USER MOD reduce.3.24.130724 H: found=0, std=0, add=845, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 843 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 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -179:sc= 0 (180deg=-7.09e-05) USER MOD Single : A 2 SER OG : rot 42:sc= 0.00134 USER MOD Single : A 3 THR OG1 : rot 180:sc= 0.573 USER MOD Single : A 5 THR OG1 : rot 180:sc= 0.0455 USER MOD Single : A 6 LYS NZ :NH3+ -139:sc= -6.88! (180deg=-9.2!) USER MOD Single : A 7 TYR OH : rot 180:sc= 0 USER MOD Single : A 9 TYR OH : rot 180:sc= 0 USER MOD Single : A 10 LYS NZ :NH3+ -159:sc= -0.281 (180deg=-1.3!) USER MOD Single : A 13 ASN : amide:sc= -3.36! C(o=-3.4!,f=-11!) USER MOD Single : A 14 THR OG1 : rot 109:sc= 0.636 USER MOD Single : A 22 SER OG : rot 43:sc= 1.22 USER MOD Single : A 29 TYR OH : rot 167:sc= 1.27 USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 ASN : amide:sc= -0.264 K(o=-0.26,f=-1.4!) USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 37 LYS NZ :NH3+ 168:sc= -0.381 (180deg=-0.763) USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 49 THR OG1 : rot 180:sc= -0.7 USER MOD Single : A 51 GLN : amide:sc= -0.386 X(o=-0.39,f=-0.59) USER MOD Single : A 64 SER OG : rot 180:sc= 0 USER MOD Single : A 65 LYS NZ :NH3+ -155:sc= -0.386 (180deg=-1.59!) USER MOD Single : A 67 GLN : amide:sc=-0.00503 K(o=-0.005,f=-1.5!) USER MOD Single : A 70 ASN : amide:sc= -0.0581 K(o=-0.058,f=-2.3!) USER MOD Single : A 74 LYS NZ :NH3+ -162:sc= -0.245 (180deg=-1.04) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 LYS NZ :NH3+ -159:sc= -0.0543 (180deg=-0.581) USER MOD Single : A 88 ASN : amide:sc= -0.0368 X(o=-0.037,f=0) USER MOD Single : A 90 LYS NZ :NH3+ 154:sc= -0.139 (180deg=-0.853) USER MOD Single : A 92 ASN : amide:sc= -2.42 K(o=-2.4,f=0.032) USER MOD Single : A 93 SER OG : rot 180:sc= 0 USER MOD Single : A 94 THR OG1 : rot 92:sc= 0.0888 USER MOD Single : A 95 THR OG1 : rot 180:sc= 0 USER MOD Single : A 96 SER OG : rot 180:sc= 0 USER MOD Single : A 97 SER OG : rot -65:sc= 1.05 USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 THR OG1 : rot 180:sc= 0 USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 ASN : amide:sc= -2.32! K(o=-2.3!,f=-0.75) USER MOD Single : A 107 THR OG1 : rot 180:sc= 0 USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 TYR OH : rot 180:sc= 0 USER MOD Single : A 111 ASN : amide:sc= -1.43 K(o=-1.4,f=-0.64) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -11.622 -2.206 -26.538 1.00 0.00 N ATOM 2 CA MET A 1 -10.381 -1.499 -26.115 1.00 0.00 C ATOM 3 C MET A 1 -10.641 -0.752 -24.805 1.00 0.00 C ATOM 4 O MET A 1 -9.864 -0.826 -23.873 1.00 0.00 O ATOM 5 CB MET A 1 -9.970 -0.499 -27.199 1.00 0.00 C ATOM 6 CG MET A 1 -8.941 0.479 -26.627 1.00 0.00 C ATOM 7 SD MET A 1 -9.791 1.751 -25.660 1.00 0.00 S ATOM 8 CE MET A 1 -9.392 3.155 -26.731 1.00 0.00 C ATOM 0 H1 MET A 1 -11.441 -2.728 -27.419 1.00 0.00 H new ATOM 0 H2 MET A 1 -11.912 -2.873 -25.794 1.00 0.00 H new ATOM 0 H3 MET A 1 -12.380 -1.512 -26.696 1.00 0.00 H new ATOM 0 HA MET A 1 -9.581 -2.225 -25.967 1.00 0.00 H new ATOM 0 HB2 MET A 1 -9.549 -1.027 -28.055 1.00 0.00 H new ATOM 0 HB3 MET A 1 -10.844 0.045 -27.558 1.00 0.00 H new ATOM 0 HG2 MET A 1 -8.227 -0.054 -25.999 1.00 0.00 H new ATOM 0 HG3 MET A 1 -8.373 0.940 -27.435 1.00 0.00 H new ATOM 0 HE1 MET A 1 -9.827 4.064 -26.316 1.00 0.00 H new ATOM 0 HE2 MET A 1 -8.310 3.267 -26.796 1.00 0.00 H new ATOM 0 HE3 MET A 1 -9.799 2.980 -27.727 1.00 0.00 H new ATOM 18 N SER A 2 -11.728 -0.034 -24.726 1.00 0.00 N ATOM 19 CA SER A 2 -12.035 0.717 -23.476 1.00 0.00 C ATOM 20 C SER A 2 -12.461 -0.267 -22.383 1.00 0.00 C ATOM 21 O SER A 2 -13.284 0.040 -21.545 1.00 0.00 O ATOM 22 CB SER A 2 -13.170 1.706 -23.742 1.00 0.00 C ATOM 23 OG SER A 2 -12.650 3.029 -23.737 1.00 0.00 O ATOM 0 H SER A 2 -12.416 0.065 -25.472 1.00 0.00 H new ATOM 0 HA SER A 2 -11.148 1.261 -23.151 1.00 0.00 H new ATOM 0 HB2 SER A 2 -13.638 1.490 -24.702 1.00 0.00 H new ATOM 0 HB3 SER A 2 -13.943 1.604 -22.980 1.00 0.00 H new ATOM 0 HG SER A 2 -11.796 3.047 -24.218 1.00 0.00 H new ATOM 29 N THR A 3 -11.904 -1.448 -22.386 1.00 0.00 N ATOM 30 CA THR A 3 -12.277 -2.449 -21.348 1.00 0.00 C ATOM 31 C THR A 3 -12.136 -1.822 -19.959 1.00 0.00 C ATOM 32 O THR A 3 -13.062 -1.231 -19.437 1.00 0.00 O ATOM 33 CB THR A 3 -11.352 -3.663 -21.454 1.00 0.00 C ATOM 34 OG1 THR A 3 -10.001 -3.238 -21.345 1.00 0.00 O ATOM 35 CG2 THR A 3 -11.564 -4.353 -22.803 1.00 0.00 C ATOM 0 H THR A 3 -11.208 -1.762 -23.062 1.00 0.00 H new ATOM 0 HA THR A 3 -13.309 -2.763 -21.502 1.00 0.00 H new ATOM 0 HB THR A 3 -11.579 -4.364 -20.651 1.00 0.00 H new ATOM 0 HG1 THR A 3 -9.407 -4.015 -21.411 1.00 0.00 H new ATOM 0 HG21 THR A 3 -10.904 -5.218 -22.877 1.00 0.00 H new ATOM 0 HG22 THR A 3 -12.601 -4.679 -22.886 1.00 0.00 H new ATOM 0 HG23 THR A 3 -11.338 -3.654 -23.609 1.00 0.00 H new ATOM 43 N VAL A 4 -10.986 -1.944 -19.356 1.00 0.00 N ATOM 44 CA VAL A 4 -10.787 -1.355 -18.002 1.00 0.00 C ATOM 45 C VAL A 4 -9.939 -0.087 -18.117 1.00 0.00 C ATOM 46 O VAL A 4 -9.268 0.135 -19.105 1.00 0.00 O ATOM 47 CB VAL A 4 -10.073 -2.367 -17.105 1.00 0.00 C ATOM 48 CG1 VAL A 4 -11.067 -3.434 -16.647 1.00 0.00 C ATOM 49 CG2 VAL A 4 -8.939 -3.030 -17.890 1.00 0.00 C ATOM 0 H VAL A 4 -10.175 -2.427 -19.743 1.00 0.00 H new ATOM 0 HA VAL A 4 -11.756 -1.106 -17.568 1.00 0.00 H new ATOM 0 HB VAL A 4 -9.663 -1.856 -16.234 1.00 0.00 H new ATOM 0 HG11 VAL A 4 -10.558 -4.155 -16.008 1.00 0.00 H new ATOM 0 HG12 VAL A 4 -11.876 -2.962 -16.089 1.00 0.00 H new ATOM 0 HG13 VAL A 4 -11.477 -3.947 -17.517 1.00 0.00 H new ATOM 0 HG21 VAL A 4 -8.429 -3.752 -17.252 1.00 0.00 H new ATOM 0 HG22 VAL A 4 -9.350 -3.541 -18.761 1.00 0.00 H new ATOM 0 HG23 VAL A 4 -8.230 -2.270 -18.217 1.00 0.00 H new ATOM 59 N THR A 5 -9.963 0.748 -17.114 1.00 0.00 N ATOM 60 CA THR A 5 -9.158 2.000 -17.166 1.00 0.00 C ATOM 61 C THR A 5 -7.889 1.827 -16.330 1.00 0.00 C ATOM 62 O THR A 5 -7.599 0.753 -15.841 1.00 0.00 O ATOM 63 CB THR A 5 -9.984 3.160 -16.605 1.00 0.00 C ATOM 64 OG1 THR A 5 -9.288 4.381 -16.818 1.00 0.00 O ATOM 65 CG2 THR A 5 -10.207 2.952 -15.107 1.00 0.00 C ATOM 0 H THR A 5 -10.506 0.617 -16.261 1.00 0.00 H new ATOM 0 HA THR A 5 -8.885 2.213 -18.199 1.00 0.00 H new ATOM 0 HB THR A 5 -10.949 3.198 -17.111 1.00 0.00 H new ATOM 0 HG1 THR A 5 -9.816 5.125 -16.461 1.00 0.00 H new ATOM 0 HG21 THR A 5 -10.795 3.779 -14.708 1.00 0.00 H new ATOM 0 HG22 THR A 5 -10.741 2.016 -14.945 1.00 0.00 H new ATOM 0 HG23 THR A 5 -9.244 2.913 -14.598 1.00 0.00 H new ATOM 73 N LYS A 6 -7.130 2.874 -16.162 1.00 0.00 N ATOM 74 CA LYS A 6 -5.880 2.768 -15.358 1.00 0.00 C ATOM 75 C LYS A 6 -5.771 3.976 -14.425 1.00 0.00 C ATOM 76 O LYS A 6 -5.978 5.103 -14.826 1.00 0.00 O ATOM 77 CB LYS A 6 -4.671 2.738 -16.295 1.00 0.00 C ATOM 78 CG LYS A 6 -4.961 1.805 -17.473 1.00 0.00 C ATOM 79 CD LYS A 6 -3.857 1.947 -18.523 1.00 0.00 C ATOM 80 CE LYS A 6 -2.493 1.740 -17.860 1.00 0.00 C ATOM 81 NZ LYS A 6 -1.994 3.043 -17.335 1.00 0.00 N ATOM 0 H LYS A 6 -7.321 3.799 -16.547 1.00 0.00 H new ATOM 0 HA LYS A 6 -5.905 1.852 -14.767 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -4.454 3.743 -16.658 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -3.788 2.396 -15.755 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -5.018 0.773 -17.127 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -5.929 2.047 -17.913 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -4.001 1.216 -19.319 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -3.903 2.934 -18.984 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -2.577 1.017 -17.049 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -1.785 1.330 -18.580 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -0.975 3.127 -17.527 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -2.500 3.822 -17.802 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -2.158 3.090 -16.309 1.00 0.00 H new ATOM 95 N TYR A 7 -5.449 3.749 -13.181 1.00 0.00 N ATOM 96 CA TYR A 7 -5.328 4.885 -12.224 1.00 0.00 C ATOM 97 C TYR A 7 -3.854 5.261 -12.061 1.00 0.00 C ATOM 98 O TYR A 7 -3.043 4.463 -11.635 1.00 0.00 O ATOM 99 CB TYR A 7 -5.902 4.471 -10.867 1.00 0.00 C ATOM 100 CG TYR A 7 -7.334 4.936 -10.762 1.00 0.00 C ATOM 101 CD1 TYR A 7 -8.229 4.692 -11.811 1.00 0.00 C ATOM 102 CD2 TYR A 7 -7.769 5.613 -9.616 1.00 0.00 C ATOM 103 CE1 TYR A 7 -9.556 5.123 -11.714 1.00 0.00 C ATOM 104 CE2 TYR A 7 -9.096 6.045 -9.519 1.00 0.00 C ATOM 105 CZ TYR A 7 -9.991 5.800 -10.568 1.00 0.00 C ATOM 106 OH TYR A 7 -11.300 6.225 -10.472 1.00 0.00 O ATOM 0 H TYR A 7 -5.265 2.827 -12.786 1.00 0.00 H new ATOM 0 HA TYR A 7 -5.881 5.743 -12.607 1.00 0.00 H new ATOM 0 HB2 TYR A 7 -5.851 3.388 -10.754 1.00 0.00 H new ATOM 0 HB3 TYR A 7 -5.308 4.904 -10.062 1.00 0.00 H new ATOM 0 HD1 TYR A 7 -7.894 4.171 -12.696 1.00 0.00 H new ATOM 0 HD2 TYR A 7 -7.080 5.802 -8.806 1.00 0.00 H new ATOM 0 HE1 TYR A 7 -10.246 4.934 -12.523 1.00 0.00 H new ATOM 0 HE2 TYR A 7 -9.430 6.568 -8.635 1.00 0.00 H new ATOM 0 HH TYR A 7 -11.435 6.676 -9.613 1.00 0.00 H new ATOM 116 N PHE A 8 -3.502 6.472 -12.397 1.00 0.00 N ATOM 117 CA PHE A 8 -2.080 6.898 -12.261 1.00 0.00 C ATOM 118 C PHE A 8 -1.811 7.321 -10.816 1.00 0.00 C ATOM 119 O PHE A 8 -2.721 7.519 -10.037 1.00 0.00 O ATOM 120 CB PHE A 8 -1.810 8.079 -13.196 1.00 0.00 C ATOM 121 CG PHE A 8 -1.420 7.563 -14.561 1.00 0.00 C ATOM 122 CD1 PHE A 8 -2.313 6.766 -15.289 1.00 0.00 C ATOM 123 CD2 PHE A 8 -0.167 7.880 -15.098 1.00 0.00 C ATOM 124 CE1 PHE A 8 -1.951 6.287 -16.554 1.00 0.00 C ATOM 125 CE2 PHE A 8 0.194 7.402 -16.362 1.00 0.00 C ATOM 126 CZ PHE A 8 -0.697 6.605 -17.091 1.00 0.00 C ATOM 0 H PHE A 8 -4.136 7.184 -12.759 1.00 0.00 H new ATOM 0 HA PHE A 8 -1.425 6.068 -12.525 1.00 0.00 H new ATOM 0 HB2 PHE A 8 -2.698 8.706 -13.273 1.00 0.00 H new ATOM 0 HB3 PHE A 8 -1.014 8.703 -12.790 1.00 0.00 H new ATOM 0 HD1 PHE A 8 -3.280 6.521 -14.875 1.00 0.00 H new ATOM 0 HD2 PHE A 8 0.521 8.494 -14.536 1.00 0.00 H new ATOM 0 HE1 PHE A 8 -2.639 5.672 -17.116 1.00 0.00 H new ATOM 0 HE2 PHE A 8 1.161 7.648 -16.776 1.00 0.00 H new ATOM 0 HZ PHE A 8 -0.418 6.236 -18.067 1.00 0.00 H new ATOM 136 N TYR A 9 -0.565 7.460 -10.451 1.00 0.00 N ATOM 137 CA TYR A 9 -0.240 7.870 -9.055 1.00 0.00 C ATOM 138 C TYR A 9 1.223 8.312 -8.981 1.00 0.00 C ATOM 139 O TYR A 9 2.130 7.510 -9.088 1.00 0.00 O ATOM 140 CB TYR A 9 -0.463 6.686 -8.111 1.00 0.00 C ATOM 141 CG TYR A 9 0.004 7.055 -6.723 1.00 0.00 C ATOM 142 CD1 TYR A 9 1.341 6.859 -6.361 1.00 0.00 C ATOM 143 CD2 TYR A 9 -0.901 7.591 -5.800 1.00 0.00 C ATOM 144 CE1 TYR A 9 1.775 7.200 -5.074 1.00 0.00 C ATOM 145 CE2 TYR A 9 -0.468 7.933 -4.513 1.00 0.00 C ATOM 146 CZ TYR A 9 0.870 7.738 -4.150 1.00 0.00 C ATOM 147 OH TYR A 9 1.297 8.074 -2.882 1.00 0.00 O ATOM 0 H TYR A 9 0.240 7.308 -11.058 1.00 0.00 H new ATOM 0 HA TYR A 9 -0.885 8.697 -8.760 1.00 0.00 H new ATOM 0 HB2 TYR A 9 -1.519 6.416 -8.091 1.00 0.00 H new ATOM 0 HB3 TYR A 9 0.082 5.813 -8.470 1.00 0.00 H new ATOM 0 HD1 TYR A 9 2.038 6.445 -7.074 1.00 0.00 H new ATOM 0 HD2 TYR A 9 -1.933 7.741 -6.080 1.00 0.00 H new ATOM 0 HE1 TYR A 9 2.807 7.048 -4.794 1.00 0.00 H new ATOM 0 HE2 TYR A 9 -1.166 8.347 -3.801 1.00 0.00 H new ATOM 0 HH TYR A 9 0.544 8.434 -2.368 1.00 0.00 H new ATOM 157 N LYS A 10 1.460 9.582 -8.801 1.00 0.00 N ATOM 158 CA LYS A 10 2.864 10.074 -8.721 1.00 0.00 C ATOM 159 C LYS A 10 3.330 10.049 -7.263 1.00 0.00 C ATOM 160 O LYS A 10 2.973 10.900 -6.472 1.00 0.00 O ATOM 161 CB LYS A 10 2.935 11.506 -9.254 1.00 0.00 C ATOM 162 CG LYS A 10 4.372 11.828 -9.665 1.00 0.00 C ATOM 163 CD LYS A 10 4.575 13.344 -9.670 1.00 0.00 C ATOM 164 CE LYS A 10 3.737 13.969 -10.786 1.00 0.00 C ATOM 165 NZ LYS A 10 3.891 13.166 -12.032 1.00 0.00 N ATOM 0 H LYS A 10 0.742 10.300 -8.706 1.00 0.00 H new ATOM 0 HA LYS A 10 3.509 9.431 -9.321 1.00 0.00 H new ATOM 0 HB2 LYS A 10 2.267 11.621 -10.108 1.00 0.00 H new ATOM 0 HB3 LYS A 10 2.599 12.207 -8.490 1.00 0.00 H new ATOM 0 HG2 LYS A 10 5.073 11.359 -8.974 1.00 0.00 H new ATOM 0 HG3 LYS A 10 4.578 11.420 -10.654 1.00 0.00 H new ATOM 0 HD2 LYS A 10 4.286 13.763 -8.706 1.00 0.00 H new ATOM 0 HD3 LYS A 10 5.629 13.580 -9.817 1.00 0.00 H new ATOM 0 HE2 LYS A 10 2.688 14.005 -10.491 1.00 0.00 H new ATOM 0 HE3 LYS A 10 4.054 14.997 -10.962 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 3.635 13.749 -12.854 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 4.878 12.853 -12.123 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 3.267 12.335 -11.989 1.00 0.00 H new ATOM 179 N GLY A 11 4.124 9.079 -6.901 1.00 0.00 N ATOM 180 CA GLY A 11 4.612 9.001 -5.495 1.00 0.00 C ATOM 181 C GLY A 11 5.554 10.173 -5.214 1.00 0.00 C ATOM 182 O GLY A 11 5.508 11.191 -5.875 1.00 0.00 O ATOM 0 H GLY A 11 4.456 8.337 -7.518 1.00 0.00 H new ATOM 0 HA2 GLY A 11 3.769 9.025 -4.805 1.00 0.00 H new ATOM 0 HA3 GLY A 11 5.131 8.057 -5.331 1.00 0.00 H new ATOM 186 N GLU A 12 6.409 10.038 -4.237 1.00 0.00 N ATOM 187 CA GLU A 12 7.352 11.145 -3.913 1.00 0.00 C ATOM 188 C GLU A 12 8.018 11.639 -5.199 1.00 0.00 C ATOM 189 O GLU A 12 7.787 12.745 -5.645 1.00 0.00 O ATOM 190 CB GLU A 12 8.424 10.635 -2.948 1.00 0.00 C ATOM 191 CG GLU A 12 9.126 11.825 -2.289 1.00 0.00 C ATOM 192 CD GLU A 12 10.603 11.491 -2.073 1.00 0.00 C ATOM 193 OE1 GLU A 12 11.283 11.246 -3.056 1.00 0.00 O ATOM 194 OE2 GLU A 12 11.028 11.487 -0.931 1.00 0.00 O ATOM 0 H GLU A 12 6.495 9.209 -3.649 1.00 0.00 H new ATOM 0 HA GLU A 12 6.805 11.965 -3.448 1.00 0.00 H new ATOM 0 HB2 GLU A 12 7.971 10.000 -2.187 1.00 0.00 H new ATOM 0 HB3 GLU A 12 9.149 10.023 -3.484 1.00 0.00 H new ATOM 0 HG2 GLU A 12 9.031 12.711 -2.917 1.00 0.00 H new ATOM 0 HG3 GLU A 12 8.652 12.058 -1.336 1.00 0.00 H new ATOM 201 N ASN A 13 8.846 10.827 -5.800 1.00 0.00 N ATOM 202 CA ASN A 13 9.527 11.252 -7.056 1.00 0.00 C ATOM 203 C ASN A 13 9.327 10.182 -8.131 1.00 0.00 C ATOM 204 O ASN A 13 9.354 10.463 -9.312 1.00 0.00 O ATOM 205 CB ASN A 13 11.022 11.434 -6.789 1.00 0.00 C ATOM 206 CG ASN A 13 11.230 12.600 -5.820 1.00 0.00 C ATOM 207 OD1 ASN A 13 10.579 12.680 -4.798 1.00 0.00 O ATOM 208 ND2 ASN A 13 12.118 13.514 -6.099 1.00 0.00 N ATOM 0 H ASN A 13 9.080 9.889 -5.475 1.00 0.00 H new ATOM 0 HA ASN A 13 9.102 12.195 -7.399 1.00 0.00 H new ATOM 0 HB2 ASN A 13 11.441 10.519 -6.369 1.00 0.00 H new ATOM 0 HB3 ASN A 13 11.548 11.626 -7.724 1.00 0.00 H new ATOM 0 HD21 ASN A 13 12.265 14.295 -5.459 1.00 0.00 H new ATOM 0 HD22 ASN A 13 12.666 13.448 -6.957 1.00 0.00 H new ATOM 215 N THR A 14 9.126 8.955 -7.731 1.00 0.00 N ATOM 216 CA THR A 14 8.925 7.869 -8.732 1.00 0.00 C ATOM 217 C THR A 14 7.468 7.867 -9.197 1.00 0.00 C ATOM 218 O THR A 14 6.582 8.322 -8.499 1.00 0.00 O ATOM 219 CB THR A 14 9.259 6.519 -8.093 1.00 0.00 C ATOM 220 OG1 THR A 14 10.446 6.643 -7.322 1.00 0.00 O ATOM 221 CG2 THR A 14 9.465 5.471 -9.188 1.00 0.00 C ATOM 0 H THR A 14 9.092 8.659 -6.756 1.00 0.00 H new ATOM 0 HA THR A 14 9.579 8.038 -9.588 1.00 0.00 H new ATOM 0 HB THR A 14 8.437 6.208 -7.447 1.00 0.00 H new ATOM 0 HG1 THR A 14 10.223 6.600 -6.369 1.00 0.00 H new ATOM 0 HG21 THR A 14 9.703 4.510 -8.732 1.00 0.00 H new ATOM 0 HG22 THR A 14 8.553 5.377 -9.778 1.00 0.00 H new ATOM 0 HG23 THR A 14 10.286 5.778 -9.836 1.00 0.00 H new ATOM 229 N ASP A 15 7.211 7.360 -10.371 1.00 0.00 N ATOM 230 CA ASP A 15 5.811 7.328 -10.880 1.00 0.00 C ATOM 231 C ASP A 15 5.339 5.877 -10.986 1.00 0.00 C ATOM 232 O ASP A 15 6.061 5.012 -11.439 1.00 0.00 O ATOM 233 CB ASP A 15 5.754 7.985 -12.261 1.00 0.00 C ATOM 234 CG ASP A 15 4.304 8.322 -12.608 1.00 0.00 C ATOM 235 OD1 ASP A 15 3.447 7.489 -12.362 1.00 0.00 O ATOM 236 OD2 ASP A 15 4.073 9.409 -13.113 1.00 0.00 O ATOM 0 H ASP A 15 7.910 6.966 -11.000 1.00 0.00 H new ATOM 0 HA ASP A 15 5.163 7.871 -10.192 1.00 0.00 H new ATOM 0 HB2 ASP A 15 6.361 8.891 -12.270 1.00 0.00 H new ATOM 0 HB3 ASP A 15 6.172 7.314 -13.012 1.00 0.00 H new ATOM 241 N LEU A 16 4.132 5.604 -10.570 1.00 0.00 N ATOM 242 CA LEU A 16 3.617 4.208 -10.647 1.00 0.00 C ATOM 243 C LEU A 16 2.213 4.215 -11.256 1.00 0.00 C ATOM 244 O LEU A 16 1.490 5.187 -11.163 1.00 0.00 O ATOM 245 CB LEU A 16 3.560 3.607 -9.240 1.00 0.00 C ATOM 246 CG LEU A 16 4.959 3.615 -8.624 1.00 0.00 C ATOM 247 CD1 LEU A 16 4.846 3.642 -7.099 1.00 0.00 C ATOM 248 CD2 LEU A 16 5.713 2.356 -9.056 1.00 0.00 C ATOM 0 H LEU A 16 3.482 6.287 -10.181 1.00 0.00 H new ATOM 0 HA LEU A 16 4.281 3.610 -11.271 1.00 0.00 H new ATOM 0 HB2 LEU A 16 2.873 4.179 -8.616 1.00 0.00 H new ATOM 0 HB3 LEU A 16 3.176 2.588 -9.284 1.00 0.00 H new ATOM 0 HG LEU A 16 5.500 4.498 -8.964 1.00 0.00 H new ATOM 0 HD11 LEU A 16 5.844 3.648 -6.660 1.00 0.00 H new ATOM 0 HD12 LEU A 16 4.309 4.538 -6.790 1.00 0.00 H new ATOM 0 HD13 LEU A 16 4.305 2.759 -6.759 1.00 0.00 H new ATOM 0 HD21 LEU A 16 6.711 2.361 -8.617 1.00 0.00 H new ATOM 0 HD22 LEU A 16 5.172 1.473 -8.716 1.00 0.00 H new ATOM 0 HD23 LEU A 16 5.795 2.336 -10.143 1.00 0.00 H new ATOM 260 N ILE A 17 1.821 3.137 -11.880 1.00 0.00 N ATOM 261 CA ILE A 17 0.465 3.083 -12.493 1.00 0.00 C ATOM 262 C ILE A 17 -0.205 1.755 -12.134 1.00 0.00 C ATOM 263 O ILE A 17 0.441 0.731 -12.029 1.00 0.00 O ATOM 264 CB ILE A 17 0.588 3.198 -14.014 1.00 0.00 C ATOM 265 CG1 ILE A 17 1.273 4.519 -14.371 1.00 0.00 C ATOM 266 CG2 ILE A 17 -0.805 3.160 -14.644 1.00 0.00 C ATOM 267 CD1 ILE A 17 1.896 4.411 -15.764 1.00 0.00 C ATOM 0 H ILE A 17 2.382 2.292 -11.991 1.00 0.00 H new ATOM 0 HA ILE A 17 -0.138 3.908 -12.114 1.00 0.00 H new ATOM 0 HB ILE A 17 1.181 2.366 -14.394 1.00 0.00 H new ATOM 0 HG12 ILE A 17 0.550 5.334 -14.347 1.00 0.00 H new ATOM 0 HG13 ILE A 17 2.042 4.753 -13.634 1.00 0.00 H new ATOM 0 HG21 ILE A 17 -0.717 3.242 -15.727 1.00 0.00 H new ATOM 0 HG22 ILE A 17 -1.294 2.219 -14.390 1.00 0.00 H new ATOM 0 HG23 ILE A 17 -1.399 3.992 -14.264 1.00 0.00 H new ATOM 0 HD11 ILE A 17 2.384 5.352 -16.018 1.00 0.00 H new ATOM 0 HD12 ILE A 17 2.632 3.607 -15.772 1.00 0.00 H new ATOM 0 HD13 ILE A 17 1.117 4.197 -16.496 1.00 0.00 H new ATOM 279 N VAL A 18 -1.496 1.763 -11.944 1.00 0.00 N ATOM 280 CA VAL A 18 -2.205 0.501 -11.591 1.00 0.00 C ATOM 281 C VAL A 18 -3.457 0.359 -12.460 1.00 0.00 C ATOM 282 O VAL A 18 -3.815 1.252 -13.201 1.00 0.00 O ATOM 283 CB VAL A 18 -2.610 0.539 -10.117 1.00 0.00 C ATOM 284 CG1 VAL A 18 -1.355 0.523 -9.241 1.00 0.00 C ATOM 285 CG2 VAL A 18 -3.407 1.815 -9.841 1.00 0.00 C ATOM 0 H VAL A 18 -2.090 2.589 -12.018 1.00 0.00 H new ATOM 0 HA VAL A 18 -1.544 -0.348 -11.765 1.00 0.00 H new ATOM 0 HB VAL A 18 -3.224 -0.332 -9.887 1.00 0.00 H new ATOM 0 HG11 VAL A 18 -1.644 0.550 -8.190 1.00 0.00 H new ATOM 0 HG12 VAL A 18 -0.786 -0.386 -9.437 1.00 0.00 H new ATOM 0 HG13 VAL A 18 -0.740 1.393 -9.471 1.00 0.00 H new ATOM 0 HG21 VAL A 18 -3.696 1.843 -8.790 1.00 0.00 H new ATOM 0 HG22 VAL A 18 -2.792 2.685 -10.072 1.00 0.00 H new ATOM 0 HG23 VAL A 18 -4.301 1.827 -10.464 1.00 0.00 H new ATOM 295 N PHE A 19 -4.124 -0.760 -12.376 1.00 0.00 N ATOM 296 CA PHE A 19 -5.352 -0.958 -13.197 1.00 0.00 C ATOM 297 C PHE A 19 -6.584 -0.921 -12.291 1.00 0.00 C ATOM 298 O PHE A 19 -6.534 -1.318 -11.144 1.00 0.00 O ATOM 299 CB PHE A 19 -5.279 -2.314 -13.903 1.00 0.00 C ATOM 300 CG PHE A 19 -4.458 -2.182 -15.163 1.00 0.00 C ATOM 301 CD1 PHE A 19 -3.093 -1.882 -15.082 1.00 0.00 C ATOM 302 CD2 PHE A 19 -5.062 -2.361 -16.413 1.00 0.00 C ATOM 303 CE1 PHE A 19 -2.332 -1.760 -16.251 1.00 0.00 C ATOM 304 CE2 PHE A 19 -4.301 -2.239 -17.583 1.00 0.00 C ATOM 305 CZ PHE A 19 -2.936 -1.939 -17.502 1.00 0.00 C ATOM 0 H PHE A 19 -3.872 -1.545 -11.775 1.00 0.00 H new ATOM 0 HA PHE A 19 -5.424 -0.164 -13.940 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -4.833 -3.057 -13.242 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -6.282 -2.664 -14.145 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -2.627 -1.745 -14.118 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -6.115 -2.593 -16.476 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -1.279 -1.528 -16.188 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -4.767 -2.376 -18.547 1.00 0.00 H new ATOM 0 HZ PHE A 19 -2.349 -1.846 -18.404 1.00 0.00 H new ATOM 315 N ALA A 20 -7.690 -0.448 -12.796 1.00 0.00 N ATOM 316 CA ALA A 20 -8.923 -0.386 -11.962 1.00 0.00 C ATOM 317 C ALA A 20 -10.110 -0.920 -12.767 1.00 0.00 C ATOM 318 O ALA A 20 -9.976 -1.292 -13.916 1.00 0.00 O ATOM 319 CB ALA A 20 -9.193 1.064 -11.558 1.00 0.00 C ATOM 0 H ALA A 20 -7.793 -0.102 -13.750 1.00 0.00 H new ATOM 0 HA ALA A 20 -8.787 -0.993 -11.067 1.00 0.00 H new ATOM 0 HB1 ALA A 20 -10.095 1.110 -10.948 1.00 0.00 H new ATOM 0 HB2 ALA A 20 -8.348 1.446 -10.985 1.00 0.00 H new ATOM 0 HB3 ALA A 20 -9.329 1.672 -12.453 1.00 0.00 H new ATOM 325 N ALA A 21 -11.271 -0.963 -12.172 1.00 0.00 N ATOM 326 CA ALA A 21 -12.464 -1.473 -12.904 1.00 0.00 C ATOM 327 C ALA A 21 -13.203 -0.303 -13.556 1.00 0.00 C ATOM 328 O ALA A 21 -13.441 -0.293 -14.748 1.00 0.00 O ATOM 329 CB ALA A 21 -13.398 -2.184 -11.922 1.00 0.00 C ATOM 0 H ALA A 21 -11.444 -0.667 -11.211 1.00 0.00 H new ATOM 0 HA ALA A 21 -12.145 -2.174 -13.675 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -14.271 -2.558 -12.456 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -12.872 -3.018 -11.459 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -13.717 -1.483 -11.151 1.00 0.00 H new ATOM 335 N SER A 22 -13.569 0.684 -12.785 1.00 0.00 N ATOM 336 CA SER A 22 -14.292 1.852 -13.361 1.00 0.00 C ATOM 337 C SER A 22 -14.436 2.941 -12.297 1.00 0.00 C ATOM 338 O SER A 22 -14.218 2.709 -11.124 1.00 0.00 O ATOM 339 CB SER A 22 -15.679 1.411 -13.831 1.00 0.00 C ATOM 340 OG SER A 22 -15.596 0.953 -15.174 1.00 0.00 O ATOM 0 H SER A 22 -13.398 0.732 -11.781 1.00 0.00 H new ATOM 0 HA SER A 22 -13.729 2.245 -14.207 1.00 0.00 H new ATOM 0 HB2 SER A 22 -16.059 0.618 -13.187 1.00 0.00 H new ATOM 0 HB3 SER A 22 -16.381 2.242 -13.761 1.00 0.00 H new ATOM 0 HG SER A 22 -14.798 0.394 -15.280 1.00 0.00 H new ATOM 346 N GLU A 23 -14.802 4.129 -12.695 1.00 0.00 N ATOM 347 CA GLU A 23 -14.959 5.231 -11.706 1.00 0.00 C ATOM 348 C GLU A 23 -16.212 4.985 -10.862 1.00 0.00 C ATOM 349 O GLU A 23 -16.344 5.495 -9.767 1.00 0.00 O ATOM 350 CB GLU A 23 -15.096 6.564 -12.446 1.00 0.00 C ATOM 351 CG GLU A 23 -14.406 7.668 -11.642 1.00 0.00 C ATOM 352 CD GLU A 23 -14.456 8.979 -12.430 1.00 0.00 C ATOM 353 OE1 GLU A 23 -15.207 9.042 -13.389 1.00 0.00 O ATOM 354 OE2 GLU A 23 -13.743 9.897 -12.059 1.00 0.00 O ATOM 0 H GLU A 23 -14.999 4.383 -13.663 1.00 0.00 H new ATOM 0 HA GLU A 23 -14.084 5.264 -11.056 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -14.650 6.489 -13.438 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -16.149 6.807 -12.588 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -14.898 7.792 -10.677 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -13.371 7.392 -11.439 1.00 0.00 H new ATOM 361 N GLU A 24 -17.132 4.208 -11.362 1.00 0.00 N ATOM 362 CA GLU A 24 -18.375 3.931 -10.589 1.00 0.00 C ATOM 363 C GLU A 24 -18.043 3.037 -9.393 1.00 0.00 C ATOM 364 O GLU A 24 -18.144 3.447 -8.253 1.00 0.00 O ATOM 365 CB GLU A 24 -19.388 3.221 -11.489 1.00 0.00 C ATOM 366 CG GLU A 24 -20.666 2.937 -10.697 1.00 0.00 C ATOM 367 CD GLU A 24 -21.185 4.238 -10.081 1.00 0.00 C ATOM 368 OE1 GLU A 24 -21.317 5.205 -10.814 1.00 0.00 O ATOM 369 OE2 GLU A 24 -21.441 4.245 -8.888 1.00 0.00 O ATOM 0 H GLU A 24 -17.077 3.753 -12.273 1.00 0.00 H new ATOM 0 HA GLU A 24 -18.799 4.871 -10.235 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -19.616 3.840 -12.357 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -18.966 2.289 -11.864 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -21.423 2.505 -11.351 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -20.466 2.206 -9.914 1.00 0.00 H new ATOM 376 N LEU A 25 -17.648 1.818 -9.641 1.00 0.00 N ATOM 377 CA LEU A 25 -17.312 0.900 -8.517 1.00 0.00 C ATOM 378 C LEU A 25 -16.279 1.565 -7.606 1.00 0.00 C ATOM 379 O LEU A 25 -16.436 1.610 -6.402 1.00 0.00 O ATOM 380 CB LEU A 25 -16.736 -0.402 -9.078 1.00 0.00 C ATOM 381 CG LEU A 25 -17.850 -1.207 -9.746 1.00 0.00 C ATOM 382 CD1 LEU A 25 -17.315 -1.857 -11.025 1.00 0.00 C ATOM 383 CD2 LEU A 25 -18.336 -2.297 -8.788 1.00 0.00 C ATOM 0 H LEU A 25 -17.544 1.419 -10.574 1.00 0.00 H new ATOM 0 HA LEU A 25 -18.213 0.682 -7.944 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -15.949 -0.183 -9.799 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -16.281 -0.985 -8.277 1.00 0.00 H new ATOM 0 HG LEU A 25 -18.678 -0.543 -9.994 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -18.110 -2.431 -11.501 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -16.967 -1.083 -11.709 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -16.487 -2.521 -10.777 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -19.131 -2.872 -9.264 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -17.507 -2.960 -8.541 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -18.717 -1.837 -7.876 1.00 0.00 H new ATOM 395 N VAL A 26 -15.221 2.083 -8.170 1.00 0.00 N ATOM 396 CA VAL A 26 -14.180 2.744 -7.334 1.00 0.00 C ATOM 397 C VAL A 26 -14.846 3.736 -6.378 1.00 0.00 C ATOM 398 O VAL A 26 -14.600 3.726 -5.189 1.00 0.00 O ATOM 399 CB VAL A 26 -13.198 3.490 -8.240 1.00 0.00 C ATOM 400 CG1 VAL A 26 -12.403 4.498 -7.409 1.00 0.00 C ATOM 401 CG2 VAL A 26 -12.234 2.488 -8.879 1.00 0.00 C ATOM 0 H VAL A 26 -15.033 2.077 -9.173 1.00 0.00 H new ATOM 0 HA VAL A 26 -13.644 1.990 -6.758 1.00 0.00 H new ATOM 0 HB VAL A 26 -13.750 4.015 -9.020 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -11.703 5.030 -8.054 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -13.087 5.211 -6.950 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -11.851 3.972 -6.630 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -11.534 3.018 -9.525 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -11.683 1.965 -8.098 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -12.798 1.767 -9.470 1.00 0.00 H new ATOM 411 N ASP A 27 -15.688 4.593 -6.889 1.00 0.00 N ATOM 412 CA ASP A 27 -16.369 5.583 -6.008 1.00 0.00 C ATOM 413 C ASP A 27 -17.146 4.845 -4.917 1.00 0.00 C ATOM 414 O ASP A 27 -17.332 5.347 -3.825 1.00 0.00 O ATOM 415 CB ASP A 27 -17.335 6.427 -6.841 1.00 0.00 C ATOM 416 CG ASP A 27 -17.593 7.758 -6.132 1.00 0.00 C ATOM 417 OD1 ASP A 27 -17.554 7.774 -4.912 1.00 0.00 O ATOM 418 OD2 ASP A 27 -17.824 8.738 -6.820 1.00 0.00 O ATOM 0 H ASP A 27 -15.933 4.650 -7.877 1.00 0.00 H new ATOM 0 HA ASP A 27 -15.624 6.232 -5.547 1.00 0.00 H new ATOM 0 HB2 ASP A 27 -16.917 6.606 -7.832 1.00 0.00 H new ATOM 0 HB3 ASP A 27 -18.273 5.891 -6.983 1.00 0.00 H new ATOM 423 N GLU A 28 -17.602 3.656 -5.202 1.00 0.00 N ATOM 424 CA GLU A 28 -18.368 2.887 -4.180 1.00 0.00 C ATOM 425 C GLU A 28 -17.407 2.367 -3.109 1.00 0.00 C ATOM 426 O GLU A 28 -17.745 2.282 -1.945 1.00 0.00 O ATOM 427 CB GLU A 28 -19.071 1.706 -4.852 1.00 0.00 C ATOM 428 CG GLU A 28 -20.541 2.054 -5.087 1.00 0.00 C ATOM 429 CD GLU A 28 -21.120 1.131 -6.161 1.00 0.00 C ATOM 430 OE1 GLU A 28 -20.972 1.449 -7.330 1.00 0.00 O ATOM 431 OE2 GLU A 28 -21.701 0.121 -5.797 1.00 0.00 O ATOM 0 H GLU A 28 -17.478 3.184 -6.098 1.00 0.00 H new ATOM 0 HA GLU A 28 -19.111 3.536 -3.717 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -18.586 1.472 -5.800 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -18.992 0.818 -4.225 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -21.103 1.947 -4.159 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -20.634 3.094 -5.398 1.00 0.00 H new ATOM 438 N TYR A 29 -16.210 2.017 -3.493 1.00 0.00 N ATOM 439 CA TYR A 29 -15.229 1.502 -2.496 1.00 0.00 C ATOM 440 C TYR A 29 -14.930 2.593 -1.465 1.00 0.00 C ATOM 441 O TYR A 29 -14.952 2.356 -0.274 1.00 0.00 O ATOM 442 CB TYR A 29 -13.934 1.107 -3.211 1.00 0.00 C ATOM 443 CG TYR A 29 -12.918 0.646 -2.193 1.00 0.00 C ATOM 444 CD1 TYR A 29 -13.182 -0.477 -1.400 1.00 0.00 C ATOM 445 CD2 TYR A 29 -11.713 1.343 -2.043 1.00 0.00 C ATOM 446 CE1 TYR A 29 -12.239 -0.904 -0.457 1.00 0.00 C ATOM 447 CE2 TYR A 29 -10.771 0.916 -1.099 1.00 0.00 C ATOM 448 CZ TYR A 29 -11.034 -0.208 -0.307 1.00 0.00 C ATOM 449 OH TYR A 29 -10.106 -0.629 0.624 1.00 0.00 O ATOM 0 H TYR A 29 -15.869 2.065 -4.453 1.00 0.00 H new ATOM 0 HA TYR A 29 -15.646 0.630 -1.992 1.00 0.00 H new ATOM 0 HB2 TYR A 29 -14.131 0.312 -3.930 1.00 0.00 H new ATOM 0 HB3 TYR A 29 -13.543 1.955 -3.773 1.00 0.00 H new ATOM 0 HD1 TYR A 29 -14.112 -1.014 -1.515 1.00 0.00 H new ATOM 0 HD2 TYR A 29 -11.510 2.209 -2.655 1.00 0.00 H new ATOM 0 HE1 TYR A 29 -12.442 -1.771 0.155 1.00 0.00 H new ATOM 0 HE2 TYR A 29 -9.842 1.454 -0.982 1.00 0.00 H new ATOM 0 HH TYR A 29 -9.252 -0.175 0.463 1.00 0.00 H new ATOM 459 N LEU A 30 -14.651 3.786 -1.914 1.00 0.00 N ATOM 460 CA LEU A 30 -14.352 4.889 -0.959 1.00 0.00 C ATOM 461 C LEU A 30 -15.348 4.844 0.201 1.00 0.00 C ATOM 462 O LEU A 30 -14.973 4.703 1.348 1.00 0.00 O ATOM 463 CB LEU A 30 -14.469 6.234 -1.681 1.00 0.00 C ATOM 464 CG LEU A 30 -13.567 6.230 -2.917 1.00 0.00 C ATOM 465 CD1 LEU A 30 -13.691 7.570 -3.643 1.00 0.00 C ATOM 466 CD2 LEU A 30 -12.114 6.018 -2.485 1.00 0.00 C ATOM 0 H LEU A 30 -14.617 4.044 -2.900 1.00 0.00 H new ATOM 0 HA LEU A 30 -13.340 4.771 -0.573 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -15.504 6.413 -1.973 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -14.182 7.045 -1.011 1.00 0.00 H new ATOM 0 HG LEU A 30 -13.870 5.425 -3.586 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -13.049 7.568 -4.524 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -14.726 7.724 -3.949 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -13.387 8.376 -2.974 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -11.470 6.015 -3.364 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -11.812 6.824 -1.817 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -12.024 5.064 -1.966 1.00 0.00 H new ATOM 478 N LYS A 31 -16.615 4.962 -0.088 1.00 0.00 N ATOM 479 CA LYS A 31 -17.633 4.924 1.000 1.00 0.00 C ATOM 480 C LYS A 31 -17.652 3.530 1.630 1.00 0.00 C ATOM 481 O LYS A 31 -18.133 3.342 2.731 1.00 0.00 O ATOM 482 CB LYS A 31 -19.012 5.241 0.419 1.00 0.00 C ATOM 483 CG LYS A 31 -18.997 6.638 -0.206 1.00 0.00 C ATOM 484 CD LYS A 31 -19.838 7.589 0.646 1.00 0.00 C ATOM 485 CE LYS A 31 -21.321 7.381 0.332 1.00 0.00 C ATOM 486 NZ LYS A 31 -21.830 8.540 -0.454 1.00 0.00 N ATOM 0 H LYS A 31 -16.989 5.083 -1.029 1.00 0.00 H new ATOM 0 HA LYS A 31 -17.381 5.663 1.761 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -19.281 4.498 -0.332 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -19.768 5.190 1.202 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -17.973 7.005 -0.276 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -19.391 6.598 -1.221 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -19.651 7.408 1.704 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -19.554 8.622 0.444 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -21.458 6.458 -0.231 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -21.888 7.278 1.257 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -22.838 8.399 -0.668 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -21.712 9.413 0.099 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -21.296 8.618 -1.343 1.00 0.00 H new ATOM 500 N ASN A 32 -17.132 2.551 0.941 1.00 0.00 N ATOM 501 CA ASN A 32 -17.120 1.171 1.500 1.00 0.00 C ATOM 502 C ASN A 32 -15.677 0.663 1.573 1.00 0.00 C ATOM 503 O ASN A 32 -15.190 0.027 0.660 1.00 0.00 O ATOM 504 CB ASN A 32 -17.938 0.247 0.596 1.00 0.00 C ATOM 505 CG ASN A 32 -18.106 -1.114 1.275 1.00 0.00 C ATOM 506 OD1 ASN A 32 -18.191 -1.197 2.484 1.00 0.00 O ATOM 507 ND2 ASN A 32 -18.158 -2.193 0.542 1.00 0.00 N ATOM 0 H ASN A 32 -16.715 2.648 0.015 1.00 0.00 H new ATOM 0 HA ASN A 32 -17.555 1.181 2.500 1.00 0.00 H new ATOM 0 HB2 ASN A 32 -18.914 0.688 0.395 1.00 0.00 H new ATOM 0 HB3 ASN A 32 -17.439 0.126 -0.366 1.00 0.00 H new ATOM 0 HD21 ASN A 32 -18.270 -3.105 0.984 1.00 0.00 H new ATOM 0 HD22 ASN A 32 -18.087 -2.124 -0.473 1.00 0.00 H new ATOM 514 N PRO A 33 -15.001 0.946 2.654 1.00 0.00 N ATOM 515 CA PRO A 33 -13.590 0.518 2.856 1.00 0.00 C ATOM 516 C PRO A 33 -13.484 -0.947 3.288 1.00 0.00 C ATOM 517 O PRO A 33 -12.882 -1.266 4.294 1.00 0.00 O ATOM 518 CB PRO A 33 -13.091 1.441 3.966 1.00 0.00 C ATOM 519 CG PRO A 33 -14.307 1.823 4.748 1.00 0.00 C ATOM 520 CD PRO A 33 -15.509 1.708 3.806 1.00 0.00 C ATOM 0 HA PRO A 33 -13.009 0.586 1.937 1.00 0.00 H new ATOM 0 HB2 PRO A 33 -12.361 0.935 4.598 1.00 0.00 H new ATOM 0 HB3 PRO A 33 -12.598 2.321 3.552 1.00 0.00 H new ATOM 0 HG2 PRO A 33 -14.431 1.168 5.610 1.00 0.00 H new ATOM 0 HG3 PRO A 33 -14.214 2.840 5.130 1.00 0.00 H new ATOM 0 HD2 PRO A 33 -16.342 1.194 4.286 1.00 0.00 H new ATOM 0 HD3 PRO A 33 -15.872 2.690 3.504 1.00 0.00 H new ATOM 528 N SER A 34 -14.064 -1.839 2.533 1.00 0.00 N ATOM 529 CA SER A 34 -13.996 -3.282 2.899 1.00 0.00 C ATOM 530 C SER A 34 -13.024 -4.000 1.961 1.00 0.00 C ATOM 531 O SER A 34 -13.330 -4.259 0.814 1.00 0.00 O ATOM 532 CB SER A 34 -15.386 -3.907 2.768 1.00 0.00 C ATOM 533 OG SER A 34 -15.662 -4.685 3.925 1.00 0.00 O ATOM 0 H SER A 34 -14.582 -1.631 1.679 1.00 0.00 H new ATOM 0 HA SER A 34 -13.649 -3.380 3.927 1.00 0.00 H new ATOM 0 HB2 SER A 34 -16.139 -3.127 2.652 1.00 0.00 H new ATOM 0 HB3 SER A 34 -15.434 -4.531 1.876 1.00 0.00 H new ATOM 0 HG SER A 34 -16.553 -5.086 3.845 1.00 0.00 H new ATOM 539 N ILE A 35 -11.853 -4.323 2.439 1.00 0.00 N ATOM 540 CA ILE A 35 -10.862 -5.022 1.573 1.00 0.00 C ATOM 541 C ILE A 35 -11.569 -6.108 0.761 1.00 0.00 C ATOM 542 O ILE A 35 -11.193 -6.406 -0.355 1.00 0.00 O ATOM 543 CB ILE A 35 -9.783 -5.664 2.450 1.00 0.00 C ATOM 544 CG1 ILE A 35 -8.710 -6.291 1.556 1.00 0.00 C ATOM 545 CG2 ILE A 35 -10.414 -6.747 3.326 1.00 0.00 C ATOM 546 CD1 ILE A 35 -7.422 -6.478 2.360 1.00 0.00 C ATOM 0 H ILE A 35 -11.540 -4.133 3.391 1.00 0.00 H new ATOM 0 HA ILE A 35 -10.402 -4.303 0.895 1.00 0.00 H new ATOM 0 HB ILE A 35 -9.330 -4.903 3.086 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -9.056 -7.252 1.174 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -8.523 -5.653 0.692 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -9.646 -7.204 3.950 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -11.180 -6.301 3.961 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -10.867 -7.509 2.692 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -6.658 -6.924 1.724 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -7.074 -5.510 2.720 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -7.615 -7.133 3.209 1.00 0.00 H new ATOM 558 N GLY A 36 -12.593 -6.703 1.312 1.00 0.00 N ATOM 559 CA GLY A 36 -13.323 -7.769 0.570 1.00 0.00 C ATOM 560 C GLY A 36 -13.787 -7.228 -0.784 1.00 0.00 C ATOM 561 O GLY A 36 -13.712 -7.901 -1.792 1.00 0.00 O ATOM 0 H GLY A 36 -12.955 -6.497 2.243 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -12.675 -8.633 0.425 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -14.181 -8.108 1.151 1.00 0.00 H new ATOM 565 N LYS A 37 -14.266 -6.014 -0.815 1.00 0.00 N ATOM 566 CA LYS A 37 -14.735 -5.432 -2.104 1.00 0.00 C ATOM 567 C LYS A 37 -13.528 -5.094 -2.981 1.00 0.00 C ATOM 568 O LYS A 37 -13.613 -5.083 -4.194 1.00 0.00 O ATOM 569 CB LYS A 37 -15.536 -4.157 -1.826 1.00 0.00 C ATOM 570 CG LYS A 37 -15.796 -3.420 -3.141 1.00 0.00 C ATOM 571 CD LYS A 37 -17.047 -2.551 -3.002 1.00 0.00 C ATOM 572 CE LYS A 37 -17.207 -1.680 -4.248 1.00 0.00 C ATOM 573 NZ LYS A 37 -16.821 -2.465 -5.455 1.00 0.00 N ATOM 0 H LYS A 37 -14.353 -5.401 -0.004 1.00 0.00 H new ATOM 0 HA LYS A 37 -15.368 -6.154 -2.620 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -16.481 -4.407 -1.344 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -14.988 -3.513 -1.138 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -14.937 -2.800 -3.399 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -15.927 -4.137 -3.952 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -17.927 -3.181 -2.871 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -16.969 -1.923 -2.114 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -18.239 -1.340 -4.337 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -16.584 -0.790 -4.165 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -17.118 -1.954 -6.311 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -15.789 -2.595 -5.469 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -17.286 -3.395 -5.428 1.00 0.00 H new ATOM 587 N LEU A 38 -12.404 -4.817 -2.380 1.00 0.00 N ATOM 588 CA LEU A 38 -11.193 -4.479 -3.181 1.00 0.00 C ATOM 589 C LEU A 38 -10.958 -5.566 -4.232 1.00 0.00 C ATOM 590 O LEU A 38 -10.594 -5.285 -5.358 1.00 0.00 O ATOM 591 CB LEU A 38 -9.978 -4.392 -2.256 1.00 0.00 C ATOM 592 CG LEU A 38 -8.962 -3.409 -2.839 1.00 0.00 C ATOM 593 CD1 LEU A 38 -9.144 -2.038 -2.184 1.00 0.00 C ATOM 594 CD2 LEU A 38 -7.545 -3.918 -2.566 1.00 0.00 C ATOM 0 H LEU A 38 -12.271 -4.810 -1.369 1.00 0.00 H new ATOM 0 HA LEU A 38 -11.341 -3.520 -3.677 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -10.287 -4.066 -1.263 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -9.523 -5.376 -2.142 1.00 0.00 H new ATOM 0 HG LEU A 38 -9.117 -3.322 -3.914 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -8.420 -1.337 -2.599 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -10.153 -1.674 -2.377 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -8.989 -2.125 -1.109 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -6.820 -3.218 -2.981 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -7.390 -4.005 -1.491 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -7.413 -4.895 -3.031 1.00 0.00 H new ATOM 606 N SER A 39 -11.160 -6.805 -3.875 1.00 0.00 N ATOM 607 CA SER A 39 -10.947 -7.907 -4.855 1.00 0.00 C ATOM 608 C SER A 39 -11.846 -7.688 -6.074 1.00 0.00 C ATOM 609 O SER A 39 -11.597 -8.211 -7.141 1.00 0.00 O ATOM 610 CB SER A 39 -11.293 -9.245 -4.199 1.00 0.00 C ATOM 611 OG SER A 39 -11.069 -10.295 -5.130 1.00 0.00 O ATOM 0 H SER A 39 -11.463 -7.101 -2.947 1.00 0.00 H new ATOM 0 HA SER A 39 -9.904 -7.916 -5.171 1.00 0.00 H new ATOM 0 HB2 SER A 39 -10.682 -9.396 -3.309 1.00 0.00 H new ATOM 0 HB3 SER A 39 -12.334 -9.246 -3.875 1.00 0.00 H new ATOM 0 HG SER A 39 -11.288 -11.154 -4.713 1.00 0.00 H new ATOM 617 N GLU A 40 -12.890 -6.920 -5.923 1.00 0.00 N ATOM 618 CA GLU A 40 -13.803 -6.671 -7.074 1.00 0.00 C ATOM 619 C GLU A 40 -13.287 -5.482 -7.886 1.00 0.00 C ATOM 620 O GLU A 40 -13.411 -5.442 -9.094 1.00 0.00 O ATOM 621 CB GLU A 40 -15.208 -6.361 -6.553 1.00 0.00 C ATOM 622 CG GLU A 40 -15.872 -7.654 -6.075 1.00 0.00 C ATOM 623 CD GLU A 40 -16.998 -7.318 -5.096 1.00 0.00 C ATOM 624 OE1 GLU A 40 -18.035 -6.863 -5.550 1.00 0.00 O ATOM 625 OE2 GLU A 40 -16.805 -7.521 -3.908 1.00 0.00 O ATOM 0 H GLU A 40 -13.150 -6.455 -5.053 1.00 0.00 H new ATOM 0 HA GLU A 40 -13.838 -7.557 -7.708 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -15.154 -5.643 -5.734 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -15.806 -5.902 -7.340 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -16.269 -8.208 -6.926 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -15.136 -8.296 -5.592 1.00 0.00 H new ATOM 632 N VAL A 41 -12.710 -4.511 -7.233 1.00 0.00 N ATOM 633 CA VAL A 41 -12.187 -3.325 -7.968 1.00 0.00 C ATOM 634 C VAL A 41 -10.880 -3.696 -8.672 1.00 0.00 C ATOM 635 O VAL A 41 -10.830 -3.835 -9.878 1.00 0.00 O ATOM 636 CB VAL A 41 -11.928 -2.186 -6.981 1.00 0.00 C ATOM 637 CG1 VAL A 41 -10.959 -1.180 -7.603 1.00 0.00 C ATOM 638 CG2 VAL A 41 -13.249 -1.485 -6.655 1.00 0.00 C ATOM 0 H VAL A 41 -12.578 -4.488 -6.222 1.00 0.00 H new ATOM 0 HA VAL A 41 -12.920 -3.005 -8.708 1.00 0.00 H new ATOM 0 HB VAL A 41 -11.494 -2.590 -6.067 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -10.775 -0.369 -6.899 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -10.018 -1.678 -7.837 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -11.392 -0.775 -8.518 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -13.066 -0.673 -5.951 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -13.682 -1.082 -7.570 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -13.941 -2.201 -6.211 1.00 0.00 H new ATOM 648 N VAL A 42 -9.819 -3.856 -7.928 1.00 0.00 N ATOM 649 CA VAL A 42 -8.517 -4.217 -8.555 1.00 0.00 C ATOM 650 C VAL A 42 -8.670 -5.523 -9.338 1.00 0.00 C ATOM 651 O VAL A 42 -8.977 -6.559 -8.782 1.00 0.00 O ATOM 652 CB VAL A 42 -7.460 -4.397 -7.465 1.00 0.00 C ATOM 653 CG1 VAL A 42 -6.086 -4.590 -8.111 1.00 0.00 C ATOM 654 CG2 VAL A 42 -7.433 -3.155 -6.571 1.00 0.00 C ATOM 0 H VAL A 42 -9.798 -3.752 -6.914 1.00 0.00 H new ATOM 0 HA VAL A 42 -8.208 -3.422 -9.234 1.00 0.00 H new ATOM 0 HB VAL A 42 -7.704 -5.273 -6.864 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -5.333 -4.718 -7.333 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -6.104 -5.475 -8.748 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -5.841 -3.715 -8.713 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -6.680 -3.283 -5.794 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -7.189 -2.279 -7.172 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -8.411 -3.018 -6.110 1.00 0.00 H new ATOM 664 N GLU A 43 -8.457 -5.483 -10.624 1.00 0.00 N ATOM 665 CA GLU A 43 -8.589 -6.723 -11.441 1.00 0.00 C ATOM 666 C GLU A 43 -7.266 -7.488 -11.421 1.00 0.00 C ATOM 667 O GLU A 43 -7.239 -8.702 -11.467 1.00 0.00 O ATOM 668 CB GLU A 43 -8.942 -6.349 -12.882 1.00 0.00 C ATOM 669 CG GLU A 43 -10.462 -6.350 -13.054 1.00 0.00 C ATOM 670 CD GLU A 43 -10.909 -7.693 -13.636 1.00 0.00 C ATOM 671 OE1 GLU A 43 -10.354 -8.093 -14.646 1.00 0.00 O ATOM 672 OE2 GLU A 43 -11.798 -8.299 -13.061 1.00 0.00 O ATOM 0 H GLU A 43 -8.197 -4.646 -11.145 1.00 0.00 H new ATOM 0 HA GLU A 43 -9.378 -7.351 -11.026 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -8.539 -5.365 -13.122 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -8.487 -7.057 -13.574 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -10.947 -6.178 -12.093 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -10.765 -5.537 -13.714 1.00 0.00 H new ATOM 679 N LEU A 44 -6.166 -6.789 -11.351 1.00 0.00 N ATOM 680 CA LEU A 44 -4.845 -7.477 -11.328 1.00 0.00 C ATOM 681 C LEU A 44 -3.943 -6.811 -10.287 1.00 0.00 C ATOM 682 O LEU A 44 -3.572 -5.661 -10.417 1.00 0.00 O ATOM 683 CB LEU A 44 -4.192 -7.375 -12.708 1.00 0.00 C ATOM 684 CG LEU A 44 -2.793 -7.990 -12.658 1.00 0.00 C ATOM 685 CD1 LEU A 44 -2.903 -9.486 -12.357 1.00 0.00 C ATOM 686 CD2 LEU A 44 -2.102 -7.793 -14.009 1.00 0.00 C ATOM 0 H LEU A 44 -6.126 -5.771 -11.309 1.00 0.00 H new ATOM 0 HA LEU A 44 -4.986 -8.527 -11.070 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -4.801 -7.892 -13.449 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -4.131 -6.331 -13.017 1.00 0.00 H new ATOM 0 HG LEU A 44 -2.210 -7.504 -11.876 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -1.906 -9.924 -12.321 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -3.396 -9.628 -11.396 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -3.485 -9.973 -13.139 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -1.104 -8.231 -13.975 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -2.685 -8.280 -14.790 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -2.023 -6.728 -14.225 1.00 0.00 H new ATOM 698 N PHE A 45 -3.587 -7.524 -9.253 1.00 0.00 N ATOM 699 CA PHE A 45 -2.710 -6.931 -8.205 1.00 0.00 C ATOM 700 C PHE A 45 -1.290 -6.778 -8.753 1.00 0.00 C ATOM 701 O PHE A 45 -0.494 -7.695 -8.703 1.00 0.00 O ATOM 702 CB PHE A 45 -2.689 -7.846 -6.980 1.00 0.00 C ATOM 703 CG PHE A 45 -3.970 -7.671 -6.198 1.00 0.00 C ATOM 704 CD1 PHE A 45 -4.303 -6.417 -5.673 1.00 0.00 C ATOM 705 CD2 PHE A 45 -4.823 -8.762 -5.999 1.00 0.00 C ATOM 706 CE1 PHE A 45 -5.490 -6.254 -4.949 1.00 0.00 C ATOM 707 CE2 PHE A 45 -6.011 -8.599 -5.275 1.00 0.00 C ATOM 708 CZ PHE A 45 -6.343 -7.346 -4.749 1.00 0.00 C ATOM 0 H PHE A 45 -3.866 -8.491 -9.089 1.00 0.00 H new ATOM 0 HA PHE A 45 -3.096 -5.952 -7.920 1.00 0.00 H new ATOM 0 HB2 PHE A 45 -2.579 -8.885 -7.291 1.00 0.00 H new ATOM 0 HB3 PHE A 45 -1.831 -7.609 -6.351 1.00 0.00 H new ATOM 0 HD1 PHE A 45 -3.644 -5.575 -5.826 1.00 0.00 H new ATOM 0 HD2 PHE A 45 -4.566 -9.730 -6.404 1.00 0.00 H new ATOM 0 HE1 PHE A 45 -5.748 -5.286 -4.545 1.00 0.00 H new ATOM 0 HE2 PHE A 45 -6.671 -9.441 -5.123 1.00 0.00 H new ATOM 0 HZ PHE A 45 -7.258 -7.221 -4.188 1.00 0.00 H new ATOM 718 N GLU A 46 -0.966 -5.627 -9.275 1.00 0.00 N ATOM 719 CA GLU A 46 0.402 -5.416 -9.825 1.00 0.00 C ATOM 720 C GLU A 46 0.623 -3.924 -10.081 1.00 0.00 C ATOM 721 O GLU A 46 -0.314 -3.163 -10.223 1.00 0.00 O ATOM 722 CB GLU A 46 0.549 -6.186 -11.139 1.00 0.00 C ATOM 723 CG GLU A 46 1.951 -6.794 -11.220 1.00 0.00 C ATOM 724 CD GLU A 46 1.934 -8.199 -10.615 1.00 0.00 C ATOM 725 OE1 GLU A 46 2.115 -8.306 -9.413 1.00 0.00 O ATOM 726 OE2 GLU A 46 1.742 -9.143 -11.362 1.00 0.00 O ATOM 0 H GLU A 46 -1.590 -4.823 -9.344 1.00 0.00 H new ATOM 0 HA GLU A 46 1.141 -5.776 -9.109 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -0.204 -6.972 -11.198 1.00 0.00 H new ATOM 0 HB3 GLU A 46 0.381 -5.519 -11.985 1.00 0.00 H new ATOM 0 HG2 GLU A 46 2.281 -6.838 -12.258 1.00 0.00 H new ATOM 0 HG3 GLU A 46 2.663 -6.165 -10.686 1.00 0.00 H new ATOM 733 N VAL A 47 1.855 -3.497 -10.140 1.00 0.00 N ATOM 734 CA VAL A 47 2.133 -2.054 -10.386 1.00 0.00 C ATOM 735 C VAL A 47 3.129 -1.914 -11.538 1.00 0.00 C ATOM 736 O VAL A 47 4.071 -2.672 -11.652 1.00 0.00 O ATOM 737 CB VAL A 47 2.724 -1.427 -9.122 1.00 0.00 C ATOM 738 CG1 VAL A 47 2.742 0.096 -9.268 1.00 0.00 C ATOM 739 CG2 VAL A 47 1.867 -1.811 -7.914 1.00 0.00 C ATOM 0 H VAL A 47 2.681 -4.085 -10.028 1.00 0.00 H new ATOM 0 HA VAL A 47 1.205 -1.545 -10.646 1.00 0.00 H new ATOM 0 HB VAL A 47 3.741 -1.791 -8.978 1.00 0.00 H new ATOM 0 HG11 VAL A 47 3.163 0.543 -8.367 1.00 0.00 H new ATOM 0 HG12 VAL A 47 3.351 0.372 -10.129 1.00 0.00 H new ATOM 0 HG13 VAL A 47 1.725 0.460 -9.412 1.00 0.00 H new ATOM 0 HG21 VAL A 47 2.288 -1.365 -7.013 1.00 0.00 H new ATOM 0 HG22 VAL A 47 0.850 -1.447 -8.059 1.00 0.00 H new ATOM 0 HG23 VAL A 47 1.852 -2.896 -7.809 1.00 0.00 H new ATOM 749 N PHE A 48 2.928 -0.950 -12.394 1.00 0.00 N ATOM 750 CA PHE A 48 3.863 -0.762 -13.539 1.00 0.00 C ATOM 751 C PHE A 48 4.500 0.627 -13.451 1.00 0.00 C ATOM 752 O PHE A 48 4.364 1.321 -12.464 1.00 0.00 O ATOM 753 CB PHE A 48 3.093 -0.887 -14.854 1.00 0.00 C ATOM 754 CG PHE A 48 2.425 -2.240 -14.920 1.00 0.00 C ATOM 755 CD1 PHE A 48 3.117 -3.337 -15.447 1.00 0.00 C ATOM 756 CD2 PHE A 48 1.115 -2.398 -14.454 1.00 0.00 C ATOM 757 CE1 PHE A 48 2.498 -4.591 -15.510 1.00 0.00 C ATOM 758 CE2 PHE A 48 0.495 -3.652 -14.515 1.00 0.00 C ATOM 759 CZ PHE A 48 1.188 -4.749 -15.043 1.00 0.00 C ATOM 0 H PHE A 48 2.156 -0.284 -12.350 1.00 0.00 H new ATOM 0 HA PHE A 48 4.642 -1.524 -13.502 1.00 0.00 H new ATOM 0 HB2 PHE A 48 2.346 -0.097 -14.927 1.00 0.00 H new ATOM 0 HB3 PHE A 48 3.771 -0.763 -15.698 1.00 0.00 H new ATOM 0 HD1 PHE A 48 4.129 -3.216 -15.805 1.00 0.00 H new ATOM 0 HD2 PHE A 48 0.582 -1.552 -14.047 1.00 0.00 H new ATOM 0 HE1 PHE A 48 3.031 -5.437 -15.919 1.00 0.00 H new ATOM 0 HE2 PHE A 48 -0.516 -3.773 -14.155 1.00 0.00 H new ATOM 0 HZ PHE A 48 0.711 -5.717 -15.090 1.00 0.00 H new ATOM 769 N THR A 49 5.197 1.037 -14.476 1.00 0.00 N ATOM 770 CA THR A 49 5.841 2.380 -14.449 1.00 0.00 C ATOM 771 C THR A 49 6.516 2.650 -15.795 1.00 0.00 C ATOM 772 O THR A 49 6.958 1.741 -16.471 1.00 0.00 O ATOM 773 CB THR A 49 6.890 2.420 -13.335 1.00 0.00 C ATOM 774 OG1 THR A 49 7.867 3.404 -13.642 1.00 0.00 O ATOM 775 CG2 THR A 49 7.563 1.051 -13.216 1.00 0.00 C ATOM 0 H THR A 49 5.348 0.500 -15.330 1.00 0.00 H new ATOM 0 HA THR A 49 5.084 3.142 -14.263 1.00 0.00 H new ATOM 0 HB THR A 49 6.407 2.669 -12.390 1.00 0.00 H new ATOM 0 HG1 THR A 49 8.538 3.432 -12.929 1.00 0.00 H new ATOM 0 HG21 THR A 49 8.310 1.080 -12.423 1.00 0.00 H new ATOM 0 HG22 THR A 49 6.813 0.296 -12.980 1.00 0.00 H new ATOM 0 HG23 THR A 49 8.046 0.800 -14.160 1.00 0.00 H new ATOM 783 N PRO A 50 6.592 3.895 -16.179 1.00 0.00 N ATOM 784 CA PRO A 50 7.223 4.307 -17.465 1.00 0.00 C ATOM 785 C PRO A 50 8.748 4.164 -17.435 1.00 0.00 C ATOM 786 O PRO A 50 9.457 5.061 -17.025 1.00 0.00 O ATOM 787 CB PRO A 50 6.828 5.778 -17.612 1.00 0.00 C ATOM 788 CG PRO A 50 6.563 6.260 -16.225 1.00 0.00 C ATOM 789 CD PRO A 50 6.083 5.050 -15.422 1.00 0.00 C ATOM 0 HA PRO A 50 6.892 3.683 -18.295 1.00 0.00 H new ATOM 0 HB2 PRO A 50 7.626 6.353 -18.082 1.00 0.00 H new ATOM 0 HB3 PRO A 50 5.944 5.886 -18.241 1.00 0.00 H new ATOM 0 HG2 PRO A 50 7.465 6.684 -15.784 1.00 0.00 H new ATOM 0 HG3 PRO A 50 5.809 7.047 -16.226 1.00 0.00 H new ATOM 0 HD2 PRO A 50 6.475 5.065 -14.405 1.00 0.00 H new ATOM 0 HD3 PRO A 50 4.996 5.028 -15.344 1.00 0.00 H new ATOM 797 N GLN A 51 9.256 3.041 -17.865 1.00 0.00 N ATOM 798 CA GLN A 51 10.732 2.842 -17.859 1.00 0.00 C ATOM 799 C GLN A 51 11.402 3.972 -18.643 1.00 0.00 C ATOM 800 O GLN A 51 12.386 4.540 -18.212 1.00 0.00 O ATOM 801 CB GLN A 51 11.068 1.499 -18.513 1.00 0.00 C ATOM 802 CG GLN A 51 12.303 0.898 -17.839 1.00 0.00 C ATOM 803 CD GLN A 51 11.918 0.344 -16.467 1.00 0.00 C ATOM 804 OE1 GLN A 51 12.055 1.020 -15.466 1.00 0.00 O ATOM 805 NE2 GLN A 51 11.439 -0.867 -16.376 1.00 0.00 N ATOM 0 H GLN A 51 8.713 2.254 -18.220 1.00 0.00 H new ATOM 0 HA GLN A 51 11.095 2.847 -16.831 1.00 0.00 H new ATOM 0 HB2 GLN A 51 10.223 0.817 -18.422 1.00 0.00 H new ATOM 0 HB3 GLN A 51 11.253 1.637 -19.578 1.00 0.00 H new ATOM 0 HG2 GLN A 51 12.719 0.104 -18.460 1.00 0.00 H new ATOM 0 HG3 GLN A 51 13.077 1.658 -17.732 1.00 0.00 H new ATOM 0 HE21 GLN A 51 11.324 -1.434 -17.216 1.00 0.00 H new ATOM 0 HE22 GLN A 51 11.180 -1.246 -15.465 1.00 0.00 H new ATOM 814 N ASP A 52 10.878 4.303 -19.792 1.00 0.00 N ATOM 815 CA ASP A 52 11.486 5.395 -20.600 1.00 0.00 C ATOM 816 C ASP A 52 10.640 5.635 -21.852 1.00 0.00 C ATOM 817 O ASP A 52 9.817 4.821 -22.223 1.00 0.00 O ATOM 818 CB ASP A 52 12.904 4.997 -21.012 1.00 0.00 C ATOM 819 CG ASP A 52 13.065 3.480 -20.888 1.00 0.00 C ATOM 820 OD1 ASP A 52 13.377 3.025 -19.800 1.00 0.00 O ATOM 821 OD2 ASP A 52 12.874 2.801 -21.883 1.00 0.00 O ATOM 0 H ASP A 52 10.055 3.864 -20.205 1.00 0.00 H new ATOM 0 HA ASP A 52 11.523 6.308 -20.006 1.00 0.00 H new ATOM 0 HB2 ASP A 52 13.098 5.311 -22.038 1.00 0.00 H new ATOM 0 HB3 ASP A 52 13.633 5.504 -20.380 1.00 0.00 H new ATOM 826 N GLY A 53 10.834 6.747 -22.508 1.00 0.00 N ATOM 827 CA GLY A 53 10.040 7.037 -23.735 1.00 0.00 C ATOM 828 C GLY A 53 9.446 8.444 -23.639 1.00 0.00 C ATOM 829 O GLY A 53 9.100 9.051 -24.633 1.00 0.00 O ATOM 0 H GLY A 53 11.508 7.467 -22.247 1.00 0.00 H new ATOM 0 HA2 GLY A 53 10.674 6.958 -24.618 1.00 0.00 H new ATOM 0 HA3 GLY A 53 9.243 6.302 -23.848 1.00 0.00 H new ATOM 833 N ARG A 54 9.325 8.967 -22.449 1.00 0.00 N ATOM 834 CA ARG A 54 8.754 10.333 -22.291 1.00 0.00 C ATOM 835 C ARG A 54 7.339 10.366 -22.871 1.00 0.00 C ATOM 836 O ARG A 54 7.150 10.442 -24.069 1.00 0.00 O ATOM 837 CB ARG A 54 9.632 11.343 -23.033 1.00 0.00 C ATOM 838 CG ARG A 54 9.719 12.637 -22.223 1.00 0.00 C ATOM 839 CD ARG A 54 10.907 12.561 -21.263 1.00 0.00 C ATOM 840 NE ARG A 54 12.087 13.233 -21.877 1.00 0.00 N ATOM 841 CZ ARG A 54 13.113 13.554 -21.139 1.00 0.00 C ATOM 842 NH1 ARG A 54 13.106 13.288 -19.861 1.00 0.00 N ATOM 843 NH2 ARG A 54 14.147 14.141 -21.676 1.00 0.00 N ATOM 0 H ARG A 54 9.597 8.507 -21.580 1.00 0.00 H new ATOM 0 HA ARG A 54 8.719 10.590 -21.232 1.00 0.00 H new ATOM 0 HB2 ARG A 54 10.629 10.930 -23.187 1.00 0.00 H new ATOM 0 HB3 ARG A 54 9.216 11.547 -24.020 1.00 0.00 H new ATOM 0 HG2 ARG A 54 9.833 13.490 -22.892 1.00 0.00 H new ATOM 0 HG3 ARG A 54 8.796 12.791 -21.664 1.00 0.00 H new ATOM 0 HD2 ARG A 54 10.654 13.039 -20.317 1.00 0.00 H new ATOM 0 HD3 ARG A 54 11.143 11.520 -21.041 1.00 0.00 H new ATOM 0 HE ARG A 54 12.092 13.442 -22.875 1.00 0.00 H new ATOM 0 HH11 ARG A 54 12.298 12.829 -19.440 1.00 0.00 H new ATOM 0 HH12 ARG A 54 13.908 13.539 -19.283 1.00 0.00 H new ATOM 0 HH21 ARG A 54 14.154 14.349 -22.674 1.00 0.00 H new ATOM 0 HH22 ARG A 54 14.949 14.391 -21.097 1.00 0.00 H new ATOM 857 N GLY A 55 6.342 10.308 -22.031 1.00 0.00 N ATOM 858 CA GLY A 55 4.940 10.335 -22.535 1.00 0.00 C ATOM 859 C GLY A 55 4.100 9.313 -21.765 1.00 0.00 C ATOM 860 O GLY A 55 4.613 8.530 -20.991 1.00 0.00 O ATOM 0 H GLY A 55 6.438 10.243 -21.018 1.00 0.00 H new ATOM 0 HA2 GLY A 55 4.518 11.333 -22.414 1.00 0.00 H new ATOM 0 HA3 GLY A 55 4.921 10.108 -23.601 1.00 0.00 H new ATOM 864 N ALA A 56 2.812 9.313 -21.973 1.00 0.00 N ATOM 865 CA ALA A 56 1.942 8.342 -21.252 1.00 0.00 C ATOM 866 C ALA A 56 1.591 7.181 -22.186 1.00 0.00 C ATOM 867 O ALA A 56 1.316 7.372 -23.353 1.00 0.00 O ATOM 868 CB ALA A 56 0.656 9.042 -20.806 1.00 0.00 C ATOM 0 H ALA A 56 2.325 9.943 -22.611 1.00 0.00 H new ATOM 0 HA ALA A 56 2.470 7.960 -20.378 1.00 0.00 H new ATOM 0 HB1 ALA A 56 0.019 8.332 -20.278 1.00 0.00 H new ATOM 0 HB2 ALA A 56 0.904 9.870 -20.142 1.00 0.00 H new ATOM 0 HB3 ALA A 56 0.128 9.424 -21.680 1.00 0.00 H new ATOM 874 N GLU A 57 1.599 5.978 -21.680 1.00 0.00 N ATOM 875 CA GLU A 57 1.267 4.807 -22.539 1.00 0.00 C ATOM 876 C GLU A 57 2.265 4.721 -23.695 1.00 0.00 C ATOM 877 O GLU A 57 2.057 5.285 -24.750 1.00 0.00 O ATOM 878 CB GLU A 57 -0.148 4.969 -23.099 1.00 0.00 C ATOM 879 CG GLU A 57 -1.112 5.307 -21.960 1.00 0.00 C ATOM 880 CD GLU A 57 -2.539 5.391 -22.506 1.00 0.00 C ATOM 881 OE1 GLU A 57 -2.784 6.251 -23.335 1.00 0.00 O ATOM 882 OE2 GLU A 57 -3.361 4.594 -22.086 1.00 0.00 O ATOM 0 H GLU A 57 1.821 5.756 -20.710 1.00 0.00 H new ATOM 0 HA GLU A 57 1.321 3.895 -21.944 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -0.165 5.758 -23.850 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -0.462 4.050 -23.595 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -1.053 4.546 -21.182 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -0.831 6.255 -21.501 1.00 0.00 H new ATOM 889 N GLY A 58 3.349 4.019 -23.504 1.00 0.00 N ATOM 890 CA GLY A 58 4.360 3.899 -24.592 1.00 0.00 C ATOM 891 C GLY A 58 5.666 3.346 -24.019 1.00 0.00 C ATOM 892 O GLY A 58 6.542 4.085 -23.619 1.00 0.00 O ATOM 0 H GLY A 58 3.578 3.524 -22.642 1.00 0.00 H new ATOM 0 HA2 GLY A 58 3.988 3.241 -25.377 1.00 0.00 H new ATOM 0 HA3 GLY A 58 4.535 4.873 -25.049 1.00 0.00 H new ATOM 896 N GLU A 59 5.803 2.048 -23.978 1.00 0.00 N ATOM 897 CA GLU A 59 7.053 1.449 -23.430 1.00 0.00 C ATOM 898 C GLU A 59 7.040 1.551 -21.903 1.00 0.00 C ATOM 899 O GLU A 59 7.661 2.421 -21.326 1.00 0.00 O ATOM 900 CB GLU A 59 8.264 2.203 -23.983 1.00 0.00 C ATOM 901 CG GLU A 59 9.456 1.249 -24.087 1.00 0.00 C ATOM 902 CD GLU A 59 9.591 0.757 -25.530 1.00 0.00 C ATOM 903 OE1 GLU A 59 9.579 1.589 -26.422 1.00 0.00 O ATOM 904 OE2 GLU A 59 9.704 -0.443 -25.717 1.00 0.00 O ATOM 0 H GLU A 59 5.105 1.378 -24.300 1.00 0.00 H new ATOM 0 HA GLU A 59 7.114 0.401 -23.723 1.00 0.00 H new ATOM 0 HB2 GLU A 59 8.030 2.618 -24.963 1.00 0.00 H new ATOM 0 HB3 GLU A 59 8.512 3.042 -23.332 1.00 0.00 H new ATOM 0 HG2 GLU A 59 10.370 1.756 -23.777 1.00 0.00 H new ATOM 0 HG3 GLU A 59 9.318 0.403 -23.414 1.00 0.00 H new ATOM 911 N LEU A 60 6.341 0.668 -21.246 1.00 0.00 N ATOM 912 CA LEU A 60 6.290 0.716 -19.757 1.00 0.00 C ATOM 913 C LEU A 60 7.099 -0.449 -19.182 1.00 0.00 C ATOM 914 O LEU A 60 7.644 -1.256 -19.908 1.00 0.00 O ATOM 915 CB LEU A 60 4.837 0.606 -19.292 1.00 0.00 C ATOM 916 CG LEU A 60 4.079 1.875 -19.683 1.00 0.00 C ATOM 917 CD1 LEU A 60 2.696 1.501 -20.218 1.00 0.00 C ATOM 918 CD2 LEU A 60 3.922 2.774 -18.454 1.00 0.00 C ATOM 0 H LEU A 60 5.803 -0.085 -21.675 1.00 0.00 H new ATOM 0 HA LEU A 60 6.712 1.659 -19.409 1.00 0.00 H new ATOM 0 HB2 LEU A 60 4.365 -0.266 -19.744 1.00 0.00 H new ATOM 0 HB3 LEU A 60 4.799 0.465 -18.212 1.00 0.00 H new ATOM 0 HG LEU A 60 4.636 2.406 -20.455 1.00 0.00 H new ATOM 0 HD11 LEU A 60 2.157 2.406 -20.496 1.00 0.00 H new ATOM 0 HD12 LEU A 60 2.805 0.860 -21.093 1.00 0.00 H new ATOM 0 HD13 LEU A 60 2.139 0.969 -19.446 1.00 0.00 H new ATOM 0 HD21 LEU A 60 3.382 3.679 -18.732 1.00 0.00 H new ATOM 0 HD22 LEU A 60 3.366 2.242 -17.682 1.00 0.00 H new ATOM 0 HD23 LEU A 60 4.907 3.042 -18.071 1.00 0.00 H new ATOM 930 N GLY A 61 7.182 -0.543 -17.883 1.00 0.00 N ATOM 931 CA GLY A 61 7.956 -1.656 -17.265 1.00 0.00 C ATOM 932 C GLY A 61 7.249 -2.125 -15.993 1.00 0.00 C ATOM 933 O GLY A 61 6.114 -1.775 -15.737 1.00 0.00 O ATOM 0 H GLY A 61 6.747 0.103 -17.224 1.00 0.00 H new ATOM 0 HA2 GLY A 61 8.048 -2.483 -17.969 1.00 0.00 H new ATOM 0 HA3 GLY A 61 8.967 -1.323 -17.030 1.00 0.00 H new ATOM 937 N ALA A 62 7.909 -2.916 -15.192 1.00 0.00 N ATOM 938 CA ALA A 62 7.274 -3.407 -13.937 1.00 0.00 C ATOM 939 C ALA A 62 8.087 -2.928 -12.733 1.00 0.00 C ATOM 940 O ALA A 62 9.192 -3.374 -12.501 1.00 0.00 O ATOM 941 CB ALA A 62 7.235 -4.937 -13.951 1.00 0.00 C ATOM 0 H ALA A 62 8.861 -3.244 -15.353 1.00 0.00 H new ATOM 0 HA ALA A 62 6.258 -3.018 -13.867 1.00 0.00 H new ATOM 0 HB1 ALA A 62 6.771 -5.298 -13.033 1.00 0.00 H new ATOM 0 HB2 ALA A 62 6.656 -5.278 -14.809 1.00 0.00 H new ATOM 0 HB3 ALA A 62 8.251 -5.326 -14.021 1.00 0.00 H new ATOM 947 N ALA A 63 7.548 -2.021 -11.965 1.00 0.00 N ATOM 948 CA ALA A 63 8.290 -1.515 -10.776 1.00 0.00 C ATOM 949 C ALA A 63 8.783 -2.698 -9.941 1.00 0.00 C ATOM 950 O ALA A 63 8.230 -3.778 -9.989 1.00 0.00 O ATOM 951 CB ALA A 63 7.361 -0.644 -9.927 1.00 0.00 C ATOM 0 H ALA A 63 6.626 -1.609 -12.110 1.00 0.00 H new ATOM 0 HA ALA A 63 9.143 -0.922 -11.106 1.00 0.00 H new ATOM 0 HB1 ALA A 63 7.904 -0.274 -9.057 1.00 0.00 H new ATOM 0 HB2 ALA A 63 7.009 0.199 -10.521 1.00 0.00 H new ATOM 0 HB3 ALA A 63 6.508 -1.236 -9.597 1.00 0.00 H new ATOM 957 N SER A 64 9.821 -2.503 -9.173 1.00 0.00 N ATOM 958 CA SER A 64 10.348 -3.618 -8.336 1.00 0.00 C ATOM 959 C SER A 64 9.728 -3.545 -6.940 1.00 0.00 C ATOM 960 O SER A 64 9.299 -2.499 -6.495 1.00 0.00 O ATOM 961 CB SER A 64 11.869 -3.496 -8.225 1.00 0.00 C ATOM 962 OG SER A 64 12.473 -4.123 -9.348 1.00 0.00 O ATOM 0 H SER A 64 10.326 -1.621 -9.089 1.00 0.00 H new ATOM 0 HA SER A 64 10.092 -4.572 -8.798 1.00 0.00 H new ATOM 0 HB2 SER A 64 12.159 -2.446 -8.180 1.00 0.00 H new ATOM 0 HB3 SER A 64 12.217 -3.962 -7.303 1.00 0.00 H new ATOM 0 HG SER A 64 13.448 -4.045 -9.281 1.00 0.00 H new ATOM 968 N LYS A 65 9.676 -4.648 -6.246 1.00 0.00 N ATOM 969 CA LYS A 65 9.082 -4.640 -4.879 1.00 0.00 C ATOM 970 C LYS A 65 9.854 -3.660 -3.994 1.00 0.00 C ATOM 971 O LYS A 65 9.392 -3.265 -2.941 1.00 0.00 O ATOM 972 CB LYS A 65 9.167 -6.045 -4.278 1.00 0.00 C ATOM 973 CG LYS A 65 8.255 -6.133 -3.052 1.00 0.00 C ATOM 974 CD LYS A 65 8.677 -7.320 -2.185 1.00 0.00 C ATOM 975 CE LYS A 65 8.246 -8.623 -2.860 1.00 0.00 C ATOM 976 NZ LYS A 65 6.835 -8.500 -3.323 1.00 0.00 N ATOM 0 H LYS A 65 10.019 -5.554 -6.566 1.00 0.00 H new ATOM 0 HA LYS A 65 8.038 -4.332 -4.938 1.00 0.00 H new ATOM 0 HB2 LYS A 65 8.870 -6.787 -5.019 1.00 0.00 H new ATOM 0 HB3 LYS A 65 10.196 -6.270 -3.996 1.00 0.00 H new ATOM 0 HG2 LYS A 65 8.313 -5.210 -2.476 1.00 0.00 H new ATOM 0 HG3 LYS A 65 7.217 -6.249 -3.365 1.00 0.00 H new ATOM 0 HD2 LYS A 65 9.757 -7.313 -2.041 1.00 0.00 H new ATOM 0 HD3 LYS A 65 8.223 -7.242 -1.197 1.00 0.00 H new ATOM 0 HE2 LYS A 65 8.899 -8.841 -3.705 1.00 0.00 H new ATOM 0 HE3 LYS A 65 8.340 -9.455 -2.162 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 6.406 -9.445 -3.384 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 6.298 -7.919 -2.648 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 6.815 -8.050 -4.260 1.00 0.00 H new ATOM 990 N ALA A 66 11.024 -3.264 -4.411 1.00 0.00 N ATOM 991 CA ALA A 66 11.823 -2.309 -3.592 1.00 0.00 C ATOM 992 C ALA A 66 11.469 -0.875 -3.991 1.00 0.00 C ATOM 993 O ALA A 66 11.365 0.004 -3.157 1.00 0.00 O ATOM 994 CB ALA A 66 13.314 -2.552 -3.836 1.00 0.00 C ATOM 0 H ALA A 66 11.462 -3.560 -5.283 1.00 0.00 H new ATOM 0 HA ALA A 66 11.598 -2.459 -2.536 1.00 0.00 H new ATOM 0 HB1 ALA A 66 13.899 -1.854 -3.237 1.00 0.00 H new ATOM 0 HB2 ALA A 66 13.567 -3.574 -3.553 1.00 0.00 H new ATOM 0 HB3 ALA A 66 13.539 -2.402 -4.892 1.00 0.00 H new ATOM 1000 N GLN A 67 11.282 -0.630 -5.258 1.00 0.00 N ATOM 1001 CA GLN A 67 10.934 0.747 -5.708 1.00 0.00 C ATOM 1002 C GLN A 67 9.620 1.180 -5.056 1.00 0.00 C ATOM 1003 O GLN A 67 9.500 2.277 -4.545 1.00 0.00 O ATOM 1004 CB GLN A 67 10.777 0.764 -7.230 1.00 0.00 C ATOM 1005 CG GLN A 67 12.120 1.101 -7.879 1.00 0.00 C ATOM 1006 CD GLN A 67 11.937 1.239 -9.391 1.00 0.00 C ATOM 1007 OE1 GLN A 67 10.836 1.433 -9.866 1.00 0.00 O ATOM 1008 NE2 GLN A 67 12.977 1.145 -10.174 1.00 0.00 N ATOM 0 H GLN A 67 11.355 -1.324 -6.002 1.00 0.00 H new ATOM 0 HA GLN A 67 11.728 1.434 -5.417 1.00 0.00 H new ATOM 0 HB2 GLN A 67 10.425 -0.206 -7.581 1.00 0.00 H new ATOM 0 HB3 GLN A 67 10.026 1.499 -7.520 1.00 0.00 H new ATOM 0 HG2 GLN A 67 12.514 2.029 -7.464 1.00 0.00 H new ATOM 0 HG3 GLN A 67 12.848 0.320 -7.660 1.00 0.00 H new ATOM 0 HE21 GLN A 67 13.902 0.982 -9.776 1.00 0.00 H new ATOM 0 HE22 GLN A 67 12.865 1.234 -11.184 1.00 0.00 H new ATOM 1017 N VAL A 68 8.632 0.328 -5.068 1.00 0.00 N ATOM 1018 CA VAL A 68 7.327 0.691 -4.447 1.00 0.00 C ATOM 1019 C VAL A 68 7.473 0.708 -2.924 1.00 0.00 C ATOM 1020 O VAL A 68 6.981 1.593 -2.253 1.00 0.00 O ATOM 1021 CB VAL A 68 6.268 -0.338 -4.846 1.00 0.00 C ATOM 1022 CG1 VAL A 68 4.873 0.254 -4.636 1.00 0.00 C ATOM 1023 CG2 VAL A 68 6.447 -0.706 -6.322 1.00 0.00 C ATOM 0 H VAL A 68 8.672 -0.604 -5.481 1.00 0.00 H new ATOM 0 HA VAL A 68 7.023 1.679 -4.794 1.00 0.00 H new ATOM 0 HB VAL A 68 6.380 -1.230 -4.230 1.00 0.00 H new ATOM 0 HG11 VAL A 68 4.119 -0.480 -4.921 1.00 0.00 H new ATOM 0 HG12 VAL A 68 4.744 0.518 -3.586 1.00 0.00 H new ATOM 0 HG13 VAL A 68 4.760 1.147 -5.251 1.00 0.00 H new ATOM 0 HG21 VAL A 68 5.693 -1.439 -6.608 1.00 0.00 H new ATOM 0 HG22 VAL A 68 6.335 0.188 -6.936 1.00 0.00 H new ATOM 0 HG23 VAL A 68 7.440 -1.129 -6.474 1.00 0.00 H new ATOM 1033 N GLU A 69 8.147 -0.264 -2.374 1.00 0.00 N ATOM 1034 CA GLU A 69 8.325 -0.303 -0.895 1.00 0.00 C ATOM 1035 C GLU A 69 9.112 0.929 -0.444 1.00 0.00 C ATOM 1036 O GLU A 69 9.033 1.345 0.695 1.00 0.00 O ATOM 1037 CB GLU A 69 9.092 -1.569 -0.507 1.00 0.00 C ATOM 1038 CG GLU A 69 8.134 -2.762 -0.489 1.00 0.00 C ATOM 1039 CD GLU A 69 7.359 -2.775 0.830 1.00 0.00 C ATOM 1040 OE1 GLU A 69 6.442 -1.981 0.963 1.00 0.00 O ATOM 1041 OE2 GLU A 69 7.694 -3.578 1.684 1.00 0.00 O ATOM 0 H GLU A 69 8.582 -1.033 -2.884 1.00 0.00 H new ATOM 0 HA GLU A 69 7.348 -0.307 -0.411 1.00 0.00 H new ATOM 0 HB2 GLU A 69 9.900 -1.749 -1.216 1.00 0.00 H new ATOM 0 HB3 GLU A 69 9.551 -1.443 0.474 1.00 0.00 H new ATOM 0 HG2 GLU A 69 7.442 -2.699 -1.329 1.00 0.00 H new ATOM 0 HG3 GLU A 69 8.692 -3.691 -0.604 1.00 0.00 H new ATOM 1048 N ASN A 70 9.873 1.515 -1.328 1.00 0.00 N ATOM 1049 CA ASN A 70 10.664 2.719 -0.948 1.00 0.00 C ATOM 1050 C ASN A 70 9.746 3.942 -0.915 1.00 0.00 C ATOM 1051 O ASN A 70 9.995 4.898 -0.206 1.00 0.00 O ATOM 1052 CB ASN A 70 11.775 2.944 -1.977 1.00 0.00 C ATOM 1053 CG ASN A 70 12.831 3.882 -1.391 1.00 0.00 C ATOM 1054 OD1 ASN A 70 12.909 4.054 -0.191 1.00 0.00 O ATOM 1055 ND2 ASN A 70 13.654 4.501 -2.193 1.00 0.00 N ATOM 0 H ASN A 70 9.981 1.212 -2.296 1.00 0.00 H new ATOM 0 HA ASN A 70 11.105 2.568 0.037 1.00 0.00 H new ATOM 0 HB2 ASN A 70 12.230 1.992 -2.250 1.00 0.00 H new ATOM 0 HB3 ASN A 70 11.359 3.372 -2.889 1.00 0.00 H new ATOM 0 HD21 ASN A 70 14.362 5.129 -1.812 1.00 0.00 H new ATOM 0 HD22 ASN A 70 13.589 4.357 -3.201 1.00 0.00 H new ATOM 1062 N GLU A 71 8.686 3.922 -1.674 1.00 0.00 N ATOM 1063 CA GLU A 71 7.752 5.083 -1.685 1.00 0.00 C ATOM 1064 C GLU A 71 6.878 5.046 -0.431 1.00 0.00 C ATOM 1065 O GLU A 71 6.494 6.069 0.101 1.00 0.00 O ATOM 1066 CB GLU A 71 6.864 5.013 -2.929 1.00 0.00 C ATOM 1067 CG GLU A 71 7.724 5.184 -4.182 1.00 0.00 C ATOM 1068 CD GLU A 71 8.475 6.514 -4.109 1.00 0.00 C ATOM 1069 OE1 GLU A 71 7.884 7.483 -3.660 1.00 0.00 O ATOM 1070 OE2 GLU A 71 9.630 6.543 -4.503 1.00 0.00 O ATOM 0 H GLU A 71 8.426 3.151 -2.288 1.00 0.00 H new ATOM 0 HA GLU A 71 8.325 6.010 -1.701 1.00 0.00 H new ATOM 0 HB2 GLU A 71 6.341 4.057 -2.962 1.00 0.00 H new ATOM 0 HB3 GLU A 71 6.102 5.792 -2.889 1.00 0.00 H new ATOM 0 HG2 GLU A 71 8.432 4.359 -4.265 1.00 0.00 H new ATOM 0 HG3 GLU A 71 7.097 5.157 -5.073 1.00 0.00 H new ATOM 1077 N PHE A 72 6.559 3.874 0.047 1.00 0.00 N ATOM 1078 CA PHE A 72 5.710 3.773 1.267 1.00 0.00 C ATOM 1079 C PHE A 72 6.582 3.394 2.466 1.00 0.00 C ATOM 1080 O PHE A 72 6.691 4.132 3.425 1.00 0.00 O ATOM 1081 CB PHE A 72 4.639 2.702 1.056 1.00 0.00 C ATOM 1082 CG PHE A 72 3.634 3.187 0.040 1.00 0.00 C ATOM 1083 CD1 PHE A 72 2.653 4.113 0.413 1.00 0.00 C ATOM 1084 CD2 PHE A 72 3.684 2.712 -1.276 1.00 0.00 C ATOM 1085 CE1 PHE A 72 1.720 4.563 -0.529 1.00 0.00 C ATOM 1086 CE2 PHE A 72 2.751 3.162 -2.219 1.00 0.00 C ATOM 1087 CZ PHE A 72 1.770 4.088 -1.845 1.00 0.00 C ATOM 0 H PHE A 72 6.850 2.983 -0.355 1.00 0.00 H new ATOM 0 HA PHE A 72 5.231 4.733 1.456 1.00 0.00 H new ATOM 0 HB2 PHE A 72 5.099 1.775 0.714 1.00 0.00 H new ATOM 0 HB3 PHE A 72 4.140 2.481 2.000 1.00 0.00 H new ATOM 0 HD1 PHE A 72 2.616 4.481 1.428 1.00 0.00 H new ATOM 0 HD2 PHE A 72 4.442 1.999 -1.564 1.00 0.00 H new ATOM 0 HE1 PHE A 72 0.962 5.276 -0.241 1.00 0.00 H new ATOM 0 HE2 PHE A 72 2.788 2.795 -3.234 1.00 0.00 H new ATOM 0 HZ PHE A 72 1.051 4.436 -2.572 1.00 0.00 H new ATOM 1097 N GLY A 73 7.206 2.249 2.419 1.00 0.00 N ATOM 1098 CA GLY A 73 8.071 1.823 3.556 1.00 0.00 C ATOM 1099 C GLY A 73 8.066 0.297 3.660 1.00 0.00 C ATOM 1100 O GLY A 73 7.038 -0.340 3.541 1.00 0.00 O ATOM 0 H GLY A 73 7.154 1.590 1.642 1.00 0.00 H new ATOM 0 HA2 GLY A 73 9.089 2.184 3.407 1.00 0.00 H new ATOM 0 HA3 GLY A 73 7.709 2.262 4.486 1.00 0.00 H new ATOM 1104 N LYS A 74 9.208 -0.296 3.878 1.00 0.00 N ATOM 1105 CA LYS A 74 9.268 -1.780 3.989 1.00 0.00 C ATOM 1106 C LYS A 74 8.474 -2.233 5.216 1.00 0.00 C ATOM 1107 O LYS A 74 8.960 -2.195 6.329 1.00 0.00 O ATOM 1108 CB LYS A 74 10.725 -2.223 4.131 1.00 0.00 C ATOM 1109 CG LYS A 74 11.513 -1.152 4.888 1.00 0.00 C ATOM 1110 CD LYS A 74 12.770 -1.776 5.497 1.00 0.00 C ATOM 1111 CE LYS A 74 13.557 -0.705 6.255 1.00 0.00 C ATOM 1112 NZ LYS A 74 13.587 0.550 5.452 1.00 0.00 N ATOM 0 H LYS A 74 10.102 0.184 3.984 1.00 0.00 H new ATOM 0 HA LYS A 74 8.838 -2.229 3.093 1.00 0.00 H new ATOM 0 HB2 LYS A 74 10.777 -3.172 4.664 1.00 0.00 H new ATOM 0 HB3 LYS A 74 11.164 -2.385 3.147 1.00 0.00 H new ATOM 0 HG2 LYS A 74 11.787 -0.342 4.212 1.00 0.00 H new ATOM 0 HG3 LYS A 74 10.894 -0.717 5.672 1.00 0.00 H new ATOM 0 HD2 LYS A 74 12.496 -2.587 6.172 1.00 0.00 H new ATOM 0 HD3 LYS A 74 13.390 -2.210 4.713 1.00 0.00 H new ATOM 0 HE2 LYS A 74 13.096 -0.518 7.225 1.00 0.00 H new ATOM 0 HE3 LYS A 74 14.573 -1.052 6.446 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 14.351 1.165 5.797 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 13.754 0.318 4.452 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 12.676 1.044 5.545 1.00 0.00 H new ATOM 1126 N GLY A 75 7.257 -2.660 5.022 1.00 0.00 N ATOM 1127 CA GLY A 75 6.434 -3.115 6.179 1.00 0.00 C ATOM 1128 C GLY A 75 4.954 -3.087 5.796 1.00 0.00 C ATOM 1129 O GLY A 75 4.103 -3.533 6.539 1.00 0.00 O ATOM 0 H GLY A 75 6.797 -2.714 4.113 1.00 0.00 H new ATOM 0 HA2 GLY A 75 6.726 -4.124 6.472 1.00 0.00 H new ATOM 0 HA3 GLY A 75 6.610 -2.470 7.040 1.00 0.00 H new ATOM 1133 N LYS A 76 4.641 -2.567 4.641 1.00 0.00 N ATOM 1134 CA LYS A 76 3.214 -2.512 4.211 1.00 0.00 C ATOM 1135 C LYS A 76 2.941 -3.634 3.208 1.00 0.00 C ATOM 1136 O LYS A 76 3.661 -3.807 2.244 1.00 0.00 O ATOM 1137 CB LYS A 76 2.932 -1.159 3.555 1.00 0.00 C ATOM 1138 CG LYS A 76 3.202 -0.037 4.558 1.00 0.00 C ATOM 1139 CD LYS A 76 2.363 1.188 4.194 1.00 0.00 C ATOM 1140 CE LYS A 76 3.026 2.448 4.755 1.00 0.00 C ATOM 1141 NZ LYS A 76 2.162 3.630 4.477 1.00 0.00 N ATOM 0 H LYS A 76 5.310 -2.178 3.977 1.00 0.00 H new ATOM 0 HA LYS A 76 2.566 -2.636 5.079 1.00 0.00 H new ATOM 0 HB2 LYS A 76 3.561 -1.032 2.674 1.00 0.00 H new ATOM 0 HB3 LYS A 76 1.897 -1.116 3.216 1.00 0.00 H new ATOM 0 HG2 LYS A 76 2.958 -0.371 5.567 1.00 0.00 H new ATOM 0 HG3 LYS A 76 4.261 0.221 4.555 1.00 0.00 H new ATOM 0 HD2 LYS A 76 2.267 1.267 3.111 1.00 0.00 H new ATOM 0 HD3 LYS A 76 1.356 1.084 4.597 1.00 0.00 H new ATOM 0 HE2 LYS A 76 3.182 2.343 5.829 1.00 0.00 H new ATOM 0 HE3 LYS A 76 4.008 2.587 4.303 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 2.612 4.486 4.858 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 2.035 3.733 3.450 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 1.235 3.496 4.929 1.00 0.00 H new ATOM 1155 N LYS A 77 1.905 -4.398 3.425 1.00 0.00 N ATOM 1156 CA LYS A 77 1.587 -5.507 2.483 1.00 0.00 C ATOM 1157 C LYS A 77 1.343 -4.935 1.085 1.00 0.00 C ATOM 1158 O LYS A 77 1.661 -3.796 0.807 1.00 0.00 O ATOM 1159 CB LYS A 77 0.330 -6.239 2.961 1.00 0.00 C ATOM 1160 CG LYS A 77 0.569 -6.801 4.363 1.00 0.00 C ATOM 1161 CD LYS A 77 -0.703 -7.494 4.858 1.00 0.00 C ATOM 1162 CE LYS A 77 -0.591 -7.753 6.362 1.00 0.00 C ATOM 1163 NZ LYS A 77 0.778 -8.249 6.680 1.00 0.00 N ATOM 0 H LYS A 77 1.266 -4.302 4.214 1.00 0.00 H new ATOM 0 HA LYS A 77 2.423 -6.205 2.449 1.00 0.00 H new ATOM 0 HB2 LYS A 77 -0.520 -5.556 2.971 1.00 0.00 H new ATOM 0 HB3 LYS A 77 0.082 -7.046 2.272 1.00 0.00 H new ATOM 0 HG2 LYS A 77 1.398 -7.508 4.347 1.00 0.00 H new ATOM 0 HG3 LYS A 77 0.848 -5.998 5.046 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -1.573 -6.872 4.649 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -0.848 -8.434 4.326 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -0.795 -6.837 6.916 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -1.336 -8.486 6.672 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 0.762 -8.752 7.590 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 1.095 -8.898 5.931 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 1.434 -7.444 6.741 1.00 0.00 H new ATOM 1177 N ILE A 78 0.782 -5.716 0.203 1.00 0.00 N ATOM 1178 CA ILE A 78 0.519 -5.215 -1.175 1.00 0.00 C ATOM 1179 C ILE A 78 -0.890 -4.622 -1.242 1.00 0.00 C ATOM 1180 O ILE A 78 -1.137 -3.662 -1.943 1.00 0.00 O ATOM 1181 CB ILE A 78 0.633 -6.374 -2.168 1.00 0.00 C ATOM 1182 CG1 ILE A 78 0.356 -5.859 -3.583 1.00 0.00 C ATOM 1183 CG2 ILE A 78 -0.389 -7.454 -1.812 1.00 0.00 C ATOM 1184 CD1 ILE A 78 1.461 -4.885 -3.997 1.00 0.00 C ATOM 0 H ILE A 78 0.495 -6.679 0.377 1.00 0.00 H new ATOM 0 HA ILE A 78 1.249 -4.446 -1.428 1.00 0.00 H new ATOM 0 HB ILE A 78 1.637 -6.795 -2.122 1.00 0.00 H new ATOM 0 HG12 ILE A 78 0.311 -6.693 -4.283 1.00 0.00 H new ATOM 0 HG13 ILE A 78 -0.613 -5.362 -3.617 1.00 0.00 H new ATOM 0 HG21 ILE A 78 -0.308 -8.279 -2.519 1.00 0.00 H new ATOM 0 HG22 ILE A 78 -0.195 -7.820 -0.804 1.00 0.00 H new ATOM 0 HG23 ILE A 78 -1.394 -7.034 -1.859 1.00 0.00 H new ATOM 0 HD11 ILE A 78 1.264 -4.518 -5.004 1.00 0.00 H new ATOM 0 HD12 ILE A 78 1.484 -4.045 -3.303 1.00 0.00 H new ATOM 0 HD13 ILE A 78 2.423 -5.397 -3.979 1.00 0.00 H new ATOM 1196 N GLU A 79 -1.816 -5.187 -0.517 1.00 0.00 N ATOM 1197 CA GLU A 79 -3.208 -4.656 -0.539 1.00 0.00 C ATOM 1198 C GLU A 79 -3.249 -3.302 0.172 1.00 0.00 C ATOM 1199 O GLU A 79 -3.983 -2.412 -0.208 1.00 0.00 O ATOM 1200 CB GLU A 79 -4.140 -5.636 0.175 1.00 0.00 C ATOM 1201 CG GLU A 79 -4.119 -6.983 -0.550 1.00 0.00 C ATOM 1202 CD GLU A 79 -5.548 -7.507 -0.698 1.00 0.00 C ATOM 1203 OE1 GLU A 79 -6.362 -6.799 -1.268 1.00 0.00 O ATOM 1204 OE2 GLU A 79 -5.805 -8.607 -0.238 1.00 0.00 O ATOM 0 H GLU A 79 -1.669 -5.994 0.090 1.00 0.00 H new ATOM 0 HA GLU A 79 -3.533 -4.534 -1.572 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -3.826 -5.764 1.211 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -5.155 -5.239 0.197 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -3.658 -6.872 -1.531 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -3.514 -7.698 0.007 1.00 0.00 H new ATOM 1211 N GLU A 80 -2.464 -3.139 1.202 1.00 0.00 N ATOM 1212 CA GLU A 80 -2.458 -1.843 1.936 1.00 0.00 C ATOM 1213 C GLU A 80 -1.886 -0.748 1.033 1.00 0.00 C ATOM 1214 O GLU A 80 -2.405 0.349 0.965 1.00 0.00 O ATOM 1215 CB GLU A 80 -1.594 -1.972 3.192 1.00 0.00 C ATOM 1216 CG GLU A 80 -1.367 -0.586 3.800 1.00 0.00 C ATOM 1217 CD GLU A 80 -1.090 -0.725 5.299 1.00 0.00 C ATOM 1218 OE1 GLU A 80 -1.335 -1.796 5.829 1.00 0.00 O ATOM 1219 OE2 GLU A 80 -0.640 0.243 5.890 1.00 0.00 O ATOM 0 H GLU A 80 -1.827 -3.847 1.566 1.00 0.00 H new ATOM 0 HA GLU A 80 -3.477 -1.582 2.222 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -2.082 -2.623 3.917 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -0.638 -2.433 2.943 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -0.527 -0.095 3.308 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -2.243 0.042 3.638 1.00 0.00 H new ATOM 1226 N VAL A 81 -0.819 -1.037 0.339 1.00 0.00 N ATOM 1227 CA VAL A 81 -0.215 -0.012 -0.558 1.00 0.00 C ATOM 1228 C VAL A 81 -1.190 0.308 -1.694 1.00 0.00 C ATOM 1229 O VAL A 81 -1.627 1.430 -1.852 1.00 0.00 O ATOM 1230 CB VAL A 81 1.090 -0.553 -1.145 1.00 0.00 C ATOM 1231 CG1 VAL A 81 1.581 0.383 -2.250 1.00 0.00 C ATOM 1232 CG2 VAL A 81 2.147 -0.634 -0.042 1.00 0.00 C ATOM 0 H VAL A 81 -0.340 -1.937 0.354 1.00 0.00 H new ATOM 0 HA VAL A 81 -0.009 0.894 0.012 1.00 0.00 H new ATOM 0 HB VAL A 81 0.917 -1.546 -1.561 1.00 0.00 H new ATOM 0 HG11 VAL A 81 2.511 -0.003 -2.668 1.00 0.00 H new ATOM 0 HG12 VAL A 81 0.828 0.444 -3.036 1.00 0.00 H new ATOM 0 HG13 VAL A 81 1.754 1.376 -1.835 1.00 0.00 H new ATOM 0 HG21 VAL A 81 3.078 -1.019 -0.458 1.00 0.00 H new ATOM 0 HG22 VAL A 81 2.318 0.360 0.372 1.00 0.00 H new ATOM 0 HG23 VAL A 81 1.799 -1.300 0.747 1.00 0.00 H new ATOM 1242 N ILE A 82 -1.532 -0.670 -2.489 1.00 0.00 N ATOM 1243 CA ILE A 82 -2.478 -0.419 -3.613 1.00 0.00 C ATOM 1244 C ILE A 82 -3.665 0.403 -3.107 1.00 0.00 C ATOM 1245 O ILE A 82 -4.225 1.209 -3.824 1.00 0.00 O ATOM 1246 CB ILE A 82 -2.981 -1.755 -4.163 1.00 0.00 C ATOM 1247 CG1 ILE A 82 -1.786 -2.623 -4.565 1.00 0.00 C ATOM 1248 CG2 ILE A 82 -3.864 -1.504 -5.387 1.00 0.00 C ATOM 1249 CD1 ILE A 82 -1.306 -2.220 -5.960 1.00 0.00 C ATOM 0 H ILE A 82 -1.198 -1.630 -2.409 1.00 0.00 H new ATOM 0 HA ILE A 82 -1.966 0.130 -4.403 1.00 0.00 H new ATOM 0 HB ILE A 82 -3.562 -2.268 -3.396 1.00 0.00 H new ATOM 0 HG12 ILE A 82 -0.978 -2.504 -3.843 1.00 0.00 H new ATOM 0 HG13 ILE A 82 -2.069 -3.676 -4.557 1.00 0.00 H new ATOM 0 HG21 ILE A 82 -4.222 -2.456 -5.779 1.00 0.00 H new ATOM 0 HG22 ILE A 82 -4.715 -0.886 -5.101 1.00 0.00 H new ATOM 0 HG23 ILE A 82 -3.285 -0.991 -6.155 1.00 0.00 H new ATOM 0 HD11 ILE A 82 -0.455 -2.839 -6.245 1.00 0.00 H new ATOM 0 HD12 ILE A 82 -2.114 -2.361 -6.678 1.00 0.00 H new ATOM 0 HD13 ILE A 82 -1.006 -1.172 -5.953 1.00 0.00 H new ATOM 1261 N ASP A 83 -4.052 0.208 -1.876 1.00 0.00 N ATOM 1262 CA ASP A 83 -5.202 0.979 -1.326 1.00 0.00 C ATOM 1263 C ASP A 83 -4.821 2.457 -1.221 1.00 0.00 C ATOM 1264 O ASP A 83 -5.380 3.302 -1.891 1.00 0.00 O ATOM 1265 CB ASP A 83 -5.558 0.443 0.063 1.00 0.00 C ATOM 1266 CG ASP A 83 -6.775 1.195 0.604 1.00 0.00 C ATOM 1267 OD1 ASP A 83 -7.883 0.764 0.332 1.00 0.00 O ATOM 1268 OD2 ASP A 83 -6.578 2.190 1.282 1.00 0.00 O ATOM 0 H ASP A 83 -3.622 -0.452 -1.228 1.00 0.00 H new ATOM 0 HA ASP A 83 -6.062 0.872 -1.988 1.00 0.00 H new ATOM 0 HB2 ASP A 83 -5.772 -0.624 0.009 1.00 0.00 H new ATOM 0 HB3 ASP A 83 -4.712 0.565 0.739 1.00 0.00 H new ATOM 1273 N LEU A 84 -3.872 2.776 -0.384 1.00 0.00 N ATOM 1274 CA LEU A 84 -3.456 4.199 -0.236 1.00 0.00 C ATOM 1275 C LEU A 84 -3.471 4.880 -1.606 1.00 0.00 C ATOM 1276 O LEU A 84 -3.713 6.065 -1.718 1.00 0.00 O ATOM 1277 CB LEU A 84 -2.042 4.259 0.347 1.00 0.00 C ATOM 1278 CG LEU A 84 -2.077 3.832 1.816 1.00 0.00 C ATOM 1279 CD1 LEU A 84 -0.715 3.259 2.213 1.00 0.00 C ATOM 1280 CD2 LEU A 84 -2.394 5.046 2.692 1.00 0.00 C ATOM 0 H LEU A 84 -3.367 2.113 0.204 1.00 0.00 H new ATOM 0 HA LEU A 84 -4.147 4.712 0.433 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -1.377 3.605 -0.217 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -1.644 5.270 0.261 1.00 0.00 H new ATOM 0 HG LEU A 84 -2.846 3.072 1.955 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -0.739 2.955 3.259 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -0.488 2.395 1.589 1.00 0.00 H new ATOM 0 HD13 LEU A 84 0.054 4.019 2.074 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -2.419 4.743 3.739 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -1.625 5.806 2.553 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -3.364 5.455 2.409 1.00 0.00 H new ATOM 1292 N ILE A 85 -3.216 4.140 -2.649 1.00 0.00 N ATOM 1293 CA ILE A 85 -3.216 4.746 -4.010 1.00 0.00 C ATOM 1294 C ILE A 85 -4.659 4.954 -4.477 1.00 0.00 C ATOM 1295 O ILE A 85 -5.034 6.026 -4.905 1.00 0.00 O ATOM 1296 CB ILE A 85 -2.496 3.813 -4.985 1.00 0.00 C ATOM 1297 CG1 ILE A 85 -1.005 3.770 -4.642 1.00 0.00 C ATOM 1298 CG2 ILE A 85 -2.673 4.329 -6.414 1.00 0.00 C ATOM 1299 CD1 ILE A 85 -0.320 2.683 -5.473 1.00 0.00 C ATOM 0 H ILE A 85 -3.008 3.142 -2.618 1.00 0.00 H new ATOM 0 HA ILE A 85 -2.702 5.706 -3.978 1.00 0.00 H new ATOM 0 HB ILE A 85 -2.918 2.811 -4.906 1.00 0.00 H new ATOM 0 HG12 ILE A 85 -0.547 4.739 -4.843 1.00 0.00 H new ATOM 0 HG13 ILE A 85 -0.871 3.568 -3.579 1.00 0.00 H new ATOM 0 HG21 ILE A 85 -2.159 3.663 -7.108 1.00 0.00 H new ATOM 0 HG22 ILE A 85 -3.734 4.361 -6.660 1.00 0.00 H new ATOM 0 HG23 ILE A 85 -2.252 5.331 -6.494 1.00 0.00 H new ATOM 0 HD11 ILE A 85 0.742 2.653 -5.228 1.00 0.00 H new ATOM 0 HD12 ILE A 85 -0.771 1.716 -5.250 1.00 0.00 H new ATOM 0 HD13 ILE A 85 -0.442 2.905 -6.533 1.00 0.00 H new ATOM 1311 N LEU A 86 -5.471 3.935 -4.396 1.00 0.00 N ATOM 1312 CA LEU A 86 -6.888 4.075 -4.834 1.00 0.00 C ATOM 1313 C LEU A 86 -7.563 5.191 -4.033 1.00 0.00 C ATOM 1314 O LEU A 86 -8.631 5.655 -4.376 1.00 0.00 O ATOM 1315 CB LEU A 86 -7.628 2.758 -4.597 1.00 0.00 C ATOM 1316 CG LEU A 86 -7.025 1.666 -5.482 1.00 0.00 C ATOM 1317 CD1 LEU A 86 -7.403 0.292 -4.929 1.00 0.00 C ATOM 1318 CD2 LEU A 86 -7.568 1.808 -6.907 1.00 0.00 C ATOM 0 H LEU A 86 -5.214 3.012 -4.046 1.00 0.00 H new ATOM 0 HA LEU A 86 -6.917 4.322 -5.895 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -7.555 2.472 -3.548 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -8.688 2.879 -4.822 1.00 0.00 H new ATOM 0 HG LEU A 86 -5.940 1.766 -5.493 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -6.973 -0.485 -5.560 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -7.018 0.190 -3.914 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -8.488 0.191 -4.917 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -7.139 1.030 -7.539 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -8.653 1.708 -6.894 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -7.299 2.787 -7.303 1.00 0.00 H new ATOM 1330 N ARG A 87 -6.948 5.623 -2.966 1.00 0.00 N ATOM 1331 CA ARG A 87 -7.556 6.706 -2.143 1.00 0.00 C ATOM 1332 C ARG A 87 -7.232 8.065 -2.769 1.00 0.00 C ATOM 1333 O ARG A 87 -8.049 8.964 -2.779 1.00 0.00 O ATOM 1334 CB ARG A 87 -6.987 6.649 -0.724 1.00 0.00 C ATOM 1335 CG ARG A 87 -8.033 6.053 0.221 1.00 0.00 C ATOM 1336 CD ARG A 87 -7.376 5.710 1.560 1.00 0.00 C ATOM 1337 NE ARG A 87 -8.279 4.822 2.343 1.00 0.00 N ATOM 1338 CZ ARG A 87 -7.817 4.165 3.372 1.00 0.00 C ATOM 1339 NH1 ARG A 87 -6.565 4.286 3.715 1.00 0.00 N ATOM 1340 NH2 ARG A 87 -8.609 3.386 4.057 1.00 0.00 N ATOM 0 H ARG A 87 -6.051 5.273 -2.629 1.00 0.00 H new ATOM 0 HA ARG A 87 -8.637 6.571 -2.106 1.00 0.00 H new ATOM 0 HB2 ARG A 87 -6.080 6.044 -0.708 1.00 0.00 H new ATOM 0 HB3 ARG A 87 -6.709 7.649 -0.392 1.00 0.00 H new ATOM 0 HG2 ARG A 87 -8.846 6.762 0.374 1.00 0.00 H new ATOM 0 HG3 ARG A 87 -8.470 5.158 -0.221 1.00 0.00 H new ATOM 0 HD2 ARG A 87 -6.419 5.216 1.392 1.00 0.00 H new ATOM 0 HD3 ARG A 87 -7.170 6.622 2.120 1.00 0.00 H new ATOM 0 HE ARG A 87 -9.259 4.727 2.075 1.00 0.00 H new ATOM 0 HH11 ARG A 87 -5.946 4.894 3.179 1.00 0.00 H new ATOM 0 HH12 ARG A 87 -6.205 3.772 4.519 1.00 0.00 H new ATOM 0 HH21 ARG A 87 -9.588 3.291 3.788 1.00 0.00 H new ATOM 0 HH22 ARG A 87 -8.249 2.872 4.861 1.00 0.00 H new ATOM 1354 N ASN A 88 -6.046 8.221 -3.290 1.00 0.00 N ATOM 1355 CA ASN A 88 -5.673 9.521 -3.914 1.00 0.00 C ATOM 1356 C ASN A 88 -6.147 9.545 -5.368 1.00 0.00 C ATOM 1357 O ASN A 88 -7.040 10.288 -5.728 1.00 0.00 O ATOM 1358 CB ASN A 88 -4.152 9.691 -3.872 1.00 0.00 C ATOM 1359 CG ASN A 88 -3.806 11.176 -3.753 1.00 0.00 C ATOM 1360 OD1 ASN A 88 -3.269 11.762 -4.673 1.00 0.00 O ATOM 1361 ND2 ASN A 88 -4.093 11.814 -2.651 1.00 0.00 N ATOM 0 H ASN A 88 -5.320 7.505 -3.310 1.00 0.00 H new ATOM 0 HA ASN A 88 -6.145 10.335 -3.364 1.00 0.00 H new ATOM 0 HB2 ASN A 88 -3.738 9.142 -3.027 1.00 0.00 H new ATOM 0 HB3 ASN A 88 -3.704 9.274 -4.774 1.00 0.00 H new ATOM 0 HD21 ASN A 88 -3.867 12.805 -2.561 1.00 0.00 H new ATOM 0 HD22 ASN A 88 -4.544 11.322 -1.879 1.00 0.00 H new ATOM 1368 N GLY A 89 -5.559 8.738 -6.207 1.00 0.00 N ATOM 1369 CA GLY A 89 -5.979 8.716 -7.638 1.00 0.00 C ATOM 1370 C GLY A 89 -5.781 10.103 -8.251 1.00 0.00 C ATOM 1371 O GLY A 89 -6.359 11.076 -7.807 1.00 0.00 O ATOM 0 H GLY A 89 -4.807 8.093 -5.965 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -5.395 7.978 -8.188 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -7.025 8.418 -7.716 1.00 0.00 H new ATOM 1375 N LYS A 90 -4.969 10.204 -9.267 1.00 0.00 N ATOM 1376 CA LYS A 90 -4.736 11.529 -9.907 1.00 0.00 C ATOM 1377 C LYS A 90 -4.753 11.370 -11.429 1.00 0.00 C ATOM 1378 O LYS A 90 -3.737 11.493 -12.086 1.00 0.00 O ATOM 1379 CB LYS A 90 -3.377 12.076 -9.466 1.00 0.00 C ATOM 1380 CG LYS A 90 -3.216 13.511 -9.972 1.00 0.00 C ATOM 1381 CD LYS A 90 -1.868 14.069 -9.508 1.00 0.00 C ATOM 1382 CE LYS A 90 -1.780 15.553 -9.863 1.00 0.00 C ATOM 1383 NZ LYS A 90 -2.852 16.300 -9.148 1.00 0.00 N ATOM 0 H LYS A 90 -4.457 9.426 -9.682 1.00 0.00 H new ATOM 0 HA LYS A 90 -5.522 12.222 -9.605 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -3.298 12.051 -8.379 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -2.576 11.449 -9.858 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -3.275 13.533 -11.060 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -4.028 14.134 -9.596 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -1.758 13.935 -8.432 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -1.053 13.522 -9.982 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -0.802 15.946 -9.587 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -1.885 15.687 -10.940 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -2.558 17.289 -9.017 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -3.728 16.271 -9.708 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -3.020 15.863 -8.220 1.00 0.00 H new ATOM 1397 N PRO A 91 -5.904 11.102 -11.981 1.00 0.00 N ATOM 1398 CA PRO A 91 -6.072 10.921 -13.452 1.00 0.00 C ATOM 1399 C PRO A 91 -5.457 12.074 -14.251 1.00 0.00 C ATOM 1400 O PRO A 91 -6.140 12.995 -14.653 1.00 0.00 O ATOM 1401 CB PRO A 91 -7.589 10.885 -13.647 1.00 0.00 C ATOM 1402 CG PRO A 91 -8.153 10.463 -12.330 1.00 0.00 C ATOM 1403 CD PRO A 91 -7.173 10.939 -11.258 1.00 0.00 C ATOM 0 HA PRO A 91 -5.568 10.023 -13.808 1.00 0.00 H new ATOM 0 HB2 PRO A 91 -7.970 11.863 -13.941 1.00 0.00 H new ATOM 0 HB3 PRO A 91 -7.866 10.185 -14.435 1.00 0.00 H new ATOM 0 HG2 PRO A 91 -9.139 10.900 -12.174 1.00 0.00 H new ATOM 0 HG3 PRO A 91 -8.274 9.380 -12.290 1.00 0.00 H new ATOM 0 HD2 PRO A 91 -7.499 11.877 -10.808 1.00 0.00 H new ATOM 0 HD3 PRO A 91 -7.081 10.213 -10.450 1.00 0.00 H new ATOM 1411 N ASN A 92 -4.174 12.030 -14.483 1.00 0.00 N ATOM 1412 CA ASN A 92 -3.519 13.122 -15.255 1.00 0.00 C ATOM 1413 C ASN A 92 -3.324 12.676 -16.705 1.00 0.00 C ATOM 1414 O ASN A 92 -2.373 11.993 -17.032 1.00 0.00 O ATOM 1415 CB ASN A 92 -2.159 13.442 -14.633 1.00 0.00 C ATOM 1416 CG ASN A 92 -1.524 12.156 -14.103 1.00 0.00 C ATOM 1417 OD1 ASN A 92 -1.188 11.272 -14.865 1.00 0.00 O ATOM 1418 ND2 ASN A 92 -1.344 12.013 -12.818 1.00 0.00 N ATOM 0 H ASN A 92 -3.551 11.285 -14.171 1.00 0.00 H new ATOM 0 HA ASN A 92 -4.148 14.012 -15.230 1.00 0.00 H new ATOM 0 HB2 ASN A 92 -1.507 13.903 -15.375 1.00 0.00 H new ATOM 0 HB3 ASN A 92 -2.278 14.162 -13.823 1.00 0.00 H new ATOM 0 HD21 ASN A 92 -0.921 11.159 -12.454 1.00 0.00 H new ATOM 0 HD22 ASN A 92 -1.626 12.755 -12.178 1.00 0.00 H new ATOM 1425 N SER A 93 -4.217 13.055 -17.578 1.00 0.00 N ATOM 1426 CA SER A 93 -4.081 12.652 -19.007 1.00 0.00 C ATOM 1427 C SER A 93 -4.307 13.870 -19.905 1.00 0.00 C ATOM 1428 O SER A 93 -5.045 13.815 -20.868 1.00 0.00 O ATOM 1429 CB SER A 93 -5.120 11.579 -19.334 1.00 0.00 C ATOM 1430 OG SER A 93 -4.961 10.484 -18.440 1.00 0.00 O ATOM 0 H SER A 93 -5.035 13.626 -17.364 1.00 0.00 H new ATOM 0 HA SER A 93 -3.081 12.255 -19.179 1.00 0.00 H new ATOM 0 HB2 SER A 93 -6.125 11.991 -19.247 1.00 0.00 H new ATOM 0 HB3 SER A 93 -5.001 11.243 -20.364 1.00 0.00 H new ATOM 0 HG SER A 93 -5.626 9.795 -18.646 1.00 0.00 H new ATOM 1436 N THR A 94 -3.675 14.970 -19.598 1.00 0.00 N ATOM 1437 CA THR A 94 -3.853 16.189 -20.435 1.00 0.00 C ATOM 1438 C THR A 94 -3.302 15.928 -21.838 1.00 0.00 C ATOM 1439 O THR A 94 -3.550 16.678 -22.763 1.00 0.00 O ATOM 1440 CB THR A 94 -3.098 17.359 -19.800 1.00 0.00 C ATOM 1441 OG1 THR A 94 -2.886 17.090 -18.421 1.00 0.00 O ATOM 1442 CG2 THR A 94 -3.918 18.641 -19.952 1.00 0.00 C ATOM 0 H THR A 94 -3.044 15.077 -18.804 1.00 0.00 H new ATOM 0 HA THR A 94 -4.913 16.434 -20.500 1.00 0.00 H new ATOM 0 HB THR A 94 -2.137 17.485 -20.298 1.00 0.00 H new ATOM 0 HG1 THR A 94 -2.020 16.647 -18.304 1.00 0.00 H new ATOM 0 HG21 THR A 94 -3.379 19.473 -19.499 1.00 0.00 H new ATOM 0 HG22 THR A 94 -4.080 18.846 -21.010 1.00 0.00 H new ATOM 0 HG23 THR A 94 -4.880 18.518 -19.455 1.00 0.00 H new ATOM 1450 N THR A 95 -2.556 14.871 -22.006 1.00 0.00 N ATOM 1451 CA THR A 95 -1.991 14.562 -23.349 1.00 0.00 C ATOM 1452 C THR A 95 -3.052 13.862 -24.201 1.00 0.00 C ATOM 1453 O THR A 95 -2.805 13.485 -25.329 1.00 0.00 O ATOM 1454 CB THR A 95 -0.775 13.645 -23.193 1.00 0.00 C ATOM 1455 OG1 THR A 95 -1.212 12.300 -23.077 1.00 0.00 O ATOM 1456 CG2 THR A 95 0.008 14.041 -21.939 1.00 0.00 C ATOM 0 H THR A 95 -2.313 14.208 -21.270 1.00 0.00 H new ATOM 0 HA THR A 95 -1.687 15.488 -23.837 1.00 0.00 H new ATOM 0 HB THR A 95 -0.130 13.743 -24.066 1.00 0.00 H new ATOM 0 HG1 THR A 95 -0.435 11.711 -22.979 1.00 0.00 H new ATOM 0 HG21 THR A 95 0.873 13.388 -21.829 1.00 0.00 H new ATOM 0 HG22 THR A 95 0.343 15.074 -22.030 1.00 0.00 H new ATOM 0 HG23 THR A 95 -0.634 13.944 -21.063 1.00 0.00 H new ATOM 1464 N SER A 96 -4.230 13.686 -23.671 1.00 0.00 N ATOM 1465 CA SER A 96 -5.305 13.009 -24.450 1.00 0.00 C ATOM 1466 C SER A 96 -5.522 13.754 -25.769 1.00 0.00 C ATOM 1467 O SER A 96 -5.786 14.940 -25.787 1.00 0.00 O ATOM 1468 CB SER A 96 -6.602 13.013 -23.642 1.00 0.00 C ATOM 1469 OG SER A 96 -7.699 13.242 -24.516 1.00 0.00 O ATOM 0 H SER A 96 -4.495 13.982 -22.732 1.00 0.00 H new ATOM 0 HA SER A 96 -5.011 11.980 -24.657 1.00 0.00 H new ATOM 0 HB2 SER A 96 -6.726 12.061 -23.126 1.00 0.00 H new ATOM 0 HB3 SER A 96 -6.564 13.788 -22.876 1.00 0.00 H new ATOM 0 HG SER A 96 -8.533 13.244 -24.001 1.00 0.00 H new ATOM 1475 N SER A 97 -5.416 13.068 -26.874 1.00 0.00 N ATOM 1476 CA SER A 97 -5.617 13.738 -28.189 1.00 0.00 C ATOM 1477 C SER A 97 -4.671 14.935 -28.302 1.00 0.00 C ATOM 1478 O SER A 97 -3.747 15.084 -27.527 1.00 0.00 O ATOM 1479 CB SER A 97 -7.064 14.220 -28.300 1.00 0.00 C ATOM 1480 OG SER A 97 -7.175 15.510 -27.713 1.00 0.00 O ATOM 0 H SER A 97 -5.199 12.073 -26.923 1.00 0.00 H new ATOM 0 HA SER A 97 -5.407 13.032 -28.992 1.00 0.00 H new ATOM 0 HB2 SER A 97 -7.368 14.256 -29.346 1.00 0.00 H new ATOM 0 HB3 SER A 97 -7.732 13.520 -27.798 1.00 0.00 H new ATOM 0 HG SER A 97 -6.990 15.449 -26.753 1.00 0.00 H new ATOM 1486 N LEU A 98 -4.894 15.791 -29.261 1.00 0.00 N ATOM 1487 CA LEU A 98 -4.007 16.977 -29.423 1.00 0.00 C ATOM 1488 C LEU A 98 -4.789 18.113 -30.087 1.00 0.00 C ATOM 1489 O LEU A 98 -5.948 17.969 -30.419 1.00 0.00 O ATOM 1490 CB LEU A 98 -2.809 16.603 -30.297 1.00 0.00 C ATOM 1491 CG LEU A 98 -3.182 15.426 -31.198 1.00 0.00 C ATOM 1492 CD1 LEU A 98 -4.352 15.823 -32.100 1.00 0.00 C ATOM 1493 CD2 LEU A 98 -1.979 15.045 -32.064 1.00 0.00 C ATOM 0 H LEU A 98 -5.652 15.720 -29.939 1.00 0.00 H new ATOM 0 HA LEU A 98 -3.655 17.303 -28.444 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -2.507 17.457 -30.903 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -1.957 16.339 -29.671 1.00 0.00 H new ATOM 0 HG LEU A 98 -3.471 14.575 -30.581 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -4.617 14.983 -32.742 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -5.210 16.095 -31.485 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -4.064 16.674 -32.717 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -2.245 14.206 -32.707 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -1.690 15.896 -32.680 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -1.144 14.761 -31.423 1.00 0.00 H new ATOM 1505 N LYS A 99 -4.162 19.241 -30.284 1.00 0.00 N ATOM 1506 CA LYS A 99 -4.870 20.383 -30.927 1.00 0.00 C ATOM 1507 C LYS A 99 -3.881 21.525 -31.168 1.00 0.00 C ATOM 1508 O LYS A 99 -4.094 22.377 -32.008 1.00 0.00 O ATOM 1509 CB LYS A 99 -5.995 20.868 -30.010 1.00 0.00 C ATOM 1510 CG LYS A 99 -7.144 21.418 -30.859 1.00 0.00 C ATOM 1511 CD LYS A 99 -8.062 22.273 -29.982 1.00 0.00 C ATOM 1512 CE LYS A 99 -9.500 22.167 -30.492 1.00 0.00 C ATOM 1513 NZ LYS A 99 -10.377 23.073 -29.697 1.00 0.00 N ATOM 0 H LYS A 99 -3.191 19.420 -30.028 1.00 0.00 H new ATOM 0 HA LYS A 99 -5.291 20.060 -31.879 1.00 0.00 H new ATOM 0 HB2 LYS A 99 -6.350 20.047 -29.387 1.00 0.00 H new ATOM 0 HB3 LYS A 99 -5.623 21.641 -29.338 1.00 0.00 H new ATOM 0 HG2 LYS A 99 -6.749 22.015 -31.681 1.00 0.00 H new ATOM 0 HG3 LYS A 99 -7.708 20.597 -31.303 1.00 0.00 H new ATOM 0 HD2 LYS A 99 -8.007 21.939 -28.946 1.00 0.00 H new ATOM 0 HD3 LYS A 99 -7.734 23.312 -30.000 1.00 0.00 H new ATOM 0 HE2 LYS A 99 -9.544 22.435 -31.548 1.00 0.00 H new ATOM 0 HE3 LYS A 99 -9.852 21.139 -30.410 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 -11.355 23.001 -30.043 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 -10.344 22.797 -28.695 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 -10.045 24.054 -29.797 1.00 0.00 H new ATOM 1527 N THR A 100 -2.801 21.551 -30.437 1.00 0.00 N ATOM 1528 CA THR A 100 -1.799 22.638 -30.624 1.00 0.00 C ATOM 1529 C THR A 100 -0.599 22.390 -29.708 1.00 0.00 C ATOM 1530 O THR A 100 -0.726 22.346 -28.501 1.00 0.00 O ATOM 1531 CB THR A 100 -2.438 23.985 -30.275 1.00 0.00 C ATOM 1532 OG1 THR A 100 -1.419 24.960 -30.105 1.00 0.00 O ATOM 1533 CG2 THR A 100 -3.241 23.851 -28.981 1.00 0.00 C ATOM 0 H THR A 100 -2.569 20.866 -29.718 1.00 0.00 H new ATOM 0 HA THR A 100 -1.466 22.651 -31.662 1.00 0.00 H new ATOM 0 HB THR A 100 -3.104 24.292 -31.082 1.00 0.00 H new ATOM 0 HG1 THR A 100 -1.826 25.823 -29.883 1.00 0.00 H new ATOM 0 HG21 THR A 100 -3.695 24.810 -28.734 1.00 0.00 H new ATOM 0 HG22 THR A 100 -4.023 23.103 -29.114 1.00 0.00 H new ATOM 0 HG23 THR A 100 -2.578 23.544 -28.172 1.00 0.00 H new ATOM 1541 N LYS A 101 0.566 22.227 -30.272 1.00 0.00 N ATOM 1542 CA LYS A 101 1.773 21.983 -29.432 1.00 0.00 C ATOM 1543 C LYS A 101 2.958 22.763 -30.004 1.00 0.00 C ATOM 1544 O LYS A 101 4.087 22.588 -29.589 1.00 0.00 O ATOM 1545 CB LYS A 101 2.098 20.488 -29.433 1.00 0.00 C ATOM 1546 CG LYS A 101 2.684 20.093 -28.075 1.00 0.00 C ATOM 1547 CD LYS A 101 3.733 18.995 -28.270 1.00 0.00 C ATOM 1548 CE LYS A 101 4.243 18.528 -26.906 1.00 0.00 C ATOM 1549 NZ LYS A 101 5.575 19.142 -26.638 1.00 0.00 N ATOM 0 H LYS A 101 0.735 22.252 -31.278 1.00 0.00 H new ATOM 0 HA LYS A 101 1.580 22.313 -28.411 1.00 0.00 H new ATOM 0 HB2 LYS A 101 1.197 19.909 -29.635 1.00 0.00 H new ATOM 0 HB3 LYS A 101 2.808 20.260 -30.228 1.00 0.00 H new ATOM 0 HG2 LYS A 101 3.136 20.961 -27.596 1.00 0.00 H new ATOM 0 HG3 LYS A 101 1.892 19.741 -27.414 1.00 0.00 H new ATOM 0 HD2 LYS A 101 3.300 18.156 -28.815 1.00 0.00 H new ATOM 0 HD3 LYS A 101 4.561 19.371 -28.870 1.00 0.00 H new ATOM 0 HE2 LYS A 101 3.537 18.810 -26.125 1.00 0.00 H new ATOM 0 HE3 LYS A 101 4.321 17.441 -26.887 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 5.923 18.825 -25.711 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 6.246 18.852 -27.377 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 5.486 20.178 -26.639 1.00 0.00 H new ATOM 1563 N GLY A 102 2.712 23.624 -30.953 1.00 0.00 N ATOM 1564 CA GLY A 102 3.826 24.415 -31.549 1.00 0.00 C ATOM 1565 C GLY A 102 3.493 25.905 -31.472 1.00 0.00 C ATOM 1566 O GLY A 102 3.114 26.414 -30.435 1.00 0.00 O ATOM 0 H GLY A 102 1.788 23.814 -31.341 1.00 0.00 H new ATOM 0 HA2 GLY A 102 4.755 24.212 -31.017 1.00 0.00 H new ATOM 0 HA3 GLY A 102 3.981 24.120 -32.587 1.00 0.00 H new ATOM 1570 N GLY A 103 3.631 26.611 -32.561 1.00 0.00 N ATOM 1571 CA GLY A 103 3.323 28.069 -32.549 1.00 0.00 C ATOM 1572 C GLY A 103 2.469 28.422 -33.767 1.00 0.00 C ATOM 1573 O GLY A 103 1.579 27.687 -34.147 1.00 0.00 O ATOM 0 H GLY A 103 3.944 26.241 -33.459 1.00 0.00 H new ATOM 0 HA2 GLY A 103 2.794 28.332 -31.633 1.00 0.00 H new ATOM 0 HA3 GLY A 103 4.247 28.647 -32.560 1.00 0.00 H new ATOM 1577 N ASN A 104 2.732 29.541 -34.384 1.00 0.00 N ATOM 1578 CA ASN A 104 1.934 29.939 -35.578 1.00 0.00 C ATOM 1579 C ASN A 104 2.877 30.250 -36.741 1.00 0.00 C ATOM 1580 O ASN A 104 3.124 31.395 -37.063 1.00 0.00 O ATOM 1581 CB ASN A 104 1.106 31.182 -35.246 1.00 0.00 C ATOM 1582 CG ASN A 104 0.076 31.419 -36.352 1.00 0.00 C ATOM 1583 OD1 ASN A 104 -1.090 31.629 -36.079 1.00 0.00 O ATOM 1584 ND2 ASN A 104 0.458 31.394 -37.599 1.00 0.00 N ATOM 0 H ASN A 104 3.465 30.197 -34.113 1.00 0.00 H new ATOM 0 HA ASN A 104 1.268 29.123 -35.859 1.00 0.00 H new ATOM 0 HB2 ASN A 104 0.603 31.052 -34.288 1.00 0.00 H new ATOM 0 HB3 ASN A 104 1.757 32.051 -35.149 1.00 0.00 H new ATOM 0 HD21 ASN A 104 -0.221 31.551 -38.344 1.00 0.00 H new ATOM 0 HD22 ASN A 104 1.436 31.218 -37.829 1.00 0.00 H new ATOM 1591 N ALA A 105 3.407 29.239 -37.374 1.00 0.00 N ATOM 1592 CA ALA A 105 4.333 29.478 -38.516 1.00 0.00 C ATOM 1593 C ALA A 105 3.542 29.475 -39.825 1.00 0.00 C ATOM 1594 O ALA A 105 4.075 29.736 -40.885 1.00 0.00 O ATOM 1595 CB ALA A 105 5.390 28.371 -38.556 1.00 0.00 C ATOM 0 H ALA A 105 3.239 28.258 -37.149 1.00 0.00 H new ATOM 0 HA ALA A 105 4.822 30.444 -38.390 1.00 0.00 H new ATOM 0 HB1 ALA A 105 6.068 28.545 -39.392 1.00 0.00 H new ATOM 0 HB2 ALA A 105 5.955 28.373 -37.624 1.00 0.00 H new ATOM 0 HB3 ALA A 105 4.901 27.405 -38.681 1.00 0.00 H new ATOM 1601 N GLY A 106 2.271 29.182 -39.760 1.00 0.00 N ATOM 1602 CA GLY A 106 1.447 29.161 -41.002 1.00 0.00 C ATOM 1603 C GLY A 106 0.332 28.126 -40.858 1.00 0.00 C ATOM 1604 O GLY A 106 -0.725 28.406 -40.328 1.00 0.00 O ATOM 0 H GLY A 106 1.769 28.957 -38.901 1.00 0.00 H new ATOM 0 HA2 GLY A 106 1.020 30.147 -41.185 1.00 0.00 H new ATOM 0 HA3 GLY A 106 2.072 28.920 -41.862 1.00 0.00 H new ATOM 1608 N THR A 107 0.557 26.928 -41.326 1.00 0.00 N ATOM 1609 CA THR A 107 -0.491 25.875 -41.215 1.00 0.00 C ATOM 1610 C THR A 107 -1.827 26.431 -41.713 1.00 0.00 C ATOM 1611 O THR A 107 -1.898 27.077 -42.740 1.00 0.00 O ATOM 1612 CB THR A 107 -0.631 25.446 -39.752 1.00 0.00 C ATOM 1613 OG1 THR A 107 0.634 25.534 -39.113 1.00 0.00 O ATOM 1614 CG2 THR A 107 -1.139 24.005 -39.688 1.00 0.00 C ATOM 0 H THR A 107 1.422 26.634 -41.780 1.00 0.00 H new ATOM 0 HA THR A 107 -0.207 25.014 -41.820 1.00 0.00 H new ATOM 0 HB THR A 107 -1.340 26.101 -39.246 1.00 0.00 H new ATOM 0 HG1 THR A 107 0.547 25.262 -38.176 1.00 0.00 H new ATOM 0 HG21 THR A 107 -1.238 23.700 -38.646 1.00 0.00 H new ATOM 0 HG22 THR A 107 -2.110 23.939 -40.180 1.00 0.00 H new ATOM 0 HG23 THR A 107 -0.431 23.347 -40.193 1.00 0.00 H new ATOM 1622 N LYS A 108 -2.888 26.186 -40.993 1.00 0.00 N ATOM 1623 CA LYS A 108 -4.217 26.702 -41.426 1.00 0.00 C ATOM 1624 C LYS A 108 -4.269 28.217 -41.222 1.00 0.00 C ATOM 1625 O LYS A 108 -4.484 28.698 -40.127 1.00 0.00 O ATOM 1626 CB LYS A 108 -5.317 26.036 -40.595 1.00 0.00 C ATOM 1627 CG LYS A 108 -6.665 26.680 -40.923 1.00 0.00 C ATOM 1628 CD LYS A 108 -7.785 25.904 -40.229 1.00 0.00 C ATOM 1629 CE LYS A 108 -9.115 26.182 -40.933 1.00 0.00 C ATOM 1630 NZ LYS A 108 -10.226 26.106 -39.943 1.00 0.00 N ATOM 0 H LYS A 108 -2.892 25.651 -40.124 1.00 0.00 H new ATOM 0 HA LYS A 108 -4.369 26.474 -42.481 1.00 0.00 H new ATOM 0 HB2 LYS A 108 -5.351 24.967 -40.807 1.00 0.00 H new ATOM 0 HB3 LYS A 108 -5.100 26.143 -39.532 1.00 0.00 H new ATOM 0 HG2 LYS A 108 -6.672 27.720 -40.596 1.00 0.00 H new ATOM 0 HG3 LYS A 108 -6.825 26.684 -42.001 1.00 0.00 H new ATOM 0 HD2 LYS A 108 -7.568 24.836 -40.249 1.00 0.00 H new ATOM 0 HD3 LYS A 108 -7.849 26.197 -39.181 1.00 0.00 H new ATOM 0 HE2 LYS A 108 -9.094 27.168 -41.397 1.00 0.00 H new ATOM 0 HE3 LYS A 108 -9.275 25.457 -41.731 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 -11.130 26.295 -40.421 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 -10.250 25.156 -39.520 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 -10.075 26.814 -39.196 1.00 0.00 H new ATOM 1644 N ALA A 109 -4.073 28.973 -42.267 1.00 0.00 N ATOM 1645 CA ALA A 109 -4.111 30.456 -42.131 1.00 0.00 C ATOM 1646 C ALA A 109 -4.871 31.058 -43.315 1.00 0.00 C ATOM 1647 O ALA A 109 -4.605 32.164 -43.738 1.00 0.00 O ATOM 1648 CB ALA A 109 -2.682 31.003 -42.112 1.00 0.00 C ATOM 0 H ALA A 109 -3.888 28.628 -43.209 1.00 0.00 H new ATOM 0 HA ALA A 109 -4.615 30.723 -41.202 1.00 0.00 H new ATOM 0 HB1 ALA A 109 -2.709 32.088 -42.013 1.00 0.00 H new ATOM 0 HB2 ALA A 109 -2.140 30.575 -41.269 1.00 0.00 H new ATOM 0 HB3 ALA A 109 -2.178 30.736 -43.041 1.00 0.00 H new ATOM 1654 N TYR A 110 -5.817 30.336 -43.853 1.00 0.00 N ATOM 1655 CA TYR A 110 -6.593 30.868 -45.010 1.00 0.00 C ATOM 1656 C TYR A 110 -7.869 31.541 -44.500 1.00 0.00 C ATOM 1657 O TYR A 110 -8.460 31.117 -43.527 1.00 0.00 O ATOM 1658 CB TYR A 110 -6.962 29.717 -45.948 1.00 0.00 C ATOM 1659 CG TYR A 110 -5.978 28.586 -45.769 1.00 0.00 C ATOM 1660 CD1 TYR A 110 -4.759 28.605 -46.458 1.00 0.00 C ATOM 1661 CD2 TYR A 110 -6.285 27.520 -44.916 1.00 0.00 C ATOM 1662 CE1 TYR A 110 -3.846 27.556 -46.293 1.00 0.00 C ATOM 1663 CE2 TYR A 110 -5.371 26.471 -44.751 1.00 0.00 C ATOM 1664 CZ TYR A 110 -4.152 26.489 -45.440 1.00 0.00 C ATOM 1665 OH TYR A 110 -3.253 25.455 -45.277 1.00 0.00 O ATOM 0 H TYR A 110 -6.086 29.402 -43.542 1.00 0.00 H new ATOM 0 HA TYR A 110 -5.989 31.597 -45.550 1.00 0.00 H new ATOM 0 HB2 TYR A 110 -7.973 29.370 -45.735 1.00 0.00 H new ATOM 0 HB3 TYR A 110 -6.954 30.060 -46.983 1.00 0.00 H new ATOM 0 HD1 TYR A 110 -4.523 29.428 -47.116 1.00 0.00 H new ATOM 0 HD2 TYR A 110 -7.226 27.506 -44.385 1.00 0.00 H new ATOM 0 HE1 TYR A 110 -2.906 27.570 -46.824 1.00 0.00 H new ATOM 0 HE2 TYR A 110 -5.607 25.648 -44.092 1.00 0.00 H new ATOM 0 HH TYR A 110 -3.621 24.797 -44.650 1.00 0.00 H new ATOM 1675 N ASN A 111 -8.298 32.588 -45.150 1.00 0.00 N ATOM 1676 CA ASN A 111 -9.536 33.287 -44.703 1.00 0.00 C ATOM 1677 C ASN A 111 -10.220 33.934 -45.909 1.00 0.00 C ATOM 1678 O ASN A 111 -10.846 34.965 -45.727 1.00 0.00 O ATOM 1679 CB ASN A 111 -9.171 34.366 -43.683 1.00 0.00 C ATOM 1680 CG ASN A 111 -8.933 33.720 -42.318 1.00 0.00 C ATOM 1681 OD1 ASN A 111 -7.954 34.009 -41.658 1.00 0.00 O ATOM 1682 ND2 ASN A 111 -9.792 32.850 -41.862 1.00 0.00 N ATOM 1683 OXT ASN A 111 -10.107 33.387 -46.994 1.00 0.00 O ATOM 0 H ASN A 111 -7.845 32.989 -45.971 1.00 0.00 H new ATOM 0 HA ASN A 111 -10.214 32.568 -44.244 1.00 0.00 H new ATOM 0 HB2 ASN A 111 -8.276 34.898 -44.006 1.00 0.00 H new ATOM 0 HB3 ASN A 111 -9.972 35.102 -43.614 1.00 0.00 H new ATOM 0 HD21 ASN A 111 -9.642 32.413 -40.953 1.00 0.00 H new ATOM 0 HD22 ASN A 111 -10.614 32.607 -42.415 1.00 0.00 H new TER 1690 ASN A 111