USER MOD reduce.3.24.130724 H: found=0, std=0, add=687, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 685 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 GLY N :NH3+ -125:sc= 0.105 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 33:sc= 1.05 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 11 THR OG1 : rot 180:sc= 0 USER MOD Single : A 13 GLN :FLIP amide:sc= -0.502 F(o=-1.3,f=-0.5) USER MOD Single : A 14 LYS NZ :NH3+ -161:sc= -0.0332 (180deg=-0.298) USER MOD Single : A 16 LYS NZ :NH3+ -149:sc= -0.436 (180deg=-1.3) USER MOD Single : A 18 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0169) USER MOD Single : A 19 THR OG1 : rot 180:sc=-0.00302 USER MOD Single : A 22 GLN : amide:sc= -0.716! C(o=-0.72!,f=-5.9!) USER MOD Single : A 27 GLN : amide:sc= -0.187 K(o=-0.19,f=-2.4!) USER MOD Single : A 29 SER OG : rot -80:sc= 0.0339 USER MOD Single : A 32 ASN : amide:sc= -0.0707 K(o=-0.071,f=-2!) USER MOD Single : A 33 SER OG : rot 36:sc= 0.625 USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 37 THR OG1 : rot 180:sc= 0.0433 USER MOD Single : A 42 ASN : amide:sc= -0.141 X(o=-0.14,f=-0.23) USER MOD Single : A 47 GLN : amide:sc= -0.217 X(o=-0.22,f=-0.22) USER MOD Single : A 48 THR OG1 : rot -55:sc= 0.512 USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 THR OG1 : rot 180:sc= 0 USER MOD Single : A 60 THR OG1 : rot 77:sc= 0.352 USER MOD Single : A 62 LYS NZ :NH3+ -176:sc= 0.00179 (180deg=0) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 66 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.0218) USER MOD Single : A 69 LYS NZ :NH3+ -108:sc= -0.651 (180deg=-2.74!) USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 MET CE :methyl -168:sc=-0.00827 (180deg=-0.203) USER MOD Single : A 78 SER OG : rot 180:sc= -0.278 USER MOD Single : A 79 ASN : amide:sc= 0 X(o=0,f=-0.037) USER MOD Single : A 82 SER OG : rot 36:sc= 0.686 USER MOD Single : A 83 SER OG : rot 180:sc= 0 USER MOD Single : A 84 SER OG : rot 180:sc= 0 USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 9.238 -18.321 34.564 1.00 0.00 N ATOM 2 CA GLY A 1 9.413 -17.057 33.873 1.00 0.00 C ATOM 3 C GLY A 1 9.135 -17.165 32.387 1.00 0.00 C ATOM 4 O GLY A 1 8.759 -18.228 31.895 1.00 0.00 O ATOM 0 H1 GLY A 1 8.564 -18.198 35.346 1.00 0.00 H new ATOM 0 H2 GLY A 1 8.871 -19.032 33.899 1.00 0.00 H new ATOM 0 H3 GLY A 1 10.153 -18.640 34.942 1.00 0.00 H new ATOM 0 HA2 GLY A 1 8.748 -16.312 34.311 1.00 0.00 H new ATOM 0 HA3 GLY A 1 10.433 -16.702 34.024 1.00 0.00 H new ATOM 8 N SER A 2 9.320 -16.061 31.671 1.00 0.00 N ATOM 9 CA SER A 2 9.081 -16.034 30.232 1.00 0.00 C ATOM 10 C SER A 2 9.851 -14.893 29.575 1.00 0.00 C ATOM 11 O SER A 2 9.621 -13.721 29.874 1.00 0.00 O ATOM 12 CB SER A 2 7.586 -15.888 29.944 1.00 0.00 C ATOM 13 OG SER A 2 7.292 -16.211 28.596 1.00 0.00 O ATOM 0 H SER A 2 9.635 -15.173 32.063 1.00 0.00 H new ATOM 0 HA SER A 2 9.434 -16.976 29.813 1.00 0.00 H new ATOM 0 HB2 SER A 2 7.019 -16.539 30.609 1.00 0.00 H new ATOM 0 HB3 SER A 2 7.270 -14.866 30.153 1.00 0.00 H new ATOM 0 HG SER A 2 6.330 -16.111 28.438 1.00 0.00 H new ATOM 19 N SER A 3 10.766 -15.244 28.677 1.00 0.00 N ATOM 20 CA SER A 3 11.573 -14.250 27.979 1.00 0.00 C ATOM 21 C SER A 3 10.840 -13.720 26.750 1.00 0.00 C ATOM 22 O SER A 3 9.898 -14.341 26.260 1.00 0.00 O ATOM 23 CB SER A 3 12.916 -14.853 27.564 1.00 0.00 C ATOM 24 OG SER A 3 12.774 -15.676 26.419 1.00 0.00 O ATOM 0 H SER A 3 10.967 -16.209 28.416 1.00 0.00 H new ATOM 0 HA SER A 3 11.751 -13.419 28.661 1.00 0.00 H new ATOM 0 HB2 SER A 3 13.628 -14.054 27.355 1.00 0.00 H new ATOM 0 HB3 SER A 3 13.325 -15.438 28.388 1.00 0.00 H new ATOM 0 HG SER A 3 13.647 -16.048 26.173 1.00 0.00 H new ATOM 30 N GLY A 4 11.280 -12.566 26.258 1.00 0.00 N ATOM 31 CA GLY A 4 10.655 -11.971 25.091 1.00 0.00 C ATOM 32 C GLY A 4 11.660 -11.305 24.172 1.00 0.00 C ATOM 33 O GLY A 4 12.643 -10.725 24.632 1.00 0.00 O ATOM 0 H GLY A 4 12.058 -12.033 26.646 1.00 0.00 H new ATOM 0 HA2 GLY A 4 10.117 -12.741 24.539 1.00 0.00 H new ATOM 0 HA3 GLY A 4 9.918 -11.235 25.413 1.00 0.00 H new ATOM 37 N SER A 5 11.414 -11.390 22.868 1.00 0.00 N ATOM 38 CA SER A 5 12.307 -10.796 21.881 1.00 0.00 C ATOM 39 C SER A 5 11.629 -10.706 20.518 1.00 0.00 C ATOM 40 O SER A 5 10.599 -11.339 20.282 1.00 0.00 O ATOM 41 CB SER A 5 13.595 -11.615 21.770 1.00 0.00 C ATOM 42 OG SER A 5 14.554 -11.189 22.722 1.00 0.00 O ATOM 0 H SER A 5 10.603 -11.865 22.471 1.00 0.00 H new ATOM 0 HA SER A 5 12.553 -9.787 22.211 1.00 0.00 H new ATOM 0 HB2 SER A 5 13.372 -12.671 21.921 1.00 0.00 H new ATOM 0 HB3 SER A 5 14.007 -11.517 20.766 1.00 0.00 H new ATOM 0 HG SER A 5 14.097 -10.885 23.534 1.00 0.00 H new ATOM 48 N SER A 6 12.213 -9.915 19.624 1.00 0.00 N ATOM 49 CA SER A 6 11.663 -9.738 18.285 1.00 0.00 C ATOM 50 C SER A 6 12.654 -9.009 17.383 1.00 0.00 C ATOM 51 O SER A 6 13.458 -8.202 17.849 1.00 0.00 O ATOM 52 CB SER A 6 10.347 -8.960 18.349 1.00 0.00 C ATOM 53 OG SER A 6 10.539 -7.681 18.928 1.00 0.00 O ATOM 0 H SER A 6 13.067 -9.386 19.802 1.00 0.00 H new ATOM 0 HA SER A 6 11.473 -10.725 17.864 1.00 0.00 H new ATOM 0 HB2 SER A 6 9.936 -8.850 17.345 1.00 0.00 H new ATOM 0 HB3 SER A 6 9.617 -9.521 18.933 1.00 0.00 H new ATOM 0 HG SER A 6 9.684 -7.203 18.956 1.00 0.00 H new ATOM 59 N GLY A 7 12.591 -9.300 16.087 1.00 0.00 N ATOM 60 CA GLY A 7 13.487 -8.664 15.139 1.00 0.00 C ATOM 61 C GLY A 7 14.923 -8.644 15.623 1.00 0.00 C ATOM 62 O GLY A 7 15.413 -7.639 16.139 1.00 0.00 O ATOM 0 H GLY A 7 11.935 -9.965 15.677 1.00 0.00 H new ATOM 0 HA2 GLY A 7 13.435 -9.190 14.186 1.00 0.00 H new ATOM 0 HA3 GLY A 7 13.154 -7.642 14.958 1.00 0.00 H new ATOM 66 N PRO A 8 15.623 -9.776 15.460 1.00 0.00 N ATOM 67 CA PRO A 8 17.021 -9.911 15.879 1.00 0.00 C ATOM 68 C PRO A 8 17.968 -9.086 15.013 1.00 0.00 C ATOM 69 O PRO A 8 18.798 -8.336 15.526 1.00 0.00 O ATOM 70 CB PRO A 8 17.302 -11.405 15.704 1.00 0.00 C ATOM 71 CG PRO A 8 16.336 -11.853 14.662 1.00 0.00 C ATOM 72 CD PRO A 8 15.103 -11.013 14.853 1.00 0.00 C ATOM 0 HA PRO A 8 17.178 -9.550 16.896 1.00 0.00 H new ATOM 0 HB2 PRO A 8 18.331 -11.580 15.391 1.00 0.00 H new ATOM 0 HB3 PRO A 8 17.156 -11.947 16.638 1.00 0.00 H new ATOM 0 HG2 PRO A 8 16.749 -11.718 13.663 1.00 0.00 H new ATOM 0 HG3 PRO A 8 16.107 -12.913 14.772 1.00 0.00 H new ATOM 0 HD2 PRO A 8 14.601 -10.815 13.906 1.00 0.00 H new ATOM 0 HD3 PRO A 8 14.378 -11.505 15.502 1.00 0.00 H new ATOM 80 N ASP A 9 17.836 -9.229 13.699 1.00 0.00 N ATOM 81 CA ASP A 9 18.679 -8.495 12.762 1.00 0.00 C ATOM 82 C ASP A 9 18.104 -8.558 11.351 1.00 0.00 C ATOM 83 O ASP A 9 18.052 -9.624 10.737 1.00 0.00 O ATOM 84 CB ASP A 9 20.100 -9.059 12.773 1.00 0.00 C ATOM 85 CG ASP A 9 20.180 -10.441 12.156 1.00 0.00 C ATOM 86 OD1 ASP A 9 19.642 -11.392 12.762 1.00 0.00 O ATOM 87 OD2 ASP A 9 20.780 -10.573 11.069 1.00 0.00 O ATOM 0 H ASP A 9 17.154 -9.846 13.258 1.00 0.00 H new ATOM 0 HA ASP A 9 18.708 -7.452 13.077 1.00 0.00 H new ATOM 0 HB2 ASP A 9 20.760 -8.383 12.229 1.00 0.00 H new ATOM 0 HB3 ASP A 9 20.463 -9.101 13.800 1.00 0.00 H new ATOM 92 N PHE A 10 17.671 -7.409 10.842 1.00 0.00 N ATOM 93 CA PHE A 10 17.098 -7.333 9.503 1.00 0.00 C ATOM 94 C PHE A 10 18.036 -7.956 8.473 1.00 0.00 C ATOM 95 O PHE A 10 19.254 -7.978 8.658 1.00 0.00 O ATOM 96 CB PHE A 10 16.808 -5.878 9.131 1.00 0.00 C ATOM 97 CG PHE A 10 17.901 -4.928 9.530 1.00 0.00 C ATOM 98 CD1 PHE A 10 19.063 -4.833 8.780 1.00 0.00 C ATOM 99 CD2 PHE A 10 17.767 -4.131 10.655 1.00 0.00 C ATOM 100 CE1 PHE A 10 20.070 -3.959 9.145 1.00 0.00 C ATOM 101 CE2 PHE A 10 18.771 -3.255 11.024 1.00 0.00 C ATOM 102 CZ PHE A 10 19.924 -3.171 10.269 1.00 0.00 C ATOM 0 H PHE A 10 17.706 -6.518 11.337 1.00 0.00 H new ATOM 0 HA PHE A 10 16.163 -7.894 9.503 1.00 0.00 H new ATOM 0 HB2 PHE A 10 16.654 -5.810 8.054 1.00 0.00 H new ATOM 0 HB3 PHE A 10 15.877 -5.568 9.606 1.00 0.00 H new ATOM 0 HD1 PHE A 10 19.183 -5.449 7.901 1.00 0.00 H new ATOM 0 HD2 PHE A 10 16.868 -4.195 11.251 1.00 0.00 H new ATOM 0 HE1 PHE A 10 20.970 -3.893 8.551 1.00 0.00 H new ATOM 0 HE2 PHE A 10 18.654 -2.637 11.902 1.00 0.00 H new ATOM 0 HZ PHE A 10 20.711 -2.490 10.557 1.00 0.00 H new ATOM 112 N THR A 11 17.460 -8.464 7.388 1.00 0.00 N ATOM 113 CA THR A 11 18.243 -9.090 6.330 1.00 0.00 C ATOM 114 C THR A 11 19.380 -8.181 5.876 1.00 0.00 C ATOM 115 O THR A 11 19.247 -6.958 5.825 1.00 0.00 O ATOM 116 CB THR A 11 17.365 -9.440 5.113 1.00 0.00 C ATOM 117 OG1 THR A 11 16.645 -8.280 4.679 1.00 0.00 O ATOM 118 CG2 THR A 11 16.385 -10.552 5.456 1.00 0.00 C ATOM 0 H THR A 11 16.454 -8.454 7.219 1.00 0.00 H new ATOM 0 HA THR A 11 18.658 -10.008 6.746 1.00 0.00 H new ATOM 0 HB THR A 11 18.016 -9.785 4.310 1.00 0.00 H new ATOM 0 HG1 THR A 11 16.091 -8.510 3.904 1.00 0.00 H new ATOM 0 HG21 THR A 11 15.776 -10.782 4.582 1.00 0.00 H new ATOM 0 HG22 THR A 11 16.936 -11.442 5.759 1.00 0.00 H new ATOM 0 HG23 THR A 11 15.740 -10.229 6.273 1.00 0.00 H new ATOM 126 N PRO A 12 20.526 -8.790 5.538 1.00 0.00 N ATOM 127 CA PRO A 12 21.709 -8.054 5.081 1.00 0.00 C ATOM 128 C PRO A 12 21.512 -7.441 3.699 1.00 0.00 C ATOM 129 O PRO A 12 21.901 -6.299 3.456 1.00 0.00 O ATOM 130 CB PRO A 12 22.800 -9.126 5.040 1.00 0.00 C ATOM 131 CG PRO A 12 22.065 -10.408 4.853 1.00 0.00 C ATOM 132 CD PRO A 12 20.756 -10.244 5.575 1.00 0.00 C ATOM 0 HA PRO A 12 21.943 -7.213 5.734 1.00 0.00 H new ATOM 0 HB2 PRO A 12 23.499 -8.948 4.223 1.00 0.00 H new ATOM 0 HB3 PRO A 12 23.382 -9.134 5.962 1.00 0.00 H new ATOM 0 HG2 PRO A 12 21.904 -10.615 3.795 1.00 0.00 H new ATOM 0 HG3 PRO A 12 22.632 -11.246 5.259 1.00 0.00 H new ATOM 0 HD2 PRO A 12 19.953 -10.791 5.080 1.00 0.00 H new ATOM 0 HD3 PRO A 12 20.812 -10.616 6.598 1.00 0.00 H new ATOM 140 N GLN A 13 20.907 -8.207 2.798 1.00 0.00 N ATOM 141 CA GLN A 13 20.659 -7.738 1.439 1.00 0.00 C ATOM 142 C GLN A 13 19.421 -6.849 1.388 1.00 0.00 C ATOM 143 O GLN A 13 18.618 -6.829 2.321 1.00 0.00 O ATOM 144 CB GLN A 13 20.488 -8.926 0.490 1.00 0.00 C ATOM 145 CG GLN A 13 21.805 -9.512 0.006 1.00 0.00 C ATOM 146 CD GLN A 13 22.522 -10.303 1.082 1.00 0.00 C ATOM 147 OE1 GLN A 13 21.887 -11.368 1.557 1.00 0.00 O flip ATOM 148 NE2 GLN A 13 23.635 -9.960 1.482 1.00 0.00 N flip ATOM 0 H GLN A 13 20.579 -9.155 2.984 1.00 0.00 H new ATOM 0 HA GLN A 13 21.520 -7.150 1.122 1.00 0.00 H new ATOM 0 HB2 GLN A 13 19.917 -9.705 0.995 1.00 0.00 H new ATOM 0 HB3 GLN A 13 19.902 -8.610 -0.373 1.00 0.00 H new ATOM 0 HG2 GLN A 13 21.617 -10.159 -0.851 1.00 0.00 H new ATOM 0 HG3 GLN A 13 22.452 -8.706 -0.339 1.00 0.00 H new ATOM 0 HE21 GLN A 13 24.086 -9.134 1.089 1.00 0.00 H new ATOM 0 HE22 GLN A 13 24.106 -10.502 2.207 1.00 0.00 H new ATOM 157 N LYS A 14 19.273 -6.113 0.291 1.00 0.00 N ATOM 158 CA LYS A 14 18.133 -5.221 0.116 1.00 0.00 C ATOM 159 C LYS A 14 16.888 -6.003 -0.291 1.00 0.00 C ATOM 160 O LYS A 14 16.981 -7.039 -0.949 1.00 0.00 O ATOM 161 CB LYS A 14 18.448 -4.158 -0.939 1.00 0.00 C ATOM 162 CG LYS A 14 19.185 -2.951 -0.384 1.00 0.00 C ATOM 163 CD LYS A 14 19.914 -2.191 -1.480 1.00 0.00 C ATOM 164 CE LYS A 14 21.194 -2.902 -1.893 1.00 0.00 C ATOM 165 NZ LYS A 14 22.217 -2.876 -0.810 1.00 0.00 N ATOM 0 H LYS A 14 19.929 -6.117 -0.490 1.00 0.00 H new ATOM 0 HA LYS A 14 17.937 -4.731 1.070 1.00 0.00 H new ATOM 0 HB2 LYS A 14 19.049 -4.609 -1.729 1.00 0.00 H new ATOM 0 HB3 LYS A 14 17.517 -3.826 -1.397 1.00 0.00 H new ATOM 0 HG2 LYS A 14 18.477 -2.287 0.111 1.00 0.00 H new ATOM 0 HG3 LYS A 14 19.900 -3.276 0.372 1.00 0.00 H new ATOM 0 HD2 LYS A 14 19.261 -2.083 -2.346 1.00 0.00 H new ATOM 0 HD3 LYS A 14 20.151 -1.186 -1.132 1.00 0.00 H new ATOM 0 HE2 LYS A 14 20.967 -3.936 -2.154 1.00 0.00 H new ATOM 0 HE3 LYS A 14 21.600 -2.429 -2.787 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 23.156 -3.069 -1.214 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 22.220 -1.939 -0.358 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 21.990 -3.602 -0.101 1.00 0.00 H new ATOM 179 N PHE A 15 15.723 -5.499 0.103 1.00 0.00 N ATOM 180 CA PHE A 15 14.460 -6.150 -0.221 1.00 0.00 C ATOM 181 C PHE A 15 13.435 -5.133 -0.715 1.00 0.00 C ATOM 182 O PHE A 15 12.339 -5.020 -0.165 1.00 0.00 O ATOM 183 CB PHE A 15 13.913 -6.888 1.002 1.00 0.00 C ATOM 184 CG PHE A 15 13.415 -5.972 2.083 1.00 0.00 C ATOM 185 CD1 PHE A 15 14.287 -5.123 2.746 1.00 0.00 C ATOM 186 CD2 PHE A 15 12.075 -5.958 2.435 1.00 0.00 C ATOM 187 CE1 PHE A 15 13.832 -4.279 3.741 1.00 0.00 C ATOM 188 CE2 PHE A 15 11.614 -5.116 3.429 1.00 0.00 C ATOM 189 CZ PHE A 15 12.493 -4.275 4.083 1.00 0.00 C ATOM 0 H PHE A 15 15.628 -4.642 0.647 1.00 0.00 H new ATOM 0 HA PHE A 15 14.646 -6.870 -1.018 1.00 0.00 H new ATOM 0 HB2 PHE A 15 13.099 -7.542 0.688 1.00 0.00 H new ATOM 0 HB3 PHE A 15 14.696 -7.527 1.411 1.00 0.00 H new ATOM 0 HD1 PHE A 15 15.334 -5.121 2.482 1.00 0.00 H new ATOM 0 HD2 PHE A 15 11.383 -6.613 1.927 1.00 0.00 H new ATOM 0 HE1 PHE A 15 14.522 -3.623 4.251 1.00 0.00 H new ATOM 0 HE2 PHE A 15 10.567 -5.116 3.694 1.00 0.00 H new ATOM 0 HZ PHE A 15 12.135 -3.616 4.860 1.00 0.00 H new ATOM 199 N LYS A 16 13.799 -4.393 -1.757 1.00 0.00 N ATOM 200 CA LYS A 16 12.913 -3.385 -2.328 1.00 0.00 C ATOM 201 C LYS A 16 12.714 -3.620 -3.822 1.00 0.00 C ATOM 202 O LYS A 16 12.219 -2.747 -4.534 1.00 0.00 O ATOM 203 CB LYS A 16 13.482 -1.984 -2.092 1.00 0.00 C ATOM 204 CG LYS A 16 14.947 -1.851 -2.470 1.00 0.00 C ATOM 205 CD LYS A 16 15.116 -1.559 -3.952 1.00 0.00 C ATOM 206 CE LYS A 16 15.113 -0.064 -4.229 1.00 0.00 C ATOM 207 NZ LYS A 16 13.733 0.496 -4.234 1.00 0.00 N ATOM 0 H LYS A 16 14.702 -4.473 -2.224 1.00 0.00 H new ATOM 0 HA LYS A 16 11.945 -3.465 -1.833 1.00 0.00 H new ATOM 0 HB2 LYS A 16 12.900 -1.263 -2.667 1.00 0.00 H new ATOM 0 HB3 LYS A 16 13.362 -1.725 -1.040 1.00 0.00 H new ATOM 0 HG2 LYS A 16 15.403 -1.051 -1.886 1.00 0.00 H new ATOM 0 HG3 LYS A 16 15.474 -2.771 -2.217 1.00 0.00 H new ATOM 0 HD2 LYS A 16 16.051 -1.994 -4.305 1.00 0.00 H new ATOM 0 HD3 LYS A 16 14.311 -2.036 -4.512 1.00 0.00 H new ATOM 0 HE2 LYS A 16 15.709 0.447 -3.473 1.00 0.00 H new ATOM 0 HE3 LYS A 16 15.586 0.128 -5.192 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 13.686 1.298 -4.894 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 13.061 -0.239 -4.534 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 13.487 0.820 -3.277 1.00 0.00 H new ATOM 221 N GLU A 17 13.101 -4.803 -4.287 1.00 0.00 N ATOM 222 CA GLU A 17 12.963 -5.150 -5.697 1.00 0.00 C ATOM 223 C GLU A 17 11.585 -5.744 -5.979 1.00 0.00 C ATOM 224 O GLU A 17 11.453 -6.701 -6.741 1.00 0.00 O ATOM 225 CB GLU A 17 14.052 -6.143 -6.109 1.00 0.00 C ATOM 226 CG GLU A 17 14.376 -6.109 -7.594 1.00 0.00 C ATOM 227 CD GLU A 17 13.370 -6.877 -8.428 1.00 0.00 C ATOM 228 OE1 GLU A 17 13.358 -8.123 -8.346 1.00 0.00 O ATOM 229 OE2 GLU A 17 12.593 -6.232 -9.163 1.00 0.00 O ATOM 0 H GLU A 17 13.512 -5.537 -3.710 1.00 0.00 H new ATOM 0 HA GLU A 17 13.073 -4.237 -6.282 1.00 0.00 H new ATOM 0 HB2 GLU A 17 14.959 -5.931 -5.543 1.00 0.00 H new ATOM 0 HB3 GLU A 17 13.735 -7.150 -5.838 1.00 0.00 H new ATOM 0 HG2 GLU A 17 14.407 -5.073 -7.932 1.00 0.00 H new ATOM 0 HG3 GLU A 17 15.370 -6.527 -7.755 1.00 0.00 H new ATOM 236 N LYS A 18 10.561 -5.169 -5.357 1.00 0.00 N ATOM 237 CA LYS A 18 9.193 -5.638 -5.540 1.00 0.00 C ATOM 238 C LYS A 18 8.682 -5.295 -6.935 1.00 0.00 C ATOM 239 O LYS A 18 9.297 -4.511 -7.658 1.00 0.00 O ATOM 240 CB LYS A 18 8.275 -5.021 -4.482 1.00 0.00 C ATOM 241 CG LYS A 18 8.770 -5.214 -3.060 1.00 0.00 C ATOM 242 CD LYS A 18 7.627 -5.164 -2.060 1.00 0.00 C ATOM 243 CE LYS A 18 7.931 -5.995 -0.823 1.00 0.00 C ATOM 244 NZ LYS A 18 9.081 -5.444 -0.053 1.00 0.00 N ATOM 0 H LYS A 18 10.653 -4.377 -4.721 1.00 0.00 H new ATOM 0 HA LYS A 18 9.189 -6.722 -5.428 1.00 0.00 H new ATOM 0 HB2 LYS A 18 8.172 -3.954 -4.680 1.00 0.00 H new ATOM 0 HB3 LYS A 18 7.282 -5.460 -4.575 1.00 0.00 H new ATOM 0 HG2 LYS A 18 9.283 -6.172 -2.979 1.00 0.00 H new ATOM 0 HG3 LYS A 18 9.499 -4.440 -2.819 1.00 0.00 H new ATOM 0 HD2 LYS A 18 7.442 -4.130 -1.768 1.00 0.00 H new ATOM 0 HD3 LYS A 18 6.715 -5.530 -2.530 1.00 0.00 H new ATOM 0 HE2 LYS A 18 7.049 -6.030 -0.183 1.00 0.00 H new ATOM 0 HE3 LYS A 18 8.151 -7.021 -1.120 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 9.182 -5.965 0.841 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 9.952 -5.543 -0.612 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 8.913 -4.438 0.150 1.00 0.00 H new ATOM 258 N THR A 19 7.551 -5.886 -7.308 1.00 0.00 N ATOM 259 CA THR A 19 6.957 -5.643 -8.617 1.00 0.00 C ATOM 260 C THR A 19 5.652 -4.865 -8.492 1.00 0.00 C ATOM 261 O THR A 19 4.984 -4.917 -7.460 1.00 0.00 O ATOM 262 CB THR A 19 6.686 -6.962 -9.365 1.00 0.00 C ATOM 263 OG1 THR A 19 6.212 -6.686 -10.688 1.00 0.00 O ATOM 264 CG2 THR A 19 5.663 -7.806 -8.620 1.00 0.00 C ATOM 0 H THR A 19 7.028 -6.537 -6.722 1.00 0.00 H new ATOM 0 HA THR A 19 7.676 -5.053 -9.186 1.00 0.00 H new ATOM 0 HB THR A 19 7.621 -7.520 -9.423 1.00 0.00 H new ATOM 0 HG1 THR A 19 6.044 -7.529 -11.158 1.00 0.00 H new ATOM 0 HG21 THR A 19 5.488 -8.732 -9.167 1.00 0.00 H new ATOM 0 HG22 THR A 19 6.039 -8.039 -7.624 1.00 0.00 H new ATOM 0 HG23 THR A 19 4.728 -7.253 -8.534 1.00 0.00 H new ATOM 272 N ALA A 20 5.294 -4.145 -9.550 1.00 0.00 N ATOM 273 CA ALA A 20 4.066 -3.359 -9.559 1.00 0.00 C ATOM 274 C ALA A 20 2.912 -4.136 -8.935 1.00 0.00 C ATOM 275 O ALA A 20 2.399 -3.761 -7.881 1.00 0.00 O ATOM 276 CB ALA A 20 3.717 -2.942 -10.980 1.00 0.00 C ATOM 0 H ALA A 20 5.837 -4.090 -10.412 1.00 0.00 H new ATOM 0 HA ALA A 20 4.232 -2.464 -8.960 1.00 0.00 H new ATOM 0 HB1 ALA A 20 2.798 -2.356 -10.972 1.00 0.00 H new ATOM 0 HB2 ALA A 20 4.527 -2.341 -11.392 1.00 0.00 H new ATOM 0 HB3 ALA A 20 3.575 -3.830 -11.595 1.00 0.00 H new ATOM 282 N GLU A 21 2.509 -5.218 -9.592 1.00 0.00 N ATOM 283 CA GLU A 21 1.414 -6.046 -9.101 1.00 0.00 C ATOM 284 C GLU A 21 1.477 -6.186 -7.583 1.00 0.00 C ATOM 285 O GLU A 21 0.504 -5.907 -6.883 1.00 0.00 O ATOM 286 CB GLU A 21 1.457 -7.429 -9.754 1.00 0.00 C ATOM 287 CG GLU A 21 0.087 -8.063 -9.929 1.00 0.00 C ATOM 288 CD GLU A 21 -0.656 -7.522 -11.135 1.00 0.00 C ATOM 289 OE1 GLU A 21 -1.053 -6.339 -11.106 1.00 0.00 O ATOM 290 OE2 GLU A 21 -0.841 -8.283 -12.108 1.00 0.00 O ATOM 0 H GLU A 21 2.924 -5.542 -10.466 1.00 0.00 H new ATOM 0 HA GLU A 21 0.476 -5.557 -9.365 1.00 0.00 H new ATOM 0 HB2 GLU A 21 1.937 -7.346 -10.729 1.00 0.00 H new ATOM 0 HB3 GLU A 21 2.078 -8.088 -9.148 1.00 0.00 H new ATOM 0 HG2 GLU A 21 0.201 -9.142 -10.031 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -0.507 -7.888 -9.032 1.00 0.00 H new ATOM 297 N GLN A 22 2.628 -6.622 -7.082 1.00 0.00 N ATOM 298 CA GLN A 22 2.818 -6.801 -5.647 1.00 0.00 C ATOM 299 C GLN A 22 2.424 -5.541 -4.885 1.00 0.00 C ATOM 300 O GLN A 22 1.600 -5.587 -3.970 1.00 0.00 O ATOM 301 CB GLN A 22 4.274 -7.161 -5.345 1.00 0.00 C ATOM 302 CG GLN A 22 4.622 -8.606 -5.665 1.00 0.00 C ATOM 303 CD GLN A 22 6.065 -8.942 -5.344 1.00 0.00 C ATOM 304 OE1 GLN A 22 6.943 -8.081 -5.400 1.00 0.00 O ATOM 305 NE2 GLN A 22 6.318 -10.201 -5.005 1.00 0.00 N ATOM 0 H GLN A 22 3.443 -6.858 -7.648 1.00 0.00 H new ATOM 0 HA GLN A 22 2.174 -7.617 -5.319 1.00 0.00 H new ATOM 0 HB2 GLN A 22 4.928 -6.503 -5.917 1.00 0.00 H new ATOM 0 HB3 GLN A 22 4.475 -6.972 -4.290 1.00 0.00 H new ATOM 0 HG2 GLN A 22 3.964 -9.268 -5.101 1.00 0.00 H new ATOM 0 HG3 GLN A 22 4.435 -8.796 -6.722 1.00 0.00 H new ATOM 0 HE21 GLN A 22 5.560 -10.882 -4.971 1.00 0.00 H new ATOM 0 HE22 GLN A 22 7.271 -10.487 -4.778 1.00 0.00 H new ATOM 314 N LEU A 23 3.018 -4.415 -5.266 1.00 0.00 N ATOM 315 CA LEU A 23 2.730 -3.140 -4.617 1.00 0.00 C ATOM 316 C LEU A 23 1.245 -2.805 -4.712 1.00 0.00 C ATOM 317 O LEU A 23 0.572 -2.629 -3.696 1.00 0.00 O ATOM 318 CB LEU A 23 3.558 -2.023 -5.254 1.00 0.00 C ATOM 319 CG LEU A 23 5.009 -1.913 -4.785 1.00 0.00 C ATOM 320 CD1 LEU A 23 5.754 -0.864 -5.596 1.00 0.00 C ATOM 321 CD2 LEU A 23 5.066 -1.581 -3.301 1.00 0.00 C ATOM 0 H LEU A 23 3.702 -4.359 -6.021 1.00 0.00 H new ATOM 0 HA LEU A 23 2.998 -3.227 -3.564 1.00 0.00 H new ATOM 0 HB2 LEU A 23 3.556 -2.168 -6.334 1.00 0.00 H new ATOM 0 HB3 LEU A 23 3.061 -1.073 -5.059 1.00 0.00 H new ATOM 0 HG LEU A 23 5.495 -2.876 -4.941 1.00 0.00 H new ATOM 0 HD11 LEU A 23 6.785 -0.800 -5.248 1.00 0.00 H new ATOM 0 HD12 LEU A 23 5.743 -1.143 -6.650 1.00 0.00 H new ATOM 0 HD13 LEU A 23 5.268 0.104 -5.472 1.00 0.00 H new ATOM 0 HD21 LEU A 23 6.106 -1.507 -2.985 1.00 0.00 H new ATOM 0 HD22 LEU A 23 4.563 -0.631 -3.121 1.00 0.00 H new ATOM 0 HD23 LEU A 23 4.569 -2.368 -2.733 1.00 0.00 H new ATOM 333 N ARG A 24 0.740 -2.720 -5.938 1.00 0.00 N ATOM 334 CA ARG A 24 -0.666 -2.407 -6.165 1.00 0.00 C ATOM 335 C ARG A 24 -1.541 -3.006 -5.068 1.00 0.00 C ATOM 336 O ARG A 24 -2.390 -2.324 -4.494 1.00 0.00 O ATOM 337 CB ARG A 24 -1.113 -2.931 -7.531 1.00 0.00 C ATOM 338 CG ARG A 24 -2.596 -2.738 -7.802 1.00 0.00 C ATOM 339 CD ARG A 24 -2.927 -2.952 -9.271 1.00 0.00 C ATOM 340 NE ARG A 24 -4.366 -2.912 -9.519 1.00 0.00 N ATOM 341 CZ ARG A 24 -5.166 -3.962 -9.372 1.00 0.00 C ATOM 342 NH1 ARG A 24 -4.671 -5.127 -8.978 1.00 0.00 N ATOM 343 NH2 ARG A 24 -6.465 -3.847 -9.617 1.00 0.00 N ATOM 0 H ARG A 24 1.283 -2.863 -6.789 1.00 0.00 H new ATOM 0 HA ARG A 24 -0.778 -1.323 -6.144 1.00 0.00 H new ATOM 0 HB2 ARG A 24 -0.541 -2.426 -8.309 1.00 0.00 H new ATOM 0 HB3 ARG A 24 -0.875 -3.993 -7.599 1.00 0.00 H new ATOM 0 HG2 ARG A 24 -3.172 -3.435 -7.193 1.00 0.00 H new ATOM 0 HG3 ARG A 24 -2.894 -1.733 -7.504 1.00 0.00 H new ATOM 0 HD2 ARG A 24 -2.435 -2.185 -9.869 1.00 0.00 H new ATOM 0 HD3 ARG A 24 -2.530 -3.914 -9.596 1.00 0.00 H new ATOM 0 HE ARG A 24 -4.779 -2.030 -9.822 1.00 0.00 H new ATOM 0 HH11 ARG A 24 -3.673 -5.219 -8.787 1.00 0.00 H new ATOM 0 HH12 ARG A 24 -5.288 -5.932 -8.866 1.00 0.00 H new ATOM 0 HH21 ARG A 24 -6.850 -2.952 -9.918 1.00 0.00 H new ATOM 0 HH22 ARG A 24 -7.079 -4.654 -9.504 1.00 0.00 H new ATOM 357 N VAL A 25 -1.328 -4.287 -4.781 1.00 0.00 N ATOM 358 CA VAL A 25 -2.096 -4.978 -3.753 1.00 0.00 C ATOM 359 C VAL A 25 -1.776 -4.430 -2.367 1.00 0.00 C ATOM 360 O VAL A 25 -2.645 -3.881 -1.689 1.00 0.00 O ATOM 361 CB VAL A 25 -1.820 -6.493 -3.770 1.00 0.00 C ATOM 362 CG1 VAL A 25 -2.625 -7.195 -2.687 1.00 0.00 C ATOM 363 CG2 VAL A 25 -2.131 -7.076 -5.140 1.00 0.00 C ATOM 0 H VAL A 25 -0.630 -4.867 -5.247 1.00 0.00 H new ATOM 0 HA VAL A 25 -3.149 -4.805 -3.975 1.00 0.00 H new ATOM 0 HB VAL A 25 -0.762 -6.654 -3.564 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -2.417 -8.265 -2.715 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -2.347 -6.796 -1.711 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -3.688 -7.028 -2.858 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -1.930 -8.147 -5.134 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -3.181 -6.905 -5.378 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -1.505 -6.594 -5.891 1.00 0.00 H new ATOM 373 N LEU A 26 -0.524 -4.582 -1.951 1.00 0.00 N ATOM 374 CA LEU A 26 -0.088 -4.101 -0.644 1.00 0.00 C ATOM 375 C LEU A 26 -0.584 -2.681 -0.393 1.00 0.00 C ATOM 376 O LEU A 26 -1.305 -2.428 0.572 1.00 0.00 O ATOM 377 CB LEU A 26 1.438 -4.145 -0.546 1.00 0.00 C ATOM 378 CG LEU A 26 2.082 -5.524 -0.699 1.00 0.00 C ATOM 379 CD1 LEU A 26 3.470 -5.401 -1.307 1.00 0.00 C ATOM 380 CD2 LEU A 26 2.148 -6.233 0.646 1.00 0.00 C ATOM 0 H LEU A 26 0.208 -5.034 -2.499 1.00 0.00 H new ATOM 0 HA LEU A 26 -0.514 -4.755 0.117 1.00 0.00 H new ATOM 0 HB2 LEU A 26 1.850 -3.487 -1.311 1.00 0.00 H new ATOM 0 HB3 LEU A 26 1.732 -3.734 0.420 1.00 0.00 H new ATOM 0 HG LEU A 26 1.465 -6.119 -1.372 1.00 0.00 H new ATOM 0 HD11 LEU A 26 3.912 -6.392 -1.408 1.00 0.00 H new ATOM 0 HD12 LEU A 26 3.397 -4.934 -2.289 1.00 0.00 H new ATOM 0 HD13 LEU A 26 4.098 -4.788 -0.660 1.00 0.00 H new ATOM 0 HD21 LEU A 26 2.609 -7.213 0.519 1.00 0.00 H new ATOM 0 HD22 LEU A 26 2.742 -5.640 1.341 1.00 0.00 H new ATOM 0 HD23 LEU A 26 1.140 -6.355 1.043 1.00 0.00 H new ATOM 392 N GLN A 27 -0.195 -1.760 -1.268 1.00 0.00 N ATOM 393 CA GLN A 27 -0.603 -0.366 -1.141 1.00 0.00 C ATOM 394 C GLN A 27 -2.111 -0.256 -0.940 1.00 0.00 C ATOM 395 O GLN A 27 -2.580 0.511 -0.100 1.00 0.00 O ATOM 396 CB GLN A 27 -0.183 0.425 -2.381 1.00 0.00 C ATOM 397 CG GLN A 27 0.118 1.888 -2.097 1.00 0.00 C ATOM 398 CD GLN A 27 -0.179 2.786 -3.282 1.00 0.00 C ATOM 399 OE1 GLN A 27 -0.896 2.399 -4.205 1.00 0.00 O ATOM 400 NE2 GLN A 27 0.372 3.994 -3.262 1.00 0.00 N ATOM 0 H GLN A 27 0.402 -1.954 -2.072 1.00 0.00 H new ATOM 0 HA GLN A 27 -0.107 0.053 -0.266 1.00 0.00 H new ATOM 0 HB2 GLN A 27 0.701 -0.041 -2.817 1.00 0.00 H new ATOM 0 HB3 GLN A 27 -0.976 0.364 -3.126 1.00 0.00 H new ATOM 0 HG2 GLN A 27 -0.471 2.216 -1.241 1.00 0.00 H new ATOM 0 HG3 GLN A 27 1.167 1.992 -1.821 1.00 0.00 H new ATOM 0 HE21 GLN A 27 0.960 4.273 -2.477 1.00 0.00 H new ATOM 0 HE22 GLN A 27 0.207 4.642 -4.032 1.00 0.00 H new ATOM 409 N ALA A 28 -2.864 -1.027 -1.717 1.00 0.00 N ATOM 410 CA ALA A 28 -4.319 -1.017 -1.623 1.00 0.00 C ATOM 411 C ALA A 28 -4.783 -1.484 -0.248 1.00 0.00 C ATOM 412 O ALA A 28 -5.788 -1.003 0.276 1.00 0.00 O ATOM 413 CB ALA A 28 -4.924 -1.891 -2.711 1.00 0.00 C ATOM 0 H ALA A 28 -2.491 -1.666 -2.419 1.00 0.00 H new ATOM 0 HA ALA A 28 -4.661 0.008 -1.764 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -6.011 -1.874 -2.629 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -4.628 -1.512 -3.689 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -4.567 -2.914 -2.596 1.00 0.00 H new ATOM 419 N SER A 29 -4.045 -2.426 0.333 1.00 0.00 N ATOM 420 CA SER A 29 -4.385 -2.961 1.646 1.00 0.00 C ATOM 421 C SER A 29 -3.927 -2.016 2.753 1.00 0.00 C ATOM 422 O SER A 29 -4.744 -1.462 3.488 1.00 0.00 O ATOM 423 CB SER A 29 -3.746 -4.338 1.839 1.00 0.00 C ATOM 424 OG SER A 29 -3.912 -4.795 3.170 1.00 0.00 O ATOM 0 H SER A 29 -3.209 -2.834 -0.085 1.00 0.00 H new ATOM 0 HA SER A 29 -5.469 -3.060 1.702 1.00 0.00 H new ATOM 0 HB2 SER A 29 -4.195 -5.051 1.148 1.00 0.00 H new ATOM 0 HB3 SER A 29 -2.684 -4.287 1.599 1.00 0.00 H new ATOM 0 HG SER A 29 -3.242 -4.372 3.747 1.00 0.00 H new ATOM 430 N PHE A 30 -2.615 -1.838 2.865 1.00 0.00 N ATOM 431 CA PHE A 30 -2.047 -0.961 3.882 1.00 0.00 C ATOM 432 C PHE A 30 -2.866 0.320 4.015 1.00 0.00 C ATOM 433 O PHE A 30 -3.286 0.692 5.111 1.00 0.00 O ATOM 434 CB PHE A 30 -0.596 -0.619 3.539 1.00 0.00 C ATOM 435 CG PHE A 30 -0.065 0.568 4.291 1.00 0.00 C ATOM 436 CD1 PHE A 30 0.438 0.422 5.574 1.00 0.00 C ATOM 437 CD2 PHE A 30 -0.069 1.828 3.716 1.00 0.00 C ATOM 438 CE1 PHE A 30 0.926 1.513 6.269 1.00 0.00 C ATOM 439 CE2 PHE A 30 0.418 2.922 4.406 1.00 0.00 C ATOM 440 CZ PHE A 30 0.917 2.764 5.684 1.00 0.00 C ATOM 0 H PHE A 30 -1.925 -2.289 2.264 1.00 0.00 H new ATOM 0 HA PHE A 30 -2.073 -1.488 4.836 1.00 0.00 H new ATOM 0 HB2 PHE A 30 0.032 -1.484 3.751 1.00 0.00 H new ATOM 0 HB3 PHE A 30 -0.520 -0.425 2.469 1.00 0.00 H new ATOM 0 HD1 PHE A 30 0.449 -0.554 6.036 1.00 0.00 H new ATOM 0 HD2 PHE A 30 -0.457 1.957 2.717 1.00 0.00 H new ATOM 0 HE1 PHE A 30 1.314 1.387 7.269 1.00 0.00 H new ATOM 0 HE2 PHE A 30 0.408 3.899 3.946 1.00 0.00 H new ATOM 0 HZ PHE A 30 1.299 3.617 6.225 1.00 0.00 H new ATOM 450 N LEU A 31 -3.088 0.992 2.890 1.00 0.00 N ATOM 451 CA LEU A 31 -3.856 2.232 2.879 1.00 0.00 C ATOM 452 C LEU A 31 -5.088 2.118 3.771 1.00 0.00 C ATOM 453 O LEU A 31 -5.249 2.879 4.724 1.00 0.00 O ATOM 454 CB LEU A 31 -4.277 2.582 1.450 1.00 0.00 C ATOM 455 CG LEU A 31 -3.212 3.254 0.582 1.00 0.00 C ATOM 456 CD1 LEU A 31 -3.546 3.093 -0.893 1.00 0.00 C ATOM 457 CD2 LEU A 31 -3.081 4.726 0.944 1.00 0.00 C ATOM 0 H LEU A 31 -2.747 0.699 1.974 1.00 0.00 H new ATOM 0 HA LEU A 31 -3.221 3.027 3.269 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -4.598 1.667 0.953 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -5.145 3.239 1.499 1.00 0.00 H new ATOM 0 HG LEU A 31 -2.255 2.767 0.772 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -2.777 3.577 -1.495 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -3.588 2.033 -1.143 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -4.512 3.553 -1.100 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -2.319 5.189 0.317 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -4.036 5.227 0.784 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -2.794 4.819 1.991 1.00 0.00 H new ATOM 469 N ASN A 32 -5.954 1.161 3.454 1.00 0.00 N ATOM 470 CA ASN A 32 -7.172 0.946 4.228 1.00 0.00 C ATOM 471 C ASN A 32 -6.861 0.867 5.720 1.00 0.00 C ATOM 472 O ASN A 32 -7.404 1.630 6.519 1.00 0.00 O ATOM 473 CB ASN A 32 -7.870 -0.337 3.773 1.00 0.00 C ATOM 474 CG ASN A 32 -9.352 -0.334 4.096 1.00 0.00 C ATOM 475 OD1 ASN A 32 -9.948 0.719 4.321 1.00 0.00 O ATOM 476 ND2 ASN A 32 -9.954 -1.518 4.123 1.00 0.00 N ATOM 0 H ASN A 32 -5.835 0.522 2.667 1.00 0.00 H new ATOM 0 HA ASN A 32 -7.836 1.793 4.057 1.00 0.00 H new ATOM 0 HB2 ASN A 32 -7.735 -0.459 2.698 1.00 0.00 H new ATOM 0 HB3 ASN A 32 -7.398 -1.194 4.253 1.00 0.00 H new ATOM 0 HD21 ASN A 32 -10.949 -1.579 4.337 1.00 0.00 H new ATOM 0 HD22 ASN A 32 -9.421 -2.366 3.930 1.00 0.00 H new ATOM 483 N SER A 33 -5.984 -0.062 6.088 1.00 0.00 N ATOM 484 CA SER A 33 -5.603 -0.243 7.484 1.00 0.00 C ATOM 485 C SER A 33 -4.085 -0.280 7.632 1.00 0.00 C ATOM 486 O SER A 33 -3.421 -1.178 7.113 1.00 0.00 O ATOM 487 CB SER A 33 -6.213 -1.532 8.037 1.00 0.00 C ATOM 488 OG SER A 33 -5.705 -2.669 7.360 1.00 0.00 O ATOM 0 H SER A 33 -5.524 -0.701 5.439 1.00 0.00 H new ATOM 0 HA SER A 33 -5.985 0.605 8.053 1.00 0.00 H new ATOM 0 HB2 SER A 33 -5.996 -1.612 9.102 1.00 0.00 H new ATOM 0 HB3 SER A 33 -7.298 -1.498 7.934 1.00 0.00 H new ATOM 0 HG SER A 33 -4.763 -2.521 7.133 1.00 0.00 H new ATOM 494 N SER A 34 -3.542 0.702 8.345 1.00 0.00 N ATOM 495 CA SER A 34 -2.102 0.784 8.559 1.00 0.00 C ATOM 496 C SER A 34 -1.598 -0.427 9.337 1.00 0.00 C ATOM 497 O SER A 34 -0.504 -0.931 9.084 1.00 0.00 O ATOM 498 CB SER A 34 -1.750 2.070 9.311 1.00 0.00 C ATOM 499 OG SER A 34 -2.434 2.139 10.550 1.00 0.00 O ATOM 0 H SER A 34 -4.077 1.451 8.784 1.00 0.00 H new ATOM 0 HA SER A 34 -1.615 0.796 7.584 1.00 0.00 H new ATOM 0 HB2 SER A 34 -0.674 2.112 9.483 1.00 0.00 H new ATOM 0 HB3 SER A 34 -2.009 2.935 8.700 1.00 0.00 H new ATOM 0 HG SER A 34 -2.191 2.968 11.012 1.00 0.00 H new ATOM 505 N VAL A 35 -2.405 -0.891 10.287 1.00 0.00 N ATOM 506 CA VAL A 35 -2.043 -2.044 11.102 1.00 0.00 C ATOM 507 C VAL A 35 -2.483 -3.345 10.440 1.00 0.00 C ATOM 508 O VAL A 35 -3.678 -3.597 10.276 1.00 0.00 O ATOM 509 CB VAL A 35 -2.670 -1.957 12.506 1.00 0.00 C ATOM 510 CG1 VAL A 35 -2.262 -3.157 13.348 1.00 0.00 C ATOM 511 CG2 VAL A 35 -2.272 -0.657 13.188 1.00 0.00 C ATOM 0 H VAL A 35 -3.314 -0.485 10.511 1.00 0.00 H new ATOM 0 HA VAL A 35 -0.957 -2.037 11.196 1.00 0.00 H new ATOM 0 HB VAL A 35 -3.755 -1.968 12.402 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -2.714 -3.078 14.337 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -2.602 -4.073 12.865 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -1.177 -3.180 13.446 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -2.724 -0.613 14.179 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -1.187 -0.613 13.282 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -2.619 0.187 12.593 1.00 0.00 H new ATOM 521 N LEU A 36 -1.512 -4.168 10.063 1.00 0.00 N ATOM 522 CA LEU A 36 -1.798 -5.445 9.419 1.00 0.00 C ATOM 523 C LEU A 36 -2.296 -6.468 10.435 1.00 0.00 C ATOM 524 O LEU A 36 -1.791 -6.543 11.556 1.00 0.00 O ATOM 525 CB LEU A 36 -0.548 -5.976 8.715 1.00 0.00 C ATOM 526 CG LEU A 36 -0.781 -7.050 7.652 1.00 0.00 C ATOM 527 CD1 LEU A 36 -1.259 -6.421 6.352 1.00 0.00 C ATOM 528 CD2 LEU A 36 0.489 -7.856 7.421 1.00 0.00 C ATOM 0 H LEU A 36 -0.519 -3.974 10.192 1.00 0.00 H new ATOM 0 HA LEU A 36 -2.582 -5.283 8.680 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -0.034 -5.136 8.247 1.00 0.00 H new ATOM 0 HB3 LEU A 36 0.125 -6.381 9.470 1.00 0.00 H new ATOM 0 HG LEU A 36 -1.557 -7.726 8.011 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -1.419 -7.201 5.608 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -2.194 -5.889 6.527 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -0.507 -5.721 5.988 1.00 0.00 H new ATOM 0 HD21 LEU A 36 0.305 -8.616 6.661 1.00 0.00 H new ATOM 0 HD22 LEU A 36 1.285 -7.192 7.084 1.00 0.00 H new ATOM 0 HD23 LEU A 36 0.788 -8.338 8.352 1.00 0.00 H new ATOM 540 N THR A 37 -3.288 -7.257 10.036 1.00 0.00 N ATOM 541 CA THR A 37 -3.854 -8.277 10.910 1.00 0.00 C ATOM 542 C THR A 37 -3.598 -9.676 10.362 1.00 0.00 C ATOM 543 O THR A 37 -3.384 -9.853 9.162 1.00 0.00 O ATOM 544 CB THR A 37 -5.370 -8.080 11.096 1.00 0.00 C ATOM 545 OG1 THR A 37 -6.068 -8.518 9.925 1.00 0.00 O ATOM 546 CG2 THR A 37 -5.697 -6.619 11.370 1.00 0.00 C ATOM 0 H THR A 37 -3.717 -7.209 9.112 1.00 0.00 H new ATOM 0 HA THR A 37 -3.361 -8.173 11.876 1.00 0.00 H new ATOM 0 HB THR A 37 -5.689 -8.674 11.953 1.00 0.00 H new ATOM 0 HG1 THR A 37 -7.031 -8.391 10.052 1.00 0.00 H new ATOM 0 HG21 THR A 37 -6.773 -6.505 11.498 1.00 0.00 H new ATOM 0 HG22 THR A 37 -5.188 -6.296 12.278 1.00 0.00 H new ATOM 0 HG23 THR A 37 -5.365 -6.008 10.531 1.00 0.00 H new ATOM 554 N ASP A 38 -3.622 -10.667 11.246 1.00 0.00 N ATOM 555 CA ASP A 38 -3.395 -12.051 10.849 1.00 0.00 C ATOM 556 C ASP A 38 -4.216 -12.404 9.613 1.00 0.00 C ATOM 557 O ASP A 38 -3.738 -13.101 8.718 1.00 0.00 O ATOM 558 CB ASP A 38 -3.747 -12.998 11.998 1.00 0.00 C ATOM 559 CG ASP A 38 -5.233 -13.287 12.074 1.00 0.00 C ATOM 560 OD1 ASP A 38 -6.022 -12.323 12.164 1.00 0.00 O ATOM 561 OD2 ASP A 38 -5.608 -14.478 12.044 1.00 0.00 O ATOM 0 H ASP A 38 -3.796 -10.537 12.243 1.00 0.00 H new ATOM 0 HA ASP A 38 -2.339 -12.164 10.606 1.00 0.00 H new ATOM 0 HB2 ASP A 38 -3.203 -13.934 11.873 1.00 0.00 H new ATOM 0 HB3 ASP A 38 -3.416 -12.561 12.940 1.00 0.00 H new ATOM 566 N GLU A 39 -5.452 -11.918 9.571 1.00 0.00 N ATOM 567 CA GLU A 39 -6.340 -12.185 8.445 1.00 0.00 C ATOM 568 C GLU A 39 -5.812 -11.532 7.170 1.00 0.00 C ATOM 569 O GLU A 39 -5.421 -12.217 6.226 1.00 0.00 O ATOM 570 CB GLU A 39 -7.750 -11.674 8.746 1.00 0.00 C ATOM 571 CG GLU A 39 -8.529 -11.269 7.506 1.00 0.00 C ATOM 572 CD GLU A 39 -10.026 -11.443 7.674 1.00 0.00 C ATOM 573 OE1 GLU A 39 -10.437 -12.356 8.420 1.00 0.00 O ATOM 574 OE2 GLU A 39 -10.785 -10.664 7.060 1.00 0.00 O ATOM 0 H GLU A 39 -5.862 -11.338 10.303 1.00 0.00 H new ATOM 0 HA GLU A 39 -6.377 -13.264 8.293 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -8.303 -12.450 9.275 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -7.681 -10.818 9.417 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -8.312 -10.227 7.270 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -8.191 -11.865 6.658 1.00 0.00 H new ATOM 581 N GLU A 40 -5.806 -10.203 7.152 1.00 0.00 N ATOM 582 CA GLU A 40 -5.328 -9.457 5.994 1.00 0.00 C ATOM 583 C GLU A 40 -3.984 -9.999 5.515 1.00 0.00 C ATOM 584 O GLU A 40 -3.810 -10.303 4.334 1.00 0.00 O ATOM 585 CB GLU A 40 -5.199 -7.971 6.333 1.00 0.00 C ATOM 586 CG GLU A 40 -4.957 -7.088 5.120 1.00 0.00 C ATOM 587 CD GLU A 40 -6.182 -6.966 4.235 1.00 0.00 C ATOM 588 OE1 GLU A 40 -7.169 -6.337 4.670 1.00 0.00 O ATOM 589 OE2 GLU A 40 -6.153 -7.499 3.106 1.00 0.00 O ATOM 0 H GLU A 40 -6.127 -9.621 7.926 1.00 0.00 H new ATOM 0 HA GLU A 40 -6.056 -9.577 5.192 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -6.108 -7.642 6.836 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -4.379 -7.838 7.038 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -4.653 -6.095 5.452 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -4.131 -7.496 4.537 1.00 0.00 H new ATOM 596 N LEU A 41 -3.037 -10.117 6.439 1.00 0.00 N ATOM 597 CA LEU A 41 -1.708 -10.621 6.112 1.00 0.00 C ATOM 598 C LEU A 41 -1.797 -11.838 5.197 1.00 0.00 C ATOM 599 O LEU A 41 -1.122 -11.906 4.170 1.00 0.00 O ATOM 600 CB LEU A 41 -0.950 -10.985 7.390 1.00 0.00 C ATOM 601 CG LEU A 41 0.558 -11.186 7.243 1.00 0.00 C ATOM 602 CD1 LEU A 41 1.224 -11.256 8.608 1.00 0.00 C ATOM 603 CD2 LEU A 41 0.852 -12.444 6.439 1.00 0.00 C ATOM 0 H LEU A 41 -3.165 -9.871 7.420 1.00 0.00 H new ATOM 0 HA LEU A 41 -1.167 -9.833 5.588 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -1.121 -10.200 8.126 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -1.380 -11.901 7.795 1.00 0.00 H new ATOM 0 HG LEU A 41 0.968 -10.331 6.706 1.00 0.00 H new ATOM 0 HD11 LEU A 41 2.297 -11.399 8.482 1.00 0.00 H new ATOM 0 HD12 LEU A 41 1.043 -10.327 9.149 1.00 0.00 H new ATOM 0 HD13 LEU A 41 0.810 -12.092 9.172 1.00 0.00 H new ATOM 0 HD21 LEU A 41 1.930 -12.571 6.344 1.00 0.00 H new ATOM 0 HD22 LEU A 41 0.428 -13.309 6.949 1.00 0.00 H new ATOM 0 HD23 LEU A 41 0.409 -12.354 5.447 1.00 0.00 H new ATOM 615 N ASN A 42 -2.636 -12.797 5.576 1.00 0.00 N ATOM 616 CA ASN A 42 -2.815 -14.011 4.788 1.00 0.00 C ATOM 617 C ASN A 42 -3.169 -13.674 3.343 1.00 0.00 C ATOM 618 O ASN A 42 -2.372 -13.895 2.430 1.00 0.00 O ATOM 619 CB ASN A 42 -3.909 -14.886 5.402 1.00 0.00 C ATOM 620 CG ASN A 42 -3.388 -15.758 6.529 1.00 0.00 C ATOM 621 OD1 ASN A 42 -2.390 -16.460 6.373 1.00 0.00 O ATOM 622 ND2 ASN A 42 -4.065 -15.716 7.670 1.00 0.00 N ATOM 0 H ASN A 42 -3.202 -12.757 6.423 1.00 0.00 H new ATOM 0 HA ASN A 42 -1.874 -14.560 4.794 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -4.710 -14.250 5.779 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -4.342 -15.519 4.627 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -3.763 -16.281 8.463 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -4.887 -15.118 7.753 1.00 0.00 H new ATOM 629 N ARG A 43 -4.368 -13.138 3.142 1.00 0.00 N ATOM 630 CA ARG A 43 -4.828 -12.772 1.808 1.00 0.00 C ATOM 631 C ARG A 43 -3.681 -12.210 0.973 1.00 0.00 C ATOM 632 O ARG A 43 -3.511 -12.574 -0.191 1.00 0.00 O ATOM 633 CB ARG A 43 -5.958 -11.744 1.900 1.00 0.00 C ATOM 634 CG ARG A 43 -7.322 -12.360 2.164 1.00 0.00 C ATOM 635 CD ARG A 43 -8.427 -11.318 2.088 1.00 0.00 C ATOM 636 NE ARG A 43 -8.611 -10.622 3.359 1.00 0.00 N ATOM 637 CZ ARG A 43 -9.170 -9.421 3.465 1.00 0.00 C ATOM 638 NH1 ARG A 43 -9.597 -8.787 2.381 1.00 0.00 N ATOM 639 NH2 ARG A 43 -9.302 -8.852 4.656 1.00 0.00 N ATOM 0 H ARG A 43 -5.039 -12.947 3.886 1.00 0.00 H new ATOM 0 HA ARG A 43 -5.203 -13.672 1.320 1.00 0.00 H new ATOM 0 HB2 ARG A 43 -5.729 -11.035 2.696 1.00 0.00 H new ATOM 0 HB3 ARG A 43 -5.999 -11.177 0.970 1.00 0.00 H new ATOM 0 HG2 ARG A 43 -7.513 -13.149 1.436 1.00 0.00 H new ATOM 0 HG3 ARG A 43 -7.327 -12.827 3.149 1.00 0.00 H new ATOM 0 HD2 ARG A 43 -8.189 -10.594 1.309 1.00 0.00 H new ATOM 0 HD3 ARG A 43 -9.361 -11.800 1.800 1.00 0.00 H new ATOM 0 HE ARG A 43 -8.293 -11.083 4.212 1.00 0.00 H new ATOM 0 HH11 ARG A 43 -9.497 -9.221 1.463 1.00 0.00 H new ATOM 0 HH12 ARG A 43 -10.026 -7.865 2.465 1.00 0.00 H new ATOM 0 HH21 ARG A 43 -8.974 -9.336 5.492 1.00 0.00 H new ATOM 0 HH22 ARG A 43 -9.731 -7.930 4.736 1.00 0.00 H new ATOM 653 N LEU A 44 -2.898 -11.322 1.575 1.00 0.00 N ATOM 654 CA LEU A 44 -1.767 -10.710 0.887 1.00 0.00 C ATOM 655 C LEU A 44 -0.683 -11.742 0.595 1.00 0.00 C ATOM 656 O LEU A 44 -0.119 -11.773 -0.499 1.00 0.00 O ATOM 657 CB LEU A 44 -1.189 -9.570 1.728 1.00 0.00 C ATOM 658 CG LEU A 44 -2.140 -8.411 2.031 1.00 0.00 C ATOM 659 CD1 LEU A 44 -1.644 -7.614 3.228 1.00 0.00 C ATOM 660 CD2 LEU A 44 -2.290 -7.511 0.814 1.00 0.00 C ATOM 0 H LEU A 44 -3.025 -11.010 2.538 1.00 0.00 H new ATOM 0 HA LEU A 44 -2.125 -10.309 -0.061 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -0.840 -9.984 2.674 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -0.315 -9.172 1.212 1.00 0.00 H new ATOM 0 HG LEU A 44 -3.119 -8.824 2.275 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -2.333 -6.793 3.429 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -1.590 -8.264 4.101 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -0.654 -7.212 3.013 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -2.970 -6.692 1.049 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -1.316 -7.106 0.539 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -2.691 -8.089 -0.019 1.00 0.00 H new ATOM 672 N ARG A 45 -0.397 -12.587 1.581 1.00 0.00 N ATOM 673 CA ARG A 45 0.619 -13.621 1.430 1.00 0.00 C ATOM 674 C ARG A 45 0.383 -14.434 0.160 1.00 0.00 C ATOM 675 O ARG A 45 1.311 -15.024 -0.393 1.00 0.00 O ATOM 676 CB ARG A 45 0.619 -14.547 2.647 1.00 0.00 C ATOM 677 CG ARG A 45 1.978 -15.161 2.946 1.00 0.00 C ATOM 678 CD ARG A 45 1.975 -15.900 4.275 1.00 0.00 C ATOM 679 NE ARG A 45 1.402 -17.238 4.155 1.00 0.00 N ATOM 680 CZ ARG A 45 1.501 -18.167 5.100 1.00 0.00 C ATOM 681 NH1 ARG A 45 2.148 -17.905 6.227 1.00 0.00 N ATOM 682 NH2 ARG A 45 0.953 -19.361 4.917 1.00 0.00 N ATOM 0 H ARG A 45 -0.855 -12.575 2.492 1.00 0.00 H new ATOM 0 HA ARG A 45 1.590 -13.132 1.353 1.00 0.00 H new ATOM 0 HB2 ARG A 45 0.283 -13.986 3.519 1.00 0.00 H new ATOM 0 HB3 ARG A 45 -0.104 -15.347 2.484 1.00 0.00 H new ATOM 0 HG2 ARG A 45 2.251 -15.849 2.146 1.00 0.00 H new ATOM 0 HG3 ARG A 45 2.736 -14.378 2.966 1.00 0.00 H new ATOM 0 HD2 ARG A 45 2.995 -15.975 4.651 1.00 0.00 H new ATOM 0 HD3 ARG A 45 1.407 -15.327 5.008 1.00 0.00 H new ATOM 0 HE ARG A 45 0.898 -17.472 3.299 1.00 0.00 H new ATOM 0 HH11 ARG A 45 2.572 -16.988 6.371 1.00 0.00 H new ATOM 0 HH12 ARG A 45 2.222 -18.620 6.951 1.00 0.00 H new ATOM 0 HH21 ARG A 45 0.455 -19.566 4.051 1.00 0.00 H new ATOM 0 HH22 ARG A 45 1.029 -20.074 5.643 1.00 0.00 H new ATOM 696 N ALA A 46 -0.865 -14.459 -0.297 1.00 0.00 N ATOM 697 CA ALA A 46 -1.222 -15.197 -1.502 1.00 0.00 C ATOM 698 C ALA A 46 -1.282 -14.274 -2.714 1.00 0.00 C ATOM 699 O ALA A 46 -0.951 -14.677 -3.829 1.00 0.00 O ATOM 700 CB ALA A 46 -2.555 -15.907 -1.310 1.00 0.00 C ATOM 0 H ALA A 46 -1.645 -13.977 0.149 1.00 0.00 H new ATOM 0 HA ALA A 46 -0.448 -15.943 -1.684 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -2.810 -16.454 -2.218 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -2.479 -16.604 -0.475 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -3.332 -15.172 -1.100 1.00 0.00 H new ATOM 706 N GLN A 47 -1.707 -13.035 -2.488 1.00 0.00 N ATOM 707 CA GLN A 47 -1.811 -12.056 -3.563 1.00 0.00 C ATOM 708 C GLN A 47 -0.429 -11.637 -4.054 1.00 0.00 C ATOM 709 O GLN A 47 -0.113 -11.764 -5.238 1.00 0.00 O ATOM 710 CB GLN A 47 -2.590 -10.827 -3.089 1.00 0.00 C ATOM 711 CG GLN A 47 -4.083 -11.073 -2.943 1.00 0.00 C ATOM 712 CD GLN A 47 -4.716 -11.596 -4.217 1.00 0.00 C ATOM 713 OE1 GLN A 47 -5.060 -12.774 -4.315 1.00 0.00 O ATOM 714 NE2 GLN A 47 -4.873 -10.720 -5.203 1.00 0.00 N ATOM 0 H GLN A 47 -1.985 -12.686 -1.571 1.00 0.00 H new ATOM 0 HA GLN A 47 -2.346 -12.520 -4.392 1.00 0.00 H new ATOM 0 HB2 GLN A 47 -2.188 -10.500 -2.130 1.00 0.00 H new ATOM 0 HB3 GLN A 47 -2.432 -10.012 -3.795 1.00 0.00 H new ATOM 0 HG2 GLN A 47 -4.252 -11.788 -2.138 1.00 0.00 H new ATOM 0 HG3 GLN A 47 -4.574 -10.144 -2.653 1.00 0.00 H new ATOM 0 HE21 GLN A 47 -4.573 -9.753 -5.079 1.00 0.00 H new ATOM 0 HE22 GLN A 47 -5.293 -11.014 -6.085 1.00 0.00 H new ATOM 723 N THR A 48 0.394 -11.137 -3.137 1.00 0.00 N ATOM 724 CA THR A 48 1.741 -10.699 -3.477 1.00 0.00 C ATOM 725 C THR A 48 2.683 -11.887 -3.632 1.00 0.00 C ATOM 726 O THR A 48 3.809 -11.742 -4.110 1.00 0.00 O ATOM 727 CB THR A 48 2.308 -9.745 -2.408 1.00 0.00 C ATOM 728 OG1 THR A 48 2.440 -10.433 -1.158 1.00 0.00 O ATOM 729 CG2 THR A 48 1.407 -8.532 -2.232 1.00 0.00 C ATOM 0 H THR A 48 0.150 -11.026 -2.153 1.00 0.00 H new ATOM 0 HA THR A 48 1.670 -10.169 -4.427 1.00 0.00 H new ATOM 0 HB THR A 48 3.288 -9.404 -2.740 1.00 0.00 H new ATOM 0 HG1 THR A 48 1.577 -10.822 -0.906 1.00 0.00 H new ATOM 0 HG21 THR A 48 1.828 -7.873 -1.472 1.00 0.00 H new ATOM 0 HG22 THR A 48 1.332 -7.994 -3.177 1.00 0.00 H new ATOM 0 HG23 THR A 48 0.415 -8.858 -1.920 1.00 0.00 H new ATOM 737 N LYS A 49 2.216 -13.063 -3.227 1.00 0.00 N ATOM 738 CA LYS A 49 3.016 -14.279 -3.323 1.00 0.00 C ATOM 739 C LYS A 49 4.308 -14.145 -2.523 1.00 0.00 C ATOM 740 O LYS A 49 5.319 -14.768 -2.849 1.00 0.00 O ATOM 741 CB LYS A 49 3.340 -14.586 -4.787 1.00 0.00 C ATOM 742 CG LYS A 49 2.111 -14.674 -5.676 1.00 0.00 C ATOM 743 CD LYS A 49 1.467 -16.048 -5.603 1.00 0.00 C ATOM 744 CE LYS A 49 0.339 -16.189 -6.613 1.00 0.00 C ATOM 745 NZ LYS A 49 0.846 -16.556 -7.964 1.00 0.00 N ATOM 0 H LYS A 49 1.287 -13.200 -2.829 1.00 0.00 H new ATOM 0 HA LYS A 49 2.434 -15.101 -2.905 1.00 0.00 H new ATOM 0 HB2 LYS A 49 4.003 -13.812 -5.174 1.00 0.00 H new ATOM 0 HB3 LYS A 49 3.885 -15.529 -4.840 1.00 0.00 H new ATOM 0 HG2 LYS A 49 1.388 -13.916 -5.375 1.00 0.00 H new ATOM 0 HG3 LYS A 49 2.390 -14.456 -6.707 1.00 0.00 H new ATOM 0 HD2 LYS A 49 2.220 -16.814 -5.788 1.00 0.00 H new ATOM 0 HD3 LYS A 49 1.080 -16.217 -4.598 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -0.363 -16.949 -6.270 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -0.212 -15.251 -6.675 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 0.046 -16.642 -8.623 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 1.496 -15.818 -8.303 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 1.350 -17.464 -7.911 1.00 0.00 H new ATOM 759 N LEU A 50 4.267 -13.329 -1.475 1.00 0.00 N ATOM 760 CA LEU A 50 5.435 -13.115 -0.627 1.00 0.00 C ATOM 761 C LEU A 50 5.222 -13.722 0.756 1.00 0.00 C ATOM 762 O LEU A 50 4.119 -14.152 1.095 1.00 0.00 O ATOM 763 CB LEU A 50 5.730 -11.619 -0.501 1.00 0.00 C ATOM 764 CG LEU A 50 6.506 -10.988 -1.657 1.00 0.00 C ATOM 765 CD1 LEU A 50 6.493 -9.471 -1.544 1.00 0.00 C ATOM 766 CD2 LEU A 50 7.935 -11.510 -1.688 1.00 0.00 C ATOM 0 H LEU A 50 3.439 -12.805 -1.192 1.00 0.00 H new ATOM 0 HA LEU A 50 6.288 -13.609 -1.092 1.00 0.00 H new ATOM 0 HB2 LEU A 50 4.783 -11.090 -0.394 1.00 0.00 H new ATOM 0 HB3 LEU A 50 6.292 -11.456 0.419 1.00 0.00 H new ATOM 0 HG LEU A 50 6.018 -11.266 -2.591 1.00 0.00 H new ATOM 0 HD11 LEU A 50 7.050 -9.039 -2.375 1.00 0.00 H new ATOM 0 HD12 LEU A 50 5.464 -9.113 -1.572 1.00 0.00 H new ATOM 0 HD13 LEU A 50 6.956 -9.172 -0.603 1.00 0.00 H new ATOM 0 HD21 LEU A 50 8.472 -11.050 -2.517 1.00 0.00 H new ATOM 0 HD22 LEU A 50 8.433 -11.262 -0.751 1.00 0.00 H new ATOM 0 HD23 LEU A 50 7.924 -12.592 -1.818 1.00 0.00 H new ATOM 778 N THR A 51 6.285 -13.752 1.553 1.00 0.00 N ATOM 779 CA THR A 51 6.215 -14.304 2.900 1.00 0.00 C ATOM 780 C THR A 51 5.630 -13.293 3.880 1.00 0.00 C ATOM 781 O THR A 51 5.658 -12.088 3.632 1.00 0.00 O ATOM 782 CB THR A 51 7.605 -14.743 3.400 1.00 0.00 C ATOM 783 OG1 THR A 51 7.472 -15.524 4.593 1.00 0.00 O ATOM 784 CG2 THR A 51 8.486 -13.534 3.676 1.00 0.00 C ATOM 0 H THR A 51 7.205 -13.400 1.289 1.00 0.00 H new ATOM 0 HA THR A 51 5.563 -15.176 2.851 1.00 0.00 H new ATOM 0 HB THR A 51 8.074 -15.345 2.622 1.00 0.00 H new ATOM 0 HG1 THR A 51 8.359 -15.801 4.904 1.00 0.00 H new ATOM 0 HG21 THR A 51 9.462 -13.868 4.028 1.00 0.00 H new ATOM 0 HG22 THR A 51 8.609 -12.956 2.760 1.00 0.00 H new ATOM 0 HG23 THR A 51 8.019 -12.910 4.438 1.00 0.00 H new ATOM 792 N ARG A 52 5.102 -13.792 4.992 1.00 0.00 N ATOM 793 CA ARG A 52 4.510 -12.931 6.009 1.00 0.00 C ATOM 794 C ARG A 52 5.536 -11.937 6.545 1.00 0.00 C ATOM 795 O ARG A 52 5.189 -10.822 6.936 1.00 0.00 O ATOM 796 CB ARG A 52 3.952 -13.773 7.158 1.00 0.00 C ATOM 797 CG ARG A 52 4.962 -14.743 7.749 1.00 0.00 C ATOM 798 CD ARG A 52 4.691 -15.000 9.223 1.00 0.00 C ATOM 799 NE ARG A 52 3.672 -16.027 9.421 1.00 0.00 N ATOM 800 CZ ARG A 52 3.912 -17.330 9.324 1.00 0.00 C ATOM 801 NH1 ARG A 52 5.132 -17.762 9.034 1.00 0.00 N ATOM 802 NH2 ARG A 52 2.932 -18.203 9.518 1.00 0.00 N ATOM 0 H ARG A 52 5.072 -14.788 5.212 1.00 0.00 H new ATOM 0 HA ARG A 52 3.696 -12.373 5.547 1.00 0.00 H new ATOM 0 HB2 ARG A 52 3.596 -13.108 7.945 1.00 0.00 H new ATOM 0 HB3 ARG A 52 3.089 -14.334 6.800 1.00 0.00 H new ATOM 0 HG2 ARG A 52 4.927 -15.685 7.202 1.00 0.00 H new ATOM 0 HG3 ARG A 52 5.968 -14.341 7.628 1.00 0.00 H new ATOM 0 HD2 ARG A 52 5.615 -15.307 9.713 1.00 0.00 H new ATOM 0 HD3 ARG A 52 4.370 -14.074 9.699 1.00 0.00 H new ATOM 0 HE ARG A 52 2.723 -15.727 9.646 1.00 0.00 H new ATOM 0 HH11 ARG A 52 5.888 -17.093 8.885 1.00 0.00 H new ATOM 0 HH12 ARG A 52 5.314 -18.763 8.960 1.00 0.00 H new ATOM 0 HH21 ARG A 52 1.993 -17.874 9.742 1.00 0.00 H new ATOM 0 HH22 ARG A 52 3.118 -19.203 9.443 1.00 0.00 H new ATOM 816 N ARG A 53 6.800 -12.348 6.558 1.00 0.00 N ATOM 817 CA ARG A 53 7.876 -11.495 7.047 1.00 0.00 C ATOM 818 C ARG A 53 8.033 -10.260 6.165 1.00 0.00 C ATOM 819 O ARG A 53 8.157 -9.141 6.663 1.00 0.00 O ATOM 820 CB ARG A 53 9.192 -12.273 7.093 1.00 0.00 C ATOM 821 CG ARG A 53 10.150 -11.785 8.167 1.00 0.00 C ATOM 822 CD ARG A 53 9.756 -12.302 9.542 1.00 0.00 C ATOM 823 NE ARG A 53 8.802 -11.418 10.206 1.00 0.00 N ATOM 824 CZ ARG A 53 8.062 -11.784 11.247 1.00 0.00 C ATOM 825 NH1 ARG A 53 8.166 -13.010 11.740 1.00 0.00 N ATOM 826 NH2 ARG A 53 7.216 -10.922 11.797 1.00 0.00 N ATOM 0 H ARG A 53 7.104 -13.267 6.235 1.00 0.00 H new ATOM 0 HA ARG A 53 7.619 -11.170 8.055 1.00 0.00 H new ATOM 0 HB2 ARG A 53 8.975 -13.328 7.263 1.00 0.00 H new ATOM 0 HB3 ARG A 53 9.681 -12.201 6.122 1.00 0.00 H new ATOM 0 HG2 ARG A 53 11.162 -12.113 7.930 1.00 0.00 H new ATOM 0 HG3 ARG A 53 10.163 -10.695 8.177 1.00 0.00 H new ATOM 0 HD2 ARG A 53 9.321 -13.297 9.444 1.00 0.00 H new ATOM 0 HD3 ARG A 53 10.648 -12.403 10.161 1.00 0.00 H new ATOM 0 HE ARG A 53 8.698 -10.467 9.851 1.00 0.00 H new ATOM 0 HH11 ARG A 53 8.815 -13.675 11.320 1.00 0.00 H new ATOM 0 HH12 ARG A 53 7.597 -13.288 12.539 1.00 0.00 H new ATOM 0 HH21 ARG A 53 7.133 -9.978 11.421 1.00 0.00 H new ATOM 0 HH22 ARG A 53 6.648 -11.204 12.596 1.00 0.00 H new ATOM 840 N GLU A 54 8.029 -10.472 4.852 1.00 0.00 N ATOM 841 CA GLU A 54 8.173 -9.376 3.902 1.00 0.00 C ATOM 842 C GLU A 54 7.028 -8.377 4.045 1.00 0.00 C ATOM 843 O GLU A 54 7.245 -7.212 4.380 1.00 0.00 O ATOM 844 CB GLU A 54 8.217 -9.915 2.470 1.00 0.00 C ATOM 845 CG GLU A 54 9.569 -10.488 2.078 1.00 0.00 C ATOM 846 CD GLU A 54 10.709 -9.523 2.336 1.00 0.00 C ATOM 847 OE1 GLU A 54 11.269 -9.552 3.453 1.00 0.00 O ATOM 848 OE2 GLU A 54 11.042 -8.739 1.424 1.00 0.00 O ATOM 0 H GLU A 54 7.928 -11.392 4.423 1.00 0.00 H new ATOM 0 HA GLU A 54 9.110 -8.863 4.119 1.00 0.00 H new ATOM 0 HB2 GLU A 54 7.457 -10.689 2.358 1.00 0.00 H new ATOM 0 HB3 GLU A 54 7.958 -9.112 1.780 1.00 0.00 H new ATOM 0 HG2 GLU A 54 9.744 -11.409 2.635 1.00 0.00 H new ATOM 0 HG3 GLU A 54 9.554 -10.753 1.021 1.00 0.00 H new ATOM 855 N ILE A 55 5.810 -8.842 3.789 1.00 0.00 N ATOM 856 CA ILE A 55 4.631 -7.991 3.889 1.00 0.00 C ATOM 857 C ILE A 55 4.612 -7.233 5.212 1.00 0.00 C ATOM 858 O ILE A 55 4.736 -6.008 5.240 1.00 0.00 O ATOM 859 CB ILE A 55 3.333 -8.809 3.761 1.00 0.00 C ATOM 860 CG1 ILE A 55 3.298 -9.543 2.419 1.00 0.00 C ATOM 861 CG2 ILE A 55 2.119 -7.903 3.907 1.00 0.00 C ATOM 862 CD1 ILE A 55 2.340 -10.713 2.395 1.00 0.00 C ATOM 0 H ILE A 55 5.614 -9.804 3.511 1.00 0.00 H new ATOM 0 HA ILE A 55 4.685 -7.280 3.065 1.00 0.00 H new ATOM 0 HB ILE A 55 3.307 -9.550 4.560 1.00 0.00 H new ATOM 0 HG12 ILE A 55 3.018 -8.838 1.636 1.00 0.00 H new ATOM 0 HG13 ILE A 55 4.301 -9.900 2.183 1.00 0.00 H new ATOM 0 HG21 ILE A 55 1.209 -8.496 3.814 1.00 0.00 H new ATOM 0 HG22 ILE A 55 2.140 -7.421 4.885 1.00 0.00 H new ATOM 0 HG23 ILE A 55 2.137 -7.142 3.127 1.00 0.00 H new ATOM 0 HD11 ILE A 55 2.368 -11.186 1.413 1.00 0.00 H new ATOM 0 HD12 ILE A 55 2.632 -11.438 3.155 1.00 0.00 H new ATOM 0 HD13 ILE A 55 1.329 -10.360 2.599 1.00 0.00 H new ATOM 874 N ASP A 56 4.457 -7.969 6.307 1.00 0.00 N ATOM 875 CA ASP A 56 4.425 -7.367 7.635 1.00 0.00 C ATOM 876 C ASP A 56 5.388 -6.187 7.721 1.00 0.00 C ATOM 877 O ASP A 56 4.999 -5.081 8.093 1.00 0.00 O ATOM 878 CB ASP A 56 4.778 -8.407 8.699 1.00 0.00 C ATOM 879 CG ASP A 56 5.311 -7.777 9.971 1.00 0.00 C ATOM 880 OD1 ASP A 56 4.495 -7.455 10.860 1.00 0.00 O ATOM 881 OD2 ASP A 56 6.543 -7.607 10.078 1.00 0.00 O ATOM 0 H ASP A 56 4.352 -8.984 6.301 1.00 0.00 H new ATOM 0 HA ASP A 56 3.414 -7.002 7.816 1.00 0.00 H new ATOM 0 HB2 ASP A 56 3.892 -8.998 8.933 1.00 0.00 H new ATOM 0 HB3 ASP A 56 5.523 -9.094 8.298 1.00 0.00 H new ATOM 886 N ALA A 57 6.648 -6.431 7.373 1.00 0.00 N ATOM 887 CA ALA A 57 7.666 -5.389 7.410 1.00 0.00 C ATOM 888 C ALA A 57 7.276 -4.209 6.526 1.00 0.00 C ATOM 889 O ALA A 57 7.320 -3.057 6.957 1.00 0.00 O ATOM 890 CB ALA A 57 9.013 -5.952 6.979 1.00 0.00 C ATOM 0 H ALA A 57 6.987 -7.341 7.062 1.00 0.00 H new ATOM 0 HA ALA A 57 7.746 -5.030 8.436 1.00 0.00 H new ATOM 0 HB1 ALA A 57 9.764 -5.163 7.011 1.00 0.00 H new ATOM 0 HB2 ALA A 57 9.303 -6.757 7.654 1.00 0.00 H new ATOM 0 HB3 ALA A 57 8.937 -6.339 5.963 1.00 0.00 H new ATOM 896 N TRP A 58 6.897 -4.504 5.288 1.00 0.00 N ATOM 897 CA TRP A 58 6.500 -3.467 4.343 1.00 0.00 C ATOM 898 C TRP A 58 5.509 -2.499 4.981 1.00 0.00 C ATOM 899 O TRP A 58 5.791 -1.309 5.120 1.00 0.00 O ATOM 900 CB TRP A 58 5.884 -4.096 3.092 1.00 0.00 C ATOM 901 CG TRP A 58 5.677 -3.117 1.976 1.00 0.00 C ATOM 902 CD1 TRP A 58 6.579 -2.772 1.010 1.00 0.00 C ATOM 903 CD2 TRP A 58 4.493 -2.357 1.711 1.00 0.00 C ATOM 904 NE1 TRP A 58 6.027 -1.843 0.161 1.00 0.00 N ATOM 905 CE2 TRP A 58 4.747 -1.573 0.569 1.00 0.00 C ATOM 906 CE3 TRP A 58 3.241 -2.264 2.326 1.00 0.00 C ATOM 907 CZ2 TRP A 58 3.797 -0.707 0.034 1.00 0.00 C ATOM 908 CZ3 TRP A 58 2.299 -1.405 1.794 1.00 0.00 C ATOM 909 CH2 TRP A 58 2.581 -0.636 0.656 1.00 0.00 C ATOM 0 H TRP A 58 6.856 -5.453 4.915 1.00 0.00 H new ATOM 0 HA TRP A 58 7.392 -2.909 4.059 1.00 0.00 H new ATOM 0 HB2 TRP A 58 6.530 -4.902 2.744 1.00 0.00 H new ATOM 0 HB3 TRP A 58 4.926 -4.545 3.354 1.00 0.00 H new ATOM 0 HD1 TRP A 58 7.579 -3.171 0.926 1.00 0.00 H new ATOM 0 HE1 TRP A 58 6.494 -1.423 -0.642 1.00 0.00 H new ATOM 0 HE3 TRP A 58 3.014 -2.854 3.202 1.00 0.00 H new ATOM 0 HZ2 TRP A 58 4.013 -0.112 -0.841 1.00 0.00 H new ATOM 0 HZ3 TRP A 58 1.329 -1.324 2.262 1.00 0.00 H new ATOM 0 HH2 TRP A 58 1.823 0.025 0.263 1.00 0.00 H new ATOM 920 N PHE A 59 4.348 -3.017 5.368 1.00 0.00 N ATOM 921 CA PHE A 59 3.315 -2.198 5.991 1.00 0.00 C ATOM 922 C PHE A 59 3.919 -1.259 7.030 1.00 0.00 C ATOM 923 O PHE A 59 3.593 -0.072 7.077 1.00 0.00 O ATOM 924 CB PHE A 59 2.255 -3.087 6.645 1.00 0.00 C ATOM 925 CG PHE A 59 1.173 -3.524 5.700 1.00 0.00 C ATOM 926 CD1 PHE A 59 1.485 -4.213 4.539 1.00 0.00 C ATOM 927 CD2 PHE A 59 -0.157 -3.245 5.972 1.00 0.00 C ATOM 928 CE1 PHE A 59 0.491 -4.615 3.667 1.00 0.00 C ATOM 929 CE2 PHE A 59 -1.156 -3.646 5.104 1.00 0.00 C ATOM 930 CZ PHE A 59 -0.831 -4.332 3.951 1.00 0.00 C ATOM 0 H PHE A 59 4.099 -4.000 5.261 1.00 0.00 H new ATOM 0 HA PHE A 59 2.845 -1.596 5.213 1.00 0.00 H new ATOM 0 HB2 PHE A 59 2.740 -3.969 7.063 1.00 0.00 H new ATOM 0 HB3 PHE A 59 1.803 -2.548 7.477 1.00 0.00 H new ATOM 0 HD1 PHE A 59 2.517 -4.438 4.313 1.00 0.00 H new ATOM 0 HD2 PHE A 59 -0.416 -2.708 6.872 1.00 0.00 H new ATOM 0 HE1 PHE A 59 0.747 -5.150 2.764 1.00 0.00 H new ATOM 0 HE2 PHE A 59 -2.189 -3.423 5.328 1.00 0.00 H new ATOM 0 HZ PHE A 59 -1.609 -4.647 3.272 1.00 0.00 H new ATOM 940 N THR A 60 4.803 -1.798 7.864 1.00 0.00 N ATOM 941 CA THR A 60 5.452 -1.010 8.904 1.00 0.00 C ATOM 942 C THR A 60 6.178 0.192 8.311 1.00 0.00 C ATOM 943 O THR A 60 5.748 1.332 8.480 1.00 0.00 O ATOM 944 CB THR A 60 6.457 -1.858 9.707 1.00 0.00 C ATOM 945 OG1 THR A 60 5.827 -3.058 10.170 1.00 0.00 O ATOM 946 CG2 THR A 60 7.002 -1.075 10.892 1.00 0.00 C ATOM 0 H THR A 60 5.086 -2.778 7.839 1.00 0.00 H new ATOM 0 HA THR A 60 4.665 -0.662 9.573 1.00 0.00 H new ATOM 0 HB THR A 60 7.287 -2.115 9.050 1.00 0.00 H new ATOM 0 HG1 THR A 60 5.751 -3.695 9.429 1.00 0.00 H new ATOM 0 HG21 THR A 60 7.709 -1.695 11.443 1.00 0.00 H new ATOM 0 HG22 THR A 60 7.508 -0.178 10.534 1.00 0.00 H new ATOM 0 HG23 THR A 60 6.180 -0.790 11.549 1.00 0.00 H new ATOM 954 N GLU A 61 7.280 -0.072 7.616 1.00 0.00 N ATOM 955 CA GLU A 61 8.065 0.990 6.999 1.00 0.00 C ATOM 956 C GLU A 61 7.157 2.047 6.377 1.00 0.00 C ATOM 957 O GLU A 61 7.337 3.245 6.596 1.00 0.00 O ATOM 958 CB GLU A 61 8.997 0.411 5.932 1.00 0.00 C ATOM 959 CG GLU A 61 8.427 0.476 4.525 1.00 0.00 C ATOM 960 CD GLU A 61 9.397 -0.037 3.478 1.00 0.00 C ATOM 961 OE1 GLU A 61 10.386 0.668 3.190 1.00 0.00 O ATOM 962 OE2 GLU A 61 9.166 -1.144 2.948 1.00 0.00 O ATOM 0 H GLU A 61 7.649 -1.011 7.466 1.00 0.00 H new ATOM 0 HA GLU A 61 8.664 1.463 7.777 1.00 0.00 H new ATOM 0 HB2 GLU A 61 9.943 0.951 5.957 1.00 0.00 H new ATOM 0 HB3 GLU A 61 9.216 -0.628 6.178 1.00 0.00 H new ATOM 0 HG2 GLU A 61 7.509 -0.109 4.482 1.00 0.00 H new ATOM 0 HG3 GLU A 61 8.159 1.507 4.293 1.00 0.00 H new ATOM 969 N LYS A 62 6.180 1.594 5.598 1.00 0.00 N ATOM 970 CA LYS A 62 5.242 2.498 4.944 1.00 0.00 C ATOM 971 C LYS A 62 4.780 3.591 5.903 1.00 0.00 C ATOM 972 O LYS A 62 4.737 4.768 5.545 1.00 0.00 O ATOM 973 CB LYS A 62 4.033 1.720 4.420 1.00 0.00 C ATOM 974 CG LYS A 62 3.404 2.334 3.181 1.00 0.00 C ATOM 975 CD LYS A 62 4.241 2.069 1.941 1.00 0.00 C ATOM 976 CE LYS A 62 3.518 2.507 0.676 1.00 0.00 C ATOM 977 NZ LYS A 62 4.449 2.632 -0.479 1.00 0.00 N ATOM 0 H LYS A 62 6.018 0.606 5.404 1.00 0.00 H new ATOM 0 HA LYS A 62 5.755 2.969 4.105 1.00 0.00 H new ATOM 0 HB2 LYS A 62 4.339 0.699 4.193 1.00 0.00 H new ATOM 0 HB3 LYS A 62 3.281 1.660 5.207 1.00 0.00 H new ATOM 0 HG2 LYS A 62 2.403 1.926 3.040 1.00 0.00 H new ATOM 0 HG3 LYS A 62 3.293 3.409 3.323 1.00 0.00 H new ATOM 0 HD2 LYS A 62 5.190 2.599 2.021 1.00 0.00 H new ATOM 0 HD3 LYS A 62 4.474 1.006 1.879 1.00 0.00 H new ATOM 0 HE2 LYS A 62 2.736 1.786 0.436 1.00 0.00 H new ATOM 0 HE3 LYS A 62 3.026 3.464 0.851 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 3.932 2.997 -1.304 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 5.219 3.288 -0.235 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 4.848 1.699 -0.706 1.00 0.00 H new ATOM 991 N LYS A 63 4.435 3.193 7.123 1.00 0.00 N ATOM 992 CA LYS A 63 3.979 4.138 8.135 1.00 0.00 C ATOM 993 C LYS A 63 4.905 5.348 8.207 1.00 0.00 C ATOM 994 O LYS A 63 4.455 6.476 8.411 1.00 0.00 O ATOM 995 CB LYS A 63 3.907 3.456 9.503 1.00 0.00 C ATOM 996 CG LYS A 63 2.872 2.347 9.576 1.00 0.00 C ATOM 997 CD LYS A 63 2.950 1.597 10.895 1.00 0.00 C ATOM 998 CE LYS A 63 1.899 0.500 10.976 1.00 0.00 C ATOM 999 NZ LYS A 63 2.305 -0.589 11.907 1.00 0.00 N ATOM 0 H LYS A 63 4.463 2.222 7.435 1.00 0.00 H new ATOM 0 HA LYS A 63 2.983 4.481 7.853 1.00 0.00 H new ATOM 0 HB2 LYS A 63 4.886 3.044 9.746 1.00 0.00 H new ATOM 0 HB3 LYS A 63 3.679 4.205 10.261 1.00 0.00 H new ATOM 0 HG2 LYS A 63 1.875 2.770 9.456 1.00 0.00 H new ATOM 0 HG3 LYS A 63 3.024 1.651 8.751 1.00 0.00 H new ATOM 0 HD2 LYS A 63 3.942 1.161 11.008 1.00 0.00 H new ATOM 0 HD3 LYS A 63 2.813 2.295 11.721 1.00 0.00 H new ATOM 0 HE2 LYS A 63 0.953 0.927 11.308 1.00 0.00 H new ATOM 0 HE3 LYS A 63 1.730 0.084 9.983 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 1.563 -1.317 11.934 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 3.195 -1.014 11.577 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 2.441 -0.197 12.861 1.00 0.00 H new ATOM 1013 N LYS A 64 6.200 5.107 8.036 1.00 0.00 N ATOM 1014 CA LYS A 64 7.190 6.177 8.079 1.00 0.00 C ATOM 1015 C LYS A 64 7.093 7.058 6.837 1.00 0.00 C ATOM 1016 O LYS A 64 7.296 8.270 6.907 1.00 0.00 O ATOM 1017 CB LYS A 64 8.600 5.591 8.193 1.00 0.00 C ATOM 1018 CG LYS A 64 8.925 5.053 9.575 1.00 0.00 C ATOM 1019 CD LYS A 64 8.307 3.683 9.800 1.00 0.00 C ATOM 1020 CE LYS A 64 8.468 3.229 11.242 1.00 0.00 C ATOM 1021 NZ LYS A 64 9.862 2.797 11.536 1.00 0.00 N ATOM 0 H LYS A 64 6.589 4.180 7.866 1.00 0.00 H new ATOM 0 HA LYS A 64 6.987 6.792 8.956 1.00 0.00 H new ATOM 0 HB2 LYS A 64 8.711 4.788 7.464 1.00 0.00 H new ATOM 0 HB3 LYS A 64 9.326 6.361 7.932 1.00 0.00 H new ATOM 0 HG2 LYS A 64 10.006 4.990 9.697 1.00 0.00 H new ATOM 0 HG3 LYS A 64 8.559 5.747 10.332 1.00 0.00 H new ATOM 0 HD2 LYS A 64 7.248 3.714 9.543 1.00 0.00 H new ATOM 0 HD3 LYS A 64 8.775 2.958 9.135 1.00 0.00 H new ATOM 0 HE2 LYS A 64 8.191 4.043 11.912 1.00 0.00 H new ATOM 0 HE3 LYS A 64 7.783 2.405 11.442 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 9.930 2.495 12.529 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 10.118 2.003 10.915 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 10.514 3.590 11.370 1.00 0.00 H new ATOM 1035 N SER A 65 6.780 6.440 5.702 1.00 0.00 N ATOM 1036 CA SER A 65 6.658 7.168 4.445 1.00 0.00 C ATOM 1037 C SER A 65 5.585 8.248 4.544 1.00 0.00 C ATOM 1038 O SER A 65 5.722 9.332 3.975 1.00 0.00 O ATOM 1039 CB SER A 65 6.325 6.205 3.304 1.00 0.00 C ATOM 1040 OG SER A 65 6.849 6.672 2.073 1.00 0.00 O ATOM 0 H SER A 65 6.607 5.438 5.628 1.00 0.00 H new ATOM 0 HA SER A 65 7.614 7.649 4.238 1.00 0.00 H new ATOM 0 HB2 SER A 65 6.733 5.219 3.526 1.00 0.00 H new ATOM 0 HB3 SER A 65 5.244 6.092 3.223 1.00 0.00 H new ATOM 0 HG SER A 65 6.624 6.038 1.360 1.00 0.00 H new ATOM 1046 N LYS A 66 4.515 7.945 5.271 1.00 0.00 N ATOM 1047 CA LYS A 66 3.417 8.888 5.448 1.00 0.00 C ATOM 1048 C LYS A 66 3.809 10.005 6.410 1.00 0.00 C ATOM 1049 O LYS A 66 3.031 10.926 6.656 1.00 0.00 O ATOM 1050 CB LYS A 66 2.174 8.163 5.970 1.00 0.00 C ATOM 1051 CG LYS A 66 1.321 7.552 4.873 1.00 0.00 C ATOM 1052 CD LYS A 66 -0.152 7.553 5.245 1.00 0.00 C ATOM 1053 CE LYS A 66 -0.846 8.820 4.771 1.00 0.00 C ATOM 1054 NZ LYS A 66 -1.107 8.794 3.305 1.00 0.00 N ATOM 0 H LYS A 66 4.385 7.053 5.748 1.00 0.00 H new ATOM 0 HA LYS A 66 3.191 9.331 4.478 1.00 0.00 H new ATOM 0 HB2 LYS A 66 2.484 7.376 6.658 1.00 0.00 H new ATOM 0 HB3 LYS A 66 1.567 8.865 6.542 1.00 0.00 H new ATOM 0 HG2 LYS A 66 1.464 8.109 3.947 1.00 0.00 H new ATOM 0 HG3 LYS A 66 1.648 6.530 4.683 1.00 0.00 H new ATOM 0 HD2 LYS A 66 -0.640 6.683 4.805 1.00 0.00 H new ATOM 0 HD3 LYS A 66 -0.255 7.463 6.326 1.00 0.00 H new ATOM 0 HE2 LYS A 66 -1.788 8.940 5.306 1.00 0.00 H new ATOM 0 HE3 LYS A 66 -0.229 9.685 5.015 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 -1.712 9.599 3.046 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 -0.205 8.859 2.791 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 -1.586 7.906 3.053 1.00 0.00 H new ATOM 1068 N ALA A 67 5.020 9.917 6.950 1.00 0.00 N ATOM 1069 CA ALA A 67 5.516 10.922 7.882 1.00 0.00 C ATOM 1070 C ALA A 67 6.603 11.778 7.240 1.00 0.00 C ATOM 1071 O ALA A 67 7.456 12.337 7.930 1.00 0.00 O ATOM 1072 CB ALA A 67 6.042 10.257 9.145 1.00 0.00 C ATOM 0 H ALA A 67 5.676 9.160 6.758 1.00 0.00 H new ATOM 0 HA ALA A 67 4.685 11.576 8.148 1.00 0.00 H new ATOM 0 HB1 ALA A 67 6.409 11.020 9.832 1.00 0.00 H new ATOM 0 HB2 ALA A 67 5.239 9.695 9.622 1.00 0.00 H new ATOM 0 HB3 ALA A 67 6.856 9.579 8.887 1.00 0.00 H new ATOM 1078 N LEU A 68 6.567 11.875 5.916 1.00 0.00 N ATOM 1079 CA LEU A 68 7.550 12.662 5.179 1.00 0.00 C ATOM 1080 C LEU A 68 6.983 14.027 4.803 1.00 0.00 C ATOM 1081 O LEU A 68 5.864 14.374 5.183 1.00 0.00 O ATOM 1082 CB LEU A 68 7.991 11.915 3.920 1.00 0.00 C ATOM 1083 CG LEU A 68 9.015 10.799 4.126 1.00 0.00 C ATOM 1084 CD1 LEU A 68 9.002 9.838 2.946 1.00 0.00 C ATOM 1085 CD2 LEU A 68 10.407 11.381 4.326 1.00 0.00 C ATOM 0 H LEU A 68 5.868 11.419 5.330 1.00 0.00 H new ATOM 0 HA LEU A 68 8.415 12.814 5.824 1.00 0.00 H new ATOM 0 HB2 LEU A 68 7.107 11.487 3.447 1.00 0.00 H new ATOM 0 HB3 LEU A 68 8.408 12.639 3.220 1.00 0.00 H new ATOM 0 HG LEU A 68 8.743 10.244 5.024 1.00 0.00 H new ATOM 0 HD11 LEU A 68 9.737 9.050 3.110 1.00 0.00 H new ATOM 0 HD12 LEU A 68 8.011 9.395 2.849 1.00 0.00 H new ATOM 0 HD13 LEU A 68 9.249 10.380 2.033 1.00 0.00 H new ATOM 0 HD21 LEU A 68 11.122 10.572 4.471 1.00 0.00 H new ATOM 0 HD22 LEU A 68 10.689 11.961 3.447 1.00 0.00 H new ATOM 0 HD23 LEU A 68 10.408 12.028 5.203 1.00 0.00 H new ATOM 1097 N LYS A 69 7.761 14.799 4.051 1.00 0.00 N ATOM 1098 CA LYS A 69 7.336 16.125 3.618 1.00 0.00 C ATOM 1099 C LYS A 69 5.839 16.148 3.326 1.00 0.00 C ATOM 1100 O LYS A 69 5.343 15.357 2.525 1.00 0.00 O ATOM 1101 CB LYS A 69 8.117 16.552 2.373 1.00 0.00 C ATOM 1102 CG LYS A 69 7.658 17.878 1.793 1.00 0.00 C ATOM 1103 CD LYS A 69 8.412 18.221 0.519 1.00 0.00 C ATOM 1104 CE LYS A 69 9.824 18.700 0.820 1.00 0.00 C ATOM 1105 NZ LYS A 69 10.767 17.563 1.007 1.00 0.00 N ATOM 0 H LYS A 69 8.690 14.529 3.729 1.00 0.00 H new ATOM 0 HA LYS A 69 7.541 16.827 4.426 1.00 0.00 H new ATOM 0 HB2 LYS A 69 9.175 16.622 2.624 1.00 0.00 H new ATOM 0 HB3 LYS A 69 8.021 15.779 1.611 1.00 0.00 H new ATOM 0 HG2 LYS A 69 6.589 17.834 1.584 1.00 0.00 H new ATOM 0 HG3 LYS A 69 7.806 18.669 2.529 1.00 0.00 H new ATOM 0 HD2 LYS A 69 8.454 17.345 -0.128 1.00 0.00 H new ATOM 0 HD3 LYS A 69 7.873 18.995 -0.027 1.00 0.00 H new ATOM 0 HE2 LYS A 69 10.175 19.332 0.004 1.00 0.00 H new ATOM 0 HE3 LYS A 69 9.815 19.316 1.719 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 11.021 17.485 2.012 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 10.313 16.681 0.695 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 11.626 17.728 0.445 1.00 0.00 H new ATOM 1119 N GLU A 70 5.127 17.061 3.979 1.00 0.00 N ATOM 1120 CA GLU A 70 3.687 17.186 3.787 1.00 0.00 C ATOM 1121 C GLU A 70 2.962 15.938 4.283 1.00 0.00 C ATOM 1122 O GLU A 70 2.105 15.390 3.590 1.00 0.00 O ATOM 1123 CB GLU A 70 3.366 17.423 2.310 1.00 0.00 C ATOM 1124 CG GLU A 70 1.964 17.958 2.071 1.00 0.00 C ATOM 1125 CD GLU A 70 1.777 18.495 0.665 1.00 0.00 C ATOM 1126 OE1 GLU A 70 2.369 19.547 0.347 1.00 0.00 O ATOM 1127 OE2 GLU A 70 1.037 17.862 -0.117 1.00 0.00 O ATOM 0 H GLU A 70 5.523 17.724 4.645 1.00 0.00 H new ATOM 0 HA GLU A 70 3.341 18.041 4.368 1.00 0.00 H new ATOM 0 HB2 GLU A 70 4.090 18.126 1.898 1.00 0.00 H new ATOM 0 HB3 GLU A 70 3.486 16.486 1.766 1.00 0.00 H new ATOM 0 HG2 GLU A 70 1.240 17.163 2.252 1.00 0.00 H new ATOM 0 HG3 GLU A 70 1.754 18.750 2.790 1.00 0.00 H new ATOM 1134 N GLU A 71 3.312 15.496 5.487 1.00 0.00 N ATOM 1135 CA GLU A 71 2.695 14.313 6.074 1.00 0.00 C ATOM 1136 C GLU A 71 1.205 14.538 6.315 1.00 0.00 C ATOM 1137 O GLU A 71 0.722 15.670 6.273 1.00 0.00 O ATOM 1138 CB GLU A 71 3.386 13.950 7.390 1.00 0.00 C ATOM 1139 CG GLU A 71 3.099 14.927 8.518 1.00 0.00 C ATOM 1140 CD GLU A 71 3.622 14.444 9.856 1.00 0.00 C ATOM 1141 OE1 GLU A 71 3.164 13.379 10.322 1.00 0.00 O ATOM 1142 OE2 GLU A 71 4.489 15.129 10.438 1.00 0.00 O ATOM 0 H GLU A 71 4.019 15.939 6.074 1.00 0.00 H new ATOM 0 HA GLU A 71 2.811 13.488 5.371 1.00 0.00 H new ATOM 0 HB2 GLU A 71 3.068 12.953 7.695 1.00 0.00 H new ATOM 0 HB3 GLU A 71 4.462 13.905 7.225 1.00 0.00 H new ATOM 0 HG2 GLU A 71 3.550 15.891 8.282 1.00 0.00 H new ATOM 0 HG3 GLU A 71 2.023 15.088 8.589 1.00 0.00 H new ATOM 1149 N LYS A 72 0.481 13.452 6.565 1.00 0.00 N ATOM 1150 CA LYS A 72 -0.953 13.529 6.813 1.00 0.00 C ATOM 1151 C LYS A 72 -1.294 14.749 7.663 1.00 0.00 C ATOM 1152 O LYS A 72 -0.848 14.867 8.803 1.00 0.00 O ATOM 1153 CB LYS A 72 -1.440 12.257 7.511 1.00 0.00 C ATOM 1154 CG LYS A 72 -0.723 11.968 8.819 1.00 0.00 C ATOM 1155 CD LYS A 72 -1.024 10.566 9.321 1.00 0.00 C ATOM 1156 CE LYS A 72 -0.657 10.410 10.789 1.00 0.00 C ATOM 1157 NZ LYS A 72 -0.487 8.980 11.169 1.00 0.00 N ATOM 0 H LYS A 72 0.865 12.508 6.601 1.00 0.00 H new ATOM 0 HA LYS A 72 -1.457 13.625 5.852 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -2.509 12.345 7.704 1.00 0.00 H new ATOM 0 HB3 LYS A 72 -1.307 11.410 6.838 1.00 0.00 H new ATOM 0 HG2 LYS A 72 0.352 12.082 8.679 1.00 0.00 H new ATOM 0 HG3 LYS A 72 -1.026 12.697 9.570 1.00 0.00 H new ATOM 0 HD2 LYS A 72 -2.083 10.349 9.184 1.00 0.00 H new ATOM 0 HD3 LYS A 72 -0.470 9.839 8.727 1.00 0.00 H new ATOM 0 HE2 LYS A 72 0.267 10.952 10.992 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -1.433 10.860 11.407 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 -0.237 8.916 12.177 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 -1.376 8.468 10.999 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 0.271 8.557 10.597 1.00 0.00 H new ATOM 1171 N MET A 73 -2.089 15.654 7.099 1.00 0.00 N ATOM 1172 CA MET A 73 -2.491 16.864 7.807 1.00 0.00 C ATOM 1173 C MET A 73 -3.817 16.654 8.532 1.00 0.00 C ATOM 1174 O MET A 73 -4.884 16.727 7.924 1.00 0.00 O ATOM 1175 CB MET A 73 -2.610 18.036 6.831 1.00 0.00 C ATOM 1176 CG MET A 73 -1.281 18.462 6.229 1.00 0.00 C ATOM 1177 SD MET A 73 -0.065 18.917 7.480 1.00 0.00 S ATOM 1178 CE MET A 73 -0.794 20.419 8.129 1.00 0.00 C ATOM 0 H MET A 73 -2.467 15.572 6.155 1.00 0.00 H new ATOM 0 HA MET A 73 -1.725 17.094 8.547 1.00 0.00 H new ATOM 0 HB2 MET A 73 -3.292 17.761 6.027 1.00 0.00 H new ATOM 0 HB3 MET A 73 -3.054 18.886 7.349 1.00 0.00 H new ATOM 0 HG2 MET A 73 -0.884 17.648 5.622 1.00 0.00 H new ATOM 0 HG3 MET A 73 -1.444 19.308 5.561 1.00 0.00 H new ATOM 0 HE1 MET A 73 -0.067 20.935 8.756 1.00 0.00 H new ATOM 0 HE2 MET A 73 -1.087 21.068 7.303 1.00 0.00 H new ATOM 0 HE3 MET A 73 -1.673 20.169 8.724 1.00 0.00 H new ATOM 1188 N GLU A 74 -3.740 16.393 9.833 1.00 0.00 N ATOM 1189 CA GLU A 74 -4.935 16.172 10.639 1.00 0.00 C ATOM 1190 C GLU A 74 -5.363 17.457 11.341 1.00 0.00 C ATOM 1191 O GLU A 74 -4.714 17.906 12.286 1.00 0.00 O ATOM 1192 CB GLU A 74 -4.684 15.072 11.673 1.00 0.00 C ATOM 1193 CG GLU A 74 -4.951 13.671 11.148 1.00 0.00 C ATOM 1194 CD GLU A 74 -5.371 12.709 12.242 1.00 0.00 C ATOM 1195 OE1 GLU A 74 -4.869 12.844 13.377 1.00 0.00 O ATOM 1196 OE2 GLU A 74 -6.204 11.821 11.962 1.00 0.00 O ATOM 0 H GLU A 74 -2.864 16.329 10.351 1.00 0.00 H new ATOM 0 HA GLU A 74 -5.738 15.858 9.973 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -3.650 15.133 12.012 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -5.316 15.252 12.543 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -5.731 13.714 10.388 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -4.052 13.292 10.661 1.00 0.00 H new ATOM 1203 N ILE A 75 -6.460 18.043 10.873 1.00 0.00 N ATOM 1204 CA ILE A 75 -6.975 19.276 11.456 1.00 0.00 C ATOM 1205 C ILE A 75 -6.726 19.318 12.960 1.00 0.00 C ATOM 1206 O ILE A 75 -7.346 18.578 13.723 1.00 0.00 O ATOM 1207 CB ILE A 75 -8.484 19.435 11.192 1.00 0.00 C ATOM 1208 CG1 ILE A 75 -8.794 19.195 9.713 1.00 0.00 C ATOM 1209 CG2 ILE A 75 -8.953 20.818 11.619 1.00 0.00 C ATOM 1210 CD1 ILE A 75 -9.110 17.752 9.388 1.00 0.00 C ATOM 0 H ILE A 75 -7.009 17.684 10.092 1.00 0.00 H new ATOM 0 HA ILE A 75 -6.442 20.098 10.979 1.00 0.00 H new ATOM 0 HB ILE A 75 -9.021 18.692 11.781 1.00 0.00 H new ATOM 0 HG12 ILE A 75 -9.640 19.818 9.422 1.00 0.00 H new ATOM 0 HG13 ILE A 75 -7.941 19.515 9.115 1.00 0.00 H new ATOM 0 HG21 ILE A 75 -10.021 20.915 11.426 1.00 0.00 H new ATOM 0 HG22 ILE A 75 -8.762 20.954 12.684 1.00 0.00 H new ATOM 0 HG23 ILE A 75 -8.412 21.576 11.053 1.00 0.00 H new ATOM 0 HD11 ILE A 75 -9.320 17.656 8.323 1.00 0.00 H new ATOM 0 HD12 ILE A 75 -8.257 17.125 9.648 1.00 0.00 H new ATOM 0 HD13 ILE A 75 -9.982 17.433 9.959 1.00 0.00 H new ATOM 1222 N ASP A 76 -5.817 20.192 13.379 1.00 0.00 N ATOM 1223 CA ASP A 76 -5.488 20.334 14.792 1.00 0.00 C ATOM 1224 C ASP A 76 -4.680 21.605 15.037 1.00 0.00 C ATOM 1225 O ASP A 76 -3.748 21.911 14.294 1.00 0.00 O ATOM 1226 CB ASP A 76 -4.703 19.115 15.280 1.00 0.00 C ATOM 1227 CG ASP A 76 -3.971 19.381 16.581 1.00 0.00 C ATOM 1228 OD1 ASP A 76 -4.640 19.705 17.584 1.00 0.00 O ATOM 1229 OD2 ASP A 76 -2.728 19.264 16.595 1.00 0.00 O ATOM 0 H ASP A 76 -5.295 20.812 12.760 1.00 0.00 H new ATOM 0 HA ASP A 76 -6.421 20.404 15.351 1.00 0.00 H new ATOM 0 HB2 ASP A 76 -5.386 18.277 15.416 1.00 0.00 H new ATOM 0 HB3 ASP A 76 -3.984 18.820 14.516 1.00 0.00 H new ATOM 1234 N GLU A 77 -5.047 22.341 16.081 1.00 0.00 N ATOM 1235 CA GLU A 77 -4.357 23.580 16.421 1.00 0.00 C ATOM 1236 C GLU A 77 -2.852 23.352 16.531 1.00 0.00 C ATOM 1237 O GLU A 77 -2.383 22.651 17.427 1.00 0.00 O ATOM 1238 CB GLU A 77 -4.895 24.145 17.738 1.00 0.00 C ATOM 1239 CG GLU A 77 -6.204 24.902 17.585 1.00 0.00 C ATOM 1240 CD GLU A 77 -6.808 25.298 18.918 1.00 0.00 C ATOM 1241 OE1 GLU A 77 -6.324 26.278 19.521 1.00 0.00 O ATOM 1242 OE2 GLU A 77 -7.765 24.627 19.358 1.00 0.00 O ATOM 0 H GLU A 77 -5.817 22.101 16.705 1.00 0.00 H new ATOM 0 HA GLU A 77 -4.541 24.299 15.623 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -5.039 23.326 18.443 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -4.148 24.811 18.170 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -6.034 25.797 16.987 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -6.915 24.284 17.037 1.00 0.00 H new ATOM 1249 N SER A 78 -2.101 23.950 15.612 1.00 0.00 N ATOM 1250 CA SER A 78 -0.649 23.810 15.602 1.00 0.00 C ATOM 1251 C SER A 78 0.005 24.985 14.883 1.00 0.00 C ATOM 1252 O SER A 78 -0.661 25.750 14.186 1.00 0.00 O ATOM 1253 CB SER A 78 -0.247 22.497 14.927 1.00 0.00 C ATOM 1254 OG SER A 78 -0.888 21.391 15.540 1.00 0.00 O ATOM 0 H SER A 78 -2.473 24.536 14.865 1.00 0.00 H new ATOM 0 HA SER A 78 -0.302 23.800 16.635 1.00 0.00 H new ATOM 0 HB2 SER A 78 -0.509 22.533 13.870 1.00 0.00 H new ATOM 0 HB3 SER A 78 0.834 22.372 14.983 1.00 0.00 H new ATOM 0 HG SER A 78 -0.616 20.564 15.090 1.00 0.00 H new ATOM 1260 N ASN A 79 1.316 25.123 15.058 1.00 0.00 N ATOM 1261 CA ASN A 79 2.062 26.205 14.426 1.00 0.00 C ATOM 1262 C ASN A 79 3.555 25.894 14.400 1.00 0.00 C ATOM 1263 O ASN A 79 4.212 25.866 15.440 1.00 0.00 O ATOM 1264 CB ASN A 79 1.817 27.521 15.167 1.00 0.00 C ATOM 1265 CG ASN A 79 2.285 28.727 14.375 1.00 0.00 C ATOM 1266 OD1 ASN A 79 3.465 29.077 14.395 1.00 0.00 O ATOM 1267 ND2 ASN A 79 1.359 29.369 13.673 1.00 0.00 N ATOM 0 H ASN A 79 1.883 24.499 15.632 1.00 0.00 H new ATOM 0 HA ASN A 79 1.712 26.303 13.399 1.00 0.00 H new ATOM 0 HB2 ASN A 79 0.753 27.621 15.381 1.00 0.00 H new ATOM 0 HB3 ASN A 79 2.335 27.497 16.126 1.00 0.00 H new ATOM 0 HD21 ASN A 79 1.614 30.188 13.121 1.00 0.00 H new ATOM 0 HD22 ASN A 79 0.392 29.043 13.686 1.00 0.00 H new ATOM 1274 N ALA A 80 4.084 25.660 13.203 1.00 0.00 N ATOM 1275 CA ALA A 80 5.499 25.353 13.040 1.00 0.00 C ATOM 1276 C ALA A 80 6.093 26.110 11.857 1.00 0.00 C ATOM 1277 O ALA A 80 5.365 26.647 11.023 1.00 0.00 O ATOM 1278 CB ALA A 80 5.698 23.855 12.864 1.00 0.00 C ATOM 0 H ALA A 80 3.553 25.677 12.332 1.00 0.00 H new ATOM 0 HA ALA A 80 6.020 25.674 13.942 1.00 0.00 H new ATOM 0 HB1 ALA A 80 6.760 23.641 12.743 1.00 0.00 H new ATOM 0 HB2 ALA A 80 5.320 23.332 13.742 1.00 0.00 H new ATOM 0 HB3 ALA A 80 5.157 23.517 11.980 1.00 0.00 H new ATOM 1284 N GLY A 81 7.420 26.148 11.790 1.00 0.00 N ATOM 1285 CA GLY A 81 8.089 26.843 10.705 1.00 0.00 C ATOM 1286 C GLY A 81 9.572 27.022 10.959 1.00 0.00 C ATOM 1287 O GLY A 81 9.991 27.261 12.091 1.00 0.00 O ATOM 0 H GLY A 81 8.044 25.710 12.468 1.00 0.00 H new ATOM 0 HA2 GLY A 81 7.947 26.286 9.779 1.00 0.00 H new ATOM 0 HA3 GLY A 81 7.627 27.820 10.564 1.00 0.00 H new ATOM 1291 N SER A 82 10.370 26.905 9.902 1.00 0.00 N ATOM 1292 CA SER A 82 11.817 27.050 10.016 1.00 0.00 C ATOM 1293 C SER A 82 12.444 27.330 8.654 1.00 0.00 C ATOM 1294 O SER A 82 11.822 27.109 7.615 1.00 0.00 O ATOM 1295 CB SER A 82 12.431 25.787 10.623 1.00 0.00 C ATOM 1296 OG SER A 82 12.482 25.874 12.037 1.00 0.00 O ATOM 0 H SER A 82 10.039 26.710 8.957 1.00 0.00 H new ATOM 0 HA SER A 82 12.022 27.896 10.672 1.00 0.00 H new ATOM 0 HB2 SER A 82 11.844 24.916 10.330 1.00 0.00 H new ATOM 0 HB3 SER A 82 13.436 25.641 10.228 1.00 0.00 H new ATOM 0 HG SER A 82 11.687 26.344 12.365 1.00 0.00 H new ATOM 1302 N SER A 83 13.680 27.818 8.668 1.00 0.00 N ATOM 1303 CA SER A 83 14.391 28.133 7.434 1.00 0.00 C ATOM 1304 C SER A 83 15.880 28.332 7.702 1.00 0.00 C ATOM 1305 O SER A 83 16.286 28.631 8.824 1.00 0.00 O ATOM 1306 CB SER A 83 13.805 29.390 6.789 1.00 0.00 C ATOM 1307 OG SER A 83 13.756 30.463 7.713 1.00 0.00 O ATOM 0 H SER A 83 14.210 28.004 9.520 1.00 0.00 H new ATOM 0 HA SER A 83 14.271 27.293 6.750 1.00 0.00 H new ATOM 0 HB2 SER A 83 14.409 29.675 5.927 1.00 0.00 H new ATOM 0 HB3 SER A 83 12.802 29.179 6.419 1.00 0.00 H new ATOM 0 HG SER A 83 13.379 31.255 7.275 1.00 0.00 H new ATOM 1313 N SER A 84 16.689 28.164 6.661 1.00 0.00 N ATOM 1314 CA SER A 84 18.134 28.321 6.782 1.00 0.00 C ATOM 1315 C SER A 84 18.810 28.200 5.420 1.00 0.00 C ATOM 1316 O SER A 84 18.411 27.388 4.586 1.00 0.00 O ATOM 1317 CB SER A 84 18.703 27.273 7.741 1.00 0.00 C ATOM 1318 OG SER A 84 20.026 27.602 8.130 1.00 0.00 O ATOM 0 H SER A 84 16.369 27.919 5.724 1.00 0.00 H new ATOM 0 HA SER A 84 18.334 29.316 7.180 1.00 0.00 H new ATOM 0 HB2 SER A 84 18.068 27.201 8.624 1.00 0.00 H new ATOM 0 HB3 SER A 84 18.694 26.294 7.262 1.00 0.00 H new ATOM 0 HG SER A 84 20.366 26.918 8.744 1.00 0.00 H new ATOM 1324 N GLY A 85 19.838 29.015 5.202 1.00 0.00 N ATOM 1325 CA GLY A 85 20.554 28.985 3.940 1.00 0.00 C ATOM 1326 C GLY A 85 22.040 29.229 4.111 1.00 0.00 C ATOM 1327 O GLY A 85 22.470 29.996 4.973 1.00 0.00 O ATOM 0 H GLY A 85 20.188 29.695 5.877 1.00 0.00 H new ATOM 0 HA2 GLY A 85 20.400 28.018 3.462 1.00 0.00 H new ATOM 0 HA3 GLY A 85 20.139 29.740 3.272 1.00 0.00 H new ATOM 1331 N PRO A 86 22.853 28.565 3.275 1.00 0.00 N ATOM 1332 CA PRO A 86 24.312 28.697 3.319 1.00 0.00 C ATOM 1333 C PRO A 86 24.785 30.068 2.846 1.00 0.00 C ATOM 1334 O PRO A 86 23.976 30.929 2.503 1.00 0.00 O ATOM 1335 CB PRO A 86 24.796 27.605 2.362 1.00 0.00 C ATOM 1336 CG PRO A 86 23.659 27.394 1.422 1.00 0.00 C ATOM 1337 CD PRO A 86 22.410 27.635 2.223 1.00 0.00 C ATOM 0 HA PRO A 86 24.700 28.597 4.333 1.00 0.00 H new ATOM 0 HB2 PRO A 86 25.696 27.914 1.831 1.00 0.00 H new ATOM 0 HB3 PRO A 86 25.041 26.689 2.899 1.00 0.00 H new ATOM 0 HG2 PRO A 86 23.719 28.080 0.577 1.00 0.00 H new ATOM 0 HG3 PRO A 86 23.672 26.383 1.014 1.00 0.00 H new ATOM 0 HD2 PRO A 86 21.618 28.068 1.612 1.00 0.00 H new ATOM 0 HD3 PRO A 86 22.018 26.709 2.644 1.00 0.00 H new ATOM 1345 N SER A 87 26.099 30.263 2.831 1.00 0.00 N ATOM 1346 CA SER A 87 26.679 31.530 2.403 1.00 0.00 C ATOM 1347 C SER A 87 28.195 31.417 2.272 1.00 0.00 C ATOM 1348 O SER A 87 28.816 30.531 2.859 1.00 0.00 O ATOM 1349 CB SER A 87 26.323 32.639 3.395 1.00 0.00 C ATOM 1350 OG SER A 87 26.294 33.904 2.758 1.00 0.00 O ATOM 0 H SER A 87 26.783 29.559 3.110 1.00 0.00 H new ATOM 0 HA SER A 87 26.265 31.779 1.426 1.00 0.00 H new ATOM 0 HB2 SER A 87 25.351 32.432 3.843 1.00 0.00 H new ATOM 0 HB3 SER A 87 27.051 32.653 4.206 1.00 0.00 H new ATOM 0 HG SER A 87 26.062 34.595 3.413 1.00 0.00 H new ATOM 1356 N SER A 88 28.785 32.322 1.496 1.00 0.00 N ATOM 1357 CA SER A 88 30.227 32.322 1.284 1.00 0.00 C ATOM 1358 C SER A 88 30.819 33.698 1.574 1.00 0.00 C ATOM 1359 O SER A 88 30.095 34.648 1.871 1.00 0.00 O ATOM 1360 CB SER A 88 30.553 31.908 -0.153 1.00 0.00 C ATOM 1361 OG SER A 88 29.956 32.792 -1.086 1.00 0.00 O ATOM 0 H SER A 88 28.286 33.064 1.004 1.00 0.00 H new ATOM 0 HA SER A 88 30.670 31.602 1.972 1.00 0.00 H new ATOM 0 HB2 SER A 88 31.634 31.899 -0.296 1.00 0.00 H new ATOM 0 HB3 SER A 88 30.199 30.893 -0.331 1.00 0.00 H new ATOM 0 HG SER A 88 30.180 32.507 -1.996 1.00 0.00 H new ATOM 1367 N GLY A 89 32.142 33.798 1.486 1.00 0.00 N ATOM 1368 CA GLY A 89 32.809 35.061 1.743 1.00 0.00 C ATOM 1369 C GLY A 89 34.286 35.014 1.405 1.00 0.00 C ATOM 1370 O GLY A 89 35.090 35.724 2.009 1.00 0.00 O ATOM 0 H GLY A 89 32.763 33.027 1.241 1.00 0.00 H new ATOM 0 HA2 GLY A 89 32.330 35.847 1.159 1.00 0.00 H new ATOM 0 HA3 GLY A 89 32.688 35.326 2.793 1.00 0.00 H new TER 1374 GLY A 89