USER MOD reduce.3.24.130724 H: found=0, std=0, add=968, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 967 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 125 ASN : amide:sc= -0.223 K(o=-0.22,f=-1.3) USER MOD Set 1.2: A 129 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.1: A 78 SER OG : rot -80:sc= 0.918 USER MOD Set 2.2: A 80 CYS SG : rot -8:sc= 0.391 USER MOD Set 3.1: A 11 ASN : amide:sc= -2.59! C(o=-0.8!,f=-4.6!) USER MOD Set 3.2: A 34 SER OG : rot -120:sc= 1.49 USER MOD Set 3.3: A 62 SER OG : rot 177:sc= 0.293 USER MOD Set 4.1: A 8 SER OG : rot 83:sc= 0.646 USER MOD Set 4.2: A 15 SER OG : rot -177:sc= 2.07 USER MOD Single : A 1 MET CE :methyl -177:sc= 0 (180deg=-0.0102) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 LYS NZ :NH3+ -177:sc= 1.26 (180deg=1.19) USER MOD Single : A 5 MET CE :methyl -161:sc= -2.37 (180deg=-3!) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 SER OG : rot 180:sc=-0.00199 USER MOD Single : A 13 SER OG : rot -61:sc= 1.48 USER MOD Single : A 16 GLN : amide:sc= 0.361 K(o=0.36,f=-3.8!) USER MOD Single : A 17 MET CE :methyl -142:sc= -0.0106 (180deg=-0.403) USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 THR OG1 : rot -77:sc= 1.21 USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 THR OG1 : rot 70:sc= 0.868 USER MOD Single : A 35 SER OG : rot 149:sc=-0.00135 USER MOD Single : A 39 SER OG : rot 180:sc= 0.00163 USER MOD Single : A 40 SER OG : rot 180:sc= 0.303 USER MOD Single : A 43 HIS : no HD1:sc= -1.02 K(o=-1,f=-5.9!) USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 MET CE :methyl 173:sc= -0.596 (180deg=-0.689) USER MOD Single : A 50 MET CE :methyl -154:sc= -1.68 (180deg=-4.05!) USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : A 60 GLN :FLIP amide:sc= -0.0299 F(o=-1.2!,f=-0.03) USER MOD Single : A 61 THR OG1 : rot 86:sc= 1.09 USER MOD Single : A 67 ASN : amide:sc= 0.939 K(o=0.94,f=0) USER MOD Single : A 69 ASN : amide:sc= 0.705 K(o=0.7,f=0) USER MOD Single : A 73 TYR OH : rot 180:sc= 0 USER MOD Single : A 92 THR OG1 : rot -75:sc= 1.23 USER MOD Single : A 93 GLN : amide:sc= 0.83 K(o=0.83,f=-0.17) USER MOD Single : A 100 GLN : amide:sc= 0.953 K(o=0.95,f=0) USER MOD Single : A 107 GLN : amide:sc= 0.688 K(o=0.69,f=-0.24) USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 114 THR OG1 : rot 71:sc= 1.28 USER MOD Single : A 118 GLN : amide:sc= -0.209 X(o=-0.21,f=-0.14) USER MOD Single : A 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 131 SER OG : rot 70:sc= 1.14 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 0.930 -0.441 0.379 1.00 0.00 N ATOM 2 CA MET A 1 1.761 -0.559 -0.865 1.00 0.00 C ATOM 3 C MET A 1 2.210 -2.010 -1.104 1.00 0.00 C ATOM 4 O MET A 1 2.841 -2.596 -0.229 1.00 0.00 O ATOM 5 CB MET A 1 2.992 0.389 -0.819 1.00 0.00 C ATOM 6 CG MET A 1 3.839 0.433 -2.096 1.00 0.00 C ATOM 7 SD MET A 1 5.367 1.402 -1.920 1.00 0.00 S ATOM 8 CE MET A 1 4.727 3.098 -1.801 1.00 0.00 C ATOM 0 H1 MET A 1 0.643 0.550 0.512 1.00 0.00 H new ATOM 0 H2 MET A 1 0.083 -1.038 0.289 1.00 0.00 H new ATOM 0 H3 MET A 1 1.487 -0.753 1.200 1.00 0.00 H new ATOM 0 HA MET A 1 1.131 -0.256 -1.701 1.00 0.00 H new ATOM 0 HB2 MET A 1 2.643 1.398 -0.600 1.00 0.00 H new ATOM 0 HB3 MET A 1 3.631 0.086 0.010 1.00 0.00 H new ATOM 0 HG2 MET A 1 4.096 -0.585 -2.387 1.00 0.00 H new ATOM 0 HG3 MET A 1 3.242 0.855 -2.904 1.00 0.00 H new ATOM 0 HE1 MET A 1 5.560 3.798 -1.743 1.00 0.00 H new ATOM 0 HE2 MET A 1 4.125 3.322 -2.681 1.00 0.00 H new ATOM 0 HE3 MET A 1 4.111 3.193 -0.907 1.00 0.00 H new ATOM 20 N LYS A 2 1.954 -2.570 -2.299 1.00 0.00 N ATOM 21 CA LYS A 2 2.529 -3.866 -2.722 1.00 0.00 C ATOM 22 C LYS A 2 3.904 -3.625 -3.351 1.00 0.00 C ATOM 23 O LYS A 2 3.983 -3.100 -4.459 1.00 0.00 O ATOM 24 CB LYS A 2 1.608 -4.592 -3.730 1.00 0.00 C ATOM 25 CG LYS A 2 0.457 -5.392 -3.093 1.00 0.00 C ATOM 26 CD LYS A 2 -0.782 -4.592 -2.653 1.00 0.00 C ATOM 27 CE LYS A 2 -1.594 -4.072 -3.853 1.00 0.00 C ATOM 28 NZ LYS A 2 -2.892 -3.474 -3.422 1.00 0.00 N ATOM 0 H LYS A 2 1.346 -2.143 -2.998 1.00 0.00 H new ATOM 0 HA LYS A 2 2.626 -4.504 -1.843 1.00 0.00 H new ATOM 0 HB2 LYS A 2 1.185 -3.854 -4.411 1.00 0.00 H new ATOM 0 HB3 LYS A 2 2.214 -5.270 -4.331 1.00 0.00 H new ATOM 0 HG2 LYS A 2 0.136 -6.152 -3.806 1.00 0.00 H new ATOM 0 HG3 LYS A 2 0.849 -5.917 -2.222 1.00 0.00 H new ATOM 0 HD2 LYS A 2 -1.418 -5.223 -2.032 1.00 0.00 H new ATOM 0 HD3 LYS A 2 -0.469 -3.750 -2.036 1.00 0.00 H new ATOM 0 HE2 LYS A 2 -1.010 -3.326 -4.392 1.00 0.00 H new ATOM 0 HE3 LYS A 2 -1.783 -4.891 -4.547 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 -3.412 -3.135 -4.256 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 -3.459 -4.193 -2.930 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 -2.711 -2.677 -2.779 1.00 0.00 H new ATOM 42 N LYS A 3 4.985 -3.982 -2.654 1.00 0.00 N ATOM 43 CA LYS A 3 6.357 -3.858 -3.190 1.00 0.00 C ATOM 44 C LYS A 3 6.702 -5.047 -4.086 1.00 0.00 C ATOM 45 O LYS A 3 6.299 -6.180 -3.814 1.00 0.00 O ATOM 46 CB LYS A 3 7.403 -3.661 -2.076 1.00 0.00 C ATOM 47 CG LYS A 3 7.043 -2.486 -1.161 1.00 0.00 C ATOM 48 CD LYS A 3 8.132 -2.208 -0.125 1.00 0.00 C ATOM 49 CE LYS A 3 7.631 -1.098 0.812 1.00 0.00 C ATOM 50 NZ LYS A 3 8.579 -0.866 1.933 1.00 0.00 N ATOM 0 H LYS A 3 4.943 -4.363 -1.709 1.00 0.00 H new ATOM 0 HA LYS A 3 6.386 -2.957 -3.803 1.00 0.00 H new ATOM 0 HB2 LYS A 3 7.480 -4.573 -1.484 1.00 0.00 H new ATOM 0 HB3 LYS A 3 8.382 -3.488 -2.523 1.00 0.00 H new ATOM 0 HG2 LYS A 3 6.882 -1.593 -1.765 1.00 0.00 H new ATOM 0 HG3 LYS A 3 6.104 -2.699 -0.651 1.00 0.00 H new ATOM 0 HD2 LYS A 3 8.357 -3.111 0.442 1.00 0.00 H new ATOM 0 HD3 LYS A 3 9.055 -1.902 -0.617 1.00 0.00 H new ATOM 0 HE2 LYS A 3 7.500 -0.175 0.247 1.00 0.00 H new ATOM 0 HE3 LYS A 3 6.653 -1.370 1.210 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 8.188 -0.147 2.575 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 8.724 -1.754 2.455 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 9.489 -0.534 1.555 1.00 0.00 H new ATOM 64 N VAL A 4 7.478 -4.785 -5.137 1.00 0.00 N ATOM 65 CA VAL A 4 7.956 -5.815 -6.077 1.00 0.00 C ATOM 66 C VAL A 4 9.403 -6.167 -5.764 1.00 0.00 C ATOM 67 O VAL A 4 10.189 -5.270 -5.478 1.00 0.00 O ATOM 68 CB VAL A 4 7.816 -5.367 -7.545 1.00 0.00 C ATOM 69 CG1 VAL A 4 8.195 -6.496 -8.509 1.00 0.00 C ATOM 70 CG2 VAL A 4 6.389 -4.935 -7.877 1.00 0.00 C ATOM 0 H VAL A 4 7.799 -3.845 -5.368 1.00 0.00 H new ATOM 0 HA VAL A 4 7.331 -6.699 -5.950 1.00 0.00 H new ATOM 0 HB VAL A 4 8.493 -4.521 -7.665 1.00 0.00 H new ATOM 0 HG11 VAL A 4 8.086 -6.149 -9.537 1.00 0.00 H new ATOM 0 HG12 VAL A 4 9.229 -6.792 -8.334 1.00 0.00 H new ATOM 0 HG13 VAL A 4 7.540 -7.351 -8.343 1.00 0.00 H new ATOM 0 HG21 VAL A 4 6.336 -4.627 -8.921 1.00 0.00 H new ATOM 0 HG22 VAL A 4 5.708 -5.769 -7.709 1.00 0.00 H new ATOM 0 HG23 VAL A 4 6.104 -4.100 -7.238 1.00 0.00 H new ATOM 80 N MET A 5 9.779 -7.439 -5.882 1.00 0.00 N ATOM 81 CA MET A 5 11.175 -7.883 -5.825 1.00 0.00 C ATOM 82 C MET A 5 11.518 -8.751 -7.038 1.00 0.00 C ATOM 83 O MET A 5 10.963 -9.837 -7.196 1.00 0.00 O ATOM 84 CB MET A 5 11.444 -8.656 -4.517 1.00 0.00 C ATOM 85 CG MET A 5 12.920 -9.087 -4.435 1.00 0.00 C ATOM 86 SD MET A 5 14.031 -7.671 -4.523 1.00 0.00 S ATOM 87 CE MET A 5 14.209 -7.214 -2.786 1.00 0.00 C ATOM 0 H MET A 5 9.116 -8.202 -6.022 1.00 0.00 H new ATOM 0 HA MET A 5 11.814 -7.000 -5.844 1.00 0.00 H new ATOM 0 HB2 MET A 5 11.194 -8.030 -3.660 1.00 0.00 H new ATOM 0 HB3 MET A 5 10.800 -9.534 -4.468 1.00 0.00 H new ATOM 0 HG2 MET A 5 13.091 -9.627 -3.503 1.00 0.00 H new ATOM 0 HG3 MET A 5 13.144 -9.777 -5.249 1.00 0.00 H new ATOM 0 HE1 MET A 5 14.574 -6.189 -2.715 1.00 0.00 H new ATOM 0 HE2 MET A 5 13.242 -7.290 -2.289 1.00 0.00 H new ATOM 0 HE3 MET A 5 14.919 -7.886 -2.304 1.00 0.00 H new ATOM 97 N PHE A 6 12.468 -8.320 -7.865 1.00 0.00 N ATOM 98 CA PHE A 6 13.027 -9.169 -8.928 1.00 0.00 C ATOM 99 C PHE A 6 14.232 -9.963 -8.414 1.00 0.00 C ATOM 100 O PHE A 6 15.062 -9.420 -7.693 1.00 0.00 O ATOM 101 CB PHE A 6 13.370 -8.333 -10.163 1.00 0.00 C ATOM 102 CG PHE A 6 12.243 -7.433 -10.616 1.00 0.00 C ATOM 103 CD1 PHE A 6 11.185 -7.911 -11.414 1.00 0.00 C ATOM 104 CD2 PHE A 6 12.235 -6.099 -10.179 1.00 0.00 C ATOM 105 CE1 PHE A 6 10.097 -7.076 -11.706 1.00 0.00 C ATOM 106 CE2 PHE A 6 11.143 -5.270 -10.459 1.00 0.00 C ATOM 107 CZ PHE A 6 10.066 -5.758 -11.222 1.00 0.00 C ATOM 0 H PHE A 6 12.872 -7.384 -7.823 1.00 0.00 H new ATOM 0 HA PHE A 6 12.271 -9.894 -9.229 1.00 0.00 H new ATOM 0 HB2 PHE A 6 14.247 -7.723 -9.946 1.00 0.00 H new ATOM 0 HB3 PHE A 6 13.641 -9.001 -10.980 1.00 0.00 H new ATOM 0 HD1 PHE A 6 11.212 -8.919 -11.800 1.00 0.00 H new ATOM 0 HD2 PHE A 6 13.076 -5.711 -9.624 1.00 0.00 H new ATOM 0 HE1 PHE A 6 9.279 -7.448 -12.306 1.00 0.00 H new ATOM 0 HE2 PHE A 6 11.127 -4.255 -10.089 1.00 0.00 H new ATOM 0 HZ PHE A 6 9.219 -5.122 -11.434 1.00 0.00 H new ATOM 117 N VAL A 7 14.339 -11.237 -8.787 1.00 0.00 N ATOM 118 CA VAL A 7 15.322 -12.202 -8.266 1.00 0.00 C ATOM 119 C VAL A 7 16.020 -12.905 -9.432 1.00 0.00 C ATOM 120 O VAL A 7 15.363 -13.402 -10.340 1.00 0.00 O ATOM 121 CB VAL A 7 14.653 -13.227 -7.317 1.00 0.00 C ATOM 122 CG1 VAL A 7 15.714 -13.996 -6.521 1.00 0.00 C ATOM 123 CG2 VAL A 7 13.722 -12.568 -6.291 1.00 0.00 C ATOM 0 H VAL A 7 13.722 -11.647 -9.488 1.00 0.00 H new ATOM 0 HA VAL A 7 16.068 -11.662 -7.683 1.00 0.00 H new ATOM 0 HB VAL A 7 14.074 -13.888 -7.962 1.00 0.00 H new ATOM 0 HG11 VAL A 7 15.225 -14.711 -5.860 1.00 0.00 H new ATOM 0 HG12 VAL A 7 16.371 -14.528 -7.209 1.00 0.00 H new ATOM 0 HG13 VAL A 7 16.302 -13.296 -5.927 1.00 0.00 H new ATOM 0 HG21 VAL A 7 13.282 -13.335 -5.654 1.00 0.00 H new ATOM 0 HG22 VAL A 7 14.292 -11.870 -5.678 1.00 0.00 H new ATOM 0 HG23 VAL A 7 12.930 -12.030 -6.811 1.00 0.00 H new ATOM 133 N SER A 8 17.352 -12.934 -9.421 1.00 0.00 N ATOM 134 CA SER A 8 18.197 -13.536 -10.477 1.00 0.00 C ATOM 135 C SER A 8 19.402 -14.256 -9.856 1.00 0.00 C ATOM 136 O SER A 8 19.669 -14.062 -8.672 1.00 0.00 O ATOM 137 CB SER A 8 18.683 -12.422 -11.417 1.00 0.00 C ATOM 138 OG SER A 8 17.569 -11.775 -11.980 1.00 0.00 O ATOM 0 H SER A 8 17.898 -12.531 -8.660 1.00 0.00 H new ATOM 0 HA SER A 8 17.612 -14.267 -11.035 1.00 0.00 H new ATOM 0 HB2 SER A 8 19.295 -11.707 -10.867 1.00 0.00 H new ATOM 0 HB3 SER A 8 19.311 -12.841 -12.203 1.00 0.00 H new ATOM 0 HG SER A 8 17.235 -11.097 -11.357 1.00 0.00 H new ATOM 144 N LYS A 9 20.202 -15.016 -10.629 1.00 0.00 N ATOM 145 CA LYS A 9 21.501 -15.524 -10.111 1.00 0.00 C ATOM 146 C LYS A 9 22.437 -14.338 -9.869 1.00 0.00 C ATOM 147 O LYS A 9 22.943 -14.193 -8.772 1.00 0.00 O ATOM 148 CB LYS A 9 22.067 -16.662 -10.986 1.00 0.00 C ATOM 149 CG LYS A 9 23.372 -17.224 -10.382 1.00 0.00 C ATOM 150 CD LYS A 9 23.696 -18.663 -10.821 1.00 0.00 C ATOM 151 CE LYS A 9 23.893 -18.813 -12.339 1.00 0.00 C ATOM 152 NZ LYS A 9 24.303 -20.204 -12.699 1.00 0.00 N ATOM 0 H LYS A 9 19.987 -15.289 -11.588 1.00 0.00 H new ATOM 0 HA LYS A 9 21.366 -16.008 -9.144 1.00 0.00 H new ATOM 0 HB2 LYS A 9 21.329 -17.460 -11.074 1.00 0.00 H new ATOM 0 HB3 LYS A 9 22.258 -16.291 -11.993 1.00 0.00 H new ATOM 0 HG2 LYS A 9 24.200 -16.574 -10.664 1.00 0.00 H new ATOM 0 HG3 LYS A 9 23.299 -17.194 -9.295 1.00 0.00 H new ATOM 0 HD2 LYS A 9 24.600 -18.995 -10.311 1.00 0.00 H new ATOM 0 HD3 LYS A 9 22.889 -19.322 -10.501 1.00 0.00 H new ATOM 0 HE2 LYS A 9 22.967 -18.560 -12.855 1.00 0.00 H new ATOM 0 HE3 LYS A 9 24.651 -18.108 -12.681 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 24.428 -20.273 -13.729 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 25.199 -20.435 -12.225 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 23.567 -20.873 -12.394 1.00 0.00 H new ATOM 166 N ARG A 10 22.570 -13.445 -10.858 1.00 0.00 N ATOM 167 CA ARG A 10 23.218 -12.123 -10.707 1.00 0.00 C ATOM 168 C ARG A 10 22.110 -11.087 -10.645 1.00 0.00 C ATOM 169 O ARG A 10 21.466 -10.889 -11.669 1.00 0.00 O ATOM 170 CB ARG A 10 24.179 -11.801 -11.877 1.00 0.00 C ATOM 171 CG ARG A 10 25.612 -12.315 -11.647 1.00 0.00 C ATOM 172 CD ARG A 10 25.844 -13.767 -12.099 1.00 0.00 C ATOM 173 NE ARG A 10 25.888 -13.856 -13.570 1.00 0.00 N ATOM 174 CZ ARG A 10 26.008 -14.921 -14.336 1.00 0.00 C ATOM 175 NH1 ARG A 10 26.195 -16.119 -13.860 1.00 0.00 N ATOM 176 NH2 ARG A 10 25.929 -14.773 -15.617 1.00 0.00 N ATOM 0 H ARG A 10 22.227 -13.617 -11.803 1.00 0.00 H new ATOM 0 HA ARG A 10 23.824 -12.120 -9.801 1.00 0.00 H new ATOM 0 HB2 ARG A 10 23.785 -12.241 -12.793 1.00 0.00 H new ATOM 0 HB3 ARG A 10 24.207 -10.722 -12.028 1.00 0.00 H new ATOM 0 HG2 ARG A 10 26.308 -11.666 -12.178 1.00 0.00 H new ATOM 0 HG3 ARG A 10 25.848 -12.235 -10.586 1.00 0.00 H new ATOM 0 HD2 ARG A 10 26.779 -14.138 -11.679 1.00 0.00 H new ATOM 0 HD3 ARG A 10 25.047 -14.404 -11.715 1.00 0.00 H new ATOM 0 HE ARG A 10 25.815 -12.967 -14.065 1.00 0.00 H new ATOM 0 HH11 ARG A 10 26.255 -16.264 -12.852 1.00 0.00 H new ATOM 0 HH12 ARG A 10 26.282 -16.912 -14.495 1.00 0.00 H new ATOM 0 HH21 ARG A 10 25.777 -13.846 -16.015 1.00 0.00 H new ATOM 0 HH22 ARG A 10 26.019 -15.583 -16.230 1.00 0.00 H new ATOM 190 N ASN A 11 21.901 -10.390 -9.534 1.00 0.00 N ATOM 191 CA ASN A 11 20.957 -9.260 -9.471 1.00 0.00 C ATOM 192 C ASN A 11 21.263 -8.268 -10.600 1.00 0.00 C ATOM 193 O ASN A 11 20.389 -7.960 -11.405 1.00 0.00 O ATOM 194 CB ASN A 11 21.049 -8.613 -8.073 1.00 0.00 C ATOM 195 CG ASN A 11 20.182 -7.377 -7.854 1.00 0.00 C ATOM 196 OD1 ASN A 11 19.862 -6.635 -8.764 1.00 0.00 O ATOM 197 ND2 ASN A 11 19.774 -7.103 -6.641 1.00 0.00 N ATOM 0 H ASN A 11 22.374 -10.584 -8.651 1.00 0.00 H new ATOM 0 HA ASN A 11 19.932 -9.601 -9.616 1.00 0.00 H new ATOM 0 HB2 ASN A 11 20.776 -9.361 -7.329 1.00 0.00 H new ATOM 0 HB3 ASN A 11 22.088 -8.342 -7.887 1.00 0.00 H new ATOM 0 HD21 ASN A 11 19.198 -6.279 -6.471 1.00 0.00 H new ATOM 0 HD22 ASN A 11 20.032 -7.714 -5.866 1.00 0.00 H new ATOM 204 N SER A 12 22.533 -7.900 -10.750 1.00 0.00 N ATOM 205 CA SER A 12 23.035 -7.001 -11.796 1.00 0.00 C ATOM 206 C SER A 12 22.666 -7.388 -13.233 1.00 0.00 C ATOM 207 O SER A 12 22.457 -6.514 -14.073 1.00 0.00 O ATOM 208 CB SER A 12 24.553 -6.955 -11.673 1.00 0.00 C ATOM 209 OG SER A 12 25.083 -8.251 -11.895 1.00 0.00 O ATOM 0 H SER A 12 23.270 -8.229 -10.126 1.00 0.00 H new ATOM 0 HA SER A 12 22.557 -6.036 -11.630 1.00 0.00 H new ATOM 0 HB2 SER A 12 24.966 -6.252 -12.396 1.00 0.00 H new ATOM 0 HB3 SER A 12 24.838 -6.598 -10.683 1.00 0.00 H new ATOM 0 HG SER A 12 26.060 -8.223 -11.818 1.00 0.00 H new ATOM 215 N SER A 13 22.561 -8.694 -13.521 1.00 0.00 N ATOM 216 CA SER A 13 22.320 -9.201 -14.882 1.00 0.00 C ATOM 217 C SER A 13 20.862 -9.081 -15.317 1.00 0.00 C ATOM 218 O SER A 13 20.592 -8.895 -16.494 1.00 0.00 O ATOM 219 CB SER A 13 22.798 -10.652 -14.995 1.00 0.00 C ATOM 220 OG SER A 13 21.840 -11.571 -14.457 1.00 0.00 O ATOM 0 H SER A 13 22.641 -9.429 -12.818 1.00 0.00 H new ATOM 0 HA SER A 13 22.896 -8.572 -15.561 1.00 0.00 H new ATOM 0 HB2 SER A 13 22.985 -10.893 -16.042 1.00 0.00 H new ATOM 0 HB3 SER A 13 23.746 -10.765 -14.468 1.00 0.00 H new ATOM 0 HG SER A 13 21.701 -11.380 -13.506 1.00 0.00 H new ATOM 226 N ARG A 14 19.915 -9.225 -14.380 1.00 0.00 N ATOM 227 CA ARG A 14 18.466 -9.334 -14.678 1.00 0.00 C ATOM 228 C ARG A 14 17.607 -8.571 -13.679 1.00 0.00 C ATOM 229 O ARG A 14 16.882 -7.680 -14.095 1.00 0.00 O ATOM 230 CB ARG A 14 18.106 -10.832 -14.795 1.00 0.00 C ATOM 231 CG ARG A 14 18.226 -11.348 -16.241 1.00 0.00 C ATOM 232 CD ARG A 14 18.432 -12.863 -16.293 1.00 0.00 C ATOM 233 NE ARG A 14 19.748 -13.218 -15.712 1.00 0.00 N ATOM 234 CZ ARG A 14 20.190 -14.420 -15.405 1.00 0.00 C ATOM 235 NH1 ARG A 14 19.545 -15.501 -15.724 1.00 0.00 N ATOM 236 NH2 ARG A 14 21.330 -14.532 -14.786 1.00 0.00 N ATOM 0 H ARG A 14 20.127 -9.270 -13.383 1.00 0.00 H new ATOM 0 HA ARG A 14 18.247 -8.852 -15.631 1.00 0.00 H new ATOM 0 HB2 ARG A 14 18.763 -11.413 -14.148 1.00 0.00 H new ATOM 0 HB3 ARG A 14 17.088 -10.988 -14.439 1.00 0.00 H new ATOM 0 HG2 ARG A 14 17.325 -11.085 -16.796 1.00 0.00 H new ATOM 0 HG3 ARG A 14 19.061 -10.851 -16.735 1.00 0.00 H new ATOM 0 HD2 ARG A 14 17.636 -13.365 -15.744 1.00 0.00 H new ATOM 0 HD3 ARG A 14 18.376 -13.210 -17.325 1.00 0.00 H new ATOM 0 HE ARG A 14 20.385 -12.442 -15.529 1.00 0.00 H new ATOM 0 HH11 ARG A 14 18.662 -15.437 -16.231 1.00 0.00 H new ATOM 0 HH12 ARG A 14 19.921 -16.414 -15.468 1.00 0.00 H new ATOM 0 HH21 ARG A 14 21.865 -13.697 -14.547 1.00 0.00 H new ATOM 0 HH22 ARG A 14 21.688 -15.455 -14.540 1.00 0.00 H new ATOM 250 N SER A 15 17.710 -8.829 -12.374 1.00 0.00 N ATOM 251 CA SER A 15 16.903 -8.123 -11.351 1.00 0.00 C ATOM 252 C SER A 15 17.050 -6.605 -11.407 1.00 0.00 C ATOM 253 O SER A 15 16.065 -5.886 -11.328 1.00 0.00 O ATOM 254 CB SER A 15 17.283 -8.573 -9.951 1.00 0.00 C ATOM 255 OG SER A 15 17.225 -9.974 -9.896 1.00 0.00 O ATOM 0 H SER A 15 18.347 -9.526 -11.988 1.00 0.00 H new ATOM 0 HA SER A 15 15.868 -8.381 -11.577 1.00 0.00 H new ATOM 0 HB2 SER A 15 18.286 -8.227 -9.702 1.00 0.00 H new ATOM 0 HB3 SER A 15 16.604 -8.138 -9.217 1.00 0.00 H new ATOM 0 HG SER A 15 17.419 -10.274 -8.983 1.00 0.00 H new ATOM 261 N GLN A 16 18.265 -6.119 -11.620 1.00 0.00 N ATOM 262 CA GLN A 16 18.594 -4.713 -11.841 1.00 0.00 C ATOM 263 C GLN A 16 18.041 -4.157 -13.156 1.00 0.00 C ATOM 264 O GLN A 16 17.572 -3.019 -13.196 1.00 0.00 O ATOM 265 CB GLN A 16 20.119 -4.632 -11.776 1.00 0.00 C ATOM 266 CG GLN A 16 20.588 -3.240 -11.351 1.00 0.00 C ATOM 267 CD GLN A 16 22.071 -3.213 -11.023 1.00 0.00 C ATOM 268 OE1 GLN A 16 22.923 -3.617 -11.796 1.00 0.00 O ATOM 269 NE2 GLN A 16 22.437 -2.746 -9.855 1.00 0.00 N ATOM 0 H GLN A 16 19.088 -6.721 -11.645 1.00 0.00 H new ATOM 0 HA GLN A 16 18.124 -4.089 -11.081 1.00 0.00 H new ATOM 0 HB2 GLN A 16 20.494 -5.374 -11.072 1.00 0.00 H new ATOM 0 HB3 GLN A 16 20.539 -4.877 -12.751 1.00 0.00 H new ATOM 0 HG2 GLN A 16 20.381 -2.528 -12.150 1.00 0.00 H new ATOM 0 HG3 GLN A 16 20.018 -2.916 -10.480 1.00 0.00 H new ATOM 0 HE21 GLN A 16 21.734 -2.405 -9.199 1.00 0.00 H new ATOM 0 HE22 GLN A 16 23.425 -2.723 -9.602 1.00 0.00 H new ATOM 278 N MET A 17 18.003 -4.974 -14.218 1.00 0.00 N ATOM 279 CA MET A 17 17.349 -4.604 -15.478 1.00 0.00 C ATOM 280 C MET A 17 15.837 -4.437 -15.272 1.00 0.00 C ATOM 281 O MET A 17 15.273 -3.389 -15.572 1.00 0.00 O ATOM 282 CB MET A 17 17.679 -5.614 -16.599 1.00 0.00 C ATOM 283 CG MET A 17 19.182 -5.609 -16.928 1.00 0.00 C ATOM 284 SD MET A 17 19.596 -5.751 -18.691 1.00 0.00 S ATOM 285 CE MET A 17 18.952 -7.398 -19.085 1.00 0.00 C ATOM 0 H MET A 17 18.422 -5.904 -14.227 1.00 0.00 H new ATOM 0 HA MET A 17 17.742 -3.640 -15.801 1.00 0.00 H new ATOM 0 HB2 MET A 17 17.375 -6.615 -16.292 1.00 0.00 H new ATOM 0 HB3 MET A 17 17.107 -5.368 -17.494 1.00 0.00 H new ATOM 0 HG2 MET A 17 19.617 -4.687 -16.543 1.00 0.00 H new ATOM 0 HG3 MET A 17 19.656 -6.432 -16.394 1.00 0.00 H new ATOM 0 HE1 MET A 17 19.629 -7.897 -19.778 1.00 0.00 H new ATOM 0 HE2 MET A 17 18.871 -7.985 -18.170 1.00 0.00 H new ATOM 0 HE3 MET A 17 17.968 -7.304 -19.544 1.00 0.00 H new ATOM 295 N ALA A 18 15.187 -5.424 -14.655 1.00 0.00 N ATOM 296 CA ALA A 18 13.770 -5.342 -14.302 1.00 0.00 C ATOM 297 C ALA A 18 13.477 -4.272 -13.246 1.00 0.00 C ATOM 298 O ALA A 18 12.391 -3.707 -13.261 1.00 0.00 O ATOM 299 CB ALA A 18 13.315 -6.728 -13.847 1.00 0.00 C ATOM 0 H ALA A 18 15.628 -6.303 -14.386 1.00 0.00 H new ATOM 0 HA ALA A 18 13.205 -5.030 -15.180 1.00 0.00 H new ATOM 0 HB1 ALA A 18 12.259 -6.694 -13.577 1.00 0.00 H new ATOM 0 HB2 ALA A 18 13.460 -7.443 -14.657 1.00 0.00 H new ATOM 0 HB3 ALA A 18 13.901 -7.037 -12.981 1.00 0.00 H new ATOM 305 N GLU A 19 14.437 -3.913 -12.389 1.00 0.00 N ATOM 306 CA GLU A 19 14.226 -2.875 -11.377 1.00 0.00 C ATOM 307 C GLU A 19 14.159 -1.531 -12.075 1.00 0.00 C ATOM 308 O GLU A 19 13.191 -0.809 -11.896 1.00 0.00 O ATOM 309 CB GLU A 19 15.358 -2.940 -10.348 1.00 0.00 C ATOM 310 CG GLU A 19 15.401 -1.817 -9.299 1.00 0.00 C ATOM 311 CD GLU A 19 16.790 -1.797 -8.652 1.00 0.00 C ATOM 312 OE1 GLU A 19 17.729 -1.357 -9.350 1.00 0.00 O ATOM 313 OE2 GLU A 19 16.944 -2.231 -7.484 1.00 0.00 O ATOM 0 H GLU A 19 15.369 -4.327 -12.376 1.00 0.00 H new ATOM 0 HA GLU A 19 13.289 -3.026 -10.842 1.00 0.00 H new ATOM 0 HB2 GLU A 19 15.287 -3.893 -9.824 1.00 0.00 H new ATOM 0 HB3 GLU A 19 16.307 -2.941 -10.885 1.00 0.00 H new ATOM 0 HG2 GLU A 19 15.189 -0.856 -9.767 1.00 0.00 H new ATOM 0 HG3 GLU A 19 14.634 -1.979 -8.541 1.00 0.00 H new ATOM 320 N GLY A 20 15.121 -1.227 -12.949 1.00 0.00 N ATOM 321 CA GLY A 20 15.107 0.020 -13.712 1.00 0.00 C ATOM 322 C GLY A 20 13.911 0.128 -14.654 1.00 0.00 C ATOM 323 O GLY A 20 13.268 1.174 -14.690 1.00 0.00 O ATOM 0 H GLY A 20 15.920 -1.829 -13.145 1.00 0.00 H new ATOM 0 HA2 GLY A 20 15.095 0.863 -13.021 1.00 0.00 H new ATOM 0 HA3 GLY A 20 16.027 0.096 -14.291 1.00 0.00 H new ATOM 327 N PHE A 21 13.530 -0.946 -15.353 1.00 0.00 N ATOM 328 CA PHE A 21 12.291 -0.946 -16.145 1.00 0.00 C ATOM 329 C PHE A 21 11.050 -0.752 -15.276 1.00 0.00 C ATOM 330 O PHE A 21 10.189 0.041 -15.627 1.00 0.00 O ATOM 331 CB PHE A 21 12.187 -2.233 -16.981 1.00 0.00 C ATOM 332 CG PHE A 21 12.769 -2.136 -18.373 1.00 0.00 C ATOM 333 CD1 PHE A 21 12.166 -1.276 -19.309 1.00 0.00 C ATOM 334 CD2 PHE A 21 13.865 -2.929 -18.758 1.00 0.00 C ATOM 335 CE1 PHE A 21 12.679 -1.178 -20.610 1.00 0.00 C ATOM 336 CE2 PHE A 21 14.371 -2.838 -20.064 1.00 0.00 C ATOM 337 CZ PHE A 21 13.786 -1.957 -20.987 1.00 0.00 C ATOM 0 H PHE A 21 14.055 -1.820 -15.388 1.00 0.00 H new ATOM 0 HA PHE A 21 12.336 -0.093 -16.823 1.00 0.00 H new ATOM 0 HB2 PHE A 21 12.692 -3.038 -16.447 1.00 0.00 H new ATOM 0 HB3 PHE A 21 11.137 -2.513 -17.061 1.00 0.00 H new ATOM 0 HD1 PHE A 21 11.305 -0.689 -19.024 1.00 0.00 H new ATOM 0 HD2 PHE A 21 14.317 -3.607 -18.049 1.00 0.00 H new ATOM 0 HE1 PHE A 21 12.224 -0.505 -21.321 1.00 0.00 H new ATOM 0 HE2 PHE A 21 15.212 -3.447 -20.359 1.00 0.00 H new ATOM 0 HZ PHE A 21 14.187 -1.878 -21.987 1.00 0.00 H new ATOM 347 N ALA A 22 10.939 -1.410 -14.122 1.00 0.00 N ATOM 348 CA ALA A 22 9.728 -1.305 -13.304 1.00 0.00 C ATOM 349 C ALA A 22 9.644 0.072 -12.624 1.00 0.00 C ATOM 350 O ALA A 22 8.582 0.683 -12.567 1.00 0.00 O ATOM 351 CB ALA A 22 9.709 -2.503 -12.346 1.00 0.00 C ATOM 0 H ALA A 22 11.663 -2.015 -13.735 1.00 0.00 H new ATOM 0 HA ALA A 22 8.823 -1.356 -13.910 1.00 0.00 H new ATOM 0 HB1 ALA A 22 8.817 -2.455 -11.721 1.00 0.00 H new ATOM 0 HB2 ALA A 22 9.699 -3.429 -12.921 1.00 0.00 H new ATOM 0 HB3 ALA A 22 10.597 -2.478 -11.714 1.00 0.00 H new ATOM 357 N LYS A 23 10.799 0.611 -12.222 1.00 0.00 N ATOM 358 CA LYS A 23 10.993 1.976 -11.716 1.00 0.00 C ATOM 359 C LYS A 23 10.531 3.009 -12.746 1.00 0.00 C ATOM 360 O LYS A 23 9.733 3.877 -12.422 1.00 0.00 O ATOM 361 CB LYS A 23 12.489 2.122 -11.400 1.00 0.00 C ATOM 362 CG LYS A 23 12.864 3.374 -10.609 1.00 0.00 C ATOM 363 CD LYS A 23 14.401 3.441 -10.543 1.00 0.00 C ATOM 364 CE LYS A 23 14.954 4.538 -9.623 1.00 0.00 C ATOM 365 NZ LYS A 23 14.604 5.923 -10.066 1.00 0.00 N ATOM 0 H LYS A 23 11.670 0.081 -12.241 1.00 0.00 H new ATOM 0 HA LYS A 23 10.397 2.152 -10.820 1.00 0.00 H new ATOM 0 HB2 LYS A 23 12.813 1.246 -10.839 1.00 0.00 H new ATOM 0 HB3 LYS A 23 13.044 2.123 -12.338 1.00 0.00 H new ATOM 0 HG2 LYS A 23 12.462 4.266 -11.091 1.00 0.00 H new ATOM 0 HG3 LYS A 23 12.439 3.335 -9.606 1.00 0.00 H new ATOM 0 HD2 LYS A 23 14.779 2.476 -10.205 1.00 0.00 H new ATOM 0 HD3 LYS A 23 14.788 3.600 -11.549 1.00 0.00 H new ATOM 0 HE2 LYS A 23 14.573 4.381 -8.614 1.00 0.00 H new ATOM 0 HE3 LYS A 23 16.039 4.445 -9.572 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 15.008 6.613 -9.401 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 14.990 6.091 -11.017 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 13.570 6.029 -10.089 1.00 0.00 H new ATOM 379 N THR A 24 10.978 2.871 -13.996 1.00 0.00 N ATOM 380 CA THR A 24 10.639 3.806 -15.087 1.00 0.00 C ATOM 381 C THR A 24 9.248 3.607 -15.697 1.00 0.00 C ATOM 382 O THR A 24 8.679 4.573 -16.210 1.00 0.00 O ATOM 383 CB THR A 24 11.705 3.798 -16.180 1.00 0.00 C ATOM 384 OG1 THR A 24 11.943 2.504 -16.672 1.00 0.00 O ATOM 385 CG2 THR A 24 13.021 4.362 -15.652 1.00 0.00 C ATOM 0 H THR A 24 11.588 2.107 -14.288 1.00 0.00 H new ATOM 0 HA THR A 24 10.614 4.785 -14.609 1.00 0.00 H new ATOM 0 HB THR A 24 11.325 4.420 -16.990 1.00 0.00 H new ATOM 0 HG1 THR A 24 12.490 2.005 -16.030 1.00 0.00 H new ATOM 0 HG21 THR A 24 13.768 4.348 -16.446 1.00 0.00 H new ATOM 0 HG22 THR A 24 12.868 5.388 -15.316 1.00 0.00 H new ATOM 0 HG23 THR A 24 13.368 3.754 -14.817 1.00 0.00 H new ATOM 393 N LEU A 25 8.662 2.404 -15.609 1.00 0.00 N ATOM 394 CA LEU A 25 7.317 2.120 -16.148 1.00 0.00 C ATOM 395 C LEU A 25 6.191 2.387 -15.131 1.00 0.00 C ATOM 396 O LEU A 25 5.075 2.718 -15.527 1.00 0.00 O ATOM 397 CB LEU A 25 7.253 0.673 -16.686 1.00 0.00 C ATOM 398 CG LEU A 25 8.062 0.454 -17.981 1.00 0.00 C ATOM 399 CD1 LEU A 25 8.254 -1.043 -18.228 1.00 0.00 C ATOM 400 CD2 LEU A 25 7.352 1.060 -19.193 1.00 0.00 C ATOM 0 H LEU A 25 9.103 1.599 -15.164 1.00 0.00 H new ATOM 0 HA LEU A 25 7.148 2.814 -16.971 1.00 0.00 H new ATOM 0 HB2 LEU A 25 7.623 -0.007 -15.918 1.00 0.00 H new ATOM 0 HB3 LEU A 25 6.212 0.410 -16.870 1.00 0.00 H new ATOM 0 HG LEU A 25 9.026 0.946 -17.853 1.00 0.00 H new ATOM 0 HD11 LEU A 25 8.826 -1.190 -19.144 1.00 0.00 H new ATOM 0 HD12 LEU A 25 8.792 -1.484 -17.389 1.00 0.00 H new ATOM 0 HD13 LEU A 25 7.281 -1.523 -18.327 1.00 0.00 H new ATOM 0 HD21 LEU A 25 7.949 0.888 -20.088 1.00 0.00 H new ATOM 0 HD22 LEU A 25 6.375 0.593 -19.313 1.00 0.00 H new ATOM 0 HD23 LEU A 25 7.226 2.132 -19.042 1.00 0.00 H new ATOM 412 N GLY A 26 6.488 2.261 -13.831 1.00 0.00 N ATOM 413 CA GLY A 26 5.565 2.571 -12.726 1.00 0.00 C ATOM 414 C GLY A 26 5.709 4.017 -12.245 1.00 0.00 C ATOM 415 O GLY A 26 4.822 4.843 -12.454 1.00 0.00 O ATOM 0 H GLY A 26 7.398 1.933 -13.508 1.00 0.00 H new ATOM 0 HA2 GLY A 26 4.539 2.398 -13.052 1.00 0.00 H new ATOM 0 HA3 GLY A 26 5.754 1.892 -11.895 1.00 0.00 H new ATOM 419 N ALA A 27 6.858 4.301 -11.620 1.00 0.00 N ATOM 420 CA ALA A 27 7.276 5.574 -11.028 1.00 0.00 C ATOM 421 C ALA A 27 6.296 6.181 -9.994 1.00 0.00 C ATOM 422 O ALA A 27 5.404 6.971 -10.315 1.00 0.00 O ATOM 423 CB ALA A 27 7.681 6.548 -12.149 1.00 0.00 C ATOM 0 H ALA A 27 7.577 3.586 -11.507 1.00 0.00 H new ATOM 0 HA ALA A 27 8.149 5.367 -10.409 1.00 0.00 H new ATOM 0 HB1 ALA A 27 7.993 7.497 -11.712 1.00 0.00 H new ATOM 0 HB2 ALA A 27 8.507 6.123 -12.720 1.00 0.00 H new ATOM 0 HB3 ALA A 27 6.831 6.715 -12.810 1.00 0.00 H new ATOM 429 N GLY A 28 6.497 5.830 -8.717 1.00 0.00 N ATOM 430 CA GLY A 28 5.826 6.449 -7.560 1.00 0.00 C ATOM 431 C GLY A 28 4.453 5.873 -7.181 1.00 0.00 C ATOM 432 O GLY A 28 3.927 6.225 -6.123 1.00 0.00 O ATOM 0 H GLY A 28 7.146 5.090 -8.450 1.00 0.00 H new ATOM 0 HA2 GLY A 28 6.484 6.361 -6.696 1.00 0.00 H new ATOM 0 HA3 GLY A 28 5.706 7.513 -7.763 1.00 0.00 H new ATOM 436 N LYS A 29 3.884 4.964 -7.991 1.00 0.00 N ATOM 437 CA LYS A 29 2.621 4.256 -7.671 1.00 0.00 C ATOM 438 C LYS A 29 2.823 3.282 -6.506 1.00 0.00 C ATOM 439 O LYS A 29 2.052 3.259 -5.549 1.00 0.00 O ATOM 440 CB LYS A 29 2.073 3.494 -8.899 1.00 0.00 C ATOM 441 CG LYS A 29 2.113 4.252 -10.235 1.00 0.00 C ATOM 442 CD LYS A 29 1.464 5.644 -10.208 1.00 0.00 C ATOM 443 CE LYS A 29 -0.048 5.574 -9.944 1.00 0.00 C ATOM 444 NZ LYS A 29 -0.676 6.925 -9.979 1.00 0.00 N ATOM 0 H LYS A 29 4.284 4.695 -8.890 1.00 0.00 H new ATOM 0 HA LYS A 29 1.891 5.012 -7.381 1.00 0.00 H new ATOM 0 HB2 LYS A 29 2.640 2.570 -9.011 1.00 0.00 H new ATOM 0 HB3 LYS A 29 1.040 3.211 -8.695 1.00 0.00 H new ATOM 0 HG2 LYS A 29 3.153 4.358 -10.545 1.00 0.00 H new ATOM 0 HG3 LYS A 29 1.614 3.649 -10.993 1.00 0.00 H new ATOM 0 HD2 LYS A 29 1.938 6.249 -9.436 1.00 0.00 H new ATOM 0 HD3 LYS A 29 1.642 6.145 -11.160 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -0.519 4.934 -10.691 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -0.227 5.114 -8.972 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -1.696 6.838 -9.797 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -0.244 7.528 -9.250 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -0.527 7.353 -10.915 1.00 0.00 H new ATOM 458 N ILE A 30 3.906 2.512 -6.621 1.00 0.00 N ATOM 459 CA ILE A 30 4.426 1.536 -5.648 1.00 0.00 C ATOM 460 C ILE A 30 5.969 1.598 -5.592 1.00 0.00 C ATOM 461 O ILE A 30 6.574 2.409 -6.295 1.00 0.00 O ATOM 462 CB ILE A 30 3.878 0.113 -5.962 1.00 0.00 C ATOM 463 CG1 ILE A 30 4.218 -0.459 -7.362 1.00 0.00 C ATOM 464 CG2 ILE A 30 2.344 0.071 -5.862 1.00 0.00 C ATOM 465 CD1 ILE A 30 5.698 -0.664 -7.706 1.00 0.00 C ATOM 0 H ILE A 30 4.489 2.553 -7.457 1.00 0.00 H new ATOM 0 HA ILE A 30 4.071 1.791 -4.650 1.00 0.00 H new ATOM 0 HB ILE A 30 4.380 -0.497 -5.212 1.00 0.00 H new ATOM 0 HG12 ILE A 30 3.714 -1.420 -7.464 1.00 0.00 H new ATOM 0 HG13 ILE A 30 3.789 0.207 -8.110 1.00 0.00 H new ATOM 0 HG21 ILE A 30 1.992 -0.936 -6.087 1.00 0.00 H new ATOM 0 HG22 ILE A 30 2.038 0.346 -4.853 1.00 0.00 H new ATOM 0 HG23 ILE A 30 1.913 0.774 -6.576 1.00 0.00 H new ATOM 0 HD11 ILE A 30 5.784 -1.069 -8.714 1.00 0.00 H new ATOM 0 HD12 ILE A 30 6.220 0.292 -7.653 1.00 0.00 H new ATOM 0 HD13 ILE A 30 6.143 -1.361 -6.996 1.00 0.00 H new ATOM 477 N ALA A 31 6.615 0.717 -4.813 1.00 0.00 N ATOM 478 CA ALA A 31 8.080 0.579 -4.809 1.00 0.00 C ATOM 479 C ALA A 31 8.548 -0.726 -5.455 1.00 0.00 C ATOM 480 O ALA A 31 8.111 -1.818 -5.090 1.00 0.00 O ATOM 481 CB ALA A 31 8.637 0.690 -3.390 1.00 0.00 C ATOM 0 H ALA A 31 6.140 0.083 -4.171 1.00 0.00 H new ATOM 0 HA ALA A 31 8.469 1.400 -5.411 1.00 0.00 H new ATOM 0 HB1 ALA A 31 9.722 0.585 -3.416 1.00 0.00 H new ATOM 0 HB2 ALA A 31 8.377 1.662 -2.972 1.00 0.00 H new ATOM 0 HB3 ALA A 31 8.210 -0.098 -2.769 1.00 0.00 H new ATOM 487 N VAL A 32 9.476 -0.611 -6.399 1.00 0.00 N ATOM 488 CA VAL A 32 10.198 -1.733 -6.993 1.00 0.00 C ATOM 489 C VAL A 32 11.550 -1.996 -6.320 1.00 0.00 C ATOM 490 O VAL A 32 12.189 -1.076 -5.807 1.00 0.00 O ATOM 491 CB VAL A 32 10.358 -1.491 -8.490 1.00 0.00 C ATOM 492 CG1 VAL A 32 8.989 -1.280 -9.146 1.00 0.00 C ATOM 493 CG2 VAL A 32 11.299 -0.341 -8.867 1.00 0.00 C ATOM 0 H VAL A 32 9.756 0.291 -6.784 1.00 0.00 H new ATOM 0 HA VAL A 32 9.609 -2.636 -6.830 1.00 0.00 H new ATOM 0 HB VAL A 32 10.834 -2.394 -8.871 1.00 0.00 H new ATOM 0 HG11 VAL A 32 9.120 -1.108 -10.214 1.00 0.00 H new ATOM 0 HG12 VAL A 32 8.372 -2.166 -8.994 1.00 0.00 H new ATOM 0 HG13 VAL A 32 8.500 -0.416 -8.697 1.00 0.00 H new ATOM 0 HG21 VAL A 32 11.345 -0.250 -9.952 1.00 0.00 H new ATOM 0 HG22 VAL A 32 10.925 0.590 -8.440 1.00 0.00 H new ATOM 0 HG23 VAL A 32 12.296 -0.544 -8.477 1.00 0.00 H new ATOM 503 N THR A 33 11.996 -3.257 -6.350 1.00 0.00 N ATOM 504 CA THR A 33 13.193 -3.716 -5.629 1.00 0.00 C ATOM 505 C THR A 33 13.900 -4.845 -6.382 1.00 0.00 C ATOM 506 O THR A 33 13.280 -5.565 -7.166 1.00 0.00 O ATOM 507 CB THR A 33 12.854 -4.163 -4.185 1.00 0.00 C ATOM 508 OG1 THR A 33 11.627 -3.643 -3.725 1.00 0.00 O ATOM 509 CG2 THR A 33 13.910 -3.696 -3.185 1.00 0.00 C ATOM 0 H THR A 33 11.533 -3.996 -6.880 1.00 0.00 H new ATOM 0 HA THR A 33 13.872 -2.866 -5.569 1.00 0.00 H new ATOM 0 HB THR A 33 12.809 -5.251 -4.240 1.00 0.00 H new ATOM 0 HG1 THR A 33 10.889 -4.070 -4.209 1.00 0.00 H new ATOM 0 HG21 THR A 33 13.636 -4.029 -2.184 1.00 0.00 H new ATOM 0 HG22 THR A 33 14.878 -4.117 -3.455 1.00 0.00 H new ATOM 0 HG23 THR A 33 13.970 -2.608 -3.201 1.00 0.00 H new ATOM 517 N SER A 34 15.196 -5.025 -6.132 1.00 0.00 N ATOM 518 CA SER A 34 16.039 -6.070 -6.736 1.00 0.00 C ATOM 519 C SER A 34 16.799 -6.930 -5.713 1.00 0.00 C ATOM 520 O SER A 34 17.293 -6.437 -4.699 1.00 0.00 O ATOM 521 CB SER A 34 17.037 -5.448 -7.714 1.00 0.00 C ATOM 522 OG SER A 34 17.980 -4.635 -7.042 1.00 0.00 O ATOM 0 H SER A 34 15.711 -4.430 -5.482 1.00 0.00 H new ATOM 0 HA SER A 34 15.352 -6.736 -7.258 1.00 0.00 H new ATOM 0 HB2 SER A 34 17.557 -6.237 -8.257 1.00 0.00 H new ATOM 0 HB3 SER A 34 16.501 -4.852 -8.453 1.00 0.00 H new ATOM 0 HG SER A 34 17.917 -3.716 -7.376 1.00 0.00 H new ATOM 528 N SER A 35 16.914 -8.230 -6.005 1.00 0.00 N ATOM 529 CA SER A 35 17.554 -9.265 -5.183 1.00 0.00 C ATOM 530 C SER A 35 18.225 -10.302 -6.083 1.00 0.00 C ATOM 531 O SER A 35 18.040 -10.302 -7.302 1.00 0.00 O ATOM 532 CB SER A 35 16.489 -9.900 -4.284 1.00 0.00 C ATOM 533 OG SER A 35 16.986 -11.012 -3.571 1.00 0.00 O ATOM 0 H SER A 35 16.540 -8.612 -6.874 1.00 0.00 H new ATOM 0 HA SER A 35 18.330 -8.830 -4.553 1.00 0.00 H new ATOM 0 HB2 SER A 35 16.119 -9.155 -3.580 1.00 0.00 H new ATOM 0 HB3 SER A 35 15.640 -10.211 -4.893 1.00 0.00 H new ATOM 0 HG SER A 35 16.521 -11.084 -2.711 1.00 0.00 H new ATOM 539 N GLY A 36 19.010 -11.208 -5.513 1.00 0.00 N ATOM 540 CA GLY A 36 19.527 -12.366 -6.241 1.00 0.00 C ATOM 541 C GLY A 36 20.610 -13.146 -5.497 1.00 0.00 C ATOM 542 O GLY A 36 21.079 -12.706 -4.449 1.00 0.00 O ATOM 0 H GLY A 36 19.306 -11.164 -4.538 1.00 0.00 H new ATOM 0 HA2 GLY A 36 18.699 -13.039 -6.464 1.00 0.00 H new ATOM 0 HA3 GLY A 36 19.930 -12.029 -7.196 1.00 0.00 H new ATOM 546 N LEU A 37 20.996 -14.314 -6.020 1.00 0.00 N ATOM 547 CA LEU A 37 21.951 -15.225 -5.350 1.00 0.00 C ATOM 548 C LEU A 37 23.337 -14.568 -5.164 1.00 0.00 C ATOM 549 O LEU A 37 24.002 -14.762 -4.146 1.00 0.00 O ATOM 550 CB LEU A 37 22.076 -16.549 -6.137 1.00 0.00 C ATOM 551 CG LEU A 37 20.766 -17.302 -6.460 1.00 0.00 C ATOM 552 CD1 LEU A 37 21.078 -18.651 -7.104 1.00 0.00 C ATOM 553 CD2 LEU A 37 19.898 -17.553 -5.226 1.00 0.00 C ATOM 0 H LEU A 37 20.660 -14.661 -6.918 1.00 0.00 H new ATOM 0 HA LEU A 37 21.558 -15.442 -4.357 1.00 0.00 H new ATOM 0 HB2 LEU A 37 22.585 -16.337 -7.077 1.00 0.00 H new ATOM 0 HB3 LEU A 37 22.721 -17.220 -5.570 1.00 0.00 H new ATOM 0 HG LEU A 37 20.210 -16.659 -7.142 1.00 0.00 H new ATOM 0 HD11 LEU A 37 20.147 -19.172 -7.327 1.00 0.00 H new ATOM 0 HD12 LEU A 37 21.635 -18.493 -8.027 1.00 0.00 H new ATOM 0 HD13 LEU A 37 21.675 -19.252 -6.418 1.00 0.00 H new ATOM 0 HD21 LEU A 37 18.993 -18.085 -5.520 1.00 0.00 H new ATOM 0 HD22 LEU A 37 20.454 -18.153 -4.506 1.00 0.00 H new ATOM 0 HD23 LEU A 37 19.627 -16.600 -4.772 1.00 0.00 H new ATOM 565 N GLU A 38 23.729 -13.750 -6.136 1.00 0.00 N ATOM 566 CA GLU A 38 24.871 -12.841 -6.155 1.00 0.00 C ATOM 567 C GLU A 38 24.316 -11.449 -6.484 1.00 0.00 C ATOM 568 O GLU A 38 23.660 -11.259 -7.509 1.00 0.00 O ATOM 569 CB GLU A 38 25.885 -13.360 -7.192 1.00 0.00 C ATOM 570 CG GLU A 38 27.114 -12.463 -7.362 1.00 0.00 C ATOM 571 CD GLU A 38 27.929 -12.336 -6.060 1.00 0.00 C ATOM 572 OE1 GLU A 38 28.838 -13.169 -5.822 1.00 0.00 O ATOM 573 OE2 GLU A 38 27.655 -11.402 -5.269 1.00 0.00 O ATOM 0 H GLU A 38 23.207 -13.702 -7.011 1.00 0.00 H new ATOM 0 HA GLU A 38 25.400 -12.784 -5.203 1.00 0.00 H new ATOM 0 HB2 GLU A 38 26.213 -14.357 -6.897 1.00 0.00 H new ATOM 0 HB3 GLU A 38 25.385 -13.461 -8.155 1.00 0.00 H new ATOM 0 HG2 GLU A 38 27.751 -12.868 -8.149 1.00 0.00 H new ATOM 0 HG3 GLU A 38 26.796 -11.472 -7.687 1.00 0.00 H new ATOM 580 N SER A 39 24.535 -10.459 -5.620 1.00 0.00 N ATOM 581 CA SER A 39 24.087 -9.083 -5.876 1.00 0.00 C ATOM 582 C SER A 39 24.950 -8.415 -6.952 1.00 0.00 C ATOM 583 O SER A 39 24.443 -7.794 -7.887 1.00 0.00 O ATOM 584 CB SER A 39 24.110 -8.292 -4.569 1.00 0.00 C ATOM 585 OG SER A 39 25.398 -8.350 -3.975 1.00 0.00 O ATOM 0 H SER A 39 25.022 -10.581 -4.732 1.00 0.00 H new ATOM 0 HA SER A 39 23.065 -9.103 -6.255 1.00 0.00 H new ATOM 0 HB2 SER A 39 23.838 -7.254 -4.760 1.00 0.00 H new ATOM 0 HB3 SER A 39 23.367 -8.694 -3.880 1.00 0.00 H new ATOM 0 HG SER A 39 25.396 -7.837 -3.140 1.00 0.00 H new ATOM 591 N SER A 40 26.257 -8.644 -6.862 1.00 0.00 N ATOM 592 CA SER A 40 27.299 -8.092 -7.739 1.00 0.00 C ATOM 593 C SER A 40 27.295 -6.541 -7.821 1.00 0.00 C ATOM 594 O SER A 40 26.660 -5.853 -7.016 1.00 0.00 O ATOM 595 CB SER A 40 27.201 -8.761 -9.122 1.00 0.00 C ATOM 596 OG SER A 40 28.403 -8.564 -9.853 1.00 0.00 O ATOM 0 H SER A 40 26.644 -9.251 -6.139 1.00 0.00 H new ATOM 0 HA SER A 40 28.267 -8.327 -7.297 1.00 0.00 H new ATOM 0 HB2 SER A 40 27.010 -9.828 -9.004 1.00 0.00 H new ATOM 0 HB3 SER A 40 26.359 -8.345 -9.675 1.00 0.00 H new ATOM 0 HG SER A 40 28.327 -8.996 -10.729 1.00 0.00 H new ATOM 602 N ARG A 41 28.035 -5.974 -8.786 1.00 0.00 N ATOM 603 CA ARG A 41 28.115 -4.532 -9.115 1.00 0.00 C ATOM 604 C ARG A 41 27.137 -4.134 -10.227 1.00 0.00 C ATOM 605 O ARG A 41 26.621 -4.999 -10.923 1.00 0.00 O ATOM 606 CB ARG A 41 29.573 -4.182 -9.493 1.00 0.00 C ATOM 607 CG ARG A 41 29.998 -4.727 -10.876 1.00 0.00 C ATOM 608 CD ARG A 41 31.464 -4.406 -11.201 1.00 0.00 C ATOM 609 NE ARG A 41 32.406 -5.133 -10.324 1.00 0.00 N ATOM 610 CZ ARG A 41 33.716 -4.959 -10.252 1.00 0.00 C ATOM 611 NH1 ARG A 41 34.341 -4.079 -10.988 1.00 0.00 N ATOM 612 NH2 ARG A 41 34.432 -5.674 -9.432 1.00 0.00 N ATOM 0 H ARG A 41 28.629 -6.536 -9.395 1.00 0.00 H new ATOM 0 HA ARG A 41 27.820 -3.959 -8.236 1.00 0.00 H new ATOM 0 HB2 ARG A 41 29.692 -3.099 -9.486 1.00 0.00 H new ATOM 0 HB3 ARG A 41 30.243 -4.581 -8.732 1.00 0.00 H new ATOM 0 HG2 ARG A 41 29.850 -5.807 -10.900 1.00 0.00 H new ATOM 0 HG3 ARG A 41 29.355 -4.300 -11.646 1.00 0.00 H new ATOM 0 HD2 ARG A 41 31.668 -4.662 -12.241 1.00 0.00 H new ATOM 0 HD3 ARG A 41 31.630 -3.334 -11.099 1.00 0.00 H new ATOM 0 HE ARG A 41 32.005 -5.842 -9.711 1.00 0.00 H new ATOM 0 HH11 ARG A 41 33.818 -3.499 -11.644 1.00 0.00 H new ATOM 0 HH12 ARG A 41 35.352 -3.972 -10.906 1.00 0.00 H new ATOM 0 HH21 ARG A 41 33.984 -6.373 -8.840 1.00 0.00 H new ATOM 0 HH22 ARG A 41 35.441 -5.535 -9.382 1.00 0.00 H new ATOM 626 N VAL A 42 26.935 -2.834 -10.471 1.00 0.00 N ATOM 627 CA VAL A 42 26.204 -2.333 -11.652 1.00 0.00 C ATOM 628 C VAL A 42 26.957 -2.784 -12.918 1.00 0.00 C ATOM 629 O VAL A 42 28.110 -2.410 -13.128 1.00 0.00 O ATOM 630 CB VAL A 42 25.999 -0.804 -11.561 1.00 0.00 C ATOM 631 CG1 VAL A 42 24.960 -0.483 -10.477 1.00 0.00 C ATOM 632 CG2 VAL A 42 27.268 -0.006 -11.217 1.00 0.00 C ATOM 0 H VAL A 42 27.273 -2.094 -9.856 1.00 0.00 H new ATOM 0 HA VAL A 42 25.200 -2.755 -11.696 1.00 0.00 H new ATOM 0 HB VAL A 42 25.677 -0.504 -12.558 1.00 0.00 H new ATOM 0 HG11 VAL A 42 24.819 0.596 -10.416 1.00 0.00 H new ATOM 0 HG12 VAL A 42 24.012 -0.959 -10.729 1.00 0.00 H new ATOM 0 HG13 VAL A 42 25.310 -0.858 -9.515 1.00 0.00 H new ATOM 0 HG21 VAL A 42 27.029 1.057 -11.175 1.00 0.00 H new ATOM 0 HG22 VAL A 42 27.651 -0.331 -10.250 1.00 0.00 H new ATOM 0 HG23 VAL A 42 28.024 -0.178 -11.983 1.00 0.00 H new ATOM 642 N HIS A 43 26.347 -3.655 -13.732 1.00 0.00 N ATOM 643 CA HIS A 43 27.055 -4.336 -14.834 1.00 0.00 C ATOM 644 C HIS A 43 27.415 -3.403 -16.010 1.00 0.00 C ATOM 645 O HIS A 43 26.530 -2.691 -16.483 1.00 0.00 O ATOM 646 CB HIS A 43 26.251 -5.564 -15.295 1.00 0.00 C ATOM 647 CG HIS A 43 26.989 -6.376 -16.319 1.00 0.00 C ATOM 648 ND1 HIS A 43 26.983 -6.148 -17.697 1.00 0.00 N ATOM 649 CD2 HIS A 43 27.879 -7.369 -16.033 1.00 0.00 C ATOM 650 CE1 HIS A 43 27.851 -7.039 -18.208 1.00 0.00 C ATOM 651 NE2 HIS A 43 28.430 -7.752 -17.231 1.00 0.00 N ATOM 0 H HIS A 43 25.362 -3.908 -13.651 1.00 0.00 H new ATOM 0 HA HIS A 43 28.015 -4.670 -14.441 1.00 0.00 H new ATOM 0 HB2 HIS A 43 26.023 -6.191 -14.433 1.00 0.00 H new ATOM 0 HB3 HIS A 43 25.299 -5.236 -15.712 1.00 0.00 H new ATOM 0 HD2 HIS A 43 28.105 -7.774 -15.058 1.00 0.00 H new ATOM 0 HE1 HIS A 43 28.054 -7.163 -19.261 1.00 0.00 H new ATOM 0 HE2 HIS A 43 29.155 -8.458 -17.356 1.00 0.00 H new ATOM 659 N PRO A 44 28.663 -3.416 -16.528 1.00 0.00 N ATOM 660 CA PRO A 44 29.140 -2.467 -17.548 1.00 0.00 C ATOM 661 C PRO A 44 28.315 -2.463 -18.842 1.00 0.00 C ATOM 662 O PRO A 44 28.030 -1.393 -19.387 1.00 0.00 O ATOM 663 CB PRO A 44 30.596 -2.864 -17.833 1.00 0.00 C ATOM 664 CG PRO A 44 30.674 -4.321 -17.383 1.00 0.00 C ATOM 665 CD PRO A 44 29.755 -4.312 -16.169 1.00 0.00 C ATOM 0 HA PRO A 44 29.042 -1.450 -17.168 1.00 0.00 H new ATOM 0 HB2 PRO A 44 30.839 -2.759 -18.890 1.00 0.00 H new ATOM 0 HB3 PRO A 44 31.296 -2.237 -17.281 1.00 0.00 H new ATOM 0 HG2 PRO A 44 30.327 -5.008 -18.155 1.00 0.00 H new ATOM 0 HG3 PRO A 44 31.691 -4.617 -17.126 1.00 0.00 H new ATOM 0 HD2 PRO A 44 29.387 -5.313 -15.946 1.00 0.00 H new ATOM 0 HD3 PRO A 44 30.279 -3.959 -15.280 1.00 0.00 H new ATOM 673 N THR A 45 27.880 -3.634 -19.319 1.00 0.00 N ATOM 674 CA THR A 45 27.065 -3.734 -20.542 1.00 0.00 C ATOM 675 C THR A 45 25.607 -3.411 -20.243 1.00 0.00 C ATOM 676 O THR A 45 24.978 -2.699 -21.022 1.00 0.00 O ATOM 677 CB THR A 45 27.219 -5.103 -21.221 1.00 0.00 C ATOM 678 OG1 THR A 45 28.594 -5.380 -21.412 1.00 0.00 O ATOM 679 CG2 THR A 45 26.547 -5.159 -22.593 1.00 0.00 C ATOM 0 H THR A 45 28.078 -4.532 -18.877 1.00 0.00 H new ATOM 0 HA THR A 45 27.433 -2.992 -21.251 1.00 0.00 H new ATOM 0 HB THR A 45 26.741 -5.833 -20.567 1.00 0.00 H new ATOM 0 HG1 THR A 45 28.695 -6.254 -21.844 1.00 0.00 H new ATOM 0 HG21 THR A 45 26.687 -6.149 -23.027 1.00 0.00 H new ATOM 0 HG22 THR A 45 25.481 -4.958 -22.485 1.00 0.00 H new ATOM 0 HG23 THR A 45 26.993 -4.410 -23.247 1.00 0.00 H new ATOM 687 N ALA A 46 25.070 -3.819 -19.086 1.00 0.00 N ATOM 688 CA ALA A 46 23.706 -3.442 -18.705 1.00 0.00 C ATOM 689 C ALA A 46 23.557 -1.922 -18.518 1.00 0.00 C ATOM 690 O ALA A 46 22.585 -1.368 -19.018 1.00 0.00 O ATOM 691 CB ALA A 46 23.274 -4.226 -17.465 1.00 0.00 C ATOM 0 H ALA A 46 25.554 -4.404 -18.405 1.00 0.00 H new ATOM 0 HA ALA A 46 23.036 -3.707 -19.523 1.00 0.00 H new ATOM 0 HB1 ALA A 46 22.259 -3.940 -17.189 1.00 0.00 H new ATOM 0 HB2 ALA A 46 23.304 -5.294 -17.681 1.00 0.00 H new ATOM 0 HB3 ALA A 46 23.951 -4.004 -16.640 1.00 0.00 H new ATOM 697 N ILE A 47 24.530 -1.218 -17.916 1.00 0.00 N ATOM 698 CA ILE A 47 24.554 0.256 -17.857 1.00 0.00 C ATOM 699 C ILE A 47 24.307 0.851 -19.251 1.00 0.00 C ATOM 700 O ILE A 47 23.402 1.666 -19.401 1.00 0.00 O ATOM 701 CB ILE A 47 25.881 0.757 -17.233 1.00 0.00 C ATOM 702 CG1 ILE A 47 25.984 0.392 -15.733 1.00 0.00 C ATOM 703 CG2 ILE A 47 26.005 2.287 -17.350 1.00 0.00 C ATOM 704 CD1 ILE A 47 27.407 0.457 -15.171 1.00 0.00 C ATOM 0 H ILE A 47 25.327 -1.656 -17.454 1.00 0.00 H new ATOM 0 HA ILE A 47 23.747 0.599 -17.209 1.00 0.00 H new ATOM 0 HB ILE A 47 26.681 0.266 -17.787 1.00 0.00 H new ATOM 0 HG12 ILE A 47 25.348 1.067 -15.161 1.00 0.00 H new ATOM 0 HG13 ILE A 47 25.593 -0.615 -15.587 1.00 0.00 H new ATOM 0 HG21 ILE A 47 26.945 2.611 -16.904 1.00 0.00 H new ATOM 0 HG22 ILE A 47 25.984 2.574 -18.401 1.00 0.00 H new ATOM 0 HG23 ILE A 47 25.174 2.760 -16.828 1.00 0.00 H new ATOM 0 HD11 ILE A 47 27.394 0.188 -14.115 1.00 0.00 H new ATOM 0 HD12 ILE A 47 28.045 -0.239 -15.715 1.00 0.00 H new ATOM 0 HD13 ILE A 47 27.796 1.469 -15.282 1.00 0.00 H new ATOM 716 N ALA A 48 25.022 0.377 -20.278 1.00 0.00 N ATOM 717 CA ALA A 48 24.824 0.818 -21.659 1.00 0.00 C ATOM 718 C ALA A 48 23.437 0.465 -22.223 1.00 0.00 C ATOM 719 O ALA A 48 22.686 1.351 -22.627 1.00 0.00 O ATOM 720 CB ALA A 48 25.937 0.220 -22.525 1.00 0.00 C ATOM 0 H ALA A 48 25.755 -0.324 -20.172 1.00 0.00 H new ATOM 0 HA ALA A 48 24.871 1.907 -21.673 1.00 0.00 H new ATOM 0 HB1 ALA A 48 25.805 0.539 -23.559 1.00 0.00 H new ATOM 0 HB2 ALA A 48 26.905 0.563 -22.161 1.00 0.00 H new ATOM 0 HB3 ALA A 48 25.894 -0.868 -22.473 1.00 0.00 H new ATOM 726 N MET A 49 23.074 -0.823 -22.243 1.00 0.00 N ATOM 727 CA MET A 49 21.842 -1.294 -22.904 1.00 0.00 C ATOM 728 C MET A 49 20.565 -0.776 -22.236 1.00 0.00 C ATOM 729 O MET A 49 19.513 -0.755 -22.875 1.00 0.00 O ATOM 730 CB MET A 49 21.764 -2.827 -22.928 1.00 0.00 C ATOM 731 CG MET A 49 22.958 -3.572 -23.552 1.00 0.00 C ATOM 732 SD MET A 49 23.359 -3.229 -25.287 1.00 0.00 S ATOM 733 CE MET A 49 24.455 -1.788 -25.148 1.00 0.00 C ATOM 0 H MET A 49 23.619 -1.567 -21.806 1.00 0.00 H new ATOM 0 HA MET A 49 21.900 -0.896 -23.917 1.00 0.00 H new ATOM 0 HB2 MET A 49 21.643 -3.177 -21.903 1.00 0.00 H new ATOM 0 HB3 MET A 49 20.863 -3.113 -23.471 1.00 0.00 H new ATOM 0 HG2 MET A 49 23.841 -3.348 -22.954 1.00 0.00 H new ATOM 0 HG3 MET A 49 22.771 -4.642 -23.457 1.00 0.00 H new ATOM 0 HE1 MET A 49 24.872 -1.552 -26.127 1.00 0.00 H new ATOM 0 HE2 MET A 49 23.887 -0.933 -24.780 1.00 0.00 H new ATOM 0 HE3 MET A 49 25.265 -2.012 -24.453 1.00 0.00 H new ATOM 743 N MET A 50 20.647 -0.393 -20.963 1.00 0.00 N ATOM 744 CA MET A 50 19.551 0.166 -20.176 1.00 0.00 C ATOM 745 C MET A 50 19.513 1.699 -20.295 1.00 0.00 C ATOM 746 O MET A 50 18.442 2.261 -20.509 1.00 0.00 O ATOM 747 CB MET A 50 19.692 -0.322 -18.726 1.00 0.00 C ATOM 748 CG MET A 50 19.664 -1.855 -18.596 1.00 0.00 C ATOM 749 SD MET A 50 18.047 -2.626 -18.887 1.00 0.00 S ATOM 750 CE MET A 50 17.055 -1.785 -17.630 1.00 0.00 C ATOM 0 H MET A 50 21.514 -0.467 -20.431 1.00 0.00 H new ATOM 0 HA MET A 50 18.592 -0.182 -20.560 1.00 0.00 H new ATOM 0 HB2 MET A 50 20.628 0.054 -18.312 1.00 0.00 H new ATOM 0 HB3 MET A 50 18.886 0.102 -18.127 1.00 0.00 H new ATOM 0 HG2 MET A 50 20.382 -2.276 -19.300 1.00 0.00 H new ATOM 0 HG3 MET A 50 20.003 -2.125 -17.596 1.00 0.00 H new ATOM 0 HE1 MET A 50 16.213 -2.417 -17.348 1.00 0.00 H new ATOM 0 HE2 MET A 50 17.671 -1.588 -16.752 1.00 0.00 H new ATOM 0 HE3 MET A 50 16.683 -0.842 -18.031 1.00 0.00 H new ATOM 760 N GLU A 51 20.662 2.388 -20.295 1.00 0.00 N ATOM 761 CA GLU A 51 20.766 3.828 -20.603 1.00 0.00 C ATOM 762 C GLU A 51 20.212 4.170 -22.000 1.00 0.00 C ATOM 763 O GLU A 51 19.541 5.189 -22.158 1.00 0.00 O ATOM 764 CB GLU A 51 22.230 4.278 -20.454 1.00 0.00 C ATOM 765 CG GLU A 51 22.463 5.747 -20.815 1.00 0.00 C ATOM 766 CD GLU A 51 23.903 6.187 -20.480 1.00 0.00 C ATOM 767 OE1 GLU A 51 24.846 5.805 -21.217 1.00 0.00 O ATOM 768 OE2 GLU A 51 24.099 6.945 -19.499 1.00 0.00 O ATOM 0 H GLU A 51 21.561 1.958 -20.078 1.00 0.00 H new ATOM 0 HA GLU A 51 20.148 4.375 -19.891 1.00 0.00 H new ATOM 0 HB2 GLU A 51 22.549 4.111 -19.425 1.00 0.00 H new ATOM 0 HB3 GLU A 51 22.859 3.653 -21.088 1.00 0.00 H new ATOM 0 HG2 GLU A 51 22.273 5.897 -21.878 1.00 0.00 H new ATOM 0 HG3 GLU A 51 21.754 6.373 -20.273 1.00 0.00 H new ATOM 775 N GLU A 52 20.387 3.285 -22.990 1.00 0.00 N ATOM 776 CA GLU A 52 19.753 3.382 -24.318 1.00 0.00 C ATOM 777 C GLU A 52 18.222 3.536 -24.246 1.00 0.00 C ATOM 778 O GLU A 52 17.630 4.212 -25.091 1.00 0.00 O ATOM 779 CB GLU A 52 20.077 2.114 -25.126 1.00 0.00 C ATOM 780 CG GLU A 52 21.494 2.148 -25.705 1.00 0.00 C ATOM 781 CD GLU A 52 21.913 0.838 -26.400 1.00 0.00 C ATOM 782 OE1 GLU A 52 21.172 -0.175 -26.370 1.00 0.00 O ATOM 783 OE2 GLU A 52 23.014 0.813 -27.002 1.00 0.00 O ATOM 0 H GLU A 52 20.984 2.464 -22.892 1.00 0.00 H new ATOM 0 HA GLU A 52 20.153 4.276 -24.796 1.00 0.00 H new ATOM 0 HB2 GLU A 52 19.968 1.239 -24.486 1.00 0.00 H new ATOM 0 HB3 GLU A 52 19.357 2.007 -25.937 1.00 0.00 H new ATOM 0 HG2 GLU A 52 21.564 2.967 -26.421 1.00 0.00 H new ATOM 0 HG3 GLU A 52 22.199 2.364 -24.903 1.00 0.00 H new ATOM 790 N VAL A 53 17.580 2.937 -23.233 1.00 0.00 N ATOM 791 CA VAL A 53 16.119 3.011 -22.999 1.00 0.00 C ATOM 792 C VAL A 53 15.709 4.122 -22.007 1.00 0.00 C ATOM 793 O VAL A 53 14.541 4.218 -21.629 1.00 0.00 O ATOM 794 CB VAL A 53 15.530 1.635 -22.596 1.00 0.00 C ATOM 795 CG1 VAL A 53 14.119 1.448 -23.167 1.00 0.00 C ATOM 796 CG2 VAL A 53 16.359 0.447 -23.105 1.00 0.00 C ATOM 0 H VAL A 53 18.066 2.374 -22.535 1.00 0.00 H new ATOM 0 HA VAL A 53 15.681 3.292 -23.957 1.00 0.00 H new ATOM 0 HB VAL A 53 15.530 1.644 -21.506 1.00 0.00 H new ATOM 0 HG11 VAL A 53 13.732 0.474 -22.868 1.00 0.00 H new ATOM 0 HG12 VAL A 53 13.465 2.232 -22.785 1.00 0.00 H new ATOM 0 HG13 VAL A 53 14.156 1.505 -24.255 1.00 0.00 H new ATOM 0 HG21 VAL A 53 15.892 -0.485 -22.788 1.00 0.00 H new ATOM 0 HG22 VAL A 53 16.407 0.477 -24.194 1.00 0.00 H new ATOM 0 HG23 VAL A 53 17.367 0.505 -22.695 1.00 0.00 H new ATOM 806 N GLY A 54 16.648 4.966 -21.561 1.00 0.00 N ATOM 807 CA GLY A 54 16.423 5.986 -20.520 1.00 0.00 C ATOM 808 C GLY A 54 16.595 5.474 -19.080 1.00 0.00 C ATOM 809 O GLY A 54 16.147 6.129 -18.138 1.00 0.00 O ATOM 0 H GLY A 54 17.604 4.962 -21.918 1.00 0.00 H new ATOM 0 HA2 GLY A 54 17.114 6.813 -20.683 1.00 0.00 H new ATOM 0 HA3 GLY A 54 15.415 6.386 -20.632 1.00 0.00 H new ATOM 813 N ILE A 55 17.222 4.304 -18.905 1.00 0.00 N ATOM 814 CA ILE A 55 17.302 3.546 -17.645 1.00 0.00 C ATOM 815 C ILE A 55 18.774 3.356 -17.249 1.00 0.00 C ATOM 816 O ILE A 55 19.280 2.241 -17.191 1.00 0.00 O ATOM 817 CB ILE A 55 16.526 2.205 -17.769 1.00 0.00 C ATOM 818 CG1 ILE A 55 15.149 2.361 -18.455 1.00 0.00 C ATOM 819 CG2 ILE A 55 16.352 1.579 -16.370 1.00 0.00 C ATOM 820 CD1 ILE A 55 14.400 1.051 -18.692 1.00 0.00 C ATOM 0 H ILE A 55 17.710 3.837 -19.670 1.00 0.00 H new ATOM 0 HA ILE A 55 16.822 4.105 -16.842 1.00 0.00 H new ATOM 0 HB ILE A 55 17.118 1.549 -18.407 1.00 0.00 H new ATOM 0 HG12 ILE A 55 14.526 3.014 -17.844 1.00 0.00 H new ATOM 0 HG13 ILE A 55 15.291 2.861 -19.413 1.00 0.00 H new ATOM 0 HG21 ILE A 55 15.808 0.639 -16.457 1.00 0.00 H new ATOM 0 HG22 ILE A 55 17.332 1.392 -15.931 1.00 0.00 H new ATOM 0 HG23 ILE A 55 15.793 2.264 -15.732 1.00 0.00 H new ATOM 0 HD11 ILE A 55 13.446 1.260 -19.177 1.00 0.00 H new ATOM 0 HD12 ILE A 55 14.997 0.401 -19.331 1.00 0.00 H new ATOM 0 HD13 ILE A 55 14.221 0.556 -17.737 1.00 0.00 H new ATOM 832 N ASP A 56 19.512 4.437 -17.007 1.00 0.00 N ATOM 833 CA ASP A 56 20.892 4.316 -16.516 1.00 0.00 C ATOM 834 C ASP A 56 20.927 3.621 -15.133 1.00 0.00 C ATOM 835 O ASP A 56 20.506 4.204 -14.129 1.00 0.00 O ATOM 836 CB ASP A 56 21.551 5.699 -16.466 1.00 0.00 C ATOM 837 CG ASP A 56 22.932 5.663 -15.784 1.00 0.00 C ATOM 838 OD1 ASP A 56 23.585 4.593 -15.797 1.00 0.00 O ATOM 839 OD2 ASP A 56 23.339 6.697 -15.199 1.00 0.00 O ATOM 0 H ASP A 56 19.188 5.395 -17.139 1.00 0.00 H new ATOM 0 HA ASP A 56 21.459 3.691 -17.206 1.00 0.00 H new ATOM 0 HB2 ASP A 56 21.659 6.085 -17.480 1.00 0.00 H new ATOM 0 HB3 ASP A 56 20.901 6.390 -15.929 1.00 0.00 H new ATOM 844 N ILE A 57 21.447 2.382 -15.067 1.00 0.00 N ATOM 845 CA ILE A 57 21.557 1.626 -13.812 1.00 0.00 C ATOM 846 C ILE A 57 22.842 1.945 -13.031 1.00 0.00 C ATOM 847 O ILE A 57 22.997 1.436 -11.929 1.00 0.00 O ATOM 848 CB ILE A 57 21.394 0.099 -14.016 1.00 0.00 C ATOM 849 CG1 ILE A 57 22.476 -0.501 -14.939 1.00 0.00 C ATOM 850 CG2 ILE A 57 19.989 -0.259 -14.532 1.00 0.00 C ATOM 851 CD1 ILE A 57 22.993 -1.857 -14.448 1.00 0.00 C ATOM 0 H ILE A 57 21.801 1.880 -15.881 1.00 0.00 H new ATOM 0 HA ILE A 57 20.719 1.963 -13.202 1.00 0.00 H new ATOM 0 HB ILE A 57 21.525 -0.349 -13.031 1.00 0.00 H new ATOM 0 HG12 ILE A 57 22.067 -0.615 -15.943 1.00 0.00 H new ATOM 0 HG13 ILE A 57 23.311 0.196 -15.012 1.00 0.00 H new ATOM 0 HG21 ILE A 57 19.914 -1.339 -14.663 1.00 0.00 H new ATOM 0 HG22 ILE A 57 19.241 0.072 -13.811 1.00 0.00 H new ATOM 0 HG23 ILE A 57 19.816 0.235 -15.488 1.00 0.00 H new ATOM 0 HD11 ILE A 57 23.751 -2.229 -15.137 1.00 0.00 H new ATOM 0 HD12 ILE A 57 23.430 -1.742 -13.456 1.00 0.00 H new ATOM 0 HD13 ILE A 57 22.167 -2.566 -14.401 1.00 0.00 H new ATOM 863 N SER A 58 23.763 2.765 -13.556 1.00 0.00 N ATOM 864 CA SER A 58 25.093 2.979 -12.959 1.00 0.00 C ATOM 865 C SER A 58 25.020 3.586 -11.543 1.00 0.00 C ATOM 866 O SER A 58 25.804 3.233 -10.663 1.00 0.00 O ATOM 867 CB SER A 58 25.946 3.850 -13.888 1.00 0.00 C ATOM 868 OG SER A 58 27.285 3.921 -13.422 1.00 0.00 O ATOM 0 H SER A 58 23.608 3.301 -14.410 1.00 0.00 H new ATOM 0 HA SER A 58 25.564 2.002 -12.848 1.00 0.00 H new ATOM 0 HB2 SER A 58 25.929 3.439 -14.897 1.00 0.00 H new ATOM 0 HB3 SER A 58 25.522 4.853 -13.945 1.00 0.00 H new ATOM 0 HG SER A 58 27.813 4.480 -14.029 1.00 0.00 H new ATOM 874 N GLY A 59 24.022 4.446 -11.292 1.00 0.00 N ATOM 875 CA GLY A 59 23.694 5.001 -9.967 1.00 0.00 C ATOM 876 C GLY A 59 22.574 4.272 -9.204 1.00 0.00 C ATOM 877 O GLY A 59 22.078 4.801 -8.208 1.00 0.00 O ATOM 0 H GLY A 59 23.401 4.786 -12.026 1.00 0.00 H new ATOM 0 HA2 GLY A 59 24.595 4.989 -9.354 1.00 0.00 H new ATOM 0 HA3 GLY A 59 23.406 6.045 -10.090 1.00 0.00 H new ATOM 881 N GLN A 60 22.130 3.100 -9.678 1.00 0.00 N ATOM 882 CA GLN A 60 20.940 2.385 -9.181 1.00 0.00 C ATOM 883 C GLN A 60 21.295 1.208 -8.245 1.00 0.00 C ATOM 884 O GLN A 60 22.436 0.750 -8.182 1.00 0.00 O ATOM 885 CB GLN A 60 20.067 1.976 -10.384 1.00 0.00 C ATOM 886 CG GLN A 60 18.559 1.929 -10.070 1.00 0.00 C ATOM 887 CD GLN A 60 17.738 1.577 -11.308 1.00 0.00 C ATOM 888 OE1 GLN A 60 17.410 0.324 -11.505 1.00 0.00 O flip ATOM 889 NE2 GLN A 60 17.373 2.413 -12.116 1.00 0.00 N flip ATOM 0 H GLN A 60 22.599 2.607 -10.438 1.00 0.00 H new ATOM 0 HA GLN A 60 20.358 3.055 -8.548 1.00 0.00 H new ATOM 0 HB2 GLN A 60 20.237 2.678 -11.200 1.00 0.00 H new ATOM 0 HB3 GLN A 60 20.386 0.995 -10.736 1.00 0.00 H new ATOM 0 HG2 GLN A 60 18.372 1.193 -9.288 1.00 0.00 H new ATOM 0 HG3 GLN A 60 18.237 2.895 -9.682 1.00 0.00 H new ATOM 0 HE21 GLN A 60 17.618 3.394 -11.981 1.00 0.00 H new ATOM 0 HE22 GLN A 60 16.823 2.132 -12.927 1.00 0.00 H new ATOM 898 N THR A 61 20.306 0.734 -7.483 1.00 0.00 N ATOM 899 CA THR A 61 20.449 -0.231 -6.380 1.00 0.00 C ATOM 900 C THR A 61 20.737 -1.678 -6.804 1.00 0.00 C ATOM 901 O THR A 61 20.492 -2.096 -7.932 1.00 0.00 O ATOM 902 CB THR A 61 19.181 -0.204 -5.497 1.00 0.00 C ATOM 903 OG1 THR A 61 18.003 -0.040 -6.260 1.00 0.00 O ATOM 904 CG2 THR A 61 19.221 0.981 -4.532 1.00 0.00 C ATOM 0 H THR A 61 19.338 1.023 -7.621 1.00 0.00 H new ATOM 0 HA THR A 61 21.332 0.095 -5.831 1.00 0.00 H new ATOM 0 HB THR A 61 19.167 -1.159 -4.972 1.00 0.00 H new ATOM 0 HG1 THR A 61 17.693 -0.915 -6.575 1.00 0.00 H new ATOM 0 HG21 THR A 61 18.319 0.982 -3.919 1.00 0.00 H new ATOM 0 HG22 THR A 61 20.097 0.897 -3.889 1.00 0.00 H new ATOM 0 HG23 THR A 61 19.275 1.910 -5.099 1.00 0.00 H new ATOM 912 N SER A 62 21.294 -2.451 -5.870 1.00 0.00 N ATOM 913 CA SER A 62 21.468 -3.913 -5.913 1.00 0.00 C ATOM 914 C SER A 62 21.456 -4.448 -4.470 1.00 0.00 C ATOM 915 O SER A 62 21.894 -3.754 -3.549 1.00 0.00 O ATOM 916 CB SER A 62 22.781 -4.307 -6.584 1.00 0.00 C ATOM 917 OG SER A 62 22.776 -5.712 -6.766 1.00 0.00 O ATOM 0 H SER A 62 21.661 -2.052 -5.006 1.00 0.00 H new ATOM 0 HA SER A 62 20.654 -4.342 -6.497 1.00 0.00 H new ATOM 0 HB2 SER A 62 22.886 -3.799 -7.543 1.00 0.00 H new ATOM 0 HB3 SER A 62 23.629 -4.006 -5.969 1.00 0.00 H new ATOM 0 HG SER A 62 23.592 -5.984 -7.237 1.00 0.00 H new ATOM 923 N ASP A 63 20.963 -5.666 -4.258 1.00 0.00 N ATOM 924 CA ASP A 63 20.902 -6.327 -2.946 1.00 0.00 C ATOM 925 C ASP A 63 21.021 -7.860 -3.087 1.00 0.00 C ATOM 926 O ASP A 63 20.599 -8.393 -4.123 1.00 0.00 O ATOM 927 CB ASP A 63 19.596 -5.943 -2.226 1.00 0.00 C ATOM 928 CG ASP A 63 19.791 -5.874 -0.703 1.00 0.00 C ATOM 929 OD1 ASP A 63 20.470 -4.934 -0.226 1.00 0.00 O ATOM 930 OD2 ASP A 63 19.271 -6.743 0.031 1.00 0.00 O ATOM 0 H ASP A 63 20.583 -6.240 -5.011 1.00 0.00 H new ATOM 0 HA ASP A 63 21.747 -5.986 -2.348 1.00 0.00 H new ATOM 0 HB2 ASP A 63 19.247 -4.978 -2.593 1.00 0.00 H new ATOM 0 HB3 ASP A 63 18.821 -6.673 -2.462 1.00 0.00 H new ATOM 935 N PRO A 64 21.618 -8.580 -2.112 1.00 0.00 N ATOM 936 CA PRO A 64 21.724 -10.043 -2.130 1.00 0.00 C ATOM 937 C PRO A 64 20.517 -10.716 -1.437 1.00 0.00 C ATOM 938 O PRO A 64 19.937 -10.188 -0.487 1.00 0.00 O ATOM 939 CB PRO A 64 23.037 -10.353 -1.403 1.00 0.00 C ATOM 940 CG PRO A 64 23.098 -9.249 -0.351 1.00 0.00 C ATOM 941 CD PRO A 64 22.463 -8.044 -1.048 1.00 0.00 C ATOM 0 HA PRO A 64 21.720 -10.434 -3.147 1.00 0.00 H new ATOM 0 HB2 PRO A 64 23.027 -11.345 -0.951 1.00 0.00 H new ATOM 0 HB3 PRO A 64 23.893 -10.319 -2.077 1.00 0.00 H new ATOM 0 HG2 PRO A 64 22.550 -9.524 0.550 1.00 0.00 H new ATOM 0 HG3 PRO A 64 24.124 -9.041 -0.049 1.00 0.00 H new ATOM 0 HD2 PRO A 64 21.875 -7.454 -0.345 1.00 0.00 H new ATOM 0 HD3 PRO A 64 23.228 -7.384 -1.456 1.00 0.00 H new ATOM 949 N ILE A 65 20.185 -11.940 -1.853 1.00 0.00 N ATOM 950 CA ILE A 65 18.959 -12.665 -1.444 1.00 0.00 C ATOM 951 C ILE A 65 18.871 -13.043 0.049 1.00 0.00 C ATOM 952 O ILE A 65 17.778 -13.306 0.546 1.00 0.00 O ATOM 953 CB ILE A 65 18.780 -13.895 -2.365 1.00 0.00 C ATOM 954 CG1 ILE A 65 17.362 -14.493 -2.291 1.00 0.00 C ATOM 955 CG2 ILE A 65 19.848 -14.970 -2.082 1.00 0.00 C ATOM 956 CD1 ILE A 65 17.070 -15.513 -3.400 1.00 0.00 C ATOM 0 H ILE A 65 20.767 -12.475 -2.498 1.00 0.00 H new ATOM 0 HA ILE A 65 18.130 -11.968 -1.566 1.00 0.00 H new ATOM 0 HB ILE A 65 18.918 -13.537 -3.385 1.00 0.00 H new ATOM 0 HG12 ILE A 65 17.229 -14.974 -1.322 1.00 0.00 H new ATOM 0 HG13 ILE A 65 16.632 -13.686 -2.349 1.00 0.00 H new ATOM 0 HG21 ILE A 65 19.693 -15.820 -2.746 1.00 0.00 H new ATOM 0 HG22 ILE A 65 20.840 -14.552 -2.253 1.00 0.00 H new ATOM 0 HG23 ILE A 65 19.767 -15.299 -1.046 1.00 0.00 H new ATOM 0 HD11 ILE A 65 16.055 -15.893 -3.287 1.00 0.00 H new ATOM 0 HD12 ILE A 65 17.171 -15.032 -4.373 1.00 0.00 H new ATOM 0 HD13 ILE A 65 17.777 -16.340 -3.329 1.00 0.00 H new ATOM 968 N GLU A 66 19.995 -13.057 0.774 1.00 0.00 N ATOM 969 CA GLU A 66 20.024 -13.348 2.220 1.00 0.00 C ATOM 970 C GLU A 66 20.075 -12.084 3.107 1.00 0.00 C ATOM 971 O GLU A 66 19.931 -12.188 4.327 1.00 0.00 O ATOM 972 CB GLU A 66 21.164 -14.329 2.541 1.00 0.00 C ATOM 973 CG GLU A 66 20.964 -15.682 1.842 1.00 0.00 C ATOM 974 CD GLU A 66 21.984 -16.717 2.353 1.00 0.00 C ATOM 975 OE1 GLU A 66 23.110 -16.796 1.802 1.00 0.00 O ATOM 976 OE2 GLU A 66 21.671 -17.461 3.316 1.00 0.00 O ATOM 0 H GLU A 66 20.915 -12.867 0.377 1.00 0.00 H new ATOM 0 HA GLU A 66 19.075 -13.823 2.468 1.00 0.00 H new ATOM 0 HB2 GLU A 66 22.115 -13.896 2.230 1.00 0.00 H new ATOM 0 HB3 GLU A 66 21.220 -14.481 3.619 1.00 0.00 H new ATOM 0 HG2 GLU A 66 19.951 -16.043 2.022 1.00 0.00 H new ATOM 0 HG3 GLU A 66 21.072 -15.559 0.764 1.00 0.00 H new ATOM 983 N ASN A 67 20.236 -10.890 2.515 1.00 0.00 N ATOM 984 CA ASN A 67 20.083 -9.613 3.223 1.00 0.00 C ATOM 985 C ASN A 67 18.624 -9.122 3.189 1.00 0.00 C ATOM 986 O ASN A 67 18.121 -8.607 4.191 1.00 0.00 O ATOM 987 CB ASN A 67 21.033 -8.580 2.607 1.00 0.00 C ATOM 988 CG ASN A 67 20.905 -7.224 3.282 1.00 0.00 C ATOM 989 OD1 ASN A 67 21.339 -7.020 4.407 1.00 0.00 O ATOM 990 ND2 ASN A 67 20.301 -6.268 2.621 1.00 0.00 N ATOM 0 H ASN A 67 20.477 -10.785 1.529 1.00 0.00 H new ATOM 0 HA ASN A 67 20.342 -9.755 4.272 1.00 0.00 H new ATOM 0 HB2 ASN A 67 22.060 -8.934 2.693 1.00 0.00 H new ATOM 0 HB3 ASN A 67 20.819 -8.478 1.543 1.00 0.00 H new ATOM 0 HD21 ASN A 67 20.190 -5.347 3.044 1.00 0.00 H new ATOM 0 HD22 ASN A 67 19.941 -6.445 1.683 1.00 0.00 H new ATOM 997 N PHE A 68 17.944 -9.306 2.054 1.00 0.00 N ATOM 998 CA PHE A 68 16.517 -9.025 1.909 1.00 0.00 C ATOM 999 C PHE A 68 15.640 -10.067 2.634 1.00 0.00 C ATOM 1000 O PHE A 68 16.086 -11.171 2.956 1.00 0.00 O ATOM 1001 CB PHE A 68 16.190 -8.881 0.407 1.00 0.00 C ATOM 1002 CG PHE A 68 15.011 -9.676 -0.125 1.00 0.00 C ATOM 1003 CD1 PHE A 68 15.208 -10.998 -0.559 1.00 0.00 C ATOM 1004 CD2 PHE A 68 13.742 -9.083 -0.248 1.00 0.00 C ATOM 1005 CE1 PHE A 68 14.160 -11.708 -1.163 1.00 0.00 C ATOM 1006 CE2 PHE A 68 12.702 -9.784 -0.884 1.00 0.00 C ATOM 1007 CZ PHE A 68 12.911 -11.095 -1.345 1.00 0.00 C ATOM 0 H PHE A 68 18.377 -9.659 1.200 1.00 0.00 H new ATOM 0 HA PHE A 68 16.278 -8.082 2.401 1.00 0.00 H new ATOM 0 HB2 PHE A 68 16.007 -7.826 0.200 1.00 0.00 H new ATOM 0 HB3 PHE A 68 17.075 -9.168 -0.161 1.00 0.00 H new ATOM 0 HD1 PHE A 68 16.171 -11.469 -0.427 1.00 0.00 H new ATOM 0 HD2 PHE A 68 13.567 -8.092 0.145 1.00 0.00 H new ATOM 0 HE1 PHE A 68 14.314 -12.726 -1.488 1.00 0.00 H new ATOM 0 HE2 PHE A 68 11.739 -9.313 -1.019 1.00 0.00 H new ATOM 0 HZ PHE A 68 12.112 -11.629 -1.838 1.00 0.00 H new ATOM 1017 N ASN A 69 14.374 -9.705 2.882 1.00 0.00 N ATOM 1018 CA ASN A 69 13.334 -10.618 3.359 1.00 0.00 C ATOM 1019 C ASN A 69 11.995 -10.332 2.668 1.00 0.00 C ATOM 1020 O ASN A 69 11.475 -9.225 2.771 1.00 0.00 O ATOM 1021 CB ASN A 69 13.247 -10.579 4.902 1.00 0.00 C ATOM 1022 CG ASN A 69 13.349 -9.195 5.546 1.00 0.00 C ATOM 1023 OD1 ASN A 69 14.213 -8.941 6.373 1.00 0.00 O ATOM 1024 ND2 ASN A 69 12.481 -8.263 5.218 1.00 0.00 N ATOM 0 H ASN A 69 14.041 -8.750 2.753 1.00 0.00 H new ATOM 0 HA ASN A 69 13.602 -11.639 3.088 1.00 0.00 H new ATOM 0 HB2 ASN A 69 12.301 -11.029 5.204 1.00 0.00 H new ATOM 0 HB3 ASN A 69 14.042 -11.205 5.307 1.00 0.00 H new ATOM 0 HD21 ASN A 69 12.534 -7.342 5.652 1.00 0.00 H new ATOM 0 HD22 ASN A 69 11.755 -8.462 4.529 1.00 0.00 H new ATOM 1031 N ALA A 70 11.393 -11.327 2.009 1.00 0.00 N ATOM 1032 CA ALA A 70 10.227 -11.138 1.131 1.00 0.00 C ATOM 1033 C ALA A 70 8.899 -10.775 1.833 1.00 0.00 C ATOM 1034 O ALA A 70 7.879 -10.622 1.167 1.00 0.00 O ATOM 1035 CB ALA A 70 10.062 -12.379 0.244 1.00 0.00 C ATOM 0 H ALA A 70 11.702 -12.297 2.069 1.00 0.00 H new ATOM 0 HA ALA A 70 10.447 -10.252 0.535 1.00 0.00 H new ATOM 0 HB1 ALA A 70 9.200 -12.247 -0.410 1.00 0.00 H new ATOM 0 HB2 ALA A 70 10.958 -12.516 -0.361 1.00 0.00 H new ATOM 0 HB3 ALA A 70 9.910 -13.257 0.872 1.00 0.00 H new ATOM 1041 N ASP A 71 8.895 -10.608 3.158 1.00 0.00 N ATOM 1042 CA ASP A 71 7.670 -10.397 3.948 1.00 0.00 C ATOM 1043 C ASP A 71 7.001 -9.040 3.646 1.00 0.00 C ATOM 1044 O ASP A 71 5.776 -8.913 3.720 1.00 0.00 O ATOM 1045 CB ASP A 71 8.018 -10.522 5.436 1.00 0.00 C ATOM 1046 CG ASP A 71 6.770 -10.428 6.329 1.00 0.00 C ATOM 1047 OD1 ASP A 71 5.954 -11.382 6.334 1.00 0.00 O ATOM 1048 OD2 ASP A 71 6.617 -9.418 7.058 1.00 0.00 O ATOM 0 H ASP A 71 9.746 -10.615 3.721 1.00 0.00 H new ATOM 0 HA ASP A 71 6.942 -11.159 3.670 1.00 0.00 H new ATOM 0 HB2 ASP A 71 8.519 -11.474 5.612 1.00 0.00 H new ATOM 0 HB3 ASP A 71 8.721 -9.736 5.711 1.00 0.00 H new ATOM 1053 N ASP A 72 7.802 -8.043 3.248 1.00 0.00 N ATOM 1054 CA ASP A 72 7.350 -6.705 2.843 1.00 0.00 C ATOM 1055 C ASP A 72 7.128 -6.570 1.316 1.00 0.00 C ATOM 1056 O ASP A 72 6.722 -5.509 0.839 1.00 0.00 O ATOM 1057 CB ASP A 72 8.367 -5.684 3.378 1.00 0.00 C ATOM 1058 CG ASP A 72 7.825 -4.246 3.470 1.00 0.00 C ATOM 1059 OD1 ASP A 72 6.649 -4.044 3.862 1.00 0.00 O ATOM 1060 OD2 ASP A 72 8.608 -3.294 3.231 1.00 0.00 O ATOM 0 H ASP A 72 8.815 -8.149 3.197 1.00 0.00 H new ATOM 0 HA ASP A 72 6.367 -6.515 3.274 1.00 0.00 H new ATOM 0 HB2 ASP A 72 8.697 -6.000 4.367 1.00 0.00 H new ATOM 0 HB3 ASP A 72 9.245 -5.689 2.732 1.00 0.00 H new ATOM 1065 N TYR A 73 7.407 -7.632 0.542 1.00 0.00 N ATOM 1066 CA TYR A 73 7.454 -7.647 -0.925 1.00 0.00 C ATOM 1067 C TYR A 73 6.485 -8.709 -1.468 1.00 0.00 C ATOM 1068 O TYR A 73 6.877 -9.820 -1.824 1.00 0.00 O ATOM 1069 CB TYR A 73 8.903 -7.854 -1.414 1.00 0.00 C ATOM 1070 CG TYR A 73 9.922 -6.922 -0.783 1.00 0.00 C ATOM 1071 CD1 TYR A 73 10.470 -7.260 0.467 1.00 0.00 C ATOM 1072 CD2 TYR A 73 10.294 -5.712 -1.401 1.00 0.00 C ATOM 1073 CE1 TYR A 73 11.358 -6.394 1.126 1.00 0.00 C ATOM 1074 CE2 TYR A 73 11.140 -4.814 -0.720 1.00 0.00 C ATOM 1075 CZ TYR A 73 11.684 -5.150 0.539 1.00 0.00 C ATOM 1076 OH TYR A 73 12.515 -4.273 1.172 1.00 0.00 O ATOM 0 H TYR A 73 7.616 -8.546 0.944 1.00 0.00 H new ATOM 0 HA TYR A 73 7.127 -6.683 -1.314 1.00 0.00 H new ATOM 0 HB2 TYR A 73 9.197 -8.884 -1.211 1.00 0.00 H new ATOM 0 HB3 TYR A 73 8.930 -7.722 -2.496 1.00 0.00 H new ATOM 0 HD1 TYR A 73 10.204 -8.200 0.927 1.00 0.00 H new ATOM 0 HD2 TYR A 73 9.933 -5.474 -2.391 1.00 0.00 H new ATOM 0 HE1 TYR A 73 11.789 -6.677 2.075 1.00 0.00 H new ATOM 0 HE2 TYR A 73 11.375 -3.859 -1.166 1.00 0.00 H new ATOM 0 HH TYR A 73 12.627 -3.471 0.620 1.00 0.00 H new ATOM 1086 N ASP A 74 5.195 -8.365 -1.522 1.00 0.00 N ATOM 1087 CA ASP A 74 4.098 -9.278 -1.887 1.00 0.00 C ATOM 1088 C ASP A 74 4.232 -9.891 -3.294 1.00 0.00 C ATOM 1089 O ASP A 74 3.630 -10.931 -3.572 1.00 0.00 O ATOM 1090 CB ASP A 74 2.771 -8.513 -1.801 1.00 0.00 C ATOM 1091 CG ASP A 74 2.503 -7.979 -0.386 1.00 0.00 C ATOM 1092 OD1 ASP A 74 1.946 -8.731 0.451 1.00 0.00 O ATOM 1093 OD2 ASP A 74 2.846 -6.802 -0.120 1.00 0.00 O ATOM 0 H ASP A 74 4.872 -7.421 -1.308 1.00 0.00 H new ATOM 0 HA ASP A 74 4.136 -10.110 -1.183 1.00 0.00 H new ATOM 0 HB2 ASP A 74 2.786 -7.681 -2.505 1.00 0.00 H new ATOM 0 HB3 ASP A 74 1.954 -9.170 -2.101 1.00 0.00 H new ATOM 1098 N VAL A 75 5.010 -9.253 -4.177 1.00 0.00 N ATOM 1099 CA VAL A 75 5.202 -9.660 -5.574 1.00 0.00 C ATOM 1100 C VAL A 75 6.671 -10.007 -5.821 1.00 0.00 C ATOM 1101 O VAL A 75 7.514 -9.112 -5.853 1.00 0.00 O ATOM 1102 CB VAL A 75 4.726 -8.542 -6.523 1.00 0.00 C ATOM 1103 CG1 VAL A 75 4.771 -9.009 -7.978 1.00 0.00 C ATOM 1104 CG2 VAL A 75 3.300 -8.063 -6.218 1.00 0.00 C ATOM 0 H VAL A 75 5.538 -8.416 -3.932 1.00 0.00 H new ATOM 0 HA VAL A 75 4.605 -10.549 -5.774 1.00 0.00 H new ATOM 0 HB VAL A 75 5.411 -7.709 -6.364 1.00 0.00 H new ATOM 0 HG11 VAL A 75 4.431 -8.204 -8.629 1.00 0.00 H new ATOM 0 HG12 VAL A 75 5.793 -9.281 -8.241 1.00 0.00 H new ATOM 0 HG13 VAL A 75 4.121 -9.875 -8.102 1.00 0.00 H new ATOM 0 HG21 VAL A 75 3.023 -7.276 -6.919 1.00 0.00 H new ATOM 0 HG22 VAL A 75 2.607 -8.898 -6.317 1.00 0.00 H new ATOM 0 HG23 VAL A 75 3.257 -7.674 -5.201 1.00 0.00 H new ATOM 1114 N VAL A 76 6.998 -11.286 -6.021 1.00 0.00 N ATOM 1115 CA VAL A 76 8.385 -11.763 -6.188 1.00 0.00 C ATOM 1116 C VAL A 76 8.570 -12.467 -7.531 1.00 0.00 C ATOM 1117 O VAL A 76 7.804 -13.360 -7.883 1.00 0.00 O ATOM 1118 CB VAL A 76 8.825 -12.676 -5.029 1.00 0.00 C ATOM 1119 CG1 VAL A 76 10.314 -13.028 -5.161 1.00 0.00 C ATOM 1120 CG2 VAL A 76 8.628 -12.012 -3.660 1.00 0.00 C ATOM 0 H VAL A 76 6.305 -12.032 -6.073 1.00 0.00 H new ATOM 0 HA VAL A 76 9.027 -10.882 -6.172 1.00 0.00 H new ATOM 0 HB VAL A 76 8.203 -13.569 -5.089 1.00 0.00 H new ATOM 0 HG11 VAL A 76 10.610 -13.674 -4.334 1.00 0.00 H new ATOM 0 HG12 VAL A 76 10.483 -13.546 -6.105 1.00 0.00 H new ATOM 0 HG13 VAL A 76 10.907 -12.114 -5.138 1.00 0.00 H new ATOM 0 HG21 VAL A 76 8.952 -12.695 -2.875 1.00 0.00 H new ATOM 0 HG22 VAL A 76 9.218 -11.096 -3.611 1.00 0.00 H new ATOM 0 HG23 VAL A 76 7.574 -11.773 -3.520 1.00 0.00 H new ATOM 1130 N ILE A 77 9.591 -12.083 -8.296 1.00 0.00 N ATOM 1131 CA ILE A 77 9.786 -12.541 -9.676 1.00 0.00 C ATOM 1132 C ILE A 77 11.112 -13.279 -9.831 1.00 0.00 C ATOM 1133 O ILE A 77 12.167 -12.674 -9.673 1.00 0.00 O ATOM 1134 CB ILE A 77 9.749 -11.332 -10.635 1.00 0.00 C ATOM 1135 CG1 ILE A 77 8.526 -10.406 -10.458 1.00 0.00 C ATOM 1136 CG2 ILE A 77 9.875 -11.803 -12.092 1.00 0.00 C ATOM 1137 CD1 ILE A 77 7.161 -11.079 -10.624 1.00 0.00 C ATOM 0 H ILE A 77 10.314 -11.439 -7.975 1.00 0.00 H new ATOM 0 HA ILE A 77 8.980 -13.233 -9.922 1.00 0.00 H new ATOM 0 HB ILE A 77 10.609 -10.718 -10.369 1.00 0.00 H new ATOM 0 HG12 ILE A 77 8.572 -9.957 -9.466 1.00 0.00 H new ATOM 0 HG13 ILE A 77 8.601 -9.592 -11.179 1.00 0.00 H new ATOM 0 HG21 ILE A 77 9.847 -10.940 -12.757 1.00 0.00 H new ATOM 0 HG22 ILE A 77 10.819 -12.332 -12.223 1.00 0.00 H new ATOM 0 HG23 ILE A 77 9.048 -12.472 -12.331 1.00 0.00 H new ATOM 0 HD11 ILE A 77 6.372 -10.341 -10.480 1.00 0.00 H new ATOM 0 HD12 ILE A 77 7.083 -11.502 -11.625 1.00 0.00 H new ATOM 0 HD13 ILE A 77 7.055 -11.873 -9.885 1.00 0.00 H new ATOM 1149 N SER A 78 11.077 -14.553 -10.205 1.00 0.00 N ATOM 1150 CA SER A 78 12.268 -15.297 -10.613 1.00 0.00 C ATOM 1151 C SER A 78 12.542 -14.985 -12.082 1.00 0.00 C ATOM 1152 O SER A 78 11.828 -15.441 -12.974 1.00 0.00 O ATOM 1153 CB SER A 78 12.063 -16.795 -10.401 1.00 0.00 C ATOM 1154 OG SER A 78 13.259 -17.489 -10.694 1.00 0.00 O ATOM 0 H SER A 78 10.219 -15.103 -10.235 1.00 0.00 H new ATOM 0 HA SER A 78 13.124 -14.999 -10.007 1.00 0.00 H new ATOM 0 HB2 SER A 78 11.763 -16.988 -9.371 1.00 0.00 H new ATOM 0 HB3 SER A 78 11.257 -17.155 -11.040 1.00 0.00 H new ATOM 0 HG SER A 78 13.346 -17.595 -11.664 1.00 0.00 H new ATOM 1160 N LEU A 79 13.563 -14.176 -12.351 1.00 0.00 N ATOM 1161 CA LEU A 79 13.973 -13.846 -13.718 1.00 0.00 C ATOM 1162 C LEU A 79 14.798 -14.976 -14.334 1.00 0.00 C ATOM 1163 O LEU A 79 14.696 -15.223 -15.530 1.00 0.00 O ATOM 1164 CB LEU A 79 14.693 -12.492 -13.699 1.00 0.00 C ATOM 1165 CG LEU A 79 13.791 -11.319 -13.285 1.00 0.00 C ATOM 1166 CD1 LEU A 79 14.649 -10.072 -13.318 1.00 0.00 C ATOM 1167 CD2 LEU A 79 12.647 -11.080 -14.250 1.00 0.00 C ATOM 0 H LEU A 79 14.131 -13.730 -11.630 1.00 0.00 H new ATOM 0 HA LEU A 79 13.102 -13.749 -14.366 1.00 0.00 H new ATOM 0 HB2 LEU A 79 15.538 -12.549 -13.013 1.00 0.00 H new ATOM 0 HB3 LEU A 79 15.101 -12.293 -14.690 1.00 0.00 H new ATOM 0 HG LEU A 79 13.370 -11.549 -12.306 1.00 0.00 H new ATOM 0 HD11 LEU A 79 14.048 -9.209 -13.030 1.00 0.00 H new ATOM 0 HD12 LEU A 79 15.480 -10.184 -12.622 1.00 0.00 H new ATOM 0 HD13 LEU A 79 15.037 -9.924 -14.326 1.00 0.00 H new ATOM 0 HD21 LEU A 79 12.047 -10.239 -13.902 1.00 0.00 H new ATOM 0 HD22 LEU A 79 13.046 -10.856 -15.239 1.00 0.00 H new ATOM 0 HD23 LEU A 79 12.024 -11.973 -14.304 1.00 0.00 H new ATOM 1179 N CYS A 80 15.572 -15.697 -13.519 1.00 0.00 N ATOM 1180 CA CYS A 80 16.225 -16.942 -13.933 1.00 0.00 C ATOM 1181 C CYS A 80 15.186 -18.067 -14.089 1.00 0.00 C ATOM 1182 O CYS A 80 14.152 -18.052 -13.422 1.00 0.00 O ATOM 1183 CB CYS A 80 17.256 -17.364 -12.861 1.00 0.00 C ATOM 1184 SG CYS A 80 16.500 -17.771 -11.252 1.00 0.00 S ATOM 0 H CYS A 80 15.764 -15.434 -12.552 1.00 0.00 H new ATOM 0 HA CYS A 80 16.721 -16.773 -14.889 1.00 0.00 H new ATOM 0 HB2 CYS A 80 17.812 -18.229 -13.222 1.00 0.00 H new ATOM 0 HB3 CYS A 80 17.976 -16.558 -12.722 1.00 0.00 H new ATOM 0 HG CYS A 80 15.236 -17.468 -11.277 1.00 0.00 H new ATOM 1243 N LEU A 86 15.187 -21.088 -5.255 1.00 0.00 N ATOM 1244 CA LEU A 86 15.061 -19.974 -4.304 1.00 0.00 C ATOM 1245 C LEU A 86 14.546 -20.462 -2.929 1.00 0.00 C ATOM 1246 O LEU A 86 13.898 -21.514 -2.867 1.00 0.00 O ATOM 1247 CB LEU A 86 14.117 -18.903 -4.881 1.00 0.00 C ATOM 1248 CG LEU A 86 14.479 -18.337 -6.267 1.00 0.00 C ATOM 1249 CD1 LEU A 86 13.465 -17.251 -6.629 1.00 0.00 C ATOM 1250 CD2 LEU A 86 15.883 -17.735 -6.320 1.00 0.00 C ATOM 0 HA LEU A 86 16.049 -19.540 -4.151 1.00 0.00 H new ATOM 0 HB2 LEU A 86 13.115 -19.328 -4.938 1.00 0.00 H new ATOM 0 HB3 LEU A 86 14.072 -18.073 -4.176 1.00 0.00 H new ATOM 0 HG LEU A 86 14.456 -19.166 -6.974 1.00 0.00 H new ATOM 0 HD11 LEU A 86 13.707 -16.839 -7.609 1.00 0.00 H new ATOM 0 HD12 LEU A 86 12.464 -17.682 -6.654 1.00 0.00 H new ATOM 0 HD13 LEU A 86 13.500 -16.457 -5.883 1.00 0.00 H new ATOM 0 HD21 LEU A 86 16.078 -17.354 -7.322 1.00 0.00 H new ATOM 0 HD22 LEU A 86 15.956 -16.919 -5.601 1.00 0.00 H new ATOM 0 HD23 LEU A 86 16.617 -18.502 -6.075 1.00 0.00 H new ATOM 1262 N PRO A 87 14.777 -19.712 -1.829 1.00 0.00 N ATOM 1263 CA PRO A 87 14.211 -20.032 -0.515 1.00 0.00 C ATOM 1264 C PRO A 87 12.671 -20.081 -0.555 1.00 0.00 C ATOM 1265 O PRO A 87 12.062 -19.163 -1.115 1.00 0.00 O ATOM 1266 CB PRO A 87 14.718 -18.939 0.437 1.00 0.00 C ATOM 1267 CG PRO A 87 15.996 -18.446 -0.241 1.00 0.00 C ATOM 1268 CD PRO A 87 15.641 -18.546 -1.724 1.00 0.00 C ATOM 0 HA PRO A 87 14.523 -21.022 -0.182 1.00 0.00 H new ATOM 0 HB2 PRO A 87 13.989 -18.137 0.553 1.00 0.00 H new ATOM 0 HB3 PRO A 87 14.918 -19.334 1.433 1.00 0.00 H new ATOM 0 HG2 PRO A 87 16.242 -17.425 0.050 1.00 0.00 H new ATOM 0 HG3 PRO A 87 16.856 -19.066 0.013 1.00 0.00 H new ATOM 0 HD2 PRO A 87 15.132 -17.646 -2.069 1.00 0.00 H new ATOM 0 HD3 PRO A 87 16.535 -18.661 -2.337 1.00 0.00 H new ATOM 1276 N PRO A 88 12.004 -21.104 0.020 1.00 0.00 N ATOM 1277 CA PRO A 88 10.551 -21.259 -0.079 1.00 0.00 C ATOM 1278 C PRO A 88 9.765 -20.084 0.519 1.00 0.00 C ATOM 1279 O PRO A 88 8.717 -19.728 -0.017 1.00 0.00 O ATOM 1280 CB PRO A 88 10.223 -22.594 0.602 1.00 0.00 C ATOM 1281 CG PRO A 88 11.420 -22.853 1.517 1.00 0.00 C ATOM 1282 CD PRO A 88 12.580 -22.229 0.746 1.00 0.00 C ATOM 0 HA PRO A 88 10.242 -21.260 -1.124 1.00 0.00 H new ATOM 0 HB2 PRO A 88 9.294 -22.534 1.169 1.00 0.00 H new ATOM 0 HB3 PRO A 88 10.100 -23.394 -0.128 1.00 0.00 H new ATOM 0 HG2 PRO A 88 11.289 -22.389 2.495 1.00 0.00 H new ATOM 0 HG3 PRO A 88 11.575 -23.918 1.688 1.00 0.00 H new ATOM 0 HD2 PRO A 88 13.368 -21.898 1.422 1.00 0.00 H new ATOM 0 HD3 PRO A 88 13.029 -22.949 0.062 1.00 0.00 H new ATOM 1290 N GLU A 89 10.270 -19.402 1.551 1.00 0.00 N ATOM 1291 CA GLU A 89 9.642 -18.177 2.074 1.00 0.00 C ATOM 1292 C GLU A 89 9.664 -17.005 1.071 1.00 0.00 C ATOM 1293 O GLU A 89 8.736 -16.194 1.056 1.00 0.00 O ATOM 1294 CB GLU A 89 10.233 -17.779 3.441 1.00 0.00 C ATOM 1295 CG GLU A 89 11.764 -17.673 3.515 1.00 0.00 C ATOM 1296 CD GLU A 89 12.407 -19.006 3.943 1.00 0.00 C ATOM 1297 OE1 GLU A 89 12.626 -19.877 3.069 1.00 0.00 O ATOM 1298 OE2 GLU A 89 12.687 -19.193 5.155 1.00 0.00 O ATOM 0 H GLU A 89 11.118 -19.677 2.046 1.00 0.00 H new ATOM 0 HA GLU A 89 8.589 -18.415 2.225 1.00 0.00 H new ATOM 0 HB2 GLU A 89 9.809 -16.817 3.730 1.00 0.00 H new ATOM 0 HB3 GLU A 89 9.904 -18.508 4.181 1.00 0.00 H new ATOM 0 HG2 GLU A 89 12.156 -17.376 2.542 1.00 0.00 H new ATOM 0 HG3 GLU A 89 12.041 -16.891 4.223 1.00 0.00 H new ATOM 1305 N TRP A 90 10.666 -16.920 0.184 1.00 0.00 N ATOM 1306 CA TRP A 90 10.706 -15.927 -0.900 1.00 0.00 C ATOM 1307 C TRP A 90 9.821 -16.321 -2.101 1.00 0.00 C ATOM 1308 O TRP A 90 9.405 -15.453 -2.865 1.00 0.00 O ATOM 1309 CB TRP A 90 12.169 -15.646 -1.286 1.00 0.00 C ATOM 1310 CG TRP A 90 13.134 -15.221 -0.205 1.00 0.00 C ATOM 1311 CD1 TRP A 90 14.469 -15.172 -0.406 1.00 0.00 C ATOM 1312 CD2 TRP A 90 12.944 -14.790 1.196 1.00 0.00 C ATOM 1313 NE1 TRP A 90 15.110 -14.731 0.729 1.00 0.00 N ATOM 1314 CE2 TRP A 90 14.231 -14.529 1.762 1.00 0.00 C ATOM 1315 CE3 TRP A 90 11.846 -14.586 2.068 1.00 0.00 C ATOM 1316 CZ2 TRP A 90 14.423 -14.143 3.094 1.00 0.00 C ATOM 1317 CZ3 TRP A 90 12.023 -14.213 3.416 1.00 0.00 C ATOM 1318 CH2 TRP A 90 13.311 -14.019 3.941 1.00 0.00 C ATOM 0 H TRP A 90 11.475 -17.541 0.198 1.00 0.00 H new ATOM 0 HA TRP A 90 10.271 -14.996 -0.537 1.00 0.00 H new ATOM 0 HB2 TRP A 90 12.568 -16.548 -1.750 1.00 0.00 H new ATOM 0 HB3 TRP A 90 12.166 -14.869 -2.051 1.00 0.00 H new ATOM 0 HD1 TRP A 90 14.964 -15.441 -1.328 1.00 0.00 H new ATOM 0 HE1 TRP A 90 16.116 -14.574 0.794 1.00 0.00 H new ATOM 0 HE3 TRP A 90 10.844 -14.720 1.689 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 15.417 -13.943 3.466 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 11.160 -14.075 4.051 1.00 0.00 H new ATOM 0 HH2 TRP A 90 13.444 -13.777 4.985 1.00 0.00 H new ATOM 1329 N VAL A 91 9.466 -17.604 -2.242 1.00 0.00 N ATOM 1330 CA VAL A 91 8.574 -18.148 -3.282 1.00 0.00 C ATOM 1331 C VAL A 91 7.096 -18.096 -2.871 1.00 0.00 C ATOM 1332 O VAL A 91 6.233 -17.858 -3.709 1.00 0.00 O ATOM 1333 CB VAL A 91 8.997 -19.597 -3.610 1.00 0.00 C ATOM 1334 CG1 VAL A 91 8.037 -20.329 -4.552 1.00 0.00 C ATOM 1335 CG2 VAL A 91 10.388 -19.620 -4.259 1.00 0.00 C ATOM 0 H VAL A 91 9.806 -18.326 -1.607 1.00 0.00 H new ATOM 0 HA VAL A 91 8.672 -17.523 -4.170 1.00 0.00 H new ATOM 0 HB VAL A 91 8.991 -20.114 -2.651 1.00 0.00 H new ATOM 0 HG11 VAL A 91 8.404 -21.339 -4.733 1.00 0.00 H new ATOM 0 HG12 VAL A 91 7.048 -20.379 -4.097 1.00 0.00 H new ATOM 0 HG13 VAL A 91 7.975 -19.791 -5.498 1.00 0.00 H new ATOM 0 HG21 VAL A 91 10.668 -20.649 -4.483 1.00 0.00 H new ATOM 0 HG22 VAL A 91 10.368 -19.041 -5.182 1.00 0.00 H new ATOM 0 HG23 VAL A 91 11.116 -19.186 -3.574 1.00 0.00 H new ATOM 1345 N THR A 92 6.780 -18.277 -1.586 1.00 0.00 N ATOM 1346 CA THR A 92 5.394 -18.423 -1.076 1.00 0.00 C ATOM 1347 C THR A 92 4.704 -17.090 -0.713 1.00 0.00 C ATOM 1348 O THR A 92 3.783 -17.052 0.104 1.00 0.00 O ATOM 1349 CB THR A 92 5.307 -19.482 0.043 1.00 0.00 C ATOM 1350 OG1 THR A 92 6.237 -19.234 1.073 1.00 0.00 O ATOM 1351 CG2 THR A 92 5.578 -20.887 -0.503 1.00 0.00 C ATOM 0 H THR A 92 7.484 -18.329 -0.850 1.00 0.00 H new ATOM 0 HA THR A 92 4.808 -18.798 -1.915 1.00 0.00 H new ATOM 0 HB THR A 92 4.294 -19.419 0.441 1.00 0.00 H new ATOM 0 HG1 THR A 92 7.134 -19.487 0.771 1.00 0.00 H new ATOM 0 HG21 THR A 92 5.510 -21.612 0.308 1.00 0.00 H new ATOM 0 HG22 THR A 92 4.840 -21.128 -1.268 1.00 0.00 H new ATOM 0 HG23 THR A 92 6.577 -20.922 -0.938 1.00 0.00 H new ATOM 1359 N GLN A 93 5.127 -15.986 -1.341 1.00 0.00 N ATOM 1360 CA GLN A 93 4.449 -14.681 -1.281 1.00 0.00 C ATOM 1361 C GLN A 93 3.202 -14.630 -2.181 1.00 0.00 C ATOM 1362 O GLN A 93 2.960 -15.528 -2.990 1.00 0.00 O ATOM 1363 CB GLN A 93 5.449 -13.553 -1.601 1.00 0.00 C ATOM 1364 CG GLN A 93 6.638 -13.500 -0.625 1.00 0.00 C ATOM 1365 CD GLN A 93 6.211 -13.416 0.845 1.00 0.00 C ATOM 1366 OE1 GLN A 93 5.284 -12.708 1.220 1.00 0.00 O ATOM 1367 NE2 GLN A 93 6.838 -14.164 1.730 1.00 0.00 N ATOM 0 H GLN A 93 5.968 -15.973 -1.918 1.00 0.00 H new ATOM 0 HA GLN A 93 4.084 -14.533 -0.265 1.00 0.00 H new ATOM 0 HB2 GLN A 93 5.826 -13.687 -2.615 1.00 0.00 H new ATOM 0 HB3 GLN A 93 4.927 -12.597 -1.579 1.00 0.00 H new ATOM 0 HG2 GLN A 93 7.256 -14.387 -0.767 1.00 0.00 H new ATOM 0 HG3 GLN A 93 7.259 -12.637 -0.866 1.00 0.00 H new ATOM 0 HE21 GLN A 93 7.612 -14.760 1.437 1.00 0.00 H new ATOM 0 HE22 GLN A 93 6.549 -14.147 2.708 1.00 0.00 H new ATOM 1376 N GLU A 94 2.390 -13.580 -2.011 1.00 0.00 N ATOM 1377 CA GLU A 94 1.054 -13.465 -2.613 1.00 0.00 C ATOM 1378 C GLU A 94 1.049 -13.615 -4.149 1.00 0.00 C ATOM 1379 O GLU A 94 0.164 -14.279 -4.703 1.00 0.00 O ATOM 1380 CB GLU A 94 0.438 -12.123 -2.190 1.00 0.00 C ATOM 1381 CG GLU A 94 -1.058 -12.100 -2.490 1.00 0.00 C ATOM 1382 CD GLU A 94 -1.722 -10.821 -1.947 1.00 0.00 C ATOM 1383 OE1 GLU A 94 -1.736 -9.788 -2.663 1.00 0.00 O ATOM 1384 OE2 GLU A 94 -2.248 -10.841 -0.806 1.00 0.00 O ATOM 0 H GLU A 94 2.646 -12.773 -1.442 1.00 0.00 H new ATOM 0 HA GLU A 94 0.453 -14.296 -2.244 1.00 0.00 H new ATOM 0 HB2 GLU A 94 0.603 -11.961 -1.125 1.00 0.00 H new ATOM 0 HB3 GLU A 94 0.933 -11.307 -2.717 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -1.215 -12.164 -3.567 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -1.533 -12.975 -2.046 1.00 0.00 H new ATOM 1391 N ILE A 95 2.063 -13.063 -4.827 1.00 0.00 N ATOM 1392 CA ILE A 95 2.337 -13.288 -6.253 1.00 0.00 C ATOM 1393 C ILE A 95 3.788 -13.760 -6.411 1.00 0.00 C ATOM 1394 O ILE A 95 4.722 -13.054 -6.027 1.00 0.00 O ATOM 1395 CB ILE A 95 2.038 -12.021 -7.097 1.00 0.00 C ATOM 1396 CG1 ILE A 95 0.543 -11.626 -7.000 1.00 0.00 C ATOM 1397 CG2 ILE A 95 2.455 -12.245 -8.567 1.00 0.00 C ATOM 1398 CD1 ILE A 95 0.134 -10.395 -7.825 1.00 0.00 C ATOM 0 H ILE A 95 2.733 -12.431 -4.388 1.00 0.00 H new ATOM 0 HA ILE A 95 1.673 -14.064 -6.632 1.00 0.00 H new ATOM 0 HB ILE A 95 2.625 -11.196 -6.694 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -0.062 -12.475 -7.320 1.00 0.00 H new ATOM 0 HG13 ILE A 95 0.301 -11.439 -5.954 1.00 0.00 H new ATOM 0 HG21 ILE A 95 2.239 -11.348 -9.147 1.00 0.00 H new ATOM 0 HG22 ILE A 95 3.523 -12.459 -8.614 1.00 0.00 H new ATOM 0 HG23 ILE A 95 1.898 -13.086 -8.979 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -0.930 -10.203 -7.689 1.00 0.00 H new ATOM 0 HD12 ILE A 95 0.705 -9.528 -7.492 1.00 0.00 H new ATOM 0 HD13 ILE A 95 0.337 -10.580 -8.880 1.00 0.00 H new ATOM 1410 N PHE A 96 3.972 -14.928 -7.034 1.00 0.00 N ATOM 1411 CA PHE A 96 5.277 -15.427 -7.475 1.00 0.00 C ATOM 1412 C PHE A 96 5.230 -15.837 -8.958 1.00 0.00 C ATOM 1413 O PHE A 96 4.230 -16.386 -9.426 1.00 0.00 O ATOM 1414 CB PHE A 96 5.805 -16.535 -6.551 1.00 0.00 C ATOM 1415 CG PHE A 96 7.133 -17.109 -7.003 1.00 0.00 C ATOM 1416 CD1 PHE A 96 8.329 -16.432 -6.697 1.00 0.00 C ATOM 1417 CD2 PHE A 96 7.177 -18.295 -7.762 1.00 0.00 C ATOM 1418 CE1 PHE A 96 9.564 -16.938 -7.135 1.00 0.00 C ATOM 1419 CE2 PHE A 96 8.413 -18.806 -8.197 1.00 0.00 C ATOM 1420 CZ PHE A 96 9.606 -18.129 -7.880 1.00 0.00 C ATOM 0 H PHE A 96 3.204 -15.564 -7.250 1.00 0.00 H new ATOM 0 HA PHE A 96 6.001 -14.616 -7.399 1.00 0.00 H new ATOM 0 HB2 PHE A 96 5.914 -16.137 -5.542 1.00 0.00 H new ATOM 0 HB3 PHE A 96 5.069 -17.337 -6.499 1.00 0.00 H new ATOM 0 HD1 PHE A 96 8.297 -15.518 -6.122 1.00 0.00 H new ATOM 0 HD2 PHE A 96 6.262 -18.812 -8.010 1.00 0.00 H new ATOM 0 HE1 PHE A 96 10.478 -16.413 -6.900 1.00 0.00 H new ATOM 0 HE2 PHE A 96 8.447 -19.718 -8.774 1.00 0.00 H new ATOM 0 HZ PHE A 96 10.555 -18.525 -8.210 1.00 0.00 H new ATOM 1430 N GLU A 97 6.299 -15.546 -9.702 1.00 0.00 N ATOM 1431 CA GLU A 97 6.370 -15.704 -11.163 1.00 0.00 C ATOM 1432 C GLU A 97 7.758 -16.186 -11.627 1.00 0.00 C ATOM 1433 O GLU A 97 8.756 -15.925 -10.957 1.00 0.00 O ATOM 1434 CB GLU A 97 6.004 -14.359 -11.836 1.00 0.00 C ATOM 1435 CG GLU A 97 4.841 -14.457 -12.828 1.00 0.00 C ATOM 1436 CD GLU A 97 5.219 -15.232 -14.103 1.00 0.00 C ATOM 1437 OE1 GLU A 97 5.242 -16.486 -14.066 1.00 0.00 O ATOM 1438 OE2 GLU A 97 5.506 -14.581 -15.135 1.00 0.00 O ATOM 0 H GLU A 97 7.163 -15.184 -9.298 1.00 0.00 H new ATOM 0 HA GLU A 97 5.657 -16.472 -11.461 1.00 0.00 H new ATOM 0 HB2 GLU A 97 5.749 -13.635 -11.063 1.00 0.00 H new ATOM 0 HB3 GLU A 97 6.881 -13.974 -12.356 1.00 0.00 H new ATOM 0 HG2 GLU A 97 3.996 -14.948 -12.345 1.00 0.00 H new ATOM 0 HG3 GLU A 97 4.514 -13.453 -13.100 1.00 0.00 H new ATOM 1445 N ASP A 98 7.835 -16.845 -12.788 1.00 0.00 N ATOM 1446 CA ASP A 98 9.083 -17.324 -13.403 1.00 0.00 C ATOM 1447 C ASP A 98 9.168 -16.894 -14.879 1.00 0.00 C ATOM 1448 O ASP A 98 8.351 -17.305 -15.710 1.00 0.00 O ATOM 1449 CB ASP A 98 9.215 -18.849 -13.253 1.00 0.00 C ATOM 1450 CG ASP A 98 10.640 -19.342 -13.587 1.00 0.00 C ATOM 1451 OD1 ASP A 98 11.140 -19.039 -14.695 1.00 0.00 O ATOM 1452 OD2 ASP A 98 11.235 -20.068 -12.752 1.00 0.00 O ATOM 0 H ASP A 98 7.009 -17.067 -13.343 1.00 0.00 H new ATOM 0 HA ASP A 98 9.921 -16.866 -12.878 1.00 0.00 H new ATOM 0 HB2 ASP A 98 8.962 -19.136 -12.232 1.00 0.00 H new ATOM 0 HB3 ASP A 98 8.498 -19.341 -13.910 1.00 0.00 H new ATOM 1457 N TRP A 99 10.149 -16.048 -15.209 1.00 0.00 N ATOM 1458 CA TRP A 99 10.329 -15.464 -16.546 1.00 0.00 C ATOM 1459 C TRP A 99 11.379 -16.190 -17.404 1.00 0.00 C ATOM 1460 O TRP A 99 11.554 -15.810 -18.559 1.00 0.00 O ATOM 1461 CB TRP A 99 10.634 -13.962 -16.436 1.00 0.00 C ATOM 1462 CG TRP A 99 9.581 -13.062 -15.858 1.00 0.00 C ATOM 1463 CD1 TRP A 99 8.435 -13.426 -15.238 1.00 0.00 C ATOM 1464 CD2 TRP A 99 9.598 -11.604 -15.796 1.00 0.00 C ATOM 1465 NE1 TRP A 99 7.762 -12.304 -14.801 1.00 0.00 N ATOM 1466 CE2 TRP A 99 8.480 -11.159 -15.040 1.00 0.00 C ATOM 1467 CE3 TRP A 99 10.474 -10.611 -16.280 1.00 0.00 C ATOM 1468 CZ2 TRP A 99 8.314 -9.824 -14.658 1.00 0.00 C ATOM 1469 CZ3 TRP A 99 10.340 -9.272 -15.874 1.00 0.00 C ATOM 1470 CH2 TRP A 99 9.288 -8.884 -15.026 1.00 0.00 C ATOM 0 H TRP A 99 10.857 -15.742 -14.541 1.00 0.00 H new ATOM 0 HA TRP A 99 9.384 -15.599 -17.073 1.00 0.00 H new ATOM 0 HB2 TRP A 99 11.535 -13.849 -15.833 1.00 0.00 H new ATOM 0 HB3 TRP A 99 10.871 -13.597 -17.435 1.00 0.00 H new ATOM 0 HD1 TRP A 99 8.097 -14.443 -15.105 1.00 0.00 H new ATOM 0 HE1 TRP A 99 6.845 -12.323 -14.356 1.00 0.00 H new ATOM 0 HE3 TRP A 99 11.258 -10.883 -16.971 1.00 0.00 H new ATOM 0 HZ2 TRP A 99 7.448 -9.521 -14.088 1.00 0.00 H new ATOM 0 HZ3 TRP A 99 11.051 -8.535 -16.216 1.00 0.00 H new ATOM 0 HH2 TRP A 99 9.230 -7.869 -14.660 1.00 0.00 H new ATOM 1481 N GLN A 100 12.051 -17.231 -16.893 1.00 0.00 N ATOM 1482 CA GLN A 100 12.970 -18.121 -17.624 1.00 0.00 C ATOM 1483 C GLN A 100 13.988 -17.439 -18.574 1.00 0.00 C ATOM 1484 O GLN A 100 14.240 -17.914 -19.685 1.00 0.00 O ATOM 1485 CB GLN A 100 12.212 -19.344 -18.200 1.00 0.00 C ATOM 1486 CG GLN A 100 10.951 -19.104 -19.055 1.00 0.00 C ATOM 1487 CD GLN A 100 11.221 -18.681 -20.502 1.00 0.00 C ATOM 1488 OE1 GLN A 100 11.418 -19.508 -21.384 1.00 0.00 O ATOM 1489 NE2 GLN A 100 11.199 -17.405 -20.825 1.00 0.00 N ATOM 0 H GLN A 100 11.966 -17.490 -15.910 1.00 0.00 H new ATOM 0 HA GLN A 100 13.665 -18.509 -16.880 1.00 0.00 H new ATOM 0 HB2 GLN A 100 12.917 -19.914 -18.805 1.00 0.00 H new ATOM 0 HB3 GLN A 100 11.926 -19.979 -17.362 1.00 0.00 H new ATOM 0 HG2 GLN A 100 10.357 -20.018 -19.064 1.00 0.00 H new ATOM 0 HG3 GLN A 100 10.345 -18.335 -18.575 1.00 0.00 H new ATOM 0 HE21 GLN A 100 11.037 -16.700 -20.106 1.00 0.00 H new ATOM 0 HE22 GLN A 100 11.344 -17.122 -21.794 1.00 0.00 H new ATOM 1498 N LEU A 101 14.585 -16.324 -18.137 1.00 0.00 N ATOM 1499 CA LEU A 101 15.533 -15.515 -18.916 1.00 0.00 C ATOM 1500 C LEU A 101 16.980 -16.042 -18.838 1.00 0.00 C ATOM 1501 O LEU A 101 17.508 -16.280 -17.747 1.00 0.00 O ATOM 1502 CB LEU A 101 15.498 -14.046 -18.445 1.00 0.00 C ATOM 1503 CG LEU A 101 14.142 -13.324 -18.481 1.00 0.00 C ATOM 1504 CD1 LEU A 101 14.364 -11.899 -18.002 1.00 0.00 C ATOM 1505 CD2 LEU A 101 13.558 -13.260 -19.884 1.00 0.00 C ATOM 0 H LEU A 101 14.418 -15.948 -17.204 1.00 0.00 H new ATOM 0 HA LEU A 101 15.215 -15.585 -19.956 1.00 0.00 H new ATOM 0 HB2 LEU A 101 15.871 -14.012 -17.421 1.00 0.00 H new ATOM 0 HB3 LEU A 101 16.198 -13.479 -19.058 1.00 0.00 H new ATOM 0 HG LEU A 101 13.445 -13.875 -17.850 1.00 0.00 H new ATOM 0 HD11 LEU A 101 13.417 -11.359 -18.016 1.00 0.00 H new ATOM 0 HD12 LEU A 101 14.758 -11.914 -16.986 1.00 0.00 H new ATOM 0 HD13 LEU A 101 15.076 -11.401 -18.660 1.00 0.00 H new ATOM 0 HD21 LEU A 101 12.600 -12.741 -19.856 1.00 0.00 H new ATOM 0 HD22 LEU A 101 14.243 -12.722 -20.539 1.00 0.00 H new ATOM 0 HD23 LEU A 101 13.411 -14.271 -20.264 1.00 0.00 H new ATOM 1517 N GLU A 102 17.646 -16.118 -19.991 1.00 0.00 N ATOM 1518 CA GLU A 102 19.079 -16.441 -20.120 1.00 0.00 C ATOM 1519 C GLU A 102 19.975 -15.360 -19.478 1.00 0.00 C ATOM 1520 O GLU A 102 19.574 -14.203 -19.360 1.00 0.00 O ATOM 1521 CB GLU A 102 19.390 -16.645 -21.616 1.00 0.00 C ATOM 1522 CG GLU A 102 20.811 -17.151 -21.893 1.00 0.00 C ATOM 1523 CD GLU A 102 20.951 -17.640 -23.349 1.00 0.00 C ATOM 1524 OE1 GLU A 102 21.206 -16.808 -24.252 1.00 0.00 O ATOM 1525 OE2 GLU A 102 20.805 -18.864 -23.600 1.00 0.00 O ATOM 0 H GLU A 102 17.195 -15.953 -20.891 1.00 0.00 H new ATOM 0 HA GLU A 102 19.300 -17.359 -19.575 1.00 0.00 H new ATOM 0 HB2 GLU A 102 18.675 -17.355 -22.032 1.00 0.00 H new ATOM 0 HB3 GLU A 102 19.243 -15.700 -22.140 1.00 0.00 H new ATOM 0 HG2 GLU A 102 21.528 -16.352 -21.704 1.00 0.00 H new ATOM 0 HG3 GLU A 102 21.051 -17.964 -21.208 1.00 0.00 H new ATOM 1532 N ASP A 103 21.185 -15.721 -19.041 1.00 0.00 N ATOM 1533 CA ASP A 103 22.127 -14.803 -18.393 1.00 0.00 C ATOM 1534 C ASP A 103 22.928 -13.951 -19.406 1.00 0.00 C ATOM 1535 O ASP A 103 23.678 -14.518 -20.205 1.00 0.00 O ATOM 1536 CB ASP A 103 23.019 -15.576 -17.409 1.00 0.00 C ATOM 1537 CG ASP A 103 24.023 -16.565 -18.037 1.00 0.00 C ATOM 1538 OD1 ASP A 103 23.600 -17.463 -18.804 1.00 0.00 O ATOM 1539 OD2 ASP A 103 25.222 -16.501 -17.666 1.00 0.00 O ATOM 0 H ASP A 103 21.543 -16.672 -19.128 1.00 0.00 H new ATOM 0 HA ASP A 103 21.554 -14.075 -17.819 1.00 0.00 H new ATOM 0 HB2 ASP A 103 23.576 -14.855 -16.811 1.00 0.00 H new ATOM 0 HB3 ASP A 103 22.376 -16.128 -16.724 1.00 0.00 H new ATOM 1544 N PRO A 104 22.782 -12.606 -19.409 1.00 0.00 N ATOM 1545 CA PRO A 104 23.334 -11.747 -20.468 1.00 0.00 C ATOM 1546 C PRO A 104 24.805 -11.344 -20.280 1.00 0.00 C ATOM 1547 O PRO A 104 25.507 -11.095 -21.257 1.00 0.00 O ATOM 1548 CB PRO A 104 22.431 -10.515 -20.464 1.00 0.00 C ATOM 1549 CG PRO A 104 22.014 -10.375 -19.002 1.00 0.00 C ATOM 1550 CD PRO A 104 21.870 -11.832 -18.569 1.00 0.00 C ATOM 0 HA PRO A 104 23.344 -12.290 -21.413 1.00 0.00 H new ATOM 0 HB2 PRO A 104 22.961 -9.630 -20.816 1.00 0.00 H new ATOM 0 HB3 PRO A 104 21.567 -10.650 -21.115 1.00 0.00 H new ATOM 0 HG2 PRO A 104 22.764 -9.847 -18.413 1.00 0.00 H new ATOM 0 HG3 PRO A 104 21.080 -9.824 -18.896 1.00 0.00 H new ATOM 0 HD2 PRO A 104 22.119 -11.950 -17.514 1.00 0.00 H new ATOM 0 HD3 PRO A 104 20.843 -12.174 -18.694 1.00 0.00 H new ATOM 1558 N ASP A 105 25.292 -11.286 -19.041 1.00 0.00 N ATOM 1559 CA ASP A 105 26.647 -10.899 -18.653 1.00 0.00 C ATOM 1560 C ASP A 105 27.685 -11.968 -19.043 1.00 0.00 C ATOM 1561 O ASP A 105 28.092 -12.815 -18.246 1.00 0.00 O ATOM 1562 CB ASP A 105 26.659 -10.508 -17.164 1.00 0.00 C ATOM 1563 CG ASP A 105 26.183 -11.584 -16.182 1.00 0.00 C ATOM 1564 OD1 ASP A 105 25.151 -12.255 -16.436 1.00 0.00 O ATOM 1565 OD2 ASP A 105 26.809 -11.737 -15.110 1.00 0.00 O ATOM 0 H ASP A 105 24.716 -11.522 -18.233 1.00 0.00 H new ATOM 0 HA ASP A 105 26.954 -10.017 -19.214 1.00 0.00 H new ATOM 0 HB2 ASP A 105 27.675 -10.221 -16.893 1.00 0.00 H new ATOM 0 HB3 ASP A 105 26.033 -9.625 -17.036 1.00 0.00 H new ATOM 1570 N GLY A 106 28.083 -11.915 -20.319 1.00 0.00 N ATOM 1571 CA GLY A 106 28.963 -12.875 -21.001 1.00 0.00 C ATOM 1572 C GLY A 106 28.550 -13.172 -22.455 1.00 0.00 C ATOM 1573 O GLY A 106 29.318 -13.784 -23.200 1.00 0.00 O ATOM 0 H GLY A 106 27.785 -11.161 -20.938 1.00 0.00 H new ATOM 0 HA2 GLY A 106 29.982 -12.488 -20.994 1.00 0.00 H new ATOM 0 HA3 GLY A 106 28.973 -13.808 -20.438 1.00 0.00 H new ATOM 1577 N GLN A 107 27.358 -12.726 -22.869 1.00 0.00 N ATOM 1578 CA GLN A 107 26.822 -12.842 -24.232 1.00 0.00 C ATOM 1579 C GLN A 107 27.176 -11.607 -25.090 1.00 0.00 C ATOM 1580 O GLN A 107 27.739 -10.625 -24.595 1.00 0.00 O ATOM 1581 CB GLN A 107 25.289 -13.031 -24.182 1.00 0.00 C ATOM 1582 CG GLN A 107 24.754 -13.995 -23.108 1.00 0.00 C ATOM 1583 CD GLN A 107 25.225 -15.444 -23.210 1.00 0.00 C ATOM 1584 OE1 GLN A 107 25.785 -15.904 -24.197 1.00 0.00 O ATOM 1585 NE2 GLN A 107 24.996 -16.217 -22.170 1.00 0.00 N ATOM 0 H GLN A 107 26.712 -12.254 -22.236 1.00 0.00 H new ATOM 0 HA GLN A 107 27.281 -13.714 -24.699 1.00 0.00 H new ATOM 0 HB2 GLN A 107 24.829 -12.055 -24.025 1.00 0.00 H new ATOM 0 HB3 GLN A 107 24.956 -13.387 -25.157 1.00 0.00 H new ATOM 0 HG2 GLN A 107 25.039 -13.610 -22.129 1.00 0.00 H new ATOM 0 HG3 GLN A 107 23.665 -13.985 -23.150 1.00 0.00 H new ATOM 0 HE21 GLN A 107 24.530 -15.838 -21.346 1.00 0.00 H new ATOM 0 HE22 GLN A 107 25.285 -17.195 -22.188 1.00 0.00 H new ATOM 1594 N SER A 108 26.816 -11.634 -26.379 1.00 0.00 N ATOM 1595 CA SER A 108 26.888 -10.460 -27.263 1.00 0.00 C ATOM 1596 C SER A 108 25.822 -9.416 -26.903 1.00 0.00 C ATOM 1597 O SER A 108 24.803 -9.728 -26.279 1.00 0.00 O ATOM 1598 CB SER A 108 26.755 -10.894 -28.729 1.00 0.00 C ATOM 1599 OG SER A 108 25.469 -11.450 -28.971 1.00 0.00 O ATOM 0 H SER A 108 26.465 -12.473 -26.842 1.00 0.00 H new ATOM 0 HA SER A 108 27.862 -9.990 -27.122 1.00 0.00 H new ATOM 0 HB2 SER A 108 26.916 -10.037 -29.384 1.00 0.00 H new ATOM 0 HB3 SER A 108 27.525 -11.627 -28.968 1.00 0.00 H new ATOM 0 HG SER A 108 25.401 -11.720 -29.911 1.00 0.00 H new ATOM 1605 N LEU A 109 26.027 -8.159 -27.326 1.00 0.00 N ATOM 1606 CA LEU A 109 25.110 -7.053 -27.006 1.00 0.00 C ATOM 1607 C LEU A 109 23.710 -7.271 -27.597 1.00 0.00 C ATOM 1608 O LEU A 109 22.728 -6.915 -26.964 1.00 0.00 O ATOM 1609 CB LEU A 109 25.723 -5.705 -27.445 1.00 0.00 C ATOM 1610 CG LEU A 109 26.654 -5.076 -26.389 1.00 0.00 C ATOM 1611 CD1 LEU A 109 27.921 -5.889 -26.120 1.00 0.00 C ATOM 1612 CD2 LEU A 109 27.080 -3.675 -26.826 1.00 0.00 C ATOM 0 H LEU A 109 26.827 -7.881 -27.895 1.00 0.00 H new ATOM 0 HA LEU A 109 24.978 -7.028 -25.924 1.00 0.00 H new ATOM 0 HB2 LEU A 109 26.283 -5.854 -28.368 1.00 0.00 H new ATOM 0 HB3 LEU A 109 24.918 -5.006 -27.670 1.00 0.00 H new ATOM 0 HG LEU A 109 26.071 -5.050 -25.468 1.00 0.00 H new ATOM 0 HD11 LEU A 109 28.525 -5.383 -25.367 1.00 0.00 H new ATOM 0 HD12 LEU A 109 27.647 -6.881 -25.760 1.00 0.00 H new ATOM 0 HD13 LEU A 109 28.495 -5.983 -27.042 1.00 0.00 H new ATOM 0 HD21 LEU A 109 27.737 -3.243 -26.071 1.00 0.00 H new ATOM 0 HD22 LEU A 109 27.610 -3.736 -27.777 1.00 0.00 H new ATOM 0 HD23 LEU A 109 26.197 -3.046 -26.942 1.00 0.00 H new ATOM 1624 N GLU A 110 23.584 -7.946 -28.739 1.00 0.00 N ATOM 1625 CA GLU A 110 22.279 -8.320 -29.321 1.00 0.00 C ATOM 1626 C GLU A 110 21.468 -9.238 -28.392 1.00 0.00 C ATOM 1627 O GLU A 110 20.265 -9.043 -28.205 1.00 0.00 O ATOM 1628 CB GLU A 110 22.509 -9.044 -30.652 1.00 0.00 C ATOM 1629 CG GLU A 110 23.092 -8.124 -31.734 1.00 0.00 C ATOM 1630 CD GLU A 110 23.232 -8.878 -33.073 1.00 0.00 C ATOM 1631 OE1 GLU A 110 22.267 -8.878 -33.881 1.00 0.00 O ATOM 1632 OE2 GLU A 110 24.308 -9.470 -33.336 1.00 0.00 O ATOM 0 H GLU A 110 24.382 -8.254 -29.295 1.00 0.00 H new ATOM 0 HA GLU A 110 21.710 -7.402 -29.467 1.00 0.00 H new ATOM 0 HB2 GLU A 110 23.185 -9.884 -30.492 1.00 0.00 H new ATOM 0 HB3 GLU A 110 21.564 -9.458 -31.004 1.00 0.00 H new ATOM 0 HG2 GLU A 110 22.447 -7.255 -31.866 1.00 0.00 H new ATOM 0 HG3 GLU A 110 24.066 -7.753 -31.416 1.00 0.00 H new ATOM 1639 N VAL A 111 22.127 -10.203 -27.745 1.00 0.00 N ATOM 1640 CA VAL A 111 21.496 -11.107 -26.762 1.00 0.00 C ATOM 1641 C VAL A 111 21.202 -10.360 -25.460 1.00 0.00 C ATOM 1642 O VAL A 111 20.142 -10.547 -24.860 1.00 0.00 O ATOM 1643 CB VAL A 111 22.372 -12.353 -26.516 1.00 0.00 C ATOM 1644 CG1 VAL A 111 21.779 -13.274 -25.441 1.00 0.00 C ATOM 1645 CG2 VAL A 111 22.519 -13.179 -27.801 1.00 0.00 C ATOM 0 H VAL A 111 23.121 -10.385 -27.885 1.00 0.00 H new ATOM 0 HA VAL A 111 20.547 -11.453 -27.170 1.00 0.00 H new ATOM 0 HB VAL A 111 23.340 -11.980 -26.182 1.00 0.00 H new ATOM 0 HG11 VAL A 111 22.430 -14.137 -25.302 1.00 0.00 H new ATOM 0 HG12 VAL A 111 21.694 -12.729 -24.501 1.00 0.00 H new ATOM 0 HG13 VAL A 111 20.791 -13.611 -25.755 1.00 0.00 H new ATOM 0 HG21 VAL A 111 23.141 -14.052 -27.603 1.00 0.00 H new ATOM 0 HG22 VAL A 111 21.535 -13.503 -28.140 1.00 0.00 H new ATOM 0 HG23 VAL A 111 22.986 -12.569 -28.574 1.00 0.00 H new ATOM 1655 N PHE A 112 22.083 -9.434 -25.076 1.00 0.00 N ATOM 1656 CA PHE A 112 21.882 -8.543 -23.927 1.00 0.00 C ATOM 1657 C PHE A 112 20.620 -7.686 -24.120 1.00 0.00 C ATOM 1658 O PHE A 112 19.728 -7.725 -23.276 1.00 0.00 O ATOM 1659 CB PHE A 112 23.155 -7.702 -23.694 1.00 0.00 C ATOM 1660 CG PHE A 112 23.545 -7.504 -22.246 1.00 0.00 C ATOM 1661 CD1 PHE A 112 22.671 -6.884 -21.332 1.00 0.00 C ATOM 1662 CD2 PHE A 112 24.793 -7.980 -21.803 1.00 0.00 C ATOM 1663 CE1 PHE A 112 23.050 -6.756 -19.983 1.00 0.00 C ATOM 1664 CE2 PHE A 112 25.169 -7.836 -20.460 1.00 0.00 C ATOM 1665 CZ PHE A 112 24.306 -7.212 -19.547 1.00 0.00 C ATOM 0 H PHE A 112 22.968 -9.278 -25.559 1.00 0.00 H new ATOM 0 HA PHE A 112 21.714 -9.132 -23.026 1.00 0.00 H new ATOM 0 HB2 PHE A 112 23.986 -8.179 -24.214 1.00 0.00 H new ATOM 0 HB3 PHE A 112 23.012 -6.723 -24.151 1.00 0.00 H new ATOM 0 HD1 PHE A 112 21.715 -6.509 -21.665 1.00 0.00 H new ATOM 0 HD2 PHE A 112 25.464 -8.458 -22.501 1.00 0.00 H new ATOM 0 HE1 PHE A 112 22.370 -6.303 -19.276 1.00 0.00 H new ATOM 0 HE2 PHE A 112 26.127 -8.207 -20.127 1.00 0.00 H new ATOM 0 HZ PHE A 112 24.604 -7.083 -18.517 1.00 0.00 H new ATOM 1675 N ARG A 113 20.468 -7.029 -25.285 1.00 0.00 N ATOM 1676 CA ARG A 113 19.254 -6.282 -25.696 1.00 0.00 C ATOM 1677 C ARG A 113 18.008 -7.172 -25.843 1.00 0.00 C ATOM 1678 O ARG A 113 16.897 -6.687 -25.672 1.00 0.00 O ATOM 1679 CB ARG A 113 19.502 -5.516 -27.015 1.00 0.00 C ATOM 1680 CG ARG A 113 20.539 -4.393 -26.861 1.00 0.00 C ATOM 1681 CD ARG A 113 20.538 -3.458 -28.078 1.00 0.00 C ATOM 1682 NE ARG A 113 21.615 -2.450 -27.991 1.00 0.00 N ATOM 1683 CZ ARG A 113 22.704 -2.369 -28.733 1.00 0.00 C ATOM 1684 NH1 ARG A 113 23.022 -3.263 -29.628 1.00 0.00 N ATOM 1685 NH2 ARG A 113 23.511 -1.365 -28.585 1.00 0.00 N ATOM 0 H ARG A 113 21.205 -7.000 -25.990 1.00 0.00 H new ATOM 0 HA ARG A 113 19.051 -5.578 -24.889 1.00 0.00 H new ATOM 0 HB2 ARG A 113 19.841 -6.216 -27.779 1.00 0.00 H new ATOM 0 HB3 ARG A 113 18.562 -5.091 -27.366 1.00 0.00 H new ATOM 0 HG2 ARG A 113 20.325 -3.819 -25.959 1.00 0.00 H new ATOM 0 HG3 ARG A 113 21.531 -4.827 -26.734 1.00 0.00 H new ATOM 0 HD2 ARG A 113 20.661 -4.045 -28.988 1.00 0.00 H new ATOM 0 HD3 ARG A 113 19.574 -2.955 -28.150 1.00 0.00 H new ATOM 0 HE ARG A 113 21.504 -1.733 -27.274 1.00 0.00 H new ATOM 0 HH11 ARG A 113 22.417 -4.070 -29.780 1.00 0.00 H new ATOM 0 HH12 ARG A 113 23.875 -3.155 -30.176 1.00 0.00 H new ATOM 0 HH21 ARG A 113 23.304 -0.641 -27.897 1.00 0.00 H new ATOM 0 HH22 ARG A 113 24.353 -1.299 -29.157 1.00 0.00 H new ATOM 1699 N THR A 114 18.179 -8.471 -26.073 1.00 0.00 N ATOM 1700 CA THR A 114 17.078 -9.448 -26.243 1.00 0.00 C ATOM 1701 C THR A 114 16.433 -9.796 -24.909 1.00 0.00 C ATOM 1702 O THR A 114 15.236 -9.564 -24.747 1.00 0.00 O ATOM 1703 CB THR A 114 17.512 -10.720 -26.994 1.00 0.00 C ATOM 1704 OG1 THR A 114 17.889 -10.386 -28.313 1.00 0.00 O ATOM 1705 CG2 THR A 114 16.392 -11.761 -27.113 1.00 0.00 C ATOM 0 H THR A 114 19.103 -8.895 -26.150 1.00 0.00 H new ATOM 0 HA THR A 114 16.332 -8.957 -26.868 1.00 0.00 H new ATOM 0 HB THR A 114 18.334 -11.143 -26.416 1.00 0.00 H new ATOM 0 HG1 THR A 114 18.740 -9.901 -28.297 1.00 0.00 H new ATOM 0 HG21 THR A 114 16.762 -12.633 -27.652 1.00 0.00 H new ATOM 0 HG22 THR A 114 16.067 -12.061 -26.117 1.00 0.00 H new ATOM 0 HG23 THR A 114 15.550 -11.330 -27.655 1.00 0.00 H new ATOM 1713 N VAL A 115 17.191 -10.259 -23.901 1.00 0.00 N ATOM 1714 CA VAL A 115 16.599 -10.525 -22.579 1.00 0.00 C ATOM 1715 C VAL A 115 16.114 -9.224 -21.929 1.00 0.00 C ATOM 1716 O VAL A 115 15.066 -9.213 -21.307 1.00 0.00 O ATOM 1717 CB VAL A 115 17.529 -11.356 -21.680 1.00 0.00 C ATOM 1718 CG1 VAL A 115 17.928 -12.675 -22.353 1.00 0.00 C ATOM 1719 CG2 VAL A 115 18.794 -10.620 -21.240 1.00 0.00 C ATOM 0 H VAL A 115 18.190 -10.453 -23.971 1.00 0.00 H new ATOM 0 HA VAL A 115 15.717 -11.149 -22.721 1.00 0.00 H new ATOM 0 HB VAL A 115 16.941 -11.553 -20.784 1.00 0.00 H new ATOM 0 HG11 VAL A 115 18.585 -13.237 -21.690 1.00 0.00 H new ATOM 0 HG12 VAL A 115 17.034 -13.262 -22.561 1.00 0.00 H new ATOM 0 HG13 VAL A 115 18.449 -12.464 -23.287 1.00 0.00 H new ATOM 0 HG21 VAL A 115 19.395 -11.275 -20.609 1.00 0.00 H new ATOM 0 HG22 VAL A 115 19.371 -10.332 -22.118 1.00 0.00 H new ATOM 0 HG23 VAL A 115 18.519 -9.728 -20.678 1.00 0.00 H new ATOM 1729 N ARG A 116 16.788 -8.098 -22.189 1.00 0.00 N ATOM 1730 CA ARG A 116 16.368 -6.716 -21.847 1.00 0.00 C ATOM 1731 C ARG A 116 15.013 -6.330 -22.467 1.00 0.00 C ATOM 1732 O ARG A 116 14.152 -5.809 -21.770 1.00 0.00 O ATOM 1733 CB ARG A 116 17.567 -5.851 -22.286 1.00 0.00 C ATOM 1734 CG ARG A 116 17.548 -4.326 -22.338 1.00 0.00 C ATOM 1735 CD ARG A 116 16.764 -3.707 -23.505 1.00 0.00 C ATOM 1736 NE ARG A 116 17.493 -2.526 -24.027 1.00 0.00 N ATOM 1737 CZ ARG A 116 17.566 -2.090 -25.273 1.00 0.00 C ATOM 1738 NH1 ARG A 116 16.845 -2.587 -26.233 1.00 0.00 N ATOM 1739 NH2 ARG A 116 18.397 -1.137 -25.561 1.00 0.00 N ATOM 0 H ARG A 116 17.688 -8.117 -22.668 1.00 0.00 H new ATOM 0 HA ARG A 116 16.160 -6.578 -20.786 1.00 0.00 H new ATOM 0 HB2 ARG A 116 18.394 -6.122 -21.630 1.00 0.00 H new ATOM 0 HB3 ARG A 116 17.832 -6.186 -23.289 1.00 0.00 H new ATOM 0 HG2 ARG A 116 17.126 -3.955 -21.404 1.00 0.00 H new ATOM 0 HG3 ARG A 116 18.577 -3.970 -22.387 1.00 0.00 H new ATOM 0 HD2 ARG A 116 16.631 -4.444 -24.297 1.00 0.00 H new ATOM 0 HD3 ARG A 116 15.768 -3.414 -23.172 1.00 0.00 H new ATOM 0 HE ARG A 116 18.005 -1.979 -23.335 1.00 0.00 H new ATOM 0 HH11 ARG A 116 16.190 -3.345 -26.039 1.00 0.00 H new ATOM 0 HH12 ARG A 116 16.934 -2.220 -27.180 1.00 0.00 H new ATOM 0 HH21 ARG A 116 18.984 -0.734 -24.830 1.00 0.00 H new ATOM 0 HH22 ARG A 116 18.464 -0.791 -26.518 1.00 0.00 H new ATOM 1753 N GLY A 117 14.780 -6.658 -23.737 1.00 0.00 N ATOM 1754 CA GLY A 117 13.484 -6.461 -24.415 1.00 0.00 C ATOM 1755 C GLY A 117 12.373 -7.374 -23.882 1.00 0.00 C ATOM 1756 O GLY A 117 11.248 -6.925 -23.668 1.00 0.00 O ATOM 0 H GLY A 117 15.491 -7.074 -24.339 1.00 0.00 H new ATOM 0 HA2 GLY A 117 13.176 -5.422 -24.300 1.00 0.00 H new ATOM 0 HA3 GLY A 117 13.610 -6.640 -25.483 1.00 0.00 H new ATOM 1760 N GLN A 118 12.698 -8.631 -23.557 1.00 0.00 N ATOM 1761 CA GLN A 118 11.781 -9.531 -22.840 1.00 0.00 C ATOM 1762 C GLN A 118 11.426 -8.993 -21.451 1.00 0.00 C ATOM 1763 O GLN A 118 10.260 -9.002 -21.060 1.00 0.00 O ATOM 1764 CB GLN A 118 12.411 -10.921 -22.686 1.00 0.00 C ATOM 1765 CG GLN A 118 12.451 -11.686 -24.015 1.00 0.00 C ATOM 1766 CD GLN A 118 13.100 -13.051 -23.836 1.00 0.00 C ATOM 1767 OE1 GLN A 118 14.031 -13.437 -24.529 1.00 0.00 O ATOM 1768 NE2 GLN A 118 12.644 -13.819 -22.870 1.00 0.00 N ATOM 0 H GLN A 118 13.599 -9.053 -23.781 1.00 0.00 H new ATOM 0 HA GLN A 118 10.868 -9.596 -23.432 1.00 0.00 H new ATOM 0 HB2 GLN A 118 13.424 -10.818 -22.296 1.00 0.00 H new ATOM 0 HB3 GLN A 118 11.845 -11.496 -21.954 1.00 0.00 H new ATOM 0 HG2 GLN A 118 11.438 -11.808 -24.400 1.00 0.00 H new ATOM 0 HG3 GLN A 118 13.006 -11.109 -24.755 1.00 0.00 H new ATOM 0 HE21 GLN A 118 11.868 -13.501 -22.289 1.00 0.00 H new ATOM 0 HE22 GLN A 118 13.067 -14.732 -22.702 1.00 0.00 H new ATOM 1777 N VAL A 119 12.428 -8.484 -20.722 1.00 0.00 N ATOM 1778 CA VAL A 119 12.224 -7.864 -19.409 1.00 0.00 C ATOM 1779 C VAL A 119 11.255 -6.689 -19.537 1.00 0.00 C ATOM 1780 O VAL A 119 10.300 -6.652 -18.778 1.00 0.00 O ATOM 1781 CB VAL A 119 13.554 -7.417 -18.757 1.00 0.00 C ATOM 1782 CG1 VAL A 119 13.385 -6.458 -17.577 1.00 0.00 C ATOM 1783 CG2 VAL A 119 14.312 -8.617 -18.198 1.00 0.00 C ATOM 0 H VAL A 119 13.401 -8.491 -21.027 1.00 0.00 H new ATOM 0 HA VAL A 119 11.792 -8.616 -18.748 1.00 0.00 H new ATOM 0 HB VAL A 119 14.086 -6.912 -19.563 1.00 0.00 H new ATOM 0 HG11 VAL A 119 14.365 -6.195 -17.179 1.00 0.00 H new ATOM 0 HG12 VAL A 119 12.875 -5.555 -17.912 1.00 0.00 H new ATOM 0 HG13 VAL A 119 12.794 -6.940 -16.798 1.00 0.00 H new ATOM 0 HG21 VAL A 119 15.244 -8.280 -17.744 1.00 0.00 H new ATOM 0 HG22 VAL A 119 13.701 -9.115 -17.445 1.00 0.00 H new ATOM 0 HG23 VAL A 119 14.533 -9.316 -19.005 1.00 0.00 H new ATOM 1793 N LYS A 120 11.430 -5.782 -20.509 1.00 0.00 N ATOM 1794 CA LYS A 120 10.487 -4.671 -20.760 1.00 0.00 C ATOM 1795 C LYS A 120 9.038 -5.170 -20.850 1.00 0.00 C ATOM 1796 O LYS A 120 8.189 -4.736 -20.078 1.00 0.00 O ATOM 1797 CB LYS A 120 10.895 -3.915 -22.035 1.00 0.00 C ATOM 1798 CG LYS A 120 10.007 -2.679 -22.268 1.00 0.00 C ATOM 1799 CD LYS A 120 10.430 -1.937 -23.540 1.00 0.00 C ATOM 1800 CE LYS A 120 9.505 -0.735 -23.787 1.00 0.00 C ATOM 1801 NZ LYS A 120 9.803 -0.056 -25.082 1.00 0.00 N ATOM 0 H LYS A 120 12.227 -5.794 -21.145 1.00 0.00 H new ATOM 0 HA LYS A 120 10.535 -3.984 -19.915 1.00 0.00 H new ATOM 0 HB2 LYS A 120 11.937 -3.606 -21.958 1.00 0.00 H new ATOM 0 HB3 LYS A 120 10.823 -4.583 -22.894 1.00 0.00 H new ATOM 0 HG2 LYS A 120 8.964 -2.985 -22.350 1.00 0.00 H new ATOM 0 HG3 LYS A 120 10.076 -2.009 -21.411 1.00 0.00 H new ATOM 0 HD2 LYS A 120 11.462 -1.598 -23.446 1.00 0.00 H new ATOM 0 HD3 LYS A 120 10.394 -2.614 -24.393 1.00 0.00 H new ATOM 0 HE2 LYS A 120 8.468 -1.069 -23.784 1.00 0.00 H new ATOM 0 HE3 LYS A 120 9.613 -0.021 -22.970 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 9.156 0.749 -25.209 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 10.785 0.286 -25.077 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 9.675 -0.729 -25.864 1.00 0.00 H new ATOM 1815 N GLU A 121 8.779 -6.128 -21.740 1.00 0.00 N ATOM 1816 CA GLU A 121 7.431 -6.659 -21.987 1.00 0.00 C ATOM 1817 C GLU A 121 6.805 -7.311 -20.740 1.00 0.00 C ATOM 1818 O GLU A 121 5.641 -7.055 -20.419 1.00 0.00 O ATOM 1819 CB GLU A 121 7.496 -7.642 -23.169 1.00 0.00 C ATOM 1820 CG GLU A 121 6.114 -8.140 -23.604 1.00 0.00 C ATOM 1821 CD GLU A 121 6.220 -9.024 -24.860 1.00 0.00 C ATOM 1822 OE1 GLU A 121 6.480 -10.246 -24.731 1.00 0.00 O ATOM 1823 OE2 GLU A 121 6.037 -8.508 -25.990 1.00 0.00 O ATOM 0 H GLU A 121 9.500 -6.563 -22.315 1.00 0.00 H new ATOM 0 HA GLU A 121 6.774 -5.826 -22.236 1.00 0.00 H new ATOM 0 HB2 GLU A 121 7.984 -7.156 -24.014 1.00 0.00 H new ATOM 0 HB3 GLU A 121 8.114 -8.496 -22.892 1.00 0.00 H new ATOM 0 HG2 GLU A 121 5.655 -8.706 -22.793 1.00 0.00 H new ATOM 0 HG3 GLU A 121 5.463 -7.289 -23.807 1.00 0.00 H new ATOM 1830 N ARG A 122 7.581 -8.116 -19.998 1.00 0.00 N ATOM 1831 CA ARG A 122 7.093 -8.789 -18.781 1.00 0.00 C ATOM 1832 C ARG A 122 6.987 -7.838 -17.576 1.00 0.00 C ATOM 1833 O ARG A 122 6.038 -7.944 -16.801 1.00 0.00 O ATOM 1834 CB ARG A 122 7.958 -10.026 -18.494 1.00 0.00 C ATOM 1835 CG ARG A 122 7.854 -11.100 -19.594 1.00 0.00 C ATOM 1836 CD ARG A 122 8.440 -12.443 -19.140 1.00 0.00 C ATOM 1837 NE ARG A 122 7.476 -13.197 -18.300 1.00 0.00 N ATOM 1838 CZ ARG A 122 6.577 -14.082 -18.710 1.00 0.00 C ATOM 1839 NH1 ARG A 122 6.418 -14.379 -19.970 1.00 0.00 N ATOM 1840 NH2 ARG A 122 5.804 -14.698 -17.869 1.00 0.00 N ATOM 0 H ARG A 122 8.556 -8.319 -20.220 1.00 0.00 H new ATOM 0 HA ARG A 122 6.071 -9.123 -18.960 1.00 0.00 H new ATOM 0 HB2 ARG A 122 8.999 -9.719 -18.391 1.00 0.00 H new ATOM 0 HB3 ARG A 122 7.657 -10.460 -17.540 1.00 0.00 H new ATOM 0 HG2 ARG A 122 6.809 -11.235 -19.871 1.00 0.00 H new ATOM 0 HG3 ARG A 122 8.379 -10.758 -20.486 1.00 0.00 H new ATOM 0 HD2 ARG A 122 8.708 -13.038 -20.013 1.00 0.00 H new ATOM 0 HD3 ARG A 122 9.358 -12.270 -18.578 1.00 0.00 H new ATOM 0 HE ARG A 122 7.508 -13.014 -17.297 1.00 0.00 H new ATOM 0 HH11 ARG A 122 6.996 -13.925 -20.678 1.00 0.00 H new ATOM 0 HH12 ARG A 122 5.716 -15.065 -20.248 1.00 0.00 H new ATOM 0 HH21 ARG A 122 5.881 -14.505 -16.870 1.00 0.00 H new ATOM 0 HH22 ARG A 122 5.120 -15.375 -18.207 1.00 0.00 H new ATOM 1854 N VAL A 123 7.874 -6.848 -17.462 1.00 0.00 N ATOM 1855 CA VAL A 123 7.790 -5.773 -16.454 1.00 0.00 C ATOM 1856 C VAL A 123 6.542 -4.920 -16.659 1.00 0.00 C ATOM 1857 O VAL A 123 5.860 -4.645 -15.676 1.00 0.00 O ATOM 1858 CB VAL A 123 9.020 -4.853 -16.461 1.00 0.00 C ATOM 1859 CG1 VAL A 123 8.780 -3.627 -15.586 1.00 0.00 C ATOM 1860 CG2 VAL A 123 10.246 -5.538 -15.852 1.00 0.00 C ATOM 0 H VAL A 123 8.686 -6.763 -18.074 1.00 0.00 H new ATOM 0 HA VAL A 123 7.744 -6.278 -15.489 1.00 0.00 H new ATOM 0 HB VAL A 123 9.188 -4.593 -17.506 1.00 0.00 H new ATOM 0 HG11 VAL A 123 9.663 -2.988 -15.605 1.00 0.00 H new ATOM 0 HG12 VAL A 123 7.922 -3.072 -15.965 1.00 0.00 H new ATOM 0 HG13 VAL A 123 8.583 -3.944 -14.562 1.00 0.00 H new ATOM 0 HG21 VAL A 123 11.094 -4.854 -15.876 1.00 0.00 H new ATOM 0 HG22 VAL A 123 10.033 -5.815 -14.820 1.00 0.00 H new ATOM 0 HG23 VAL A 123 10.485 -6.433 -16.426 1.00 0.00 H new ATOM 1870 N GLU A 124 6.232 -4.500 -17.892 1.00 0.00 N ATOM 1871 CA GLU A 124 5.019 -3.719 -18.188 1.00 0.00 C ATOM 1872 C GLU A 124 3.788 -4.436 -17.631 1.00 0.00 C ATOM 1873 O GLU A 124 3.074 -3.895 -16.793 1.00 0.00 O ATOM 1874 CB GLU A 124 4.836 -3.507 -19.704 1.00 0.00 C ATOM 1875 CG GLU A 124 5.717 -2.407 -20.300 1.00 0.00 C ATOM 1876 CD GLU A 124 5.395 -2.208 -21.794 1.00 0.00 C ATOM 1877 OE1 GLU A 124 5.955 -2.931 -22.653 1.00 0.00 O ATOM 1878 OE2 GLU A 124 4.572 -1.318 -22.124 1.00 0.00 O ATOM 0 H GLU A 124 6.810 -4.690 -18.711 1.00 0.00 H new ATOM 0 HA GLU A 124 5.132 -2.744 -17.715 1.00 0.00 H new ATOM 0 HB2 GLU A 124 5.049 -4.444 -20.218 1.00 0.00 H new ATOM 0 HB3 GLU A 124 3.792 -3.266 -19.901 1.00 0.00 H new ATOM 0 HG2 GLU A 124 5.558 -1.473 -19.760 1.00 0.00 H new ATOM 0 HG3 GLU A 124 6.768 -2.670 -20.180 1.00 0.00 H new ATOM 1885 N ASN A 125 3.606 -5.698 -18.022 1.00 0.00 N ATOM 1886 CA ASN A 125 2.533 -6.572 -17.548 1.00 0.00 C ATOM 1887 C ASN A 125 2.503 -6.697 -16.009 1.00 0.00 C ATOM 1888 O ASN A 125 1.428 -6.704 -15.415 1.00 0.00 O ATOM 1889 CB ASN A 125 2.716 -7.936 -18.245 1.00 0.00 C ATOM 1890 CG ASN A 125 1.542 -8.895 -18.088 1.00 0.00 C ATOM 1891 OD1 ASN A 125 0.425 -8.532 -17.749 1.00 0.00 O ATOM 1892 ND2 ASN A 125 1.755 -10.162 -18.362 1.00 0.00 N ATOM 0 H ASN A 125 4.220 -6.153 -18.697 1.00 0.00 H new ATOM 0 HA ASN A 125 1.564 -6.144 -17.805 1.00 0.00 H new ATOM 0 HB2 ASN A 125 2.888 -7.765 -19.308 1.00 0.00 H new ATOM 0 HB3 ASN A 125 3.613 -8.413 -17.849 1.00 0.00 H new ATOM 0 HD21 ASN A 125 0.991 -10.834 -18.291 1.00 0.00 H new ATOM 0 HD22 ASN A 125 2.684 -10.473 -18.646 1.00 0.00 H new ATOM 1899 N LEU A 126 3.663 -6.744 -15.343 1.00 0.00 N ATOM 1900 CA LEU A 126 3.750 -6.875 -13.884 1.00 0.00 C ATOM 1901 C LEU A 126 3.398 -5.570 -13.147 1.00 0.00 C ATOM 1902 O LEU A 126 2.476 -5.546 -12.333 1.00 0.00 O ATOM 1903 CB LEU A 126 5.152 -7.418 -13.528 1.00 0.00 C ATOM 1904 CG LEU A 126 5.380 -7.962 -12.106 1.00 0.00 C ATOM 1905 CD1 LEU A 126 5.600 -6.870 -11.063 1.00 0.00 C ATOM 1906 CD2 LEU A 126 4.240 -8.879 -11.654 1.00 0.00 C ATOM 0 H LEU A 126 4.572 -6.692 -15.803 1.00 0.00 H new ATOM 0 HA LEU A 126 2.999 -7.585 -13.538 1.00 0.00 H new ATOM 0 HB2 LEU A 126 5.389 -8.216 -14.232 1.00 0.00 H new ATOM 0 HB3 LEU A 126 5.872 -6.618 -13.698 1.00 0.00 H new ATOM 0 HG LEU A 126 6.301 -8.541 -12.174 1.00 0.00 H new ATOM 0 HD11 LEU A 126 5.754 -7.326 -10.085 1.00 0.00 H new ATOM 0 HD12 LEU A 126 6.478 -6.282 -11.331 1.00 0.00 H new ATOM 0 HD13 LEU A 126 4.726 -6.220 -11.027 1.00 0.00 H new ATOM 0 HD21 LEU A 126 4.442 -9.240 -10.646 1.00 0.00 H new ATOM 0 HD22 LEU A 126 3.302 -8.323 -11.660 1.00 0.00 H new ATOM 0 HD23 LEU A 126 4.163 -9.727 -12.335 1.00 0.00 H new ATOM 1918 N ILE A 127 4.105 -4.472 -13.437 1.00 0.00 N ATOM 1919 CA ILE A 127 3.933 -3.173 -12.783 1.00 0.00 C ATOM 1920 C ILE A 127 2.560 -2.554 -13.077 1.00 0.00 C ATOM 1921 O ILE A 127 1.960 -1.932 -12.202 1.00 0.00 O ATOM 1922 CB ILE A 127 5.135 -2.274 -13.190 1.00 0.00 C ATOM 1923 CG1 ILE A 127 5.747 -1.533 -11.988 1.00 0.00 C ATOM 1924 CG2 ILE A 127 4.870 -1.320 -14.368 1.00 0.00 C ATOM 1925 CD1 ILE A 127 4.781 -0.627 -11.223 1.00 0.00 C ATOM 0 H ILE A 127 4.832 -4.464 -14.153 1.00 0.00 H new ATOM 0 HA ILE A 127 3.938 -3.287 -11.699 1.00 0.00 H new ATOM 0 HB ILE A 127 5.875 -2.981 -13.565 1.00 0.00 H new ATOM 0 HG12 ILE A 127 6.154 -2.270 -11.296 1.00 0.00 H new ATOM 0 HG13 ILE A 127 6.584 -0.930 -12.341 1.00 0.00 H new ATOM 0 HG21 ILE A 127 5.768 -0.738 -14.574 1.00 0.00 H new ATOM 0 HG22 ILE A 127 4.602 -1.899 -15.252 1.00 0.00 H new ATOM 0 HG23 ILE A 127 4.051 -0.647 -14.114 1.00 0.00 H new ATOM 0 HD11 ILE A 127 5.307 -0.151 -10.396 1.00 0.00 H new ATOM 0 HD12 ILE A 127 4.391 0.138 -11.894 1.00 0.00 H new ATOM 0 HD13 ILE A 127 3.955 -1.222 -10.833 1.00 0.00 H new ATOM 1937 N ALA A 128 2.019 -2.765 -14.277 1.00 0.00 N ATOM 1938 CA ALA A 128 0.782 -2.115 -14.716 1.00 0.00 C ATOM 1939 C ALA A 128 -0.496 -2.697 -14.062 1.00 0.00 C ATOM 1940 O ALA A 128 -1.532 -2.032 -14.056 1.00 0.00 O ATOM 1941 CB ALA A 128 0.748 -2.131 -16.248 1.00 0.00 C ATOM 0 H ALA A 128 2.425 -3.391 -14.973 1.00 0.00 H new ATOM 0 HA ALA A 128 0.785 -1.081 -14.370 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -0.166 -1.651 -16.597 1.00 0.00 H new ATOM 0 HB2 ALA A 128 1.612 -1.592 -16.637 1.00 0.00 H new ATOM 0 HB3 ALA A 128 0.774 -3.162 -16.602 1.00 0.00 H new ATOM 1947 N LYS A 129 -0.419 -3.891 -13.446 1.00 0.00 N ATOM 1948 CA LYS A 129 -1.497 -4.475 -12.611 1.00 0.00 C ATOM 1949 C LYS A 129 -1.645 -3.794 -11.244 1.00 0.00 C ATOM 1950 O LYS A 129 -2.748 -3.740 -10.700 1.00 0.00 O ATOM 1951 CB LYS A 129 -1.230 -5.977 -12.400 1.00 0.00 C ATOM 1952 CG LYS A 129 -1.474 -6.791 -13.674 1.00 0.00 C ATOM 1953 CD LYS A 129 -1.052 -8.254 -13.463 1.00 0.00 C ATOM 1954 CE LYS A 129 -0.853 -8.971 -14.804 1.00 0.00 C ATOM 1955 NZ LYS A 129 -2.120 -9.151 -15.571 1.00 0.00 N ATOM 0 H LYS A 129 0.404 -4.490 -13.512 1.00 0.00 H new ATOM 0 HA LYS A 129 -2.430 -4.315 -13.151 1.00 0.00 H new ATOM 0 HB2 LYS A 129 -0.200 -6.119 -12.072 1.00 0.00 H new ATOM 0 HB3 LYS A 129 -1.873 -6.350 -11.603 1.00 0.00 H new ATOM 0 HG2 LYS A 129 -2.529 -6.745 -13.946 1.00 0.00 H new ATOM 0 HG3 LYS A 129 -0.912 -6.359 -14.502 1.00 0.00 H new ATOM 0 HD2 LYS A 129 -0.127 -8.289 -12.888 1.00 0.00 H new ATOM 0 HD3 LYS A 129 -1.811 -8.774 -12.878 1.00 0.00 H new ATOM 0 HE2 LYS A 129 -0.147 -8.403 -15.410 1.00 0.00 H new ATOM 0 HE3 LYS A 129 -0.404 -9.948 -14.623 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 -1.918 -9.641 -16.466 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 -2.788 -9.717 -15.010 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 -2.539 -8.221 -15.773 1.00 0.00 H new ATOM 1969 N ILE A 130 -0.532 -3.289 -10.699 1.00 0.00 N ATOM 1970 CA ILE A 130 -0.432 -2.708 -9.345 1.00 0.00 C ATOM 1971 C ILE A 130 -0.281 -1.172 -9.347 1.00 0.00 C ATOM 1972 O ILE A 130 -0.353 -0.548 -8.286 1.00 0.00 O ATOM 1973 CB ILE A 130 0.687 -3.413 -8.536 1.00 0.00 C ATOM 1974 CG1 ILE A 130 2.056 -3.283 -9.238 1.00 0.00 C ATOM 1975 CG2 ILE A 130 0.309 -4.887 -8.296 1.00 0.00 C ATOM 1976 CD1 ILE A 130 3.220 -3.962 -8.510 1.00 0.00 C ATOM 0 H ILE A 130 0.356 -3.271 -11.201 1.00 0.00 H new ATOM 0 HA ILE A 130 -1.382 -2.894 -8.844 1.00 0.00 H new ATOM 0 HB ILE A 130 0.782 -2.920 -7.568 1.00 0.00 H new ATOM 0 HG12 ILE A 130 1.976 -3.706 -10.239 1.00 0.00 H new ATOM 0 HG13 ILE A 130 2.288 -2.225 -9.357 1.00 0.00 H new ATOM 0 HG21 ILE A 130 1.099 -5.377 -7.727 1.00 0.00 H new ATOM 0 HG22 ILE A 130 -0.625 -4.937 -7.737 1.00 0.00 H new ATOM 0 HG23 ILE A 130 0.185 -5.392 -9.254 1.00 0.00 H new ATOM 0 HD11 ILE A 130 4.139 -3.817 -9.078 1.00 0.00 H new ATOM 0 HD12 ILE A 130 3.334 -3.524 -7.518 1.00 0.00 H new ATOM 0 HD13 ILE A 130 3.017 -5.029 -8.415 1.00 0.00 H new ATOM 1988 N SER A 131 -0.110 -0.563 -10.529 1.00 0.00 N ATOM 1989 CA SER A 131 -0.134 0.893 -10.760 1.00 0.00 C ATOM 1990 C SER A 131 -1.540 1.496 -10.603 1.00 0.00 C ATOM 1991 O SER A 131 -2.518 0.925 -11.140 1.00 0.00 O ATOM 1992 CB SER A 131 0.403 1.218 -12.151 1.00 0.00 C ATOM 1993 OG SER A 131 1.768 0.853 -12.218 1.00 0.00 O ATOM 1994 OXT SER A 131 -1.658 2.560 -9.955 1.00 0.00 O ATOM 0 H SER A 131 0.056 -1.090 -11.386 1.00 0.00 H new ATOM 0 HA SER A 131 0.504 1.340 -9.997 1.00 0.00 H new ATOM 0 HB2 SER A 131 -0.167 0.681 -12.909 1.00 0.00 H new ATOM 0 HB3 SER A 131 0.288 2.282 -12.359 1.00 0.00 H new ATOM 0 HG SER A 131 1.846 -0.124 -12.211 1.00 0.00 H new