USER MOD reduce.3.24.130724 H: found=0, std=0, add=1166, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 1160 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 67 HIS : no HE2:sc= -0.639 K(o=0.033,f=-13!) USER MOD Set 1.2: B 69 ASN : amide:sc= 0.672 K(o=0.033,f=-13!) USER MOD Set 2.1: B 37 HIS : no HD1:sc= -1.08 X(o=-1.1,f=-1.6) USER MOD Set 2.2: B 40 THR OG1 : rot 180:sc= -0.071 USER MOD Single : A 1 VAL N :NH3+ 175:sc= -0.256 (180deg=-0.322) USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 4 LYS NZ :NH3+ -110:sc= 1.13 (180deg=0.703) USER MOD Single : A 8 TYR OH : rot -156:sc= 1.23 USER MOD Single : A 9 HIS : no HD1:sc= 1.23 K(o=1.2,f=-7.7!) USER MOD Single : A 12 CYS SG : rot 180:sc= -0.383 USER MOD Single : A 15 CYS SG : rot 180:sc= -4.07! USER MOD Single : A 17 SER OG : rot 74:sc= 0.217 USER MOD Single : A 20 GLN :FLIP amide:sc= -0.0126 F(o=-1.2,f=-0.013) USER MOD Single : A 24 ASN :FLIP amide:sc= 0 F(o=-1.1,f=0) USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 30 LYS NZ :NH3+ -162:sc= 0.725 (180deg=-0.147) USER MOD Single : A 31 TYR OH : rot 180:sc= 0 USER MOD Single : A 32 THR OG1 : rot 180:sc= 0 USER MOD Single : A 37 HIS : no HE2:sc= 0.0732 K(o=0.073,f=-2.1) USER MOD Single : A 40 THR OG1 : rot 180:sc= -0.213 USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 LYS NZ :NH3+ 155:sc= 1.13 (180deg=0.428) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 SER OG : rot -170:sc= -0.0382 USER MOD Single : A 69 ASN : amide:sc= -0.0966 K(o=-0.097,f=-9.6!) USER MOD Single : A 78 LYS NZ :NH3+ 169:sc= 1.17 (180deg=1.03) USER MOD Single : A 80 SER OG : rot 180:sc= 0 USER MOD Single : B 1 VAL N :NH3+ -118:sc= -0.244 (180deg=-0.348) USER MOD Single : B 3 SER OG : rot 129:sc= 1.29 USER MOD Single : B 4 LYS NZ :NH3+ -156:sc= 1.32 (180deg=1.1) USER MOD Single : B 8 TYR OH : rot -141:sc= 0.66 USER MOD Single : B 9 HIS : no HD1:sc= -0.26 K(o=-0.26,f=-2.4) USER MOD Single : B 12 CYS SG : rot 180:sc= -0.151 USER MOD Single : B 15 CYS SG : rot 19:sc= -6.4! USER MOD Single : B 17 SER OG : rot 180:sc= 0.0134 USER MOD Single : B 20 GLN :FLIP amide:sc= 0 F(o=-1,f=0) USER MOD Single : B 24 ASN : amide:sc= 0.335 X(o=0.33,f=0) USER MOD Single : B 29 SER OG : rot 180:sc= 0 USER MOD Single : B 30 LYS NZ :NH3+ 170:sc= 3.61 (180deg=3.24) USER MOD Single : B 31 TYR OH : rot 180:sc= 0 USER MOD Single : B 32 THR OG1 : rot 180:sc= 0 USER MOD Single : B 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 50 LYS NZ :NH3+ -113:sc= 0.102 (180deg=-0.261) USER MOD Single : B 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 55 SER OG : rot -160:sc= 0.637 USER MOD Single : B 67 HIS : no HE2:sc= 0.548 K(o=0.55,f=-7.7!) USER MOD Single : B 78 LYS NZ :NH3+ -156:sc= 2.23 (180deg=1.63) USER MOD Single : B 80 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N VAL A 1 33.104 16.095 -12.768 1.00 0.00 N ATOM 2 CA VAL A 1 32.354 16.581 -11.585 1.00 0.00 C ATOM 3 C VAL A 1 30.945 16.006 -11.566 1.00 0.00 C ATOM 4 O VAL A 1 30.494 15.417 -12.547 1.00 0.00 O ATOM 5 CB VAL A 1 32.269 18.124 -11.545 1.00 0.00 C ATOM 6 CG1 VAL A 1 33.637 18.730 -11.277 1.00 0.00 C ATOM 7 CG2 VAL A 1 31.681 18.666 -12.843 1.00 0.00 C ATOM 0 H1 VAL A 1 34.031 16.564 -12.808 1.00 0.00 H new ATOM 0 H2 VAL A 1 33.239 15.066 -12.695 1.00 0.00 H new ATOM 0 H3 VAL A 1 32.568 16.313 -13.632 1.00 0.00 H new ATOM 0 HA VAL A 1 32.903 16.243 -10.706 1.00 0.00 H new ATOM 0 HB VAL A 1 31.606 18.408 -10.728 1.00 0.00 H new ATOM 0 HG11 VAL A 1 33.555 19.817 -11.253 1.00 0.00 H new ATOM 0 HG12 VAL A 1 34.012 18.373 -10.318 1.00 0.00 H new ATOM 0 HG13 VAL A 1 34.327 18.436 -12.068 1.00 0.00 H new ATOM 0 HG21 VAL A 1 31.630 19.754 -12.793 1.00 0.00 H new ATOM 0 HG22 VAL A 1 32.313 18.370 -13.680 1.00 0.00 H new ATOM 0 HG23 VAL A 1 30.679 18.262 -12.985 1.00 0.00 H new ATOM 19 N ALA A 2 30.253 16.189 -10.449 1.00 0.00 N ATOM 20 CA ALA A 2 28.893 15.698 -10.292 1.00 0.00 C ATOM 21 C ALA A 2 28.160 16.523 -9.243 1.00 0.00 C ATOM 22 O ALA A 2 28.759 17.390 -8.603 1.00 0.00 O ATOM 23 CB ALA A 2 28.898 14.226 -9.901 1.00 0.00 C ATOM 0 H ALA A 2 30.617 16.679 -9.632 1.00 0.00 H new ATOM 0 HA ALA A 2 28.373 15.797 -11.245 1.00 0.00 H new ATOM 0 HB1 ALA A 2 27.872 13.876 -9.788 1.00 0.00 H new ATOM 0 HB2 ALA A 2 29.396 13.645 -10.677 1.00 0.00 H new ATOM 0 HB3 ALA A 2 29.430 14.102 -8.958 1.00 0.00 H new ATOM 29 N SER A 3 26.876 16.254 -9.069 1.00 0.00 N ATOM 30 CA SER A 3 26.081 16.946 -8.070 1.00 0.00 C ATOM 31 C SER A 3 26.388 16.402 -6.677 1.00 0.00 C ATOM 32 O SER A 3 26.968 15.322 -6.536 1.00 0.00 O ATOM 33 CB SER A 3 24.593 16.797 -8.390 1.00 0.00 C ATOM 34 OG SER A 3 24.296 17.320 -9.676 1.00 0.00 O ATOM 0 H SER A 3 26.361 15.559 -9.609 1.00 0.00 H new ATOM 0 HA SER A 3 26.337 18.005 -8.087 1.00 0.00 H new ATOM 0 HB2 SER A 3 24.311 15.745 -8.347 1.00 0.00 H new ATOM 0 HB3 SER A 3 24.001 17.316 -7.636 1.00 0.00 H new ATOM 0 HG SER A 3 23.339 17.212 -9.860 1.00 0.00 H new ATOM 40 N LYS A 4 26.003 17.149 -5.654 1.00 0.00 N ATOM 41 CA LYS A 4 26.303 16.776 -4.281 1.00 0.00 C ATOM 42 C LYS A 4 25.056 16.268 -3.565 1.00 0.00 C ATOM 43 O LYS A 4 24.025 16.941 -3.541 1.00 0.00 O ATOM 44 CB LYS A 4 26.898 17.976 -3.539 1.00 0.00 C ATOM 45 CG LYS A 4 27.180 17.721 -2.067 1.00 0.00 C ATOM 46 CD LYS A 4 27.940 18.882 -1.442 1.00 0.00 C ATOM 47 CE LYS A 4 29.342 19.006 -2.022 1.00 0.00 C ATOM 48 NZ LYS A 4 30.231 17.899 -1.581 1.00 0.00 N ATOM 0 H LYS A 4 25.481 18.020 -5.750 1.00 0.00 H new ATOM 0 HA LYS A 4 27.032 15.965 -4.292 1.00 0.00 H new ATOM 0 HB2 LYS A 4 27.826 18.269 -4.030 1.00 0.00 H new ATOM 0 HB3 LYS A 4 26.212 18.819 -3.625 1.00 0.00 H new ATOM 0 HG2 LYS A 4 26.241 17.570 -1.535 1.00 0.00 H new ATOM 0 HG3 LYS A 4 27.759 16.804 -1.959 1.00 0.00 H new ATOM 0 HD2 LYS A 4 27.392 19.809 -1.609 1.00 0.00 H new ATOM 0 HD3 LYS A 4 28.002 18.739 -0.363 1.00 0.00 H new ATOM 0 HE2 LYS A 4 29.284 19.012 -3.110 1.00 0.00 H new ATOM 0 HE3 LYS A 4 29.775 19.960 -1.721 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 30.948 18.270 -0.926 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 29.666 17.171 -1.099 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 30.701 17.481 -2.409 1.00 0.00 H new ATOM 62 N ALA A 5 25.161 15.071 -2.997 1.00 0.00 N ATOM 63 CA ALA A 5 24.074 14.483 -2.230 1.00 0.00 C ATOM 64 C ALA A 5 24.611 13.915 -0.924 1.00 0.00 C ATOM 65 O ALA A 5 25.185 12.827 -0.896 1.00 0.00 O ATOM 66 CB ALA A 5 23.371 13.400 -3.038 1.00 0.00 C ATOM 0 H ALA A 5 25.995 14.487 -3.056 1.00 0.00 H new ATOM 0 HA ALA A 5 23.344 15.260 -2.002 1.00 0.00 H new ATOM 0 HB1 ALA A 5 22.561 12.973 -2.447 1.00 0.00 H new ATOM 0 HB2 ALA A 5 22.964 13.834 -3.951 1.00 0.00 H new ATOM 0 HB3 ALA A 5 24.084 12.617 -3.295 1.00 0.00 H new ATOM 72 N ILE A 6 24.438 14.660 0.154 1.00 0.00 N ATOM 73 CA ILE A 6 24.982 14.261 1.444 1.00 0.00 C ATOM 74 C ILE A 6 23.921 13.525 2.257 1.00 0.00 C ATOM 75 O ILE A 6 22.846 14.058 2.516 1.00 0.00 O ATOM 76 CB ILE A 6 25.491 15.479 2.244 1.00 0.00 C ATOM 77 CG1 ILE A 6 26.297 16.417 1.344 1.00 0.00 C ATOM 78 CG2 ILE A 6 26.353 15.014 3.409 1.00 0.00 C ATOM 79 CD1 ILE A 6 26.769 17.676 2.043 1.00 0.00 C ATOM 0 H ILE A 6 23.927 15.543 0.164 1.00 0.00 H new ATOM 0 HA ILE A 6 25.826 13.598 1.256 1.00 0.00 H new ATOM 0 HB ILE A 6 24.629 16.023 2.629 1.00 0.00 H new ATOM 0 HG12 ILE A 6 27.163 15.880 0.958 1.00 0.00 H new ATOM 0 HG13 ILE A 6 25.686 16.696 0.485 1.00 0.00 H new ATOM 0 HG21 ILE A 6 26.708 15.880 3.968 1.00 0.00 H new ATOM 0 HG22 ILE A 6 25.763 14.375 4.066 1.00 0.00 H new ATOM 0 HG23 ILE A 6 27.207 14.453 3.029 1.00 0.00 H new ATOM 0 HD11 ILE A 6 27.333 18.291 1.342 1.00 0.00 H new ATOM 0 HD12 ILE A 6 25.907 18.236 2.405 1.00 0.00 H new ATOM 0 HD13 ILE A 6 27.407 17.407 2.885 1.00 0.00 H new ATOM 91 N PHE A 7 24.227 12.305 2.657 1.00 0.00 N ATOM 92 CA PHE A 7 23.258 11.455 3.329 1.00 0.00 C ATOM 93 C PHE A 7 23.588 11.332 4.816 1.00 0.00 C ATOM 94 O PHE A 7 24.511 10.618 5.198 1.00 0.00 O ATOM 95 CB PHE A 7 23.238 10.075 2.664 1.00 0.00 C ATOM 96 CG PHE A 7 22.067 9.221 3.051 1.00 0.00 C ATOM 97 CD1 PHE A 7 20.812 9.465 2.514 1.00 0.00 C ATOM 98 CD2 PHE A 7 22.216 8.171 3.940 1.00 0.00 C ATOM 99 CE1 PHE A 7 19.730 8.678 2.859 1.00 0.00 C ATOM 100 CE2 PHE A 7 21.139 7.380 4.288 1.00 0.00 C ATOM 101 CZ PHE A 7 19.894 7.634 3.746 1.00 0.00 C ATOM 0 H PHE A 7 25.144 11.877 2.528 1.00 0.00 H new ATOM 0 HA PHE A 7 22.269 11.906 3.242 1.00 0.00 H new ATOM 0 HB2 PHE A 7 23.236 10.206 1.582 1.00 0.00 H new ATOM 0 HB3 PHE A 7 24.157 9.548 2.919 1.00 0.00 H new ATOM 0 HD1 PHE A 7 20.679 10.280 1.818 1.00 0.00 H new ATOM 0 HD2 PHE A 7 23.187 7.968 4.367 1.00 0.00 H new ATOM 0 HE1 PHE A 7 18.757 8.880 2.435 1.00 0.00 H new ATOM 0 HE2 PHE A 7 21.270 6.564 4.983 1.00 0.00 H new ATOM 0 HZ PHE A 7 19.050 7.016 4.016 1.00 0.00 H new ATOM 111 N TYR A 8 22.841 12.045 5.644 1.00 0.00 N ATOM 112 CA TYR A 8 23.048 12.011 7.088 1.00 0.00 C ATOM 113 C TYR A 8 22.122 10.992 7.740 1.00 0.00 C ATOM 114 O TYR A 8 20.915 10.996 7.490 1.00 0.00 O ATOM 115 CB TYR A 8 22.778 13.384 7.715 1.00 0.00 C ATOM 116 CG TYR A 8 23.836 14.436 7.454 1.00 0.00 C ATOM 117 CD1 TYR A 8 23.867 15.144 6.263 1.00 0.00 C ATOM 118 CD2 TYR A 8 24.783 14.743 8.425 1.00 0.00 C ATOM 119 CE1 TYR A 8 24.811 16.127 6.043 1.00 0.00 C ATOM 120 CE2 TYR A 8 25.734 15.721 8.209 1.00 0.00 C ATOM 121 CZ TYR A 8 25.745 16.411 7.017 1.00 0.00 C ATOM 122 OH TYR A 8 26.680 17.398 6.800 1.00 0.00 O ATOM 0 H TYR A 8 22.083 12.657 5.342 1.00 0.00 H new ATOM 0 HA TYR A 8 24.087 11.731 7.259 1.00 0.00 H new ATOM 0 HB2 TYR A 8 21.823 13.753 7.342 1.00 0.00 H new ATOM 0 HB3 TYR A 8 22.673 13.258 8.793 1.00 0.00 H new ATOM 0 HD1 TYR A 8 23.141 14.923 5.495 1.00 0.00 H new ATOM 0 HD2 TYR A 8 24.775 14.208 9.363 1.00 0.00 H new ATOM 0 HE1 TYR A 8 24.818 16.672 5.111 1.00 0.00 H new ATOM 0 HE2 TYR A 8 26.466 15.944 8.971 1.00 0.00 H new ATOM 0 HH TYR A 8 27.467 17.232 7.359 1.00 0.00 H new ATOM 132 N HIS A 9 22.682 10.126 8.576 1.00 0.00 N ATOM 133 CA HIS A 9 21.876 9.206 9.368 1.00 0.00 C ATOM 134 C HIS A 9 22.676 8.689 10.559 1.00 0.00 C ATOM 135 O HIS A 9 23.903 8.740 10.556 1.00 0.00 O ATOM 136 CB HIS A 9 21.349 8.041 8.515 1.00 0.00 C ATOM 137 CG HIS A 9 22.372 7.016 8.125 1.00 0.00 C ATOM 138 ND1 HIS A 9 22.535 5.868 8.855 1.00 0.00 N ATOM 139 CD2 HIS A 9 23.201 6.981 7.056 1.00 0.00 C ATOM 140 CE1 HIS A 9 23.455 5.163 8.220 1.00 0.00 C ATOM 141 NE2 HIS A 9 23.890 5.795 7.122 1.00 0.00 N ATOM 0 H HIS A 9 23.688 10.042 8.723 1.00 0.00 H new ATOM 0 HA HIS A 9 21.011 9.754 9.742 1.00 0.00 H new ATOM 0 HB2 HIS A 9 20.551 7.542 9.065 1.00 0.00 H new ATOM 0 HB3 HIS A 9 20.904 8.449 7.608 1.00 0.00 H new ATOM 0 HD2 HIS A 9 23.302 7.741 6.296 1.00 0.00 H new ATOM 0 HE1 HIS A 9 23.812 4.197 8.546 1.00 0.00 H new ATOM 0 HE2 HIS A 9 24.594 5.461 6.464 1.00 0.00 H new ATOM 149 N ALA A 10 21.979 8.199 11.577 1.00 0.00 N ATOM 150 CA ALA A 10 22.626 7.776 12.815 1.00 0.00 C ATOM 151 C ALA A 10 22.768 6.258 12.893 1.00 0.00 C ATOM 152 O ALA A 10 23.069 5.711 13.953 1.00 0.00 O ATOM 153 CB ALA A 10 21.846 8.294 14.013 1.00 0.00 C ATOM 0 H ALA A 10 20.965 8.084 11.571 1.00 0.00 H new ATOM 0 HA ALA A 10 23.630 8.199 12.826 1.00 0.00 H new ATOM 0 HB1 ALA A 10 22.336 7.974 14.932 1.00 0.00 H new ATOM 0 HB2 ALA A 10 21.811 9.383 13.981 1.00 0.00 H new ATOM 0 HB3 ALA A 10 20.831 7.897 13.986 1.00 0.00 H new ATOM 159 N GLY A 11 22.566 5.582 11.770 1.00 0.00 N ATOM 160 CA GLY A 11 22.677 4.134 11.749 1.00 0.00 C ATOM 161 C GLY A 11 21.413 3.447 12.225 1.00 0.00 C ATOM 162 O GLY A 11 21.417 2.250 12.517 1.00 0.00 O ATOM 0 H GLY A 11 22.328 6.008 10.874 1.00 0.00 H new ATOM 0 HA2 GLY A 11 22.905 3.805 10.735 1.00 0.00 H new ATOM 0 HA3 GLY A 11 23.512 3.828 12.379 1.00 0.00 H new ATOM 166 N CYS A 12 20.331 4.207 12.309 1.00 0.00 N ATOM 167 CA CYS A 12 19.045 3.669 12.722 1.00 0.00 C ATOM 168 C CYS A 12 18.519 2.696 11.668 1.00 0.00 C ATOM 169 O CYS A 12 18.845 2.826 10.488 1.00 0.00 O ATOM 170 CB CYS A 12 18.050 4.812 12.928 1.00 0.00 C ATOM 171 SG CYS A 12 18.684 6.150 13.963 1.00 0.00 S ATOM 0 H CYS A 12 20.320 5.204 12.095 1.00 0.00 H new ATOM 0 HA CYS A 12 19.169 3.131 13.662 1.00 0.00 H new ATOM 0 HB2 CYS A 12 17.770 5.218 11.956 1.00 0.00 H new ATOM 0 HB3 CYS A 12 17.142 4.414 13.380 1.00 0.00 H new ATOM 0 HG CYS A 12 17.777 7.074 14.081 1.00 0.00 H new ATOM 177 N PRO A 13 17.705 1.711 12.079 1.00 0.00 N ATOM 178 CA PRO A 13 17.145 0.703 11.163 1.00 0.00 C ATOM 179 C PRO A 13 16.481 1.332 9.942 1.00 0.00 C ATOM 180 O PRO A 13 16.728 0.923 8.805 1.00 0.00 O ATOM 181 CB PRO A 13 16.108 -0.012 12.027 1.00 0.00 C ATOM 182 CG PRO A 13 16.609 0.141 13.419 1.00 0.00 C ATOM 183 CD PRO A 13 17.268 1.489 13.470 1.00 0.00 C ATOM 0 HA PRO A 13 17.913 0.045 10.757 1.00 0.00 H new ATOM 0 HB2 PRO A 13 15.120 0.433 11.910 1.00 0.00 H new ATOM 0 HB3 PRO A 13 16.019 -1.063 11.751 1.00 0.00 H new ATOM 0 HG2 PRO A 13 15.792 0.078 14.138 1.00 0.00 H new ATOM 0 HG3 PRO A 13 17.316 -0.650 13.669 1.00 0.00 H new ATOM 0 HD2 PRO A 13 16.575 2.262 13.801 1.00 0.00 H new ATOM 0 HD3 PRO A 13 18.110 1.498 14.162 1.00 0.00 H new ATOM 191 N VAL A 14 15.662 2.347 10.187 1.00 0.00 N ATOM 192 CA VAL A 14 14.964 3.056 9.121 1.00 0.00 C ATOM 193 C VAL A 14 15.962 3.728 8.178 1.00 0.00 C ATOM 194 O VAL A 14 15.747 3.796 6.967 1.00 0.00 O ATOM 195 CB VAL A 14 14.007 4.119 9.703 1.00 0.00 C ATOM 196 CG1 VAL A 14 13.173 4.760 8.605 1.00 0.00 C ATOM 197 CG2 VAL A 14 13.112 3.506 10.770 1.00 0.00 C ATOM 0 H VAL A 14 15.463 2.700 11.123 1.00 0.00 H new ATOM 0 HA VAL A 14 14.381 2.325 8.561 1.00 0.00 H new ATOM 0 HB VAL A 14 14.610 4.900 10.167 1.00 0.00 H new ATOM 0 HG11 VAL A 14 12.508 5.505 9.041 1.00 0.00 H new ATOM 0 HG12 VAL A 14 13.832 5.241 7.882 1.00 0.00 H new ATOM 0 HG13 VAL A 14 12.581 3.994 8.104 1.00 0.00 H new ATOM 0 HG21 VAL A 14 12.445 4.270 11.168 1.00 0.00 H new ATOM 0 HG22 VAL A 14 12.522 2.702 10.331 1.00 0.00 H new ATOM 0 HG23 VAL A 14 13.728 3.106 11.576 1.00 0.00 H new ATOM 207 N CYS A 15 17.065 4.202 8.744 1.00 0.00 N ATOM 208 CA CYS A 15 18.112 4.848 7.967 1.00 0.00 C ATOM 209 C CYS A 15 18.802 3.837 7.060 1.00 0.00 C ATOM 210 O CYS A 15 19.089 4.127 5.898 1.00 0.00 O ATOM 211 CB CYS A 15 19.134 5.496 8.896 1.00 0.00 C ATOM 212 SG CYS A 15 18.423 6.660 10.083 1.00 0.00 S ATOM 0 H CYS A 15 17.257 4.150 9.744 1.00 0.00 H new ATOM 0 HA CYS A 15 17.656 5.620 7.348 1.00 0.00 H new ATOM 0 HB2 CYS A 15 19.660 4.713 9.442 1.00 0.00 H new ATOM 0 HB3 CYS A 15 19.877 6.018 8.293 1.00 0.00 H new ATOM 0 HG CYS A 15 19.368 7.154 10.826 1.00 0.00 H new ATOM 218 N VAL A 16 19.051 2.648 7.598 1.00 0.00 N ATOM 219 CA VAL A 16 19.681 1.574 6.839 1.00 0.00 C ATOM 220 C VAL A 16 18.830 1.201 5.628 1.00 0.00 C ATOM 221 O VAL A 16 19.353 0.950 4.543 1.00 0.00 O ATOM 222 CB VAL A 16 19.908 0.322 7.716 1.00 0.00 C ATOM 223 CG1 VAL A 16 20.544 -0.799 6.907 1.00 0.00 C ATOM 224 CG2 VAL A 16 20.768 0.662 8.924 1.00 0.00 C ATOM 0 H VAL A 16 18.825 2.403 8.562 1.00 0.00 H new ATOM 0 HA VAL A 16 20.650 1.940 6.500 1.00 0.00 H new ATOM 0 HB VAL A 16 18.937 -0.023 8.070 1.00 0.00 H new ATOM 0 HG11 VAL A 16 20.694 -1.669 7.546 1.00 0.00 H new ATOM 0 HG12 VAL A 16 19.889 -1.066 6.078 1.00 0.00 H new ATOM 0 HG13 VAL A 16 21.506 -0.466 6.517 1.00 0.00 H new ATOM 0 HG21 VAL A 16 20.916 -0.233 9.529 1.00 0.00 H new ATOM 0 HG22 VAL A 16 21.735 1.037 8.588 1.00 0.00 H new ATOM 0 HG23 VAL A 16 20.270 1.425 9.522 1.00 0.00 H new ATOM 234 N SER A 17 17.516 1.185 5.818 1.00 0.00 N ATOM 235 CA SER A 17 16.588 0.884 4.738 1.00 0.00 C ATOM 236 C SER A 17 16.725 1.904 3.605 1.00 0.00 C ATOM 237 O SER A 17 16.786 1.542 2.430 1.00 0.00 O ATOM 238 CB SER A 17 15.156 0.873 5.274 1.00 0.00 C ATOM 239 OG SER A 17 15.046 0.014 6.400 1.00 0.00 O ATOM 0 H SER A 17 17.069 1.378 6.714 1.00 0.00 H new ATOM 0 HA SER A 17 16.826 -0.101 4.337 1.00 0.00 H new ATOM 0 HB2 SER A 17 14.859 1.884 5.552 1.00 0.00 H new ATOM 0 HB3 SER A 17 14.472 0.544 4.491 1.00 0.00 H new ATOM 0 HG SER A 17 15.472 0.435 7.176 1.00 0.00 H new ATOM 245 N ALA A 18 16.804 3.180 3.970 1.00 0.00 N ATOM 246 CA ALA A 18 16.919 4.249 2.988 1.00 0.00 C ATOM 247 C ALA A 18 18.290 4.238 2.316 1.00 0.00 C ATOM 248 O ALA A 18 18.402 4.478 1.114 1.00 0.00 O ATOM 249 CB ALA A 18 16.655 5.598 3.640 1.00 0.00 C ATOM 0 H ALA A 18 16.790 3.497 4.939 1.00 0.00 H new ATOM 0 HA ALA A 18 16.168 4.080 2.217 1.00 0.00 H new ATOM 0 HB1 ALA A 18 16.745 6.387 2.893 1.00 0.00 H new ATOM 0 HB2 ALA A 18 15.649 5.609 4.060 1.00 0.00 H new ATOM 0 HB3 ALA A 18 17.382 5.766 4.435 1.00 0.00 H new ATOM 255 N GLU A 19 19.327 3.952 3.094 1.00 0.00 N ATOM 256 CA GLU A 19 20.685 3.886 2.569 1.00 0.00 C ATOM 257 C GLU A 19 20.822 2.734 1.575 1.00 0.00 C ATOM 258 O GLU A 19 21.284 2.920 0.449 1.00 0.00 O ATOM 259 CB GLU A 19 21.688 3.709 3.713 1.00 0.00 C ATOM 260 CG GLU A 19 23.139 3.686 3.255 1.00 0.00 C ATOM 261 CD GLU A 19 24.100 3.334 4.372 1.00 0.00 C ATOM 262 OE1 GLU A 19 24.357 2.129 4.580 1.00 0.00 O ATOM 263 OE2 GLU A 19 24.612 4.254 5.041 1.00 0.00 O ATOM 0 H GLU A 19 19.253 3.762 4.093 1.00 0.00 H new ATOM 0 HA GLU A 19 20.897 4.821 2.051 1.00 0.00 H new ATOM 0 HB2 GLU A 19 21.555 4.519 4.430 1.00 0.00 H new ATOM 0 HB3 GLU A 19 21.467 2.780 4.238 1.00 0.00 H new ATOM 0 HG2 GLU A 19 23.249 2.964 2.446 1.00 0.00 H new ATOM 0 HG3 GLU A 19 23.403 4.662 2.849 1.00 0.00 H new ATOM 270 N GLN A 20 20.389 1.555 1.999 1.00 0.00 N ATOM 271 CA GLN A 20 20.517 0.342 1.198 1.00 0.00 C ATOM 272 C GLN A 20 19.722 0.436 -0.102 1.00 0.00 C ATOM 273 O GLN A 20 20.156 -0.062 -1.141 1.00 0.00 O ATOM 274 CB GLN A 20 20.049 -0.863 2.018 1.00 0.00 C ATOM 275 CG GLN A 20 20.058 -2.176 1.255 1.00 0.00 C ATOM 276 CD GLN A 20 19.611 -3.345 2.110 1.00 0.00 C ATOM 277 OE1 GLN A 20 19.898 -3.278 3.400 1.00 0.00 O flip ATOM 278 NE2 GLN A 20 19.016 -4.302 1.616 1.00 0.00 N flip ATOM 0 H GLN A 20 19.941 1.411 2.904 1.00 0.00 H new ATOM 0 HA GLN A 20 21.567 0.221 0.930 1.00 0.00 H new ATOM 0 HB2 GLN A 20 20.688 -0.961 2.896 1.00 0.00 H new ATOM 0 HB3 GLN A 20 19.038 -0.672 2.379 1.00 0.00 H new ATOM 0 HG2 GLN A 20 19.404 -2.093 0.387 1.00 0.00 H new ATOM 0 HG3 GLN A 20 21.063 -2.368 0.879 1.00 0.00 H new ATOM 0 HE21 GLN A 20 18.813 -4.316 0.616 1.00 0.00 H new ATOM 0 HE22 GLN A 20 18.725 -5.082 2.206 1.00 0.00 H new ATOM 287 N ALA A 21 18.562 1.072 -0.048 1.00 0.00 N ATOM 288 CA ALA A 21 17.705 1.166 -1.218 1.00 0.00 C ATOM 289 C ALA A 21 17.961 2.448 -2.004 1.00 0.00 C ATOM 290 O ALA A 21 18.502 2.409 -3.107 1.00 0.00 O ATOM 291 CB ALA A 21 16.244 1.075 -0.814 1.00 0.00 C ATOM 0 H ALA A 21 18.195 1.528 0.787 1.00 0.00 H new ATOM 0 HA ALA A 21 17.945 0.326 -1.870 1.00 0.00 H new ATOM 0 HB1 ALA A 21 15.616 1.147 -1.702 1.00 0.00 H new ATOM 0 HB2 ALA A 21 16.062 0.122 -0.317 1.00 0.00 H new ATOM 0 HB3 ALA A 21 16.004 1.891 -0.132 1.00 0.00 H new ATOM 297 N VAL A 22 17.596 3.582 -1.420 1.00 0.00 N ATOM 298 CA VAL A 22 17.638 4.859 -2.126 1.00 0.00 C ATOM 299 C VAL A 22 19.071 5.316 -2.387 1.00 0.00 C ATOM 300 O VAL A 22 19.428 5.641 -3.518 1.00 0.00 O ATOM 301 CB VAL A 22 16.889 5.960 -1.344 1.00 0.00 C ATOM 302 CG1 VAL A 22 16.858 7.261 -2.134 1.00 0.00 C ATOM 303 CG2 VAL A 22 15.478 5.507 -0.997 1.00 0.00 C ATOM 0 H VAL A 22 17.267 3.645 -0.457 1.00 0.00 H new ATOM 0 HA VAL A 22 17.142 4.698 -3.083 1.00 0.00 H new ATOM 0 HB VAL A 22 17.428 6.142 -0.414 1.00 0.00 H new ATOM 0 HG11 VAL A 22 16.325 8.021 -1.563 1.00 0.00 H new ATOM 0 HG12 VAL A 22 17.878 7.597 -2.322 1.00 0.00 H new ATOM 0 HG13 VAL A 22 16.349 7.098 -3.084 1.00 0.00 H new ATOM 0 HG21 VAL A 22 14.967 6.297 -0.446 1.00 0.00 H new ATOM 0 HG22 VAL A 22 14.929 5.291 -1.914 1.00 0.00 H new ATOM 0 HG23 VAL A 22 15.525 4.608 -0.382 1.00 0.00 H new ATOM 313 N ALA A 23 19.898 5.317 -1.347 1.00 0.00 N ATOM 314 CA ALA A 23 21.264 5.825 -1.458 1.00 0.00 C ATOM 315 C ALA A 23 22.129 4.935 -2.351 1.00 0.00 C ATOM 316 O ALA A 23 23.168 5.366 -2.850 1.00 0.00 O ATOM 317 CB ALA A 23 21.892 5.974 -0.080 1.00 0.00 C ATOM 0 H ALA A 23 19.649 4.973 -0.420 1.00 0.00 H new ATOM 0 HA ALA A 23 21.212 6.807 -1.927 1.00 0.00 H new ATOM 0 HB1 ALA A 23 22.909 6.353 -0.183 1.00 0.00 H new ATOM 0 HB2 ALA A 23 21.303 6.672 0.515 1.00 0.00 H new ATOM 0 HB3 ALA A 23 21.915 5.004 0.416 1.00 0.00 H new ATOM 323 N ASN A 24 21.705 3.695 -2.549 1.00 0.00 N ATOM 324 CA ASN A 24 22.420 2.786 -3.440 1.00 0.00 C ATOM 325 C ASN A 24 21.829 2.828 -4.844 1.00 0.00 C ATOM 326 O ASN A 24 22.462 2.397 -5.809 1.00 0.00 O ATOM 327 CB ASN A 24 22.410 1.352 -2.904 1.00 0.00 C ATOM 328 CG ASN A 24 23.470 1.105 -1.839 1.00 0.00 C ATOM 329 OD1 ASN A 24 23.760 2.109 -1.026 1.00 0.00 O flip ATOM 330 ND2 ASN A 24 24.024 0.009 -1.749 1.00 0.00 N flip ATOM 0 H ASN A 24 20.876 3.295 -2.109 1.00 0.00 H new ATOM 0 HA ASN A 24 23.456 3.122 -3.486 1.00 0.00 H new ATOM 0 HB2 ASN A 24 21.427 1.133 -2.487 1.00 0.00 H new ATOM 0 HB3 ASN A 24 22.567 0.660 -3.731 1.00 0.00 H new ATOM 0 HD21 ASN A 24 23.776 -0.742 -2.393 1.00 0.00 H new ATOM 0 HD22 ASN A 24 24.731 -0.148 -1.031 1.00 0.00 H new ATOM 337 N ALA A 25 20.613 3.352 -4.956 1.00 0.00 N ATOM 338 CA ALA A 25 19.963 3.506 -6.251 1.00 0.00 C ATOM 339 C ALA A 25 20.486 4.747 -6.961 1.00 0.00 C ATOM 340 O ALA A 25 20.387 4.872 -8.184 1.00 0.00 O ATOM 341 CB ALA A 25 18.452 3.587 -6.087 1.00 0.00 C ATOM 0 H ALA A 25 20.058 3.677 -4.164 1.00 0.00 H new ATOM 0 HA ALA A 25 20.196 2.632 -6.859 1.00 0.00 H new ATOM 0 HB1 ALA A 25 17.985 3.702 -7.065 1.00 0.00 H new ATOM 0 HB2 ALA A 25 18.088 2.674 -5.616 1.00 0.00 H new ATOM 0 HB3 ALA A 25 18.199 4.443 -5.462 1.00 0.00 H new ATOM 347 N ILE A 26 21.035 5.668 -6.184 1.00 0.00 N ATOM 348 CA ILE A 26 21.631 6.872 -6.732 1.00 0.00 C ATOM 349 C ILE A 26 23.028 6.567 -7.258 1.00 0.00 C ATOM 350 O ILE A 26 23.846 5.964 -6.564 1.00 0.00 O ATOM 351 CB ILE A 26 21.709 7.994 -5.675 1.00 0.00 C ATOM 352 CG1 ILE A 26 20.315 8.301 -5.121 1.00 0.00 C ATOM 353 CG2 ILE A 26 22.331 9.248 -6.276 1.00 0.00 C ATOM 354 CD1 ILE A 26 20.314 9.335 -4.017 1.00 0.00 C ATOM 0 H ILE A 26 21.079 5.602 -5.167 1.00 0.00 H new ATOM 0 HA ILE A 26 20.997 7.217 -7.549 1.00 0.00 H new ATOM 0 HB ILE A 26 22.341 7.655 -4.854 1.00 0.00 H new ATOM 0 HG12 ILE A 26 19.679 8.650 -5.935 1.00 0.00 H new ATOM 0 HG13 ILE A 26 19.872 7.379 -4.744 1.00 0.00 H new ATOM 0 HG21 ILE A 26 22.379 10.030 -5.518 1.00 0.00 H new ATOM 0 HG22 ILE A 26 23.337 9.022 -6.628 1.00 0.00 H new ATOM 0 HG23 ILE A 26 21.722 9.591 -7.113 1.00 0.00 H new ATOM 0 HD11 ILE A 26 19.293 9.501 -3.674 1.00 0.00 H new ATOM 0 HD12 ILE A 26 20.923 8.980 -3.185 1.00 0.00 H new ATOM 0 HD13 ILE A 26 20.726 10.271 -4.395 1.00 0.00 H new ATOM 366 N ASP A 27 23.287 6.972 -8.491 1.00 0.00 N ATOM 367 CA ASP A 27 24.571 6.723 -9.124 1.00 0.00 C ATOM 368 C ASP A 27 25.533 7.864 -8.834 1.00 0.00 C ATOM 369 O ASP A 27 25.166 9.038 -8.943 1.00 0.00 O ATOM 370 CB ASP A 27 24.406 6.546 -10.636 1.00 0.00 C ATOM 371 CG ASP A 27 23.726 7.729 -11.292 1.00 0.00 C ATOM 372 OD1 ASP A 27 22.487 7.836 -11.175 1.00 0.00 O ATOM 373 OD2 ASP A 27 24.415 8.553 -11.926 1.00 0.00 O ATOM 0 H ASP A 27 22.621 7.477 -9.075 1.00 0.00 H new ATOM 0 HA ASP A 27 24.981 5.801 -8.711 1.00 0.00 H new ATOM 0 HB2 ASP A 27 25.386 6.398 -11.089 1.00 0.00 H new ATOM 0 HB3 ASP A 27 23.825 5.644 -10.831 1.00 0.00 H new ATOM 378 N PRO A 28 26.776 7.533 -8.453 1.00 0.00 N ATOM 379 CA PRO A 28 27.818 8.528 -8.168 1.00 0.00 C ATOM 380 C PRO A 28 28.237 9.308 -9.412 1.00 0.00 C ATOM 381 O PRO A 28 29.041 10.238 -9.332 1.00 0.00 O ATOM 382 CB PRO A 28 28.993 7.693 -7.640 1.00 0.00 C ATOM 383 CG PRO A 28 28.412 6.364 -7.298 1.00 0.00 C ATOM 384 CD PRO A 28 27.262 6.162 -8.239 1.00 0.00 C ATOM 0 HA PRO A 28 27.468 9.282 -7.463 1.00 0.00 H new ATOM 0 HB2 PRO A 28 29.776 7.598 -8.392 1.00 0.00 H new ATOM 0 HB3 PRO A 28 29.446 8.161 -6.766 1.00 0.00 H new ATOM 0 HG2 PRO A 28 29.153 5.573 -7.412 1.00 0.00 H new ATOM 0 HG3 PRO A 28 28.077 6.340 -6.261 1.00 0.00 H new ATOM 0 HD2 PRO A 28 27.579 5.694 -9.171 1.00 0.00 H new ATOM 0 HD3 PRO A 28 26.493 5.522 -7.807 1.00 0.00 H new ATOM 392 N SER A 29 27.695 8.917 -10.560 1.00 0.00 N ATOM 393 CA SER A 29 27.971 9.603 -11.807 1.00 0.00 C ATOM 394 C SER A 29 27.259 10.953 -11.835 1.00 0.00 C ATOM 395 O SER A 29 27.860 11.976 -12.161 1.00 0.00 O ATOM 396 CB SER A 29 27.525 8.736 -12.985 1.00 0.00 C ATOM 397 OG SER A 29 28.063 7.428 -12.878 1.00 0.00 O ATOM 0 H SER A 29 27.059 8.124 -10.648 1.00 0.00 H new ATOM 0 HA SER A 29 29.044 9.779 -11.888 1.00 0.00 H new ATOM 0 HB2 SER A 29 26.437 8.685 -13.014 1.00 0.00 H new ATOM 0 HB3 SER A 29 27.848 9.192 -13.921 1.00 0.00 H new ATOM 0 HG SER A 29 27.765 6.888 -13.640 1.00 0.00 H new ATOM 403 N LYS A 30 25.977 10.950 -11.485 1.00 0.00 N ATOM 404 CA LYS A 30 25.212 12.186 -11.414 1.00 0.00 C ATOM 405 C LYS A 30 25.311 12.818 -10.032 1.00 0.00 C ATOM 406 O LYS A 30 25.502 14.027 -9.909 1.00 0.00 O ATOM 407 CB LYS A 30 23.742 11.944 -11.764 1.00 0.00 C ATOM 408 CG LYS A 30 23.489 11.760 -13.250 1.00 0.00 C ATOM 409 CD LYS A 30 22.002 11.647 -13.553 1.00 0.00 C ATOM 410 CE LYS A 30 21.407 10.353 -13.022 1.00 0.00 C ATOM 411 NZ LYS A 30 22.093 9.156 -13.578 1.00 0.00 N ATOM 0 H LYS A 30 25.450 10.110 -11.248 1.00 0.00 H new ATOM 0 HA LYS A 30 25.641 12.873 -12.144 1.00 0.00 H new ATOM 0 HB2 LYS A 30 23.393 11.059 -11.233 1.00 0.00 H new ATOM 0 HB3 LYS A 30 23.149 12.786 -11.405 1.00 0.00 H new ATOM 0 HG2 LYS A 30 23.910 12.602 -13.799 1.00 0.00 H new ATOM 0 HG3 LYS A 30 24.002 10.864 -13.599 1.00 0.00 H new ATOM 0 HD2 LYS A 30 21.477 12.495 -13.112 1.00 0.00 H new ATOM 0 HD3 LYS A 30 21.847 11.702 -14.631 1.00 0.00 H new ATOM 0 HE2 LYS A 30 21.479 10.340 -11.934 1.00 0.00 H new ATOM 0 HE3 LYS A 30 20.347 10.312 -13.272 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 21.490 8.319 -13.447 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 22.272 9.299 -14.592 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 22.997 9.013 -13.084 1.00 0.00 H new ATOM 425 N TYR A 31 25.192 12.002 -8.994 1.00 0.00 N ATOM 426 CA TYR A 31 25.175 12.512 -7.632 1.00 0.00 C ATOM 427 C TYR A 31 26.219 11.824 -6.768 1.00 0.00 C ATOM 428 O TYR A 31 26.219 10.603 -6.627 1.00 0.00 O ATOM 429 CB TYR A 31 23.789 12.332 -7.006 1.00 0.00 C ATOM 430 CG TYR A 31 22.737 13.267 -7.561 1.00 0.00 C ATOM 431 CD1 TYR A 31 22.120 13.013 -8.780 1.00 0.00 C ATOM 432 CD2 TYR A 31 22.362 14.405 -6.862 1.00 0.00 C ATOM 433 CE1 TYR A 31 21.162 13.869 -9.287 1.00 0.00 C ATOM 434 CE2 TYR A 31 21.403 15.265 -7.361 1.00 0.00 C ATOM 435 CZ TYR A 31 20.807 14.994 -8.573 1.00 0.00 C ATOM 436 OH TYR A 31 19.855 15.852 -9.072 1.00 0.00 O ATOM 0 H TYR A 31 25.106 10.988 -9.069 1.00 0.00 H new ATOM 0 HA TYR A 31 25.413 13.575 -7.679 1.00 0.00 H new ATOM 0 HB2 TYR A 31 23.463 11.303 -7.159 1.00 0.00 H new ATOM 0 HB3 TYR A 31 23.865 12.485 -5.930 1.00 0.00 H new ATOM 0 HD1 TYR A 31 22.394 12.131 -9.340 1.00 0.00 H new ATOM 0 HD2 TYR A 31 22.827 14.622 -5.912 1.00 0.00 H new ATOM 0 HE1 TYR A 31 20.694 13.658 -10.237 1.00 0.00 H new ATOM 0 HE2 TYR A 31 21.122 16.146 -6.803 1.00 0.00 H new ATOM 0 HH TYR A 31 19.722 16.593 -8.445 1.00 0.00 H new ATOM 446 N THR A 32 27.106 12.616 -6.194 1.00 0.00 N ATOM 447 CA THR A 32 28.103 12.103 -5.276 1.00 0.00 C ATOM 448 C THR A 32 27.477 11.909 -3.896 1.00 0.00 C ATOM 449 O THR A 32 27.189 12.880 -3.196 1.00 0.00 O ATOM 450 CB THR A 32 29.307 13.061 -5.175 1.00 0.00 C ATOM 451 OG1 THR A 32 29.789 13.372 -6.492 1.00 0.00 O ATOM 452 CG2 THR A 32 30.431 12.447 -4.351 1.00 0.00 C ATOM 0 H THR A 32 27.155 13.623 -6.349 1.00 0.00 H new ATOM 0 HA THR A 32 28.461 11.145 -5.654 1.00 0.00 H new ATOM 0 HB THR A 32 28.977 13.973 -4.677 1.00 0.00 H new ATOM 0 HG1 THR A 32 30.553 13.982 -6.425 1.00 0.00 H new ATOM 0 HG21 THR A 32 31.266 13.145 -4.297 1.00 0.00 H new ATOM 0 HG22 THR A 32 30.070 12.235 -3.345 1.00 0.00 H new ATOM 0 HG23 THR A 32 30.762 11.521 -4.821 1.00 0.00 H new ATOM 460 N VAL A 33 27.238 10.654 -3.536 1.00 0.00 N ATOM 461 CA VAL A 33 26.594 10.326 -2.272 1.00 0.00 C ATOM 462 C VAL A 33 27.598 10.363 -1.123 1.00 0.00 C ATOM 463 O VAL A 33 28.460 9.491 -1.005 1.00 0.00 O ATOM 464 CB VAL A 33 25.929 8.932 -2.322 1.00 0.00 C ATOM 465 CG1 VAL A 33 25.157 8.655 -1.040 1.00 0.00 C ATOM 466 CG2 VAL A 33 25.018 8.814 -3.535 1.00 0.00 C ATOM 0 H VAL A 33 27.482 9.844 -4.105 1.00 0.00 H new ATOM 0 HA VAL A 33 25.823 11.077 -2.102 1.00 0.00 H new ATOM 0 HB VAL A 33 26.716 8.183 -2.412 1.00 0.00 H new ATOM 0 HG11 VAL A 33 24.697 7.668 -1.098 1.00 0.00 H new ATOM 0 HG12 VAL A 33 25.839 8.688 -0.190 1.00 0.00 H new ATOM 0 HG13 VAL A 33 24.381 9.410 -0.912 1.00 0.00 H new ATOM 0 HG21 VAL A 33 24.560 7.825 -3.551 1.00 0.00 H new ATOM 0 HG22 VAL A 33 24.239 9.574 -3.480 1.00 0.00 H new ATOM 0 HG23 VAL A 33 25.602 8.958 -4.444 1.00 0.00 H new ATOM 476 N GLU A 34 27.490 11.383 -0.294 1.00 0.00 N ATOM 477 CA GLU A 34 28.369 11.537 0.853 1.00 0.00 C ATOM 478 C GLU A 34 27.630 11.162 2.130 1.00 0.00 C ATOM 479 O GLU A 34 26.903 11.972 2.698 1.00 0.00 O ATOM 480 CB GLU A 34 28.881 12.976 0.929 1.00 0.00 C ATOM 481 CG GLU A 34 29.709 13.378 -0.279 1.00 0.00 C ATOM 482 CD GLU A 34 30.008 14.861 -0.326 1.00 0.00 C ATOM 483 OE1 GLU A 34 31.032 15.287 0.252 1.00 0.00 O ATOM 484 OE2 GLU A 34 29.234 15.606 -0.954 1.00 0.00 O ATOM 0 H GLU A 34 26.796 12.124 -0.393 1.00 0.00 H new ATOM 0 HA GLU A 34 29.224 10.871 0.741 1.00 0.00 H new ATOM 0 HB2 GLU A 34 28.032 13.653 1.022 1.00 0.00 H new ATOM 0 HB3 GLU A 34 29.483 13.094 1.830 1.00 0.00 H new ATOM 0 HG2 GLU A 34 30.648 12.824 -0.269 1.00 0.00 H new ATOM 0 HG3 GLU A 34 29.179 13.091 -1.187 1.00 0.00 H new ATOM 491 N ILE A 35 27.791 9.923 2.562 1.00 0.00 N ATOM 492 CA ILE A 35 27.095 9.439 3.744 1.00 0.00 C ATOM 493 C ILE A 35 27.834 9.851 5.014 1.00 0.00 C ATOM 494 O ILE A 35 29.039 9.624 5.150 1.00 0.00 O ATOM 495 CB ILE A 35 26.925 7.906 3.711 1.00 0.00 C ATOM 496 CG1 ILE A 35 26.138 7.493 2.463 1.00 0.00 C ATOM 497 CG2 ILE A 35 26.227 7.413 4.973 1.00 0.00 C ATOM 498 CD1 ILE A 35 25.972 5.996 2.313 1.00 0.00 C ATOM 0 H ILE A 35 28.396 9.235 2.114 1.00 0.00 H new ATOM 0 HA ILE A 35 26.104 9.893 3.746 1.00 0.00 H new ATOM 0 HB ILE A 35 27.913 7.447 3.671 1.00 0.00 H new ATOM 0 HG12 ILE A 35 25.152 7.957 2.497 1.00 0.00 H new ATOM 0 HG13 ILE A 35 26.644 7.883 1.580 1.00 0.00 H new ATOM 0 HG21 ILE A 35 26.117 6.329 4.929 1.00 0.00 H new ATOM 0 HG22 ILE A 35 26.821 7.682 5.846 1.00 0.00 H new ATOM 0 HG23 ILE A 35 25.242 7.874 5.048 1.00 0.00 H new ATOM 0 HD11 ILE A 35 25.405 5.782 1.407 1.00 0.00 H new ATOM 0 HD12 ILE A 35 26.953 5.526 2.247 1.00 0.00 H new ATOM 0 HD13 ILE A 35 25.438 5.601 3.177 1.00 0.00 H new ATOM 510 N VAL A 36 27.105 10.471 5.929 1.00 0.00 N ATOM 511 CA VAL A 36 27.665 10.926 7.189 1.00 0.00 C ATOM 512 C VAL A 36 26.950 10.251 8.355 1.00 0.00 C ATOM 513 O VAL A 36 25.756 10.470 8.579 1.00 0.00 O ATOM 514 CB VAL A 36 27.560 12.459 7.337 1.00 0.00 C ATOM 515 CG1 VAL A 36 28.184 12.920 8.646 1.00 0.00 C ATOM 516 CG2 VAL A 36 28.214 13.161 6.154 1.00 0.00 C ATOM 0 H VAL A 36 26.111 10.672 5.818 1.00 0.00 H new ATOM 0 HA VAL A 36 28.721 10.655 7.198 1.00 0.00 H new ATOM 0 HB VAL A 36 26.503 12.726 7.351 1.00 0.00 H new ATOM 0 HG11 VAL A 36 28.098 14.004 8.728 1.00 0.00 H new ATOM 0 HG12 VAL A 36 27.665 12.450 9.482 1.00 0.00 H new ATOM 0 HG13 VAL A 36 29.236 12.637 8.667 1.00 0.00 H new ATOM 0 HG21 VAL A 36 28.128 14.240 6.279 1.00 0.00 H new ATOM 0 HG22 VAL A 36 29.267 12.884 6.103 1.00 0.00 H new ATOM 0 HG23 VAL A 36 27.715 12.862 5.232 1.00 0.00 H new ATOM 526 N HIS A 37 27.681 9.418 9.079 1.00 0.00 N ATOM 527 CA HIS A 37 27.118 8.682 10.200 1.00 0.00 C ATOM 528 C HIS A 37 27.120 9.544 11.462 1.00 0.00 C ATOM 529 O HIS A 37 28.171 9.980 11.931 1.00 0.00 O ATOM 530 CB HIS A 37 27.909 7.394 10.430 1.00 0.00 C ATOM 531 CG HIS A 37 27.220 6.403 11.316 1.00 0.00 C ATOM 532 ND1 HIS A 37 27.524 6.296 12.653 1.00 0.00 N ATOM 533 CD2 HIS A 37 26.274 5.486 11.004 1.00 0.00 C ATOM 534 CE1 HIS A 37 26.768 5.318 13.118 1.00 0.00 C ATOM 535 NE2 HIS A 37 25.995 4.797 12.156 1.00 0.00 N ATOM 0 H HIS A 37 28.670 9.234 8.909 1.00 0.00 H new ATOM 0 HA HIS A 37 26.086 8.423 9.966 1.00 0.00 H new ATOM 0 HB2 HIS A 37 28.109 6.926 9.466 1.00 0.00 H new ATOM 0 HB3 HIS A 37 28.875 7.647 10.868 1.00 0.00 H new ATOM 0 HD1 HIS A 37 28.195 6.857 13.178 1.00 0.00 H new ATOM 0 HD2 HIS A 37 25.826 5.328 10.034 1.00 0.00 H new ATOM 0 HE1 HIS A 37 26.772 4.981 14.144 1.00 0.00 H new ATOM 543 N LEU A 38 25.934 9.785 11.996 1.00 0.00 N ATOM 544 CA LEU A 38 25.773 10.626 13.175 1.00 0.00 C ATOM 545 C LEU A 38 25.571 9.780 14.428 1.00 0.00 C ATOM 546 O LEU A 38 25.242 10.298 15.492 1.00 0.00 O ATOM 547 CB LEU A 38 24.576 11.565 12.990 1.00 0.00 C ATOM 548 CG LEU A 38 24.678 12.537 11.813 1.00 0.00 C ATOM 549 CD1 LEU A 38 23.371 13.297 11.641 1.00 0.00 C ATOM 550 CD2 LEU A 38 25.833 13.506 12.020 1.00 0.00 C ATOM 0 H LEU A 38 25.060 9.407 11.629 1.00 0.00 H new ATOM 0 HA LEU A 38 26.683 11.214 13.298 1.00 0.00 H new ATOM 0 HB2 LEU A 38 23.678 10.960 12.863 1.00 0.00 H new ATOM 0 HB3 LEU A 38 24.444 12.142 13.905 1.00 0.00 H new ATOM 0 HG LEU A 38 24.869 11.964 10.906 1.00 0.00 H new ATOM 0 HD11 LEU A 38 23.458 13.985 10.800 1.00 0.00 H new ATOM 0 HD12 LEU A 38 22.562 12.592 11.450 1.00 0.00 H new ATOM 0 HD13 LEU A 38 23.155 13.860 12.549 1.00 0.00 H new ATOM 0 HD21 LEU A 38 25.890 14.190 11.173 1.00 0.00 H new ATOM 0 HD22 LEU A 38 25.671 14.075 12.936 1.00 0.00 H new ATOM 0 HD23 LEU A 38 26.766 12.948 12.100 1.00 0.00 H new ATOM 562 N GLY A 39 25.784 8.477 14.302 1.00 0.00 N ATOM 563 CA GLY A 39 25.561 7.577 15.420 1.00 0.00 C ATOM 564 C GLY A 39 26.829 7.311 16.205 1.00 0.00 C ATOM 565 O GLY A 39 26.965 6.272 16.853 1.00 0.00 O ATOM 0 H GLY A 39 26.107 8.026 13.446 1.00 0.00 H new ATOM 0 HA2 GLY A 39 24.809 8.004 16.083 1.00 0.00 H new ATOM 0 HA3 GLY A 39 25.161 6.633 15.050 1.00 0.00 H new ATOM 569 N THR A 40 27.763 8.247 16.135 1.00 0.00 N ATOM 570 CA THR A 40 29.031 8.130 16.838 1.00 0.00 C ATOM 571 C THR A 40 29.647 9.510 17.038 1.00 0.00 C ATOM 572 O THR A 40 30.009 9.890 18.153 1.00 0.00 O ATOM 573 CB THR A 40 30.030 7.237 16.067 1.00 0.00 C ATOM 574 OG1 THR A 40 29.449 5.951 15.816 1.00 0.00 O ATOM 575 CG2 THR A 40 31.323 7.062 16.851 1.00 0.00 C ATOM 0 H THR A 40 27.664 9.105 15.592 1.00 0.00 H new ATOM 0 HA THR A 40 28.828 7.667 17.804 1.00 0.00 H new ATOM 0 HB THR A 40 30.258 7.727 15.121 1.00 0.00 H new ATOM 0 HG1 THR A 40 30.089 5.393 15.326 1.00 0.00 H new ATOM 0 HG21 THR A 40 32.008 6.430 16.286 1.00 0.00 H new ATOM 0 HG22 THR A 40 31.782 8.036 17.018 1.00 0.00 H new ATOM 0 HG23 THR A 40 31.106 6.594 17.811 1.00 0.00 H new ATOM 583 N ASP A 41 29.747 10.260 15.951 1.00 0.00 N ATOM 584 CA ASP A 41 30.340 11.586 15.989 1.00 0.00 C ATOM 585 C ASP A 41 29.294 12.615 16.407 1.00 0.00 C ATOM 586 O ASP A 41 28.382 12.931 15.643 1.00 0.00 O ATOM 587 CB ASP A 41 30.911 11.946 14.616 1.00 0.00 C ATOM 588 CG ASP A 41 31.822 13.156 14.653 1.00 0.00 C ATOM 589 OD1 ASP A 41 31.425 14.200 15.207 1.00 0.00 O ATOM 590 OD2 ASP A 41 32.941 13.073 14.100 1.00 0.00 O ATOM 0 H ASP A 41 29.423 9.970 15.028 1.00 0.00 H new ATOM 0 HA ASP A 41 31.150 11.589 16.719 1.00 0.00 H new ATOM 0 HB2 ASP A 41 31.465 11.093 14.224 1.00 0.00 H new ATOM 0 HB3 ASP A 41 30.089 12.137 13.926 1.00 0.00 H new ATOM 595 N LYS A 42 29.427 13.130 17.621 1.00 0.00 N ATOM 596 CA LYS A 42 28.461 14.081 18.156 1.00 0.00 C ATOM 597 C LYS A 42 28.838 15.515 17.797 1.00 0.00 C ATOM 598 O LYS A 42 28.095 16.456 18.075 1.00 0.00 O ATOM 599 CB LYS A 42 28.350 13.922 19.673 1.00 0.00 C ATOM 600 CG LYS A 42 27.821 12.559 20.095 1.00 0.00 C ATOM 601 CD LYS A 42 27.832 12.392 21.605 1.00 0.00 C ATOM 602 CE LYS A 42 27.320 11.021 22.018 1.00 0.00 C ATOM 603 NZ LYS A 42 27.507 10.779 23.470 1.00 0.00 N ATOM 0 H LYS A 42 30.194 12.906 18.255 1.00 0.00 H new ATOM 0 HA LYS A 42 27.492 13.869 17.705 1.00 0.00 H new ATOM 0 HB2 LYS A 42 29.331 14.079 20.121 1.00 0.00 H new ATOM 0 HB3 LYS A 42 27.693 14.697 20.066 1.00 0.00 H new ATOM 0 HG2 LYS A 42 26.804 12.433 19.723 1.00 0.00 H new ATOM 0 HG3 LYS A 42 28.427 11.777 19.638 1.00 0.00 H new ATOM 0 HD2 LYS A 42 28.846 12.531 21.980 1.00 0.00 H new ATOM 0 HD3 LYS A 42 27.214 13.165 22.062 1.00 0.00 H new ATOM 0 HE2 LYS A 42 26.262 10.937 21.769 1.00 0.00 H new ATOM 0 HE3 LYS A 42 27.843 10.251 21.451 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 27.146 9.835 23.714 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 28.519 10.834 23.704 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 26.987 11.499 24.012 1.00 0.00 H new ATOM 617 N ALA A 43 29.989 15.679 17.160 1.00 0.00 N ATOM 618 CA ALA A 43 30.447 16.997 16.753 1.00 0.00 C ATOM 619 C ALA A 43 29.826 17.381 15.418 1.00 0.00 C ATOM 620 O ALA A 43 29.583 18.559 15.146 1.00 0.00 O ATOM 621 CB ALA A 43 31.965 17.033 16.674 1.00 0.00 C ATOM 0 H ALA A 43 30.621 14.917 16.915 1.00 0.00 H new ATOM 0 HA ALA A 43 30.130 17.724 17.501 1.00 0.00 H new ATOM 0 HB1 ALA A 43 32.290 18.027 16.368 1.00 0.00 H new ATOM 0 HB2 ALA A 43 32.386 16.799 17.652 1.00 0.00 H new ATOM 0 HB3 ALA A 43 32.309 16.299 15.946 1.00 0.00 H new ATOM 627 N ARG A 44 29.551 16.377 14.593 1.00 0.00 N ATOM 628 CA ARG A 44 28.945 16.604 13.284 1.00 0.00 C ATOM 629 C ARG A 44 27.467 16.957 13.418 1.00 0.00 C ATOM 630 O ARG A 44 26.839 17.392 12.455 1.00 0.00 O ATOM 631 CB ARG A 44 29.091 15.379 12.385 1.00 0.00 C ATOM 632 CG ARG A 44 30.526 14.948 12.149 1.00 0.00 C ATOM 633 CD ARG A 44 30.588 13.818 11.140 1.00 0.00 C ATOM 634 NE ARG A 44 31.869 13.112 11.157 1.00 0.00 N ATOM 635 CZ ARG A 44 32.425 12.569 10.074 1.00 0.00 C ATOM 636 NH1 ARG A 44 31.935 12.834 8.868 1.00 0.00 N ATOM 637 NH2 ARG A 44 33.496 11.793 10.193 1.00 0.00 N ATOM 0 H ARG A 44 29.738 15.397 14.807 1.00 0.00 H new ATOM 0 HA ARG A 44 29.473 17.442 12.828 1.00 0.00 H new ATOM 0 HB2 ARG A 44 28.543 14.549 12.830 1.00 0.00 H new ATOM 0 HB3 ARG A 44 28.624 15.591 11.423 1.00 0.00 H new ATOM 0 HG2 ARG A 44 31.111 15.795 11.790 1.00 0.00 H new ATOM 0 HG3 ARG A 44 30.974 14.627 13.090 1.00 0.00 H new ATOM 0 HD2 ARG A 44 29.785 13.110 11.345 1.00 0.00 H new ATOM 0 HD3 ARG A 44 30.412 14.219 10.142 1.00 0.00 H new ATOM 0 HE ARG A 44 32.363 13.031 12.045 1.00 0.00 H new ATOM 0 HH11 ARG A 44 31.131 13.454 8.769 1.00 0.00 H new ATOM 0 HH12 ARG A 44 32.362 12.417 8.041 1.00 0.00 H new ATOM 0 HH21 ARG A 44 33.895 11.612 11.114 1.00 0.00 H new ATOM 0 HH22 ARG A 44 33.920 11.378 9.363 1.00 0.00 H new ATOM 651 N ILE A 45 26.910 16.769 14.610 1.00 0.00 N ATOM 652 CA ILE A 45 25.518 17.122 14.860 1.00 0.00 C ATOM 653 C ILE A 45 25.307 18.616 14.626 1.00 0.00 C ATOM 654 O ILE A 45 24.307 19.029 14.040 1.00 0.00 O ATOM 655 CB ILE A 45 25.080 16.745 16.294 1.00 0.00 C ATOM 656 CG1 ILE A 45 25.220 15.234 16.504 1.00 0.00 C ATOM 657 CG2 ILE A 45 23.646 17.192 16.557 1.00 0.00 C ATOM 658 CD1 ILE A 45 24.837 14.771 17.895 1.00 0.00 C ATOM 0 H ILE A 45 27.399 16.376 15.414 1.00 0.00 H new ATOM 0 HA ILE A 45 24.902 16.553 14.164 1.00 0.00 H new ATOM 0 HB ILE A 45 25.729 17.260 17.003 1.00 0.00 H new ATOM 0 HG12 ILE A 45 24.597 14.716 15.775 1.00 0.00 H new ATOM 0 HG13 ILE A 45 26.252 14.943 16.306 1.00 0.00 H new ATOM 0 HG21 ILE A 45 23.359 16.916 17.572 1.00 0.00 H new ATOM 0 HG22 ILE A 45 23.575 18.273 16.441 1.00 0.00 H new ATOM 0 HG23 ILE A 45 22.977 16.706 15.846 1.00 0.00 H new ATOM 0 HD11 ILE A 45 24.962 13.691 17.966 1.00 0.00 H new ATOM 0 HD12 ILE A 45 25.476 15.260 18.630 1.00 0.00 H new ATOM 0 HD13 ILE A 45 23.796 15.029 18.091 1.00 0.00 H new ATOM 670 N ALA A 46 26.284 19.415 15.047 1.00 0.00 N ATOM 671 CA ALA A 46 26.238 20.859 14.854 1.00 0.00 C ATOM 672 C ALA A 46 26.264 21.210 13.369 1.00 0.00 C ATOM 673 O ALA A 46 25.724 22.235 12.946 1.00 0.00 O ATOM 674 CB ALA A 46 27.402 21.525 15.573 1.00 0.00 C ATOM 0 H ALA A 46 27.121 19.083 15.526 1.00 0.00 H new ATOM 0 HA ALA A 46 25.304 21.230 15.277 1.00 0.00 H new ATOM 0 HB1 ALA A 46 27.355 22.603 15.420 1.00 0.00 H new ATOM 0 HB2 ALA A 46 27.344 21.307 16.639 1.00 0.00 H new ATOM 0 HB3 ALA A 46 28.342 21.143 15.175 1.00 0.00 H new ATOM 680 N GLU A 47 26.900 20.349 12.584 1.00 0.00 N ATOM 681 CA GLU A 47 26.962 20.513 11.138 1.00 0.00 C ATOM 682 C GLU A 47 25.606 20.185 10.519 1.00 0.00 C ATOM 683 O GLU A 47 25.116 20.908 9.650 1.00 0.00 O ATOM 684 CB GLU A 47 28.050 19.601 10.560 1.00 0.00 C ATOM 685 CG GLU A 47 28.160 19.640 9.045 1.00 0.00 C ATOM 686 CD GLU A 47 29.218 18.691 8.520 1.00 0.00 C ATOM 687 OE1 GLU A 47 28.893 17.513 8.261 1.00 0.00 O ATOM 688 OE2 GLU A 47 30.383 19.120 8.368 1.00 0.00 O ATOM 0 H GLU A 47 27.385 19.521 12.930 1.00 0.00 H new ATOM 0 HA GLU A 47 27.210 21.548 10.902 1.00 0.00 H new ATOM 0 HB2 GLU A 47 29.011 19.884 10.990 1.00 0.00 H new ATOM 0 HB3 GLU A 47 27.851 18.576 10.872 1.00 0.00 H new ATOM 0 HG2 GLU A 47 27.196 19.384 8.606 1.00 0.00 H new ATOM 0 HG3 GLU A 47 28.396 20.655 8.726 1.00 0.00 H new ATOM 695 N ALA A 48 24.998 19.105 11.001 1.00 0.00 N ATOM 696 CA ALA A 48 23.707 18.646 10.499 1.00 0.00 C ATOM 697 C ALA A 48 22.639 19.727 10.637 1.00 0.00 C ATOM 698 O ALA A 48 21.856 19.953 9.711 1.00 0.00 O ATOM 699 CB ALA A 48 23.279 17.381 11.228 1.00 0.00 C ATOM 0 H ALA A 48 25.384 18.526 11.747 1.00 0.00 H new ATOM 0 HA ALA A 48 23.819 18.423 9.438 1.00 0.00 H new ATOM 0 HB1 ALA A 48 22.314 17.049 10.844 1.00 0.00 H new ATOM 0 HB2 ALA A 48 24.022 16.600 11.068 1.00 0.00 H new ATOM 0 HB3 ALA A 48 23.194 17.587 12.295 1.00 0.00 H new ATOM 705 N GLU A 49 22.631 20.401 11.789 1.00 0.00 N ATOM 706 CA GLU A 49 21.673 21.476 12.063 1.00 0.00 C ATOM 707 C GLU A 49 21.662 22.500 10.931 1.00 0.00 C ATOM 708 O GLU A 49 20.607 22.919 10.455 1.00 0.00 O ATOM 709 CB GLU A 49 22.039 22.204 13.361 1.00 0.00 C ATOM 710 CG GLU A 49 22.246 21.297 14.561 1.00 0.00 C ATOM 711 CD GLU A 49 22.712 22.063 15.784 1.00 0.00 C ATOM 712 OE1 GLU A 49 23.735 22.778 15.692 1.00 0.00 O ATOM 713 OE2 GLU A 49 22.062 21.964 16.842 1.00 0.00 O ATOM 0 H GLU A 49 23.282 20.220 12.553 1.00 0.00 H new ATOM 0 HA GLU A 49 20.688 21.017 12.154 1.00 0.00 H new ATOM 0 HB2 GLU A 49 22.951 22.778 13.195 1.00 0.00 H new ATOM 0 HB3 GLU A 49 21.250 22.919 13.595 1.00 0.00 H new ATOM 0 HG2 GLU A 49 21.313 20.782 14.790 1.00 0.00 H new ATOM 0 HG3 GLU A 49 22.980 20.531 14.313 1.00 0.00 H new ATOM 720 N LYS A 50 22.855 22.880 10.501 1.00 0.00 N ATOM 721 CA LYS A 50 23.029 23.959 9.540 1.00 0.00 C ATOM 722 C LYS A 50 22.886 23.452 8.110 1.00 0.00 C ATOM 723 O LYS A 50 22.521 24.204 7.206 1.00 0.00 O ATOM 724 CB LYS A 50 24.396 24.600 9.765 1.00 0.00 C ATOM 725 CG LYS A 50 24.546 25.149 11.173 1.00 0.00 C ATOM 726 CD LYS A 50 25.999 25.272 11.589 1.00 0.00 C ATOM 727 CE LYS A 50 26.120 25.683 13.048 1.00 0.00 C ATOM 728 NZ LYS A 50 25.335 24.793 13.947 1.00 0.00 N ATOM 0 H LYS A 50 23.728 22.451 10.807 1.00 0.00 H new ATOM 0 HA LYS A 50 22.250 24.706 9.689 1.00 0.00 H new ATOM 0 HB2 LYS A 50 25.177 23.862 9.579 1.00 0.00 H new ATOM 0 HB3 LYS A 50 24.541 25.406 9.045 1.00 0.00 H new ATOM 0 HG2 LYS A 50 24.069 26.127 11.232 1.00 0.00 H new ATOM 0 HG3 LYS A 50 24.024 24.497 11.873 1.00 0.00 H new ATOM 0 HD2 LYS A 50 26.506 24.320 11.433 1.00 0.00 H new ATOM 0 HD3 LYS A 50 26.500 26.007 10.959 1.00 0.00 H new ATOM 0 HE2 LYS A 50 27.169 25.663 13.344 1.00 0.00 H new ATOM 0 HE3 LYS A 50 25.775 26.711 13.165 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 25.748 24.812 14.901 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 24.350 25.124 13.989 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 25.358 23.820 13.579 1.00 0.00 H new ATOM 742 N ALA A 51 23.161 22.169 7.914 1.00 0.00 N ATOM 743 CA ALA A 51 22.998 21.543 6.610 1.00 0.00 C ATOM 744 C ALA A 51 21.520 21.432 6.252 1.00 0.00 C ATOM 745 O ALA A 51 21.156 21.361 5.079 1.00 0.00 O ATOM 746 CB ALA A 51 23.653 20.169 6.594 1.00 0.00 C ATOM 0 H ALA A 51 23.499 21.541 8.644 1.00 0.00 H new ATOM 0 HA ALA A 51 23.488 22.169 5.864 1.00 0.00 H new ATOM 0 HB1 ALA A 51 23.522 19.715 5.612 1.00 0.00 H new ATOM 0 HB2 ALA A 51 24.717 20.271 6.808 1.00 0.00 H new ATOM 0 HB3 ALA A 51 23.190 19.536 7.351 1.00 0.00 H new ATOM 752 N GLY A 52 20.673 21.435 7.274 1.00 0.00 N ATOM 753 CA GLY A 52 19.245 21.320 7.058 1.00 0.00 C ATOM 754 C GLY A 52 18.708 19.995 7.544 1.00 0.00 C ATOM 755 O GLY A 52 17.531 19.681 7.360 1.00 0.00 O ATOM 0 H GLY A 52 20.952 21.515 8.252 1.00 0.00 H new ATOM 0 HA2 GLY A 52 18.733 22.131 7.575 1.00 0.00 H new ATOM 0 HA3 GLY A 52 19.028 21.432 5.996 1.00 0.00 H new ATOM 759 N VAL A 53 19.577 19.223 8.176 1.00 0.00 N ATOM 760 CA VAL A 53 19.220 17.909 8.678 1.00 0.00 C ATOM 761 C VAL A 53 18.522 18.033 10.023 1.00 0.00 C ATOM 762 O VAL A 53 19.158 18.267 11.048 1.00 0.00 O ATOM 763 CB VAL A 53 20.464 17.010 8.821 1.00 0.00 C ATOM 764 CG1 VAL A 53 20.081 15.618 9.298 1.00 0.00 C ATOM 765 CG2 VAL A 53 21.217 16.940 7.503 1.00 0.00 C ATOM 0 H VAL A 53 20.545 19.489 8.354 1.00 0.00 H new ATOM 0 HA VAL A 53 18.543 17.449 7.958 1.00 0.00 H new ATOM 0 HB VAL A 53 21.119 17.450 9.573 1.00 0.00 H new ATOM 0 HG11 VAL A 53 20.978 15.005 9.390 1.00 0.00 H new ATOM 0 HG12 VAL A 53 19.589 15.688 10.268 1.00 0.00 H new ATOM 0 HG13 VAL A 53 19.402 15.161 8.579 1.00 0.00 H new ATOM 0 HG21 VAL A 53 22.093 16.302 7.618 1.00 0.00 H new ATOM 0 HG22 VAL A 53 20.565 16.526 6.733 1.00 0.00 H new ATOM 0 HG23 VAL A 53 21.533 17.941 7.211 1.00 0.00 H new ATOM 775 N LYS A 54 17.208 17.904 10.002 1.00 0.00 N ATOM 776 CA LYS A 54 16.413 18.013 11.212 1.00 0.00 C ATOM 777 C LYS A 54 15.859 16.649 11.604 1.00 0.00 C ATOM 778 O LYS A 54 15.237 16.493 12.655 1.00 0.00 O ATOM 779 CB LYS A 54 15.290 19.029 11.005 1.00 0.00 C ATOM 780 CG LYS A 54 15.811 20.430 10.727 1.00 0.00 C ATOM 781 CD LYS A 54 14.716 21.360 10.237 1.00 0.00 C ATOM 782 CE LYS A 54 15.277 22.735 9.911 1.00 0.00 C ATOM 783 NZ LYS A 54 14.285 23.593 9.211 1.00 0.00 N ATOM 0 H LYS A 54 16.667 17.723 9.157 1.00 0.00 H new ATOM 0 HA LYS A 54 17.045 18.364 12.028 1.00 0.00 H new ATOM 0 HB2 LYS A 54 14.663 18.707 10.173 1.00 0.00 H new ATOM 0 HB3 LYS A 54 14.657 19.050 11.892 1.00 0.00 H new ATOM 0 HG2 LYS A 54 16.253 20.839 11.636 1.00 0.00 H new ATOM 0 HG3 LYS A 54 16.604 20.380 9.981 1.00 0.00 H new ATOM 0 HD2 LYS A 54 14.243 20.936 9.351 1.00 0.00 H new ATOM 0 HD3 LYS A 54 13.942 21.450 10.999 1.00 0.00 H new ATOM 0 HE2 LYS A 54 15.593 23.225 10.832 1.00 0.00 H new ATOM 0 HE3 LYS A 54 16.164 22.625 9.288 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 14.710 24.520 9.008 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 14.002 23.139 8.319 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 13.448 23.720 9.815 1.00 0.00 H new ATOM 797 N SER A 55 16.083 15.667 10.745 1.00 0.00 N ATOM 798 CA SER A 55 15.715 14.286 11.026 1.00 0.00 C ATOM 799 C SER A 55 16.649 13.340 10.275 1.00 0.00 C ATOM 800 O SER A 55 17.401 13.771 9.402 1.00 0.00 O ATOM 801 CB SER A 55 14.261 14.025 10.619 1.00 0.00 C ATOM 802 OG SER A 55 13.380 14.924 11.272 1.00 0.00 O ATOM 0 H SER A 55 16.524 15.803 9.835 1.00 0.00 H new ATOM 0 HA SER A 55 15.810 14.108 12.097 1.00 0.00 H new ATOM 0 HB2 SER A 55 14.158 14.130 9.539 1.00 0.00 H new ATOM 0 HB3 SER A 55 13.989 12.999 10.867 1.00 0.00 H new ATOM 0 HG SER A 55 12.454 14.641 11.123 1.00 0.00 H new ATOM 808 N VAL A 56 16.611 12.064 10.623 1.00 0.00 N ATOM 809 CA VAL A 56 17.422 11.066 9.945 1.00 0.00 C ATOM 810 C VAL A 56 16.560 9.886 9.504 1.00 0.00 C ATOM 811 O VAL A 56 15.644 9.465 10.224 1.00 0.00 O ATOM 812 CB VAL A 56 18.588 10.559 10.830 1.00 0.00 C ATOM 813 CG1 VAL A 56 19.599 11.669 11.081 1.00 0.00 C ATOM 814 CG2 VAL A 56 18.075 10.001 12.150 1.00 0.00 C ATOM 0 H VAL A 56 16.026 11.694 11.372 1.00 0.00 H new ATOM 0 HA VAL A 56 17.855 11.550 9.069 1.00 0.00 H new ATOM 0 HB VAL A 56 19.085 9.753 10.291 1.00 0.00 H new ATOM 0 HG11 VAL A 56 20.409 11.290 11.705 1.00 0.00 H new ATOM 0 HG12 VAL A 56 20.005 12.014 10.130 1.00 0.00 H new ATOM 0 HG13 VAL A 56 19.109 12.500 11.589 1.00 0.00 H new ATOM 0 HG21 VAL A 56 18.916 9.653 12.749 1.00 0.00 H new ATOM 0 HG22 VAL A 56 17.541 10.782 12.692 1.00 0.00 H new ATOM 0 HG23 VAL A 56 17.399 9.168 11.955 1.00 0.00 H new ATOM 824 N PRO A 57 16.839 9.331 8.316 1.00 0.00 N ATOM 825 CA PRO A 57 17.934 9.788 7.457 1.00 0.00 C ATOM 826 C PRO A 57 17.542 10.965 6.561 1.00 0.00 C ATOM 827 O PRO A 57 16.389 11.096 6.146 1.00 0.00 O ATOM 828 CB PRO A 57 18.231 8.550 6.620 1.00 0.00 C ATOM 829 CG PRO A 57 16.917 7.855 6.484 1.00 0.00 C ATOM 830 CD PRO A 57 16.104 8.208 7.708 1.00 0.00 C ATOM 0 HA PRO A 57 18.782 10.161 8.032 1.00 0.00 H new ATOM 0 HB2 PRO A 57 18.638 8.820 5.646 1.00 0.00 H new ATOM 0 HB3 PRO A 57 18.968 7.911 7.107 1.00 0.00 H new ATOM 0 HG2 PRO A 57 16.405 8.172 5.576 1.00 0.00 H new ATOM 0 HG3 PRO A 57 17.057 6.776 6.411 1.00 0.00 H new ATOM 0 HD2 PRO A 57 15.087 8.495 7.442 1.00 0.00 H new ATOM 0 HD3 PRO A 57 16.028 7.364 8.393 1.00 0.00 H new ATOM 838 N ALA A 58 18.514 11.817 6.265 1.00 0.00 N ATOM 839 CA ALA A 58 18.277 12.988 5.436 1.00 0.00 C ATOM 840 C ALA A 58 19.206 12.999 4.231 1.00 0.00 C ATOM 841 O ALA A 58 20.424 12.882 4.372 1.00 0.00 O ATOM 842 CB ALA A 58 18.462 14.260 6.248 1.00 0.00 C ATOM 0 H ALA A 58 19.476 11.718 6.588 1.00 0.00 H new ATOM 0 HA ALA A 58 17.249 12.944 5.077 1.00 0.00 H new ATOM 0 HB1 ALA A 58 18.281 15.127 5.613 1.00 0.00 H new ATOM 0 HB2 ALA A 58 17.758 14.266 7.080 1.00 0.00 H new ATOM 0 HB3 ALA A 58 19.480 14.300 6.635 1.00 0.00 H new ATOM 848 N LEU A 59 18.622 13.129 3.050 1.00 0.00 N ATOM 849 CA LEU A 59 19.385 13.208 1.816 1.00 0.00 C ATOM 850 C LEU A 59 19.492 14.659 1.359 1.00 0.00 C ATOM 851 O LEU A 59 18.545 15.219 0.810 1.00 0.00 O ATOM 852 CB LEU A 59 18.720 12.354 0.733 1.00 0.00 C ATOM 853 CG LEU A 59 19.431 12.333 -0.622 1.00 0.00 C ATOM 854 CD1 LEU A 59 20.823 11.736 -0.488 1.00 0.00 C ATOM 855 CD2 LEU A 59 18.609 11.551 -1.635 1.00 0.00 C ATOM 0 H LEU A 59 17.612 13.182 2.921 1.00 0.00 H new ATOM 0 HA LEU A 59 20.390 12.825 1.994 1.00 0.00 H new ATOM 0 HB2 LEU A 59 18.644 11.330 1.099 1.00 0.00 H new ATOM 0 HB3 LEU A 59 17.703 12.716 0.584 1.00 0.00 H new ATOM 0 HG LEU A 59 19.534 13.359 -0.975 1.00 0.00 H new ATOM 0 HD11 LEU A 59 21.312 11.730 -1.462 1.00 0.00 H new ATOM 0 HD12 LEU A 59 21.410 12.334 0.209 1.00 0.00 H new ATOM 0 HD13 LEU A 59 20.747 10.715 -0.114 1.00 0.00 H new ATOM 0 HD21 LEU A 59 19.126 11.544 -2.595 1.00 0.00 H new ATOM 0 HD22 LEU A 59 18.479 10.527 -1.285 1.00 0.00 H new ATOM 0 HD23 LEU A 59 17.633 12.021 -1.752 1.00 0.00 H new ATOM 867 N VAL A 60 20.639 15.266 1.612 1.00 0.00 N ATOM 868 CA VAL A 60 20.861 16.667 1.288 1.00 0.00 C ATOM 869 C VAL A 60 21.290 16.828 -0.167 1.00 0.00 C ATOM 870 O VAL A 60 22.438 16.559 -0.521 1.00 0.00 O ATOM 871 CB VAL A 60 21.936 17.289 2.207 1.00 0.00 C ATOM 872 CG1 VAL A 60 22.097 18.774 1.930 1.00 0.00 C ATOM 873 CG2 VAL A 60 21.596 17.049 3.671 1.00 0.00 C ATOM 0 H VAL A 60 21.439 14.806 2.045 1.00 0.00 H new ATOM 0 HA VAL A 60 19.916 17.188 1.444 1.00 0.00 H new ATOM 0 HB VAL A 60 22.887 16.801 1.991 1.00 0.00 H new ATOM 0 HG11 VAL A 60 22.860 19.187 2.590 1.00 0.00 H new ATOM 0 HG12 VAL A 60 22.398 18.920 0.893 1.00 0.00 H new ATOM 0 HG13 VAL A 60 21.149 19.282 2.108 1.00 0.00 H new ATOM 0 HG21 VAL A 60 22.366 17.495 4.301 1.00 0.00 H new ATOM 0 HG22 VAL A 60 20.632 17.503 3.900 1.00 0.00 H new ATOM 0 HG23 VAL A 60 21.547 15.977 3.862 1.00 0.00 H new ATOM 883 N ILE A 61 20.356 17.254 -1.005 1.00 0.00 N ATOM 884 CA ILE A 61 20.639 17.510 -2.410 1.00 0.00 C ATOM 885 C ILE A 61 20.567 19.006 -2.691 1.00 0.00 C ATOM 886 O ILE A 61 19.506 19.620 -2.539 1.00 0.00 O ATOM 887 CB ILE A 61 19.651 16.770 -3.338 1.00 0.00 C ATOM 888 CG1 ILE A 61 19.742 15.257 -3.118 1.00 0.00 C ATOM 889 CG2 ILE A 61 19.929 17.118 -4.795 1.00 0.00 C ATOM 890 CD1 ILE A 61 18.773 14.459 -3.965 1.00 0.00 C ATOM 0 H ILE A 61 19.389 17.431 -0.734 1.00 0.00 H new ATOM 0 HA ILE A 61 21.643 17.138 -2.615 1.00 0.00 H new ATOM 0 HB ILE A 61 18.638 17.092 -3.095 1.00 0.00 H new ATOM 0 HG12 ILE A 61 20.758 14.928 -3.336 1.00 0.00 H new ATOM 0 HG13 ILE A 61 19.555 15.040 -2.066 1.00 0.00 H new ATOM 0 HG21 ILE A 61 19.224 16.589 -5.436 1.00 0.00 H new ATOM 0 HG22 ILE A 61 19.816 18.192 -4.941 1.00 0.00 H new ATOM 0 HG23 ILE A 61 20.946 16.822 -5.052 1.00 0.00 H new ATOM 0 HD11 ILE A 61 18.896 13.397 -3.755 1.00 0.00 H new ATOM 0 HD12 ILE A 61 17.752 14.760 -3.731 1.00 0.00 H new ATOM 0 HD13 ILE A 61 18.973 14.646 -5.020 1.00 0.00 H new ATOM 902 N ASP A 62 21.704 19.590 -3.073 1.00 0.00 N ATOM 903 CA ASP A 62 21.788 21.027 -3.360 1.00 0.00 C ATOM 904 C ASP A 62 21.442 21.858 -2.128 1.00 0.00 C ATOM 905 O ASP A 62 21.011 23.007 -2.238 1.00 0.00 O ATOM 906 CB ASP A 62 20.861 21.415 -4.521 1.00 0.00 C ATOM 907 CG ASP A 62 21.547 21.368 -5.871 1.00 0.00 C ATOM 908 OD1 ASP A 62 22.324 22.301 -6.179 1.00 0.00 O ATOM 909 OD2 ASP A 62 21.295 20.417 -6.641 1.00 0.00 O ATOM 0 H ASP A 62 22.584 19.089 -3.192 1.00 0.00 H new ATOM 0 HA ASP A 62 22.818 21.238 -3.647 1.00 0.00 H new ATOM 0 HB2 ASP A 62 20.003 20.743 -4.533 1.00 0.00 H new ATOM 0 HB3 ASP A 62 20.476 22.421 -4.350 1.00 0.00 H new ATOM 914 N GLY A 63 21.641 21.276 -0.954 1.00 0.00 N ATOM 915 CA GLY A 63 21.342 21.975 0.280 1.00 0.00 C ATOM 916 C GLY A 63 20.001 21.576 0.862 1.00 0.00 C ATOM 917 O GLY A 63 19.751 21.773 2.048 1.00 0.00 O ATOM 0 H GLY A 63 22.005 20.331 -0.834 1.00 0.00 H new ATOM 0 HA2 GLY A 63 22.126 21.771 1.009 1.00 0.00 H new ATOM 0 HA3 GLY A 63 21.350 23.049 0.096 1.00 0.00 H new ATOM 921 N ALA A 64 19.137 21.011 0.029 1.00 0.00 N ATOM 922 CA ALA A 64 17.817 20.588 0.471 1.00 0.00 C ATOM 923 C ALA A 64 17.873 19.181 1.047 1.00 0.00 C ATOM 924 O ALA A 64 18.134 18.215 0.328 1.00 0.00 O ATOM 925 CB ALA A 64 16.820 20.658 -0.677 1.00 0.00 C ATOM 0 H ALA A 64 19.328 20.835 -0.957 1.00 0.00 H new ATOM 0 HA ALA A 64 17.483 21.267 1.256 1.00 0.00 H new ATOM 0 HB1 ALA A 64 15.839 20.338 -0.327 1.00 0.00 H new ATOM 0 HB2 ALA A 64 16.758 21.683 -1.043 1.00 0.00 H new ATOM 0 HB3 ALA A 64 17.148 20.004 -1.484 1.00 0.00 H new ATOM 931 N ALA A 65 17.649 19.072 2.346 1.00 0.00 N ATOM 932 CA ALA A 65 17.707 17.786 3.023 1.00 0.00 C ATOM 933 C ALA A 65 16.368 17.064 2.949 1.00 0.00 C ATOM 934 O ALA A 65 15.423 17.411 3.654 1.00 0.00 O ATOM 935 CB ALA A 65 18.132 17.968 4.472 1.00 0.00 C ATOM 0 H ALA A 65 17.425 19.860 2.954 1.00 0.00 H new ATOM 0 HA ALA A 65 18.449 17.171 2.514 1.00 0.00 H new ATOM 0 HB1 ALA A 65 18.171 16.996 4.965 1.00 0.00 H new ATOM 0 HB2 ALA A 65 19.118 18.432 4.507 1.00 0.00 H new ATOM 0 HB3 ALA A 65 17.413 18.606 4.985 1.00 0.00 H new ATOM 941 N PHE A 66 16.290 16.071 2.076 1.00 0.00 N ATOM 942 CA PHE A 66 15.091 15.263 1.944 1.00 0.00 C ATOM 943 C PHE A 66 15.105 14.143 2.976 1.00 0.00 C ATOM 944 O PHE A 66 15.855 13.175 2.847 1.00 0.00 O ATOM 945 CB PHE A 66 14.981 14.682 0.531 1.00 0.00 C ATOM 946 CG PHE A 66 14.893 15.727 -0.547 1.00 0.00 C ATOM 947 CD1 PHE A 66 13.706 16.404 -0.777 1.00 0.00 C ATOM 948 CD2 PHE A 66 15.996 16.031 -1.330 1.00 0.00 C ATOM 949 CE1 PHE A 66 13.620 17.365 -1.766 1.00 0.00 C ATOM 950 CE2 PHE A 66 15.915 16.991 -2.321 1.00 0.00 C ATOM 951 CZ PHE A 66 14.726 17.658 -2.540 1.00 0.00 C ATOM 0 H PHE A 66 17.048 15.806 1.447 1.00 0.00 H new ATOM 0 HA PHE A 66 14.223 15.898 2.119 1.00 0.00 H new ATOM 0 HB2 PHE A 66 15.847 14.048 0.340 1.00 0.00 H new ATOM 0 HB3 PHE A 66 14.100 14.043 0.478 1.00 0.00 H new ATOM 0 HD1 PHE A 66 12.838 16.178 -0.176 1.00 0.00 H new ATOM 0 HD2 PHE A 66 16.928 15.512 -1.164 1.00 0.00 H new ATOM 0 HE1 PHE A 66 12.689 17.886 -1.934 1.00 0.00 H new ATOM 0 HE2 PHE A 66 16.781 17.219 -2.924 1.00 0.00 H new ATOM 0 HZ PHE A 66 14.661 18.407 -3.315 1.00 0.00 H new ATOM 961 N HIS A 67 14.298 14.300 4.011 1.00 0.00 N ATOM 962 CA HIS A 67 14.226 13.322 5.091 1.00 0.00 C ATOM 963 C HIS A 67 13.415 12.102 4.655 1.00 0.00 C ATOM 964 O HIS A 67 12.188 12.099 4.732 1.00 0.00 O ATOM 965 CB HIS A 67 13.603 13.961 6.336 1.00 0.00 C ATOM 966 CG HIS A 67 14.340 15.178 6.817 1.00 0.00 C ATOM 967 ND1 HIS A 67 14.015 16.468 6.459 1.00 0.00 N ATOM 968 CD2 HIS A 67 15.402 15.282 7.651 1.00 0.00 C ATOM 969 CE1 HIS A 67 14.871 17.295 7.071 1.00 0.00 C ATOM 970 NE2 HIS A 67 15.734 16.625 7.811 1.00 0.00 N ATOM 0 H HIS A 67 13.678 15.101 4.129 1.00 0.00 H new ATOM 0 HA HIS A 67 15.236 12.993 5.333 1.00 0.00 H new ATOM 0 HB2 HIS A 67 12.571 14.234 6.117 1.00 0.00 H new ATOM 0 HB3 HIS A 67 13.574 13.223 7.138 1.00 0.00 H new ATOM 0 HD1 HIS A 67 13.255 16.744 5.837 1.00 0.00 H new ATOM 0 HD2 HIS A 67 15.912 14.453 8.119 1.00 0.00 H new ATOM 0 HE1 HIS A 67 14.857 18.370 6.972 1.00 0.00 H new ATOM 978 N ILE A 68 14.103 11.075 4.188 1.00 0.00 N ATOM 979 CA ILE A 68 13.439 9.905 3.628 1.00 0.00 C ATOM 980 C ILE A 68 13.125 8.884 4.714 1.00 0.00 C ATOM 981 O ILE A 68 14.032 8.272 5.274 1.00 0.00 O ATOM 982 CB ILE A 68 14.300 9.245 2.529 1.00 0.00 C ATOM 983 CG1 ILE A 68 14.624 10.264 1.431 1.00 0.00 C ATOM 984 CG2 ILE A 68 13.580 8.036 1.942 1.00 0.00 C ATOM 985 CD1 ILE A 68 15.551 9.732 0.360 1.00 0.00 C ATOM 0 H ILE A 68 15.122 11.025 4.184 1.00 0.00 H new ATOM 0 HA ILE A 68 12.505 10.246 3.182 1.00 0.00 H new ATOM 0 HB ILE A 68 15.234 8.903 2.974 1.00 0.00 H new ATOM 0 HG12 ILE A 68 13.694 10.590 0.965 1.00 0.00 H new ATOM 0 HG13 ILE A 68 15.078 11.144 1.887 1.00 0.00 H new ATOM 0 HG21 ILE A 68 14.201 7.583 1.169 1.00 0.00 H new ATOM 0 HG22 ILE A 68 13.392 7.307 2.730 1.00 0.00 H new ATOM 0 HG23 ILE A 68 12.632 8.353 1.507 1.00 0.00 H new ATOM 0 HD11 ILE A 68 15.734 10.509 -0.382 1.00 0.00 H new ATOM 0 HD12 ILE A 68 16.496 9.433 0.813 1.00 0.00 H new ATOM 0 HD13 ILE A 68 15.091 8.870 -0.124 1.00 0.00 H new ATOM 997 N ASN A 69 11.832 8.713 4.993 1.00 0.00 N ATOM 998 CA ASN A 69 11.356 7.803 6.041 1.00 0.00 C ATOM 999 C ASN A 69 11.779 8.287 7.422 1.00 0.00 C ATOM 1000 O ASN A 69 12.925 8.127 7.834 1.00 0.00 O ATOM 1001 CB ASN A 69 11.838 6.364 5.806 1.00 0.00 C ATOM 1002 CG ASN A 69 11.009 5.634 4.769 1.00 0.00 C ATOM 1003 OD1 ASN A 69 10.433 6.247 3.874 1.00 0.00 O ATOM 1004 ND2 ASN A 69 10.940 4.316 4.879 1.00 0.00 N ATOM 0 H ASN A 69 11.084 9.200 4.500 1.00 0.00 H new ATOM 0 HA ASN A 69 10.267 7.802 5.994 1.00 0.00 H new ATOM 0 HB2 ASN A 69 12.880 6.381 5.486 1.00 0.00 H new ATOM 0 HB3 ASN A 69 11.802 5.815 6.747 1.00 0.00 H new ATOM 0 HD21 ASN A 69 10.395 3.776 4.207 1.00 0.00 H new ATOM 0 HD22 ASN A 69 11.432 3.841 5.636 1.00 0.00 H new ATOM 1011 N PHE A 70 10.833 8.874 8.139 1.00 0.00 N ATOM 1012 CA PHE A 70 11.110 9.452 9.443 1.00 0.00 C ATOM 1013 C PHE A 70 11.354 8.361 10.481 1.00 0.00 C ATOM 1014 O PHE A 70 10.416 7.722 10.963 1.00 0.00 O ATOM 1015 CB PHE A 70 9.954 10.358 9.879 1.00 0.00 C ATOM 1016 CG PHE A 70 10.164 11.013 11.218 1.00 0.00 C ATOM 1017 CD1 PHE A 70 11.037 12.080 11.353 1.00 0.00 C ATOM 1018 CD2 PHE A 70 9.483 10.564 12.339 1.00 0.00 C ATOM 1019 CE1 PHE A 70 11.227 12.687 12.580 1.00 0.00 C ATOM 1020 CE2 PHE A 70 9.670 11.166 13.569 1.00 0.00 C ATOM 1021 CZ PHE A 70 10.543 12.229 13.689 1.00 0.00 C ATOM 0 H PHE A 70 9.863 8.962 7.837 1.00 0.00 H new ATOM 0 HA PHE A 70 12.016 10.054 9.365 1.00 0.00 H new ATOM 0 HB2 PHE A 70 9.808 11.132 9.126 1.00 0.00 H new ATOM 0 HB3 PHE A 70 9.037 9.770 9.913 1.00 0.00 H new ATOM 0 HD1 PHE A 70 11.575 12.442 10.489 1.00 0.00 H new ATOM 0 HD2 PHE A 70 8.798 9.734 12.250 1.00 0.00 H new ATOM 0 HE1 PHE A 70 11.910 13.519 12.672 1.00 0.00 H new ATOM 0 HE2 PHE A 70 9.134 10.806 14.435 1.00 0.00 H new ATOM 0 HZ PHE A 70 10.691 12.702 14.649 1.00 0.00 H new ATOM 1031 N GLY A 71 12.618 8.132 10.795 1.00 0.00 N ATOM 1032 CA GLY A 71 12.963 7.196 11.843 1.00 0.00 C ATOM 1033 C GLY A 71 13.228 7.912 13.147 1.00 0.00 C ATOM 1034 O GLY A 71 12.615 7.612 14.173 1.00 0.00 O ATOM 0 H GLY A 71 13.414 8.579 10.341 1.00 0.00 H new ATOM 0 HA2 GLY A 71 12.152 6.480 11.976 1.00 0.00 H new ATOM 0 HA3 GLY A 71 13.846 6.628 11.551 1.00 0.00 H new ATOM 1038 N ALA A 72 14.149 8.857 13.107 1.00 0.00 N ATOM 1039 CA ALA A 72 14.448 9.684 14.262 1.00 0.00 C ATOM 1040 C ALA A 72 14.663 11.121 13.825 1.00 0.00 C ATOM 1041 O ALA A 72 15.020 11.374 12.677 1.00 0.00 O ATOM 1042 CB ALA A 72 15.674 9.158 14.993 1.00 0.00 C ATOM 0 H ALA A 72 14.707 9.072 12.281 1.00 0.00 H new ATOM 0 HA ALA A 72 13.603 9.648 14.949 1.00 0.00 H new ATOM 0 HB1 ALA A 72 15.883 9.791 15.856 1.00 0.00 H new ATOM 0 HB2 ALA A 72 15.488 8.138 15.328 1.00 0.00 H new ATOM 0 HB3 ALA A 72 16.531 9.168 14.320 1.00 0.00 H new ATOM 1048 N GLY A 73 14.430 12.059 14.722 1.00 0.00 N ATOM 1049 CA GLY A 73 14.715 13.445 14.425 1.00 0.00 C ATOM 1050 C GLY A 73 16.040 13.860 15.018 1.00 0.00 C ATOM 1051 O GLY A 73 16.637 13.103 15.787 1.00 0.00 O ATOM 0 H GLY A 73 14.048 11.888 15.652 1.00 0.00 H new ATOM 0 HA2 GLY A 73 14.732 13.594 13.345 1.00 0.00 H new ATOM 0 HA3 GLY A 73 13.920 14.077 14.821 1.00 0.00 H new ATOM 1055 N ILE A 74 16.509 15.053 14.685 1.00 0.00 N ATOM 1056 CA ILE A 74 17.757 15.542 15.247 1.00 0.00 C ATOM 1057 C ILE A 74 17.562 15.841 16.731 1.00 0.00 C ATOM 1058 O ILE A 74 18.504 15.791 17.519 1.00 0.00 O ATOM 1059 CB ILE A 74 18.290 16.796 14.508 1.00 0.00 C ATOM 1060 CG1 ILE A 74 19.727 17.097 14.947 1.00 0.00 C ATOM 1061 CG2 ILE A 74 17.389 18.001 14.757 1.00 0.00 C ATOM 1062 CD1 ILE A 74 20.386 18.209 14.159 1.00 0.00 C ATOM 0 H ILE A 74 16.050 15.693 14.037 1.00 0.00 H new ATOM 0 HA ILE A 74 18.507 14.762 15.120 1.00 0.00 H new ATOM 0 HB ILE A 74 18.286 16.591 13.437 1.00 0.00 H new ATOM 0 HG12 ILE A 74 19.726 17.364 16.004 1.00 0.00 H new ATOM 0 HG13 ILE A 74 20.325 16.191 14.848 1.00 0.00 H new ATOM 0 HG21 ILE A 74 17.785 18.867 14.227 1.00 0.00 H new ATOM 0 HG22 ILE A 74 16.383 17.784 14.397 1.00 0.00 H new ATOM 0 HG23 ILE A 74 17.353 18.214 15.825 1.00 0.00 H new ATOM 0 HD11 ILE A 74 21.400 18.364 14.527 1.00 0.00 H new ATOM 0 HD12 ILE A 74 20.421 17.936 13.104 1.00 0.00 H new ATOM 0 HD13 ILE A 74 19.812 19.128 14.278 1.00 0.00 H new ATOM 1074 N ASP A 75 16.310 16.106 17.109 1.00 0.00 N ATOM 1075 CA ASP A 75 15.953 16.316 18.508 1.00 0.00 C ATOM 1076 C ASP A 75 16.123 15.023 19.291 1.00 0.00 C ATOM 1077 O ASP A 75 16.447 15.042 20.474 1.00 0.00 O ATOM 1078 CB ASP A 75 14.507 16.805 18.644 1.00 0.00 C ATOM 1079 CG ASP A 75 14.308 18.229 18.168 1.00 0.00 C ATOM 1080 OD1 ASP A 75 14.484 19.161 18.980 1.00 0.00 O ATOM 1081 OD2 ASP A 75 13.948 18.423 16.986 1.00 0.00 O ATOM 0 H ASP A 75 15.526 16.180 16.461 1.00 0.00 H new ATOM 0 HA ASP A 75 16.618 17.080 18.910 1.00 0.00 H new ATOM 0 HB2 ASP A 75 13.853 16.144 18.075 1.00 0.00 H new ATOM 0 HB3 ASP A 75 14.203 16.733 19.688 1.00 0.00 H new ATOM 1086 N ASP A 76 15.918 13.897 18.615 1.00 0.00 N ATOM 1087 CA ASP A 76 16.059 12.588 19.246 1.00 0.00 C ATOM 1088 C ASP A 76 17.521 12.287 19.528 1.00 0.00 C ATOM 1089 O ASP A 76 17.843 11.478 20.394 1.00 0.00 O ATOM 1090 CB ASP A 76 15.461 11.479 18.372 1.00 0.00 C ATOM 1091 CG ASP A 76 13.950 11.536 18.304 1.00 0.00 C ATOM 1092 OD1 ASP A 76 13.296 11.452 19.366 1.00 0.00 O ATOM 1093 OD2 ASP A 76 13.403 11.671 17.190 1.00 0.00 O ATOM 0 H ASP A 76 15.654 13.864 17.630 1.00 0.00 H new ATOM 0 HA ASP A 76 15.510 12.617 20.187 1.00 0.00 H new ATOM 0 HB2 ASP A 76 15.869 11.557 17.364 1.00 0.00 H new ATOM 0 HB3 ASP A 76 15.766 10.509 18.765 1.00 0.00 H new ATOM 1098 N LEU A 77 18.403 12.938 18.786 1.00 0.00 N ATOM 1099 CA LEU A 77 19.836 12.798 19.002 1.00 0.00 C ATOM 1100 C LEU A 77 20.322 13.879 19.960 1.00 0.00 C ATOM 1101 O LEU A 77 21.387 13.765 20.570 1.00 0.00 O ATOM 1102 CB LEU A 77 20.586 12.899 17.670 1.00 0.00 C ATOM 1103 CG LEU A 77 20.163 11.883 16.605 1.00 0.00 C ATOM 1104 CD1 LEU A 77 20.921 12.124 15.310 1.00 0.00 C ATOM 1105 CD2 LEU A 77 20.391 10.461 17.098 1.00 0.00 C ATOM 0 H LEU A 77 18.151 13.571 18.026 1.00 0.00 H new ATOM 0 HA LEU A 77 20.033 11.819 19.439 1.00 0.00 H new ATOM 0 HB2 LEU A 77 20.446 13.902 17.268 1.00 0.00 H new ATOM 0 HB3 LEU A 77 21.652 12.778 17.862 1.00 0.00 H new ATOM 0 HG LEU A 77 19.098 12.012 16.412 1.00 0.00 H new ATOM 0 HD11 LEU A 77 20.608 11.393 14.564 1.00 0.00 H new ATOM 0 HD12 LEU A 77 20.708 13.129 14.945 1.00 0.00 H new ATOM 0 HD13 LEU A 77 21.991 12.023 15.491 1.00 0.00 H new ATOM 0 HD21 LEU A 77 20.084 9.755 16.327 1.00 0.00 H new ATOM 0 HD22 LEU A 77 21.448 10.318 17.321 1.00 0.00 H new ATOM 0 HD23 LEU A 77 19.804 10.290 18.000 1.00 0.00 H new ATOM 1117 N LYS A 78 19.519 14.922 20.094 1.00 0.00 N ATOM 1118 CA LYS A 78 19.857 16.059 20.931 1.00 0.00 C ATOM 1119 C LYS A 78 19.330 15.852 22.346 1.00 0.00 C ATOM 1120 O LYS A 78 18.200 16.222 22.661 1.00 0.00 O ATOM 1121 CB LYS A 78 19.274 17.338 20.321 1.00 0.00 C ATOM 1122 CG LYS A 78 19.694 18.621 21.022 1.00 0.00 C ATOM 1123 CD LYS A 78 21.201 18.816 20.985 1.00 0.00 C ATOM 1124 CE LYS A 78 21.585 20.242 21.349 1.00 0.00 C ATOM 1125 NZ LYS A 78 21.038 20.656 22.669 1.00 0.00 N ATOM 0 H LYS A 78 18.616 15.003 19.626 1.00 0.00 H new ATOM 0 HA LYS A 78 20.942 16.154 20.983 1.00 0.00 H new ATOM 0 HB2 LYS A 78 19.574 17.396 19.275 1.00 0.00 H new ATOM 0 HB3 LYS A 78 18.186 17.270 20.337 1.00 0.00 H new ATOM 0 HG2 LYS A 78 19.205 19.472 20.547 1.00 0.00 H new ATOM 0 HG3 LYS A 78 19.356 18.597 22.058 1.00 0.00 H new ATOM 0 HD2 LYS A 78 21.676 18.121 21.678 1.00 0.00 H new ATOM 0 HD3 LYS A 78 21.576 18.580 19.989 1.00 0.00 H new ATOM 0 HE2 LYS A 78 22.671 20.330 21.365 1.00 0.00 H new ATOM 0 HE3 LYS A 78 21.221 20.922 20.578 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 21.473 21.555 22.959 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 20.008 20.778 22.595 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 21.250 19.925 23.377 1.00 0.00 H new ATOM 1139 N GLY A 79 20.141 15.220 23.182 1.00 0.00 N ATOM 1140 CA GLY A 79 19.767 15.030 24.568 1.00 0.00 C ATOM 1141 C GLY A 79 19.965 16.295 25.374 1.00 0.00 C ATOM 1142 O GLY A 79 19.005 16.991 25.703 1.00 0.00 O ATOM 0 H GLY A 79 21.050 14.836 22.925 1.00 0.00 H new ATOM 0 HA2 GLY A 79 18.723 14.720 24.625 1.00 0.00 H new ATOM 0 HA3 GLY A 79 20.362 14.225 25.000 1.00 0.00 H new ATOM 1146 N SER A 80 21.216 16.600 25.679 1.00 0.00 N ATOM 1147 CA SER A 80 21.551 17.810 26.404 1.00 0.00 C ATOM 1148 C SER A 80 22.503 18.665 25.574 1.00 0.00 C ATOM 1149 O SER A 80 22.022 19.543 24.832 1.00 0.00 O ATOM 1150 CB SER A 80 22.184 17.462 27.752 1.00 0.00 C ATOM 1151 OG SER A 80 21.346 16.592 28.500 1.00 0.00 O ATOM 1152 OXT SER A 80 23.725 18.442 25.649 1.00 0.00 O ATOM 0 H SER A 80 22.019 16.021 25.433 1.00 0.00 H new ATOM 0 HA SER A 80 20.639 18.377 26.588 1.00 0.00 H new ATOM 0 HB2 SER A 80 23.153 16.990 27.591 1.00 0.00 H new ATOM 0 HB3 SER A 80 22.365 18.375 28.319 1.00 0.00 H new ATOM 0 HG SER A 80 21.773 16.383 29.357 1.00 0.00 H new TER 1158 SER A 80 ATOM 1159 N VAL B 1 17.948 -4.721 -14.293 1.00 0.00 N ATOM 1160 CA VAL B 1 16.471 -4.626 -14.286 1.00 0.00 C ATOM 1161 C VAL B 1 16.026 -3.228 -14.693 1.00 0.00 C ATOM 1162 O VAL B 1 16.856 -2.346 -14.915 1.00 0.00 O ATOM 1163 CB VAL B 1 15.880 -4.957 -12.897 1.00 0.00 C ATOM 1164 CG1 VAL B 1 16.207 -6.386 -12.495 1.00 0.00 C ATOM 1165 CG2 VAL B 1 16.384 -3.979 -11.848 1.00 0.00 C ATOM 0 H1 VAL B 1 18.247 -5.431 -14.992 1.00 0.00 H new ATOM 0 H2 VAL B 1 18.354 -3.797 -14.543 1.00 0.00 H new ATOM 0 H3 VAL B 1 18.282 -5.002 -13.349 1.00 0.00 H new ATOM 0 HA VAL B 1 16.101 -5.358 -15.003 1.00 0.00 H new ATOM 0 HB VAL B 1 14.796 -4.861 -12.962 1.00 0.00 H new ATOM 0 HG11 VAL B 1 15.780 -6.595 -11.514 1.00 0.00 H new ATOM 0 HG12 VAL B 1 15.787 -7.075 -13.228 1.00 0.00 H new ATOM 0 HG13 VAL B 1 17.289 -6.514 -12.455 1.00 0.00 H new ATOM 0 HG21 VAL B 1 15.955 -4.232 -10.879 1.00 0.00 H new ATOM 0 HG22 VAL B 1 17.471 -4.036 -11.789 1.00 0.00 H new ATOM 0 HG23 VAL B 1 16.088 -2.966 -12.123 1.00 0.00 H new ATOM 1177 N ALA B 2 14.721 -3.039 -14.793 1.00 0.00 N ATOM 1178 CA ALA B 2 14.149 -1.746 -15.115 1.00 0.00 C ATOM 1179 C ALA B 2 12.810 -1.585 -14.405 1.00 0.00 C ATOM 1180 O ALA B 2 11.849 -1.062 -14.973 1.00 0.00 O ATOM 1181 CB ALA B 2 13.978 -1.606 -16.621 1.00 0.00 C ATOM 0 H ALA B 2 14.031 -3.777 -14.653 1.00 0.00 H new ATOM 0 HA ALA B 2 14.824 -0.961 -14.774 1.00 0.00 H new ATOM 0 HB1 ALA B 2 13.548 -0.631 -16.849 1.00 0.00 H new ATOM 0 HB2 ALA B 2 14.949 -1.697 -17.107 1.00 0.00 H new ATOM 0 HB3 ALA B 2 13.314 -2.390 -16.986 1.00 0.00 H new ATOM 1187 N SER B 3 12.756 -2.043 -13.159 1.00 0.00 N ATOM 1188 CA SER B 3 11.539 -1.968 -12.366 1.00 0.00 C ATOM 1189 C SER B 3 11.148 -0.514 -12.120 1.00 0.00 C ATOM 1190 O SER B 3 11.999 0.376 -12.109 1.00 0.00 O ATOM 1191 CB SER B 3 11.730 -2.724 -11.048 1.00 0.00 C ATOM 1192 OG SER B 3 13.056 -2.581 -10.560 1.00 0.00 O ATOM 0 H SER B 3 13.546 -2.472 -12.677 1.00 0.00 H new ATOM 0 HA SER B 3 10.725 -2.439 -12.917 1.00 0.00 H new ATOM 0 HB2 SER B 3 11.025 -2.350 -10.306 1.00 0.00 H new ATOM 0 HB3 SER B 3 11.506 -3.780 -11.196 1.00 0.00 H new ATOM 0 HG SER B 3 13.031 -2.298 -9.622 1.00 0.00 H new ATOM 1198 N LYS B 4 9.858 -0.271 -11.941 1.00 0.00 N ATOM 1199 CA LYS B 4 9.367 1.090 -11.836 1.00 0.00 C ATOM 1200 C LYS B 4 9.374 1.580 -10.395 1.00 0.00 C ATOM 1201 O LYS B 4 9.156 0.812 -9.454 1.00 0.00 O ATOM 1202 CB LYS B 4 7.955 1.212 -12.418 1.00 0.00 C ATOM 1203 CG LYS B 4 6.880 0.491 -11.618 1.00 0.00 C ATOM 1204 CD LYS B 4 5.492 0.839 -12.132 1.00 0.00 C ATOM 1205 CE LYS B 4 4.405 0.191 -11.293 1.00 0.00 C ATOM 1206 NZ LYS B 4 3.046 0.548 -11.775 1.00 0.00 N ATOM 0 H LYS B 4 9.141 -0.992 -11.866 1.00 0.00 H new ATOM 0 HA LYS B 4 10.044 1.718 -12.415 1.00 0.00 H new ATOM 0 HB2 LYS B 4 7.693 2.268 -12.486 1.00 0.00 H new ATOM 0 HB3 LYS B 4 7.959 0.819 -13.435 1.00 0.00 H new ATOM 0 HG2 LYS B 4 7.036 -0.586 -11.681 1.00 0.00 H new ATOM 0 HG3 LYS B 4 6.961 0.763 -10.566 1.00 0.00 H new ATOM 0 HD2 LYS B 4 5.362 1.921 -12.124 1.00 0.00 H new ATOM 0 HD3 LYS B 4 5.395 0.514 -13.168 1.00 0.00 H new ATOM 0 HE2 LYS B 4 4.526 -0.892 -11.316 1.00 0.00 H new ATOM 0 HE3 LYS B 4 4.515 0.502 -10.254 1.00 0.00 H new ATOM 0 HZ1 LYS B 4 2.364 0.450 -10.996 1.00 0.00 H new ATOM 0 HZ2 LYS B 4 3.045 1.531 -12.114 1.00 0.00 H new ATOM 0 HZ3 LYS B 4 2.776 -0.087 -12.553 1.00 0.00 H new ATOM 1220 N ALA B 5 9.641 2.863 -10.242 1.00 0.00 N ATOM 1221 CA ALA B 5 9.517 3.533 -8.965 1.00 0.00 C ATOM 1222 C ALA B 5 8.248 4.367 -8.982 1.00 0.00 C ATOM 1223 O ALA B 5 8.100 5.260 -9.814 1.00 0.00 O ATOM 1224 CB ALA B 5 10.735 4.402 -8.691 1.00 0.00 C ATOM 0 H ALA B 5 9.950 3.469 -11.002 1.00 0.00 H new ATOM 0 HA ALA B 5 9.460 2.795 -8.165 1.00 0.00 H new ATOM 0 HB1 ALA B 5 10.620 4.896 -7.726 1.00 0.00 H new ATOM 0 HB2 ALA B 5 11.630 3.780 -8.676 1.00 0.00 H new ATOM 0 HB3 ALA B 5 10.829 5.154 -9.474 1.00 0.00 H new ATOM 1230 N ILE B 6 7.333 4.074 -8.079 1.00 0.00 N ATOM 1231 CA ILE B 6 6.019 4.698 -8.110 1.00 0.00 C ATOM 1232 C ILE B 6 5.985 5.913 -7.196 1.00 0.00 C ATOM 1233 O ILE B 6 6.014 5.783 -5.976 1.00 0.00 O ATOM 1234 CB ILE B 6 4.917 3.710 -7.679 1.00 0.00 C ATOM 1235 CG1 ILE B 6 5.157 2.330 -8.298 1.00 0.00 C ATOM 1236 CG2 ILE B 6 3.551 4.240 -8.092 1.00 0.00 C ATOM 1237 CD1 ILE B 6 4.201 1.265 -7.803 1.00 0.00 C ATOM 0 H ILE B 6 7.471 3.411 -7.316 1.00 0.00 H new ATOM 0 HA ILE B 6 5.830 5.007 -9.138 1.00 0.00 H new ATOM 0 HB ILE B 6 4.946 3.610 -6.594 1.00 0.00 H new ATOM 0 HG12 ILE B 6 5.070 2.408 -9.382 1.00 0.00 H new ATOM 0 HG13 ILE B 6 6.179 2.017 -8.082 1.00 0.00 H new ATOM 0 HG21 ILE B 6 2.779 3.535 -7.783 1.00 0.00 H new ATOM 0 HG22 ILE B 6 3.375 5.204 -7.614 1.00 0.00 H new ATOM 0 HG23 ILE B 6 3.520 4.361 -9.175 1.00 0.00 H new ATOM 0 HD11 ILE B 6 4.433 0.315 -8.286 1.00 0.00 H new ATOM 0 HD12 ILE B 6 4.303 1.158 -6.723 1.00 0.00 H new ATOM 0 HD13 ILE B 6 3.178 1.554 -8.044 1.00 0.00 H new ATOM 1249 N PHE B 7 5.929 7.091 -7.793 1.00 0.00 N ATOM 1250 CA PHE B 7 5.958 8.333 -7.041 1.00 0.00 C ATOM 1251 C PHE B 7 4.554 8.904 -6.895 1.00 0.00 C ATOM 1252 O PHE B 7 3.941 9.326 -7.874 1.00 0.00 O ATOM 1253 CB PHE B 7 6.877 9.346 -7.733 1.00 0.00 C ATOM 1254 CG PHE B 7 6.963 10.676 -7.031 1.00 0.00 C ATOM 1255 CD1 PHE B 7 7.684 10.809 -5.855 1.00 0.00 C ATOM 1256 CD2 PHE B 7 6.322 11.790 -7.549 1.00 0.00 C ATOM 1257 CE1 PHE B 7 7.763 12.029 -5.210 1.00 0.00 C ATOM 1258 CE2 PHE B 7 6.398 13.012 -6.908 1.00 0.00 C ATOM 1259 CZ PHE B 7 7.119 13.132 -5.737 1.00 0.00 C ATOM 0 H PHE B 7 5.863 7.213 -8.803 1.00 0.00 H new ATOM 0 HA PHE B 7 6.349 8.127 -6.045 1.00 0.00 H new ATOM 0 HB2 PHE B 7 7.878 8.921 -7.808 1.00 0.00 H new ATOM 0 HB3 PHE B 7 6.522 9.507 -8.751 1.00 0.00 H new ATOM 0 HD1 PHE B 7 8.189 9.950 -5.438 1.00 0.00 H new ATOM 0 HD2 PHE B 7 5.756 11.702 -8.465 1.00 0.00 H new ATOM 0 HE1 PHE B 7 8.328 12.120 -4.294 1.00 0.00 H new ATOM 0 HE2 PHE B 7 5.894 13.872 -7.323 1.00 0.00 H new ATOM 0 HZ PHE B 7 7.180 14.086 -5.234 1.00 0.00 H new ATOM 1269 N TYR B 8 4.051 8.901 -5.674 1.00 0.00 N ATOM 1270 CA TYR B 8 2.743 9.469 -5.384 1.00 0.00 C ATOM 1271 C TYR B 8 2.891 10.906 -4.909 1.00 0.00 C ATOM 1272 O TYR B 8 3.713 11.199 -4.039 1.00 0.00 O ATOM 1273 CB TYR B 8 2.013 8.653 -4.313 1.00 0.00 C ATOM 1274 CG TYR B 8 1.450 7.336 -4.800 1.00 0.00 C ATOM 1275 CD1 TYR B 8 2.260 6.218 -4.946 1.00 0.00 C ATOM 1276 CD2 TYR B 8 0.098 7.207 -5.095 1.00 0.00 C ATOM 1277 CE1 TYR B 8 1.739 5.012 -5.377 1.00 0.00 C ATOM 1278 CE2 TYR B 8 -0.431 6.002 -5.521 1.00 0.00 C ATOM 1279 CZ TYR B 8 0.394 4.908 -5.661 1.00 0.00 C ATOM 1280 OH TYR B 8 -0.123 3.702 -6.078 1.00 0.00 O ATOM 0 H TYR B 8 4.529 8.510 -4.862 1.00 0.00 H new ATOM 0 HA TYR B 8 2.156 9.444 -6.302 1.00 0.00 H new ATOM 0 HB2 TYR B 8 2.702 8.457 -3.492 1.00 0.00 H new ATOM 0 HB3 TYR B 8 1.198 9.254 -3.909 1.00 0.00 H new ATOM 0 HD1 TYR B 8 3.313 6.291 -4.719 1.00 0.00 H new ATOM 0 HD2 TYR B 8 -0.552 8.063 -4.990 1.00 0.00 H new ATOM 0 HE1 TYR B 8 2.384 4.153 -5.491 1.00 0.00 H new ATOM 0 HE2 TYR B 8 -1.485 5.919 -5.743 1.00 0.00 H new ATOM 0 HH TYR B 8 -0.794 3.857 -6.775 1.00 0.00 H new ATOM 1290 N HIS B 9 2.105 11.802 -5.485 1.00 0.00 N ATOM 1291 CA HIS B 9 2.109 13.192 -5.058 1.00 0.00 C ATOM 1292 C HIS B 9 0.696 13.767 -5.109 1.00 0.00 C ATOM 1293 O HIS B 9 -0.232 13.108 -5.584 1.00 0.00 O ATOM 1294 CB HIS B 9 3.077 14.031 -5.906 1.00 0.00 C ATOM 1295 CG HIS B 9 2.634 14.275 -7.317 1.00 0.00 C ATOM 1296 ND1 HIS B 9 2.226 15.521 -7.726 1.00 0.00 N ATOM 1297 CD2 HIS B 9 2.578 13.423 -8.367 1.00 0.00 C ATOM 1298 CE1 HIS B 9 1.932 15.401 -9.008 1.00 0.00 C ATOM 1299 NE2 HIS B 9 2.129 14.148 -9.442 1.00 0.00 N ATOM 0 H HIS B 9 1.459 11.593 -6.246 1.00 0.00 H new ATOM 0 HA HIS B 9 2.459 13.231 -4.026 1.00 0.00 H new ATOM 0 HB2 HIS B 9 3.225 14.993 -5.416 1.00 0.00 H new ATOM 0 HB3 HIS B 9 4.045 13.531 -5.926 1.00 0.00 H new ATOM 0 HD2 HIS B 9 2.837 12.374 -8.360 1.00 0.00 H new ATOM 0 HE1 HIS B 9 1.577 16.211 -9.629 1.00 0.00 H new ATOM 0 HE2 HIS B 9 1.975 13.801 -10.389 1.00 0.00 H new ATOM 1307 N ALA B 10 0.539 14.990 -4.617 1.00 0.00 N ATOM 1308 CA ALA B 10 -0.778 15.607 -4.528 1.00 0.00 C ATOM 1309 C ALA B 10 -0.754 17.048 -5.032 1.00 0.00 C ATOM 1310 O ALA B 10 -1.664 17.826 -4.750 1.00 0.00 O ATOM 1311 CB ALA B 10 -1.279 15.556 -3.091 1.00 0.00 C ATOM 0 H ALA B 10 1.304 15.572 -4.275 1.00 0.00 H new ATOM 0 HA ALA B 10 -1.460 15.045 -5.166 1.00 0.00 H new ATOM 0 HB1 ALA B 10 -2.264 16.019 -3.032 1.00 0.00 H new ATOM 0 HB2 ALA B 10 -1.346 14.518 -2.766 1.00 0.00 H new ATOM 0 HB3 ALA B 10 -0.586 16.095 -2.445 1.00 0.00 H new ATOM 1317 N GLY B 11 0.284 17.397 -5.784 1.00 0.00 N ATOM 1318 CA GLY B 11 0.379 18.737 -6.340 1.00 0.00 C ATOM 1319 C GLY B 11 0.976 19.743 -5.370 1.00 0.00 C ATOM 1320 O GLY B 11 1.250 20.882 -5.743 1.00 0.00 O ATOM 0 H GLY B 11 1.060 16.779 -6.019 1.00 0.00 H new ATOM 0 HA2 GLY B 11 0.988 18.707 -7.244 1.00 0.00 H new ATOM 0 HA3 GLY B 11 -0.615 19.072 -6.636 1.00 0.00 H new ATOM 1324 N CYS B 12 1.161 19.321 -4.125 1.00 0.00 N ATOM 1325 CA CYS B 12 1.759 20.166 -3.094 1.00 0.00 C ATOM 1326 C CYS B 12 3.167 20.614 -3.505 1.00 0.00 C ATOM 1327 O CYS B 12 3.833 19.927 -4.278 1.00 0.00 O ATOM 1328 CB CYS B 12 1.817 19.387 -1.777 1.00 0.00 C ATOM 1329 SG CYS B 12 0.269 18.557 -1.351 1.00 0.00 S ATOM 0 H CYS B 12 0.903 18.389 -3.801 1.00 0.00 H new ATOM 0 HA CYS B 12 1.146 21.058 -2.967 1.00 0.00 H new ATOM 0 HB2 CYS B 12 2.611 18.643 -1.840 1.00 0.00 H new ATOM 0 HB3 CYS B 12 2.085 20.072 -0.972 1.00 0.00 H new ATOM 0 HG CYS B 12 0.412 17.923 -0.225 1.00 0.00 H new ATOM 1335 N PRO B 13 3.635 21.767 -2.995 1.00 0.00 N ATOM 1336 CA PRO B 13 4.964 22.312 -3.326 1.00 0.00 C ATOM 1337 C PRO B 13 6.092 21.297 -3.133 1.00 0.00 C ATOM 1338 O PRO B 13 7.029 21.236 -3.930 1.00 0.00 O ATOM 1339 CB PRO B 13 5.122 23.474 -2.344 1.00 0.00 C ATOM 1340 CG PRO B 13 3.730 23.894 -2.032 1.00 0.00 C ATOM 1341 CD PRO B 13 2.901 22.643 -2.065 1.00 0.00 C ATOM 0 HA PRO B 13 5.028 22.601 -4.375 1.00 0.00 H new ATOM 0 HB2 PRO B 13 5.653 23.163 -1.444 1.00 0.00 H new ATOM 0 HB3 PRO B 13 5.693 24.291 -2.785 1.00 0.00 H new ATOM 0 HG2 PRO B 13 3.677 24.371 -1.053 1.00 0.00 H new ATOM 0 HG3 PRO B 13 3.369 24.620 -2.761 1.00 0.00 H new ATOM 0 HD2 PRO B 13 2.813 22.194 -1.076 1.00 0.00 H new ATOM 0 HD3 PRO B 13 1.888 22.842 -2.416 1.00 0.00 H new ATOM 1349 N VAL B 14 5.978 20.488 -2.082 1.00 0.00 N ATOM 1350 CA VAL B 14 6.985 19.476 -1.764 1.00 0.00 C ATOM 1351 C VAL B 14 7.128 18.454 -2.898 1.00 0.00 C ATOM 1352 O VAL B 14 8.204 17.889 -3.106 1.00 0.00 O ATOM 1353 CB VAL B 14 6.636 18.743 -0.445 1.00 0.00 C ATOM 1354 CG1 VAL B 14 7.719 17.741 -0.067 1.00 0.00 C ATOM 1355 CG2 VAL B 14 6.426 19.744 0.680 1.00 0.00 C ATOM 0 H VAL B 14 5.193 20.514 -1.432 1.00 0.00 H new ATOM 0 HA VAL B 14 7.936 19.995 -1.642 1.00 0.00 H new ATOM 0 HB VAL B 14 5.709 18.193 -0.604 1.00 0.00 H new ATOM 0 HG11 VAL B 14 7.445 17.243 0.863 1.00 0.00 H new ATOM 0 HG12 VAL B 14 7.821 17.000 -0.859 1.00 0.00 H new ATOM 0 HG13 VAL B 14 8.667 18.263 0.066 1.00 0.00 H new ATOM 0 HG21 VAL B 14 6.182 19.212 1.599 1.00 0.00 H new ATOM 0 HG22 VAL B 14 7.338 20.323 0.827 1.00 0.00 H new ATOM 0 HG23 VAL B 14 5.608 20.416 0.421 1.00 0.00 H new ATOM 1365 N CYS B 15 6.045 18.239 -3.646 1.00 0.00 N ATOM 1366 CA CYS B 15 6.060 17.297 -4.761 1.00 0.00 C ATOM 1367 C CYS B 15 7.080 17.737 -5.799 1.00 0.00 C ATOM 1368 O CYS B 15 7.857 16.931 -6.306 1.00 0.00 O ATOM 1369 CB CYS B 15 4.680 17.211 -5.417 1.00 0.00 C ATOM 1370 SG CYS B 15 3.311 17.043 -4.250 1.00 0.00 S ATOM 0 H CYS B 15 5.149 18.704 -3.499 1.00 0.00 H new ATOM 0 HA CYS B 15 6.330 16.315 -4.372 1.00 0.00 H new ATOM 0 HB2 CYS B 15 4.521 18.105 -6.020 1.00 0.00 H new ATOM 0 HB3 CYS B 15 4.667 16.361 -6.099 1.00 0.00 H new ATOM 0 HG CYS B 15 3.699 17.420 -3.068 1.00 0.00 H new ATOM 1376 N VAL B 16 7.084 19.034 -6.080 1.00 0.00 N ATOM 1377 CA VAL B 16 7.956 19.604 -7.094 1.00 0.00 C ATOM 1378 C VAL B 16 9.418 19.408 -6.713 1.00 0.00 C ATOM 1379 O VAL B 16 10.218 18.935 -7.517 1.00 0.00 O ATOM 1380 CB VAL B 16 7.678 21.108 -7.289 1.00 0.00 C ATOM 1381 CG1 VAL B 16 8.458 21.654 -8.476 1.00 0.00 C ATOM 1382 CG2 VAL B 16 6.187 21.362 -7.461 1.00 0.00 C ATOM 0 H VAL B 16 6.486 19.716 -5.613 1.00 0.00 H new ATOM 0 HA VAL B 16 7.751 19.085 -8.031 1.00 0.00 H new ATOM 0 HB VAL B 16 8.013 21.633 -6.394 1.00 0.00 H new ATOM 0 HG11 VAL B 16 8.245 22.717 -8.593 1.00 0.00 H new ATOM 0 HG12 VAL B 16 9.525 21.514 -8.305 1.00 0.00 H new ATOM 0 HG13 VAL B 16 8.163 21.123 -9.381 1.00 0.00 H new ATOM 0 HG21 VAL B 16 6.013 22.429 -7.597 1.00 0.00 H new ATOM 0 HG22 VAL B 16 5.824 20.821 -8.335 1.00 0.00 H new ATOM 0 HG23 VAL B 16 5.655 21.018 -6.574 1.00 0.00 H new ATOM 1392 N SER B 17 9.750 19.754 -5.477 1.00 0.00 N ATOM 1393 CA SER B 17 11.114 19.636 -4.980 1.00 0.00 C ATOM 1394 C SER B 17 11.619 18.197 -5.098 1.00 0.00 C ATOM 1395 O SER B 17 12.725 17.951 -5.591 1.00 0.00 O ATOM 1396 CB SER B 17 11.163 20.099 -3.527 1.00 0.00 C ATOM 1397 OG SER B 17 10.452 21.315 -3.370 1.00 0.00 O ATOM 0 H SER B 17 9.087 20.122 -4.795 1.00 0.00 H new ATOM 0 HA SER B 17 11.765 20.267 -5.585 1.00 0.00 H new ATOM 0 HB2 SER B 17 10.734 19.334 -2.880 1.00 0.00 H new ATOM 0 HB3 SER B 17 12.199 20.234 -3.217 1.00 0.00 H new ATOM 0 HG SER B 17 10.491 21.598 -2.433 1.00 0.00 H new ATOM 1403 N ALA B 18 10.793 17.251 -4.666 1.00 0.00 N ATOM 1404 CA ALA B 18 11.149 15.841 -4.718 1.00 0.00 C ATOM 1405 C ALA B 18 11.287 15.366 -6.161 1.00 0.00 C ATOM 1406 O ALA B 18 12.183 14.585 -6.488 1.00 0.00 O ATOM 1407 CB ALA B 18 10.109 15.010 -3.981 1.00 0.00 C ATOM 0 H ALA B 18 9.870 17.437 -4.275 1.00 0.00 H new ATOM 0 HA ALA B 18 12.114 15.713 -4.227 1.00 0.00 H new ATOM 0 HB1 ALA B 18 10.386 13.957 -4.027 1.00 0.00 H new ATOM 0 HB2 ALA B 18 10.061 15.328 -2.939 1.00 0.00 H new ATOM 0 HB3 ALA B 18 9.134 15.149 -4.448 1.00 0.00 H new ATOM 1413 N GLU B 19 10.404 15.855 -7.019 1.00 0.00 N ATOM 1414 CA GLU B 19 10.397 15.471 -8.424 1.00 0.00 C ATOM 1415 C GLU B 19 11.642 15.997 -9.139 1.00 0.00 C ATOM 1416 O GLU B 19 12.238 15.304 -9.963 1.00 0.00 O ATOM 1417 CB GLU B 19 9.137 16.010 -9.100 1.00 0.00 C ATOM 1418 CG GLU B 19 8.909 15.462 -10.496 1.00 0.00 C ATOM 1419 CD GLU B 19 7.787 16.176 -11.216 1.00 0.00 C ATOM 1420 OE1 GLU B 19 6.607 15.901 -10.919 1.00 0.00 O ATOM 1421 OE2 GLU B 19 8.083 17.028 -12.081 1.00 0.00 O ATOM 0 H GLU B 19 9.677 16.524 -6.764 1.00 0.00 H new ATOM 0 HA GLU B 19 10.403 14.383 -8.486 1.00 0.00 H new ATOM 0 HB2 GLU B 19 8.273 15.771 -8.480 1.00 0.00 H new ATOM 0 HB3 GLU B 19 9.201 17.097 -9.152 1.00 0.00 H new ATOM 0 HG2 GLU B 19 9.827 15.556 -11.075 1.00 0.00 H new ATOM 0 HG3 GLU B 19 8.679 14.398 -10.433 1.00 0.00 H new ATOM 1428 N GLN B 20 12.037 17.221 -8.816 1.00 0.00 N ATOM 1429 CA GLN B 20 13.200 17.835 -9.445 1.00 0.00 C ATOM 1430 C GLN B 20 14.481 17.091 -9.085 1.00 0.00 C ATOM 1431 O GLN B 20 15.230 16.667 -9.963 1.00 0.00 O ATOM 1432 CB GLN B 20 13.329 19.303 -9.032 1.00 0.00 C ATOM 1433 CG GLN B 20 12.166 20.172 -9.481 1.00 0.00 C ATOM 1434 CD GLN B 20 12.307 21.620 -9.050 1.00 0.00 C ATOM 1435 OE1 GLN B 20 12.991 21.854 -7.939 1.00 0.00 O flip ATOM 1436 NE2 GLN B 20 11.810 22.526 -9.716 1.00 0.00 N flip ATOM 0 H GLN B 20 11.571 17.808 -8.124 1.00 0.00 H new ATOM 0 HA GLN B 20 13.054 17.777 -10.524 1.00 0.00 H new ATOM 0 HB2 GLN B 20 13.414 19.359 -7.947 1.00 0.00 H new ATOM 0 HB3 GLN B 20 14.253 19.707 -9.446 1.00 0.00 H new ATOM 0 HG2 GLN B 20 12.085 20.128 -10.567 1.00 0.00 H new ATOM 0 HG3 GLN B 20 11.239 19.767 -9.076 1.00 0.00 H new ATOM 0 HE21 GLN B 20 11.290 22.308 -10.566 1.00 0.00 H new ATOM 0 HE22 GLN B 20 11.918 23.496 -9.419 1.00 0.00 H new ATOM 1445 N ALA B 21 14.721 16.922 -7.793 1.00 0.00 N ATOM 1446 CA ALA B 21 15.971 16.340 -7.327 1.00 0.00 C ATOM 1447 C ALA B 21 15.930 14.813 -7.328 1.00 0.00 C ATOM 1448 O ALA B 21 16.642 14.165 -8.094 1.00 0.00 O ATOM 1449 CB ALA B 21 16.296 16.861 -5.935 1.00 0.00 C ATOM 0 H ALA B 21 14.070 17.178 -7.051 1.00 0.00 H new ATOM 0 HA ALA B 21 16.756 16.641 -8.021 1.00 0.00 H new ATOM 0 HB1 ALA B 21 17.233 16.422 -5.592 1.00 0.00 H new ATOM 0 HB2 ALA B 21 16.394 17.946 -5.966 1.00 0.00 H new ATOM 0 HB3 ALA B 21 15.494 16.589 -5.248 1.00 0.00 H new ATOM 1455 N VAL B 22 15.074 14.247 -6.488 1.00 0.00 N ATOM 1456 CA VAL B 22 15.064 12.806 -6.248 1.00 0.00 C ATOM 1457 C VAL B 22 14.681 12.022 -7.505 1.00 0.00 C ATOM 1458 O VAL B 22 15.319 11.022 -7.837 1.00 0.00 O ATOM 1459 CB VAL B 22 14.099 12.435 -5.100 1.00 0.00 C ATOM 1460 CG1 VAL B 22 14.190 10.951 -4.771 1.00 0.00 C ATOM 1461 CG2 VAL B 22 14.386 13.280 -3.865 1.00 0.00 C ATOM 0 H VAL B 22 14.373 14.765 -5.958 1.00 0.00 H new ATOM 0 HA VAL B 22 16.080 12.532 -5.964 1.00 0.00 H new ATOM 0 HB VAL B 22 13.082 12.645 -5.430 1.00 0.00 H new ATOM 0 HG11 VAL B 22 13.501 10.715 -3.960 1.00 0.00 H new ATOM 0 HG12 VAL B 22 13.927 10.366 -5.652 1.00 0.00 H new ATOM 0 HG13 VAL B 22 15.208 10.708 -4.465 1.00 0.00 H new ATOM 0 HG21 VAL B 22 13.696 13.004 -3.067 1.00 0.00 H new ATOM 0 HG22 VAL B 22 15.410 13.106 -3.535 1.00 0.00 H new ATOM 0 HG23 VAL B 22 14.257 14.335 -4.108 1.00 0.00 H new ATOM 1471 N ALA B 23 13.663 12.494 -8.215 1.00 0.00 N ATOM 1472 CA ALA B 23 13.153 11.777 -9.383 1.00 0.00 C ATOM 1473 C ALA B 23 14.100 11.875 -10.580 1.00 0.00 C ATOM 1474 O ALA B 23 13.906 11.193 -11.586 1.00 0.00 O ATOM 1475 CB ALA B 23 11.766 12.280 -9.757 1.00 0.00 C ATOM 0 H ALA B 23 13.175 13.365 -8.006 1.00 0.00 H new ATOM 0 HA ALA B 23 13.086 10.724 -9.110 1.00 0.00 H new ATOM 0 HB1 ALA B 23 11.404 11.734 -10.628 1.00 0.00 H new ATOM 0 HB2 ALA B 23 11.084 12.123 -8.921 1.00 0.00 H new ATOM 0 HB3 ALA B 23 11.815 13.344 -9.990 1.00 0.00 H new ATOM 1481 N ASN B 24 15.112 12.732 -10.483 1.00 0.00 N ATOM 1482 CA ASN B 24 16.132 12.812 -11.527 1.00 0.00 C ATOM 1483 C ASN B 24 17.404 12.098 -11.093 1.00 0.00 C ATOM 1484 O ASN B 24 18.201 11.667 -11.927 1.00 0.00 O ATOM 1485 CB ASN B 24 16.435 14.264 -11.907 1.00 0.00 C ATOM 1486 CG ASN B 24 15.459 14.806 -12.934 1.00 0.00 C ATOM 1487 OD1 ASN B 24 15.654 14.638 -14.141 1.00 0.00 O ATOM 1488 ND2 ASN B 24 14.408 15.469 -12.473 1.00 0.00 N ATOM 0 H ASN B 24 15.249 13.374 -9.703 1.00 0.00 H new ATOM 0 HA ASN B 24 15.737 12.312 -12.411 1.00 0.00 H new ATOM 0 HB2 ASN B 24 16.401 14.886 -11.013 1.00 0.00 H new ATOM 0 HB3 ASN B 24 17.449 14.330 -12.302 1.00 0.00 H new ATOM 0 HD21 ASN B 24 13.727 15.861 -13.123 1.00 0.00 H new ATOM 0 HD22 ASN B 24 14.280 15.588 -11.468 1.00 0.00 H new ATOM 1495 N ALA B 25 17.596 11.979 -9.783 1.00 0.00 N ATOM 1496 CA ALA B 25 18.701 11.196 -9.247 1.00 0.00 C ATOM 1497 C ALA B 25 18.457 9.717 -9.509 1.00 0.00 C ATOM 1498 O ALA B 25 19.389 8.941 -9.736 1.00 0.00 O ATOM 1499 CB ALA B 25 18.874 11.457 -7.759 1.00 0.00 C ATOM 0 H ALA B 25 17.003 12.413 -9.076 1.00 0.00 H new ATOM 0 HA ALA B 25 19.621 11.496 -9.748 1.00 0.00 H new ATOM 0 HB1 ALA B 25 19.705 10.862 -7.379 1.00 0.00 H new ATOM 0 HB2 ALA B 25 19.081 12.515 -7.597 1.00 0.00 H new ATOM 0 HB3 ALA B 25 17.960 11.182 -7.233 1.00 0.00 H new ATOM 1505 N ILE B 26 17.192 9.331 -9.469 1.00 0.00 N ATOM 1506 CA ILE B 26 16.789 7.993 -9.851 1.00 0.00 C ATOM 1507 C ILE B 26 16.179 8.040 -11.246 1.00 0.00 C ATOM 1508 O ILE B 26 14.965 8.138 -11.407 1.00 0.00 O ATOM 1509 CB ILE B 26 15.782 7.385 -8.849 1.00 0.00 C ATOM 1510 CG1 ILE B 26 16.347 7.460 -7.426 1.00 0.00 C ATOM 1511 CG2 ILE B 26 15.466 5.940 -9.220 1.00 0.00 C ATOM 1512 CD1 ILE B 26 15.397 6.951 -6.363 1.00 0.00 C ATOM 0 H ILE B 26 16.423 9.933 -9.173 1.00 0.00 H new ATOM 0 HA ILE B 26 17.672 7.353 -9.847 1.00 0.00 H new ATOM 0 HB ILE B 26 14.857 7.960 -8.891 1.00 0.00 H new ATOM 0 HG12 ILE B 26 17.270 6.883 -7.381 1.00 0.00 H new ATOM 0 HG13 ILE B 26 16.607 8.495 -7.202 1.00 0.00 H new ATOM 0 HG21 ILE B 26 14.755 5.528 -8.504 1.00 0.00 H new ATOM 0 HG22 ILE B 26 15.034 5.907 -10.220 1.00 0.00 H new ATOM 0 HG23 ILE B 26 16.383 5.351 -9.202 1.00 0.00 H new ATOM 0 HD11 ILE B 26 15.868 7.036 -5.384 1.00 0.00 H new ATOM 0 HD12 ILE B 26 14.482 7.543 -6.379 1.00 0.00 H new ATOM 0 HD13 ILE B 26 15.156 5.906 -6.560 1.00 0.00 H new ATOM 1524 N ASP B 27 17.041 8.028 -12.249 1.00 0.00 N ATOM 1525 CA ASP B 27 16.614 8.148 -13.634 1.00 0.00 C ATOM 1526 C ASP B 27 16.062 6.822 -14.157 1.00 0.00 C ATOM 1527 O ASP B 27 16.442 5.746 -13.679 1.00 0.00 O ATOM 1528 CB ASP B 27 17.778 8.629 -14.504 1.00 0.00 C ATOM 1529 CG ASP B 27 18.947 7.669 -14.503 1.00 0.00 C ATOM 1530 OD1 ASP B 27 19.780 7.736 -13.575 1.00 0.00 O ATOM 1531 OD2 ASP B 27 19.041 6.849 -15.434 1.00 0.00 O ATOM 0 H ASP B 27 18.050 7.936 -12.128 1.00 0.00 H new ATOM 0 HA ASP B 27 15.812 8.884 -13.682 1.00 0.00 H new ATOM 0 HB2 ASP B 27 17.428 8.767 -15.527 1.00 0.00 H new ATOM 0 HB3 ASP B 27 18.113 9.603 -14.148 1.00 0.00 H new ATOM 1536 N PRO B 28 15.154 6.892 -15.152 1.00 0.00 N ATOM 1537 CA PRO B 28 14.452 5.720 -15.705 1.00 0.00 C ATOM 1538 C PRO B 28 15.369 4.688 -16.363 1.00 0.00 C ATOM 1539 O PRO B 28 14.922 3.591 -16.704 1.00 0.00 O ATOM 1540 CB PRO B 28 13.502 6.323 -16.749 1.00 0.00 C ATOM 1541 CG PRO B 28 13.382 7.759 -16.380 1.00 0.00 C ATOM 1542 CD PRO B 28 14.710 8.139 -15.798 1.00 0.00 C ATOM 0 HA PRO B 28 13.957 5.164 -14.909 1.00 0.00 H new ATOM 0 HB2 PRO B 28 13.899 6.207 -17.757 1.00 0.00 H new ATOM 0 HB3 PRO B 28 12.531 5.829 -16.730 1.00 0.00 H new ATOM 0 HG2 PRO B 28 13.147 8.369 -17.252 1.00 0.00 H new ATOM 0 HG3 PRO B 28 12.580 7.912 -15.658 1.00 0.00 H new ATOM 0 HD2 PRO B 28 15.409 8.467 -16.567 1.00 0.00 H new ATOM 0 HD3 PRO B 28 14.619 8.955 -15.081 1.00 0.00 H new ATOM 1550 N SER B 29 16.638 5.026 -16.555 1.00 0.00 N ATOM 1551 CA SER B 29 17.598 4.075 -17.101 1.00 0.00 C ATOM 1552 C SER B 29 17.903 3.008 -16.051 1.00 0.00 C ATOM 1553 O SER B 29 18.293 1.882 -16.370 1.00 0.00 O ATOM 1554 CB SER B 29 18.878 4.797 -17.542 1.00 0.00 C ATOM 1555 OG SER B 29 19.771 3.927 -18.223 1.00 0.00 O ATOM 0 H SER B 29 17.025 5.946 -16.342 1.00 0.00 H new ATOM 0 HA SER B 29 17.172 3.593 -17.981 1.00 0.00 H new ATOM 0 HB2 SER B 29 18.618 5.632 -18.193 1.00 0.00 H new ATOM 0 HB3 SER B 29 19.377 5.217 -16.669 1.00 0.00 H new ATOM 0 HG SER B 29 20.573 4.424 -18.489 1.00 0.00 H new ATOM 1561 N LYS B 30 17.704 3.378 -14.793 1.00 0.00 N ATOM 1562 CA LYS B 30 17.857 2.451 -13.685 1.00 0.00 C ATOM 1563 C LYS B 30 16.484 1.994 -13.209 1.00 0.00 C ATOM 1564 O LYS B 30 16.194 0.800 -13.165 1.00 0.00 O ATOM 1565 CB LYS B 30 18.612 3.121 -12.536 1.00 0.00 C ATOM 1566 CG LYS B 30 19.981 3.650 -12.933 1.00 0.00 C ATOM 1567 CD LYS B 30 20.619 4.449 -11.808 1.00 0.00 C ATOM 1568 CE LYS B 30 19.757 5.640 -11.420 1.00 0.00 C ATOM 1569 NZ LYS B 30 20.411 6.489 -10.392 1.00 0.00 N ATOM 0 H LYS B 30 17.434 4.322 -14.515 1.00 0.00 H new ATOM 0 HA LYS B 30 18.429 1.586 -14.021 1.00 0.00 H new ATOM 0 HB2 LYS B 30 18.012 3.945 -12.149 1.00 0.00 H new ATOM 0 HB3 LYS B 30 18.730 2.404 -11.723 1.00 0.00 H new ATOM 0 HG2 LYS B 30 20.630 2.817 -13.202 1.00 0.00 H new ATOM 0 HG3 LYS B 30 19.886 4.279 -13.818 1.00 0.00 H new ATOM 0 HD2 LYS B 30 20.767 3.806 -10.940 1.00 0.00 H new ATOM 0 HD3 LYS B 30 21.604 4.796 -12.119 1.00 0.00 H new ATOM 0 HE2 LYS B 30 19.548 6.240 -12.306 1.00 0.00 H new ATOM 0 HE3 LYS B 30 18.798 5.286 -11.041 1.00 0.00 H new ATOM 0 HZ1 LYS B 30 19.874 7.373 -10.279 1.00 0.00 H new ATOM 0 HZ2 LYS B 30 20.435 5.980 -9.485 1.00 0.00 H new ATOM 0 HZ3 LYS B 30 21.382 6.710 -10.691 1.00 0.00 H new ATOM 1583 N TYR B 31 15.640 2.962 -12.869 1.00 0.00 N ATOM 1584 CA TYR B 31 14.285 2.683 -12.411 1.00 0.00 C ATOM 1585 C TYR B 31 13.309 3.655 -13.060 1.00 0.00 C ATOM 1586 O TYR B 31 13.446 4.870 -12.914 1.00 0.00 O ATOM 1587 CB TYR B 31 14.184 2.802 -10.885 1.00 0.00 C ATOM 1588 CG TYR B 31 15.078 1.848 -10.123 1.00 0.00 C ATOM 1589 CD1 TYR B 31 14.735 0.509 -9.979 1.00 0.00 C ATOM 1590 CD2 TYR B 31 16.260 2.289 -9.543 1.00 0.00 C ATOM 1591 CE1 TYR B 31 15.548 -0.361 -9.277 1.00 0.00 C ATOM 1592 CE2 TYR B 31 17.076 1.425 -8.841 1.00 0.00 C ATOM 1593 CZ TYR B 31 16.716 0.101 -8.711 1.00 0.00 C ATOM 1594 OH TYR B 31 17.529 -0.761 -8.008 1.00 0.00 O ATOM 0 H TYR B 31 15.874 3.954 -12.903 1.00 0.00 H new ATOM 0 HA TYR B 31 14.034 1.662 -12.697 1.00 0.00 H new ATOM 0 HB2 TYR B 31 14.432 3.823 -10.595 1.00 0.00 H new ATOM 0 HB3 TYR B 31 13.150 2.628 -10.587 1.00 0.00 H new ATOM 0 HD1 TYR B 31 13.820 0.143 -10.422 1.00 0.00 H new ATOM 0 HD2 TYR B 31 16.546 3.326 -9.643 1.00 0.00 H new ATOM 0 HE1 TYR B 31 15.269 -1.399 -9.173 1.00 0.00 H new ATOM 0 HE2 TYR B 31 17.992 1.785 -8.396 1.00 0.00 H new ATOM 0 HH TYR B 31 18.312 -0.274 -7.676 1.00 0.00 H new ATOM 1604 N THR B 32 12.340 3.123 -13.788 1.00 0.00 N ATOM 1605 CA THR B 32 11.342 3.948 -14.453 1.00 0.00 C ATOM 1606 C THR B 32 10.428 4.614 -13.428 1.00 0.00 C ATOM 1607 O THR B 32 9.640 3.942 -12.764 1.00 0.00 O ATOM 1608 CB THR B 32 10.488 3.101 -15.419 1.00 0.00 C ATOM 1609 OG1 THR B 32 11.337 2.275 -16.226 1.00 0.00 O ATOM 1610 CG2 THR B 32 9.637 3.986 -16.318 1.00 0.00 C ATOM 0 H THR B 32 12.223 2.120 -13.934 1.00 0.00 H new ATOM 0 HA THR B 32 11.869 4.715 -15.020 1.00 0.00 H new ATOM 0 HB THR B 32 9.825 2.474 -14.823 1.00 0.00 H new ATOM 0 HG1 THR B 32 10.788 1.739 -16.836 1.00 0.00 H new ATOM 0 HG21 THR B 32 9.046 3.362 -16.988 1.00 0.00 H new ATOM 0 HG22 THR B 32 8.971 4.593 -15.705 1.00 0.00 H new ATOM 0 HG23 THR B 32 10.284 4.637 -16.905 1.00 0.00 H new ATOM 1618 N VAL B 33 10.536 5.923 -13.287 1.00 0.00 N ATOM 1619 CA VAL B 33 9.735 6.648 -12.314 1.00 0.00 C ATOM 1620 C VAL B 33 8.335 6.903 -12.856 1.00 0.00 C ATOM 1621 O VAL B 33 8.166 7.556 -13.887 1.00 0.00 O ATOM 1622 CB VAL B 33 10.386 7.990 -11.921 1.00 0.00 C ATOM 1623 CG1 VAL B 33 9.582 8.685 -10.832 1.00 0.00 C ATOM 1624 CG2 VAL B 33 11.822 7.777 -11.473 1.00 0.00 C ATOM 0 H VAL B 33 11.170 6.506 -13.833 1.00 0.00 H new ATOM 0 HA VAL B 33 9.673 6.024 -11.422 1.00 0.00 H new ATOM 0 HB VAL B 33 10.392 8.634 -12.800 1.00 0.00 H new ATOM 0 HG11 VAL B 33 10.061 9.629 -10.572 1.00 0.00 H new ATOM 0 HG12 VAL B 33 8.572 8.878 -11.193 1.00 0.00 H new ATOM 0 HG13 VAL B 33 9.536 8.046 -9.950 1.00 0.00 H new ATOM 0 HG21 VAL B 33 12.264 8.735 -11.200 1.00 0.00 H new ATOM 0 HG22 VAL B 33 11.839 7.111 -10.611 1.00 0.00 H new ATOM 0 HG23 VAL B 33 12.395 7.332 -12.287 1.00 0.00 H new ATOM 1634 N GLU B 34 7.339 6.377 -12.163 1.00 0.00 N ATOM 1635 CA GLU B 34 5.952 6.540 -12.551 1.00 0.00 C ATOM 1636 C GLU B 34 5.288 7.595 -11.670 1.00 0.00 C ATOM 1637 O GLU B 34 5.100 7.384 -10.470 1.00 0.00 O ATOM 1638 CB GLU B 34 5.220 5.197 -12.450 1.00 0.00 C ATOM 1639 CG GLU B 34 3.763 5.245 -12.879 1.00 0.00 C ATOM 1640 CD GLU B 34 3.162 3.864 -13.043 1.00 0.00 C ATOM 1641 OE1 GLU B 34 2.812 3.225 -12.028 1.00 0.00 O ATOM 1642 OE2 GLU B 34 3.039 3.400 -14.194 1.00 0.00 O ATOM 0 H GLU B 34 7.471 5.825 -11.316 1.00 0.00 H new ATOM 0 HA GLU B 34 5.902 6.878 -13.586 1.00 0.00 H new ATOM 0 HB2 GLU B 34 5.743 4.464 -13.064 1.00 0.00 H new ATOM 0 HB3 GLU B 34 5.272 4.845 -11.420 1.00 0.00 H new ATOM 0 HG2 GLU B 34 3.188 5.803 -12.140 1.00 0.00 H new ATOM 0 HG3 GLU B 34 3.682 5.787 -13.821 1.00 0.00 H new ATOM 1649 N ILE B 35 4.970 8.734 -12.267 1.00 0.00 N ATOM 1650 CA ILE B 35 4.372 9.848 -11.539 1.00 0.00 C ATOM 1651 C ILE B 35 2.868 9.643 -11.368 1.00 0.00 C ATOM 1652 O ILE B 35 2.111 9.690 -12.337 1.00 0.00 O ATOM 1653 CB ILE B 35 4.624 11.189 -12.270 1.00 0.00 C ATOM 1654 CG1 ILE B 35 6.127 11.423 -12.469 1.00 0.00 C ATOM 1655 CG2 ILE B 35 4.001 12.348 -11.503 1.00 0.00 C ATOM 1656 CD1 ILE B 35 6.915 11.493 -11.178 1.00 0.00 C ATOM 0 H ILE B 35 5.117 8.913 -13.260 1.00 0.00 H new ATOM 0 HA ILE B 35 4.843 9.884 -10.557 1.00 0.00 H new ATOM 0 HB ILE B 35 4.151 11.134 -13.251 1.00 0.00 H new ATOM 0 HG12 ILE B 35 6.531 10.620 -13.086 1.00 0.00 H new ATOM 0 HG13 ILE B 35 6.270 12.352 -13.021 1.00 0.00 H new ATOM 0 HG21 ILE B 35 4.191 13.280 -12.035 1.00 0.00 H new ATOM 0 HG22 ILE B 35 2.926 12.191 -11.417 1.00 0.00 H new ATOM 0 HG23 ILE B 35 4.440 12.403 -10.507 1.00 0.00 H new ATOM 0 HD11 ILE B 35 7.968 11.660 -11.403 1.00 0.00 H new ATOM 0 HD12 ILE B 35 6.540 12.314 -10.567 1.00 0.00 H new ATOM 0 HD13 ILE B 35 6.805 10.555 -10.633 1.00 0.00 H new ATOM 1668 N VAL B 36 2.444 9.412 -10.133 1.00 0.00 N ATOM 1669 CA VAL B 36 1.035 9.204 -9.830 1.00 0.00 C ATOM 1670 C VAL B 36 0.478 10.387 -9.045 1.00 0.00 C ATOM 1671 O VAL B 36 0.869 10.630 -7.901 1.00 0.00 O ATOM 1672 CB VAL B 36 0.813 7.904 -9.027 1.00 0.00 C ATOM 1673 CG1 VAL B 36 -0.668 7.685 -8.757 1.00 0.00 C ATOM 1674 CG2 VAL B 36 1.404 6.709 -9.762 1.00 0.00 C ATOM 0 H VAL B 36 3.059 9.364 -9.321 1.00 0.00 H new ATOM 0 HA VAL B 36 0.508 9.116 -10.780 1.00 0.00 H new ATOM 0 HB VAL B 36 1.325 8.005 -8.070 1.00 0.00 H new ATOM 0 HG11 VAL B 36 -0.802 6.764 -8.190 1.00 0.00 H new ATOM 0 HG12 VAL B 36 -1.061 8.524 -8.184 1.00 0.00 H new ATOM 0 HG13 VAL B 36 -1.203 7.610 -9.704 1.00 0.00 H new ATOM 0 HG21 VAL B 36 1.236 5.804 -9.179 1.00 0.00 H new ATOM 0 HG22 VAL B 36 0.925 6.607 -10.736 1.00 0.00 H new ATOM 0 HG23 VAL B 36 2.475 6.859 -9.899 1.00 0.00 H new ATOM 1684 N HIS B 37 -0.427 11.122 -9.670 1.00 0.00 N ATOM 1685 CA HIS B 37 -1.024 12.296 -9.052 1.00 0.00 C ATOM 1686 C HIS B 37 -2.406 11.964 -8.499 1.00 0.00 C ATOM 1687 O HIS B 37 -3.349 11.721 -9.257 1.00 0.00 O ATOM 1688 CB HIS B 37 -1.113 13.431 -10.077 1.00 0.00 C ATOM 1689 CG HIS B 37 -1.636 14.727 -9.534 1.00 0.00 C ATOM 1690 ND1 HIS B 37 -1.413 15.111 -8.231 1.00 0.00 N ATOM 1691 CD2 HIS B 37 -2.349 15.691 -10.161 1.00 0.00 C ATOM 1692 CE1 HIS B 37 -1.989 16.294 -8.102 1.00 0.00 C ATOM 1693 NE2 HIS B 37 -2.568 16.682 -9.243 1.00 0.00 N ATOM 0 H HIS B 37 -0.767 10.925 -10.611 1.00 0.00 H new ATOM 0 HA HIS B 37 -0.395 12.618 -8.222 1.00 0.00 H new ATOM 0 HB2 HIS B 37 -0.121 13.602 -10.496 1.00 0.00 H new ATOM 0 HB3 HIS B 37 -1.755 13.111 -10.898 1.00 0.00 H new ATOM 0 HD2 HIS B 37 -2.681 15.680 -11.189 1.00 0.00 H new ATOM 0 HE1 HIS B 37 -1.992 16.873 -7.191 1.00 0.00 H new ATOM 0 HE2 HIS B 37 -3.077 17.552 -9.400 1.00 0.00 H new ATOM 1701 N LEU B 38 -2.524 11.962 -7.177 1.00 0.00 N ATOM 1702 CA LEU B 38 -3.794 11.656 -6.524 1.00 0.00 C ATOM 1703 C LEU B 38 -4.775 12.812 -6.688 1.00 0.00 C ATOM 1704 O LEU B 38 -5.973 12.671 -6.435 1.00 0.00 O ATOM 1705 CB LEU B 38 -3.580 11.347 -5.040 1.00 0.00 C ATOM 1706 CG LEU B 38 -2.733 10.106 -4.749 1.00 0.00 C ATOM 1707 CD1 LEU B 38 -2.630 9.872 -3.251 1.00 0.00 C ATOM 1708 CD2 LEU B 38 -3.320 8.882 -5.437 1.00 0.00 C ATOM 0 H LEU B 38 -1.758 12.168 -6.536 1.00 0.00 H new ATOM 0 HA LEU B 38 -4.216 10.772 -7.003 1.00 0.00 H new ATOM 0 HB2 LEU B 38 -3.106 12.209 -4.570 1.00 0.00 H new ATOM 0 HB3 LEU B 38 -4.554 11.222 -4.567 1.00 0.00 H new ATOM 0 HG LEU B 38 -1.731 10.275 -5.144 1.00 0.00 H new ATOM 0 HD11 LEU B 38 -2.024 8.986 -3.062 1.00 0.00 H new ATOM 0 HD12 LEU B 38 -2.164 10.737 -2.779 1.00 0.00 H new ATOM 0 HD13 LEU B 38 -3.627 9.725 -2.836 1.00 0.00 H new ATOM 0 HD21 LEU B 38 -2.703 8.010 -5.218 1.00 0.00 H new ATOM 0 HD22 LEU B 38 -4.333 8.711 -5.073 1.00 0.00 H new ATOM 0 HD23 LEU B 38 -3.345 9.047 -6.514 1.00 0.00 H new ATOM 1720 N GLY B 39 -4.257 13.955 -7.120 1.00 0.00 N ATOM 1721 CA GLY B 39 -5.105 15.096 -7.397 1.00 0.00 C ATOM 1722 C GLY B 39 -5.968 14.864 -8.619 1.00 0.00 C ATOM 1723 O GLY B 39 -7.048 15.439 -8.745 1.00 0.00 O ATOM 0 H GLY B 39 -3.262 14.111 -7.283 1.00 0.00 H new ATOM 0 HA2 GLY B 39 -5.741 15.296 -6.534 1.00 0.00 H new ATOM 0 HA3 GLY B 39 -4.487 15.981 -7.550 1.00 0.00 H new ATOM 1727 N THR B 40 -5.493 14.011 -9.517 1.00 0.00 N ATOM 1728 CA THR B 40 -6.244 13.662 -10.709 1.00 0.00 C ATOM 1729 C THR B 40 -7.204 12.510 -10.421 1.00 0.00 C ATOM 1730 O THR B 40 -8.392 12.586 -10.734 1.00 0.00 O ATOM 1731 CB THR B 40 -5.302 13.259 -11.860 1.00 0.00 C ATOM 1732 OG1 THR B 40 -4.305 14.271 -12.054 1.00 0.00 O ATOM 1733 CG2 THR B 40 -6.074 13.054 -13.155 1.00 0.00 C ATOM 0 H THR B 40 -4.587 13.548 -9.439 1.00 0.00 H new ATOM 0 HA THR B 40 -6.812 14.543 -11.008 1.00 0.00 H new ATOM 0 HB THR B 40 -4.823 12.318 -11.589 1.00 0.00 H new ATOM 0 HG1 THR B 40 -3.709 14.007 -12.786 1.00 0.00 H new ATOM 0 HG21 THR B 40 -5.383 12.770 -13.949 1.00 0.00 H new ATOM 0 HG22 THR B 40 -6.813 12.264 -13.017 1.00 0.00 H new ATOM 0 HG23 THR B 40 -6.580 13.980 -13.428 1.00 0.00 H new ATOM 1741 N ASP B 41 -6.685 11.453 -9.808 1.00 0.00 N ATOM 1742 CA ASP B 41 -7.483 10.264 -9.535 1.00 0.00 C ATOM 1743 C ASP B 41 -7.597 10.036 -8.032 1.00 0.00 C ATOM 1744 O ASP B 41 -6.623 9.673 -7.372 1.00 0.00 O ATOM 1745 CB ASP B 41 -6.859 9.044 -10.216 1.00 0.00 C ATOM 1746 CG ASP B 41 -7.759 7.826 -10.175 1.00 0.00 C ATOM 1747 OD1 ASP B 41 -8.807 7.837 -10.852 1.00 0.00 O ATOM 1748 OD2 ASP B 41 -7.415 6.847 -9.486 1.00 0.00 O ATOM 0 H ASP B 41 -5.717 11.395 -9.491 1.00 0.00 H new ATOM 0 HA ASP B 41 -8.485 10.413 -9.937 1.00 0.00 H new ATOM 0 HB2 ASP B 41 -6.633 9.289 -11.254 1.00 0.00 H new ATOM 0 HB3 ASP B 41 -5.912 8.807 -9.731 1.00 0.00 H new ATOM 1753 N LYS B 42 -8.790 10.254 -7.497 1.00 0.00 N ATOM 1754 CA LYS B 42 -9.006 10.204 -6.057 1.00 0.00 C ATOM 1755 C LYS B 42 -9.293 8.777 -5.599 1.00 0.00 C ATOM 1756 O LYS B 42 -9.049 8.419 -4.446 1.00 0.00 O ATOM 1757 CB LYS B 42 -10.161 11.128 -5.667 1.00 0.00 C ATOM 1758 CG LYS B 42 -10.303 11.330 -4.168 1.00 0.00 C ATOM 1759 CD LYS B 42 -11.407 12.319 -3.841 1.00 0.00 C ATOM 1760 CE LYS B 42 -11.444 12.628 -2.355 1.00 0.00 C ATOM 1761 NZ LYS B 42 -12.460 13.660 -2.026 1.00 0.00 N ATOM 0 H LYS B 42 -9.626 10.468 -8.040 1.00 0.00 H new ATOM 0 HA LYS B 42 -8.097 10.544 -5.561 1.00 0.00 H new ATOM 0 HB2 LYS B 42 -10.015 12.098 -6.143 1.00 0.00 H new ATOM 0 HB3 LYS B 42 -11.091 10.717 -6.059 1.00 0.00 H new ATOM 0 HG2 LYS B 42 -10.516 10.374 -3.690 1.00 0.00 H new ATOM 0 HG3 LYS B 42 -9.359 11.688 -3.757 1.00 0.00 H new ATOM 0 HD2 LYS B 42 -11.252 13.240 -4.403 1.00 0.00 H new ATOM 0 HD3 LYS B 42 -12.368 11.912 -4.155 1.00 0.00 H new ATOM 0 HE2 LYS B 42 -11.662 11.715 -1.800 1.00 0.00 H new ATOM 0 HE3 LYS B 42 -10.461 12.971 -2.032 1.00 0.00 H new ATOM 0 HZ1 LYS B 42 -12.452 13.841 -1.002 1.00 0.00 H new ATOM 0 HZ2 LYS B 42 -12.239 14.540 -2.535 1.00 0.00 H new ATOM 0 HZ3 LYS B 42 -13.402 13.323 -2.311 1.00 0.00 H new ATOM 1775 N ALA B 43 -9.791 7.956 -6.511 1.00 0.00 N ATOM 1776 CA ALA B 43 -10.105 6.565 -6.201 1.00 0.00 C ATOM 1777 C ALA B 43 -8.834 5.722 -6.101 1.00 0.00 C ATOM 1778 O ALA B 43 -8.892 4.508 -5.901 1.00 0.00 O ATOM 1779 CB ALA B 43 -11.043 5.990 -7.249 1.00 0.00 C ATOM 0 H ALA B 43 -9.988 8.227 -7.474 1.00 0.00 H new ATOM 0 HA ALA B 43 -10.603 6.538 -5.232 1.00 0.00 H new ATOM 0 HB1 ALA B 43 -11.269 4.952 -7.005 1.00 0.00 H new ATOM 0 HB2 ALA B 43 -11.967 6.568 -7.266 1.00 0.00 H new ATOM 0 HB3 ALA B 43 -10.567 6.037 -8.228 1.00 0.00 H new ATOM 1785 N ARG B 44 -7.687 6.373 -6.226 1.00 0.00 N ATOM 1786 CA ARG B 44 -6.409 5.680 -6.199 1.00 0.00 C ATOM 1787 C ARG B 44 -5.843 5.640 -4.782 1.00 0.00 C ATOM 1788 O ARG B 44 -4.775 5.079 -4.542 1.00 0.00 O ATOM 1789 CB ARG B 44 -5.435 6.361 -7.153 1.00 0.00 C ATOM 1790 CG ARG B 44 -4.278 5.478 -7.573 1.00 0.00 C ATOM 1791 CD ARG B 44 -3.837 5.799 -8.987 1.00 0.00 C ATOM 1792 NE ARG B 44 -4.956 5.711 -9.925 1.00 0.00 N ATOM 1793 CZ ARG B 44 -4.896 5.107 -11.110 1.00 0.00 C ATOM 1794 NH1 ARG B 44 -3.775 4.518 -11.511 1.00 0.00 N ATOM 1795 NH2 ARG B 44 -5.968 5.080 -11.889 1.00 0.00 N ATOM 0 H ARG B 44 -7.616 7.383 -6.347 1.00 0.00 H new ATOM 0 HA ARG B 44 -6.559 4.651 -6.525 1.00 0.00 H new ATOM 0 HB2 ARG B 44 -5.976 6.683 -8.042 1.00 0.00 H new ATOM 0 HB3 ARG B 44 -5.041 7.259 -6.677 1.00 0.00 H new ATOM 0 HG2 ARG B 44 -3.442 5.616 -6.887 1.00 0.00 H new ATOM 0 HG3 ARG B 44 -4.573 4.431 -7.509 1.00 0.00 H new ATOM 0 HD2 ARG B 44 -3.411 6.802 -9.019 1.00 0.00 H new ATOM 0 HD3 ARG B 44 -3.050 5.109 -9.290 1.00 0.00 H new ATOM 0 HE ARG B 44 -5.840 6.141 -9.653 1.00 0.00 H new ATOM 0 HH11 ARG B 44 -2.951 4.526 -10.909 1.00 0.00 H new ATOM 0 HH12 ARG B 44 -3.738 4.058 -12.420 1.00 0.00 H new ATOM 0 HH21 ARG B 44 -6.834 5.521 -11.580 1.00 0.00 H new ATOM 0 HH22 ARG B 44 -5.927 4.618 -12.798 1.00 0.00 H new ATOM 1809 N ILE B 45 -6.574 6.231 -3.840 1.00 0.00 N ATOM 1810 CA ILE B 45 -6.190 6.181 -2.431 1.00 0.00 C ATOM 1811 C ILE B 45 -6.094 4.730 -1.964 1.00 0.00 C ATOM 1812 O ILE B 45 -5.146 4.348 -1.279 1.00 0.00 O ATOM 1813 CB ILE B 45 -7.195 6.951 -1.542 1.00 0.00 C ATOM 1814 CG1 ILE B 45 -7.172 8.444 -1.888 1.00 0.00 C ATOM 1815 CG2 ILE B 45 -6.884 6.741 -0.064 1.00 0.00 C ATOM 1816 CD1 ILE B 45 -8.164 9.271 -1.096 1.00 0.00 C ATOM 0 H ILE B 45 -7.433 6.749 -4.026 1.00 0.00 H new ATOM 0 HA ILE B 45 -5.216 6.660 -2.335 1.00 0.00 H new ATOM 0 HB ILE B 45 -8.194 6.561 -1.736 1.00 0.00 H new ATOM 0 HG12 ILE B 45 -6.169 8.832 -1.714 1.00 0.00 H new ATOM 0 HG13 ILE B 45 -7.380 8.564 -2.951 1.00 0.00 H new ATOM 0 HG21 ILE B 45 -7.604 7.292 0.541 1.00 0.00 H new ATOM 0 HG22 ILE B 45 -6.947 5.679 0.174 1.00 0.00 H new ATOM 0 HG23 ILE B 45 -5.878 7.101 0.151 1.00 0.00 H new ATOM 0 HD11 ILE B 45 -8.088 10.316 -1.396 1.00 0.00 H new ATOM 0 HD12 ILE B 45 -9.174 8.910 -1.289 1.00 0.00 H new ATOM 0 HD13 ILE B 45 -7.944 9.183 -0.032 1.00 0.00 H new ATOM 1828 N ALA B 46 -7.063 3.919 -2.380 1.00 0.00 N ATOM 1829 CA ALA B 46 -7.101 2.507 -2.015 1.00 0.00 C ATOM 1830 C ALA B 46 -5.879 1.764 -2.549 1.00 0.00 C ATOM 1831 O ALA B 46 -5.389 0.820 -1.926 1.00 0.00 O ATOM 1832 CB ALA B 46 -8.380 1.868 -2.530 1.00 0.00 C ATOM 0 H ALA B 46 -7.836 4.219 -2.974 1.00 0.00 H new ATOM 0 HA ALA B 46 -7.083 2.437 -0.927 1.00 0.00 H new ATOM 0 HB1 ALA B 46 -8.398 0.814 -2.252 1.00 0.00 H new ATOM 0 HB2 ALA B 46 -9.241 2.373 -2.092 1.00 0.00 H new ATOM 0 HB3 ALA B 46 -8.420 1.957 -3.616 1.00 0.00 H new ATOM 1838 N GLU B 47 -5.389 2.198 -3.706 1.00 0.00 N ATOM 1839 CA GLU B 47 -4.194 1.611 -4.296 1.00 0.00 C ATOM 1840 C GLU B 47 -2.969 1.996 -3.479 1.00 0.00 C ATOM 1841 O GLU B 47 -2.133 1.149 -3.157 1.00 0.00 O ATOM 1842 CB GLU B 47 -4.020 2.074 -5.744 1.00 0.00 C ATOM 1843 CG GLU B 47 -2.724 1.592 -6.377 1.00 0.00 C ATOM 1844 CD GLU B 47 -2.564 2.043 -7.811 1.00 0.00 C ATOM 1845 OE1 GLU B 47 -2.088 3.176 -8.035 1.00 0.00 O ATOM 1846 OE2 GLU B 47 -2.897 1.255 -8.723 1.00 0.00 O ATOM 0 H GLU B 47 -5.802 2.954 -4.252 1.00 0.00 H new ATOM 0 HA GLU B 47 -4.305 0.527 -4.291 1.00 0.00 H new ATOM 0 HB2 GLU B 47 -4.861 1.715 -6.337 1.00 0.00 H new ATOM 0 HB3 GLU B 47 -4.049 3.163 -5.776 1.00 0.00 H new ATOM 0 HG2 GLU B 47 -1.881 1.958 -5.791 1.00 0.00 H new ATOM 0 HG3 GLU B 47 -2.690 0.503 -6.338 1.00 0.00 H new ATOM 1853 N ALA B 48 -2.889 3.277 -3.135 1.00 0.00 N ATOM 1854 CA ALA B 48 -1.771 3.805 -2.362 1.00 0.00 C ATOM 1855 C ALA B 48 -1.614 3.059 -1.042 1.00 0.00 C ATOM 1856 O ALA B 48 -0.500 2.700 -0.656 1.00 0.00 O ATOM 1857 CB ALA B 48 -1.958 5.293 -2.113 1.00 0.00 C ATOM 0 H ALA B 48 -3.592 3.974 -3.382 1.00 0.00 H new ATOM 0 HA ALA B 48 -0.859 3.657 -2.941 1.00 0.00 H new ATOM 0 HB1 ALA B 48 -1.116 5.674 -1.535 1.00 0.00 H new ATOM 0 HB2 ALA B 48 -2.010 5.818 -3.067 1.00 0.00 H new ATOM 0 HB3 ALA B 48 -2.882 5.456 -1.558 1.00 0.00 H new ATOM 1863 N GLU B 49 -2.737 2.813 -0.368 1.00 0.00 N ATOM 1864 CA GLU B 49 -2.736 2.080 0.896 1.00 0.00 C ATOM 1865 C GLU B 49 -2.020 0.742 0.751 1.00 0.00 C ATOM 1866 O GLU B 49 -1.108 0.427 1.515 1.00 0.00 O ATOM 1867 CB GLU B 49 -4.164 1.816 1.373 1.00 0.00 C ATOM 1868 CG GLU B 49 -4.995 3.062 1.613 1.00 0.00 C ATOM 1869 CD GLU B 49 -6.380 2.718 2.121 1.00 0.00 C ATOM 1870 OE1 GLU B 49 -7.145 2.069 1.375 1.00 0.00 O ATOM 1871 OE2 GLU B 49 -6.698 3.061 3.278 1.00 0.00 O ATOM 0 H GLU B 49 -3.662 3.112 -0.678 1.00 0.00 H new ATOM 0 HA GLU B 49 -2.212 2.698 1.626 1.00 0.00 H new ATOM 0 HB2 GLU B 49 -4.670 1.196 0.633 1.00 0.00 H new ATOM 0 HB3 GLU B 49 -4.123 1.240 2.298 1.00 0.00 H new ATOM 0 HG2 GLU B 49 -4.490 3.703 2.336 1.00 0.00 H new ATOM 0 HG3 GLU B 49 -5.077 3.630 0.686 1.00 0.00 H new ATOM 1878 N LYS B 50 -2.428 -0.028 -0.250 1.00 0.00 N ATOM 1879 CA LYS B 50 -1.908 -1.377 -0.448 1.00 0.00 C ATOM 1880 C LYS B 50 -0.468 -1.351 -0.954 1.00 0.00 C ATOM 1881 O LYS B 50 0.276 -2.321 -0.793 1.00 0.00 O ATOM 1882 CB LYS B 50 -2.806 -2.142 -1.421 1.00 0.00 C ATOM 1883 CG LYS B 50 -4.242 -2.263 -0.939 1.00 0.00 C ATOM 1884 CD LYS B 50 -5.113 -3.015 -1.931 1.00 0.00 C ATOM 1885 CE LYS B 50 -6.554 -3.103 -1.450 1.00 0.00 C ATOM 1886 NZ LYS B 50 -7.181 -1.759 -1.317 1.00 0.00 N ATOM 0 H LYS B 50 -3.121 0.260 -0.941 1.00 0.00 H new ATOM 0 HA LYS B 50 -1.908 -1.888 0.515 1.00 0.00 H new ATOM 0 HB2 LYS B 50 -2.795 -1.639 -2.388 1.00 0.00 H new ATOM 0 HB3 LYS B 50 -2.396 -3.140 -1.576 1.00 0.00 H new ATOM 0 HG2 LYS B 50 -4.260 -2.777 0.022 1.00 0.00 H new ATOM 0 HG3 LYS B 50 -4.655 -1.268 -0.776 1.00 0.00 H new ATOM 0 HD2 LYS B 50 -5.081 -2.514 -2.898 1.00 0.00 H new ATOM 0 HD3 LYS B 50 -4.715 -4.019 -2.079 1.00 0.00 H new ATOM 0 HE2 LYS B 50 -7.133 -3.706 -2.149 1.00 0.00 H new ATOM 0 HE3 LYS B 50 -6.584 -3.614 -0.488 1.00 0.00 H new ATOM 0 HZ1 LYS B 50 -7.370 -1.562 -0.314 1.00 0.00 H new ATOM 0 HZ2 LYS B 50 -6.536 -1.036 -1.696 1.00 0.00 H new ATOM 0 HZ3 LYS B 50 -8.075 -1.739 -1.848 1.00 0.00 H new ATOM 1900 N ALA B 51 -0.077 -0.240 -1.563 1.00 0.00 N ATOM 1901 CA ALA B 51 1.289 -0.071 -2.039 1.00 0.00 C ATOM 1902 C ALA B 51 2.229 0.226 -0.876 1.00 0.00 C ATOM 1903 O ALA B 51 3.432 -0.023 -0.954 1.00 0.00 O ATOM 1904 CB ALA B 51 1.356 1.039 -3.079 1.00 0.00 C ATOM 0 H ALA B 51 -0.687 0.558 -1.739 1.00 0.00 H new ATOM 0 HA ALA B 51 1.609 -1.002 -2.508 1.00 0.00 H new ATOM 0 HB1 ALA B 51 2.384 1.152 -3.424 1.00 0.00 H new ATOM 0 HB2 ALA B 51 0.715 0.785 -3.924 1.00 0.00 H new ATOM 0 HB3 ALA B 51 1.017 1.975 -2.635 1.00 0.00 H new ATOM 1910 N GLY B 52 1.666 0.740 0.210 1.00 0.00 N ATOM 1911 CA GLY B 52 2.462 1.085 1.373 1.00 0.00 C ATOM 1912 C GLY B 52 2.617 2.582 1.522 1.00 0.00 C ATOM 1913 O GLY B 52 3.368 3.061 2.371 1.00 0.00 O ATOM 0 H GLY B 52 0.668 0.925 0.307 1.00 0.00 H new ATOM 0 HA2 GLY B 52 1.993 0.677 2.269 1.00 0.00 H new ATOM 0 HA3 GLY B 52 3.446 0.624 1.290 1.00 0.00 H new ATOM 1917 N VAL B 53 1.893 3.320 0.696 1.00 0.00 N ATOM 1918 CA VAL B 53 1.969 4.770 0.690 1.00 0.00 C ATOM 1919 C VAL B 53 1.114 5.355 1.807 1.00 0.00 C ATOM 1920 O VAL B 53 -0.114 5.373 1.724 1.00 0.00 O ATOM 1921 CB VAL B 53 1.513 5.344 -0.666 1.00 0.00 C ATOM 1922 CG1 VAL B 53 1.653 6.858 -0.697 1.00 0.00 C ATOM 1923 CG2 VAL B 53 2.300 4.710 -1.799 1.00 0.00 C ATOM 0 H VAL B 53 1.240 2.933 0.015 1.00 0.00 H new ATOM 0 HA VAL B 53 3.010 5.047 0.853 1.00 0.00 H new ATOM 0 HB VAL B 53 0.458 5.105 -0.798 1.00 0.00 H new ATOM 0 HG11 VAL B 53 1.324 7.234 -1.666 1.00 0.00 H new ATOM 0 HG12 VAL B 53 1.039 7.296 0.090 1.00 0.00 H new ATOM 0 HG13 VAL B 53 2.696 7.130 -0.538 1.00 0.00 H new ATOM 0 HG21 VAL B 53 1.967 5.125 -2.750 1.00 0.00 H new ATOM 0 HG22 VAL B 53 3.362 4.917 -1.665 1.00 0.00 H new ATOM 0 HG23 VAL B 53 2.137 3.632 -1.797 1.00 0.00 H new ATOM 1933 N LYS B 54 1.775 5.816 2.856 1.00 0.00 N ATOM 1934 CA LYS B 54 1.091 6.409 3.996 1.00 0.00 C ATOM 1935 C LYS B 54 0.996 7.918 3.829 1.00 0.00 C ATOM 1936 O LYS B 54 0.223 8.588 4.517 1.00 0.00 O ATOM 1937 CB LYS B 54 1.835 6.080 5.289 1.00 0.00 C ATOM 1938 CG LYS B 54 1.916 4.593 5.588 1.00 0.00 C ATOM 1939 CD LYS B 54 2.821 4.320 6.775 1.00 0.00 C ATOM 1940 CE LYS B 54 2.847 2.844 7.130 1.00 0.00 C ATOM 1941 NZ LYS B 54 3.817 2.556 8.218 1.00 0.00 N ATOM 0 H LYS B 54 2.791 5.791 2.943 1.00 0.00 H new ATOM 0 HA LYS B 54 0.085 5.994 4.048 1.00 0.00 H new ATOM 0 HB2 LYS B 54 2.845 6.485 5.229 1.00 0.00 H new ATOM 0 HB3 LYS B 54 1.340 6.582 6.120 1.00 0.00 H new ATOM 0 HG2 LYS B 54 0.918 4.206 5.792 1.00 0.00 H new ATOM 0 HG3 LYS B 54 2.291 4.063 4.712 1.00 0.00 H new ATOM 0 HD2 LYS B 54 3.832 4.658 6.548 1.00 0.00 H new ATOM 0 HD3 LYS B 54 2.478 4.896 7.635 1.00 0.00 H new ATOM 0 HE2 LYS B 54 1.851 2.526 7.438 1.00 0.00 H new ATOM 0 HE3 LYS B 54 3.108 2.262 6.246 1.00 0.00 H new ATOM 0 HZ1 LYS B 54 3.806 1.538 8.432 1.00 0.00 H new ATOM 0 HZ2 LYS B 54 4.772 2.836 7.915 1.00 0.00 H new ATOM 0 HZ3 LYS B 54 3.553 3.092 9.069 1.00 0.00 H new ATOM 1955 N SER B 55 1.808 8.457 2.934 1.00 0.00 N ATOM 1956 CA SER B 55 1.803 9.883 2.664 1.00 0.00 C ATOM 1957 C SER B 55 2.230 10.162 1.226 1.00 0.00 C ATOM 1958 O SER B 55 2.983 9.390 0.637 1.00 0.00 O ATOM 1959 CB SER B 55 2.746 10.599 3.636 1.00 0.00 C ATOM 1960 OG SER B 55 2.389 10.327 4.981 1.00 0.00 O ATOM 0 H SER B 55 2.480 7.925 2.381 1.00 0.00 H new ATOM 0 HA SER B 55 0.789 10.258 2.802 1.00 0.00 H new ATOM 0 HB2 SER B 55 3.772 10.278 3.456 1.00 0.00 H new ATOM 0 HB3 SER B 55 2.712 11.674 3.457 1.00 0.00 H new ATOM 0 HG SER B 55 2.776 11.011 5.567 1.00 0.00 H new ATOM 1966 N VAL B 56 1.733 11.261 0.664 1.00 0.00 N ATOM 1967 CA VAL B 56 2.188 11.724 -0.636 1.00 0.00 C ATOM 1968 C VAL B 56 3.582 12.351 -0.490 1.00 0.00 C ATOM 1969 O VAL B 56 4.124 12.344 0.621 1.00 0.00 O ATOM 1970 CB VAL B 56 1.173 12.683 -1.300 1.00 0.00 C ATOM 1971 CG1 VAL B 56 -0.033 11.908 -1.799 1.00 0.00 C ATOM 1972 CG2 VAL B 56 0.735 13.774 -0.343 1.00 0.00 C ATOM 0 H VAL B 56 1.015 11.845 1.092 1.00 0.00 H new ATOM 0 HA VAL B 56 2.262 10.870 -1.310 1.00 0.00 H new ATOM 0 HB VAL B 56 1.667 13.159 -2.147 1.00 0.00 H new ATOM 0 HG11 VAL B 56 -0.740 12.595 -2.264 1.00 0.00 H new ATOM 0 HG12 VAL B 56 0.288 11.167 -2.531 1.00 0.00 H new ATOM 0 HG13 VAL B 56 -0.515 11.405 -0.961 1.00 0.00 H new ATOM 0 HG21 VAL B 56 0.022 14.430 -0.841 1.00 0.00 H new ATOM 0 HG22 VAL B 56 0.264 13.324 0.531 1.00 0.00 H new ATOM 0 HG23 VAL B 56 1.604 14.353 -0.029 1.00 0.00 H new ATOM 1982 N PRO B 57 4.105 13.073 -1.512 1.00 0.00 N ATOM 1983 CA PRO B 57 5.486 12.996 -1.925 1.00 0.00 C ATOM 1984 C PRO B 57 6.272 11.843 -1.303 1.00 0.00 C ATOM 1985 O PRO B 57 6.951 11.982 -0.284 1.00 0.00 O ATOM 1986 CB PRO B 57 5.949 14.388 -1.537 1.00 0.00 C ATOM 1987 CG PRO B 57 4.741 15.243 -1.870 1.00 0.00 C ATOM 1988 CD PRO B 57 3.574 14.281 -2.111 1.00 0.00 C ATOM 0 HA PRO B 57 5.638 12.756 -2.977 1.00 0.00 H new ATOM 0 HB2 PRO B 57 6.210 14.449 -0.480 1.00 0.00 H new ATOM 0 HB3 PRO B 57 6.830 14.694 -2.101 1.00 0.00 H new ATOM 0 HG2 PRO B 57 4.515 15.929 -1.053 1.00 0.00 H new ATOM 0 HG3 PRO B 57 4.930 15.852 -2.754 1.00 0.00 H new ATOM 0 HD2 PRO B 57 2.655 14.614 -1.629 1.00 0.00 H new ATOM 0 HD3 PRO B 57 3.351 14.156 -3.171 1.00 0.00 H new ATOM 1996 N ALA B 58 6.133 10.692 -1.954 1.00 0.00 N ATOM 1997 CA ALA B 58 6.814 9.467 -1.574 1.00 0.00 C ATOM 1998 C ALA B 58 6.958 8.575 -2.801 1.00 0.00 C ATOM 1999 O ALA B 58 6.172 8.691 -3.743 1.00 0.00 O ATOM 2000 CB ALA B 58 6.035 8.743 -0.488 1.00 0.00 C ATOM 0 H ALA B 58 5.534 10.587 -2.773 1.00 0.00 H new ATOM 0 HA ALA B 58 7.801 9.710 -1.182 1.00 0.00 H new ATOM 0 HB1 ALA B 58 6.558 7.827 -0.214 1.00 0.00 H new ATOM 0 HB2 ALA B 58 5.947 9.386 0.387 1.00 0.00 H new ATOM 0 HB3 ALA B 58 5.040 8.496 -0.857 1.00 0.00 H new ATOM 2006 N LEU B 59 7.946 7.693 -2.802 1.00 0.00 N ATOM 2007 CA LEU B 59 8.172 6.830 -3.952 1.00 0.00 C ATOM 2008 C LEU B 59 8.305 5.370 -3.529 1.00 0.00 C ATOM 2009 O LEU B 59 8.943 5.053 -2.528 1.00 0.00 O ATOM 2010 CB LEU B 59 9.411 7.271 -4.752 1.00 0.00 C ATOM 2011 CG LEU B 59 10.783 6.902 -4.166 1.00 0.00 C ATOM 2012 CD1 LEU B 59 11.880 7.226 -5.167 1.00 0.00 C ATOM 2013 CD2 LEU B 59 11.043 7.631 -2.857 1.00 0.00 C ATOM 0 H LEU B 59 8.597 7.556 -2.029 1.00 0.00 H new ATOM 0 HA LEU B 59 7.300 6.922 -4.600 1.00 0.00 H new ATOM 0 HB2 LEU B 59 9.341 6.840 -5.751 1.00 0.00 H new ATOM 0 HB3 LEU B 59 9.372 8.354 -4.869 1.00 0.00 H new ATOM 0 HG LEU B 59 10.783 5.832 -3.960 1.00 0.00 H new ATOM 0 HD11 LEU B 59 12.849 6.961 -4.743 1.00 0.00 H new ATOM 0 HD12 LEU B 59 11.717 6.657 -6.083 1.00 0.00 H new ATOM 0 HD13 LEU B 59 11.862 8.292 -5.394 1.00 0.00 H new ATOM 0 HD21 LEU B 59 12.022 7.347 -2.470 1.00 0.00 H new ATOM 0 HD22 LEU B 59 11.019 8.707 -3.029 1.00 0.00 H new ATOM 0 HD23 LEU B 59 10.275 7.362 -2.132 1.00 0.00 H new ATOM 2025 N VAL B 60 7.677 4.495 -4.294 1.00 0.00 N ATOM 2026 CA VAL B 60 7.728 3.066 -4.040 1.00 0.00 C ATOM 2027 C VAL B 60 8.730 2.398 -4.978 1.00 0.00 C ATOM 2028 O VAL B 60 8.513 2.340 -6.188 1.00 0.00 O ATOM 2029 CB VAL B 60 6.337 2.420 -4.229 1.00 0.00 C ATOM 2030 CG1 VAL B 60 6.373 0.940 -3.886 1.00 0.00 C ATOM 2031 CG2 VAL B 60 5.293 3.139 -3.389 1.00 0.00 C ATOM 0 H VAL B 60 7.118 4.754 -5.107 1.00 0.00 H new ATOM 0 HA VAL B 60 8.044 2.921 -3.007 1.00 0.00 H new ATOM 0 HB VAL B 60 6.060 2.517 -5.279 1.00 0.00 H new ATOM 0 HG11 VAL B 60 5.382 0.510 -4.027 1.00 0.00 H new ATOM 0 HG12 VAL B 60 7.085 0.433 -4.537 1.00 0.00 H new ATOM 0 HG13 VAL B 60 6.678 0.815 -2.847 1.00 0.00 H new ATOM 0 HG21 VAL B 60 4.321 2.669 -3.536 1.00 0.00 H new ATOM 0 HG22 VAL B 60 5.569 3.079 -2.336 1.00 0.00 H new ATOM 0 HG23 VAL B 60 5.240 4.185 -3.692 1.00 0.00 H new ATOM 2041 N ILE B 61 9.825 1.906 -4.417 1.00 0.00 N ATOM 2042 CA ILE B 61 10.877 1.277 -5.205 1.00 0.00 C ATOM 2043 C ILE B 61 10.832 -0.238 -5.047 1.00 0.00 C ATOM 2044 O ILE B 61 11.094 -0.762 -3.961 1.00 0.00 O ATOM 2045 CB ILE B 61 12.276 1.786 -4.791 1.00 0.00 C ATOM 2046 CG1 ILE B 61 12.345 3.312 -4.896 1.00 0.00 C ATOM 2047 CG2 ILE B 61 13.352 1.144 -5.658 1.00 0.00 C ATOM 2048 CD1 ILE B 61 13.656 3.897 -4.411 1.00 0.00 C ATOM 0 H ILE B 61 10.009 1.930 -3.414 1.00 0.00 H new ATOM 0 HA ILE B 61 10.701 1.543 -6.247 1.00 0.00 H new ATOM 0 HB ILE B 61 12.453 1.504 -3.753 1.00 0.00 H new ATOM 0 HG12 ILE B 61 12.189 3.603 -5.935 1.00 0.00 H new ATOM 0 HG13 ILE B 61 11.528 3.744 -4.318 1.00 0.00 H new ATOM 0 HG21 ILE B 61 14.332 1.513 -5.354 1.00 0.00 H new ATOM 0 HG22 ILE B 61 13.318 0.061 -5.538 1.00 0.00 H new ATOM 0 HG23 ILE B 61 13.177 1.398 -6.703 1.00 0.00 H new ATOM 0 HD11 ILE B 61 13.631 4.982 -4.516 1.00 0.00 H new ATOM 0 HD12 ILE B 61 13.805 3.637 -3.363 1.00 0.00 H new ATOM 0 HD13 ILE B 61 14.476 3.494 -5.005 1.00 0.00 H new ATOM 2060 N ASP B 62 10.460 -0.931 -6.127 1.00 0.00 N ATOM 2061 CA ASP B 62 10.422 -2.400 -6.157 1.00 0.00 C ATOM 2062 C ASP B 62 9.413 -2.971 -5.160 1.00 0.00 C ATOM 2063 O ASP B 62 9.357 -4.182 -4.947 1.00 0.00 O ATOM 2064 CB ASP B 62 11.813 -2.989 -5.879 1.00 0.00 C ATOM 2065 CG ASP B 62 12.561 -3.368 -7.144 1.00 0.00 C ATOM 2066 OD1 ASP B 62 12.989 -2.464 -7.890 1.00 0.00 O ATOM 2067 OD2 ASP B 62 12.733 -4.583 -7.393 1.00 0.00 O ATOM 0 H ASP B 62 10.177 -0.493 -7.004 1.00 0.00 H new ATOM 0 HA ASP B 62 10.103 -2.685 -7.160 1.00 0.00 H new ATOM 0 HB2 ASP B 62 12.403 -2.264 -5.318 1.00 0.00 H new ATOM 0 HB3 ASP B 62 11.708 -3.871 -5.248 1.00 0.00 H new ATOM 2072 N GLY B 63 8.609 -2.103 -4.563 1.00 0.00 N ATOM 2073 CA GLY B 63 7.632 -2.544 -3.587 1.00 0.00 C ATOM 2074 C GLY B 63 7.784 -1.824 -2.263 1.00 0.00 C ATOM 2075 O GLY B 63 6.822 -1.687 -1.508 1.00 0.00 O ATOM 0 H GLY B 63 8.616 -1.098 -4.737 1.00 0.00 H new ATOM 0 HA2 GLY B 63 6.628 -2.375 -3.978 1.00 0.00 H new ATOM 0 HA3 GLY B 63 7.737 -3.617 -3.429 1.00 0.00 H new ATOM 2079 N ALA B 64 8.992 -1.351 -1.988 1.00 0.00 N ATOM 2080 CA ALA B 64 9.272 -0.646 -0.746 1.00 0.00 C ATOM 2081 C ALA B 64 8.956 0.837 -0.888 1.00 0.00 C ATOM 2082 O ALA B 64 9.514 1.520 -1.747 1.00 0.00 O ATOM 2083 CB ALA B 64 10.723 -0.846 -0.337 1.00 0.00 C ATOM 0 H ALA B 64 9.795 -1.443 -2.610 1.00 0.00 H new ATOM 0 HA ALA B 64 8.633 -1.058 0.035 1.00 0.00 H new ATOM 0 HB1 ALA B 64 10.916 -0.312 0.594 1.00 0.00 H new ATOM 0 HB2 ALA B 64 10.917 -1.909 -0.193 1.00 0.00 H new ATOM 0 HB3 ALA B 64 11.378 -0.460 -1.119 1.00 0.00 H new ATOM 2089 N ALA B 65 8.052 1.326 -0.051 1.00 0.00 N ATOM 2090 CA ALA B 65 7.626 2.718 -0.109 1.00 0.00 C ATOM 2091 C ALA B 65 8.504 3.603 0.768 1.00 0.00 C ATOM 2092 O ALA B 65 8.658 3.356 1.966 1.00 0.00 O ATOM 2093 CB ALA B 65 6.167 2.842 0.307 1.00 0.00 C ATOM 0 H ALA B 65 7.598 0.777 0.679 1.00 0.00 H new ATOM 0 HA ALA B 65 7.730 3.058 -1.139 1.00 0.00 H new ATOM 0 HB1 ALA B 65 5.863 3.888 0.259 1.00 0.00 H new ATOM 0 HB2 ALA B 65 5.545 2.252 -0.366 1.00 0.00 H new ATOM 0 HB3 ALA B 65 6.047 2.476 1.327 1.00 0.00 H new ATOM 2099 N PHE B 66 9.083 4.630 0.163 1.00 0.00 N ATOM 2100 CA PHE B 66 9.908 5.582 0.887 1.00 0.00 C ATOM 2101 C PHE B 66 9.297 6.976 0.813 1.00 0.00 C ATOM 2102 O PHE B 66 9.068 7.509 -0.272 1.00 0.00 O ATOM 2103 CB PHE B 66 11.332 5.594 0.327 1.00 0.00 C ATOM 2104 CG PHE B 66 12.047 4.285 0.497 1.00 0.00 C ATOM 2105 CD1 PHE B 66 12.578 3.928 1.727 1.00 0.00 C ATOM 2106 CD2 PHE B 66 12.182 3.408 -0.567 1.00 0.00 C ATOM 2107 CE1 PHE B 66 13.230 2.723 1.892 1.00 0.00 C ATOM 2108 CE2 PHE B 66 12.832 2.201 -0.407 1.00 0.00 C ATOM 2109 CZ PHE B 66 13.357 1.858 0.824 1.00 0.00 C ATOM 0 H PHE B 66 8.995 4.825 -0.834 1.00 0.00 H new ATOM 0 HA PHE B 66 9.952 5.276 1.932 1.00 0.00 H new ATOM 0 HB2 PHE B 66 11.296 5.846 -0.733 1.00 0.00 H new ATOM 0 HB3 PHE B 66 11.903 6.379 0.822 1.00 0.00 H new ATOM 0 HD1 PHE B 66 12.480 4.601 2.566 1.00 0.00 H new ATOM 0 HD2 PHE B 66 11.774 3.672 -1.532 1.00 0.00 H new ATOM 0 HE1 PHE B 66 13.640 2.457 2.855 1.00 0.00 H new ATOM 0 HE2 PHE B 66 12.930 1.525 -1.244 1.00 0.00 H new ATOM 0 HZ PHE B 66 13.866 0.914 0.950 1.00 0.00 H new ATOM 2119 N HIS B 67 9.035 7.556 1.972 1.00 0.00 N ATOM 2120 CA HIS B 67 8.397 8.860 2.055 1.00 0.00 C ATOM 2121 C HIS B 67 9.444 9.967 2.005 1.00 0.00 C ATOM 2122 O HIS B 67 10.331 10.032 2.858 1.00 0.00 O ATOM 2123 CB HIS B 67 7.567 8.961 3.338 1.00 0.00 C ATOM 2124 CG HIS B 67 6.419 7.997 3.381 1.00 0.00 C ATOM 2125 ND1 HIS B 67 6.446 6.792 4.052 1.00 0.00 N ATOM 2126 CD2 HIS B 67 5.190 8.075 2.810 1.00 0.00 C ATOM 2127 CE1 HIS B 67 5.266 6.191 3.867 1.00 0.00 C ATOM 2128 NE2 HIS B 67 4.464 6.930 3.121 1.00 0.00 N ATOM 0 H HIS B 67 9.257 7.140 2.877 1.00 0.00 H new ATOM 0 HA HIS B 67 7.731 8.980 1.201 1.00 0.00 H new ATOM 0 HB2 HIS B 67 8.215 8.782 4.196 1.00 0.00 H new ATOM 0 HB3 HIS B 67 7.183 9.977 3.435 1.00 0.00 H new ATOM 0 HD1 HIS B 67 7.228 6.424 4.594 1.00 0.00 H new ATOM 0 HD2 HIS B 67 4.832 8.897 2.208 1.00 0.00 H new ATOM 0 HE1 HIS B 67 5.002 5.226 4.275 1.00 0.00 H new ATOM 2136 N ILE B 68 9.331 10.835 1.008 1.00 0.00 N ATOM 2137 CA ILE B 68 10.329 11.872 0.779 1.00 0.00 C ATOM 2138 C ILE B 68 10.028 13.114 1.608 1.00 0.00 C ATOM 2139 O ILE B 68 9.181 13.927 1.239 1.00 0.00 O ATOM 2140 CB ILE B 68 10.408 12.268 -0.711 1.00 0.00 C ATOM 2141 CG1 ILE B 68 10.631 11.029 -1.583 1.00 0.00 C ATOM 2142 CG2 ILE B 68 11.527 13.280 -0.932 1.00 0.00 C ATOM 2143 CD1 ILE B 68 10.636 11.323 -3.069 1.00 0.00 C ATOM 0 H ILE B 68 8.557 10.841 0.344 1.00 0.00 H new ATOM 0 HA ILE B 68 11.289 11.456 1.084 1.00 0.00 H new ATOM 0 HB ILE B 68 9.462 12.727 -0.998 1.00 0.00 H new ATOM 0 HG12 ILE B 68 11.581 10.569 -1.309 1.00 0.00 H new ATOM 0 HG13 ILE B 68 9.850 10.299 -1.369 1.00 0.00 H new ATOM 0 HG21 ILE B 68 11.570 13.550 -1.987 1.00 0.00 H new ATOM 0 HG22 ILE B 68 11.333 14.172 -0.337 1.00 0.00 H new ATOM 0 HG23 ILE B 68 12.478 12.842 -0.630 1.00 0.00 H new ATOM 0 HD11 ILE B 68 10.799 10.398 -3.622 1.00 0.00 H new ATOM 0 HD12 ILE B 68 9.678 11.754 -3.358 1.00 0.00 H new ATOM 0 HD13 ILE B 68 11.435 12.028 -3.298 1.00 0.00 H new ATOM 2155 N ASN B 69 10.706 13.220 2.749 1.00 0.00 N ATOM 2156 CA ASN B 69 10.619 14.390 3.626 1.00 0.00 C ATOM 2157 C ASN B 69 9.228 14.503 4.248 1.00 0.00 C ATOM 2158 O ASN B 69 8.891 15.511 4.860 1.00 0.00 O ATOM 2159 CB ASN B 69 10.985 15.668 2.852 1.00 0.00 C ATOM 2160 CG ASN B 69 11.292 16.848 3.757 1.00 0.00 C ATOM 2161 OD1 ASN B 69 12.407 16.978 4.260 1.00 0.00 O ATOM 2162 ND2 ASN B 69 10.319 17.726 3.952 1.00 0.00 N ATOM 0 H ASN B 69 11.334 12.495 3.094 1.00 0.00 H new ATOM 0 HA ASN B 69 11.336 14.266 4.438 1.00 0.00 H new ATOM 0 HB2 ASN B 69 11.851 15.467 2.221 1.00 0.00 H new ATOM 0 HB3 ASN B 69 10.161 15.932 2.189 1.00 0.00 H new ATOM 0 HD21 ASN B 69 10.481 18.546 4.537 1.00 0.00 H new ATOM 0 HD22 ASN B 69 9.408 17.582 3.517 1.00 0.00 H new ATOM 2169 N PHE B 70 8.448 13.429 4.118 1.00 0.00 N ATOM 2170 CA PHE B 70 7.066 13.401 4.587 1.00 0.00 C ATOM 2171 C PHE B 70 6.258 14.508 3.912 1.00 0.00 C ATOM 2172 O PHE B 70 6.124 15.612 4.441 1.00 0.00 O ATOM 2173 CB PHE B 70 7.001 13.527 6.118 1.00 0.00 C ATOM 2174 CG PHE B 70 5.609 13.442 6.688 1.00 0.00 C ATOM 2175 CD1 PHE B 70 4.949 12.226 6.763 1.00 0.00 C ATOM 2176 CD2 PHE B 70 4.967 14.578 7.157 1.00 0.00 C ATOM 2177 CE1 PHE B 70 3.675 12.145 7.293 1.00 0.00 C ATOM 2178 CE2 PHE B 70 3.693 14.503 7.686 1.00 0.00 C ATOM 2179 CZ PHE B 70 3.046 13.285 7.754 1.00 0.00 C ATOM 0 H PHE B 70 8.757 12.558 3.686 1.00 0.00 H new ATOM 0 HA PHE B 70 6.629 12.440 4.316 1.00 0.00 H new ATOM 0 HB2 PHE B 70 7.612 12.741 6.562 1.00 0.00 H new ATOM 0 HB3 PHE B 70 7.444 14.479 6.412 1.00 0.00 H new ATOM 0 HD1 PHE B 70 5.435 11.331 6.403 1.00 0.00 H new ATOM 0 HD2 PHE B 70 5.469 15.533 7.108 1.00 0.00 H new ATOM 0 HE1 PHE B 70 3.172 11.191 7.347 1.00 0.00 H new ATOM 0 HE2 PHE B 70 3.204 15.396 8.046 1.00 0.00 H new ATOM 0 HZ PHE B 70 2.050 13.224 8.167 1.00 0.00 H new ATOM 2189 N GLY B 71 5.757 14.214 2.719 1.00 0.00 N ATOM 2190 CA GLY B 71 4.985 15.190 1.981 1.00 0.00 C ATOM 2191 C GLY B 71 3.690 15.536 2.678 1.00 0.00 C ATOM 2192 O GLY B 71 3.619 16.505 3.437 1.00 0.00 O ATOM 0 H GLY B 71 5.873 13.315 2.250 1.00 0.00 H new ATOM 0 HA2 GLY B 71 5.578 16.095 1.848 1.00 0.00 H new ATOM 0 HA3 GLY B 71 4.768 14.802 0.986 1.00 0.00 H new ATOM 2196 N ALA B 72 2.651 14.766 2.405 1.00 0.00 N ATOM 2197 CA ALA B 72 1.368 14.982 3.076 1.00 0.00 C ATOM 2198 C ALA B 72 0.721 13.659 3.439 1.00 0.00 C ATOM 2199 O ALA B 72 0.718 12.735 2.636 1.00 0.00 O ATOM 2200 CB ALA B 72 0.436 15.830 2.223 1.00 0.00 C ATOM 0 H ALA B 72 2.662 13.996 1.736 1.00 0.00 H new ATOM 0 HA ALA B 72 1.560 15.529 3.999 1.00 0.00 H new ATOM 0 HB1 ALA B 72 -0.508 15.973 2.748 1.00 0.00 H new ATOM 0 HB2 ALA B 72 0.897 16.800 2.034 1.00 0.00 H new ATOM 0 HB3 ALA B 72 0.251 15.326 1.275 1.00 0.00 H new ATOM 2206 N GLY B 73 0.168 13.569 4.639 1.00 0.00 N ATOM 2207 CA GLY B 73 -0.464 12.335 5.071 1.00 0.00 C ATOM 2208 C GLY B 73 -1.609 11.923 4.163 1.00 0.00 C ATOM 2209 O GLY B 73 -2.383 12.768 3.709 1.00 0.00 O ATOM 0 H GLY B 73 0.144 14.326 5.322 1.00 0.00 H new ATOM 0 HA2 GLY B 73 0.280 11.539 5.097 1.00 0.00 H new ATOM 0 HA3 GLY B 73 -0.836 12.457 6.088 1.00 0.00 H new ATOM 2213 N ILE B 74 -1.720 10.627 3.891 1.00 0.00 N ATOM 2214 CA ILE B 74 -2.764 10.121 3.005 1.00 0.00 C ATOM 2215 C ILE B 74 -4.145 10.333 3.626 1.00 0.00 C ATOM 2216 O ILE B 74 -5.138 10.513 2.921 1.00 0.00 O ATOM 2217 CB ILE B 74 -2.559 8.618 2.675 1.00 0.00 C ATOM 2218 CG1 ILE B 74 -3.531 8.171 1.579 1.00 0.00 C ATOM 2219 CG2 ILE B 74 -2.735 7.758 3.922 1.00 0.00 C ATOM 2220 CD1 ILE B 74 -3.343 6.730 1.148 1.00 0.00 C ATOM 0 H ILE B 74 -1.102 9.909 4.270 1.00 0.00 H new ATOM 0 HA ILE B 74 -2.699 10.683 2.073 1.00 0.00 H new ATOM 0 HB ILE B 74 -1.540 8.488 2.311 1.00 0.00 H new ATOM 0 HG12 ILE B 74 -4.552 8.304 1.935 1.00 0.00 H new ATOM 0 HG13 ILE B 74 -3.409 8.819 0.711 1.00 0.00 H new ATOM 0 HG21 ILE B 74 -2.586 6.709 3.665 1.00 0.00 H new ATOM 0 HG22 ILE B 74 -2.004 8.054 4.674 1.00 0.00 H new ATOM 0 HG23 ILE B 74 -3.741 7.895 4.320 1.00 0.00 H new ATOM 0 HD11 ILE B 74 -4.066 6.486 0.370 1.00 0.00 H new ATOM 0 HD12 ILE B 74 -2.333 6.595 0.760 1.00 0.00 H new ATOM 0 HD13 ILE B 74 -3.494 6.072 2.003 1.00 0.00 H new ATOM 2232 N ASP B 75 -4.188 10.362 4.953 1.00 0.00 N ATOM 2233 CA ASP B 75 -5.445 10.503 5.676 1.00 0.00 C ATOM 2234 C ASP B 75 -5.828 11.977 5.790 1.00 0.00 C ATOM 2235 O ASP B 75 -6.892 12.316 6.297 1.00 0.00 O ATOM 2236 CB ASP B 75 -5.335 9.859 7.063 1.00 0.00 C ATOM 2237 CG ASP B 75 -6.683 9.641 7.726 1.00 0.00 C ATOM 2238 OD1 ASP B 75 -7.430 8.738 7.285 1.00 0.00 O ATOM 2239 OD2 ASP B 75 -6.990 10.347 8.710 1.00 0.00 O ATOM 0 H ASP B 75 -3.365 10.290 5.551 1.00 0.00 H new ATOM 0 HA ASP B 75 -6.230 9.988 5.122 1.00 0.00 H new ATOM 0 HB2 ASP B 75 -4.822 8.902 6.973 1.00 0.00 H new ATOM 0 HB3 ASP B 75 -4.720 10.491 7.703 1.00 0.00 H new ATOM 2244 N ASP B 76 -4.954 12.852 5.303 1.00 0.00 N ATOM 2245 CA ASP B 76 -5.250 14.283 5.247 1.00 0.00 C ATOM 2246 C ASP B 76 -6.115 14.590 4.034 1.00 0.00 C ATOM 2247 O ASP B 76 -6.864 15.566 4.016 1.00 0.00 O ATOM 2248 CB ASP B 76 -3.965 15.115 5.186 1.00 0.00 C ATOM 2249 CG ASP B 76 -3.233 15.170 6.510 1.00 0.00 C ATOM 2250 OD1 ASP B 76 -2.415 14.269 6.784 1.00 0.00 O ATOM 2251 OD2 ASP B 76 -3.465 16.126 7.283 1.00 0.00 O ATOM 0 H ASP B 76 -4.035 12.597 4.941 1.00 0.00 H new ATOM 0 HA ASP B 76 -5.788 14.549 6.157 1.00 0.00 H new ATOM 0 HB2 ASP B 76 -3.303 14.696 4.428 1.00 0.00 H new ATOM 0 HB3 ASP B 76 -4.210 16.129 4.870 1.00 0.00 H new ATOM 2256 N LEU B 77 -6.004 13.742 3.021 1.00 0.00 N ATOM 2257 CA LEU B 77 -6.802 13.879 1.808 1.00 0.00 C ATOM 2258 C LEU B 77 -8.069 13.042 1.925 1.00 0.00 C ATOM 2259 O LEU B 77 -8.935 13.062 1.049 1.00 0.00 O ATOM 2260 CB LEU B 77 -5.994 13.420 0.590 1.00 0.00 C ATOM 2261 CG LEU B 77 -4.665 14.147 0.369 1.00 0.00 C ATOM 2262 CD1 LEU B 77 -3.907 13.525 -0.793 1.00 0.00 C ATOM 2263 CD2 LEU B 77 -4.901 15.628 0.119 1.00 0.00 C ATOM 0 H LEU B 77 -5.365 12.947 3.015 1.00 0.00 H new ATOM 0 HA LEU B 77 -7.072 14.928 1.682 1.00 0.00 H new ATOM 0 HB2 LEU B 77 -5.792 12.354 0.690 1.00 0.00 H new ATOM 0 HB3 LEU B 77 -6.609 13.546 -0.301 1.00 0.00 H new ATOM 0 HG LEU B 77 -4.062 14.043 1.271 1.00 0.00 H new ATOM 0 HD11 LEU B 77 -2.965 14.053 -0.937 1.00 0.00 H new ATOM 0 HD12 LEU B 77 -3.706 12.476 -0.576 1.00 0.00 H new ATOM 0 HD13 LEU B 77 -4.507 13.599 -1.700 1.00 0.00 H new ATOM 0 HD21 LEU B 77 -3.945 16.128 -0.036 1.00 0.00 H new ATOM 0 HD22 LEU B 77 -5.523 15.753 -0.767 1.00 0.00 H new ATOM 0 HD23 LEU B 77 -5.404 16.067 0.981 1.00 0.00 H new ATOM 2275 N LYS B 78 -8.168 12.325 3.031 1.00 0.00 N ATOM 2276 CA LYS B 78 -9.237 11.366 3.247 1.00 0.00 C ATOM 2277 C LYS B 78 -10.048 11.730 4.489 1.00 0.00 C ATOM 2278 O LYS B 78 -9.513 12.273 5.453 1.00 0.00 O ATOM 2279 CB LYS B 78 -8.623 9.968 3.398 1.00 0.00 C ATOM 2280 CG LYS B 78 -9.549 8.939 4.023 1.00 0.00 C ATOM 2281 CD LYS B 78 -8.823 7.634 4.294 1.00 0.00 C ATOM 2282 CE LYS B 78 -9.588 6.771 5.282 1.00 0.00 C ATOM 2283 NZ LYS B 78 -9.747 7.454 6.597 1.00 0.00 N ATOM 0 H LYS B 78 -7.508 12.392 3.806 1.00 0.00 H new ATOM 0 HA LYS B 78 -9.914 11.380 2.393 1.00 0.00 H new ATOM 0 HB2 LYS B 78 -8.315 9.612 2.415 1.00 0.00 H new ATOM 0 HB3 LYS B 78 -7.722 10.044 4.006 1.00 0.00 H new ATOM 0 HG2 LYS B 78 -9.955 9.331 4.955 1.00 0.00 H new ATOM 0 HG3 LYS B 78 -10.394 8.756 3.359 1.00 0.00 H new ATOM 0 HD2 LYS B 78 -8.689 7.089 3.360 1.00 0.00 H new ATOM 0 HD3 LYS B 78 -7.828 7.844 4.686 1.00 0.00 H new ATOM 0 HE2 LYS B 78 -10.570 6.533 4.874 1.00 0.00 H new ATOM 0 HE3 LYS B 78 -9.064 5.826 5.423 1.00 0.00 H new ATOM 0 HZ1 LYS B 78 -9.888 6.743 7.343 1.00 0.00 H new ATOM 0 HZ2 LYS B 78 -8.893 8.009 6.805 1.00 0.00 H new ATOM 0 HZ3 LYS B 78 -10.571 8.087 6.562 1.00 0.00 H new ATOM 2297 N GLY B 79 -11.341 11.454 4.450 1.00 0.00 N ATOM 2298 CA GLY B 79 -12.167 11.615 5.625 1.00 0.00 C ATOM 2299 C GLY B 79 -12.286 10.308 6.380 1.00 0.00 C ATOM 2300 O GLY B 79 -11.280 9.730 6.796 1.00 0.00 O ATOM 0 H GLY B 79 -11.834 11.120 3.622 1.00 0.00 H new ATOM 0 HA2 GLY B 79 -11.739 12.378 6.275 1.00 0.00 H new ATOM 0 HA3 GLY B 79 -13.158 11.964 5.334 1.00 0.00 H new ATOM 2304 N SER B 80 -13.504 9.832 6.547 1.00 0.00 N ATOM 2305 CA SER B 80 -13.735 8.543 7.174 1.00 0.00 C ATOM 2306 C SER B 80 -14.803 7.775 6.394 1.00 0.00 C ATOM 2307 O SER B 80 -15.986 7.829 6.782 1.00 0.00 O ATOM 2308 CB SER B 80 -14.156 8.736 8.634 1.00 0.00 C ATOM 2309 OG SER B 80 -13.200 9.521 9.337 1.00 0.00 O ATOM 2310 OXT SER B 80 -14.459 7.155 5.362 1.00 0.00 O ATOM 0 H SER B 80 -14.352 10.319 6.257 1.00 0.00 H new ATOM 0 HA SER B 80 -12.812 7.963 7.161 1.00 0.00 H new ATOM 0 HB2 SER B 80 -15.131 9.221 8.675 1.00 0.00 H new ATOM 0 HB3 SER B 80 -14.262 7.765 9.118 1.00 0.00 H new ATOM 0 HG SER B 80 -13.489 9.633 10.267 1.00 0.00 H new TER 2316 SER B 80