00 2.82 H new ATOM 0 HE3 LYS A 59 18.518 19.709 -4.296 1.00 2.82 H new ATOM 0 HZ1 LYS A 59 17.512 20.584 -6.302 1.00 3.55 H new ATOM 0 HZ2 LYS A 59 18.105 21.858 -5.348 1.00 3.55 H new ATOM 0 HZ3 LYS A 59 18.957 21.365 -6.732 1.00 3.55 H new ATOM 826 N PRO A 60 22.223 17.535 -1.772 1.00 1.06 N ATOM 827 CA PRO A 60 22.365 16.068 -1.750 1.00 1.15 C ATOM 828 C PRO A 60 22.479 15.368 -0.396 1.00 1.10 C ATOM 829 O PRO A 60 23.340 15.643 0.441 1.00 1.23 O ATOM 830 CB PRO A 60 23.582 15.788 -2.634 1.00 1.48 C ATOM 831 CG PRO A 60 24.235 17.117 -2.834 1.00 1.54 C ATOM 832 CD PRO A 60 23.136 18.140 -2.736 1.00 1.30 C ATOM 0 HA PRO A 60 21.428 15.639 -2.105 1.00 1.15 H new ATOM 0 HB2 PRO A 60 24.262 15.083 -2.156 1.00 1.48 H new ATOM 0 HB3 PRO A 60 23.284 15.348 -3.586 1.00 1.48 H new ATOM 0 HG2 PRO A 60 25.000 17.293 -2.078 1.00 1.54 H new ATOM 0 HG3 PRO A 60 24.729 17.167 -3.805 1.00 1.54 H new ATOM 0 HD2 PRO A 60 23.509 19.104 -2.391 1.00 1.30 H new ATOM 0 HD3 PRO A 60 22.654 18.311 -3.699 1.00 1.30 H new ATOM 840 N CYS A 61 21.576 14.392 -0.290 1.00 1.08 N ATOM 841 CA CYS A 61 21.419 13.469 0.827 1.00 1.13 C ATOM 842 C CYS A 61 20.980 12.122 0.227 1.00 1.36 C ATOM 843 O CYS A 61 20.837 12.032 -0.995 1.00 1.54 O ATOM 844 CB CYS A 61 20.417 13.979 1.864 1.00 1.30 C ATOM 845 SG CYS A 61 20.640 13.244 3.518 1.00 1.59 S ATOM 0 H CYS A 61 20.895 14.217 -1.029 1.00 1.08 H new ATOM 0 HA CYS A 61 22.360 13.366 1.368 1.00 1.13 H new ATOM 0 HB2 CYS A 61 20.507 15.062 1.942 1.00 1.30 H new ATOM 0 HB3 CYS A 61 19.406 13.768 1.515 1.00 1.30 H new ATOM 850 N GLY A 62 20.627 11.132 1.060 1.00 1.60 N ATOM 851 CA GLY A 62 20.097 9.848 0.535 1.00 1.92 C ATOM 852 C GLY A 62 20.766 9.353 -0.759 1.00 2.10 C ATOM 853 O GLY A 62 21.854 9.813 -1.118 1.00 2.43 O ATOM 0 H GLY A 62 20.693 11.184 2.077 1.00 1.60 H new ATOM 0 HA2 GLY A 62 20.213 9.083 1.303 1.00 1.92 H new ATOM 0 HA3 GLY A 62 19.028 9.959 0.355 1.00 1.92 H new ATOM 857 N SER A 63 20.110 8.420 -1.467 1.00 2.43 N ATOM 858 CA SER A 63 20.658 7.925 -2.717 1.00 2.98 C ATOM 859 C SER A 63 20.300 8.894 -3.869 1.00 2.74 C ATOM 860 O SER A 63 19.753 8.463 -4.892 1.00 3.32 O ATOM 861 CB SER A 63 20.098 6.520 -2.989 1.00 3.86 C ATOM 862 OG SER A 63 20.494 5.607 -1.976 1.00 4.11 O ATOM 0 H SER A 63 19.218 8.007 -1.194 1.00 2.43 H new ATOM 0 HA SER A 63 21.744 7.866 -2.649 1.00 2.98 H new ATOM 0 HB2 SER A 63 19.010 6.562 -3.040 1.00 3.86 H new ATOM 0 HB3 SER A 63 20.449 6.167 -3.959 1.00 3.86 H new ATOM 0 HG SER A 63 20.124 4.721 -2.171 1.00 4.11 H new ATOM 868 N GLY A 64 20.589 10.189 -3.695 1.00 2.15 N ATOM 869 CA GLY A 64 20.260 11.170 -4.721 1.00 2.11 C ATOM 870 C GLY A 64 19.166 12.163 -4.291 1.00 1.92 C ATOM 871 O GLY A 64 18.783 13.039 -5.063 1.00 2.21 O ATOM 0 H GLY A 64 21.043 10.572 -2.866 1.00 2.15 H new ATOM 0 HA2 GLY A 64 21.160 11.725 -4.984 1.00 2.11 H new ATOM 0 HA3 GLY A 64 19.933 10.648 -5.620 1.00 2.11 H new ATOM 875 N GLY A 65 18.711 12.032 -3.063 1.00 1.62 N ATOM 876 CA GLY A 65 17.679 12.935 -2.549 1.00 1.62 C ATOM 877 C GLY A 65 18.257 14.055 -1.705 1.00 1.43 C ATOM 878 O GLY A 65 19.064 13.813 -0.813 1.00 1.62 O ATOM 0 H GLY A 65 19.028 11.322 -2.403 1.00 1.62 H new ATOM 0 HA2 GLY A 65 17.125 13.363 -3.385 1.00 1.62 H new ATOM 0 HA3 GLY A 65 16.966 12.365 -1.953 1.00 1.62 H new ATOM 882 N ARG A 66 17.871 15.302 -2.021 1.00 1.17 N ATOM 883 CA ARG A 66 18.405 16.459 -1.304 1.00 1.03 C ATOM 884 C ARG A 66 17.728 16.643 0.043 1.00 0.94 C ATOM 885 O ARG A 66 16.569 16.271 0.227 1.00 1.04 O ATOM 886 CB ARG A 66 18.327 17.767 -2.120 1.00 1.10 C ATOM 887 CG ARG A 66 17.306 17.775 -3.257 1.00 1.26 C ATOM 888 CD ARG A 66 17.739 16.910 -4.439 1.00 1.41 C ATOM 889 NE ARG A 66 19.182 16.972 -4.692 1.00 1.78 N ATOM 890 CZ ARG A 66 19.804 16.269 -5.641 1.00 2.30 C ATOM 891 NH1 ARG A 66 19.115 15.478 -6.457 1.00 2.55 N ATOM 892 NH2 ARG A 66 21.120 16.363 -5.778 1.00 3.02 N ATOM 0 H ARG A 66 17.202 15.528 -2.757 1.00 1.17 H new ATOM 0 HA ARG A 66 19.461 16.242 -1.142 1.00 1.03 H new ATOM 0 HB2 ARG A 66 18.093 18.586 -1.439 1.00 1.10 H new ATOM 0 HB3 ARG A 66 19.312 17.973 -2.539 1.00 1.10 H new ATOM 0 HG2 ARG A 66 16.347 17.418 -2.882 1.00 1.26 H new ATOM 0 HG3 ARG A 66 17.154 18.799 -3.597 1.00 1.26 H new ATOM 0 HD2 ARG A 66 17.452 15.875 -4.250 1.00 1.41 H new ATOM 0 HD3 ARG A 66 17.204 17.231 -5.333 1.00 1.41 H new ATOM 0 HE ARG A 66 19.745 17.590 -4.107 1.00 1.78 H new ATOM 0 HH11 ARG A 66 18.102 15.404 -6.361 1.00 2.55 H new ATOM 0 HH12 ARG A 66 19.599 14.945 -7.179 1.00 2.55 H new ATOM 0 HH21 ARG A 66 21.655 16.972 -5.159 1.00 3.02 H new ATOM 0 HH22 ARG A 66 21.597 15.826 -6.503 1.00 3.02 H new ATOM 906 N CYS A 67 18.474 17.206 0.998 1.00 0.87 N ATOM 907 CA CYS A 67 17.994 17.418 2.293 1.00 0.87 C ATOM 908 C CYS A 67 16.966 18.515 2.267 1.00 0.88 C ATOM 909 O CYS A 67 17.318 19.684 2.081 1.00 0.93 O ATOM 910 CB CYS A 67 19.149 17.778 3.226 1.00 0.93 C ATOM 911 SG CYS A 67 18.759 17.613 4.992 1.00 1.52 S ATOM 0 H CYS A 67 19.434 17.518 0.854 1.00 0.87 H new ATOM 0 HA CYS A 67 17.528 16.506 2.667 1.00 0.87 H new ATOM 0 HB2 CYS A 67 20.002 17.141 2.993 1.00 0.93 H new ATOM 0 HB3 CYS A 67 19.455 18.805 3.027 1.00 0.93 H new ATOM 916 N ALA A 68 15.713 18.167 2.472 1.00 0.91 N ATOM 917 CA ALA A 68 14.677 19.182 2.482 1.00 0.98 C ATOM 918 C ALA A 68 14.591 19.784 3.878 1.00 0.98 C ATOM 919 O ALA A 68 14.039 20.864 4.085 1.00 1.07 O ATOM 920 CB ALA A 68 13.367 18.602 2.014 1.00 0.98 C ATOM 0 H ALA A 68 15.390 17.213 2.631 1.00 0.91 H new ATOM 0 HA ALA A 68 14.923 19.983 1.785 1.00 0.98 H new ATOM 0 HB1 ALA A 68 12.600 19.377 2.028 1.00 0.98 H new ATOM 0 HB2 ALA A 68 13.480 18.221 0.999 1.00 0.98 H new ATOM 0 HB3 ALA A 68 13.072 17.788 2.676 1.00 0.98 H new ATOM 926 N ALA A 69 15.088 19.013 4.832 1.00 0.92 N ATOM 927 CA ALA A 69 15.070 19.387 6.247 1.00 0.96 C ATOM 928 C ALA A 69 15.959 18.421 7.031 1.00 0.92 C ATOM 929 O ALA A 69 16.261 17.335 6.541 1.00 0.87 O ATOM 930 CB ALA A 69 13.649 19.359 6.777 1.00 1.00 C ATOM 0 H ALA A 69 15.518 18.106 4.651 1.00 0.92 H new ATOM 0 HA ALA A 69 15.454 20.400 6.364 1.00 0.96 H new ATOM 0 HB1 ALA A 69 13.648 19.639 7.830 1.00 1.00 H new ATOM 0 HB2 ALA A 69 13.037 20.063 6.214 1.00 1.00 H new ATOM 0 HB3 ALA A 69 13.240 18.355 6.668 1.00 1.00 H new ATOM 936 N ALA A 70 16.385 18.796 8.240 1.00 0.98 N ATOM 937 CA ALA A 70 17.243 17.913 9.044 1.00 1.00 C ATOM 938 C ALA A 70 16.593 16.531 9.235 1.00 1.04 C ATOM 939 O ALA A 70 15.386 16.425 9.450 1.00 1.24 O ATOM 940 CB ALA A 70 17.584 18.550 10.392 1.00 1.15 C ATOM 0 H ALA A 70 16.157 19.687 8.680 1.00 0.98 H new ATOM 0 HA ALA A 70 18.175 17.771 8.498 1.00 1.00 H new ATOM 0 HB1 ALA A 70 18.219 17.874 10.964 1.00 1.15 H new ATOM 0 HB2 ALA A 70 18.111 19.490 10.227 1.00 1.15 H new ATOM 0 HB3 ALA A 70 16.665 18.741 10.947 1.00 1.15 H new ATOM 946 N GLY A 71 17.411 15.481 9.164 1.00 1.15 N ATOM 947 CA GLY A 71 16.915 14.117 9.332 1.00 1.27 C ATOM 948 C GLY A 71 16.151 13.585 8.119 1.00 1.21 C ATOM 949 O GLY A 71 16.282 12.413 7.773 1.00 1.28 O ATOM 0 H GLY A 71 18.414 15.549 8.992 1.00 1.15 H new ATOM 0 HA2 GLY A 71 17.757 13.457 9.537 1.00 1.27 H new ATOM 0 HA3 GLY A 71 16.263 14.082 10.205 1.00 1.27 H new ATOM 953 N ILE A 72 15.267 14.394 7.545 1.00 1.12 N ATOM 954 CA ILE A 72 14.429 13.979 6.406 1.00 1.08 C ATOM 955 C ILE A 72 15.027 14.444 5.054 1.00 1.03 C ATOM 956 O ILE A 72 14.868 15.602 4.622 1.00 1.36 O ATOM 957 CB ILE A 72 13.024 14.542 6.596 1.00 1.52 C ATOM 958 CG1 ILE A 72 13.053 16.057 6.633 1.00 1.09 C ATOM 959 CG2 ILE A 72 12.406 13.979 7.863 1.00 2.27 C ATOM 960 CD1 ILE A 72 12.432 16.607 5.396 1.00 0.92 C ATOM 0 H ILE A 72 15.105 15.354 7.849 1.00 1.12 H new ATOM 0 HA ILE A 72 14.391 12.890 6.377 1.00 1.08 H new ATOM 0 HB ILE A 72 12.408 14.242 5.748 1.00 1.52 H new ATOM 0 HG12 ILE A 72 12.517 16.418 7.511 1.00 1.09 H new ATOM 0 HG13 ILE A 72 14.081 16.408 6.721 1.00 1.09 H new ATOM 0 HG21 ILE A 72 11.403 14.386 7.991 1.00 2.27 H new ATOM 0 HG22 ILE A 72 12.350 12.893 7.789 1.00 2.27 H new ATOM 0 HG23 ILE A 72 13.021 14.253 8.720 1.00 2.27 H new ATOM 0 HD11 ILE A 72 12.457 17.696 5.430 1.00 0.92 H new ATOM 0 HD12 ILE A 72 12.986 16.258 4.525 1.00 0.92 H new ATOM 0 HD13 ILE A 72 11.398 16.269 5.327 1.00 0.92 H new ATOM 972 N CYS A 73 15.713 13.520 4.381 1.00 0.82 N ATOM 973 CA CYS A 73 16.324 13.811 3.089 1.00 1.07 C ATOM 974 C CYS A 73 15.360 13.425 1.979 1.00 1.08 C ATOM 975 O CYS A 73 15.152 12.245 1.696 1.00 1.21 O ATOM 976 CB CYS A 73 17.652 13.068 2.939 1.00 1.19 C ATOM 977 SG CYS A 73 18.786 13.302 4.346 1.00 1.98 S ATOM 0 H CYS A 73 15.858 12.566 4.711 1.00 0.82 H new ATOM 0 HA CYS A 73 16.534 14.879 3.024 1.00 1.07 H new ATOM 0 HB2 CYS A 73 17.451 12.003 2.819 1.00 1.19 H new ATOM 0 HB3 CYS A 73 18.145 13.404 2.027 1.00 1.19 H new ATOM 982 N CYS A 74 14.740 14.435 1.387 1.00 0.98 N ATOM 983 CA CYS A 74 13.753 14.227 0.342 1.00 0.99 C ATOM 984 C CYS A 74 14.390 14.069 -1.041 1.00 1.15 C ATOM 985 O CYS A 74 15.146 14.926 -1.500 1.00 1.33 O ATOM 986 CB CYS A 74 12.753 15.384 0.366 1.00 1.13 C ATOM 987 SG CYS A 74 12.057 15.711 2.025 1.00 1.32 S ATOM 0 H CYS A 74 14.906 15.415 1.616 1.00 0.98 H new ATOM 0 HA CYS A 74 13.233 13.290 0.540 1.00 0.99 H new ATOM 0 HB2 CYS A 74 13.245 16.286 0.002 1.00 1.13 H new ATOM 0 HB3 CYS A 74 11.939 15.164 -0.324 1.00 1.13 H new ATOM 992 N SER A 75 14.062 12.953 -1.689 1.00 1.14 N ATOM 993 CA SER A 75 14.570 12.628 -3.021 1.00 1.36 C ATOM 994 C SER A 75 13.709 13.296 -4.100 1.00 1.28 C ATOM 995 O SER A 75 12.765 14.016 -3.775 1.00 1.10 O ATOM 996 CB SER A 75 14.582 11.110 -3.214 1.00 1.46 C ATOM 997 OG SER A 75 15.394 10.478 -2.239 1.00 1.99 O ATOM 0 H SER A 75 13.435 12.247 -1.304 1.00 1.14 H new ATOM 0 HA SER A 75 15.588 13.006 -3.113 1.00 1.36 H new ATOM 0 HB2 SER A 75 13.565 10.724 -3.150 1.00 1.46 H new ATOM 0 HB3 SER A 75 14.952 10.870 -4.211 1.00 1.46 H new ATOM 0 HG SER A 75 15.384 9.509 -2.383 1.00 1.99 H new ATOM 1003 N PRO A 76 14.012 13.082 -5.402 1.00 1.46 N ATOM 1004 CA PRO A 76 13.236 13.696 -6.484 1.00 1.42 C ATOM 1005 C PRO A 76 11.892 13.004 -6.685 1.00 1.18 C ATOM 1006 O PRO A 76 11.354 12.971 -7.792 1.00 1.22 O ATOM 1007 CB PRO A 76 14.128 13.498 -7.710 1.00 1.74 C ATOM 1008 CG PRO A 76 14.901 12.261 -7.414 1.00 1.86 C ATOM 1009 CD PRO A 76 15.123 12.253 -5.923 1.00 1.77 C ATOM 0 HA PRO A 76 12.995 14.739 -6.280 1.00 1.42 H new ATOM 0 HB2 PRO A 76 13.535 13.388 -8.618 1.00 1.74 H new ATOM 0 HB3 PRO A 76 14.788 14.352 -7.862 1.00 1.74 H new ATOM 0 HG2 PRO A 76 14.353 11.374 -7.731 1.00 1.86 H new ATOM 0 HG3 PRO A 76 15.850 12.257 -7.949 1.00 1.86 H new ATOM 0 HD2 PRO A 76 15.092 11.241 -5.518 1.00 1.77 H new ATOM 0 HD3 PRO A 76 16.094 12.672 -5.660 1.00 1.77 H new ATOM 1017 N ASP A 77 11.354 12.465 -5.594 1.00 0.99 N ATOM 1018 CA ASP A 77 10.066 11.781 -5.622 1.00 0.91 C ATOM 1019 C ASP A 77 9.306 12.013 -4.313 1.00 0.82 C ATOM 1020 O ASP A 77 8.076 12.001 -4.288 1.00 0.90 O ATOM 1021 CB ASP A 77 10.259 10.282 -5.862 1.00 1.16 C ATOM 1022 CG ASP A 77 11.209 9.652 -4.864 1.00 1.92 C ATOM 1023 OD1 ASP A 77 10.758 9.299 -3.755 1.00 2.65 O ATOM 1024 OD2 ASP A 77 12.406 9.511 -5.193 1.00 2.50 O ATOM 0 H ASP A 77 11.794 12.490 -4.674 1.00 0.99 H new ATOM 0 HA ASP A 77 9.479 12.192 -6.443 1.00 0.91 H new ATOM 0 HB2 ASP A 77 9.293 9.781 -5.805 1.00 1.16 H new ATOM 0 HB3 ASP A 77 10.641 10.125 -6.871 1.00 1.16 H new ATOM 1029 N GLY A 78 10.055 12.224 -3.230 1.00 0.88 N ATOM 1030 CA GLY A 78 9.447 12.457 -1.927 1.00 0.87 C ATOM 1031 C GLY A 78 10.486 12.729 -0.850 1.00 0.86 C ATOM 1032 O GLY A 78 11.407 13.512 -1.067 1.00 0.99 O ATOM 0 H GLY A 78 11.075 12.238 -3.232 1.00 0.88 H new ATOM 0 HA2 GLY A 78 8.764 13.304 -1.993 1.00 0.87 H new ATOM 0 HA3 GLY A 78 8.852 11.588 -1.645 1.00 0.87 H new ATOM 1036 N CYS A 79 10.350 12.068 0.305 1.00 0.79 N ATOM 1037 CA CYS A 79 11.299 12.236 1.413 1.00 0.80 C ATOM 1038 C CYS A 79 11.790 10.866 1.881 1.00 0.78 C ATOM 1039 O CYS A 79 11.115 9.862 1.682 1.00 0.89 O ATOM 1040 CB CYS A 79 10.671 13.042 2.542 1.00 0.94 C ATOM 1041 SG CYS A 79 10.262 14.752 2.052 1.00 1.34 S ATOM 0 H CYS A 79 9.593 11.412 0.497 1.00 0.79 H new ATOM 0 HA CYS A 79 12.165 12.801 1.069 1.00 0.80 H new ATOM 0 HB2 CYS A 79 9.765 12.540 2.880 1.00 0.94 H new ATOM 0 HB3 CYS A 79 11.356 13.066 3.389 1.00 0.94 H new ATOM 1046 N HIS A 80 13.040 10.819 2.363 1.00 0.71 N ATOM 1047 CA HIS A 80 13.657 9.549 2.709 1.00 0.76 C ATOM 1048 C HIS A 80 14.425 9.731 4.016 1.00 0.70 C ATOM 1049 O HIS A 80 15.372 10.514 4.085 1.00 0.67 O ATOM 1050 CB HIS A 80 14.551 9.084 1.540 1.00 0.87 C ATOM 1051 CG HIS A 80 15.695 8.178 1.900 1.00 0.99 C ATOM 1052 ND1 HIS A 80 15.534 6.948 2.502 1.00 1.64 N ATOM 1053 CD2 HIS A 80 17.027 8.340 1.731 1.00 1.76 C ATOM 1054 CE1 HIS A 80 16.720 6.394 2.687 1.00 2.09 C ATOM 1055 NE2 HIS A 80 17.642 7.219 2.227 1.00 2.17 N ATOM 0 H HIS A 80 13.629 11.637 2.517 1.00 0.71 H new ATOM 0 HA HIS A 80 12.914 8.768 2.867 1.00 0.76 H new ATOM 0 HB2 HIS A 80 13.923 8.571 0.812 1.00 0.87 H new ATOM 0 HB3 HIS A 80 14.956 9.967 1.046 1.00 0.87 H new ATOM 0 HD2 HIS A 80 17.516 9.195 1.287 1.00 1.76 H new ATOM 0 HE1 HIS A 80 16.903 5.430 3.138 1.00 2.09 H new ATOM 0 HE2 HIS A 80 18.648 7.050 2.239 1.00 2.17 H new ATOM 1064 N GLU A 81 13.990 9.013 5.059 1.00 0.75 N ATOM 1065 CA GLU A 81 14.623 9.119 6.374 1.00 0.77 C ATOM 1066 C GLU A 81 16.098 8.792 6.274 1.00 0.72 C ATOM 1067 O GLU A 81 16.494 7.692 5.888 1.00 0.92 O ATOM 1068 CB GLU A 81 13.941 8.205 7.399 1.00 0.94 C ATOM 1069 CG GLU A 81 13.529 6.859 6.837 1.00 1.70 C ATOM 1070 CD GLU A 81 14.391 5.721 7.348 1.00 2.35 C ATOM 1071 OE1 GLU A 81 14.302 5.402 8.551 1.00 2.71 O ATOM 1072 OE2 GLU A 81 15.155 5.149 6.543 1.00 3.05 O ATOM 0 H GLU A 81 13.209 8.358 5.016 1.00 0.75 H new ATOM 0 HA GLU A 81 14.510 10.147 6.718 1.00 0.77 H new ATOM 0 HB2 GLU A 81 14.618 8.046 8.238 1.00 0.94 H new ATOM 0 HB3 GLU A 81 13.059 8.710 7.792 1.00 0.94 H new ATOM 0 HG2 GLU A 81 12.488 6.665 7.096 1.00 1.70 H new ATOM 0 HG3 GLU A 81 13.586 6.892 5.749 1.00 1.70 H new ATOM 1079 N ASP A 82 16.895 9.786 6.596 1.00 0.76 N ATOM 1080 CA ASP A 82 18.328 9.674 6.524 1.00 0.77 C ATOM 1081 C ASP A 82 18.955 10.539 7.638 1.00 0.96 C ATOM 1082 O ASP A 82 19.001 11.763 7.527 1.00 1.21 O ATOM 1083 CB ASP A 82 18.738 10.081 5.092 1.00 0.86 C ATOM 1084 CG ASP A 82 20.212 10.414 4.935 1.00 1.34 C ATOM 1085 OD1 ASP A 82 20.719 11.270 5.686 1.00 1.82 O ATOM 1086 OD2 ASP A 82 20.859 9.808 4.053 1.00 2.02 O ATOM 0 H ASP A 82 16.563 10.696 6.916 1.00 0.76 H new ATOM 0 HA ASP A 82 18.692 8.661 6.699 1.00 0.77 H new ATOM 0 HB2 ASP A 82 18.486 9.269 4.410 1.00 0.86 H new ATOM 0 HB3 ASP A 82 18.148 10.946 4.790 1.00 0.86 H new ATOM 1091 N PRO A 83 19.396 9.906 8.759 1.00 1.15 N ATOM 1092 CA PRO A 83 19.960 10.623 9.924 1.00 1.42 C ATOM 1093 C PRO A 83 21.154 11.527 9.615 1.00 1.28 C ATOM 1094 O PRO A 83 21.672 12.189 10.515 1.00 1.40 O ATOM 1095 CB PRO A 83 20.393 9.495 10.864 1.00 1.81 C ATOM 1096 CG PRO A 83 19.537 8.338 10.491 1.00 1.93 C ATOM 1097 CD PRO A 83 19.333 8.446 9.008 1.00 1.42 C ATOM 0 HA PRO A 83 19.218 11.309 10.332 1.00 1.42 H new ATOM 0 HB2 PRO A 83 21.450 9.261 10.740 1.00 1.81 H new ATOM 0 HB3 PRO A 83 20.249 9.773 11.908 1.00 1.81 H new ATOM 0 HG2 PRO A 83 20.017 7.395 10.753 1.00 1.93 H new ATOM 0 HG3 PRO A 83 18.585 8.368 11.021 1.00 1.93 H new ATOM 0 HD2 PRO A 83 20.105 7.910 8.456 1.00 1.42 H new ATOM 0 HD3 PRO A 83 18.374 8.027 8.703 1.00 1.42 H new ATOM 1105 N ALA A 84 21.598 11.554 8.368 1.00 1.13 N ATOM 1106 CA ALA A 84 22.739 12.386 7.996 1.00 1.17 C ATOM 1107 C ALA A 84 22.429 13.880 8.135 1.00 1.20 C ATOM 1108 O ALA A 84 23.342 14.705 8.164 1.00 1.53 O ATOM 1109 CB ALA A 84 23.193 12.068 6.578 1.00 1.21 C ATOM 0 H ALA A 84 21.193 11.017 7.601 1.00 1.13 H new ATOM 0 HA ALA A 84 23.549 12.154 8.688 1.00 1.17 H new ATOM 0 HB1 ALA A 84 24.044 12.698 6.319 1.00 1.21 H new ATOM 0 HB2 ALA A 84 23.485 11.020 6.516 1.00 1.21 H new ATOM 0 HB3 ALA A 84 22.375 12.259 5.883 1.00 1.21 H new ATOM 1115 N CYS A 85 21.142 14.228 8.198 1.00 1.02 N ATOM 1116 CA CYS A 85 20.736 15.633 8.307 1.00 1.19 C ATOM 1117 C CYS A 85 20.382 16.054 9.740 1.00 1.46 C ATOM 1118 O CYS A 85 19.910 17.166 9.966 1.00 1.88 O ATOM 1119 CB CYS A 85 19.579 15.919 7.351 1.00 1.15 C ATOM 1120 SG CYS A 85 20.111 16.253 5.645 1.00 1.42 S ATOM 0 H CYS A 85 20.368 13.564 8.176 1.00 1.02 H new ATOM 0 HA CYS A 85 21.599 16.236 8.024 1.00 1.19 H new ATOM 0 HB2 CYS A 85 18.900 15.067 7.351 1.00 1.15 H new ATOM 0 HB3 CYS A 85 19.016 16.775 7.721 1.00 1.15 H new ATOM 1125 N ASP A 86 20.621 15.165 10.696 1.00 1.53 N ATOM 1126 CA ASP A 86 20.344 15.417 12.103 1.00 1.90 C ATOM 1127 C ASP A 86 21.247 16.456 12.776 1.00 1.82 C ATOM 1128 O ASP A 86 20.853 16.986 13.817 1.00 2.29 O ATOM 1129 CB ASP A 86 20.416 14.104 12.882 1.00 2.43 C ATOM 1130 CG ASP A 86 19.135 13.808 13.634 1.00 3.07 C ATOM 1131 OD1 ASP A 86 18.109 13.537 12.974 1.00 3.47 O ATOM 1132 OD2 ASP A 86 19.157 13.846 14.882 1.00 3.60 O ATOM 0 H ASP A 86 21.016 14.242 10.514 1.00 1.53 H new ATOM 0 HA ASP A 86 19.342 15.846 12.124 1.00 1.90 H new ATOM 0 HB2 ASP A 86 20.626 13.287 12.192 1.00 2.43 H new ATOM 0 HB3 ASP A 86 21.246 14.148 13.587 1.00 2.43 H new ATOM 1137 N PRO A 87 22.448 16.794 12.254 1.00 1.72 N ATOM 1138 CA PRO A 87 23.278 17.785 12.916 1.00 2.05 C ATOM 1139 C PRO A 87 22.810 19.152 12.580 1.00 2.20 C ATOM 1140 O PRO A 87 23.558 20.031 12.142 1.00 2.35 O ATOM 1141 CB PRO A 87 24.673 17.519 12.388 1.00 2.46 C ATOM 1142 CG PRO A 87 24.550 16.512 11.281 1.00 2.56 C ATOM 1143 CD PRO A 87 23.086 16.289 11.030 1.00 1.96 C ATOM 0 HA PRO A 87 23.242 17.718 14.003 1.00 2.05 H new ATOM 0 HB2 PRO A 87 25.126 18.440 12.021 1.00 2.46 H new ATOM 0 HB3 PRO A 87 25.318 17.141 13.181 1.00 2.46 H new ATOM 0 HG2 PRO A 87 25.042 16.873 10.378 1.00 2.56 H new ATOM 0 HG3 PRO A 87 25.038 15.577 11.558 1.00 2.56 H new ATOM 0 HD2 PRO A 87 22.743 16.828 10.147 1.00 1.96 H new ATOM 0 HD3 PRO A 87 22.863 15.235 10.866 1.00 1.96 H new ATOM 1151 N GLU A 88 21.567 19.338 12.905 1.00 2.56 N ATOM 1152 CA GLU A 88 20.842 20.584 12.764 1.00 3.21 C ATOM 1153 C GLU A 88 19.338 20.408 13.121 1.00 3.51 C ATOM 1154 O GLU A 88 18.595 21.390 13.130 1.00 4.11 O ATOM 1155 CB GLU A 88 20.969 21.099 11.330 1.00 3.64 C ATOM 1156 CG GLU A 88 20.115 20.342 10.315 1.00 3.54 C ATOM 1157 CD GLU A 88 19.823 21.157 9.066 1.00 4.21 C ATOM 1158 OE1 GLU A 88 20.725 21.890 8.611 1.00 4.72 O ATOM 1159 OE2 GLU A 88 18.687 21.069 8.551 1.00 4.58 O ATOM 0 H GLU A 88 20.993 18.592 13.297 1.00 2.56 H new ATOM 0 HA GLU A 88 21.276 21.305 13.456 1.00 3.21 H new ATOM 0 HB2 GLU A 88 20.691 22.153 11.308 1.00 3.64 H new ATOM 0 HB3 GLU A 88 22.014 21.039 11.026 1.00 3.64 H new ATOM 0 HG2 GLU A 88 20.626 19.422 10.032 1.00 3.54 H new ATOM 0 HG3 GLU A 88 19.174 20.053 10.783 1.00 3.54 H new ATOM 1166 N ALA A 89 18.891 19.183 13.468 1.00 3.29 N ATOM 1167 CA ALA A 89 17.522 18.911 13.830 1.00 3.88 C ATOM 1168 C ALA A 89 17.309 18.977 15.351 1.00 4.78 C ATOM 1169 O ALA A 89 17.013 17.950 15.968 1.00 5.29 O ATOM 1170 CB ALA A 89 17.155 17.530 13.268 1.00 3.48 C ATOM 0 H ALA A 89 19.492 18.360 13.499 1.00 3.29 H new ATOM 0 HA ALA A 89 16.869 19.673 13.405 1.00 3.88 H new ATOM 0 HB1 ALA A 89 16.122 17.295 13.526 1.00 3.48 H new ATOM 0 HB2 ALA A 89 17.265 17.537 12.184 1.00 3.48 H new ATOM 0 HB3 ALA A 89 17.816 16.776 13.695 1.00 3.48 H new ATOM 1176 N ALA A 90 17.636 20.119 15.973 1.00 5.12 N ATOM 1177 CA ALA A 90 17.606 20.164 17.451 1.00 6.15 C ATOM 1178 C ALA A 90 16.222 19.822 18.012 1.00 6.94 C ATOM 1179 O ALA A 90 15.266 19.642 17.255 1.00 6.98 O ATOM 1180 CB ALA A 90 18.059 21.527 17.945 1.00 6.47 C ATOM 0 H ALA A 90 17.912 20.985 15.510 1.00 5.12 H new ATOM 0 HA ALA A 90 18.297 19.404 17.815 1.00 6.15 H new ATOM 0 HB1 ALA A 90 18.032 21.547 19.034 1.00 6.47 H new ATOM 0 HB2 ALA A 90 19.076 21.718 17.604 1.00 6.47 H new ATOM 0 HB3 ALA A 90 17.394 22.296 17.552 1.00 6.47 H new ATOM 1186 N PHE A 91 16.092 19.832 19.342 1.00 7.67 N ATOM 1187 CA PHE A 91 14.796 19.606 19.986 1.00 8.56 C ATOM 1188 C PHE A 91 14.151 20.944 20.371 1.00 9.41 C ATOM 1189 O PHE A 91 14.454 21.507 21.424 1.00 9.96 O ATOM 1190 CB PHE A 91 14.947 18.722 21.226 1.00 9.02 C ATOM 1191 CG PHE A 91 14.364 17.351 21.050 1.00 9.29 C ATOM 1192 CD1 PHE A 91 13.004 17.134 21.214 1.00 9.65 C ATOM 1193 CD2 PHE A 91 15.174 16.278 20.716 1.00 9.45 C ATOM 1194 CE1 PHE A 91 12.465 15.872 21.048 1.00 10.10 C ATOM 1195 CE2 PHE A 91 14.641 15.014 20.549 1.00 9.92 C ATOM 1196 CZ PHE A 91 13.284 14.811 20.715 1.00 10.21 C ATOM 0 H PHE A 91 16.863 19.993 19.990 1.00 7.67 H new ATOM 0 HA PHE A 91 14.151 19.092 19.274 1.00 8.56 H new ATOM 0 HB2 PHE A 91 16.005 18.631 21.472 1.00 9.02 H new ATOM 0 HB3 PHE A 91 14.463 19.209 22.073 1.00 9.02 H new ATOM 0 HD1 PHE A 91 12.359 17.960 21.474 1.00 9.65 H new ATOM 0 HD2 PHE A 91 16.235 16.431 20.585 1.00 9.45 H new ATOM 0 HE1 PHE A 91 11.404 15.716 21.179 1.00 10.10 H new ATOM 0 HE2 PHE A 91 15.284 14.186 20.289 1.00 9.92 H new ATOM 0 HZ PHE A 91 12.865 13.824 20.585 1.00 10.21 H new ATOM 1206 N SER A 92 13.270 21.452 19.510 1.00 9.61 N ATOM 1207 CA SER A 92 12.594 22.727 19.754 1.00 10.49 C ATOM 1208 C SER A 92 13.597 23.877 19.799 1.00 11.25 C ATOM 1209 O SER A 92 13.571 24.720 18.877 1.00 11.48 O ATOM 1210 CB SER A 92 11.799 22.685 21.062 1.00 10.50 C ATOM 1211 OG SER A 92 10.423 22.944 20.832 1.00 10.56 O ATOM 1212 OXT SER A 92 14.399 23.924 20.756 1.00 11.77 O ATOM 0 H SER A 92 13.007 20.999 18.635 1.00 9.61 H new ATOM 0 HA SER A 92 11.903 22.894 18.928 1.00 10.49 H new ATOM 0 HB2 SER A 92 11.915 21.708 21.530 1.00 10.50 H new ATOM 0 HB3 SER A 92 12.199 23.422 21.758 1.00 10.50 H new ATOM 0 HG SER A 92 9.937 22.910 21.682 1.00 10.56 H new TER 1218 SER A 92 ATOM 1219 N ALA B 101 -9.124 -9.170 8.074 1.00 10.07 N ATOM 1220 CA ALA B 101 -8.968 -8.694 9.472 1.00 9.47 C ATOM 1221 C ALA B 101 -8.944 -7.171 9.552 1.00 8.40 C ATOM 1222 O ALA B 101 -8.344 -6.494 8.716 1.00 8.14 O ATOM 1223 CB ALA B 101 -7.703 -9.268 10.091 1.00 9.68 C ATOM 0 HA ALA B 101 -9.834 -9.044 10.034 1.00 9.47 H new ATOM 0 HB1 ALA B 101 -7.604 -8.909 11.115 1.00 9.68 H new ATOM 0 HB2 ALA B 101 -7.760 -10.357 10.092 1.00 9.68 H new ATOM 0 HB3 ALA B 101 -6.837 -8.950 9.510 1.00 9.68 H new ATOM 1231 N VAL B 102 -9.597 -6.651 10.584 1.00 8.03 N ATOM 1232 CA VAL B 102 -9.657 -5.211 10.814 1.00 7.24 C ATOM 1233 C VAL B 102 -8.424 -4.720 11.564 1.00 6.03 C ATOM 1234 O VAL B 102 -8.488 -3.721 12.285 1.00 5.94 O ATOM 1235 CB VAL B 102 -10.925 -4.767 11.589 1.00 7.66 C ATOM 1236 CG1 VAL B 102 -12.060 -4.448 10.629 1.00 7.91 C ATOM 1237 CG2 VAL B 102 -11.357 -5.811 12.612 1.00 8.41 C ATOM 0 H VAL B 102 -10.095 -7.207 11.279 1.00 8.03 H new ATOM 0 HA VAL B 102 -9.696 -4.761 9.822 1.00 7.24 H new ATOM 0 HB VAL B 102 -10.672 -3.860 12.137 1.00 7.66 H new ATOM 0 HG11 VAL B 102 -12.939 -4.139 11.195 1.00 7.91 H new ATOM 0 HG12 VAL B 102 -11.756 -3.642 9.961 1.00 7.91 H new ATOM 0 HG13 VAL B 102 -12.300 -5.334 10.042 1.00 7.91 H new ATOM 0 HG21 VAL B 102 -12.248 -5.462 13.134 1.00 8.41 H new ATOM 0 HG22 VAL B 102 -11.578 -6.749 12.103 1.00 8.41 H new ATOM 0 HG23 VAL B 102 -10.554 -5.969 13.332 1.00 8.41 H new ATOM 1247 N LEU B 103 -7.277 -5.356 11.322 1.00 5.40 N ATOM 1248 CA LEU B 103 -6.007 -4.918 11.894 1.00 4.42 C ATOM 1249 C LEU B 103 -4.876 -5.801 11.353 1.00 4.14 C ATOM 1250 O LEU B 103 -4.482 -6.779 11.986 1.00 4.51 O ATOM 1251 CB LEU B 103 -5.991 -4.864 13.436 1.00 4.44 C ATOM 1252 CG LEU B 103 -4.994 -3.844 14.012 1.00 5.04 C ATOM 1253 CD1 LEU B 103 -5.521 -2.421 13.894 1.00 5.09 C ATOM 1254 CD2 LEU B 103 -4.668 -4.164 15.462 1.00 5.87 C ATOM 0 H LEU B 103 -7.204 -6.182 10.729 1.00 5.40 H new ATOM 0 HA LEU B 103 -5.857 -3.885 11.581 1.00 4.42 H new ATOM 0 HB2 LEU B 103 -6.992 -4.620 13.792 1.00 4.44 H new ATOM 0 HB3 LEU B 103 -5.748 -5.854 13.822 1.00 4.44 H new ATOM 0 HG LEU B 103 -4.079 -3.916 13.424 1.00 5.04 H new ATOM 0 HD11 LEU B 103 -4.791 -1.727 14.311 1.00 5.09 H new ATOM 0 HD12 LEU B 103 -5.691 -2.182 12.844 1.00 5.09 H new ATOM 0 HD13 LEU B 103 -6.459 -2.334 14.442 1.00 5.09 H new ATOM 0 HD21 LEU B 103 -3.961 -3.429 15.847 1.00 5.87 H new ATOM 0 HD22 LEU B 103 -5.582 -4.134 16.055 1.00 5.87 H new ATOM 0 HD23 LEU B 103 -4.227 -5.159 15.525 1.00 5.87 H new ATOM 1266 N ASP B 104 -4.327 -5.404 10.215 1.00 4.04 N ATOM 1267 CA ASP B 104 -3.192 -6.095 9.605 1.00 4.36 C ATOM 1268 C ASP B 104 -1.977 -5.711 10.429 1.00 4.07 C ATOM 1269 O ASP B 104 -1.189 -4.833 10.090 1.00 4.12 O ATOM 1270 CB ASP B 104 -3.011 -5.712 8.138 1.00 5.06 C ATOM 1271 CG ASP B 104 -3.030 -6.925 7.225 1.00 5.80 C ATOM 1272 OD1 ASP B 104 -4.132 -7.443 6.949 1.00 6.27 O ATOM 1273 OD2 ASP B 104 -1.942 -7.358 6.791 1.00 6.19 O ATOM 0 H ASP B 104 -4.652 -4.595 9.686 1.00 4.04 H new ATOM 0 HA ASP B 104 -3.350 -7.174 9.606 1.00 4.36 H new ATOM 0 HB2 ASP B 104 -3.803 -5.024 7.843 1.00 5.06 H new ATOM 0 HB3 ASP B 104 -2.067 -5.182 8.016 1.00 5.06 H new ATOM 1278 N LEU B 105 -1.936 -6.371 11.580 1.00 4.35 N ATOM 1279 CA LEU B 105 -0.994 -6.193 12.599 1.00 4.75 C ATOM 1280 C LEU B 105 -1.023 -7.477 13.448 1.00 5.41 C ATOM 1281 O LEU B 105 -1.148 -8.580 12.920 1.00 6.19 O ATOM 1282 CB LEU B 105 -1.456 -4.915 13.298 1.00 5.45 C ATOM 1283 CG LEU B 105 -0.698 -4.385 14.496 1.00 6.23 C ATOM 1284 CD1 LEU B 105 -1.560 -4.635 15.691 1.00 5.95 C ATOM 1285 CD2 LEU B 105 0.700 -4.986 14.667 1.00 7.20 C ATOM 0 H LEU B 105 -2.624 -7.088 11.810 1.00 4.35 H new ATOM 0 HA LEU B 105 0.047 -6.062 12.305 1.00 4.75 H new ATOM 0 HB2 LEU B 105 -1.470 -4.124 12.548 1.00 5.45 H new ATOM 0 HB3 LEU B 105 -2.487 -5.074 13.613 1.00 5.45 H new ATOM 0 HG LEU B 105 -0.506 -3.321 14.356 1.00 6.23 H new ATOM 0 HD11 LEU B 105 -1.056 -4.269 16.586 1.00 5.95 H new ATOM 0 HD12 LEU B 105 -2.510 -4.114 15.570 1.00 5.95 H new ATOM 0 HD13 LEU B 105 -1.744 -5.705 15.790 1.00 5.95 H new ATOM 0 HD21 LEU B 105 1.176 -4.554 15.547 1.00 7.20 H new ATOM 0 HD22 LEU B 105 0.619 -6.066 14.791 1.00 7.20 H new ATOM 0 HD23 LEU B 105 1.301 -4.766 13.785 1.00 7.20 H new ATOM 1297 N ASP B 106 -0.880 -7.316 14.738 1.00 5.41 N ATOM 1298 CA ASP B 106 -0.866 -8.462 15.654 1.00 6.32 C ATOM 1299 C ASP B 106 -1.175 -8.031 17.103 1.00 6.19 C ATOM 1300 O ASP B 106 -2.078 -8.567 17.741 1.00 6.37 O ATOM 1301 CB ASP B 106 0.470 -9.143 15.478 1.00 7.13 C ATOM 1302 CG ASP B 106 0.462 -10.595 15.920 1.00 8.06 C ATOM 1303 OD1 ASP B 106 0.669 -10.852 17.125 1.00 8.48 O ATOM 1304 OD2 ASP B 106 0.252 -11.476 15.060 1.00 8.55 O ATOM 0 H ASP B 106 -0.771 -6.409 15.192 1.00 5.41 H new ATOM 0 HA ASP B 106 -1.657 -9.176 15.422 1.00 6.32 H new ATOM 0 HB2 ASP B 106 0.762 -9.090 14.429 1.00 7.13 H new ATOM 0 HB3 ASP B 106 1.225 -8.601 16.047 1.00 7.13 H new ATOM 1309 N VAL B 107 -0.517 -6.968 17.534 1.00 6.17 N ATOM 1310 CA VAL B 107 -0.772 -6.301 18.794 1.00 6.24 C ATOM 1311 C VAL B 107 -0.772 -4.846 18.368 1.00 5.49 C ATOM 1312 O VAL B 107 0.214 -4.372 17.790 1.00 5.67 O ATOM 1313 CB VAL B 107 0.317 -6.565 19.865 1.00 7.18 C ATOM 1314 CG1 VAL B 107 1.705 -6.195 19.353 1.00 7.33 C ATOM 1315 CG2 VAL B 107 -0.002 -5.814 21.150 1.00 7.48 C ATOM 0 H VAL B 107 0.233 -6.533 16.997 1.00 6.17 H new ATOM 0 HA VAL B 107 -1.689 -6.644 19.274 1.00 6.24 H new ATOM 0 HB VAL B 107 0.319 -7.634 20.080 1.00 7.18 H new ATOM 0 HG11 VAL B 107 2.444 -6.393 20.129 1.00 7.33 H new ATOM 0 HG12 VAL B 107 1.938 -6.791 18.470 1.00 7.33 H new ATOM 0 HG13 VAL B 107 1.727 -5.137 19.093 1.00 7.33 H new ATOM 0 HG21 VAL B 107 0.774 -6.012 21.889 1.00 7.48 H new ATOM 0 HG22 VAL B 107 -0.044 -4.744 20.945 1.00 7.48 H new ATOM 0 HG23 VAL B 107 -0.965 -6.147 21.537 1.00 7.48 H new ATOM 1325 N ARG B 108 -1.905 -4.161 18.537 1.00 5.08 N ATOM 1326 CA ARG B 108 -2.012 -2.849 18.061 1.00 4.80 C ATOM 1327 C ARG B 108 -1.333 -1.896 18.943 1.00 4.49 C ATOM 1328 O ARG B 108 -1.917 -1.472 19.952 1.00 4.98 O ATOM 1329 CB ARG B 108 -3.497 -2.440 17.915 1.00 5.26 C ATOM 1330 CG ARG B 108 -4.468 -3.151 18.868 1.00 6.18 C ATOM 1331 CD ARG B 108 -4.414 -2.577 20.280 1.00 6.96 C ATOM 1332 NE ARG B 108 -3.609 -3.406 21.180 1.00 7.64 N ATOM 1333 CZ ARG B 108 -3.140 -2.994 22.360 1.00 8.36 C ATOM 1334 NH1 ARG B 108 -3.399 -1.769 22.802 1.00 8.54 N ATOM 1335 NH2 ARG B 108 -2.412 -3.816 23.104 1.00 9.12 N ATOM 0 H ARG B 108 -2.738 -4.522 19.002 1.00 5.08 H new ATOM 0 HA ARG B 108 -1.528 -2.823 17.085 1.00 4.80 H new ATOM 0 HB2 ARG B 108 -3.578 -1.365 18.075 1.00 5.26 H new ATOM 0 HB3 ARG B 108 -3.812 -2.635 16.890 1.00 5.26 H new ATOM 0 HG2 ARG B 108 -5.483 -3.064 18.481 1.00 6.18 H new ATOM 0 HG3 ARG B 108 -4.229 -4.214 18.900 1.00 6.18 H new ATOM 0 HD2 ARG B 108 -3.998 -1.570 20.246 1.00 6.96 H new ATOM 0 HD3 ARG B 108 -5.426 -2.491 20.675 1.00 6.96 H new ATOM 0 HE ARG B 108 -3.393 -4.359 20.886 1.00 7.64 H new ATOM 0 HH11 ARG B 108 -3.962 -1.132 22.238 1.00 8.54 H new ATOM 0 HH12 ARG B 108 -3.035 -1.465 23.705 1.00 8.54 H new ATOM 0 HH21 ARG B 108 -2.212 -4.760 22.774 1.00 9.12 H new ATOM 0 HH22 ARG B 108 -2.052 -3.504 24.006 1.00 9.12 H new ATOM 1349 N THR B 109 -0.214 -1.384 18.472 1.00 4.05 N ATOM 1350 CA THR B 109 0.316 -0.299 19.187 1.00 4.08 C ATOM 1351 C THR B 109 -0.072 0.783 18.251 1.00 3.18 C ATOM 1352 O THR B 109 0.672 1.167 17.347 1.00 3.48 O ATOM 1353 CB THR B 109 1.838 -0.406 19.366 1.00 4.98 C ATOM 1354 OG1 THR B 109 2.380 0.832 19.788 1.00 5.58 O ATOM 1355 CG2 THR B 109 2.570 -0.822 18.109 1.00 5.69 C ATOM 0 H THR B 109 0.301 -1.694 17.648 1.00 4.05 H new ATOM 0 HA THR B 109 -0.036 -0.186 20.212 1.00 4.08 H new ATOM 0 HB THR B 109 1.982 -1.181 20.118 1.00 4.98 H new ATOM 0 HG1 THR B 109 2.531 0.810 20.756 1.00 5.58 H new ATOM 0 HG21 THR B 109 3.640 -0.876 18.312 1.00 5.69 H new ATOM 0 HG22 THR B 109 2.212 -1.800 17.786 1.00 5.69 H new ATOM 0 HG23 THR B 109 2.387 -0.090 17.322 1.00 5.69 H new ATOM 1363 N CYS B 110 -1.293 1.229 18.454 1.00 2.52 N ATOM 1364 CA CYS B 110 -1.836 2.244 17.560 1.00 1.89 C ATOM 1365 C CYS B 110 -1.270 3.627 17.889 1.00 1.69 C ATOM 1366 O CYS B 110 -2.004 4.558 18.221 1.00 1.94 O ATOM 1367 CB CYS B 110 -3.365 2.231 17.645 1.00 2.23 C ATOM 1368 SG CYS B 110 -4.189 1.431 16.219 1.00 2.61 S ATOM 0 H CYS B 110 -1.915 0.922 19.202 1.00 2.52 H new ATOM 0 HA CYS B 110 -1.540 2.014 16.537 1.00 1.89 H new ATOM 0 HB2 CYS B 110 -3.663 1.716 18.558 1.00 2.23 H new ATOM 0 HB3 CYS B 110 -3.722 3.258 17.728 1.00 2.23 H new ATOM 1373 N LEU B 111 0.049 3.747 17.729 1.00 1.46 N ATOM 1374 CA LEU B 111 0.789 4.998 17.946 1.00 1.37 C ATOM 1375 C LEU B 111 0.055 6.249 17.435 1.00 1.20 C ATOM 1376 O LEU B 111 -0.100 6.414 16.225 1.00 1.18 O ATOM 1377 CB LEU B 111 2.173 4.903 17.304 1.00 1.54 C ATOM 1378 CG LEU B 111 3.201 5.904 17.833 1.00 1.90 C ATOM 1379 CD1 LEU B 111 3.503 5.640 19.301 1.00 2.47 C ATOM 1380 CD2 LEU B 111 4.476 5.841 17.006 1.00 2.26 C ATOM 0 H LEU B 111 0.644 2.970 17.441 1.00 1.46 H new ATOM 0 HA LEU B 111 0.880 5.118 19.026 1.00 1.37 H new ATOM 0 HB2 LEU B 111 2.559 3.895 17.455 1.00 1.54 H new ATOM 0 HB3 LEU B 111 2.069 5.046 16.229 1.00 1.54 H new ATOM 0 HG LEU B 111 2.781 6.906 17.747 1.00 1.90 H new ATOM 0 HD11 LEU B 111 4.237 6.363 19.657 1.00 2.47 H new ATOM 0 HD12 LEU B 111 2.587 5.735 19.884 1.00 2.47 H new ATOM 0 HD13 LEU B 111 3.902 4.632 19.415 1.00 2.47 H new ATOM 0 HD21 LEU B 111 5.198 6.559 17.395 1.00 2.26 H new ATOM 0 HD22 LEU B 111 4.897 4.837 17.062 1.00 2.26 H new ATOM 0 HD23 LEU B 111 4.248 6.081 15.968 1.00 2.26 H new ATOM 1392 N PRO B 112 -0.374 7.169 18.329 1.00 1.19 N ATOM 1393 CA PRO B 112 -1.043 8.406 17.925 1.00 1.12 C ATOM 1394 C PRO B 112 -0.002 9.471 17.559 1.00 1.03 C ATOM 1395 O PRO B 112 1.025 9.570 18.237 1.00 1.06 O ATOM 1396 CB PRO B 112 -1.861 8.772 19.157 1.00 1.30 C ATOM 1397 CG PRO B 112 -1.103 8.211 20.316 1.00 1.47 C ATOM 1398 CD PRO B 112 -0.218 7.099 19.794 1.00 1.37 C ATOM 0 HA PRO B 112 -1.671 8.312 17.039 1.00 1.12 H new ATOM 0 HB2 PRO B 112 -1.974 9.852 19.247 1.00 1.30 H new ATOM 0 HB3 PRO B 112 -2.864 8.350 19.102 1.00 1.30 H new ATOM 0 HG2 PRO B 112 -0.502 8.986 20.791 1.00 1.47 H new ATOM 0 HG3 PRO B 112 -1.789 7.830 21.073 1.00 1.47 H new ATOM 0 HD2 PRO B 112 0.821 7.244 20.091 1.00 1.37 H new ATOM 0 HD3 PRO B 112 -0.528 6.128 20.181 1.00 1.37 H new ATOM 1406 N CYS B 113 -0.356 10.412 16.676 1.00 0.94 N ATOM 1407 CA CYS B 113 0.561 11.546 16.435 1.00 0.90 C ATOM 1408 C CYS B 113 -0.137 12.768 15.841 1.00 0.91 C ATOM 1409 O CYS B 113 -1.359 12.808 15.712 1.00 1.00 O ATOM 1410 CB CYS B 113 1.790 11.090 15.600 1.00 0.83 C ATOM 1411 SG CYS B 113 1.739 11.384 13.790 1.00 0.87 S ATOM 0 H CYS B 113 -1.223 10.421 16.138 1.00 0.94 H new ATOM 0 HA CYS B 113 0.926 11.878 17.407 1.00 0.90 H new ATOM 0 HB2 CYS B 113 2.672 11.592 15.998 1.00 0.83 H new ATOM 0 HB3 CYS B 113 1.930 10.022 15.764 1.00 0.83 H new ATOM 1416 N GLY B 114 0.669 13.746 15.429 1.00 0.92 N ATOM 1417 CA GLY B 114 0.123 14.941 14.825 1.00 0.99 C ATOM 1418 C GLY B 114 -0.472 15.863 15.863 1.00 1.11 C ATOM 1419 O GLY B 114 -0.109 15.784 17.036 1.00 1.16 O ATOM 0 H GLY B 114 1.686 13.728 15.504 1.00 0.92 H new ATOM 0 HA2 GLY B 114 0.907 15.465 14.278 1.00 0.99 H new ATOM 0 HA3 GLY B 114 -0.642 14.666 14.099 1.00 0.99 H new ATOM 1423 N PRO B 115 -1.415 16.736 15.486 1.00 1.19 N ATOM 1424 CA PRO B 115 -2.079 17.645 16.426 1.00 1.33 C ATOM 1425 C PRO B 115 -2.929 16.918 17.463 1.00 1.40 C ATOM 1426 O PRO B 115 -4.049 16.500 17.186 1.00 1.57 O ATOM 1427 CB PRO B 115 -3.007 18.428 15.508 1.00 1.46 C ATOM 1428 CG PRO B 115 -3.353 17.341 14.606 1.00 1.39 C ATOM 1429 CD PRO B 115 -2.013 16.885 14.153 1.00 1.21 C ATOM 0 HA PRO B 115 -1.358 18.232 16.995 1.00 1.33 H new ATOM 0 HB2 PRO B 115 -3.871 18.842 16.028 1.00 1.46 H new ATOM 0 HB3 PRO B 115 -2.509 19.257 15.005 1.00 1.46 H new ATOM 0 HG2 PRO B 115 -3.905 16.549 15.112 1.00 1.39 H new ATOM 0 HG3 PRO B 115 -3.972 17.680 13.775 1.00 1.39 H new ATOM 0 HD2 PRO B 115 -2.044 15.952 13.589 1.00 1.21 H new ATOM 0 HD3 PRO B 115 -1.498 17.617 13.530 1.00 1.21 H new ATOM 1437 N GLY B 116 -2.348 16.703 18.583 1.00 1.35 N ATOM 1438 CA GLY B 116 -3.002 16.007 19.667 1.00 1.48 C ATOM 1439 C GLY B 116 -2.929 14.529 19.534 1.00 1.44 C ATOM 1440 O GLY B 116 -3.446 13.794 20.375 1.00 1.70 O ATOM 0 H GLY B 116 -1.395 17.001 18.793 1.00 1.35 H new ATOM 0 HA2 GLY B 116 -2.545 16.305 20.611 1.00 1.48 H new ATOM 0 HA3 GLY B 116 -4.048 16.312 19.709 1.00 1.48 H new ATOM 1444 N GLY B 117 -2.241 14.092 18.514 1.00 1.29 N ATOM 1445 CA GLY B 117 -2.064 12.718 18.299 1.00 1.26 C ATOM 1446 C GLY B 117 -3.280 12.019 17.729 1.00 1.26 C ATOM 1447 O GLY B 117 -3.683 10.954 18.202 1.00 1.38 O ATOM 0 H GLY B 117 -1.796 14.693 17.821 1.00 1.29 H new ATOM 0 HA2 GLY B 117 -1.224 12.573 17.620 1.00 1.26 H new ATOM 0 HA3 GLY B 117 -1.796 12.245 19.244 1.00 1.26 H new ATOM 1451 N LYS B 118 -3.867 12.659 16.714 1.00 1.19 N ATOM 1452 CA LYS B 118 -5.049 12.136 16.025 1.00 1.25 C ATOM 1453 C LYS B 118 -4.655 11.273 14.817 1.00 1.15 C ATOM 1454 O LYS B 118 -5.523 10.756 14.118 1.00 1.25 O ATOM 1455 CB LYS B 118 -6.014 13.248 15.586 1.00 1.30 C ATOM 1456 CG LYS B 118 -5.799 14.591 16.268 1.00 1.36 C ATOM 1457 CD LYS B 118 -7.079 15.126 16.880 1.00 1.78 C ATOM 1458 CE LYS B 118 -7.353 16.549 16.419 1.00 1.95 C ATOM 1459 NZ LYS B 118 -8.691 16.683 15.778 1.00 2.54 N ATOM 0 H LYS B 118 -3.537 13.552 16.348 1.00 1.19 H new ATOM 0 HA LYS B 118 -5.573 11.512 16.749 1.00 1.25 H new ATOM 0 HB2 LYS B 118 -5.921 13.385 14.509 1.00 1.30 H new ATOM 0 HB3 LYS B 118 -7.035 12.919 15.778 1.00 1.30 H new ATOM 0 HG2 LYS B 118 -5.041 14.487 17.045 1.00 1.36 H new ATOM 0 HG3 LYS B 118 -5.416 15.309 15.543 1.00 1.36 H new ATOM 0 HD2 LYS B 118 -7.915 14.483 16.603 1.00 1.78 H new ATOM 0 HD3 LYS B 118 -7.004 15.101 17.967 1.00 1.78 H new ATOM 0 HE2 LYS B 118 -7.291 17.224 17.272 1.00 1.95 H new ATOM 0 HE3 LYS B 118 -6.581 16.856 15.713 1.00 1.95 H new ATOM 0 HZ1 LYS B 118 -8.836 17.669 15.479 1.00 2.54 H new ATOM 0 HZ2 LYS B 118 -8.742 16.059 14.948 1.00 2.54 H new ATOM 0 HZ3 LYS B 118 -9.430 16.416 16.459 1.00 2.54 H new ATOM 1473 N GLY B 119 -3.344 11.159 14.551 1.00 1.04 N ATOM 1474 CA GLY B 119 -2.845 10.373 13.424 1.00 0.97 C ATOM 1475 C GLY B 119 -2.201 9.097 13.921 1.00 0.93 C ATOM 1476 O GLY B 119 -2.452 8.714 15.063 1.00 1.02 O ATOM 0 H GLY B 119 -2.613 11.604 15.106 1.00 1.04 H new ATOM 0 HA2 GLY B 119 -3.665 10.135 12.746 1.00 0.97 H new ATOM 0 HA3 GLY B 119 -2.121 10.957 12.856 1.00 0.97 H new ATOM 1480 N ARG B 120 -1.283 8.469 13.173 1.00 0.87 N ATOM 1481 CA ARG B 120 -0.596 7.277 13.648 1.00 0.87 C ATOM 1482 C ARG B 120 0.788 7.279 12.975 1.00 0.80 C ATOM 1483 O ARG B 120 0.953 7.900 11.917 1.00 0.79 O ATOM 1484 CB ARG B 120 -1.403 6.042 13.257 1.00 0.95 C ATOM 1485 CG ARG B 120 -2.065 5.317 14.419 1.00 1.16 C ATOM 1486 CD ARG B 120 -3.438 4.786 14.021 1.00 1.60 C ATOM 1487 NE ARG B 120 -4.526 5.617 14.541 1.00 1.82 N ATOM 1488 CZ ARG B 120 -5.621 5.943 13.847 1.00 2.25 C ATOM 1489 NH1 ARG B 120 -5.781 5.524 12.597 1.00 2.62 N ATOM 1490 NH2 ARG B 120 -6.560 6.693 14.409 1.00 2.89 N ATOM 0 H ARG B 120 -1.005 8.772 12.240 1.00 0.87 H new ATOM 0 HA ARG B 120 -0.488 7.265 14.733 1.00 0.87 H new ATOM 0 HB2 ARG B 120 -2.174 6.339 12.546 1.00 0.95 H new ATOM 0 HB3 ARG B 120 -0.745 5.344 12.740 1.00 0.95 H new ATOM 0 HG2 ARG B 120 -1.432 4.491 14.745 1.00 1.16 H new ATOM 0 HG3 ARG B 120 -2.165 5.996 15.266 1.00 1.16 H new ATOM 0 HD2 ARG B 120 -3.506 4.740 12.934 1.00 1.60 H new ATOM 0 HD3 ARG B 120 -3.553 3.767 14.391 1.00 1.60 H new ATOM 0 HE ARG B 120 -4.443 5.970 15.494 1.00 1.82 H new ATOM 0 HH11 ARG B 120 -5.064 4.947 12.157 1.00 2.62 H new ATOM 0 HH12 ARG B 120 -6.621 5.779 12.077 1.00 2.62 H new ATOM 0 HH21 ARG B 120 -6.445 7.020 15.369 1.00 2.89 H new ATOM 0 HH22 ARG B 120 -7.396 6.943 13.882 1.00 2.89 H new ATOM 1504 N CYS B 121 1.791 6.643 13.580 1.00 0.82 N ATOM 1505 CA CYS B 121 3.148 6.670 13.009 1.00 0.81 C ATOM 1506 C CYS B 121 3.565 5.343 12.386 1.00 0.85 C ATOM 1507 O CYS B 121 2.997 4.292 12.681 1.00 1.05 O ATOM 1508 CB CYS B 121 4.165 7.058 14.086 1.00 0.91 C ATOM 1509 SG CYS B 121 5.600 7.986 13.455 1.00 1.07 S ATOM 0 H CYS B 121 1.700 6.112 14.446 1.00 0.82 H new ATOM 0 HA CYS B 121 3.129 7.413 12.212 1.00 0.81 H new ATOM 0 HB2 CYS B 121 3.663 7.658 14.845 1.00 0.91 H new ATOM 0 HB3 CYS B 121 4.520 6.153 14.579 1.00 0.91 H new ATOM 1514 N PHE B 122 4.586 5.411 11.523 1.00 0.76 N ATOM 1515 CA PHE B 122 5.106 4.222 10.853 1.00 0.84 C ATOM 1516 C PHE B 122 6.611 4.111 11.075 1.00 0.95 C ATOM 1517 O PHE B 122 7.121 3.052 11.439 1.00 1.44 O ATOM 1518 CB PHE B 122 4.797 4.272 9.355 1.00 0.86 C ATOM 1519 CG PHE B 122 3.334 4.141 9.037 1.00 0.86 C ATOM 1520 CD1 PHE B 122 2.476 5.217 9.198 1.00 1.41 C ATOM 1521 CD2 PHE B 122 2.816 2.940 8.575 1.00 1.42 C ATOM 1522 CE1 PHE B 122 1.131 5.099 8.905 1.00 1.53 C ATOM 1523 CE2 PHE B 122 1.471 2.817 8.281 1.00 1.50 C ATOM 1524 CZ PHE B 122 0.628 3.897 8.446 1.00 1.15 C ATOM 0 H PHE B 122 5.065 6.277 11.275 1.00 0.76 H new ATOM 0 HA PHE B 122 4.620 3.344 11.278 1.00 0.84 H new ATOM 0 HB2 PHE B 122 5.166 5.213 8.948 1.00 0.86 H new ATOM 0 HB3 PHE B 122 5.342 3.472 8.853 1.00 0.86 H new ATOM 0 HD1 PHE B 122 2.863 6.159 9.557 1.00 1.41 H new ATOM 0 HD2 PHE B 122 3.471 2.091 8.444 1.00 1.42 H new ATOM 0 HE1 PHE B 122 0.473 5.946 9.035 1.00 1.53 H new ATOM 0 HE2 PHE B 122 1.080 1.876 7.922 1.00 1.50 H new ATOM 0 HZ PHE B 122 -0.423 3.803 8.217 1.00 1.15 H new ATOM 1534 N GLY B 123 7.310 5.221 10.864 1.00 0.84 N ATOM 1535 CA GLY B 123 8.749 5.252 11.057 1.00 0.89 C ATOM 1536 C GLY B 123 9.146 6.222 12.158 1.00 0.89 C ATOM 1537 O GLY B 123 8.311 6.574 12.992 1.00 0.90 O ATOM 0 H GLY B 123 6.903 6.106 10.561 1.00 0.84 H new ATOM 0 HA2 GLY B 123 9.105 4.252 11.307 1.00 0.89 H new ATOM 0 HA3 GLY B 123 9.235 5.540 10.125 1.00 0.89 H new ATOM 1541 N PRO B 124 10.411 6.688 12.199 1.00 1.02 N ATOM 1542 CA PRO B 124 10.864 7.626 13.219 1.00 1.08 C ATOM 1543 C PRO B 124 10.538 9.070 12.842 1.00 0.96 C ATOM 1544 O PRO B 124 9.688 9.703 13.467 1.00 1.02 O ATOM 1545 CB PRO B 124 12.385 7.403 13.271 1.00 1.33 C ATOM 1546 CG PRO B 124 12.715 6.450 12.156 1.00 1.51 C ATOM 1547 CD PRO B 124 11.498 6.358 11.274 1.00 1.26 C ATOM 0 HA PRO B 124 10.375 7.461 14.179 1.00 1.08 H new ATOM 0 HB2 PRO B 124 12.920 8.345 13.147 1.00 1.33 H new ATOM 0 HB3 PRO B 124 12.684 6.991 14.235 1.00 1.33 H new ATOM 0 HG2 PRO B 124 13.575 6.805 11.589 1.00 1.51 H new ATOM 0 HG3 PRO B 124 12.977 5.469 12.553 1.00 1.51 H new ATOM 0 HD2 PRO B 124 11.548 7.058 10.440 1.00 1.26 H new ATOM 0 HD3 PRO B 124 11.380 5.362 10.848 1.00 1.26 H new ATOM 1555 N SER B 125 11.200 9.581 11.805 1.00 0.97 N ATOM 1556 CA SER B 125 10.950 10.944 11.339 1.00 0.92 C ATOM 1557 C SER B 125 9.843 10.941 10.298 1.00 0.76 C ATOM 1558 O SER B 125 9.816 11.796 9.421 1.00 0.78 O ATOM 1559 CB SER B 125 12.219 11.570 10.726 1.00 1.12 C ATOM 1560 OG SER B 125 12.879 12.404 11.663 1.00 1.25 O ATOM 0 H SER B 125 11.909 9.075 11.274 1.00 0.97 H new ATOM 0 HA SER B 125 10.650 11.540 12.201 1.00 0.92 H new ATOM 0 HB2 SER B 125 12.895 10.781 10.397 1.00 1.12 H new ATOM 0 HB3 SER B 125 11.952 12.150 9.843 1.00 1.12 H new ATOM 0 HG SER B 125 13.681 12.788 11.251 1.00 1.25 H new ATOM 1566 N ILE B 126 8.952 9.954 10.362 1.00 0.70 N ATOM 1567 CA ILE B 126 7.890 9.854 9.389 1.00 0.60 C ATOM 1568 C ILE B 126 6.591 9.325 10.014 1.00 0.57 C ATOM 1569 O ILE B 126 6.494 8.160 10.431 1.00 0.74 O ATOM 1570 CB ILE B 126 8.330 8.981 8.193 1.00 0.60 C ATOM 1571 CG1 ILE B 126 9.795 9.253 7.826 1.00 0.79 C ATOM 1572 CG2 ILE B 126 7.452 9.279 7.012 1.00 0.72 C ATOM 1573 CD1 ILE B 126 10.349 8.309 6.779 1.00 0.85 C ATOM 0 H ILE B 126 8.951 9.223 11.074 1.00 0.70 H new ATOM 0 HA ILE B 126 7.681 10.859 9.022 1.00 0.60 H new ATOM 0 HB ILE B 126 8.235 7.932 8.473 1.00 0.60 H new ATOM 0 HG12 ILE B 126 9.885 10.277 7.462 1.00 0.79 H new ATOM 0 HG13 ILE B 126 10.405 9.180 8.726 1.00 0.79 H new ATOM 0 HG21 ILE B 126 7.760 8.665 6.166 1.00 0.72 H new ATOM 0 HG22 ILE B 126 6.415 9.057 7.264 1.00 0.72 H new ATOM 0 HG23 ILE B 126 7.543 10.333 6.748 1.00 0.72 H new ATOM 0 HD11 ILE B 126 11.388 8.564 6.573 1.00 0.85 H new ATOM 0 HD12 ILE B 126 10.293 7.284 7.147 1.00 0.85 H new ATOM 0 HD13 ILE B 126 9.765 8.398 5.863 1.00 0.85 H new ATOM 1585 N CYS B 127 5.590 10.203 10.066 1.00 0.54 N ATOM 1586 CA CYS B 127 4.281 9.866 10.628 1.00 0.53 C ATOM 1587 C CYS B 127 3.199 10.194 9.610 1.00 0.53 C ATOM 1588 O CYS B 127 3.213 11.263 9.010 1.00 0.56 O ATOM 1589 CB CYS B 127 4.042 10.629 11.934 1.00 0.56 C ATOM 1590 SG CYS B 127 2.823 9.840 13.036 1.00 0.89 S ATOM 0 H CYS B 127 5.661 11.161 9.723 1.00 0.54 H new ATOM 0 HA CYS B 127 4.251 8.800 10.854 1.00 0.53 H new ATOM 0 HB2 CYS B 127 4.989 10.726 12.465 1.00 0.56 H new ATOM 0 HB3 CYS B 127 3.704 11.638 11.698 1.00 0.56 H new ATOM 1595 N CYS B 128 2.295 9.256 9.375 1.00 0.53 N ATOM 1596 CA CYS B 128 1.261 9.444 8.374 1.00 0.56 C ATOM 1597 C CYS B 128 -0.117 8.871 8.744 1.00 0.60 C ATOM 1598 O CYS B 128 -0.238 7.657 8.942 1.00 0.76 O ATOM 1599 CB CYS B 128 1.658 8.771 7.024 1.00 0.63 C ATOM 1600 SG CYS B 128 3.428 8.335 6.805 1.00 1.23 S ATOM 0 H CYS B 128 2.257 8.361 9.862 1.00 0.53 H new ATOM 0 HA CYS B 128 1.179 10.528 8.299 1.00 0.56 H new ATOM 0 HB2 CYS B 128 1.068 7.862 6.911 1.00 0.63 H new ATOM 0 HB3 CYS B 128 1.370 9.440 6.213 1.00 0.63 H new ATOM 1605 N GLY B 129 -1.207 9.706 8.776 1.00 0.60 N ATOM 1606 CA GLY B 129 -2.525 9.194 9.024 1.00 0.65 C ATOM 1607 C GLY B 129 -3.337 9.332 7.743 1.00 0.66 C ATOM 1608 O GLY B 129 -2.778 9.576 6.667 1.00 0.64 O ATOM 0 H GLY B 129 -1.162 10.715 8.631 1.00 0.60 H new ATOM 0 HA2 GLY B 129 -2.475 8.150 9.332 1.00 0.65 H new ATOM 0 HA3 GLY B 129 -3.000 9.744 9.836 1.00 0.65 H new ATOM 1612 N ASP B 130 -4.636 9.180 7.851 1.00 0.72 N ATOM 1613 CA ASP B 130 -5.519 9.224 6.695 1.00 0.76 C ATOM 1614 C ASP B 130 -5.573 10.566 6.014 1.00 0.77 C ATOM 1615 O ASP B 130 -5.331 10.667 4.809 1.00 0.81 O ATOM 1616 CB ASP B 130 -6.923 8.791 7.106 1.00 0.84 C ATOM 1617 CG ASP B 130 -7.768 8.358 5.925 1.00 1.47 C ATOM 1618 OD1 ASP B 130 -8.364 9.237 5.268 1.00 1.96 O ATOM 1619 OD2 ASP B 130 -7.833 7.140 5.655 1.00 2.35 O ATOM 0 H ASP B 130 -5.116 9.022 8.737 1.00 0.72 H new ATOM 0 HA ASP B 130 -5.101 8.533 5.963 1.00 0.76 H new ATOM 0 HB2 ASP B 130 -6.852 7.969 7.818 1.00 0.84 H new ATOM 0 HB3 ASP B 130 -7.418 9.615 7.619 1.00 0.84 H new ATOM 1624 N GLU B 131 -5.958 11.570 6.742 1.00 0.79 N ATOM 1625 CA GLU B 131 -6.109 12.897 6.175 1.00 0.85 C ATOM 1626 C GLU B 131 -5.203 13.861 6.882 1.00 0.89 C ATOM 1627 O GLU B 131 -5.311 15.077 6.729 1.00 1.03 O ATOM 1628 CB GLU B 131 -7.544 13.423 6.433 1.00 0.93 C ATOM 1629 CG GLU B 131 -8.454 12.554 7.310 1.00 1.02 C ATOM 1630 CD GLU B 131 -9.924 12.910 7.161 1.00 1.16 C ATOM 1631 OE1 GLU B 131 -10.389 13.829 7.871 1.00 1.69 O ATOM 1632 OE2 GLU B 131 -10.610 12.273 6.336 1.00 1.63 O ATOM 0 H GLU B 131 -6.177 11.506 7.736 1.00 0.79 H new ATOM 0 HA GLU B 131 -5.884 12.827 5.111 1.00 0.85 H new ATOM 0 HB2 GLU B 131 -7.467 14.407 6.895 1.00 0.93 H new ATOM 0 HB3 GLU B 131 -8.033 13.561 5.469 1.00 0.93 H new ATOM 0 HG2 GLU B 131 -8.310 11.505 7.049 1.00 1.02 H new ATOM 0 HG3 GLU B 131 -8.161 12.666 8.354 1.00 1.02 H new ATOM 1639 N LEU B 132 -4.204 13.303 7.485 1.00 0.83 N ATOM 1640 CA LEU B 132 -3.186 14.012 8.128 1.00 0.89 C ATOM 1641 C LEU B 132 -1.948 13.693 7.309 1.00 0.83 C ATOM 1642 O LEU B 132 -0.932 14.385 7.377 1.00 0.91 O ATOM 1643 CB LEU B 132 -3.088 13.471 9.544 1.00 0.93 C ATOM 1644 CG LEU B 132 -3.280 14.488 10.669 1.00 1.16 C ATOM 1645 CD1 LEU B 132 -3.494 13.782 12.004 1.00 1.25 C ATOM 1646 CD2 LEU B 132 -2.097 15.440 10.749 1.00 1.38 C ATOM 0 H LEU B 132 -4.085 12.291 7.536 1.00 0.83 H new ATOM 0 HA LEU B 132 -3.338 15.089 8.196 1.00 0.89 H new ATOM 0 HB2 LEU B 132 -3.833 12.684 9.663 1.00 0.93 H new ATOM 0 HB3 LEU B 132 -2.110 13.005 9.666 1.00 0.93 H new ATOM 0 HG LEU B 132 -4.171 15.074 10.445 1.00 1.16 H new ATOM 0 HD11 LEU B 132 -3.628 14.524 12.791 1.00 1.25 H new ATOM 0 HD12 LEU B 132 -4.381 13.152 11.944 1.00 1.25 H new ATOM 0 HD13 LEU B 132 -2.625 13.165 12.232 1.00 1.25 H new ATOM 0 HD21 LEU B 132 -2.258 16.153 11.557 1.00 1.38 H new ATOM 0 HD22 LEU B 132 -1.186 14.873 10.942 1.00 1.38 H new ATOM 0 HD23 LEU B 132 -1.997 15.977 9.806 1.00 1.38 H new ATOM 1658 N GLY B 133 -2.115 12.674 6.435 1.00 0.72 N ATOM 1659 CA GLY B 133 -1.134 12.302 5.517 1.00 0.70 C ATOM 1660 C GLY B 133 0.154 11.934 6.161 1.00 0.66 C ATOM 1661 O GLY B 133 0.110 11.156 7.068 1.00 0.65 O ATOM 0 H GLY B 133 -2.963 12.110 6.385 1.00 0.72 H new ATOM 0 HA2 GLY B 133 -1.495 11.457 4.930 1.00 0.70 H new ATOM 0 HA3 GLY B 133 -0.964 13.124 4.822 1.00 0.70 H new ATOM 1665 N CYS B 134 1.283 12.481 5.730 1.00 0.69 N ATOM 1666 CA CYS B 134 2.554 12.118 6.355 1.00 0.68 C ATOM 1667 C CYS B 134 3.456 13.285 6.605 1.00 0.64 C ATOM 1668 O CYS B 134 3.859 13.957 5.671 1.00 0.62 O ATOM 1669 CB CYS B 134 3.340 11.125 5.510 1.00 0.72 C ATOM 1670 SG CYS B 134 4.433 10.075 6.513 1.00 1.08 S ATOM 0 H CYS B 134 1.349 13.160 4.971 1.00 0.69 H new ATOM 0 HA CYS B 134 2.262 11.678 7.309 1.00 0.68 H new ATOM 0 HB2 CYS B 134 2.645 10.495 4.954 1.00 0.72 H new ATOM 0 HB3 CYS B 134 3.935 11.668 4.776 1.00 0.72 H new ATOM 1675 N PHE B 135 3.844 13.467 7.861 1.00 0.67 N ATOM 1676 CA PHE B 135 4.788 14.494 8.174 1.00 0.66 C ATOM 1677 C PHE B 135 6.090 13.765 8.249 1.00 0.64 C ATOM 1678 O PHE B 135 6.402 13.126 9.256 1.00 0.64 O ATOM 1679 CB PHE B 135 4.499 15.212 9.514 1.00 0.70 C ATOM 1680 CG PHE B 135 3.162 14.910 10.139 1.00 0.72 C ATOM 1681 CD1 PHE B 135 1.990 15.094 9.426 1.00 0.96 C ATOM 1682 CD2 PHE B 135 3.084 14.443 11.442 1.00 1.15 C ATOM 1683 CE1 PHE B 135 0.763 14.819 9.999 1.00 1.19 C ATOM 1684 CE2 PHE B 135 1.860 14.164 12.021 1.00 1.36 C ATOM 1685 CZ PHE B 135 0.698 14.353 11.298 1.00 1.23 C ATOM 0 H PHE B 135 3.517 12.919 8.657 1.00 0.67 H new ATOM 0 HA PHE B 135 4.762 15.288 7.428 1.00 0.66 H new ATOM 0 HB2 PHE B 135 5.281 14.945 10.225 1.00 0.70 H new ATOM 0 HB3 PHE B 135 4.570 16.288 9.352 1.00 0.70 H new ATOM 0 HD1 PHE B 135 2.035 15.457 8.410 1.00 0.96 H new ATOM 0 HD2 PHE B 135 3.990 14.295 12.011 1.00 1.15 H new ATOM 0 HE1 PHE B 135 -0.144 14.968 9.432 1.00 1.19 H new ATOM 0 HE2 PHE B 135 1.812 13.799 13.036 1.00 1.36 H new ATOM 0 HZ PHE B 135 -0.260 14.137 11.748 1.00 1.23 H new ATOM 1695 N VAL B 136 6.850 13.860 7.184 1.00 0.66 N ATOM 1696 CA VAL B 136 8.118 13.197 7.137 1.00 0.68 C ATOM 1697 C VAL B 136 9.154 14.183 7.631 1.00 0.71 C ATOM 1698 O VAL B 136 9.826 14.895 6.877 1.00 0.74 O ATOM 1699 CB VAL B 136 8.447 12.630 5.721 1.00 0.73 C ATOM 1700 CG1 VAL B 136 9.467 11.506 5.829 1.00 0.75 C ATOM 1701 CG2 VAL B 136 7.168 12.133 5.008 1.00 0.74 C ATOM 0 H VAL B 136 6.609 14.389 6.346 1.00 0.66 H new ATOM 0 HA VAL B 136 8.106 12.316 7.779 1.00 0.68 H new ATOM 0 HB VAL B 136 8.872 13.436 5.123 1.00 0.73 H new ATOM 0 HG11 VAL B 136 9.688 11.119 4.834 1.00 0.75 H new ATOM 0 HG12 VAL B 136 10.382 11.887 6.282 1.00 0.75 H new ATOM 0 HG13 VAL B 136 9.062 10.706 6.448 1.00 0.75 H new ATOM 0 HG21 VAL B 136 7.428 11.744 4.024 1.00 0.74 H new ATOM 0 HG22 VAL B 136 6.705 11.343 5.600 1.00 0.74 H new ATOM 0 HG23 VAL B 136 6.468 12.961 4.897 1.00 0.74 H new ATOM 1711 N GLY B 137 9.230 14.216 8.948 1.00 0.72 N ATOM 1712 CA GLY B 137 10.155 15.109 9.637 1.00 0.76 C ATOM 1713 C GLY B 137 9.497 16.372 10.182 1.00 0.73 C ATOM 1714 O GLY B 137 9.517 17.419 9.535 1.00 0.83 O ATOM 0 H GLY B 137 8.663 13.636 9.567 1.00 0.72 H new ATOM 0 HA2 GLY B 137 10.622 14.569 10.461 1.00 0.76 H new ATOM 0 HA3 GLY B 137 10.952 15.393 8.950 1.00 0.76 H new ATOM 1718 N THR B 138 8.933 16.271 11.385 1.00 0.69 N ATOM 1719 CA THR B 138 8.277 17.404 12.051 1.00 0.70 C ATOM 1720 C THR B 138 8.242 17.141 13.554 1.00 0.73 C ATOM 1721 O THR B 138 8.419 15.993 13.969 1.00 0.77 O ATOM 1722 CB THR B 138 6.867 17.607 11.498 1.00 0.73 C ATOM 1723 OG1 THR B 138 6.062 16.471 11.746 1.00 0.78 O ATOM 1724 CG2 THR B 138 6.844 17.870 10.007 1.00 0.77 C ATOM 0 H THR B 138 8.916 15.407 11.926 1.00 0.69 H new ATOM 0 HA THR B 138 8.839 18.318 11.860 1.00 0.70 H new ATOM 0 HB THR B 138 6.477 18.485 12.013 1.00 0.73 H new ATOM 0 HG1 THR B 138 5.117 16.714 11.656 1.00 0.78 H new ATOM 0 HG21 THR B 138 5.814 18.005 9.677 1.00 0.77 H new ATOM 0 HG22 THR B 138 7.417 18.771 9.788 1.00 0.77 H new ATOM 0 HG23 THR B 138 7.285 17.023 9.481 1.00 0.77 H new ATOM 1732 N ALA B 139 7.940 18.147 14.390 1.00 0.79 N ATOM 1733 CA ALA B 139 7.853 17.925 15.836 1.00 0.88 C ATOM 1734 C ALA B 139 6.647 17.054 16.173 1.00 0.83 C ATOM 1735 O ALA B 139 6.631 16.338 17.172 1.00 0.87 O ATOM 1736 CB ALA B 139 7.743 19.265 16.555 1.00 1.04 C ATOM 0 H ALA B 139 7.755 19.105 14.093 1.00 0.79 H new ATOM 0 HA ALA B 139 8.755 17.409 16.166 1.00 0.88 H new ATOM 0 HB1 ALA B 139 7.678 19.097 17.630 1.00 1.04 H new ATOM 0 HB2 ALA B 139 8.623 19.870 16.334 1.00 1.04 H new ATOM 0 HB3 ALA B 139 6.849 19.788 16.215 1.00 1.04 H new ATOM 1742 N GLU B 140 5.674 17.091 15.279 1.00 0.79 N ATOM 1743 CA GLU B 140 4.472 16.273 15.408 1.00 0.79 C ATOM 1744 C GLU B 140 4.831 14.783 15.257 1.00 0.73 C ATOM 1745 O GLU B 140 4.032 13.903 15.575 1.00 0.79 O ATOM 1746 CB GLU B 140 3.422 16.679 14.374 1.00 0.83 C ATOM 1747 CG GLU B 140 2.955 18.119 14.520 1.00 1.27 C ATOM 1748 CD GLU B 140 1.620 18.233 15.229 1.00 1.55 C ATOM 1749 OE1 GLU B 140 1.591 18.093 16.470 1.00 1.90 O ATOM 1750 OE2 GLU B 140 0.602 18.465 14.544 1.00 2.31 O ATOM 0 H GLU B 140 5.690 17.683 14.448 1.00 0.79 H new ATOM 0 HA GLU B 140 4.048 16.435 16.399 1.00 0.79 H new ATOM 0 HB2 GLU B 140 3.834 16.538 13.375 1.00 0.83 H new ATOM 0 HB3 GLU B 140 2.562 16.015 14.461 1.00 0.83 H new ATOM 0 HG2 GLU B 140 3.705 18.685 15.073 1.00 1.27 H new ATOM 0 HG3 GLU B 140 2.877 18.573 13.532 1.00 1.27 H new ATOM 1757 N ALA B 141 6.061 14.525 14.802 1.00 0.69 N ATOM 1758 CA ALA B 141 6.585 13.194 14.621 1.00 0.70 C ATOM 1759 C ALA B 141 7.531 12.861 15.757 1.00 0.77 C ATOM 1760 O ALA B 141 7.779 11.707 16.028 1.00 0.87 O ATOM 1761 CB ALA B 141 7.310 13.087 13.288 1.00 0.75 C ATOM 0 H ALA B 141 6.722 15.259 14.548 1.00 0.69 H new ATOM 0 HA ALA B 141 5.758 12.484 14.622 1.00 0.70 H new ATOM 0 HB1 ALA B 141 7.700 12.076 13.166 1.00 0.75 H new ATOM 0 HB2 ALA B 141 6.616 13.308 12.477 1.00 0.75 H new ATOM 0 HB3 ALA B 141 8.135 13.799 13.264 1.00 0.75 H new ATOM 1767 N LEU B 142 8.075 13.900 16.406 1.00 0.80 N ATOM 1768 CA LEU B 142 9.014 13.732 17.522 1.00 0.93 C ATOM 1769 C LEU B 142 8.539 12.666 18.510 1.00 1.06 C ATOM 1770 O LEU B 142 9.336 11.888 19.036 1.00 1.24 O ATOM 1771 CB LEU B 142 9.188 15.051 18.269 1.00 0.97 C ATOM 1772 CG LEU B 142 10.129 16.063 17.608 1.00 1.01 C ATOM 1773 CD1 LEU B 142 9.880 17.461 18.155 1.00 1.11 C ATOM 1774 CD2 LEU B 142 11.581 15.660 17.818 1.00 1.14 C ATOM 0 H LEU B 142 7.878 14.873 16.174 1.00 0.80 H new ATOM 0 HA LEU B 142 9.964 13.412 17.095 1.00 0.93 H new ATOM 0 HB2 LEU B 142 8.208 15.514 18.386 1.00 0.97 H new ATOM 0 HB3 LEU B 142 9.560 14.835 19.271 1.00 0.97 H new ATOM 0 HG LEU B 142 9.926 16.071 16.537 1.00 1.01 H new ATOM 0 HD11 LEU B 142 10.558 18.166 17.674 1.00 1.11 H new ATOM 0 HD12 LEU B 142 8.849 17.753 17.953 1.00 1.11 H new ATOM 0 HD13 LEU B 142 10.054 17.467 19.231 1.00 1.11 H new ATOM 0 HD21 LEU B 142 12.234 16.391 17.341 1.00 1.14 H new ATOM 0 HD22 LEU B 142 11.797 15.622 18.886 1.00 1.14 H new ATOM 0 HD23 LEU B 142 11.753 14.678 17.378 1.00 1.14 H new ATOM 1786 N ARG B 143 7.233 12.632 18.748 1.00 1.06 N ATOM 1787 CA ARG B 143 6.664 11.655 19.657 1.00 1.26 C ATOM 1788 C ARG B 143 6.709 10.267 19.028 1.00 1.27 C ATOM 1789 O ARG B 143 6.400 9.264 19.702 1.00 1.49 O ATOM 1790 CB ARG B 143 5.213 12.066 20.059 1.00 1.35 C ATOM 1791 CG ARG B 143 4.063 11.273 19.414 1.00 1.36 C ATOM 1792 CD ARG B 143 3.746 10.009 20.204 1.00 1.50 C ATOM 1793 NE ARG B 143 3.209 10.313 21.531 1.00 1.90 N ATOM 1794 CZ ARG B 143 3.779 9.931 22.676 1.00 2.20 C ATOM 1795 NH1 ARG B 143 4.898 9.215 22.669 1.00 2.36 N ATOM 1796 NH2 ARG B 143 3.225 10.266 23.832 1.00 2.93 N ATOM 0 H ARG B 143 6.555 13.267 18.326 1.00 1.06 H new ATOM 0 HA ARG B 143 7.258 11.624 20.571 1.00 1.26 H new ATOM 0 HB2 ARG B 143 5.122 11.976 21.141 1.00 1.35 H new ATOM 0 HB3 ARG B 143 5.078 13.120 19.814 1.00 1.35 H new ATOM 0 HG2 ARG B 143 3.174 11.901 19.357 1.00 1.36 H new ATOM 0 HG3 ARG B 143 4.331 11.007 18.392 1.00 1.36 H new ATOM 0 HD2 ARG B 143 3.026 9.407 19.651 1.00 1.50 H new ATOM 0 HD3 ARG B 143 4.650 9.409 20.307 1.00 1.50 H new ATOM 0 HE ARG B 143 2.344 10.851 21.584 1.00 1.90 H new ATOM 0 HH11 ARG B 143 5.330 8.952 21.783 1.00 2.36 H new ATOM 0 HH12 ARG B 143 5.325 8.928 23.550 1.00 2.36 H new ATOM 0 HH21 ARG B 143 2.365 10.814 23.845 1.00 2.93 H new ATOM 0 HH22 ARG B 143 3.658 9.975 24.708 1.00 2.93 H new ATOM 1810 N CYS B 144 7.208 10.136 17.790 1.00 1.10 N ATOM 1811 CA CYS B 144 7.348 8.824 17.176 1.00 1.17 C ATOM 1812 C CYS B 144 8.634 8.152 17.659 1.00 1.44 C ATOM 1813 O CYS B 144 8.877 6.980 17.381 1.00 1.61 O ATOM 1814 CB CYS B 144 7.434 8.995 15.648 1.00 1.05 C ATOM 1815 SG CYS B 144 5.867 9.449 14.837 1.00 1.26 S ATOM 0 H CYS B 144 7.515 10.915 17.208 1.00 1.10 H new ATOM 0 HA CYS B 144 6.490 8.210 17.449 1.00 1.17 H new ATOM 0 HB2 CYS B 144 8.177 9.760 15.424 1.00 1.05 H new ATOM 0 HB3 CYS B 144 7.795 8.063 15.213 1.00 1.05 H new ATOM 1820 N GLN B 145 9.422 8.902 18.429 1.00 1.58 N ATOM 1821 CA GLN B 145 10.663 8.389 18.991 1.00 1.89 C ATOM 1822 C GLN B 145 10.375 7.195 19.896 1.00 2.14 C ATOM 1823 O GLN B 145 11.270 6.397 20.199 1.00 2.40 O ATOM 1824 CB GLN B 145 11.407 9.480 19.765 1.00 2.00 C ATOM 1825 CG GLN B 145 12.901 9.515 19.477 1.00 2.43 C ATOM 1826 CD GLN B 145 13.257 10.460 18.345 1.00 2.77 C ATOM 1827 OE1 GLN B 145 13.507 11.645 18.565 1.00 3.35 O ATOM 1828 NE2 GLN B 145 13.285 9.939 17.124 1.00 3.05 N ATOM 0 H GLN B 145 9.218 9.870 18.676 1.00 1.58 H new ATOM 0 HA GLN B 145 11.302 8.064 18.170 1.00 1.89 H new ATOM 0 HB2 GLN B 145 10.974 10.449 19.518 1.00 2.00 H new ATOM 0 HB3 GLN B 145 11.254 9.326 20.833 1.00 2.00 H new ATOM 0 HG2 GLN B 145 13.434 9.818 20.379 1.00 2.43 H new ATOM 0 HG3 GLN B 145 13.242 8.510 19.227 1.00 2.43 H new ATOM 0 HE21 GLN B 145 13.071 8.951 16.986 1.00 3.05 H new ATOM 0 HE22 GLN B 145 13.520 10.526 16.324 1.00 3.05 H new ATOM 1837 N GLU B 146 9.109 7.042 20.296 1.00 2.12 N ATOM 1838 CA GLU B 146 8.741 5.916 21.143 1.00 2.41 C ATOM 1839 C GLU B 146 8.470 4.678 20.289 1.00 2.40 C ATOM 1840 O GLU B 146 8.095 3.621 20.802 1.00 2.57 O ATOM 1841 CB GLU B 146 7.507 6.260 21.979 1.00 2.47 C ATOM 1842 CG GLU B 146 7.370 5.419 23.238 1.00 2.88 C ATOM 1843 CD GLU B 146 5.996 5.532 23.867 1.00 3.26 C ATOM 1844 OE1 GLU B 146 5.048 4.915 23.336 1.00 3.76 O ATOM 1845 OE2 GLU B 146 5.866 6.237 24.889 1.00 3.59 O ATOM 0 H GLU B 146 8.343 7.669 20.052 1.00 2.12 H new ATOM 0 HA GLU B 146 9.571 5.703 21.817 1.00 2.41 H new ATOM 0 HB2 GLU B 146 7.550 7.313 22.258 1.00 2.47 H new ATOM 0 HB3 GLU B 146 6.615 6.129 21.366 1.00 2.47 H new ATOM 0 HG2 GLU B 146 7.570 4.375 22.997 1.00 2.88 H new ATOM 0 HG3 GLU B 146 8.124 5.729 23.962 1.00 2.88 H new ATOM 1852 N GLU B 147 8.727 4.798 18.986 1.00 2.27 N ATOM 1853 CA GLU B 147 8.557 3.682 18.073 1.00 2.36 C ATOM 1854 C GLU B 147 9.794 2.784 18.113 1.00 2.40 C ATOM 1855 O GLU B 147 9.838 1.744 17.457 1.00 2.48 O ATOM 1856 CB GLU B 147 8.322 4.194 16.649 1.00 2.40 C ATOM 1857 CG GLU B 147 7.580 3.209 15.760 1.00 2.97 C ATOM 1858 CD GLU B 147 7.521 3.663 14.315 1.00 3.47 C ATOM 1859 OE1 GLU B 147 8.490 3.406 13.571 1.00 3.71 O ATOM 1860 OE2 GLU B 147 6.505 4.278 13.926 1.00 4.01 O ATOM 0 H GLU B 147 9.053 5.658 18.546 1.00 2.27 H new ATOM 0 HA GLU B 147 7.688 3.102 18.382 1.00 2.36 H new ATOM 0 HB2 GLU B 147 7.757 5.125 16.696 1.00 2.40 H new ATOM 0 HB3 GLU B 147 9.284 4.428 16.193 1.00 2.40 H new ATOM 0 HG2 GLU B 147 8.070 2.237 15.812 1.00 2.97 H new ATOM 0 HG3 GLU B 147 6.566 3.076 16.138 1.00 2.97 H new ATOM 1867 N ASN B 148 10.783 3.174 18.926 1.00 2.59 N ATOM 1868 CA ASN B 148 11.990 2.380 19.089 1.00 3.03 C ATOM 1869 C ASN B 148 11.675 1.148 19.936 1.00 3.37 C ATOM 1870 O ASN B 148 12.314 0.105 19.801 1.00 3.85 O ATOM 1871 CB ASN B 148 13.093 3.209 19.750 1.00 3.19 C ATOM 1872 CG ASN B 148 14.015 3.861 18.738 1.00 3.48 C ATOM 1873 OD1 ASN B 148 14.054 3.466 17.572 1.00 3.92 O ATOM 1874 ND2 ASN B 148 14.762 4.868 19.178 1.00 3.79 N ATOM 0 H ASN B 148 10.764 4.033 19.476 1.00 2.59 H new ATOM 0 HA ASN B 148 12.344 2.064 18.108 1.00 3.03 H new ATOM 0 HB2 ASN B 148 12.640 3.980 20.373 1.00 3.19 H new ATOM 0 HB3 ASN B 148 13.678 2.569 20.410 1.00 3.19 H new ATOM 0 HD21 ASN B 148 15.399 5.346 18.541 1.00 3.79 H new ATOM 0 HD22 ASN B 148 14.698 5.163 20.152 1.00 3.79 H new ATOM 1881 N TYR B 149 10.668 1.282 20.803 1.00 3.23 N ATOM 1882 CA TYR B 149 10.241 0.190 21.669 1.00 3.61 C ATOM 1883 C TYR B 149 8.783 -0.166 21.371 1.00 3.72 C ATOM 1884 O TYR B 149 7.989 -0.400 22.282 1.00 4.14 O ATOM 1885 CB TYR B 149 10.400 0.595 23.139 1.00 3.69 C ATOM 1886 CG TYR B 149 11.191 -0.392 23.972 1.00 4.04 C ATOM 1887 CD1 TYR B 149 12.581 -0.406 23.939 1.00 4.26 C ATOM 1888 CD2 TYR B 149 10.546 -1.305 24.798 1.00 4.59 C ATOM 1889 CE1 TYR B 149 13.304 -1.302 24.706 1.00 4.76 C ATOM 1890 CE2 TYR B 149 11.262 -2.204 25.566 1.00 5.11 C ATOM 1891 CZ TYR B 149 12.639 -2.198 25.516 1.00 5.09 C ATOM 1892 OH TYR B 149 13.355 -3.091 26.281 1.00 5.73 O ATOM 0 H TYR B 149 10.133 2.143 20.921 1.00 3.23 H new ATOM 0 HA TYR B 149 10.864 -0.684 21.479 1.00 3.61 H new ATOM 0 HB2 TYR B 149 10.890 1.568 23.185 1.00 3.69 H new ATOM 0 HB3 TYR B 149 9.411 0.715 23.580 1.00 3.69 H new ATOM 0 HD1 TYR B 149 13.105 0.294 23.304 1.00 4.26 H new ATOM 0 HD2 TYR B 149 9.467 -1.312 24.840 1.00 4.59 H new ATOM 0 HE1 TYR B 149 14.383 -1.300 24.671 1.00 4.76 H new ATOM 0 HE2 TYR B 149 10.745 -2.907 26.202 1.00 5.11 H new ATOM 0 HH TYR B 149 12.736 -3.651 26.795 1.00 5.73 H new ATOM 1902 N LEU B 150 8.441 -0.184 20.083 1.00 3.60 N ATOM 1903 CA LEU B 150 7.078 -0.486 19.647 1.00 3.76 C ATOM 1904 C LEU B 150 7.045 -1.667 18.669 1.00 3.71 C ATOM 1905 O LEU B 150 7.916 -1.788 17.808 1.00 3.86 O ATOM 1906 CB LEU B 150 6.459 0.747 18.986 1.00 4.10 C ATOM 1907 CG LEU B 150 5.220 1.306 19.683 1.00 4.74 C ATOM 1908 CD1 LEU B 150 5.598 1.952 21.007 1.00 4.91 C ATOM 1909 CD2 LEU B 150 4.511 2.306 18.782 1.00 5.46 C ATOM 0 H LEU B 150 9.092 0.008 19.321 1.00 3.60 H new ATOM 0 HA LEU B 150 6.500 -0.763 20.529 1.00 3.76 H new ATOM 0 HB2 LEU B 150 7.214 1.531 18.938 1.00 4.10 H new ATOM 0 HB3 LEU B 150 6.196 0.495 17.959 1.00 4.10 H new ATOM 0 HG LEU B 150 4.537 0.482 19.888 1.00 4.74 H new ATOM 0 HD11 LEU B 150 4.703 2.345 21.489 1.00 4.91 H new ATOM 0 HD12 LEU B 150 6.063 1.209 21.655 1.00 4.91 H new ATOM 0 HD13 LEU B 150 6.300 2.766 20.827 1.00 4.91 H new ATOM 0 HD21 LEU B 150 3.630 2.695 19.293 1.00 5.46 H new ATOM 0 HD22 LEU B 150 5.187 3.128 18.548 1.00 5.46 H new ATOM 0 HD23 LEU B 150 4.207 1.812 17.859 1.00 5.46 H new ATOM 1921 N PRO B 151 6.038 -2.567 18.791 1.00 3.97 N ATOM 1922 CA PRO B 151 5.908 -3.740 17.917 1.00 4.33 C ATOM 1923 C PRO B 151 5.368 -3.392 16.524 1.00 4.40 C ATOM 1924 O PRO B 151 4.423 -4.016 16.039 1.00 4.80 O ATOM 1925 CB PRO B 151 4.918 -4.652 18.667 1.00 4.97 C ATOM 1926 CG PRO B 151 4.666 -3.991 19.985 1.00 5.02 C ATOM 1927 CD PRO B 151 4.955 -2.533 19.782 1.00 4.41 C ATOM 0 HA PRO B 151 6.877 -4.204 17.731 1.00 4.33 H new ATOM 0 HB2 PRO B 151 3.991 -4.767 18.105 1.00 4.97 H new ATOM 0 HB3 PRO B 151 5.334 -5.650 18.804 1.00 4.97 H new ATOM 0 HG2 PRO B 151 3.636 -4.143 20.306 1.00 5.02 H new ATOM 0 HG3 PRO B 151 5.307 -4.411 20.760 1.00 5.02 H new ATOM 0 HD2 PRO B 151 4.083 -1.992 19.414 1.00 4.41 H new ATOM 0 HD3 PRO B 151 5.265 -2.047 20.707 1.00 4.41 H new ATOM 1935 N SER B 152 5.987 -2.400 15.883 1.00 4.26 N ATOM 1936 CA SER B 152 5.599 -1.958 14.534 1.00 4.43 C ATOM 1937 C SER B 152 4.259 -1.203 14.527 1.00 3.85 C ATOM 1938 O SER B 152 3.571 -1.137 15.546 1.00 3.52 O ATOM 1939 CB SER B 152 5.556 -3.140 13.556 1.00 4.91 C ATOM 1940 OG SER B 152 4.290 -3.774 13.561 1.00 5.73 O ATOM 0 H SER B 152 6.769 -1.879 16.279 1.00 4.26 H new ATOM 0 HA SER B 152 6.366 -1.258 14.202 1.00 4.43 H new ATOM 0 HB2 SER B 152 5.784 -2.789 12.550 1.00 4.91 H new ATOM 0 HB3 SER B 152 6.327 -3.863 13.824 1.00 4.91 H new ATOM 0 HG SER B 152 4.209 -4.337 14.359 1.00 5.73 H new ATOM 1946 N PRO B 153 3.888 -0.587 13.372 1.00 4.04 N ATOM 1947 CA PRO B 153 2.648 0.203 13.235 1.00 3.79 C ATOM 1948 C PRO B 153 1.356 -0.548 13.569 1.00 2.92 C ATOM 1949 O PRO B 153 1.371 -1.676 14.063 1.00 3.04 O ATOM 1950 CB PRO B 153 2.636 0.623 11.758 1.00 4.60 C ATOM 1951 CG PRO B 153 3.624 -0.265 11.083 1.00 5.10 C ATOM 1952 CD PRO B 153 4.664 -0.575 12.115 1.00 4.86 C ATOM 0 HA PRO B 153 2.661 1.027 13.948 1.00 3.79 H new ATOM 0 HB2 PRO B 153 1.643 0.506 11.325 1.00 4.60 H new ATOM 0 HB3 PRO B 153 2.911 1.672 11.646 1.00 4.60 H new ATOM 0 HG2 PRO B 153 3.148 -1.176 10.721 1.00 5.10 H new ATOM 0 HG3 PRO B 153 4.066 0.228 10.218 1.00 5.10 H new ATOM 0 HD2 PRO B 153 5.145 -1.535 11.928 1.00 4.86 H new ATOM 0 HD3 PRO B 153 5.452 0.178 12.134 1.00 4.86 H new ATOM 1960 N CYS B 154 0.239 0.135 13.298 1.00 2.52 N ATOM 1961 CA CYS B 154 -1.113 -0.371 13.553 1.00 1.97 C ATOM 1962 C CYS B 154 -1.909 -0.452 12.235 1.00 2.15 C ATOM 1963 O CYS B 154 -2.159 0.573 11.605 1.00 2.65 O ATOM 1964 CB CYS B 154 -1.803 0.604 14.526 1.00 2.30 C ATOM 1965 SG CYS B 154 -2.985 -0.133 15.706 1.00 2.68 S ATOM 0 H CYS B 154 0.249 1.069 12.889 1.00 2.52 H new ATOM 0 HA CYS B 154 -1.068 -1.372 13.983 1.00 1.97 H new ATOM 0 HB2 CYS B 154 -1.032 1.124 15.094 1.00 2.30 H new ATOM 0 HB3 CYS B 154 -2.329 1.357 13.940 1.00 2.30 H new ATOM 1970 N GLN B 155 -2.305 -1.660 11.817 1.00 2.16 N ATOM 1971 CA GLN B 155 -3.072 -1.831 10.565 1.00 2.64 C ATOM 1972 C GLN B 155 -2.230 -1.471 9.334 1.00 2.19 C ATOM 1973 O GLN B 155 -1.004 -1.373 9.434 1.00 2.43 O ATOM 1974 CB GLN B 155 -4.352 -0.992 10.590 1.00 3.40 C ATOM 1975 CG GLN B 155 -5.525 -1.661 9.889 1.00 4.33 C ATOM 1976 CD GLN B 155 -6.585 -0.671 9.451 1.00 5.12 C ATOM 1977 OE1 GLN B 155 -6.279 0.465 9.087 1.00 5.61 O ATOM 1978 NE2 GLN B 155 -7.843 -1.098 9.482 1.00 5.63 N ATOM 0 H GLN B 155 -2.113 -2.528 12.317 1.00 2.16 H new ATOM 0 HA GLN B 155 -3.343 -2.884 10.494 1.00 2.64 H new ATOM 0 HB2 GLN B 155 -4.625 -0.789 11.626 1.00 3.40 H new ATOM 0 HB3 GLN B 155 -4.156 -0.030 10.117 1.00 3.40 H new ATOM 0 HG2 GLN B 155 -5.160 -2.206 9.018 1.00 4.33 H new ATOM 0 HG3 GLN B 155 -5.973 -2.395 10.559 1.00 4.33 H new ATOM 0 HE21 GLN B 155 -8.052 -2.048 9.791 1.00 5.63 H new ATOM 0 HE22 GLN B 155 -8.600 -0.476 9.197 1.00 5.63 H new ATOM 1987 N SER B 156 -2.877 -1.291 8.162 1.00 2.21 N ATOM 1988 CA SER B 156 -2.123 -0.983 6.954 1.00 2.03 C ATOM 1989 C SER B 156 -2.800 -0.071 5.935 1.00 1.77 C ATOM 1990 O SER B 156 -2.147 0.872 5.489 1.00 2.17 O ATOM 1991 CB SER B 156 -1.767 -2.277 6.213 1.00 2.58 C ATOM 1992 OG SER B 156 -0.596 -2.120 5.427 1.00 3.11 O ATOM 0 H SER B 156 -3.888 -1.353 8.039 1.00 2.21 H new ATOM 0 HA SER B 156 -1.258 -0.440 7.336 1.00 2.03 H new ATOM 0 HB2 SER B 156 -1.618 -3.081 6.934 1.00 2.58 H new ATOM 0 HB3 SER B 156 -2.599 -2.572 5.574 1.00 2.58 H new ATOM 0 HG SER B 156 -0.563 -1.209 5.067 1.00 3.11 H new ATOM 1998 N GLY B 157 -4.119 -0.116 5.724 1.00 1.55 N ATOM 1999 CA GLY B 157 -4.771 0.843 4.864 1.00 1.82 C ATOM 2000 C GLY B 157 -4.631 0.526 3.415 1.00 1.65 C ATOM 2001 O GLY B 157 -5.119 -0.495 2.918 1.00 2.07 O ATOM 0 H GLY B 157 -4.743 -0.807 6.140 1.00 1.55 H new ATOM 0 HA2 GLY B 157 -5.830 0.888 5.118 1.00 1.82 H new ATOM 0 HA3 GLY B 157 -4.355 1.833 5.054 1.00 1.82 H new ATOM 2005 N GLN B 158 -3.918 1.395 2.752 1.00 1.33 N ATOM 2006 CA GLN B 158 -3.644 1.224 1.376 1.00 1.42 C ATOM 2007 C GLN B 158 -2.181 0.998 1.251 1.00 1.04 C ATOM 2008 O GLN B 158 -1.389 1.927 1.354 1.00 0.95 O ATOM 2009 CB GLN B 158 -4.040 2.434 0.538 1.00 1.93 C ATOM 2010 CG GLN B 158 -5.519 2.769 0.591 1.00 2.76 C ATOM 2011 CD GLN B 158 -5.768 4.262 0.635 1.00 3.57 C ATOM 2012 OE1 GLN B 158 -6.334 4.838 -0.294 1.00 3.89 O ATOM 2013 NE2 GLN B 158 -5.337 4.900 1.717 1.00 4.34 N ATOM 0 H GLN B 158 -3.516 2.238 3.163 1.00 1.33 H new ATOM 0 HA GLN B 158 -4.229 0.384 1.002 1.00 1.42 H new ATOM 0 HB2 GLN B 158 -3.470 3.299 0.877 1.00 1.93 H new ATOM 0 HB3 GLN B 158 -3.757 2.252 -0.499 1.00 1.93 H new ATOM 0 HG2 GLN B 158 -6.017 2.345 -0.281 1.00 2.76 H new ATOM 0 HG3 GLN B 158 -5.964 2.302 1.470 1.00 2.76 H new ATOM 0 HE21 GLN B 158 -4.873 4.382 2.463 1.00 4.34 H new ATOM 0 HE22 GLN B 158 -5.470 5.908 1.802 1.00 4.34 H new ATOM 2022 N LYS B 159 -1.820 -0.243 1.191 1.00 1.15 N ATOM 2023 CA LYS B 159 -0.414 -0.594 1.130 1.00 1.13 C ATOM 2024 C LYS B 159 0.288 -0.213 -0.227 1.00 0.95 C ATOM 2025 O LYS B 159 0.557 0.949 -0.430 1.00 0.91 O ATOM 2026 CB LYS B 159 -0.214 -2.037 1.553 1.00 1.54 C ATOM 2027 CG LYS B 159 0.525 -2.167 2.870 1.00 1.91 C ATOM 2028 CD LYS B 159 1.593 -3.240 2.794 1.00 2.18 C ATOM 2029 CE LYS B 159 2.948 -2.709 3.228 1.00 2.81 C ATOM 2030 NZ LYS B 159 3.323 -3.195 4.583 1.00 3.54 N ATOM 0 H LYS B 159 -2.464 -1.034 1.182 1.00 1.15 H new ATOM 0 HA LYS B 159 0.110 0.031 1.853 1.00 1.13 H new ATOM 0 HB2 LYS B 159 -1.186 -2.524 1.637 1.00 1.54 H new ATOM 0 HB3 LYS B 159 0.341 -2.565 0.777 1.00 1.54 H new ATOM 0 HG2 LYS B 159 0.982 -1.212 3.129 1.00 1.91 H new ATOM 0 HG3 LYS B 159 -0.181 -2.408 3.664 1.00 1.91 H new ATOM 0 HD2 LYS B 159 1.311 -4.081 3.427 1.00 2.18 H new ATOM 0 HD3 LYS B 159 1.659 -3.617 1.774 1.00 2.18 H new ATOM 0 HE2 LYS B 159 3.707 -3.017 2.508 1.00 2.81 H new ATOM 0 HE3 LYS B 159 2.929 -1.619 3.225 1.00 2.81 H new ATOM 0 HZ1 LYS B 159 4.254 -2.811 4.844 1.00 3.54 H new ATOM 0 HZ2 LYS B 159 2.612 -2.880 5.274 1.00 3.54 H new ATOM 0 HZ3 LYS B 159 3.365 -4.234 4.580 1.00 3.54 H new ATOM 2044 N PRO B 160 0.652 -1.131 -1.167 1.00 1.05 N ATOM 2045 CA PRO B 160 1.402 -0.733 -2.379 1.00 1.14 C ATOM 2046 C PRO B 160 0.890 0.428 -3.225 1.00 1.10 C ATOM 2047 O PRO B 160 -0.241 0.464 -3.710 1.00 1.23 O ATOM 2048 CB PRO B 160 1.501 -2.019 -3.213 1.00 1.46 C ATOM 2049 CG PRO B 160 0.529 -2.965 -2.594 1.00 1.51 C ATOM 2050 CD PRO B 160 0.457 -2.585 -1.140 1.00 1.27 C ATOM 0 HA PRO B 160 2.349 -0.313 -2.040 1.00 1.14 H new ATOM 0 HB2 PRO B 160 1.255 -1.830 -4.258 1.00 1.46 H new ATOM 0 HB3 PRO B 160 2.513 -2.425 -3.192 1.00 1.46 H new ATOM 0 HG2 PRO B 160 -0.449 -2.886 -3.068 1.00 1.51 H new ATOM 0 HG3 PRO B 160 0.858 -3.997 -2.713 1.00 1.51 H new ATOM 0 HD2 PRO B 160 -0.503 -2.855 -0.700 1.00 1.27 H new ATOM 0 HD3 PRO B 160 1.228 -3.085 -0.554 1.00 1.27 H new ATOM 2058 N CYS B 161 1.848 1.340 -3.414 1.00 1.09 N ATOM 2059 CA CYS B 161 1.747 2.549 -4.229 1.00 1.15 C ATOM 2060 C CYS B 161 3.158 2.829 -4.781 1.00 1.37 C ATOM 2061 O CYS B 161 4.081 2.051 -4.497 1.00 1.58 O ATOM 2062 CB CYS B 161 1.281 3.732 -3.370 1.00 1.32 C ATOM 2063 SG CYS B 161 0.578 5.110 -4.326 1.00 1.58 S ATOM 0 H CYS B 161 2.765 1.247 -2.977 1.00 1.09 H new ATOM 0 HA CYS B 161 1.025 2.416 -5.034 1.00 1.15 H new ATOM 0 HB2 CYS B 161 0.535 3.379 -2.658 1.00 1.32 H new ATOM 0 HB3 CYS B 161 2.126 4.101 -2.789 1.00 1.32 H new ATOM 2068 N GLY B 162 3.365 3.899 -5.570 1.00 1.57 N ATOM 2069 CA GLY B 162 4.717 4.188 -6.070 1.00 1.88 C ATOM 2070 C GLY B 162 5.444 2.985 -6.648 1.00 2.05 C ATOM 2071 O GLY B 162 4.839 1.952 -6.924 1.00 2.37 O ATOM 0 H GLY B 162 2.642 4.555 -5.865 1.00 1.57 H new ATOM 0 HA2 GLY B 162 4.650 4.960 -6.837 1.00 1.88 H new ATOM 0 HA3 GLY B 162 5.312 4.600 -5.255 1.00 1.88 H new ATOM 2075 N SER B 163 6.752 3.127 -6.812 1.00 2.40 N ATOM 2076 CA SER B 163 7.591 2.057 -7.333 1.00 2.93 C ATOM 2077 C SER B 163 7.996 1.111 -6.197 1.00 2.71 C ATOM 2078 O SER B 163 9.159 0.751 -6.042 1.00 3.29 O ATOM 2079 CB SER B 163 8.839 2.642 -8.003 1.00 3.81 C ATOM 2080 OG SER B 163 8.495 3.444 -9.119 1.00 4.07 O ATOM 0 H SER B 163 7.259 3.983 -6.589 1.00 2.40 H new ATOM 0 HA SER B 163 7.026 1.495 -8.077 1.00 2.93 H new ATOM 0 HB2 SER B 163 9.396 3.239 -7.281 1.00 3.81 H new ATOM 0 HB3 SER B 163 9.496 1.833 -8.322 1.00 3.81 H new ATOM 0 HG SER B 163 9.310 3.805 -9.526 1.00 4.07 H new ATOM 2086 N GLY B 164 7.000 0.702 -5.421 1.00 2.12 N ATOM 2087 CA GLY B 164 7.207 -0.220 -4.315 1.00 2.11 C ATOM 2088 C GLY B 164 6.854 0.369 -2.953 1.00 1.92 C ATOM 2089 O GLY B 164 7.027 -0.296 -1.929 1.00 2.20 O ATOM 0 H GLY B 164 6.032 0.999 -5.541 1.00 2.12 H new ATOM 0 HA2 GLY B 164 6.606 -1.114 -4.481 1.00 2.11 H new ATOM 0 HA3 GLY B 164 8.251 -0.534 -4.306 1.00 2.11 H new ATOM 2093 N GLY B 165 6.438 1.641 -2.928 1.00 1.61 N ATOM 2094 CA GLY B 165 6.152 2.274 -1.645 1.00 1.60 C ATOM 2095 C GLY B 165 4.679 2.243 -1.307 1.00 1.42 C ATOM 2096 O GLY B 165 3.834 2.544 -2.143 1.00 1.62 O ATOM 0 H GLY B 165 6.297 2.229 -3.749 1.00 1.61 H new ATOM 0 HA2 GLY B 165 6.714 1.768 -0.859 1.00 1.60 H new ATOM 0 HA3 GLY B 165 6.496 3.308 -1.668 1.00 1.60 H new ATOM 2100 N ARG B 166 4.366 1.841 -0.079 1.00 1.16 N ATOM 2101 CA ARG B 166 2.974 1.723 0.337 1.00 1.03 C ATOM 2102 C ARG B 166 2.371 3.072 0.679 1.00 0.95 C ATOM 2103 O ARG B 166 3.070 3.994 1.103 1.00 1.04 O ATOM 2104 CB ARG B 166 2.784 0.741 1.511 1.00 1.08 C ATOM 2105 CG ARG B 166 4.034 0.461 2.344 1.00 1.23 C ATOM 2106 CD ARG B 166 5.052 -0.402 1.602 1.00 1.39 C ATOM 2107 NE ARG B 166 4.425 -1.441 0.779 1.00 1.79 N ATOM 2108 CZ ARG B 166 5.103 -2.294 0.007 1.00 2.31 C ATOM 2109 NH1 ARG B 166 6.430 -2.267 -0.025 1.00 2.54 N ATOM 2110 NH2 ARG B 166 4.450 -3.182 -0.728 1.00 3.05 N ATOM 0 H ARG B 166 5.049 1.594 0.637 1.00 1.16 H new ATOM 0 HA ARG B 166 2.442 1.314 -0.522 1.00 1.03 H new ATOM 0 HB2 ARG B 166 2.010 1.135 2.170 1.00 1.08 H new ATOM 0 HB3 ARG B 166 2.414 -0.204 1.115 1.00 1.08 H new ATOM 0 HG2 ARG B 166 4.499 1.406 2.623 1.00 1.23 H new ATOM 0 HG3 ARG B 166 3.746 -0.038 3.269 1.00 1.23 H new ATOM 0 HD2 ARG B 166 5.668 0.235 0.967 1.00 1.39 H new ATOM 0 HD3 ARG B 166 5.719 -0.871 2.325 1.00 1.39 H new ATOM 0 HE ARG B 166 3.408 -1.517 0.797 1.00 1.79 H new ATOM 0 HH11 ARG B 166 6.940 -1.591 0.543 1.00 2.54 H new ATOM 0 HH12 ARG B 166 6.939 -2.923 -0.618 1.00 2.54 H new ATOM 0 HH21 ARG B 166 3.431 -3.213 -0.704 1.00 3.05 H new ATOM 0 HH22 ARG B 166 4.966 -3.834 -1.318 1.00 3.05 H new ATOM 2124 N CYS B 167 1.059 3.184 0.473 1.00 0.87 N ATOM 2125 CA CYS B 167 0.358 4.375 0.726 1.00 0.88 C ATOM 2126 C CYS B 167 0.276 4.596 2.214 1.00 0.88 C ATOM 2127 O CYS B 167 -0.448 3.880 2.909 1.00 0.93 O ATOM 2128 CB CYS B 167 -1.036 4.311 0.109 1.00 0.94 C ATOM 2129 SG CYS B 167 -1.856 5.921 -0.054 1.00 1.56 S ATOM 0 H CYS B 167 0.476 2.424 0.122 1.00 0.87 H new ATOM 0 HA CYS B 167 0.887 5.213 0.271 1.00 0.88 H new ATOM 0 HB2 CYS B 167 -0.963 3.852 -0.877 1.00 0.94 H new ATOM 0 HB3 CYS B 167 -1.661 3.658 0.719 1.00 0.94 H new ATOM 2134 N ALA B 168 0.987 5.579 2.706 1.00 0.90 N ATOM 2135 CA ALA B 168 0.956 5.873 4.128 1.00 0.95 C ATOM 2136 C ALA B 168 -0.143 6.872 4.428 1.00 0.96 C ATOM 2137 O ALA B 168 -0.575 7.032 5.570 1.00 1.04 O ATOM 2138 CB ALA B 168 2.300 6.395 4.585 1.00 0.96 C ATOM 0 H ALA B 168 1.591 6.188 2.154 1.00 0.90 H new ATOM 0 HA ALA B 168 0.745 4.955 4.676 1.00 0.95 H new ATOM 0 HB1 ALA B 168 2.262 6.611 5.653 1.00 0.96 H new ATOM 0 HB2 ALA B 168 3.066 5.644 4.394 1.00 0.96 H new ATOM 0 HB3 ALA B 168 2.541 7.307 4.038 1.00 0.96 H new ATOM 2144 N ALA B 169 -0.636 7.489 3.370 1.00 0.90 N ATOM 2145 CA ALA B 169 -1.730 8.447 3.436 1.00 0.94 C ATOM 2146 C ALA B 169 -2.151 8.815 2.008 1.00 0.91 C ATOM 2147 O ALA B 169 -1.380 8.605 1.069 1.00 0.87 O ATOM 2148 CB ALA B 169 -1.309 9.672 4.206 1.00 0.98 C ATOM 0 H ALA B 169 -0.284 7.338 2.425 1.00 0.90 H new ATOM 0 HA ALA B 169 -2.578 8.004 3.958 1.00 0.94 H new ATOM 0 HB1 ALA B 169 -2.138 10.379 4.247 1.00 0.98 H new ATOM 0 HB2 ALA B 169 -1.026 9.386 5.219 1.00 0.98 H new ATOM 0 HB3 ALA B 169 -0.458 10.139 3.710 1.00 0.98 H new ATOM 2154 N ALA B 170 -3.349 9.372 1.825 1.00 0.98 N ATOM 2155 CA ALA B 170 -3.801 9.758 0.480 1.00 1.00 C ATOM 2156 C ALA B 170 -2.798 10.710 -0.197 1.00 1.04 C ATOM 2157 O ALA B 170 -2.255 11.615 0.436 1.00 1.25 O ATOM 2158 CB ALA B 170 -5.197 10.380 0.528 1.00 1.15 C ATOM 0 H ALA B 170 -4.015 9.565 2.573 1.00 0.98 H new ATOM 0 HA ALA B 170 -3.856 8.851 -0.122 1.00 1.00 H new ATOM 0 HB1 ALA B 170 -5.507 10.656 -0.480 1.00 1.15 H new ATOM 0 HB2 ALA B 170 -5.903 9.659 0.940 1.00 1.15 H new ATOM 0 HB3 ALA B 170 -5.178 11.269 1.158 1.00 1.15 H new ATOM 2164 N GLY B 171 -2.573 10.484 -1.492 1.00 1.15 N ATOM 2165 CA GLY B 171 -1.659 11.295 -2.285 1.00 1.28 C ATOM 2166 C GLY B 171 -0.170 11.183 -1.934 1.00 1.22 C ATOM 2167 O GLY B 171 0.674 11.371 -2.809 1.00 1.29 O ATOM 0 H GLY B 171 -3.021 9.733 -2.017 1.00 1.15 H new ATOM 0 HA2 GLY B 171 -1.784 11.025 -3.334 1.00 1.28 H new ATOM 0 HA3 GLY B 171 -1.956 12.339 -2.187 1.00 1.28 H new ATOM 2171 N ILE B 172 0.167 10.772 -0.716 1.00 1.13 N ATOM 2172 CA ILE B 172 1.570 10.584 -0.306 1.00 1.09 C ATOM 2173 C ILE B 172 1.865 9.091 -0.107 1.00 1.02 C ATOM 2174 O ILE B 172 1.562 8.493 0.941 1.00 1.34 O ATOM 2175 CB ILE B 172 1.853 11.374 0.976 1.00 1.53 C ATOM 2176 CG1 ILE B 172 0.932 10.926 2.092 1.00 1.09 C ATOM 2177 CG2 ILE B 172 1.708 12.868 0.723 1.00 2.27 C ATOM 2178 CD1 ILE B 172 1.691 10.157 3.112 1.00 0.91 C ATOM 0 H ILE B 172 -0.512 10.559 0.015 1.00 1.13 H new ATOM 0 HA ILE B 172 2.226 10.960 -1.091 1.00 1.09 H new ATOM 0 HB ILE B 172 2.880 11.177 1.284 1.00 1.53 H new ATOM 0 HG12 ILE B 172 0.463 11.794 2.556 1.00 1.09 H new ATOM 0 HG13 ILE B 172 0.130 10.310 1.685 1.00 1.09 H new ATOM 0 HG21 ILE B 172 1.912 13.414 1.644 1.00 2.27 H new ATOM 0 HG22 ILE B 172 2.415 13.177 -0.047 1.00 2.27 H new ATOM 0 HG23 ILE B 172 0.693 13.084 0.391 1.00 2.27 H new ATOM 0 HD11 ILE B 172 1.015 9.842 3.907 1.00 0.91 H new ATOM 0 HD12 ILE B 172 2.138 9.279 2.647 1.00 0.91 H new ATOM 0 HD13 ILE B 172 2.477 10.785 3.531 1.00 0.91 H new ATOM 2190 N CYS B 173 2.457 8.485 -1.131 1.00 0.81 N ATOM 2191 CA CYS B 173 2.794 7.070 -1.086 1.00 1.04 C ATOM 2192 C CYS B 173 4.220 6.909 -0.590 1.00 1.06 C ATOM 2193 O CYS B 173 5.180 7.188 -1.307 1.00 1.19 O ATOM 2194 CB CYS B 173 2.616 6.429 -2.464 1.00 1.17 C ATOM 2195 SG CYS B 173 0.995 6.769 -3.226 1.00 1.94 S ATOM 0 H CYS B 173 2.712 8.953 -2.001 1.00 0.81 H new ATOM 0 HA CYS B 173 2.120 6.560 -0.397 1.00 1.04 H new ATOM 0 HB2 CYS B 173 3.402 6.790 -3.127 1.00 1.17 H new ATOM 0 HB3 CYS B 173 2.746 5.351 -2.373 1.00 1.17 H new ATOM 2200 N CYS B 174 4.341 6.498 0.663 1.00 0.97 N ATOM 2201 CA CYS B 174 5.636 6.343 1.300 1.00 0.99 C ATOM 2202 C CYS B 174 6.269 4.982 1.003 1.00 1.16 C ATOM 2203 O CYS B 174 5.677 3.929 1.251 1.00 1.35 O ATOM 2204 CB CYS B 174 5.482 6.570 2.806 1.00 1.12 C ATOM 2205 SG CYS B 174 4.605 8.120 3.223 1.00 1.26 S ATOM 0 H CYS B 174 3.549 6.264 1.262 1.00 0.97 H new ATOM 0 HA CYS B 174 6.316 7.088 0.888 1.00 0.99 H new ATOM 0 HB2 CYS B 174 4.942 5.728 3.239 1.00 1.12 H new ATOM 0 HB3 CYS B 174 6.470 6.586 3.266 1.00 1.12 H new ATOM 2210 N SER B 175 7.488 5.031 0.468 1.00 1.15 N ATOM 2211 CA SER B 175 8.253 3.836 0.120 1.00 1.38 C ATOM 2212 C SER B 175 9.005 3.304 1.345 1.00 1.29 C ATOM 2213 O SER B 175 8.881 3.864 2.434 1.00 1.12 O ATOM 2214 CB SER B 175 9.236 4.161 -1.008 1.00 1.48 C ATOM 2215 OG SER B 175 8.554 4.629 -2.159 1.00 2.00 O ATOM 0 H SER B 175 7.974 5.904 0.263 1.00 1.15 H new ATOM 0 HA SER B 175 7.564 3.063 -0.220 1.00 1.38 H new ATOM 0 HB2 SER B 175 9.946 4.916 -0.670 1.00 1.48 H new ATOM 0 HB3 SER B 175 9.813 3.271 -1.260 1.00 1.48 H new ATOM 0 HG SER B 175 9.204 4.831 -2.864 1.00 2.00 H new ATOM 2221 N PRO B 176 9.794 2.213 1.204 1.00 1.49 N ATOM 2222 CA PRO B 176 10.535 1.647 2.336 1.00 1.45 C ATOM 2223 C PRO B 176 11.760 2.483 2.691 1.00 1.20 C ATOM 2224 O PRO B 176 12.761 1.966 3.187 1.00 1.25 O ATOM 2225 CB PRO B 176 10.959 0.270 1.823 1.00 1.77 C ATOM 2226 CG PRO B 176 11.075 0.441 0.348 1.00 1.90 C ATOM 2227 CD PRO B 176 10.018 1.442 -0.040 1.00 1.81 C ATOM 0 HA PRO B 176 9.936 1.612 3.246 1.00 1.45 H new ATOM 0 HB2 PRO B 176 11.906 -0.043 2.262 1.00 1.77 H new ATOM 0 HB3 PRO B 176 10.223 -0.492 2.078 1.00 1.77 H new ATOM 0 HG2 PRO B 176 12.068 0.797 0.074 1.00 1.90 H new ATOM 0 HG3 PRO B 176 10.922 -0.507 -0.168 1.00 1.90 H new ATOM 0 HD2 PRO B 176 10.354 2.084 -0.854 1.00 1.81 H new ATOM 0 HD3 PRO B 176 9.105 0.951 -0.377 1.00 1.81 H new ATOM 2235 N ASP B 177 11.658 3.787 2.443 1.00 1.01 N ATOM 2236 CA ASP B 177 12.738 4.721 2.741 1.00 0.92 C ATOM 2237 C ASP B 177 12.173 6.071 3.184 1.00 0.83 C ATOM 2238 O ASP B 177 12.805 6.801 3.947 1.00 0.90 O ATOM 2239 CB ASP B 177 13.644 4.902 1.521 1.00 1.18 C ATOM 2240 CG ASP B 177 12.874 5.307 0.282 1.00 1.96 C ATOM 2241 OD1 ASP B 177 12.607 6.516 0.117 1.00 2.72 O ATOM 2242 OD2 ASP B 177 12.538 4.416 -0.527 1.00 2.51 O ATOM 0 H ASP B 177 10.831 4.222 2.033 1.00 1.01 H new ATOM 0 HA ASP B 177 13.331 4.308 3.557 1.00 0.92 H new ATOM 0 HB2 ASP B 177 14.397 5.659 1.741 1.00 1.18 H new ATOM 0 HB3 ASP B 177 14.176 3.971 1.326 1.00 1.18 H new ATOM 2247 N GLY B 178 10.972 6.392 2.700 1.00 0.89 N ATOM 2248 CA GLY B 178 10.328 7.648 3.053 1.00 0.87 C ATOM 2249 C GLY B 178 8.951 7.784 2.423 1.00 0.85 C ATOM 2250 O GLY B 178 8.161 6.846 2.467 1.00 0.99 O ATOM 0 H GLY B 178 10.433 5.801 2.067 1.00 0.89 H new ATOM 0 HA2 GLY B 178 10.238 7.716 4.137 1.00 0.87 H new ATOM 0 HA3 GLY B 178 10.956 8.479 2.732 1.00 0.87 H new ATOM 2254 N CYS B 179 8.671 8.941 1.817 1.00 0.78 N ATOM 2255 CA CYS B 179 7.380 9.176 1.163 1.00 0.79 C ATOM 2256 C CYS B 179 7.615 9.665 -0.265 1.00 0.77 C ATOM 2257 O CYS B 179 8.696 10.157 -0.583 1.00 0.88 O ATOM 2258 CB CYS B 179 6.529 10.142 1.980 1.00 0.92 C ATOM 2259 SG CYS B 179 6.073 9.476 3.617 1.00 1.34 S ATOM 0 H CYS B 179 9.318 9.728 1.765 1.00 0.78 H new ATOM 0 HA CYS B 179 6.820 8.243 1.108 1.00 0.79 H new ATOM 0 HB2 CYS B 179 7.075 11.076 2.113 1.00 0.92 H new ATOM 0 HB3 CYS B 179 5.622 10.379 1.424 1.00 0.92 H new ATOM 2264 N HIS B 180 6.647 9.430 -1.152 1.00 0.70 N ATOM 2265 CA HIS B 180 6.834 9.728 -2.569 1.00 0.75 C ATOM 2266 C HIS B 180 5.517 10.141 -3.154 1.00 0.69 C ATOM 2267 O HIS B 180 4.545 9.388 -3.163 1.00 0.66 O ATOM 2268 CB HIS B 180 7.405 8.464 -3.284 1.00 0.89 C ATOM 2269 CG HIS B 180 7.094 8.329 -4.760 1.00 0.94 C ATOM 2270 ND1 HIS B 180 7.493 9.253 -5.703 1.00 1.60 N ATOM 2271 CD2 HIS B 180 6.412 7.373 -5.440 1.00 1.70 C ATOM 2272 CE1 HIS B 180 7.068 8.873 -6.897 1.00 2.03 C ATOM 2273 NE2 HIS B 180 6.410 7.737 -6.765 1.00 2.10 N ATOM 0 H HIS B 180 5.735 9.038 -0.916 1.00 0.70 H new ATOM 0 HA HIS B 180 7.543 10.545 -2.704 1.00 0.75 H new ATOM 0 HB2 HIS B 180 8.488 8.462 -3.161 1.00 0.89 H new ATOM 0 HB3 HIS B 180 7.024 7.580 -2.772 1.00 0.89 H new ATOM 0 HD2 HIS B 180 5.955 6.490 -5.018 1.00 1.70 H new ATOM 0 HE1 HIS B 180 7.232 9.403 -7.823 1.00 2.03 H new ATOM 0 HE2 HIS B 180 5.971 7.214 -7.523 1.00 2.10 H new ATOM 2282 N GLU B 181 5.480 11.410 -3.586 1.00 0.75 N ATOM 2283 CA GLU B 181 4.262 12.006 -4.120 1.00 0.77 C ATOM 2284 C GLU B 181 3.747 11.192 -5.279 1.00 0.73 C ATOM 2285 O GLU B 181 4.415 11.019 -6.299 1.00 0.94 O ATOM 2286 CB GLU B 181 4.494 13.464 -4.543 1.00 0.93 C ATOM 2287 CG GLU B 181 5.835 13.699 -5.206 1.00 1.69 C ATOM 2288 CD GLU B 181 5.715 13.949 -6.697 1.00 2.34 C ATOM 2289 OE1 GLU B 181 5.181 15.012 -7.080 1.00 2.69 O ATOM 2290 OE2 GLU B 181 6.154 13.083 -7.482 1.00 3.06 O ATOM 0 H GLU B 181 6.284 12.038 -3.573 1.00 0.75 H new ATOM 0 HA GLU B 181 3.511 12.006 -3.330 1.00 0.77 H new ATOM 0 HB2 GLU B 181 3.702 13.765 -5.229 1.00 0.93 H new ATOM 0 HB3 GLU B 181 4.415 14.105 -3.665 1.00 0.93 H new ATOM 0 HG2 GLU B 181 6.323 14.553 -4.737 1.00 1.69 H new ATOM 0 HG3 GLU B 181 6.476 12.834 -5.037 1.00 1.69 H new ATOM 2297 N ASP B 182 2.562 10.667 -5.079 1.00 0.77 N ATOM 2298 CA ASP B 182 1.923 9.824 -6.052 1.00 0.79 C ATOM 2299 C ASP B 182 0.398 10.035 -5.972 1.00 0.97 C ATOM 2300 O ASP B 182 -0.254 9.539 -5.053 1.00 1.22 O ATOM 2301 CB ASP B 182 2.383 8.380 -5.766 1.00 0.90 C ATOM 2302 CG ASP B 182 1.527 7.311 -6.420 1.00 1.39 C ATOM 2303 OD1 ASP B 182 0.296 7.320 -6.217 1.00 1.88 O ATOM 2304 OD2 ASP B 182 2.094 6.461 -7.140 1.00 2.06 O ATOM 0 H ASP B 182 2.014 10.815 -4.232 1.00 0.77 H new ATOM 0 HA ASP B 182 2.200 10.063 -7.079 1.00 0.79 H new ATOM 0 HB2 ASP B 182 3.412 8.264 -6.107 1.00 0.90 H new ATOM 0 HB3 ASP B 182 2.385 8.218 -4.688 1.00 0.90 H new ATOM 2309 N PRO B 183 -0.183 10.829 -6.911 1.00 1.15 N ATOM 2310 CA PRO B 183 -1.624 11.160 -6.913 1.00 1.41 C ATOM 2311 C PRO B 183 -2.568 9.958 -6.929 1.00 1.28 C ATOM 2312 O PRO B 183 -3.787 10.131 -6.901 1.00 1.41 O ATOM 2313 CB PRO B 183 -1.803 11.977 -8.195 1.00 1.79 C ATOM 2314 CG PRO B 183 -0.460 12.551 -8.472 1.00 1.91 C ATOM 2315 CD PRO B 183 0.525 11.512 -8.020 1.00 1.41 C ATOM 0 HA PRO B 183 -1.885 11.679 -5.991 1.00 1.41 H new ATOM 0 HB2 PRO B 183 -2.142 11.350 -9.019 1.00 1.79 H new ATOM 0 HB3 PRO B 183 -2.549 12.761 -8.063 1.00 1.79 H new ATOM 0 HG2 PRO B 183 -0.339 12.771 -9.533 1.00 1.91 H new ATOM 0 HG3 PRO B 183 -0.316 13.488 -7.934 1.00 1.91 H new ATOM 0 HD2 PRO B 183 0.776 10.820 -8.823 1.00 1.41 H new ATOM 0 HD3 PRO B 183 1.459 11.963 -7.684 1.00 1.41 H new ATOM 2323 N ALA B 184 -2.024 8.751 -6.985 1.00 1.13 N ATOM 2324 CA ALA B 184 -2.860 7.552 -7.015 1.00 1.18 C ATOM 2325 C ALA B 184 -3.638 7.363 -5.710 1.00 1.22 C ATOM 2326 O ALA B 184 -4.605 6.602 -5.667 1.00 1.56 O ATOM 2327 CB ALA B 184 -2.017 6.321 -7.311 1.00 1.21 C ATOM 0 H ALA B 184 -1.020 8.573 -7.010 1.00 1.13 H new ATOM 0 HA ALA B 184 -3.589 7.685 -7.815 1.00 1.18 H new ATOM 0 HB1 ALA B 184 -2.656 5.438 -7.329 1.00 1.21 H new ATOM 0 HB2 ALA B 184 -1.531 6.437 -8.280 1.00 1.21 H new ATOM 0 HB3 ALA B 184 -1.259 6.204 -6.536 1.00 1.21 H new ATOM 2333 N CYS B 185 -3.206 8.034 -4.642 1.00 1.05 N ATOM 2334 CA CYS B 185 -3.869 7.898 -3.341 1.00 1.23 C ATOM 2335 C CYS B 185 -4.825 9.060 -3.029 1.00 1.50 C ATOM 2336 O CYS B 185 -5.354 9.157 -1.923 1.00 1.94 O ATOM 2337 CB CYS B 185 -2.820 7.745 -2.238 1.00 1.19 C ATOM 2338 SG CYS B 185 -2.207 6.050 -2.043 1.00 1.46 S ATOM 0 H CYS B 185 -2.409 8.671 -4.649 1.00 1.05 H new ATOM 0 HA CYS B 185 -4.487 7.001 -3.385 1.00 1.23 H new ATOM 0 HB2 CYS B 185 -1.979 8.403 -2.455 1.00 1.19 H new ATOM 0 HB3 CYS B 185 -3.249 8.078 -1.293 1.00 1.19 H new ATOM 2343 N ASP B 186 -5.050 9.926 -4.010 1.00 1.54 N ATOM 2344 CA ASP B 186 -5.940 11.070 -3.869 1.00 1.92 C ATOM 2345 C ASP B 186 -7.429 10.723 -3.753 1.00 1.82 C ATOM 2346 O ASP B 186 -8.193 11.574 -3.290 1.00 2.28 O ATOM 2347 CB ASP B 186 -5.728 12.034 -5.039 1.00 2.44 C ATOM 2348 CG ASP B 186 -5.364 13.433 -4.579 1.00 3.09 C ATOM 2349 OD1 ASP B 186 -4.255 13.608 -4.033 1.00 3.49 O ATOM 2350 OD2 ASP B 186 -6.186 14.353 -4.769 1.00 3.61 O ATOM 0 H ASP B 186 -4.617 9.853 -4.931 1.00 1.54 H new ATOM 0 HA ASP B 186 -5.672 11.532 -2.919 1.00 1.92 H new ATOM 0 HB2 ASP B 186 -4.938 11.650 -5.684 1.00 2.44 H new ATOM 0 HB3 ASP B 186 -6.637 12.077 -5.640 1.00 2.44 H new ATOM 2355 N PRO B 187 -7.910 9.519 -4.159 1.00 1.73 N ATOM 2356 CA PRO B 187 -9.325 9.219 -4.055 1.00 2.05 C ATOM 2357 C PRO B 187 -9.779 8.879 -2.656 1.00 2.17 C ATOM 2358 O PRO B 187 -10.453 7.891 -2.380 1.00 2.31 O ATOM 2359 CB PRO B 187 -9.559 8.097 -5.036 1.00 2.47 C ATOM 2360 CG PRO B 187 -8.222 7.687 -5.566 1.00 2.58 C ATOM 2361 CD PRO B 187 -7.177 8.396 -4.753 1.00 1.99 C ATOM 0 HA PRO B 187 -9.925 10.098 -4.291 1.00 2.05 H new ATOM 0 HB2 PRO B 187 -10.054 7.257 -4.549 1.00 2.47 H new ATOM 0 HB3 PRO B 187 -10.210 8.424 -5.846 1.00 2.47 H new ATOM 0 HG2 PRO B 187 -8.096 6.607 -5.494 1.00 2.58 H new ATOM 0 HG3 PRO B 187 -8.131 7.949 -6.620 1.00 2.58 H new ATOM 0 HD2 PRO B 187 -6.752 7.745 -3.989 1.00 1.99 H new ATOM 0 HD3 PRO B 187 -6.350 8.740 -5.374 1.00 1.99 H new ATOM 2369 N GLU B 188 -9.293 9.726 -1.820 1.00 2.54 N ATOM 2370 CA GLU B 188 -9.516 9.678 -0.365 1.00 3.18 C ATOM 2371 C GLU B 188 -8.948 10.897 0.391 1.00 3.47 C ATOM 2372 O GLU B 188 -9.221 11.086 1.575 1.00 4.08 O ATOM 2373 CB GLU B 188 -8.976 8.367 0.194 1.00 3.61 C ATOM 2374 CG GLU B 188 -7.465 8.309 0.306 1.00 3.52 C ATOM 2375 CD GLU B 188 -7.006 7.280 1.317 1.00 4.20 C ATOM 2376 OE1 GLU B 188 -7.614 6.189 1.373 1.00 4.70 O ATOM 2377 OE2 GLU B 188 -6.042 7.564 2.055 1.00 4.57 O ATOM 0 H GLU B 188 -8.706 10.508 -2.110 1.00 2.54 H new ATOM 0 HA GLU B 188 -10.593 9.724 -0.203 1.00 3.18 H new ATOM 0 HB2 GLU B 188 -9.408 8.202 1.181 1.00 3.61 H new ATOM 0 HB3 GLU B 188 -9.313 7.549 -0.442 1.00 3.61 H new ATOM 0 HG2 GLU B 188 -7.039 8.073 -0.669 1.00 3.52 H new ATOM 0 HG3 GLU B 188 -7.085 9.290 0.591 1.00 3.52 H new ATOM 2384 N ALA B 189 -8.144 11.690 -0.295 1.00 3.25 N ATOM 2385 CA ALA B 189 -7.528 12.881 0.265 1.00 3.84 C ATOM 2386 C ALA B 189 -8.465 14.091 0.105 1.00 4.73 C ATOM 2387 O ALA B 189 -8.115 15.039 -0.608 1.00 5.24 O ATOM 2388 CB ALA B 189 -6.196 13.113 -0.465 1.00 3.45 C ATOM 0 H ALA B 189 -7.897 11.523 -1.270 1.00 3.25 H new ATOM 0 HA ALA B 189 -7.344 12.751 1.332 1.00 3.84 H new ATOM 0 HB1 ALA B 189 -5.711 14.003 -0.064 1.00 3.45 H new ATOM 0 HB2 ALA B 189 -5.547 12.250 -0.320 1.00 3.45 H new ATOM 0 HB3 ALA B 189 -6.384 13.251 -1.530 1.00 3.45 H new ATOM 2394 N ALA B 190 -9.659 14.113 0.741 1.00 5.07 N ATOM 2395 CA ALA B 190 -10.573 15.245 0.560 1.00 6.09 C ATOM 2396 C ALA B 190 -10.031 16.537 1.147 1.00 6.88 C ATOM 2397 O ALA B 190 -8.959 16.558 1.746 1.00 6.93 O ATOM 2398 CB ALA B 190 -11.918 14.910 1.205 1.00 6.41 C ATOM 0 H ALA B 190 -9.998 13.380 1.364 1.00 5.07 H new ATOM 0 HA ALA B 190 -10.689 15.407 -0.512 1.00 6.09 H new ATOM 0 HB1 ALA B 190 -12.603 15.748 1.074 1.00 6.41 H new ATOM 0 HB2 ALA B 190 -12.337 14.022 0.732 1.00 6.41 H new ATOM 0 HB3 ALA B 190 -11.774 14.721 2.269 1.00 6.41 H new ATOM 2404 N PHE B 191 -10.802 17.612 0.992 1.00 7.61 N ATOM 2405 CA PHE B 191 -10.424 18.913 1.533 1.00 8.50 C ATOM 2406 C PHE B 191 -11.100 19.149 2.884 1.00 9.34 C ATOM 2407 O PHE B 191 -12.248 19.591 2.945 1.00 9.88 O ATOM 2408 CB PHE B 191 -10.789 20.033 0.556 1.00 8.96 C ATOM 2409 CG PHE B 191 -9.592 20.667 -0.092 1.00 9.23 C ATOM 2410 CD1 PHE B 191 -8.861 21.640 0.573 1.00 9.60 C ATOM 2411 CD2 PHE B 191 -9.192 20.287 -1.362 1.00 9.37 C ATOM 2412 CE1 PHE B 191 -7.755 22.220 -0.018 1.00 10.04 C ATOM 2413 CE2 PHE B 191 -8.088 20.863 -1.959 1.00 9.84 C ATOM 2414 CZ PHE B 191 -7.368 21.832 -1.286 1.00 10.14 C ATOM 0 H PHE B 191 -11.693 17.606 0.495 1.00 7.61 H new ATOM 0 HA PHE B 191 -9.344 18.919 1.677 1.00 8.50 H new ATOM 0 HB2 PHE B 191 -11.443 19.632 -0.218 1.00 8.96 H new ATOM 0 HB3 PHE B 191 -11.355 20.799 1.086 1.00 8.96 H new ATOM 0 HD1 PHE B 191 -9.160 21.948 1.564 1.00 9.60 H new ATOM 0 HD2 PHE B 191 -9.751 19.530 -1.893 1.00 9.37 H new ATOM 0 HE1 PHE B 191 -7.194 22.976 0.511 1.00 10.04 H new ATOM 0 HE2 PHE B 191 -7.788 20.557 -2.950 1.00 9.84 H new ATOM 0 HZ PHE B 191 -6.505 22.285 -1.751 1.00 10.14 H new ATOM 2424 N SER B 192 -10.385 18.844 3.964 1.00 9.55 N ATOM 2425 CA SER B 192 -10.915 19.012 5.317 1.00 10.42 C ATOM 2426 C SER B 192 -12.122 18.107 5.545 1.00 11.18 C ATOM 2427 O SER B 192 -12.005 17.160 6.351 1.00 11.41 O ATOM 2428 CB SER B 192 -11.306 20.470 5.574 1.00 10.44 C ATOM 2429 OG SER B 192 -10.587 21.005 6.673 1.00 10.49 O ATOM 2430 OXT SER B 192 -13.174 18.355 4.920 1.00 11.70 O ATOM 0 H SER B 192 -9.434 18.478 3.929 1.00 9.55 H new ATOM 0 HA SER B 192 -10.128 18.731 6.016 1.00 10.42 H new ATOM 0 HB2 SER B 192 -11.109 21.065 4.682 1.00 10.44 H new ATOM 0 HB3 SER B 192 -12.376 20.534 5.770 1.00 10.44 H new ATOM 0 HG SER B 192 -10.853 21.937 6.816 1.00 10.49 H new TER 2436 SER B 192