USER MOD reduce.3.24.130724 H: found=0, std=0, add=919, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 919 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 112 ASN : amide:sc= -0.054 X(o=-0.21,f=-0.26) USER MOD Set 1.2: A 115 MET CE :methyl -172:sc= -0.156 (180deg=-0.338) USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 TYR OH : rot 180:sc= 0 USER MOD Single : A 9 LYS NZ :NH3+ 180:sc=-0.00266 (180deg=-0.00266) USER MOD Single : A 10 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 18 HIS : no HD1:sc= -0.474 X(o=-0.47,f=-0.54) USER MOD Single : A 20 THR OG1 : rot 180:sc= 0 USER MOD Single : A 25 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0501) USER MOD Single : A 26 THR OG1 : rot 180:sc= -0.885 USER MOD Single : A 27 SER OG : rot 38:sc= -0.138 USER MOD Single : A 35 CYS SG : rot 180:sc= 0 USER MOD Single : A 37 GLN : amide:sc= -0.198 K(o=-0.2,f=-1.2) USER MOD Single : A 38 ASN : amide:sc= -0.833 K(o=-0.83,f=-0.046) USER MOD Single : A 40 THR OG1 : rot 180:sc= 0.0211 USER MOD Single : A 45 THR OG1 : rot 78:sc= 0.41 USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 50 THR OG1 : rot 180:sc= 0 USER MOD Single : A 57 MET CE :methyl -175:sc= 0 (180deg=-0.0247) USER MOD Single : A 59 GLN : amide:sc= -1.23 X(o=-1.2,f=-1.2) USER MOD Single : A 62 GLN : amide:sc= -0.0285 K(o=-0.029,f=-1.4) USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 GLN : amide:sc= -0.265 K(o=-0.27,f=-1.8!) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 THR OG1 : rot 180:sc= 0.00266 USER MOD Single : A 93 MET CE :methyl -144:sc= 0 (180deg=-1.78!) USER MOD Single : A 101 TYR OH : rot 180:sc= 0 USER MOD Single : A 104 THR OG1 : rot 76:sc= 0.982 USER MOD Single : A 105 SER OG : rot -48:sc= 0.889 USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 111 SER OG : rot 180:sc= 0 USER MOD Single : A 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 130 ASN : amide:sc= -0.648 K(o=-0.65,f=-3.8) USER MOD Single : A 131 TYR OH : rot 180:sc= 0 USER MOD Single : A 132 HIS : no HD1:sc= 0 X(o=0,f=-0.04) USER MOD Single : A 136 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 137 MET CE :methyl 157:sc= -0.266 (180deg=-0.848) USER MOD ----------------------------------------------------------------- ATOM 40 N ASP A 5 -22.186 12.832 -8.596 1.00 0.00 N ATOM 41 CA ASP A 5 -20.946 12.062 -8.630 1.00 0.00 C ATOM 42 C ASP A 5 -19.978 12.548 -7.556 1.00 0.00 C ATOM 43 O ASP A 5 -19.120 13.391 -7.810 1.00 0.00 O ATOM 44 CB ASP A 5 -20.298 12.155 -10.016 1.00 0.00 C ATOM 45 CG ASP A 5 -21.190 11.597 -11.110 1.00 0.00 C ATOM 46 OD1 ASP A 5 -21.117 10.378 -11.372 1.00 0.00 O ATOM 47 OD2 ASP A 5 -21.962 12.379 -11.703 1.00 0.00 O ATOM 0 HA ASP A 5 -21.185 11.018 -8.426 1.00 0.00 H new ATOM 0 HB2 ASP A 5 -20.066 13.197 -10.236 1.00 0.00 H new ATOM 0 HB3 ASP A 5 -19.353 11.612 -10.009 1.00 0.00 H new ATOM 52 N SER A 6 -20.132 12.006 -6.351 1.00 0.00 N ATOM 53 CA SER A 6 -19.280 12.375 -5.224 1.00 0.00 C ATOM 54 C SER A 6 -17.829 11.926 -5.437 1.00 0.00 C ATOM 55 O SER A 6 -16.904 12.700 -5.203 1.00 0.00 O ATOM 56 CB SER A 6 -19.828 11.778 -3.925 1.00 0.00 C ATOM 57 OG SER A 6 -19.387 12.515 -2.798 1.00 0.00 O ATOM 0 H SER A 6 -20.841 11.307 -6.129 1.00 0.00 H new ATOM 0 HA SER A 6 -19.285 13.463 -5.152 1.00 0.00 H new ATOM 0 HB2 SER A 6 -20.918 11.772 -3.955 1.00 0.00 H new ATOM 0 HB3 SER A 6 -19.506 10.741 -3.834 1.00 0.00 H new ATOM 0 HG SER A 6 -19.752 12.114 -1.982 1.00 0.00 H new ATOM 63 N PRO A 7 -17.602 10.663 -5.869 1.00 0.00 N ATOM 64 CA PRO A 7 -16.249 10.127 -6.091 1.00 0.00 C ATOM 65 C PRO A 7 -15.561 10.681 -7.346 1.00 0.00 C ATOM 66 O PRO A 7 -14.335 10.615 -7.454 1.00 0.00 O ATOM 67 CB PRO A 7 -16.473 8.612 -6.242 1.00 0.00 C ATOM 68 CG PRO A 7 -17.898 8.370 -5.870 1.00 0.00 C ATOM 69 CD PRO A 7 -18.625 9.649 -6.157 1.00 0.00 C ATOM 0 HA PRO A 7 -15.588 10.405 -5.270 1.00 0.00 H new ATOM 0 HB2 PRO A 7 -16.276 8.288 -7.264 1.00 0.00 H new ATOM 0 HB3 PRO A 7 -15.799 8.051 -5.594 1.00 0.00 H new ATOM 0 HG2 PRO A 7 -18.317 7.546 -6.447 1.00 0.00 H new ATOM 0 HG3 PRO A 7 -17.986 8.099 -4.818 1.00 0.00 H new ATOM 0 HD2 PRO A 7 -18.967 9.699 -7.191 1.00 0.00 H new ATOM 0 HD3 PRO A 7 -19.504 9.768 -5.524 1.00 0.00 H new ATOM 77 N TYR A 8 -16.342 11.198 -8.301 1.00 0.00 N ATOM 78 CA TYR A 8 -15.778 11.727 -9.546 1.00 0.00 C ATOM 79 C TYR A 8 -15.839 13.254 -9.609 1.00 0.00 C ATOM 80 O TYR A 8 -14.806 13.915 -9.670 1.00 0.00 O ATOM 81 CB TYR A 8 -16.509 11.132 -10.758 1.00 0.00 C ATOM 82 CG TYR A 8 -16.547 9.616 -10.781 1.00 0.00 C ATOM 83 CD1 TYR A 8 -15.615 8.861 -10.077 1.00 0.00 C ATOM 84 CD2 TYR A 8 -17.517 8.942 -11.512 1.00 0.00 C ATOM 85 CE1 TYR A 8 -15.649 7.481 -10.100 1.00 0.00 C ATOM 86 CE2 TYR A 8 -17.558 7.561 -11.540 1.00 0.00 C ATOM 87 CZ TYR A 8 -16.623 6.835 -10.834 1.00 0.00 C ATOM 88 OH TYR A 8 -16.660 5.460 -10.859 1.00 0.00 O ATOM 0 H TYR A 8 -17.358 11.261 -8.236 1.00 0.00 H new ATOM 0 HA TYR A 8 -14.728 11.436 -9.568 1.00 0.00 H new ATOM 0 HB2 TYR A 8 -17.531 11.510 -10.772 1.00 0.00 H new ATOM 0 HB3 TYR A 8 -16.026 11.486 -11.669 1.00 0.00 H new ATOM 0 HD1 TYR A 8 -14.851 9.363 -9.502 1.00 0.00 H new ATOM 0 HD2 TYR A 8 -18.251 9.507 -12.068 1.00 0.00 H new ATOM 0 HE1 TYR A 8 -14.918 6.910 -9.547 1.00 0.00 H new ATOM 0 HE2 TYR A 8 -18.320 7.053 -12.113 1.00 0.00 H new ATOM 0 HH TYR A 8 -17.406 5.163 -11.420 1.00 0.00 H new ATOM 98 N LYS A 9 -17.055 13.800 -9.614 1.00 0.00 N ATOM 99 CA LYS A 9 -17.261 15.247 -9.695 1.00 0.00 C ATOM 100 C LYS A 9 -16.849 15.950 -8.401 1.00 0.00 C ATOM 101 O LYS A 9 -15.942 16.784 -8.408 1.00 0.00 O ATOM 102 CB LYS A 9 -18.727 15.554 -10.023 1.00 0.00 C ATOM 103 CG LYS A 9 -19.001 17.024 -10.305 1.00 0.00 C ATOM 104 CD LYS A 9 -19.965 17.617 -9.287 1.00 0.00 C ATOM 105 CE LYS A 9 -19.237 18.466 -8.255 1.00 0.00 C ATOM 106 NZ LYS A 9 -19.794 18.278 -6.886 1.00 0.00 N ATOM 0 H LYS A 9 -17.918 13.258 -9.563 1.00 0.00 H new ATOM 0 HA LYS A 9 -16.626 15.629 -10.495 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -19.026 14.966 -10.891 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -19.351 15.232 -9.189 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -18.064 17.580 -10.287 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -19.416 17.132 -11.307 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -20.709 18.226 -9.801 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -20.503 16.814 -8.784 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -18.178 18.207 -8.254 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -19.308 19.517 -8.534 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -19.270 18.874 -6.213 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -20.798 18.549 -6.880 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -19.703 17.280 -6.608 1.00 0.00 H new ATOM 120 N GLN A 10 -17.521 15.616 -7.294 1.00 0.00 N ATOM 121 CA GLN A 10 -17.220 16.225 -5.998 1.00 0.00 C ATOM 122 C GLN A 10 -15.753 16.022 -5.627 1.00 0.00 C ATOM 123 O GLN A 10 -15.067 16.974 -5.249 1.00 0.00 O ATOM 124 CB GLN A 10 -18.124 15.642 -4.907 1.00 0.00 C ATOM 125 CG GLN A 10 -18.480 16.636 -3.814 1.00 0.00 C ATOM 126 CD GLN A 10 -19.610 16.144 -2.929 1.00 0.00 C ATOM 127 OE1 GLN A 10 -20.760 16.064 -3.361 1.00 0.00 O ATOM 128 NE2 GLN A 10 -19.289 15.811 -1.683 1.00 0.00 N ATOM 0 H GLN A 10 -18.275 14.929 -7.271 1.00 0.00 H new ATOM 0 HA GLN A 10 -17.410 17.295 -6.078 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -19.042 15.275 -5.366 1.00 0.00 H new ATOM 0 HB3 GLN A 10 -17.627 14.782 -4.457 1.00 0.00 H new ATOM 0 HG2 GLN A 10 -17.600 16.828 -3.201 1.00 0.00 H new ATOM 0 HG3 GLN A 10 -18.765 17.585 -4.269 1.00 0.00 H new ATOM 0 HE21 GLN A 10 -18.323 15.893 -1.366 1.00 0.00 H new ATOM 0 HE22 GLN A 10 -20.009 15.474 -1.044 1.00 0.00 H new ATOM 137 N ALA A 11 -15.277 14.778 -5.750 1.00 0.00 N ATOM 138 CA ALA A 11 -13.889 14.444 -5.436 1.00 0.00 C ATOM 139 C ALA A 11 -12.919 15.241 -6.305 1.00 0.00 C ATOM 140 O ALA A 11 -11.890 15.716 -5.820 1.00 0.00 O ATOM 141 CB ALA A 11 -13.648 12.952 -5.608 1.00 0.00 C ATOM 0 H ALA A 11 -15.837 13.986 -6.066 1.00 0.00 H new ATOM 0 HA ALA A 11 -13.708 14.711 -4.395 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -12.610 12.721 -5.370 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -14.305 12.398 -4.938 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -13.856 12.666 -6.639 1.00 0.00 H new ATOM 147 N PHE A 12 -13.258 15.397 -7.590 1.00 0.00 N ATOM 148 CA PHE A 12 -12.418 16.154 -8.520 1.00 0.00 C ATOM 149 C PHE A 12 -12.263 17.601 -8.044 1.00 0.00 C ATOM 150 O PHE A 12 -11.161 18.152 -8.051 1.00 0.00 O ATOM 151 CB PHE A 12 -13.019 16.117 -9.928 1.00 0.00 C ATOM 152 CG PHE A 12 -12.310 16.989 -10.927 1.00 0.00 C ATOM 153 CD1 PHE A 12 -12.537 18.357 -10.963 1.00 0.00 C ATOM 154 CD2 PHE A 12 -11.416 16.440 -11.832 1.00 0.00 C ATOM 155 CE1 PHE A 12 -11.885 19.157 -11.878 1.00 0.00 C ATOM 156 CE2 PHE A 12 -10.763 17.236 -12.750 1.00 0.00 C ATOM 157 CZ PHE A 12 -10.998 18.595 -12.773 1.00 0.00 C ATOM 0 H PHE A 12 -14.105 15.010 -8.007 1.00 0.00 H new ATOM 0 HA PHE A 12 -11.431 15.693 -8.550 1.00 0.00 H new ATOM 0 HB2 PHE A 12 -13.007 15.088 -10.288 1.00 0.00 H new ATOM 0 HB3 PHE A 12 -14.064 16.423 -9.873 1.00 0.00 H new ATOM 0 HD1 PHE A 12 -13.233 18.801 -10.266 1.00 0.00 H new ATOM 0 HD2 PHE A 12 -11.228 15.377 -11.819 1.00 0.00 H new ATOM 0 HE1 PHE A 12 -12.068 20.221 -11.894 1.00 0.00 H new ATOM 0 HE2 PHE A 12 -10.068 16.796 -13.450 1.00 0.00 H new ATOM 0 HZ PHE A 12 -10.488 19.219 -13.492 1.00 0.00 H new ATOM 167 N SER A 13 -13.383 18.202 -7.629 1.00 0.00 N ATOM 168 CA SER A 13 -13.396 19.582 -7.142 1.00 0.00 C ATOM 169 C SER A 13 -12.538 19.748 -5.883 1.00 0.00 C ATOM 170 O SER A 13 -11.970 20.816 -5.659 1.00 0.00 O ATOM 171 CB SER A 13 -14.833 20.027 -6.855 1.00 0.00 C ATOM 172 OG SER A 13 -14.984 21.422 -7.052 1.00 0.00 O ATOM 0 H SER A 13 -14.297 17.749 -7.622 1.00 0.00 H new ATOM 0 HA SER A 13 -12.969 20.211 -7.923 1.00 0.00 H new ATOM 0 HB2 SER A 13 -15.521 19.488 -7.507 1.00 0.00 H new ATOM 0 HB3 SER A 13 -15.098 19.771 -5.829 1.00 0.00 H new ATOM 0 HG SER A 13 -15.910 21.681 -6.864 1.00 0.00 H new ATOM 178 N LEU A 14 -12.454 18.693 -5.063 1.00 0.00 N ATOM 179 CA LEU A 14 -11.667 18.733 -3.829 1.00 0.00 C ATOM 180 C LEU A 14 -10.204 19.093 -4.105 1.00 0.00 C ATOM 181 O LEU A 14 -9.594 19.847 -3.343 1.00 0.00 O ATOM 182 CB LEU A 14 -11.727 17.384 -3.102 1.00 0.00 C ATOM 183 CG LEU A 14 -13.122 16.789 -2.896 1.00 0.00 C ATOM 184 CD1 LEU A 14 -13.054 15.578 -1.979 1.00 0.00 C ATOM 185 CD2 LEU A 14 -14.079 17.831 -2.338 1.00 0.00 C ATOM 0 H LEU A 14 -12.922 17.803 -5.234 1.00 0.00 H new ATOM 0 HA LEU A 14 -12.103 19.507 -3.197 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -11.128 16.666 -3.662 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -11.256 17.500 -2.126 1.00 0.00 H new ATOM 0 HG LEU A 14 -13.501 16.467 -3.866 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -14.055 15.168 -1.843 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -12.408 14.821 -2.424 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -12.650 15.876 -1.012 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -15.064 17.384 -2.200 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -13.706 18.191 -1.379 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -14.154 18.666 -3.034 1.00 0.00 H new ATOM 197 N PHE A 15 -9.643 18.542 -5.187 1.00 0.00 N ATOM 198 CA PHE A 15 -8.244 18.797 -5.545 1.00 0.00 C ATOM 199 C PHE A 15 -8.110 19.894 -6.612 1.00 0.00 C ATOM 200 O PHE A 15 -7.186 19.861 -7.428 1.00 0.00 O ATOM 201 CB PHE A 15 -7.579 17.505 -6.041 1.00 0.00 C ATOM 202 CG PHE A 15 -7.765 16.318 -5.132 1.00 0.00 C ATOM 203 CD1 PHE A 15 -7.920 16.480 -3.763 1.00 0.00 C ATOM 204 CD2 PHE A 15 -7.786 15.035 -5.655 1.00 0.00 C ATOM 205 CE1 PHE A 15 -8.091 15.387 -2.936 1.00 0.00 C ATOM 206 CE2 PHE A 15 -7.956 13.939 -4.832 1.00 0.00 C ATOM 207 CZ PHE A 15 -8.108 14.115 -3.472 1.00 0.00 C ATOM 0 H PHE A 15 -10.134 17.919 -5.828 1.00 0.00 H new ATOM 0 HA PHE A 15 -7.739 19.148 -4.645 1.00 0.00 H new ATOM 0 HB2 PHE A 15 -7.979 17.260 -7.025 1.00 0.00 H new ATOM 0 HB3 PHE A 15 -6.512 17.686 -6.167 1.00 0.00 H new ATOM 0 HD1 PHE A 15 -7.907 17.473 -3.339 1.00 0.00 H new ATOM 0 HD2 PHE A 15 -7.668 14.890 -6.719 1.00 0.00 H new ATOM 0 HE1 PHE A 15 -8.211 15.527 -1.872 1.00 0.00 H new ATOM 0 HE2 PHE A 15 -7.970 12.944 -5.253 1.00 0.00 H new ATOM 0 HZ PHE A 15 -8.240 13.259 -2.827 1.00 0.00 H new ATOM 217 N ASP A 16 -9.023 20.870 -6.593 1.00 0.00 N ATOM 218 CA ASP A 16 -8.991 21.978 -7.550 1.00 0.00 C ATOM 219 C ASP A 16 -7.700 22.789 -7.406 1.00 0.00 C ATOM 220 O ASP A 16 -7.327 23.187 -6.300 1.00 0.00 O ATOM 221 CB ASP A 16 -10.214 22.889 -7.356 1.00 0.00 C ATOM 222 CG ASP A 16 -10.184 23.646 -6.038 1.00 0.00 C ATOM 223 OD1 ASP A 16 -10.380 23.012 -4.979 1.00 0.00 O ATOM 224 OD2 ASP A 16 -9.960 24.873 -6.064 1.00 0.00 O ATOM 0 H ASP A 16 -9.793 20.914 -5.925 1.00 0.00 H new ATOM 0 HA ASP A 16 -9.020 21.557 -8.555 1.00 0.00 H new ATOM 0 HB2 ASP A 16 -10.263 23.603 -8.178 1.00 0.00 H new ATOM 0 HB3 ASP A 16 -11.121 22.286 -7.403 1.00 0.00 H new ATOM 229 N ARG A 17 -7.020 23.028 -8.531 1.00 0.00 N ATOM 230 CA ARG A 17 -5.770 23.790 -8.524 1.00 0.00 C ATOM 231 C ARG A 17 -6.027 25.250 -8.151 1.00 0.00 C ATOM 232 O ARG A 17 -5.446 25.763 -7.193 1.00 0.00 O ATOM 233 CB ARG A 17 -5.079 23.707 -9.891 1.00 0.00 C ATOM 234 CG ARG A 17 -3.632 23.240 -9.816 1.00 0.00 C ATOM 235 CD ARG A 17 -2.726 24.304 -9.213 1.00 0.00 C ATOM 236 NE ARG A 17 -1.875 23.765 -8.152 1.00 0.00 N ATOM 237 CZ ARG A 17 -0.741 23.086 -8.365 1.00 0.00 C ATOM 238 NH1 ARG A 17 -0.306 22.861 -9.604 1.00 0.00 N ATOM 239 NH2 ARG A 17 -0.038 22.634 -7.333 1.00 0.00 N ATOM 0 H ARG A 17 -7.313 22.706 -9.454 1.00 0.00 H new ATOM 0 HA ARG A 17 -5.112 23.352 -7.773 1.00 0.00 H new ATOM 0 HB2 ARG A 17 -5.639 23.025 -10.531 1.00 0.00 H new ATOM 0 HB3 ARG A 17 -5.111 24.688 -10.365 1.00 0.00 H new ATOM 0 HG2 ARG A 17 -3.574 22.331 -9.217 1.00 0.00 H new ATOM 0 HG3 ARG A 17 -3.280 22.986 -10.816 1.00 0.00 H new ATOM 0 HD2 ARG A 17 -2.101 24.733 -9.996 1.00 0.00 H new ATOM 0 HD3 ARG A 17 -3.336 25.114 -8.812 1.00 0.00 H new ATOM 0 HE ARG A 17 -2.165 23.917 -7.186 1.00 0.00 H new ATOM 0 HH11 ARG A 17 -0.838 23.207 -10.402 1.00 0.00 H new ATOM 0 HH12 ARG A 17 0.559 22.342 -9.754 1.00 0.00 H new ATOM 0 HH21 ARG A 17 -0.362 22.804 -6.381 1.00 0.00 H new ATOM 0 HH22 ARG A 17 0.826 22.116 -7.492 1.00 0.00 H new ATOM 253 N HIS A 18 -6.901 25.911 -8.914 1.00 0.00 N ATOM 254 CA HIS A 18 -7.240 27.311 -8.666 1.00 0.00 C ATOM 255 C HIS A 18 -8.751 27.550 -8.780 1.00 0.00 C ATOM 256 O HIS A 18 -9.186 28.663 -9.083 1.00 0.00 O ATOM 257 CB HIS A 18 -6.496 28.215 -9.652 1.00 0.00 C ATOM 258 CG HIS A 18 -5.029 27.922 -9.759 1.00 0.00 C ATOM 259 ND1 HIS A 18 -4.501 27.308 -10.868 1.00 0.00 N ATOM 260 CD2 HIS A 18 -4.034 28.172 -8.875 1.00 0.00 C ATOM 261 CE1 HIS A 18 -3.206 27.197 -10.639 1.00 0.00 C ATOM 262 NE2 HIS A 18 -2.876 27.706 -9.442 1.00 0.00 N ATOM 0 H HIS A 18 -7.387 25.497 -9.710 1.00 0.00 H new ATOM 0 HA HIS A 18 -6.934 27.553 -7.648 1.00 0.00 H new ATOM 0 HB2 HIS A 18 -6.950 28.112 -10.638 1.00 0.00 H new ATOM 0 HB3 HIS A 18 -6.628 29.253 -9.348 1.00 0.00 H new ATOM 0 HD2 HIS A 18 -4.133 28.647 -7.910 1.00 0.00 H new ATOM 0 HE1 HIS A 18 -2.502 26.753 -11.327 1.00 0.00 H new ATOM 0 HE2 HIS A 18 -1.942 27.740 -9.032 1.00 0.00 H new ATOM 270 N GLY A 19 -9.548 26.501 -8.541 1.00 0.00 N ATOM 271 CA GLY A 19 -10.995 26.625 -8.632 1.00 0.00 C ATOM 272 C GLY A 19 -11.473 26.906 -10.049 1.00 0.00 C ATOM 273 O GLY A 19 -12.524 27.519 -10.241 1.00 0.00 O ATOM 0 H GLY A 19 -9.214 25.571 -8.287 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -11.458 25.706 -8.273 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -11.329 27.428 -7.975 1.00 0.00 H new ATOM 277 N THR A 20 -10.699 26.456 -11.040 1.00 0.00 N ATOM 278 CA THR A 20 -11.043 26.658 -12.448 1.00 0.00 C ATOM 279 C THR A 20 -11.767 25.438 -13.023 1.00 0.00 C ATOM 280 O THR A 20 -12.542 25.562 -13.973 1.00 0.00 O ATOM 281 CB THR A 20 -9.782 26.949 -13.273 1.00 0.00 C ATOM 282 OG1 THR A 20 -8.858 25.877 -13.180 1.00 0.00 O ATOM 283 CG2 THR A 20 -9.062 28.213 -12.849 1.00 0.00 C ATOM 0 H THR A 20 -9.827 25.948 -10.891 1.00 0.00 H new ATOM 0 HA THR A 20 -11.714 27.515 -12.504 1.00 0.00 H new ATOM 0 HB THR A 20 -10.135 27.078 -14.296 1.00 0.00 H new ATOM 0 HG1 THR A 20 -8.063 26.083 -13.715 1.00 0.00 H new ATOM 0 HG21 THR A 20 -8.181 28.357 -13.474 1.00 0.00 H new ATOM 0 HG22 THR A 20 -9.730 29.067 -12.961 1.00 0.00 H new ATOM 0 HG23 THR A 20 -8.757 28.126 -11.806 1.00 0.00 H new ATOM 291 N GLY A 21 -11.504 24.262 -12.444 1.00 0.00 N ATOM 292 CA GLY A 21 -12.128 23.035 -12.911 1.00 0.00 C ATOM 293 C GLY A 21 -11.141 22.084 -13.574 1.00 0.00 C ATOM 294 O GLY A 21 -11.549 21.186 -14.309 1.00 0.00 O ATOM 0 H GLY A 21 -10.867 24.141 -11.657 1.00 0.00 H new ATOM 0 HA2 GLY A 21 -12.601 22.530 -12.069 1.00 0.00 H new ATOM 0 HA3 GLY A 21 -12.919 23.282 -13.619 1.00 0.00 H new ATOM 298 N ARG A 22 -9.841 22.281 -13.313 1.00 0.00 N ATOM 299 CA ARG A 22 -8.795 21.435 -13.884 1.00 0.00 C ATOM 300 C ARG A 22 -7.846 20.941 -12.790 1.00 0.00 C ATOM 301 O ARG A 22 -7.783 21.525 -11.704 1.00 0.00 O ATOM 302 CB ARG A 22 -8.000 22.207 -14.941 1.00 0.00 C ATOM 303 CG ARG A 22 -8.857 22.893 -15.995 1.00 0.00 C ATOM 304 CD ARG A 22 -8.148 24.105 -16.578 1.00 0.00 C ATOM 305 NE ARG A 22 -9.065 24.999 -17.286 1.00 0.00 N ATOM 306 CZ ARG A 22 -8.670 26.023 -18.050 1.00 0.00 C ATOM 307 NH1 ARG A 22 -7.374 26.291 -18.209 1.00 0.00 N ATOM 308 NH2 ARG A 22 -9.577 26.783 -18.657 1.00 0.00 N ATOM 0 H ARG A 22 -9.492 23.024 -12.707 1.00 0.00 H new ATOM 0 HA ARG A 22 -9.274 20.576 -14.354 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -7.389 22.959 -14.441 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -7.316 21.519 -15.438 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -9.091 22.187 -16.792 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -9.805 23.201 -15.553 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -7.655 24.655 -15.776 1.00 0.00 H new ATOM 0 HD3 ARG A 22 -7.368 23.772 -17.263 1.00 0.00 H new ATOM 0 HE ARG A 22 -10.067 24.831 -17.191 1.00 0.00 H new ATOM 0 HH11 ARG A 22 -6.673 25.713 -17.746 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -7.083 27.074 -18.794 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -10.570 26.584 -18.539 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -9.279 27.565 -19.240 1.00 0.00 H new ATOM 322 N ILE A 23 -7.107 19.868 -13.080 1.00 0.00 N ATOM 323 CA ILE A 23 -6.160 19.304 -12.116 1.00 0.00 C ATOM 324 C ILE A 23 -4.900 18.774 -12.810 1.00 0.00 C ATOM 325 O ILE A 23 -4.984 18.141 -13.865 1.00 0.00 O ATOM 326 CB ILE A 23 -6.797 18.166 -11.283 1.00 0.00 C ATOM 327 CG1 ILE A 23 -7.406 17.098 -12.198 1.00 0.00 C ATOM 328 CG2 ILE A 23 -7.852 18.725 -10.335 1.00 0.00 C ATOM 329 CD1 ILE A 23 -7.324 15.694 -11.640 1.00 0.00 C ATOM 0 H ILE A 23 -7.146 19.374 -13.971 1.00 0.00 H new ATOM 0 HA ILE A 23 -5.883 20.118 -11.446 1.00 0.00 H new ATOM 0 HB ILE A 23 -6.013 17.697 -10.689 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -8.452 17.345 -12.382 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -6.897 17.126 -13.162 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -8.290 17.911 -9.757 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -7.389 19.443 -9.658 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -8.633 19.221 -10.911 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -7.776 14.996 -12.345 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -6.279 15.426 -11.482 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -7.858 15.648 -10.691 1.00 0.00 H new ATOM 341 N PRO A 24 -3.713 19.037 -12.225 1.00 0.00 N ATOM 342 CA PRO A 24 -2.430 18.596 -12.781 1.00 0.00 C ATOM 343 C PRO A 24 -2.039 17.182 -12.338 1.00 0.00 C ATOM 344 O PRO A 24 -2.682 16.603 -11.460 1.00 0.00 O ATOM 345 CB PRO A 24 -1.458 19.624 -12.210 1.00 0.00 C ATOM 346 CG PRO A 24 -2.029 19.989 -10.879 1.00 0.00 C ATOM 347 CD PRO A 24 -3.525 19.799 -10.973 1.00 0.00 C ATOM 0 HA PRO A 24 -2.448 18.542 -13.870 1.00 0.00 H new ATOM 0 HB2 PRO A 24 -0.456 19.208 -12.110 1.00 0.00 H new ATOM 0 HB3 PRO A 24 -1.378 20.496 -12.859 1.00 0.00 H new ATOM 0 HG2 PRO A 24 -1.609 19.360 -10.094 1.00 0.00 H new ATOM 0 HG3 PRO A 24 -1.786 21.021 -10.625 1.00 0.00 H new ATOM 0 HD2 PRO A 24 -3.913 19.254 -10.112 1.00 0.00 H new ATOM 0 HD3 PRO A 24 -4.047 20.755 -11.006 1.00 0.00 H new ATOM 355 N LYS A 25 -0.980 16.638 -12.958 1.00 0.00 N ATOM 356 CA LYS A 25 -0.476 15.288 -12.649 1.00 0.00 C ATOM 357 C LYS A 25 -0.416 15.013 -11.141 1.00 0.00 C ATOM 358 O LYS A 25 -0.655 13.886 -10.705 1.00 0.00 O ATOM 359 CB LYS A 25 0.917 15.080 -13.265 1.00 0.00 C ATOM 360 CG LYS A 25 1.898 16.213 -12.982 1.00 0.00 C ATOM 361 CD LYS A 25 3.286 15.894 -13.517 1.00 0.00 C ATOM 362 CE LYS A 25 4.236 17.072 -13.358 1.00 0.00 C ATOM 363 NZ LYS A 25 4.756 17.188 -11.967 1.00 0.00 N ATOM 0 H LYS A 25 -0.450 17.118 -13.685 1.00 0.00 H new ATOM 0 HA LYS A 25 -1.183 14.583 -13.086 1.00 0.00 H new ATOM 0 HB2 LYS A 25 1.335 14.148 -12.885 1.00 0.00 H new ATOM 0 HB3 LYS A 25 0.812 14.965 -14.344 1.00 0.00 H new ATOM 0 HG2 LYS A 25 1.534 17.134 -13.438 1.00 0.00 H new ATOM 0 HG3 LYS A 25 1.952 16.389 -11.908 1.00 0.00 H new ATOM 0 HD2 LYS A 25 3.689 15.028 -12.991 1.00 0.00 H new ATOM 0 HD3 LYS A 25 3.216 15.623 -14.570 1.00 0.00 H new ATOM 0 HE2 LYS A 25 5.072 16.959 -14.049 1.00 0.00 H new ATOM 0 HE3 LYS A 25 3.720 17.993 -13.630 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 5.317 18.059 -11.878 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 3.959 17.219 -11.300 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 5.356 16.366 -11.751 1.00 0.00 H new ATOM 377 N THR A 26 -0.092 16.040 -10.349 1.00 0.00 N ATOM 378 CA THR A 26 -0.002 15.893 -8.894 1.00 0.00 C ATOM 379 C THR A 26 -1.348 15.477 -8.286 1.00 0.00 C ATOM 380 O THR A 26 -1.403 14.569 -7.455 1.00 0.00 O ATOM 381 CB THR A 26 0.488 17.197 -8.251 1.00 0.00 C ATOM 382 OG1 THR A 26 -0.387 18.271 -8.550 1.00 0.00 O ATOM 383 CG2 THR A 26 1.878 17.603 -8.699 1.00 0.00 C ATOM 0 H THR A 26 0.112 16.979 -10.690 1.00 0.00 H new ATOM 0 HA THR A 26 0.719 15.102 -8.687 1.00 0.00 H new ATOM 0 HB THR A 26 0.511 16.994 -7.180 1.00 0.00 H new ATOM 0 HG1 THR A 26 -0.055 19.091 -8.128 1.00 0.00 H new ATOM 0 HG21 THR A 26 2.162 18.533 -8.206 1.00 0.00 H new ATOM 0 HG22 THR A 26 2.589 16.820 -8.434 1.00 0.00 H new ATOM 0 HG23 THR A 26 1.884 17.748 -9.779 1.00 0.00 H new ATOM 391 N SER A 27 -2.428 16.146 -8.708 1.00 0.00 N ATOM 392 CA SER A 27 -3.772 15.848 -8.207 1.00 0.00 C ATOM 393 C SER A 27 -4.278 14.498 -8.719 1.00 0.00 C ATOM 394 O SER A 27 -4.760 13.683 -7.933 1.00 0.00 O ATOM 395 CB SER A 27 -4.747 16.962 -8.603 1.00 0.00 C ATOM 396 OG SER A 27 -6.094 16.528 -8.513 1.00 0.00 O ATOM 0 H SER A 27 -2.395 16.898 -9.396 1.00 0.00 H new ATOM 0 HA SER A 27 -3.714 15.792 -7.120 1.00 0.00 H new ATOM 0 HB2 SER A 27 -4.598 17.826 -7.955 1.00 0.00 H new ATOM 0 HB3 SER A 27 -4.535 17.287 -9.622 1.00 0.00 H new ATOM 0 HG SER A 27 -6.198 15.945 -7.732 1.00 0.00 H new ATOM 402 N ILE A 28 -4.176 14.270 -10.036 1.00 0.00 N ATOM 403 CA ILE A 28 -4.642 13.002 -10.629 1.00 0.00 C ATOM 404 C ILE A 28 -4.063 11.792 -9.892 1.00 0.00 C ATOM 405 O ILE A 28 -4.740 10.775 -9.753 1.00 0.00 O ATOM 406 CB ILE A 28 -4.336 12.842 -12.150 1.00 0.00 C ATOM 407 CG1 ILE A 28 -3.613 14.059 -12.752 1.00 0.00 C ATOM 408 CG2 ILE A 28 -5.623 12.551 -12.910 1.00 0.00 C ATOM 409 CD1 ILE A 28 -4.532 15.197 -13.145 1.00 0.00 C ATOM 0 H ILE A 28 -3.782 14.933 -10.704 1.00 0.00 H new ATOM 0 HA ILE A 28 -5.725 13.043 -10.517 1.00 0.00 H new ATOM 0 HB ILE A 28 -3.651 12.000 -12.252 1.00 0.00 H new ATOM 0 HG12 ILE A 28 -2.885 14.428 -12.030 1.00 0.00 H new ATOM 0 HG13 ILE A 28 -3.055 13.737 -13.631 1.00 0.00 H new ATOM 0 HG21 ILE A 28 -5.402 12.441 -13.972 1.00 0.00 H new ATOM 0 HG22 ILE A 28 -6.067 11.629 -12.534 1.00 0.00 H new ATOM 0 HG23 ILE A 28 -6.323 13.375 -12.769 1.00 0.00 H new ATOM 0 HD11 ILE A 28 -3.942 16.014 -13.560 1.00 0.00 H new ATOM 0 HD12 ILE A 28 -5.245 14.848 -13.892 1.00 0.00 H new ATOM 0 HD13 ILE A 28 -5.071 15.549 -12.266 1.00 0.00 H new ATOM 421 N GLY A 29 -2.818 11.909 -9.413 1.00 0.00 N ATOM 422 CA GLY A 29 -2.191 10.813 -8.689 1.00 0.00 C ATOM 423 C GLY A 29 -3.031 10.343 -7.511 1.00 0.00 C ATOM 424 O GLY A 29 -3.561 9.230 -7.528 1.00 0.00 O ATOM 0 H GLY A 29 -2.238 12.742 -9.515 1.00 0.00 H new ATOM 0 HA2 GLY A 29 -2.026 9.978 -9.370 1.00 0.00 H new ATOM 0 HA3 GLY A 29 -1.212 11.131 -8.330 1.00 0.00 H new ATOM 428 N ASP A 30 -3.160 11.198 -6.494 1.00 0.00 N ATOM 429 CA ASP A 30 -3.955 10.871 -5.304 1.00 0.00 C ATOM 430 C ASP A 30 -5.439 10.698 -5.652 1.00 0.00 C ATOM 431 O ASP A 30 -6.152 9.947 -4.982 1.00 0.00 O ATOM 432 CB ASP A 30 -3.789 11.943 -4.219 1.00 0.00 C ATOM 433 CG ASP A 30 -3.758 13.360 -4.768 1.00 0.00 C ATOM 434 OD1 ASP A 30 -4.837 13.896 -5.093 1.00 0.00 O ATOM 435 OD2 ASP A 30 -2.654 13.933 -4.869 1.00 0.00 O ATOM 0 H ASP A 30 -2.726 12.121 -6.469 1.00 0.00 H new ATOM 0 HA ASP A 30 -3.583 9.923 -4.917 1.00 0.00 H new ATOM 0 HB2 ASP A 30 -4.608 11.856 -3.505 1.00 0.00 H new ATOM 0 HB3 ASP A 30 -2.866 11.754 -3.670 1.00 0.00 H new ATOM 440 N LEU A 31 -5.896 11.385 -6.708 1.00 0.00 N ATOM 441 CA LEU A 31 -7.290 11.293 -7.149 1.00 0.00 C ATOM 442 C LEU A 31 -7.619 9.860 -7.571 1.00 0.00 C ATOM 443 O LEU A 31 -8.626 9.296 -7.140 1.00 0.00 O ATOM 444 CB LEU A 31 -7.551 12.273 -8.303 1.00 0.00 C ATOM 445 CG LEU A 31 -8.748 11.942 -9.205 1.00 0.00 C ATOM 446 CD1 LEU A 31 -10.046 11.966 -8.410 1.00 0.00 C ATOM 447 CD2 LEU A 31 -8.814 12.917 -10.373 1.00 0.00 C ATOM 0 H LEU A 31 -5.319 12.010 -7.271 1.00 0.00 H new ATOM 0 HA LEU A 31 -7.940 11.564 -6.317 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -7.701 13.267 -7.883 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -6.656 12.321 -8.923 1.00 0.00 H new ATOM 0 HG LEU A 31 -8.614 10.935 -9.601 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -10.881 11.729 -9.069 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -9.996 11.229 -7.609 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -10.192 12.958 -7.982 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -9.667 12.671 -11.005 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -8.925 13.933 -9.993 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -7.897 12.846 -10.958 1.00 0.00 H new ATOM 459 N LEU A 32 -6.751 9.277 -8.401 1.00 0.00 N ATOM 460 CA LEU A 32 -6.926 7.904 -8.870 1.00 0.00 C ATOM 461 C LEU A 32 -6.898 6.919 -7.699 1.00 0.00 C ATOM 462 O LEU A 32 -7.573 5.888 -7.733 1.00 0.00 O ATOM 463 CB LEU A 32 -5.843 7.546 -9.892 1.00 0.00 C ATOM 464 CG LEU A 32 -5.904 8.340 -11.201 1.00 0.00 C ATOM 465 CD1 LEU A 32 -4.533 8.405 -11.860 1.00 0.00 C ATOM 466 CD2 LEU A 32 -6.927 7.732 -12.148 1.00 0.00 C ATOM 0 H LEU A 32 -5.916 9.739 -8.763 1.00 0.00 H new ATOM 0 HA LEU A 32 -7.901 7.832 -9.353 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -4.866 7.702 -9.434 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -5.920 6.484 -10.124 1.00 0.00 H new ATOM 0 HG LEU A 32 -6.215 9.358 -10.967 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -4.602 8.974 -12.787 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -3.828 8.893 -11.187 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -4.186 7.395 -12.078 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -6.956 8.310 -13.072 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -6.648 6.702 -12.372 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -7.911 7.748 -11.679 1.00 0.00 H new ATOM 478 N ARG A 33 -6.117 7.249 -6.661 1.00 0.00 N ATOM 479 CA ARG A 33 -6.002 6.408 -5.471 1.00 0.00 C ATOM 480 C ARG A 33 -7.382 6.142 -4.856 1.00 0.00 C ATOM 481 O ARG A 33 -7.668 5.025 -4.420 1.00 0.00 O ATOM 482 CB ARG A 33 -5.063 7.081 -4.452 1.00 0.00 C ATOM 483 CG ARG A 33 -5.691 7.372 -3.094 1.00 0.00 C ATOM 484 CD ARG A 33 -4.717 8.088 -2.172 1.00 0.00 C ATOM 485 NE ARG A 33 -5.386 9.068 -1.314 1.00 0.00 N ATOM 486 CZ ARG A 33 -4.766 9.775 -0.363 1.00 0.00 C ATOM 487 NH1 ARG A 33 -3.460 9.625 -0.149 1.00 0.00 N ATOM 488 NH2 ARG A 33 -5.458 10.639 0.373 1.00 0.00 N ATOM 0 H ARG A 33 -5.554 8.099 -6.626 1.00 0.00 H new ATOM 0 HA ARG A 33 -5.579 5.445 -5.756 1.00 0.00 H new ATOM 0 HB2 ARG A 33 -4.193 6.441 -4.304 1.00 0.00 H new ATOM 0 HB3 ARG A 33 -4.701 8.017 -4.877 1.00 0.00 H new ATOM 0 HG2 ARG A 33 -6.583 7.984 -3.228 1.00 0.00 H new ATOM 0 HG3 ARG A 33 -6.011 6.438 -2.632 1.00 0.00 H new ATOM 0 HD2 ARG A 33 -4.202 7.355 -1.551 1.00 0.00 H new ATOM 0 HD3 ARG A 33 -3.956 8.590 -2.769 1.00 0.00 H new ATOM 0 HE ARG A 33 -6.385 9.221 -1.450 1.00 0.00 H new ATOM 0 HH11 ARG A 33 -2.923 8.966 -0.713 1.00 0.00 H new ATOM 0 HH12 ARG A 33 -2.997 10.169 0.579 1.00 0.00 H new ATOM 0 HH21 ARG A 33 -6.458 10.761 0.211 1.00 0.00 H new ATOM 0 HH22 ARG A 33 -4.989 11.180 1.099 1.00 0.00 H new ATOM 502 N ALA A 34 -8.230 7.175 -4.835 1.00 0.00 N ATOM 503 CA ALA A 34 -9.581 7.059 -4.284 1.00 0.00 C ATOM 504 C ALA A 34 -10.456 6.134 -5.135 1.00 0.00 C ATOM 505 O ALA A 34 -11.351 5.468 -4.614 1.00 0.00 O ATOM 506 CB ALA A 34 -10.222 8.435 -4.169 1.00 0.00 C ATOM 0 H ALA A 34 -8.003 8.102 -5.194 1.00 0.00 H new ATOM 0 HA ALA A 34 -9.501 6.619 -3.290 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -11.227 8.335 -3.758 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -9.621 9.062 -3.511 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -10.278 8.894 -5.156 1.00 0.00 H new ATOM 512 N CYS A 35 -10.183 6.091 -6.444 1.00 0.00 N ATOM 513 CA CYS A 35 -10.935 5.242 -7.365 1.00 0.00 C ATOM 514 C CYS A 35 -10.086 4.045 -7.806 1.00 0.00 C ATOM 515 O CYS A 35 -10.111 3.646 -8.973 1.00 0.00 O ATOM 516 CB CYS A 35 -11.385 6.055 -8.585 1.00 0.00 C ATOM 517 SG CYS A 35 -12.293 7.565 -8.176 1.00 0.00 S ATOM 0 H CYS A 35 -9.444 6.637 -6.887 1.00 0.00 H new ATOM 0 HA CYS A 35 -11.818 4.866 -6.849 1.00 0.00 H new ATOM 0 HB2 CYS A 35 -10.507 6.321 -9.174 1.00 0.00 H new ATOM 0 HB3 CYS A 35 -12.014 5.426 -9.215 1.00 0.00 H new ATOM 0 HG CYS A 35 -12.627 8.181 -9.271 1.00 0.00 H new ATOM 523 N GLY A 36 -9.333 3.478 -6.858 1.00 0.00 N ATOM 524 CA GLY A 36 -8.482 2.340 -7.154 1.00 0.00 C ATOM 525 C GLY A 36 -7.113 2.452 -6.505 1.00 0.00 C ATOM 526 O GLY A 36 -6.970 2.213 -5.304 1.00 0.00 O ATOM 0 H GLY A 36 -9.301 3.792 -5.888 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -8.969 1.427 -6.811 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -8.362 2.251 -8.234 1.00 0.00 H new ATOM 530 N GLN A 37 -6.108 2.808 -7.306 1.00 0.00 N ATOM 531 CA GLN A 37 -4.736 2.945 -6.810 1.00 0.00 C ATOM 532 C GLN A 37 -4.094 4.252 -7.277 1.00 0.00 C ATOM 533 O GLN A 37 -4.642 4.962 -8.122 1.00 0.00 O ATOM 534 CB GLN A 37 -3.887 1.764 -7.281 1.00 0.00 C ATOM 535 CG GLN A 37 -3.291 0.946 -6.143 1.00 0.00 C ATOM 536 CD GLN A 37 -1.797 0.717 -6.297 1.00 0.00 C ATOM 537 OE1 GLN A 37 -1.081 1.549 -6.857 1.00 0.00 O ATOM 538 NE2 GLN A 37 -1.315 -0.416 -5.796 1.00 0.00 N ATOM 0 H GLN A 37 -6.217 3.007 -8.300 1.00 0.00 H new ATOM 0 HA GLN A 37 -4.780 2.958 -5.721 1.00 0.00 H new ATOM 0 HB2 GLN A 37 -4.501 1.112 -7.903 1.00 0.00 H new ATOM 0 HB3 GLN A 37 -3.079 2.137 -7.911 1.00 0.00 H new ATOM 0 HG2 GLN A 37 -3.480 1.456 -5.198 1.00 0.00 H new ATOM 0 HG3 GLN A 37 -3.798 -0.018 -6.091 1.00 0.00 H new ATOM 0 HE21 GLN A 37 -1.941 -1.079 -5.340 1.00 0.00 H new ATOM 0 HE22 GLN A 37 -0.319 -0.622 -5.868 1.00 0.00 H new ATOM 547 N ASN A 38 -2.913 4.548 -6.726 1.00 0.00 N ATOM 548 CA ASN A 38 -2.174 5.755 -7.088 1.00 0.00 C ATOM 549 C ASN A 38 -0.809 5.388 -7.678 1.00 0.00 C ATOM 550 O ASN A 38 0.045 4.829 -6.985 1.00 0.00 O ATOM 551 CB ASN A 38 -2.005 6.669 -5.861 1.00 0.00 C ATOM 552 CG ASN A 38 -0.816 7.613 -5.971 1.00 0.00 C ATOM 553 OD1 ASN A 38 0.042 7.651 -5.089 1.00 0.00 O ATOM 554 ND2 ASN A 38 -0.756 8.382 -7.056 1.00 0.00 N ATOM 0 H ASN A 38 -2.450 3.966 -6.028 1.00 0.00 H new ATOM 0 HA ASN A 38 -2.742 6.296 -7.845 1.00 0.00 H new ATOM 0 HB2 ASN A 38 -2.914 7.255 -5.726 1.00 0.00 H new ATOM 0 HB3 ASN A 38 -1.888 6.052 -4.970 1.00 0.00 H new ATOM 0 HD21 ASN A 38 0.021 9.032 -7.178 1.00 0.00 H new ATOM 0 HD22 ASN A 38 -1.487 8.321 -7.765 1.00 0.00 H new ATOM 561 N PRO A 39 -0.588 5.698 -8.972 1.00 0.00 N ATOM 562 CA PRO A 39 0.675 5.404 -9.657 1.00 0.00 C ATOM 563 C PRO A 39 1.751 6.459 -9.380 1.00 0.00 C ATOM 564 O PRO A 39 1.643 7.231 -8.424 1.00 0.00 O ATOM 565 CB PRO A 39 0.257 5.416 -11.128 1.00 0.00 C ATOM 566 CG PRO A 39 -0.825 6.437 -11.193 1.00 0.00 C ATOM 567 CD PRO A 39 -1.553 6.364 -9.875 1.00 0.00 C ATOM 0 HA PRO A 39 1.126 4.468 -9.329 1.00 0.00 H new ATOM 0 HB2 PRO A 39 1.092 5.679 -11.777 1.00 0.00 H new ATOM 0 HB3 PRO A 39 -0.100 4.437 -11.449 1.00 0.00 H new ATOM 0 HG2 PRO A 39 -0.411 7.432 -11.354 1.00 0.00 H new ATOM 0 HG3 PRO A 39 -1.502 6.234 -12.023 1.00 0.00 H new ATOM 0 HD2 PRO A 39 -1.821 7.356 -9.511 1.00 0.00 H new ATOM 0 HD3 PRO A 39 -2.479 5.795 -9.961 1.00 0.00 H new ATOM 575 N THR A 40 2.785 6.492 -10.223 1.00 0.00 N ATOM 576 CA THR A 40 3.877 7.458 -10.075 1.00 0.00 C ATOM 577 C THR A 40 3.634 8.692 -10.940 1.00 0.00 C ATOM 578 O THR A 40 2.771 8.682 -11.820 1.00 0.00 O ATOM 579 CB THR A 40 5.225 6.827 -10.454 1.00 0.00 C ATOM 580 OG1 THR A 40 5.088 5.949 -11.560 1.00 0.00 O ATOM 581 CG2 THR A 40 5.867 6.049 -9.325 1.00 0.00 C ATOM 0 H THR A 40 2.890 5.860 -11.017 1.00 0.00 H new ATOM 0 HA THR A 40 3.908 7.758 -9.027 1.00 0.00 H new ATOM 0 HB THR A 40 5.868 7.671 -10.703 1.00 0.00 H new ATOM 0 HG1 THR A 40 5.961 5.563 -11.781 1.00 0.00 H new ATOM 0 HG21 THR A 40 6.815 5.632 -9.664 1.00 0.00 H new ATOM 0 HG22 THR A 40 6.045 6.714 -8.480 1.00 0.00 H new ATOM 0 HG23 THR A 40 5.204 5.240 -9.017 1.00 0.00 H new ATOM 589 N LEU A 41 4.411 9.752 -10.691 1.00 0.00 N ATOM 590 CA LEU A 41 4.294 10.995 -11.455 1.00 0.00 C ATOM 591 C LEU A 41 4.474 10.735 -12.951 1.00 0.00 C ATOM 592 O LEU A 41 3.831 11.380 -13.778 1.00 0.00 O ATOM 593 CB LEU A 41 5.323 12.021 -10.971 1.00 0.00 C ATOM 594 CG LEU A 41 4.935 12.806 -9.712 1.00 0.00 C ATOM 595 CD1 LEU A 41 4.006 13.960 -10.064 1.00 0.00 C ATOM 596 CD2 LEU A 41 4.286 11.898 -8.676 1.00 0.00 C ATOM 0 H LEU A 41 5.128 9.772 -9.965 1.00 0.00 H new ATOM 0 HA LEU A 41 3.294 11.397 -11.293 1.00 0.00 H new ATOM 0 HB2 LEU A 41 6.263 11.503 -10.779 1.00 0.00 H new ATOM 0 HB3 LEU A 41 5.509 12.731 -11.777 1.00 0.00 H new ATOM 0 HG LEU A 41 5.848 13.214 -9.279 1.00 0.00 H new ATOM 0 HD11 LEU A 41 3.742 14.504 -9.157 1.00 0.00 H new ATOM 0 HD12 LEU A 41 4.509 14.633 -10.758 1.00 0.00 H new ATOM 0 HD13 LEU A 41 3.101 13.570 -10.529 1.00 0.00 H new ATOM 0 HD21 LEU A 41 4.022 12.482 -7.795 1.00 0.00 H new ATOM 0 HD22 LEU A 41 3.386 11.450 -9.098 1.00 0.00 H new ATOM 0 HD23 LEU A 41 4.985 11.111 -8.393 1.00 0.00 H new ATOM 608 N ALA A 42 5.340 9.774 -13.293 1.00 0.00 N ATOM 609 CA ALA A 42 5.577 9.420 -14.691 1.00 0.00 C ATOM 610 C ALA A 42 4.279 8.968 -15.360 1.00 0.00 C ATOM 611 O ALA A 42 4.045 9.258 -16.534 1.00 0.00 O ATOM 612 CB ALA A 42 6.639 8.334 -14.795 1.00 0.00 C ATOM 0 H ALA A 42 5.884 9.232 -12.622 1.00 0.00 H new ATOM 0 HA ALA A 42 5.940 10.306 -15.212 1.00 0.00 H new ATOM 0 HB1 ALA A 42 6.802 8.084 -15.843 1.00 0.00 H new ATOM 0 HB2 ALA A 42 7.571 8.693 -14.359 1.00 0.00 H new ATOM 0 HB3 ALA A 42 6.306 7.446 -14.258 1.00 0.00 H new ATOM 618 N GLU A 43 3.434 8.263 -14.599 1.00 0.00 N ATOM 619 CA GLU A 43 2.152 7.780 -15.107 1.00 0.00 C ATOM 620 C GLU A 43 1.212 8.949 -15.417 1.00 0.00 C ATOM 621 O GLU A 43 0.716 9.068 -16.539 1.00 0.00 O ATOM 622 CB GLU A 43 1.500 6.832 -14.095 1.00 0.00 C ATOM 623 CG GLU A 43 0.650 5.748 -14.736 1.00 0.00 C ATOM 624 CD GLU A 43 -0.639 6.288 -15.327 1.00 0.00 C ATOM 625 OE1 GLU A 43 -1.577 6.567 -14.552 1.00 0.00 O ATOM 626 OE2 GLU A 43 -0.709 6.433 -16.566 1.00 0.00 O ATOM 0 H GLU A 43 3.619 8.016 -13.627 1.00 0.00 H new ATOM 0 HA GLU A 43 2.338 7.234 -16.032 1.00 0.00 H new ATOM 0 HB2 GLU A 43 2.280 6.363 -13.495 1.00 0.00 H new ATOM 0 HB3 GLU A 43 0.879 7.413 -13.413 1.00 0.00 H new ATOM 0 HG2 GLU A 43 1.226 5.256 -15.520 1.00 0.00 H new ATOM 0 HG3 GLU A 43 0.413 4.989 -13.990 1.00 0.00 H new ATOM 633 N ILE A 44 0.975 9.812 -14.420 1.00 0.00 N ATOM 634 CA ILE A 44 0.095 10.977 -14.604 1.00 0.00 C ATOM 635 C ILE A 44 0.602 11.867 -15.737 1.00 0.00 C ATOM 636 O ILE A 44 -0.163 12.232 -16.632 1.00 0.00 O ATOM 637 CB ILE A 44 -0.078 11.842 -13.322 1.00 0.00 C ATOM 638 CG1 ILE A 44 1.038 11.601 -12.288 1.00 0.00 C ATOM 639 CG2 ILE A 44 -1.448 11.588 -12.711 1.00 0.00 C ATOM 640 CD1 ILE A 44 0.683 10.600 -11.205 1.00 0.00 C ATOM 0 H ILE A 44 1.375 9.728 -13.486 1.00 0.00 H new ATOM 0 HA ILE A 44 -0.882 10.563 -14.851 1.00 0.00 H new ATOM 0 HB ILE A 44 -0.001 12.888 -13.618 1.00 0.00 H new ATOM 0 HG12 ILE A 44 1.930 11.253 -12.809 1.00 0.00 H new ATOM 0 HG13 ILE A 44 1.293 12.551 -11.818 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -1.565 12.196 -11.814 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -2.222 11.852 -13.431 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -1.540 10.534 -12.450 1.00 0.00 H new ATOM 0 HD11 ILE A 44 1.524 10.491 -10.521 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -0.189 10.953 -10.655 1.00 0.00 H new ATOM 0 HD13 ILE A 44 0.458 9.636 -11.660 1.00 0.00 H new ATOM 652 N THR A 45 1.897 12.198 -15.703 1.00 0.00 N ATOM 653 CA THR A 45 2.512 13.028 -16.743 1.00 0.00 C ATOM 654 C THR A 45 2.289 12.406 -18.124 1.00 0.00 C ATOM 655 O THR A 45 1.977 13.111 -19.085 1.00 0.00 O ATOM 656 CB THR A 45 4.015 13.197 -16.486 1.00 0.00 C ATOM 657 OG1 THR A 45 4.256 13.668 -15.172 1.00 0.00 O ATOM 658 CG2 THR A 45 4.685 14.159 -17.445 1.00 0.00 C ATOM 0 H THR A 45 2.539 11.904 -14.967 1.00 0.00 H new ATOM 0 HA THR A 45 2.040 14.010 -16.714 1.00 0.00 H new ATOM 0 HB THR A 45 4.440 12.204 -16.633 1.00 0.00 H new ATOM 0 HG1 THR A 45 4.167 12.927 -14.537 1.00 0.00 H new ATOM 0 HG21 THR A 45 5.746 14.231 -17.206 1.00 0.00 H new ATOM 0 HG22 THR A 45 4.567 13.796 -18.466 1.00 0.00 H new ATOM 0 HG23 THR A 45 4.225 15.143 -17.354 1.00 0.00 H new ATOM 666 N GLU A 46 2.442 11.078 -18.209 1.00 0.00 N ATOM 667 CA GLU A 46 2.245 10.354 -19.467 1.00 0.00 C ATOM 668 C GLU A 46 0.824 10.564 -19.992 1.00 0.00 C ATOM 669 O GLU A 46 0.630 10.805 -21.185 1.00 0.00 O ATOM 670 CB GLU A 46 2.526 8.859 -19.281 1.00 0.00 C ATOM 671 CG GLU A 46 3.941 8.456 -19.670 1.00 0.00 C ATOM 672 CD GLU A 46 4.044 7.000 -20.081 1.00 0.00 C ATOM 673 OE1 GLU A 46 3.747 6.691 -21.255 1.00 0.00 O ATOM 674 OE2 GLU A 46 4.425 6.169 -19.231 1.00 0.00 O ATOM 0 H GLU A 46 2.702 10.485 -17.421 1.00 0.00 H new ATOM 0 HA GLU A 46 2.948 10.750 -20.200 1.00 0.00 H new ATOM 0 HB2 GLU A 46 2.354 8.592 -18.238 1.00 0.00 H new ATOM 0 HB3 GLU A 46 1.816 8.287 -19.878 1.00 0.00 H new ATOM 0 HG2 GLU A 46 4.281 9.086 -20.492 1.00 0.00 H new ATOM 0 HG3 GLU A 46 4.611 8.640 -18.830 1.00 0.00 H new ATOM 681 N ILE A 47 -0.164 10.501 -19.091 1.00 0.00 N ATOM 682 CA ILE A 47 -1.562 10.716 -19.467 1.00 0.00 C ATOM 683 C ILE A 47 -1.736 12.132 -20.021 1.00 0.00 C ATOM 684 O ILE A 47 -2.416 12.330 -21.028 1.00 0.00 O ATOM 685 CB ILE A 47 -2.523 10.500 -18.271 1.00 0.00 C ATOM 686 CG1 ILE A 47 -2.367 9.085 -17.702 1.00 0.00 C ATOM 687 CG2 ILE A 47 -3.968 10.744 -18.690 1.00 0.00 C ATOM 688 CD1 ILE A 47 -2.855 8.947 -16.275 1.00 0.00 C ATOM 0 H ILE A 47 -0.020 10.304 -18.101 1.00 0.00 H new ATOM 0 HA ILE A 47 -1.816 9.983 -20.232 1.00 0.00 H new ATOM 0 HB ILE A 47 -2.263 11.218 -17.493 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -2.915 8.386 -18.334 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -1.316 8.798 -17.747 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -4.626 10.587 -17.835 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -4.075 11.768 -19.047 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -4.237 10.052 -19.488 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -2.713 7.920 -15.940 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -2.290 9.620 -15.630 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -3.914 9.202 -16.226 1.00 0.00 H new ATOM 700 N GLU A 48 -1.091 13.110 -19.368 1.00 0.00 N ATOM 701 CA GLU A 48 -1.142 14.503 -19.812 1.00 0.00 C ATOM 702 C GLU A 48 -0.659 14.630 -21.260 1.00 0.00 C ATOM 703 O GLU A 48 -1.186 15.429 -22.030 1.00 0.00 O ATOM 704 CB GLU A 48 -0.306 15.387 -18.891 1.00 0.00 C ATOM 705 CG GLU A 48 -1.034 15.745 -17.610 1.00 0.00 C ATOM 706 CD GLU A 48 -0.277 16.744 -16.753 1.00 0.00 C ATOM 707 OE1 GLU A 48 0.852 16.424 -16.320 1.00 0.00 O ATOM 708 OE2 GLU A 48 -0.814 17.845 -16.512 1.00 0.00 O ATOM 0 H GLU A 48 -0.529 12.958 -18.531 1.00 0.00 H new ATOM 0 HA GLU A 48 -2.178 14.838 -19.768 1.00 0.00 H new ATOM 0 HB2 GLU A 48 0.623 14.873 -18.645 1.00 0.00 H new ATOM 0 HB3 GLU A 48 -0.035 16.302 -19.419 1.00 0.00 H new ATOM 0 HG2 GLU A 48 -2.012 16.156 -17.858 1.00 0.00 H new ATOM 0 HG3 GLU A 48 -1.207 14.837 -17.032 1.00 0.00 H new ATOM 715 N SER A 49 0.344 13.816 -21.623 1.00 0.00 N ATOM 716 CA SER A 49 0.897 13.807 -22.983 1.00 0.00 C ATOM 717 C SER A 49 -0.123 13.310 -24.028 1.00 0.00 C ATOM 718 O SER A 49 0.188 13.264 -25.221 1.00 0.00 O ATOM 719 CB SER A 49 2.155 12.934 -23.033 1.00 0.00 C ATOM 720 OG SER A 49 3.056 13.389 -24.028 1.00 0.00 O ATOM 0 H SER A 49 0.789 13.153 -20.989 1.00 0.00 H new ATOM 0 HA SER A 49 1.149 14.837 -23.234 1.00 0.00 H new ATOM 0 HB2 SER A 49 2.647 12.945 -22.061 1.00 0.00 H new ATOM 0 HB3 SER A 49 1.876 11.900 -23.237 1.00 0.00 H new ATOM 0 HG SER A 49 3.850 12.815 -24.037 1.00 0.00 H new ATOM 726 N THR A 50 -1.327 12.927 -23.581 1.00 0.00 N ATOM 727 CA THR A 50 -2.367 12.426 -24.476 1.00 0.00 C ATOM 728 C THR A 50 -3.604 13.334 -24.442 1.00 0.00 C ATOM 729 O THR A 50 -4.205 13.608 -25.483 1.00 0.00 O ATOM 730 CB THR A 50 -2.733 10.990 -24.077 1.00 0.00 C ATOM 731 OG1 THR A 50 -1.720 10.086 -24.485 1.00 0.00 O ATOM 732 CG2 THR A 50 -4.040 10.503 -24.662 1.00 0.00 C ATOM 0 H THR A 50 -1.601 12.957 -22.599 1.00 0.00 H new ATOM 0 HA THR A 50 -1.987 12.427 -25.498 1.00 0.00 H new ATOM 0 HB THR A 50 -2.836 11.018 -22.992 1.00 0.00 H new ATOM 0 HG1 THR A 50 -1.969 9.175 -24.221 1.00 0.00 H new ATOM 0 HG21 THR A 50 -4.227 9.481 -24.333 1.00 0.00 H new ATOM 0 HG22 THR A 50 -4.852 11.147 -24.325 1.00 0.00 H new ATOM 0 HG23 THR A 50 -3.984 10.530 -25.750 1.00 0.00 H new ATOM 740 N LEU A 51 -3.968 13.808 -23.246 1.00 0.00 N ATOM 741 CA LEU A 51 -5.123 14.697 -23.082 1.00 0.00 C ATOM 742 C LEU A 51 -4.655 16.141 -22.896 1.00 0.00 C ATOM 743 O LEU A 51 -3.524 16.379 -22.474 1.00 0.00 O ATOM 744 CB LEU A 51 -5.982 14.273 -21.877 1.00 0.00 C ATOM 745 CG LEU A 51 -5.808 12.827 -21.406 1.00 0.00 C ATOM 746 CD1 LEU A 51 -6.260 12.689 -19.963 1.00 0.00 C ATOM 747 CD2 LEU A 51 -6.572 11.868 -22.308 1.00 0.00 C ATOM 0 H LEU A 51 -3.480 13.591 -22.377 1.00 0.00 H new ATOM 0 HA LEU A 51 -5.732 14.626 -23.983 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -5.755 14.936 -21.042 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -7.031 14.428 -22.131 1.00 0.00 H new ATOM 0 HG LEU A 51 -4.751 12.568 -21.464 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -6.132 11.656 -19.639 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -5.662 13.345 -19.330 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -7.311 12.967 -19.883 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -6.433 10.847 -21.954 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -7.633 12.118 -22.289 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -6.198 11.952 -23.328 1.00 0.00 H new ATOM 759 N PRO A 52 -5.520 17.130 -23.211 1.00 0.00 N ATOM 760 CA PRO A 52 -5.191 18.556 -23.078 1.00 0.00 C ATOM 761 C PRO A 52 -4.399 18.874 -21.804 1.00 0.00 C ATOM 762 O PRO A 52 -4.626 18.263 -20.757 1.00 0.00 O ATOM 763 CB PRO A 52 -6.565 19.218 -23.036 1.00 0.00 C ATOM 764 CG PRO A 52 -7.442 18.327 -23.851 1.00 0.00 C ATOM 765 CD PRO A 52 -6.885 16.930 -23.732 1.00 0.00 C ATOM 0 HA PRO A 52 -4.550 18.903 -23.888 1.00 0.00 H new ATOM 0 HB2 PRO A 52 -6.931 19.305 -22.013 1.00 0.00 H new ATOM 0 HB3 PRO A 52 -6.531 20.226 -23.450 1.00 0.00 H new ATOM 0 HG2 PRO A 52 -8.470 18.364 -23.491 1.00 0.00 H new ATOM 0 HG3 PRO A 52 -7.457 18.649 -24.892 1.00 0.00 H new ATOM 0 HD2 PRO A 52 -7.484 16.318 -23.057 1.00 0.00 H new ATOM 0 HD3 PRO A 52 -6.873 16.422 -24.696 1.00 0.00 H new ATOM 773 N ALA A 53 -3.462 19.829 -21.927 1.00 0.00 N ATOM 774 CA ALA A 53 -2.588 20.265 -20.823 1.00 0.00 C ATOM 775 C ALA A 53 -3.168 19.972 -19.434 1.00 0.00 C ATOM 776 O ALA A 53 -2.639 19.130 -18.706 1.00 0.00 O ATOM 777 CB ALA A 53 -2.281 21.751 -20.965 1.00 0.00 C ATOM 0 H ALA A 53 -3.288 20.324 -22.802 1.00 0.00 H new ATOM 0 HA ALA A 53 -1.670 19.683 -20.899 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -1.635 22.069 -20.147 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -1.778 21.929 -21.915 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -3.211 22.319 -20.935 1.00 0.00 H new ATOM 783 N GLU A 54 -4.255 20.661 -19.076 1.00 0.00 N ATOM 784 CA GLU A 54 -4.898 20.461 -17.777 1.00 0.00 C ATOM 785 C GLU A 54 -5.992 19.401 -17.879 1.00 0.00 C ATOM 786 O GLU A 54 -6.851 19.469 -18.759 1.00 0.00 O ATOM 787 CB GLU A 54 -5.478 21.778 -17.254 1.00 0.00 C ATOM 788 CG GLU A 54 -4.897 22.197 -15.910 1.00 0.00 C ATOM 789 CD GLU A 54 -5.052 23.683 -15.621 1.00 0.00 C ATOM 790 OE1 GLU A 54 -4.822 24.500 -16.539 1.00 0.00 O ATOM 791 OE2 GLU A 54 -5.397 24.029 -14.471 1.00 0.00 O ATOM 0 H GLU A 54 -4.706 21.360 -19.666 1.00 0.00 H new ATOM 0 HA GLU A 54 -4.143 20.113 -17.072 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -5.292 22.565 -17.985 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -6.560 21.680 -17.160 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -5.385 21.628 -15.119 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -3.839 21.938 -15.883 1.00 0.00 H new ATOM 798 N VAL A 55 -5.952 18.418 -16.976 1.00 0.00 N ATOM 799 CA VAL A 55 -6.941 17.343 -16.974 1.00 0.00 C ATOM 800 C VAL A 55 -8.175 17.741 -16.168 1.00 0.00 C ATOM 801 O VAL A 55 -8.264 17.472 -14.969 1.00 0.00 O ATOM 802 CB VAL A 55 -6.357 16.024 -16.412 1.00 0.00 C ATOM 803 CG1 VAL A 55 -7.383 14.898 -16.479 1.00 0.00 C ATOM 804 CG2 VAL A 55 -5.093 15.637 -17.163 1.00 0.00 C ATOM 0 H VAL A 55 -5.248 18.346 -16.241 1.00 0.00 H new ATOM 0 HA VAL A 55 -7.228 17.174 -18.012 1.00 0.00 H new ATOM 0 HB VAL A 55 -6.103 16.188 -15.365 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -6.946 13.983 -16.078 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -8.260 15.169 -15.891 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -7.677 14.735 -17.516 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -4.697 14.708 -16.754 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -5.325 15.499 -18.219 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -4.350 16.427 -17.055 1.00 0.00 H new ATOM 814 N ASP A 56 -9.129 18.378 -16.844 1.00 0.00 N ATOM 815 CA ASP A 56 -10.370 18.808 -16.200 1.00 0.00 C ATOM 816 C ASP A 56 -11.401 17.681 -16.230 1.00 0.00 C ATOM 817 O ASP A 56 -11.124 16.597 -16.744 1.00 0.00 O ATOM 818 CB ASP A 56 -10.940 20.067 -16.877 1.00 0.00 C ATOM 819 CG ASP A 56 -10.943 19.994 -18.394 1.00 0.00 C ATOM 820 OD1 ASP A 56 -11.482 19.010 -18.943 1.00 0.00 O ATOM 821 OD2 ASP A 56 -10.413 20.928 -19.031 1.00 0.00 O ATOM 0 H ASP A 56 -9.067 18.608 -17.836 1.00 0.00 H new ATOM 0 HA ASP A 56 -10.143 19.054 -15.163 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -11.960 20.227 -16.527 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -10.356 20.933 -16.565 1.00 0.00 H new ATOM 826 N MET A 57 -12.588 17.944 -15.674 1.00 0.00 N ATOM 827 CA MET A 57 -13.671 16.954 -15.638 1.00 0.00 C ATOM 828 C MET A 57 -13.782 16.184 -16.958 1.00 0.00 C ATOM 829 O MET A 57 -13.889 14.960 -16.959 1.00 0.00 O ATOM 830 CB MET A 57 -15.007 17.633 -15.319 1.00 0.00 C ATOM 831 CG MET A 57 -15.309 17.723 -13.830 1.00 0.00 C ATOM 832 SD MET A 57 -17.021 17.308 -13.440 1.00 0.00 S ATOM 833 CE MET A 57 -17.897 18.610 -14.307 1.00 0.00 C ATOM 0 H MET A 57 -12.824 18.837 -15.241 1.00 0.00 H new ATOM 0 HA MET A 57 -13.431 16.239 -14.851 1.00 0.00 H new ATOM 0 HB2 MET A 57 -15.003 18.638 -15.741 1.00 0.00 H new ATOM 0 HB3 MET A 57 -15.810 17.084 -15.811 1.00 0.00 H new ATOM 0 HG2 MET A 57 -14.644 17.051 -13.287 1.00 0.00 H new ATOM 0 HG3 MET A 57 -15.096 18.733 -13.481 1.00 0.00 H new ATOM 0 HE1 MET A 57 -18.962 18.540 -14.087 1.00 0.00 H new ATOM 0 HE2 MET A 57 -17.522 19.580 -13.981 1.00 0.00 H new ATOM 0 HE3 MET A 57 -17.740 18.502 -15.380 1.00 0.00 H new ATOM 843 N GLU A 58 -13.759 16.915 -18.077 1.00 0.00 N ATOM 844 CA GLU A 58 -13.865 16.308 -19.406 1.00 0.00 C ATOM 845 C GLU A 58 -12.658 15.423 -19.735 1.00 0.00 C ATOM 846 O GLU A 58 -12.824 14.263 -20.108 1.00 0.00 O ATOM 847 CB GLU A 58 -14.006 17.394 -20.475 1.00 0.00 C ATOM 848 CG GLU A 58 -14.456 16.862 -21.828 1.00 0.00 C ATOM 849 CD GLU A 58 -13.388 17.005 -22.895 1.00 0.00 C ATOM 850 OE1 GLU A 58 -12.514 16.116 -22.984 1.00 0.00 O ATOM 851 OE2 GLU A 58 -13.423 18.007 -23.639 1.00 0.00 O ATOM 0 H GLU A 58 -13.668 17.931 -18.088 1.00 0.00 H new ATOM 0 HA GLU A 58 -14.753 15.676 -19.399 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -14.722 18.140 -20.131 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -13.049 17.902 -20.594 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -14.727 15.811 -21.729 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -15.353 17.394 -22.144 1.00 0.00 H new ATOM 858 N GLN A 59 -11.452 15.983 -19.610 1.00 0.00 N ATOM 859 CA GLN A 59 -10.219 15.247 -19.910 1.00 0.00 C ATOM 860 C GLN A 59 -10.105 13.971 -19.075 1.00 0.00 C ATOM 861 O GLN A 59 -9.901 12.884 -19.619 1.00 0.00 O ATOM 862 CB GLN A 59 -8.996 16.135 -19.668 1.00 0.00 C ATOM 863 CG GLN A 59 -8.567 16.922 -20.894 1.00 0.00 C ATOM 864 CD GLN A 59 -9.327 18.225 -21.051 1.00 0.00 C ATOM 865 OE1 GLN A 59 -8.838 19.288 -20.675 1.00 0.00 O ATOM 866 NE2 GLN A 59 -10.528 18.151 -21.615 1.00 0.00 N ATOM 0 H GLN A 59 -11.302 16.944 -19.303 1.00 0.00 H new ATOM 0 HA GLN A 59 -10.257 14.961 -20.961 1.00 0.00 H new ATOM 0 HB2 GLN A 59 -9.216 16.831 -18.858 1.00 0.00 H new ATOM 0 HB3 GLN A 59 -8.165 15.513 -19.336 1.00 0.00 H new ATOM 0 HG2 GLN A 59 -7.500 17.135 -20.829 1.00 0.00 H new ATOM 0 HG3 GLN A 59 -8.716 16.310 -21.784 1.00 0.00 H new ATOM 0 HE21 GLN A 59 -10.897 17.248 -21.913 1.00 0.00 H new ATOM 0 HE22 GLN A 59 -11.081 18.997 -21.750 1.00 0.00 H new ATOM 875 N PHE A 60 -10.234 14.114 -17.754 1.00 0.00 N ATOM 876 CA PHE A 60 -10.139 12.975 -16.843 1.00 0.00 C ATOM 877 C PHE A 60 -11.221 11.938 -17.159 1.00 0.00 C ATOM 878 O PHE A 60 -10.919 10.753 -17.301 1.00 0.00 O ATOM 879 CB PHE A 60 -10.204 13.461 -15.381 1.00 0.00 C ATOM 880 CG PHE A 60 -11.328 12.896 -14.555 1.00 0.00 C ATOM 881 CD1 PHE A 60 -11.315 11.568 -14.162 1.00 0.00 C ATOM 882 CD2 PHE A 60 -12.386 13.697 -14.160 1.00 0.00 C ATOM 883 CE1 PHE A 60 -12.337 11.048 -13.391 1.00 0.00 C ATOM 884 CE2 PHE A 60 -13.413 13.184 -13.391 1.00 0.00 C ATOM 885 CZ PHE A 60 -13.388 11.858 -13.005 1.00 0.00 C ATOM 0 H PHE A 60 -10.404 15.008 -17.293 1.00 0.00 H new ATOM 0 HA PHE A 60 -9.177 12.482 -16.983 1.00 0.00 H new ATOM 0 HB2 PHE A 60 -9.260 13.216 -14.894 1.00 0.00 H new ATOM 0 HB3 PHE A 60 -10.289 14.548 -15.382 1.00 0.00 H new ATOM 0 HD1 PHE A 60 -10.496 10.931 -14.462 1.00 0.00 H new ATOM 0 HD2 PHE A 60 -12.409 14.735 -14.457 1.00 0.00 H new ATOM 0 HE1 PHE A 60 -12.314 10.011 -13.091 1.00 0.00 H new ATOM 0 HE2 PHE A 60 -14.234 13.819 -13.092 1.00 0.00 H new ATOM 0 HZ PHE A 60 -14.189 11.455 -12.402 1.00 0.00 H new ATOM 895 N LEU A 61 -12.472 12.388 -17.289 1.00 0.00 N ATOM 896 CA LEU A 61 -13.580 11.489 -17.615 1.00 0.00 C ATOM 897 C LEU A 61 -13.378 10.832 -18.984 1.00 0.00 C ATOM 898 O LEU A 61 -13.862 9.726 -19.221 1.00 0.00 O ATOM 899 CB LEU A 61 -14.918 12.234 -17.580 1.00 0.00 C ATOM 900 CG LEU A 61 -15.456 12.538 -16.178 1.00 0.00 C ATOM 901 CD1 LEU A 61 -16.766 13.306 -16.265 1.00 0.00 C ATOM 902 CD2 LEU A 61 -15.639 11.254 -15.381 1.00 0.00 C ATOM 0 H LEU A 61 -12.741 13.365 -17.174 1.00 0.00 H new ATOM 0 HA LEU A 61 -13.598 10.705 -16.858 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -14.807 13.174 -18.121 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -15.660 11.642 -18.117 1.00 0.00 H new ATOM 0 HG LEU A 61 -14.726 13.159 -15.659 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -17.134 13.513 -15.260 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -16.603 14.246 -16.793 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -17.502 12.710 -16.805 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -16.022 11.493 -14.389 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -16.346 10.604 -15.896 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -14.680 10.744 -15.287 1.00 0.00 H new ATOM 914 N GLN A 62 -12.658 11.517 -19.883 1.00 0.00 N ATOM 915 CA GLN A 62 -12.392 10.993 -21.223 1.00 0.00 C ATOM 916 C GLN A 62 -11.519 9.741 -21.157 1.00 0.00 C ATOM 917 O GLN A 62 -11.782 8.760 -21.852 1.00 0.00 O ATOM 918 CB GLN A 62 -11.713 12.058 -22.093 1.00 0.00 C ATOM 919 CG GLN A 62 -12.595 12.587 -23.215 1.00 0.00 C ATOM 920 CD GLN A 62 -12.546 11.726 -24.467 1.00 0.00 C ATOM 921 OE1 GLN A 62 -11.934 10.656 -24.480 1.00 0.00 O ATOM 922 NE2 GLN A 62 -13.193 12.189 -25.532 1.00 0.00 N ATOM 0 H GLN A 62 -12.251 12.435 -19.703 1.00 0.00 H new ATOM 0 HA GLN A 62 -13.348 10.725 -21.673 1.00 0.00 H new ATOM 0 HB2 GLN A 62 -11.408 12.891 -21.460 1.00 0.00 H new ATOM 0 HB3 GLN A 62 -10.805 11.637 -22.525 1.00 0.00 H new ATOM 0 HG2 GLN A 62 -13.625 12.647 -22.862 1.00 0.00 H new ATOM 0 HG3 GLN A 62 -12.284 13.601 -23.466 1.00 0.00 H new ATOM 0 HE21 GLN A 62 -13.688 13.079 -25.481 1.00 0.00 H new ATOM 0 HE22 GLN A 62 -13.195 11.654 -26.400 1.00 0.00 H new ATOM 931 N VAL A 63 -10.488 9.779 -20.312 1.00 0.00 N ATOM 932 CA VAL A 63 -9.583 8.635 -20.150 1.00 0.00 C ATOM 933 C VAL A 63 -10.196 7.577 -19.230 1.00 0.00 C ATOM 934 O VAL A 63 -10.057 6.377 -19.478 1.00 0.00 O ATOM 935 CB VAL A 63 -8.185 9.029 -19.598 1.00 0.00 C ATOM 936 CG1 VAL A 63 -7.130 8.866 -20.679 1.00 0.00 C ATOM 937 CG2 VAL A 63 -8.162 10.447 -19.046 1.00 0.00 C ATOM 0 H VAL A 63 -10.257 10.585 -19.730 1.00 0.00 H new ATOM 0 HA VAL A 63 -9.444 8.230 -21.152 1.00 0.00 H new ATOM 0 HB VAL A 63 -7.961 8.357 -18.769 1.00 0.00 H new ATOM 0 HG11 VAL A 63 -6.155 9.145 -20.280 1.00 0.00 H new ATOM 0 HG12 VAL A 63 -7.104 7.827 -21.008 1.00 0.00 H new ATOM 0 HG13 VAL A 63 -7.374 9.509 -21.525 1.00 0.00 H new ATOM 0 HG21 VAL A 63 -7.164 10.676 -18.672 1.00 0.00 H new ATOM 0 HG22 VAL A 63 -8.423 11.150 -19.837 1.00 0.00 H new ATOM 0 HG23 VAL A 63 -8.883 10.533 -18.233 1.00 0.00 H new ATOM 947 N LEU A 64 -10.876 8.031 -18.174 1.00 0.00 N ATOM 948 CA LEU A 64 -11.516 7.126 -17.218 1.00 0.00 C ATOM 949 C LEU A 64 -12.708 6.402 -17.844 1.00 0.00 C ATOM 950 O LEU A 64 -12.955 5.235 -17.544 1.00 0.00 O ATOM 951 CB LEU A 64 -11.974 7.898 -15.979 1.00 0.00 C ATOM 952 CG LEU A 64 -11.706 7.193 -14.647 1.00 0.00 C ATOM 953 CD1 LEU A 64 -10.471 7.776 -13.973 1.00 0.00 C ATOM 954 CD2 LEU A 64 -12.919 7.297 -13.731 1.00 0.00 C ATOM 0 H LEU A 64 -10.997 9.021 -17.960 1.00 0.00 H new ATOM 0 HA LEU A 64 -10.777 6.379 -16.927 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -11.476 8.867 -15.968 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -13.044 8.091 -16.063 1.00 0.00 H new ATOM 0 HG LEU A 64 -11.520 6.138 -14.848 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -10.296 7.263 -13.028 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -9.606 7.645 -14.623 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -10.626 8.839 -13.786 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -12.708 6.790 -12.789 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -13.139 8.347 -13.536 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -13.779 6.829 -14.211 1.00 0.00 H new ATOM 1165 N PHE A 79 -3.807 -4.022 -18.736 1.00 0.00 N ATOM 1166 CA PHE A 79 -2.465 -3.718 -19.225 1.00 0.00 C ATOM 1167 C PHE A 79 -1.557 -4.950 -19.142 1.00 0.00 C ATOM 1168 O PHE A 79 -0.737 -5.182 -20.032 1.00 0.00 O ATOM 1169 CB PHE A 79 -1.871 -2.528 -18.446 1.00 0.00 C ATOM 1170 CG PHE A 79 -0.845 -2.891 -17.401 1.00 0.00 C ATOM 1171 CD1 PHE A 79 0.453 -3.222 -17.763 1.00 0.00 C ATOM 1172 CD2 PHE A 79 -1.181 -2.895 -16.057 1.00 0.00 C ATOM 1173 CE1 PHE A 79 1.392 -3.552 -16.803 1.00 0.00 C ATOM 1174 CE2 PHE A 79 -0.247 -3.223 -15.094 1.00 0.00 C ATOM 1175 CZ PHE A 79 1.041 -3.552 -15.467 1.00 0.00 C ATOM 0 HA PHE A 79 -2.534 -3.436 -20.276 1.00 0.00 H new ATOM 0 HB2 PHE A 79 -1.414 -1.841 -19.158 1.00 0.00 H new ATOM 0 HB3 PHE A 79 -2.685 -1.989 -17.961 1.00 0.00 H new ATOM 0 HD1 PHE A 79 0.733 -3.222 -18.806 1.00 0.00 H new ATOM 0 HD2 PHE A 79 -2.187 -2.638 -15.758 1.00 0.00 H new ATOM 0 HE1 PHE A 79 2.399 -3.809 -17.097 1.00 0.00 H new ATOM 0 HE2 PHE A 79 -0.524 -3.222 -14.050 1.00 0.00 H new ATOM 0 HZ PHE A 79 1.773 -3.809 -14.715 1.00 0.00 H new ATOM 1185 N VAL A 80 -1.715 -5.737 -18.072 1.00 0.00 N ATOM 1186 CA VAL A 80 -0.913 -6.946 -17.876 1.00 0.00 C ATOM 1187 C VAL A 80 -1.179 -7.966 -18.984 1.00 0.00 C ATOM 1188 O VAL A 80 -0.244 -8.489 -19.586 1.00 0.00 O ATOM 1189 CB VAL A 80 -1.196 -7.602 -16.504 1.00 0.00 C ATOM 1190 CG1 VAL A 80 -0.490 -8.946 -16.388 1.00 0.00 C ATOM 1191 CG2 VAL A 80 -0.776 -6.677 -15.369 1.00 0.00 C ATOM 0 H VAL A 80 -2.391 -5.557 -17.330 1.00 0.00 H new ATOM 0 HA VAL A 80 0.132 -6.639 -17.909 1.00 0.00 H new ATOM 0 HB VAL A 80 -2.269 -7.775 -16.428 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -0.705 -9.387 -15.415 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -0.845 -9.612 -17.174 1.00 0.00 H new ATOM 0 HG13 VAL A 80 0.585 -8.802 -16.492 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -0.983 -7.157 -14.413 1.00 0.00 H new ATOM 0 HG22 VAL A 80 0.291 -6.468 -15.446 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -1.335 -5.743 -15.435 1.00 0.00 H new ATOM 1201 N LYS A 81 -2.460 -8.243 -19.243 1.00 0.00 N ATOM 1202 CA LYS A 81 -2.850 -9.204 -20.276 1.00 0.00 C ATOM 1203 C LYS A 81 -2.422 -8.744 -21.674 1.00 0.00 C ATOM 1204 O LYS A 81 -2.129 -9.573 -22.536 1.00 0.00 O ATOM 1205 CB LYS A 81 -4.362 -9.435 -20.248 1.00 0.00 C ATOM 1206 CG LYS A 81 -4.754 -10.905 -20.222 1.00 0.00 C ATOM 1207 CD LYS A 81 -4.234 -11.606 -18.977 1.00 0.00 C ATOM 1208 CE LYS A 81 -4.967 -11.134 -17.735 1.00 0.00 C ATOM 1209 NZ LYS A 81 -4.475 -11.804 -16.498 1.00 0.00 N ATOM 0 H LYS A 81 -3.244 -7.815 -18.751 1.00 0.00 H new ATOM 0 HA LYS A 81 -2.336 -10.140 -20.057 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -4.780 -8.941 -19.371 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -4.809 -8.964 -21.123 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -5.840 -10.992 -20.262 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -4.362 -11.402 -21.109 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -4.355 -12.684 -19.086 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -3.167 -11.414 -18.867 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -4.847 -10.055 -17.633 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -6.034 -11.327 -17.850 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -5.005 -11.449 -15.677 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -4.613 -12.831 -16.582 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -3.463 -11.599 -16.371 1.00 0.00 H new ATOM 1223 N GLY A 82 -2.391 -7.423 -21.893 1.00 0.00 N ATOM 1224 CA GLY A 82 -2.004 -6.887 -23.188 1.00 0.00 C ATOM 1225 C GLY A 82 -0.556 -7.185 -23.535 1.00 0.00 C ATOM 1226 O GLY A 82 -0.266 -7.704 -24.614 1.00 0.00 O ATOM 0 H GLY A 82 -2.628 -6.719 -21.194 1.00 0.00 H new ATOM 0 HA2 GLY A 82 -2.652 -7.305 -23.958 1.00 0.00 H new ATOM 0 HA3 GLY A 82 -2.160 -5.808 -23.192 1.00 0.00 H new ATOM 1230 N PHE A 83 0.353 -6.858 -22.616 1.00 0.00 N ATOM 1231 CA PHE A 83 1.781 -7.100 -22.826 1.00 0.00 C ATOM 1232 C PHE A 83 2.120 -8.579 -22.627 1.00 0.00 C ATOM 1233 O PHE A 83 2.970 -9.125 -23.334 1.00 0.00 O ATOM 1234 CB PHE A 83 2.620 -6.235 -21.878 1.00 0.00 C ATOM 1235 CG PHE A 83 2.463 -4.754 -22.107 1.00 0.00 C ATOM 1236 CD1 PHE A 83 2.637 -4.210 -23.371 1.00 0.00 C ATOM 1237 CD2 PHE A 83 2.141 -3.908 -21.057 1.00 0.00 C ATOM 1238 CE1 PHE A 83 2.493 -2.852 -23.582 1.00 0.00 C ATOM 1239 CE2 PHE A 83 1.995 -2.549 -21.263 1.00 0.00 C ATOM 1240 CZ PHE A 83 2.173 -2.020 -22.527 1.00 0.00 C ATOM 0 H PHE A 83 0.127 -6.426 -21.720 1.00 0.00 H new ATOM 0 HA PHE A 83 2.020 -6.827 -23.854 1.00 0.00 H new ATOM 0 HB2 PHE A 83 2.343 -6.466 -20.849 1.00 0.00 H new ATOM 0 HB3 PHE A 83 3.671 -6.501 -21.992 1.00 0.00 H new ATOM 0 HD1 PHE A 83 2.888 -4.855 -24.200 1.00 0.00 H new ATOM 0 HD2 PHE A 83 2.003 -4.316 -20.066 1.00 0.00 H new ATOM 0 HE1 PHE A 83 2.631 -2.441 -24.571 1.00 0.00 H new ATOM 0 HE2 PHE A 83 1.742 -1.901 -20.437 1.00 0.00 H new ATOM 0 HZ PHE A 83 2.062 -0.958 -22.690 1.00 0.00 H new ATOM 1250 N GLN A 84 1.446 -9.219 -21.666 1.00 0.00 N ATOM 1251 CA GLN A 84 1.665 -10.635 -21.375 1.00 0.00 C ATOM 1252 C GLN A 84 0.946 -11.522 -22.396 1.00 0.00 C ATOM 1253 O GLN A 84 -0.075 -12.144 -22.089 1.00 0.00 O ATOM 1254 CB GLN A 84 1.198 -10.968 -19.953 1.00 0.00 C ATOM 1255 CG GLN A 84 1.670 -12.327 -19.452 1.00 0.00 C ATOM 1256 CD GLN A 84 0.560 -13.148 -18.814 1.00 0.00 C ATOM 1257 OE1 GLN A 84 -0.518 -12.633 -18.507 1.00 0.00 O ATOM 1258 NE2 GLN A 84 0.819 -14.436 -18.607 1.00 0.00 N ATOM 0 H GLN A 84 0.742 -8.775 -21.076 1.00 0.00 H new ATOM 0 HA GLN A 84 2.734 -10.834 -21.447 1.00 0.00 H new ATOM 0 HB2 GLN A 84 1.557 -10.196 -19.273 1.00 0.00 H new ATOM 0 HB3 GLN A 84 0.109 -10.938 -19.922 1.00 0.00 H new ATOM 0 HG2 GLN A 84 2.094 -12.887 -20.285 1.00 0.00 H new ATOM 0 HG3 GLN A 84 2.469 -12.182 -18.725 1.00 0.00 H new ATOM 0 HE21 GLN A 84 1.723 -14.824 -18.875 1.00 0.00 H new ATOM 0 HE22 GLN A 84 0.113 -15.036 -18.180 1.00 0.00 H new ATOM 1267 N VAL A 85 1.492 -11.573 -23.610 1.00 0.00 N ATOM 1268 CA VAL A 85 0.923 -12.382 -24.685 1.00 0.00 C ATOM 1269 C VAL A 85 2.007 -13.239 -25.333 1.00 0.00 C ATOM 1270 O VAL A 85 1.937 -14.470 -25.305 1.00 0.00 O ATOM 1271 CB VAL A 85 0.248 -11.504 -25.764 1.00 0.00 C ATOM 1272 CG1 VAL A 85 -0.282 -12.360 -26.907 1.00 0.00 C ATOM 1273 CG2 VAL A 85 -0.870 -10.669 -25.156 1.00 0.00 C ATOM 0 H VAL A 85 2.333 -11.060 -23.874 1.00 0.00 H new ATOM 0 HA VAL A 85 0.162 -13.025 -24.242 1.00 0.00 H new ATOM 0 HB VAL A 85 1.000 -10.827 -26.168 1.00 0.00 H new ATOM 0 HG11 VAL A 85 -0.752 -11.720 -27.653 1.00 0.00 H new ATOM 0 HG12 VAL A 85 0.543 -12.906 -27.365 1.00 0.00 H new ATOM 0 HG13 VAL A 85 -1.016 -13.068 -26.522 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -1.332 -10.059 -25.932 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -1.620 -11.328 -24.719 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -0.460 -10.021 -24.381 1.00 0.00 H new ATOM 1283 N PHE A 86 3.013 -12.576 -25.905 1.00 0.00 N ATOM 1284 CA PHE A 86 4.125 -13.267 -26.550 1.00 0.00 C ATOM 1285 C PHE A 86 5.422 -13.047 -25.765 1.00 0.00 C ATOM 1286 O PHE A 86 6.480 -12.787 -26.345 1.00 0.00 O ATOM 1287 CB PHE A 86 4.275 -12.781 -27.996 1.00 0.00 C ATOM 1288 CG PHE A 86 4.466 -13.893 -28.989 1.00 0.00 C ATOM 1289 CD1 PHE A 86 3.512 -14.890 -29.125 1.00 0.00 C ATOM 1290 CD2 PHE A 86 5.597 -13.940 -29.787 1.00 0.00 C ATOM 1291 CE1 PHE A 86 3.684 -15.913 -30.038 1.00 0.00 C ATOM 1292 CE2 PHE A 86 5.775 -14.961 -30.702 1.00 0.00 C ATOM 1293 CZ PHE A 86 4.817 -15.948 -30.827 1.00 0.00 C ATOM 0 H PHE A 86 3.078 -11.559 -25.934 1.00 0.00 H new ATOM 0 HA PHE A 86 3.916 -14.337 -26.563 1.00 0.00 H new ATOM 0 HB2 PHE A 86 3.390 -12.208 -28.271 1.00 0.00 H new ATOM 0 HB3 PHE A 86 5.126 -12.102 -28.056 1.00 0.00 H new ATOM 0 HD1 PHE A 86 2.624 -14.867 -28.510 1.00 0.00 H new ATOM 0 HD2 PHE A 86 6.349 -13.170 -29.693 1.00 0.00 H new ATOM 0 HE1 PHE A 86 2.934 -16.684 -30.134 1.00 0.00 H new ATOM 0 HE2 PHE A 86 6.662 -14.987 -31.318 1.00 0.00 H new ATOM 0 HZ PHE A 86 4.954 -16.747 -31.541 1.00 0.00 H new ATOM 1303 N ASP A 87 5.325 -13.154 -24.437 1.00 0.00 N ATOM 1304 CA ASP A 87 6.473 -12.969 -23.558 1.00 0.00 C ATOM 1305 C ASP A 87 6.579 -14.121 -22.558 1.00 0.00 C ATOM 1306 O ASP A 87 6.245 -13.969 -21.379 1.00 0.00 O ATOM 1307 CB ASP A 87 6.357 -11.631 -22.819 1.00 0.00 C ATOM 1308 CG ASP A 87 6.733 -10.449 -23.692 1.00 0.00 C ATOM 1309 OD1 ASP A 87 5.844 -9.923 -24.394 1.00 0.00 O ATOM 1310 OD2 ASP A 87 7.919 -10.053 -23.677 1.00 0.00 O ATOM 0 H ASP A 87 4.456 -13.369 -23.949 1.00 0.00 H new ATOM 0 HA ASP A 87 7.378 -12.961 -24.166 1.00 0.00 H new ATOM 0 HB2 ASP A 87 5.335 -11.504 -22.463 1.00 0.00 H new ATOM 0 HB3 ASP A 87 7.001 -11.648 -21.940 1.00 0.00 H new ATOM 1315 N LYS A 88 7.044 -15.275 -23.041 1.00 0.00 N ATOM 1316 CA LYS A 88 7.196 -16.462 -22.197 1.00 0.00 C ATOM 1317 C LYS A 88 8.188 -16.204 -21.060 1.00 0.00 C ATOM 1318 O LYS A 88 7.877 -16.446 -19.892 1.00 0.00 O ATOM 1319 CB LYS A 88 7.659 -17.660 -23.034 1.00 0.00 C ATOM 1320 CG LYS A 88 7.547 -18.995 -22.309 1.00 0.00 C ATOM 1321 CD LYS A 88 6.527 -19.910 -22.970 1.00 0.00 C ATOM 1322 CE LYS A 88 5.193 -19.884 -22.239 1.00 0.00 C ATOM 1323 NZ LYS A 88 5.094 -20.967 -21.220 1.00 0.00 N ATOM 0 H LYS A 88 7.322 -15.413 -24.013 1.00 0.00 H new ATOM 0 HA LYS A 88 6.223 -16.689 -21.761 1.00 0.00 H new ATOM 0 HB2 LYS A 88 7.068 -17.703 -23.949 1.00 0.00 H new ATOM 0 HB3 LYS A 88 8.696 -17.505 -23.332 1.00 0.00 H new ATOM 0 HG2 LYS A 88 8.521 -19.485 -22.296 1.00 0.00 H new ATOM 0 HG3 LYS A 88 7.263 -18.823 -21.271 1.00 0.00 H new ATOM 0 HD2 LYS A 88 6.381 -19.604 -24.006 1.00 0.00 H new ATOM 0 HD3 LYS A 88 6.912 -20.930 -22.990 1.00 0.00 H new ATOM 0 HE2 LYS A 88 5.064 -18.917 -21.754 1.00 0.00 H new ATOM 0 HE3 LYS A 88 4.382 -19.989 -22.960 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 4.170 -20.914 -20.745 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 5.191 -21.892 -21.686 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 5.852 -20.852 -20.517 1.00 0.00 H new ATOM 1337 N ASP A 89 9.377 -15.710 -21.411 1.00 0.00 N ATOM 1338 CA ASP A 89 10.411 -15.419 -20.423 1.00 0.00 C ATOM 1339 C ASP A 89 10.505 -13.918 -20.144 1.00 0.00 C ATOM 1340 O ASP A 89 10.506 -13.498 -18.986 1.00 0.00 O ATOM 1341 CB ASP A 89 11.767 -15.949 -20.895 1.00 0.00 C ATOM 1342 CG ASP A 89 12.560 -16.592 -19.773 1.00 0.00 C ATOM 1343 OD1 ASP A 89 12.877 -15.891 -18.788 1.00 0.00 O ATOM 1344 OD2 ASP A 89 12.865 -17.799 -19.878 1.00 0.00 O ATOM 0 H ASP A 89 9.645 -15.504 -22.373 1.00 0.00 H new ATOM 0 HA ASP A 89 10.135 -15.922 -19.496 1.00 0.00 H new ATOM 0 HB2 ASP A 89 11.612 -16.678 -21.690 1.00 0.00 H new ATOM 0 HB3 ASP A 89 12.346 -15.130 -21.322 1.00 0.00 H new ATOM 1349 N ALA A 90 10.591 -13.117 -21.214 1.00 0.00 N ATOM 1350 CA ALA A 90 10.692 -11.661 -21.092 1.00 0.00 C ATOM 1351 C ALA A 90 11.917 -11.261 -20.261 1.00 0.00 C ATOM 1352 O ALA A 90 11.805 -10.524 -19.277 1.00 0.00 O ATOM 1353 CB ALA A 90 9.411 -11.088 -20.491 1.00 0.00 C ATOM 0 H ALA A 90 10.592 -13.456 -22.176 1.00 0.00 H new ATOM 0 HA ALA A 90 10.820 -11.242 -22.090 1.00 0.00 H new ATOM 0 HB1 ALA A 90 9.501 -10.005 -20.407 1.00 0.00 H new ATOM 0 HB2 ALA A 90 8.566 -11.333 -21.135 1.00 0.00 H new ATOM 0 HB3 ALA A 90 9.250 -11.517 -19.502 1.00 0.00 H new ATOM 1359 N THR A 91 13.086 -11.759 -20.667 1.00 0.00 N ATOM 1360 CA THR A 91 14.340 -11.465 -19.969 1.00 0.00 C ATOM 1361 C THR A 91 14.816 -10.042 -20.264 1.00 0.00 C ATOM 1362 O THR A 91 15.171 -9.299 -19.347 1.00 0.00 O ATOM 1363 CB THR A 91 15.427 -12.473 -20.361 1.00 0.00 C ATOM 1364 OG1 THR A 91 15.537 -12.582 -21.771 1.00 0.00 O ATOM 1365 CG2 THR A 91 15.182 -13.861 -19.812 1.00 0.00 C ATOM 0 H THR A 91 13.191 -12.369 -21.477 1.00 0.00 H new ATOM 0 HA THR A 91 14.150 -11.549 -18.899 1.00 0.00 H new ATOM 0 HB THR A 91 16.347 -12.082 -19.926 1.00 0.00 H new ATOM 0 HG1 THR A 91 16.238 -13.229 -21.995 1.00 0.00 H new ATOM 0 HG21 THR A 91 15.988 -14.524 -20.127 1.00 0.00 H new ATOM 0 HG22 THR A 91 15.149 -13.821 -18.723 1.00 0.00 H new ATOM 0 HG23 THR A 91 14.232 -14.239 -20.190 1.00 0.00 H new ATOM 1373 N GLY A 92 14.824 -9.673 -21.546 1.00 0.00 N ATOM 1374 CA GLY A 92 15.260 -8.343 -21.939 1.00 0.00 C ATOM 1375 C GLY A 92 15.007 -8.055 -23.405 1.00 0.00 C ATOM 1376 O GLY A 92 15.942 -7.761 -24.155 1.00 0.00 O ATOM 0 H GLY A 92 14.536 -10.273 -22.319 1.00 0.00 H new ATOM 0 HA2 GLY A 92 14.741 -7.601 -21.332 1.00 0.00 H new ATOM 0 HA3 GLY A 92 16.325 -8.238 -21.731 1.00 0.00 H new ATOM 1380 N MET A 93 13.740 -8.138 -23.817 1.00 0.00 N ATOM 1381 CA MET A 93 13.363 -7.882 -25.206 1.00 0.00 C ATOM 1382 C MET A 93 11.850 -7.726 -25.350 1.00 0.00 C ATOM 1383 O MET A 93 11.076 -8.348 -24.616 1.00 0.00 O ATOM 1384 CB MET A 93 13.860 -9.010 -26.118 1.00 0.00 C ATOM 1385 CG MET A 93 13.356 -10.392 -25.728 1.00 0.00 C ATOM 1386 SD MET A 93 14.666 -11.632 -25.716 1.00 0.00 S ATOM 1387 CE MET A 93 14.993 -11.800 -27.470 1.00 0.00 C ATOM 0 H MET A 93 12.959 -8.381 -23.207 1.00 0.00 H new ATOM 0 HA MET A 93 13.835 -6.947 -25.508 1.00 0.00 H new ATOM 0 HB2 MET A 93 13.551 -8.798 -27.142 1.00 0.00 H new ATOM 0 HB3 MET A 93 14.950 -9.017 -26.109 1.00 0.00 H new ATOM 0 HG2 MET A 93 12.899 -10.342 -24.740 1.00 0.00 H new ATOM 0 HG3 MET A 93 12.576 -10.700 -26.424 1.00 0.00 H new ATOM 0 HE1 MET A 93 15.231 -12.839 -27.698 1.00 0.00 H new ATOM 0 HE2 MET A 93 14.112 -11.497 -28.035 1.00 0.00 H new ATOM 0 HE3 MET A 93 15.836 -11.166 -27.745 1.00 0.00 H new ATOM 1397 N ILE A 94 11.439 -6.891 -26.303 1.00 0.00 N ATOM 1398 CA ILE A 94 10.023 -6.644 -26.553 1.00 0.00 C ATOM 1399 C ILE A 94 9.678 -6.896 -28.023 1.00 0.00 C ATOM 1400 O ILE A 94 10.474 -6.605 -28.915 1.00 0.00 O ATOM 1401 CB ILE A 94 9.630 -5.197 -26.139 1.00 0.00 C ATOM 1402 CG1 ILE A 94 8.354 -5.207 -25.279 1.00 0.00 C ATOM 1403 CG2 ILE A 94 9.458 -4.285 -27.350 1.00 0.00 C ATOM 1404 CD1 ILE A 94 7.097 -5.617 -26.026 1.00 0.00 C ATOM 0 H ILE A 94 12.070 -6.374 -26.915 1.00 0.00 H new ATOM 0 HA ILE A 94 9.448 -7.340 -25.943 1.00 0.00 H new ATOM 0 HB ILE A 94 10.449 -4.794 -25.544 1.00 0.00 H new ATOM 0 HG12 ILE A 94 8.501 -5.887 -24.440 1.00 0.00 H new ATOM 0 HG13 ILE A 94 8.205 -4.212 -24.860 1.00 0.00 H new ATOM 0 HG21 ILE A 94 9.184 -3.284 -27.016 1.00 0.00 H new ATOM 0 HG22 ILE A 94 10.394 -4.238 -27.906 1.00 0.00 H new ATOM 0 HG23 ILE A 94 8.673 -4.680 -27.995 1.00 0.00 H new ATOM 0 HD11 ILE A 94 6.246 -5.597 -25.345 1.00 0.00 H new ATOM 0 HD12 ILE A 94 6.920 -4.924 -26.848 1.00 0.00 H new ATOM 0 HD13 ILE A 94 7.221 -6.625 -26.421 1.00 0.00 H new ATOM 1416 N GLY A 95 8.489 -7.440 -28.264 1.00 0.00 N ATOM 1417 CA GLY A 95 8.055 -7.721 -29.620 1.00 0.00 C ATOM 1418 C GLY A 95 6.985 -6.756 -30.086 1.00 0.00 C ATOM 1419 O GLY A 95 5.799 -7.077 -30.029 1.00 0.00 O ATOM 0 H GLY A 95 7.816 -7.692 -27.540 1.00 0.00 H new ATOM 0 HA2 GLY A 95 8.911 -7.666 -30.293 1.00 0.00 H new ATOM 0 HA3 GLY A 95 7.672 -8.740 -29.674 1.00 0.00 H new ATOM 1423 N VAL A 96 7.407 -5.565 -30.532 1.00 0.00 N ATOM 1424 CA VAL A 96 6.478 -4.530 -31.004 1.00 0.00 C ATOM 1425 C VAL A 96 5.376 -5.108 -31.894 1.00 0.00 C ATOM 1426 O VAL A 96 4.229 -4.683 -31.802 1.00 0.00 O ATOM 1427 CB VAL A 96 7.204 -3.393 -31.760 1.00 0.00 C ATOM 1428 CG1 VAL A 96 6.194 -2.432 -32.376 1.00 0.00 C ATOM 1429 CG2 VAL A 96 8.148 -2.645 -30.827 1.00 0.00 C ATOM 0 H VAL A 96 8.389 -5.294 -30.576 1.00 0.00 H new ATOM 0 HA VAL A 96 6.021 -4.114 -30.106 1.00 0.00 H new ATOM 0 HB VAL A 96 7.794 -3.837 -32.562 1.00 0.00 H new ATOM 0 HG11 VAL A 96 6.722 -1.638 -32.904 1.00 0.00 H new ATOM 0 HG12 VAL A 96 5.558 -2.973 -33.077 1.00 0.00 H new ATOM 0 HG13 VAL A 96 5.579 -1.997 -31.589 1.00 0.00 H new ATOM 0 HG21 VAL A 96 8.649 -1.849 -31.378 1.00 0.00 H new ATOM 0 HG22 VAL A 96 7.579 -2.214 -30.003 1.00 0.00 H new ATOM 0 HG23 VAL A 96 8.892 -3.336 -30.431 1.00 0.00 H new ATOM 1439 N GLY A 97 5.719 -6.085 -32.743 1.00 0.00 N ATOM 1440 CA GLY A 97 4.719 -6.699 -33.607 1.00 0.00 C ATOM 1441 C GLY A 97 3.510 -7.180 -32.817 1.00 0.00 C ATOM 1442 O GLY A 97 2.366 -6.884 -33.172 1.00 0.00 O ATOM 0 H GLY A 97 6.663 -6.457 -32.845 1.00 0.00 H new ATOM 0 HA2 GLY A 97 4.398 -5.980 -34.361 1.00 0.00 H new ATOM 0 HA3 GLY A 97 5.164 -7.540 -34.138 1.00 0.00 H new ATOM 1446 N GLU A 98 3.777 -7.900 -31.723 1.00 0.00 N ATOM 1447 CA GLU A 98 2.722 -8.408 -30.846 1.00 0.00 C ATOM 1448 C GLU A 98 2.174 -7.289 -29.956 1.00 0.00 C ATOM 1449 O GLU A 98 0.965 -7.196 -29.743 1.00 0.00 O ATOM 1450 CB GLU A 98 3.247 -9.554 -29.969 1.00 0.00 C ATOM 1451 CG GLU A 98 3.996 -10.635 -30.739 1.00 0.00 C ATOM 1452 CD GLU A 98 3.090 -11.449 -31.641 1.00 0.00 C ATOM 1453 OE1 GLU A 98 2.889 -11.042 -32.805 1.00 0.00 O ATOM 1454 OE2 GLU A 98 2.579 -12.494 -31.185 1.00 0.00 O ATOM 0 H GLU A 98 4.721 -8.144 -31.424 1.00 0.00 H new ATOM 0 HA GLU A 98 1.918 -8.786 -31.477 1.00 0.00 H new ATOM 0 HB2 GLU A 98 3.909 -9.141 -29.208 1.00 0.00 H new ATOM 0 HB3 GLU A 98 2.407 -10.011 -29.447 1.00 0.00 H new ATOM 0 HG2 GLU A 98 4.778 -10.171 -31.340 1.00 0.00 H new ATOM 0 HG3 GLU A 98 4.491 -11.301 -30.032 1.00 0.00 H new ATOM 1461 N LEU A 99 3.075 -6.435 -29.448 1.00 0.00 N ATOM 1462 CA LEU A 99 2.688 -5.312 -28.589 1.00 0.00 C ATOM 1463 C LEU A 99 1.720 -4.378 -29.327 1.00 0.00 C ATOM 1464 O LEU A 99 0.745 -3.896 -28.746 1.00 0.00 O ATOM 1465 CB LEU A 99 3.944 -4.558 -28.098 1.00 0.00 C ATOM 1466 CG LEU A 99 4.149 -3.130 -28.624 1.00 0.00 C ATOM 1467 CD1 LEU A 99 3.145 -2.167 -28.001 1.00 0.00 C ATOM 1468 CD2 LEU A 99 5.572 -2.664 -28.341 1.00 0.00 C ATOM 0 H LEU A 99 4.078 -6.503 -29.619 1.00 0.00 H new ATOM 0 HA LEU A 99 2.167 -5.699 -27.713 1.00 0.00 H new ATOM 0 HB2 LEU A 99 3.910 -4.517 -27.009 1.00 0.00 H new ATOM 0 HB3 LEU A 99 4.820 -5.148 -28.368 1.00 0.00 H new ATOM 0 HG LEU A 99 3.986 -3.139 -29.702 1.00 0.00 H new ATOM 0 HD11 LEU A 99 3.313 -1.163 -28.391 1.00 0.00 H new ATOM 0 HD12 LEU A 99 2.133 -2.487 -28.247 1.00 0.00 H new ATOM 0 HD13 LEU A 99 3.270 -2.161 -26.918 1.00 0.00 H new ATOM 0 HD21 LEU A 99 5.705 -1.650 -28.719 1.00 0.00 H new ATOM 0 HD22 LEU A 99 5.752 -2.677 -27.266 1.00 0.00 H new ATOM 0 HD23 LEU A 99 6.278 -3.331 -28.836 1.00 0.00 H new ATOM 1480 N ARG A 100 1.997 -4.145 -30.613 1.00 0.00 N ATOM 1481 CA ARG A 100 1.165 -3.289 -31.457 1.00 0.00 C ATOM 1482 C ARG A 100 -0.210 -3.920 -31.669 1.00 0.00 C ATOM 1483 O ARG A 100 -1.231 -3.263 -31.484 1.00 0.00 O ATOM 1484 CB ARG A 100 1.857 -3.053 -32.808 1.00 0.00 C ATOM 1485 CG ARG A 100 0.983 -2.365 -33.851 1.00 0.00 C ATOM 1486 CD ARG A 100 0.303 -3.367 -34.776 1.00 0.00 C ATOM 1487 NE ARG A 100 1.254 -4.296 -35.391 1.00 0.00 N ATOM 1488 CZ ARG A 100 0.912 -5.469 -35.934 1.00 0.00 C ATOM 1489 NH1 ARG A 100 -0.361 -5.866 -35.949 1.00 0.00 N ATOM 1490 NH2 ARG A 100 1.847 -6.250 -36.464 1.00 0.00 N ATOM 0 H ARG A 100 2.802 -4.544 -31.095 1.00 0.00 H new ATOM 0 HA ARG A 100 1.029 -2.330 -30.957 1.00 0.00 H new ATOM 0 HB2 ARG A 100 2.750 -2.450 -32.645 1.00 0.00 H new ATOM 0 HB3 ARG A 100 2.189 -4.012 -33.205 1.00 0.00 H new ATOM 0 HG2 ARG A 100 0.226 -1.763 -33.349 1.00 0.00 H new ATOM 0 HG3 ARG A 100 1.593 -1.682 -34.442 1.00 0.00 H new ATOM 0 HD2 ARG A 100 -0.439 -3.932 -34.212 1.00 0.00 H new ATOM 0 HD3 ARG A 100 -0.233 -2.829 -35.558 1.00 0.00 H new ATOM 0 HE ARG A 100 2.239 -4.031 -35.406 1.00 0.00 H new ATOM 0 HH11 ARG A 100 -1.085 -5.273 -35.544 1.00 0.00 H new ATOM 0 HH12 ARG A 100 -0.611 -6.763 -36.366 1.00 0.00 H new ATOM 0 HH21 ARG A 100 2.823 -5.954 -36.456 1.00 0.00 H new ATOM 0 HH22 ARG A 100 1.589 -7.145 -36.879 1.00 0.00 H new ATOM 1504 N TYR A 101 -0.224 -5.203 -32.051 1.00 0.00 N ATOM 1505 CA TYR A 101 -1.472 -5.937 -32.283 1.00 0.00 C ATOM 1506 C TYR A 101 -2.422 -5.823 -31.083 1.00 0.00 C ATOM 1507 O TYR A 101 -3.639 -5.720 -31.254 1.00 0.00 O ATOM 1508 CB TYR A 101 -1.162 -7.412 -32.569 1.00 0.00 C ATOM 1509 CG TYR A 101 -2.388 -8.283 -32.754 1.00 0.00 C ATOM 1510 CD1 TYR A 101 -3.100 -8.272 -33.948 1.00 0.00 C ATOM 1511 CD2 TYR A 101 -2.831 -9.118 -31.734 1.00 0.00 C ATOM 1512 CE1 TYR A 101 -4.216 -9.070 -34.120 1.00 0.00 C ATOM 1513 CE2 TYR A 101 -3.946 -9.918 -31.899 1.00 0.00 C ATOM 1514 CZ TYR A 101 -4.634 -9.890 -33.093 1.00 0.00 C ATOM 1515 OH TYR A 101 -5.744 -10.687 -33.263 1.00 0.00 O ATOM 0 H TYR A 101 0.619 -5.755 -32.206 1.00 0.00 H new ATOM 0 HA TYR A 101 -1.969 -5.494 -33.146 1.00 0.00 H new ATOM 0 HB2 TYR A 101 -0.548 -7.474 -33.467 1.00 0.00 H new ATOM 0 HB3 TYR A 101 -0.567 -7.812 -31.748 1.00 0.00 H new ATOM 0 HD1 TYR A 101 -2.776 -7.630 -34.754 1.00 0.00 H new ATOM 0 HD2 TYR A 101 -2.295 -9.142 -30.797 1.00 0.00 H new ATOM 0 HE1 TYR A 101 -4.758 -9.051 -35.054 1.00 0.00 H new ATOM 0 HE2 TYR A 101 -4.276 -10.561 -31.097 1.00 0.00 H new ATOM 0 HH TYR A 101 -5.904 -11.204 -32.446 1.00 0.00 H new ATOM 1525 N VAL A 102 -1.855 -5.848 -29.874 1.00 0.00 N ATOM 1526 CA VAL A 102 -2.640 -5.754 -28.642 1.00 0.00 C ATOM 1527 C VAL A 102 -3.154 -4.331 -28.402 1.00 0.00 C ATOM 1528 O VAL A 102 -4.335 -4.132 -28.114 1.00 0.00 O ATOM 1529 CB VAL A 102 -1.815 -6.197 -27.412 1.00 0.00 C ATOM 1530 CG1 VAL A 102 -2.681 -6.197 -26.160 1.00 0.00 C ATOM 1531 CG2 VAL A 102 -1.195 -7.573 -27.636 1.00 0.00 C ATOM 0 H VAL A 102 -0.850 -5.933 -29.723 1.00 0.00 H new ATOM 0 HA VAL A 102 -3.491 -6.424 -28.770 1.00 0.00 H new ATOM 0 HB VAL A 102 -1.005 -5.481 -27.272 1.00 0.00 H new ATOM 0 HG11 VAL A 102 -2.083 -6.511 -25.304 1.00 0.00 H new ATOM 0 HG12 VAL A 102 -3.066 -5.193 -25.984 1.00 0.00 H new ATOM 0 HG13 VAL A 102 -3.514 -6.887 -26.294 1.00 0.00 H new ATOM 0 HG21 VAL A 102 -0.620 -7.861 -26.756 1.00 0.00 H new ATOM 0 HG22 VAL A 102 -1.985 -8.304 -27.809 1.00 0.00 H new ATOM 0 HG23 VAL A 102 -0.537 -7.538 -28.504 1.00 0.00 H new ATOM 1541 N LEU A 103 -2.256 -3.350 -28.502 1.00 0.00 N ATOM 1542 CA LEU A 103 -2.611 -1.946 -28.277 1.00 0.00 C ATOM 1543 C LEU A 103 -3.519 -1.389 -29.381 1.00 0.00 C ATOM 1544 O LEU A 103 -4.309 -0.477 -29.133 1.00 0.00 O ATOM 1545 CB LEU A 103 -1.344 -1.097 -28.153 1.00 0.00 C ATOM 1546 CG LEU A 103 -0.855 -0.883 -26.720 1.00 0.00 C ATOM 1547 CD1 LEU A 103 0.625 -0.535 -26.705 1.00 0.00 C ATOM 1548 CD2 LEU A 103 -1.671 0.205 -26.038 1.00 0.00 C ATOM 0 H LEU A 103 -1.275 -3.501 -28.738 1.00 0.00 H new ATOM 0 HA LEU A 103 -3.174 -1.899 -27.345 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -0.548 -1.571 -28.727 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -1.529 -0.124 -28.608 1.00 0.00 H new ATOM 0 HG LEU A 103 -0.991 -1.812 -26.166 1.00 0.00 H new ATOM 0 HD11 LEU A 103 0.953 -0.387 -25.676 1.00 0.00 H new ATOM 0 HD12 LEU A 103 1.195 -1.349 -27.154 1.00 0.00 H new ATOM 0 HD13 LEU A 103 0.789 0.380 -27.274 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -1.311 0.345 -25.019 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -1.567 1.138 -26.591 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -2.721 -0.088 -26.015 1.00 0.00 H new ATOM 1560 N THR A 104 -3.405 -1.935 -30.594 1.00 0.00 N ATOM 1561 CA THR A 104 -4.222 -1.487 -31.725 1.00 0.00 C ATOM 1562 C THR A 104 -5.708 -1.768 -31.484 1.00 0.00 C ATOM 1563 O THR A 104 -6.565 -0.958 -31.843 1.00 0.00 O ATOM 1564 CB THR A 104 -3.760 -2.172 -33.019 1.00 0.00 C ATOM 1565 OG1 THR A 104 -2.460 -1.739 -33.377 1.00 0.00 O ATOM 1566 CG2 THR A 104 -4.667 -1.910 -34.203 1.00 0.00 C ATOM 0 H THR A 104 -2.755 -2.688 -30.819 1.00 0.00 H new ATOM 0 HA THR A 104 -4.093 -0.409 -31.824 1.00 0.00 H new ATOM 0 HB THR A 104 -3.781 -3.239 -32.798 1.00 0.00 H new ATOM 0 HG1 THR A 104 -1.799 -2.175 -32.799 1.00 0.00 H new ATOM 0 HG21 THR A 104 -4.277 -2.426 -35.081 1.00 0.00 H new ATOM 0 HG22 THR A 104 -5.669 -2.277 -33.982 1.00 0.00 H new ATOM 0 HG23 THR A 104 -4.708 -0.839 -34.400 1.00 0.00 H new ATOM 1574 N SER A 105 -6.004 -2.920 -30.874 1.00 0.00 N ATOM 1575 CA SER A 105 -7.386 -3.310 -30.586 1.00 0.00 C ATOM 1576 C SER A 105 -8.013 -2.457 -29.473 1.00 0.00 C ATOM 1577 O SER A 105 -9.230 -2.489 -29.283 1.00 0.00 O ATOM 1578 CB SER A 105 -7.451 -4.794 -30.209 1.00 0.00 C ATOM 1579 OG SER A 105 -6.840 -5.036 -28.953 1.00 0.00 O ATOM 0 H SER A 105 -5.305 -3.598 -30.571 1.00 0.00 H new ATOM 0 HA SER A 105 -7.964 -3.138 -31.494 1.00 0.00 H new ATOM 0 HB2 SER A 105 -8.491 -5.118 -30.178 1.00 0.00 H new ATOM 0 HB3 SER A 105 -6.955 -5.388 -30.977 1.00 0.00 H new ATOM 0 HG SER A 105 -5.961 -4.602 -28.928 1.00 0.00 H new ATOM 1585 N LEU A 106 -7.190 -1.691 -28.745 1.00 0.00 N ATOM 1586 CA LEU A 106 -7.693 -0.838 -27.666 1.00 0.00 C ATOM 1587 C LEU A 106 -8.455 0.359 -28.238 1.00 0.00 C ATOM 1588 O LEU A 106 -9.668 0.473 -28.061 1.00 0.00 O ATOM 1589 CB LEU A 106 -6.541 -0.357 -26.774 1.00 0.00 C ATOM 1590 CG LEU A 106 -6.435 -1.057 -25.415 1.00 0.00 C ATOM 1591 CD1 LEU A 106 -5.125 -0.701 -24.726 1.00 0.00 C ATOM 1592 CD2 LEU A 106 -7.621 -0.693 -24.530 1.00 0.00 C ATOM 0 H LEU A 106 -6.180 -1.646 -28.884 1.00 0.00 H new ATOM 0 HA LEU A 106 -8.378 -1.428 -27.058 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -5.603 -0.497 -27.311 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -6.655 0.714 -26.606 1.00 0.00 H new ATOM 0 HG LEU A 106 -6.450 -2.134 -25.585 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -5.071 -1.209 -23.763 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -4.288 -1.016 -25.350 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -5.077 0.377 -24.571 1.00 0.00 H new ATOM 0 HD21 LEU A 106 -7.527 -1.200 -23.570 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -7.639 0.385 -24.371 1.00 0.00 H new ATOM 0 HD23 LEU A 106 -8.546 -1.004 -25.016 1.00 0.00 H new ATOM 1604 N GLY A 107 -7.732 1.241 -28.933 1.00 0.00 N ATOM 1605 CA GLY A 107 -8.347 2.413 -29.534 1.00 0.00 C ATOM 1606 C GLY A 107 -7.476 3.033 -30.611 1.00 0.00 C ATOM 1607 O GLY A 107 -7.246 4.243 -30.609 1.00 0.00 O ATOM 0 H GLY A 107 -6.727 1.161 -29.089 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -9.309 2.135 -29.964 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -8.545 3.154 -28.759 1.00 0.00 H new ATOM 1611 N GLU A 108 -6.988 2.192 -31.530 1.00 0.00 N ATOM 1612 CA GLU A 108 -6.127 2.638 -32.626 1.00 0.00 C ATOM 1613 C GLU A 108 -4.839 3.280 -32.101 1.00 0.00 C ATOM 1614 O GLU A 108 -4.465 4.381 -32.513 1.00 0.00 O ATOM 1615 CB GLU A 108 -6.880 3.609 -33.543 1.00 0.00 C ATOM 1616 CG GLU A 108 -7.799 2.915 -34.537 1.00 0.00 C ATOM 1617 CD GLU A 108 -9.266 3.047 -34.170 1.00 0.00 C ATOM 1618 OE1 GLU A 108 -9.713 2.340 -33.241 1.00 0.00 O ATOM 1619 OE2 GLU A 108 -9.967 3.857 -34.811 1.00 0.00 O ATOM 0 H GLU A 108 -7.178 1.190 -31.534 1.00 0.00 H new ATOM 0 HA GLU A 108 -5.846 1.759 -33.206 1.00 0.00 H new ATOM 0 HB2 GLU A 108 -7.469 4.292 -32.931 1.00 0.00 H new ATOM 0 HB3 GLU A 108 -6.157 4.214 -34.090 1.00 0.00 H new ATOM 0 HG2 GLU A 108 -7.638 3.336 -35.529 1.00 0.00 H new ATOM 0 HG3 GLU A 108 -7.536 1.859 -34.592 1.00 0.00 H new ATOM 1626 N LYS A 109 -4.162 2.570 -31.192 1.00 0.00 N ATOM 1627 CA LYS A 109 -2.905 3.041 -30.609 1.00 0.00 C ATOM 1628 C LYS A 109 -1.788 3.046 -31.671 1.00 0.00 C ATOM 1629 O LYS A 109 -2.028 3.433 -32.816 1.00 0.00 O ATOM 1630 CB LYS A 109 -2.538 2.166 -29.402 1.00 0.00 C ATOM 1631 CG LYS A 109 -1.784 2.911 -28.313 1.00 0.00 C ATOM 1632 CD LYS A 109 -2.724 3.732 -27.445 1.00 0.00 C ATOM 1633 CE LYS A 109 -1.988 4.378 -26.284 1.00 0.00 C ATOM 1634 NZ LYS A 109 -2.893 5.207 -25.441 1.00 0.00 N ATOM 0 H LYS A 109 -4.468 1.661 -30.844 1.00 0.00 H new ATOM 0 HA LYS A 109 -3.026 4.067 -30.261 1.00 0.00 H new ATOM 0 HB2 LYS A 109 -3.450 1.747 -28.978 1.00 0.00 H new ATOM 0 HB3 LYS A 109 -1.931 1.328 -29.744 1.00 0.00 H new ATOM 0 HG2 LYS A 109 -1.243 2.198 -27.691 1.00 0.00 H new ATOM 0 HG3 LYS A 109 -1.041 3.567 -28.767 1.00 0.00 H new ATOM 0 HD2 LYS A 109 -3.199 4.504 -28.051 1.00 0.00 H new ATOM 0 HD3 LYS A 109 -3.519 3.092 -27.062 1.00 0.00 H new ATOM 0 HE2 LYS A 109 -1.529 3.603 -25.670 1.00 0.00 H new ATOM 0 HE3 LYS A 109 -1.180 5.000 -26.668 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 -2.350 5.629 -24.661 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 -3.312 5.963 -26.020 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 -3.650 4.609 -25.052 1.00 0.00 H new ATOM 1648 N LEU A 110 -0.575 2.615 -31.301 1.00 0.00 N ATOM 1649 CA LEU A 110 0.545 2.570 -32.243 1.00 0.00 C ATOM 1650 C LEU A 110 0.326 1.450 -33.263 1.00 0.00 C ATOM 1651 O LEU A 110 0.923 0.378 -33.160 1.00 0.00 O ATOM 1652 CB LEU A 110 1.872 2.358 -31.499 1.00 0.00 C ATOM 1653 CG LEU A 110 2.139 3.328 -30.342 1.00 0.00 C ATOM 1654 CD1 LEU A 110 3.043 2.682 -29.303 1.00 0.00 C ATOM 1655 CD2 LEU A 110 2.755 4.622 -30.856 1.00 0.00 C ATOM 0 H LEU A 110 -0.347 2.294 -30.360 1.00 0.00 H new ATOM 0 HA LEU A 110 0.595 3.524 -32.768 1.00 0.00 H new ATOM 0 HB2 LEU A 110 1.892 1.340 -31.110 1.00 0.00 H new ATOM 0 HB3 LEU A 110 2.689 2.441 -32.216 1.00 0.00 H new ATOM 0 HG LEU A 110 1.186 3.568 -29.869 1.00 0.00 H new ATOM 0 HD11 LEU A 110 3.222 3.385 -28.489 1.00 0.00 H new ATOM 0 HD12 LEU A 110 2.563 1.786 -28.910 1.00 0.00 H new ATOM 0 HD13 LEU A 110 3.993 2.412 -29.765 1.00 0.00 H new ATOM 0 HD21 LEU A 110 2.936 5.296 -30.019 1.00 0.00 H new ATOM 0 HD22 LEU A 110 3.698 4.402 -31.356 1.00 0.00 H new ATOM 0 HD23 LEU A 110 2.072 5.095 -31.561 1.00 0.00 H new ATOM 1667 N SER A 111 -0.553 1.710 -34.234 1.00 0.00 N ATOM 1668 CA SER A 111 -0.889 0.735 -35.275 1.00 0.00 C ATOM 1669 C SER A 111 0.324 0.370 -36.136 1.00 0.00 C ATOM 1670 O SER A 111 1.443 0.822 -35.878 1.00 0.00 O ATOM 1671 CB SER A 111 -2.018 1.283 -36.155 1.00 0.00 C ATOM 1672 OG SER A 111 -1.582 2.400 -36.914 1.00 0.00 O ATOM 0 H SER A 111 -1.049 2.597 -34.321 1.00 0.00 H new ATOM 0 HA SER A 111 -1.220 -0.178 -34.780 1.00 0.00 H new ATOM 0 HB2 SER A 111 -2.372 0.500 -36.826 1.00 0.00 H new ATOM 0 HB3 SER A 111 -2.862 1.573 -35.529 1.00 0.00 H new ATOM 0 HG SER A 111 -2.321 2.728 -37.467 1.00 0.00 H new ATOM 1678 N ASN A 112 0.088 -0.456 -37.160 1.00 0.00 N ATOM 1679 CA ASN A 112 1.147 -0.899 -38.070 1.00 0.00 C ATOM 1680 C ASN A 112 1.938 0.279 -38.646 1.00 0.00 C ATOM 1681 O ASN A 112 3.147 0.173 -38.844 1.00 0.00 O ATOM 1682 CB ASN A 112 0.555 -1.736 -39.207 1.00 0.00 C ATOM 1683 CG ASN A 112 1.621 -2.380 -40.075 1.00 0.00 C ATOM 1684 OD1 ASN A 112 1.766 -2.041 -41.248 1.00 0.00 O ATOM 1685 ND2 ASN A 112 2.373 -3.318 -39.503 1.00 0.00 N ATOM 0 H ASN A 112 -0.834 -0.833 -37.380 1.00 0.00 H new ATOM 0 HA ASN A 112 1.838 -1.511 -37.490 1.00 0.00 H new ATOM 0 HB2 ASN A 112 -0.084 -2.513 -38.787 1.00 0.00 H new ATOM 0 HB3 ASN A 112 -0.079 -1.103 -39.827 1.00 0.00 H new ATOM 0 HD21 ASN A 112 3.103 -3.785 -40.041 1.00 0.00 H new ATOM 0 HD22 ASN A 112 2.220 -3.569 -38.526 1.00 0.00 H new ATOM 1692 N GLU A 113 1.256 1.397 -38.913 1.00 0.00 N ATOM 1693 CA GLU A 113 1.910 2.585 -39.466 1.00 0.00 C ATOM 1694 C GLU A 113 2.914 3.178 -38.476 1.00 0.00 C ATOM 1695 O GLU A 113 4.068 3.430 -38.832 1.00 0.00 O ATOM 1696 CB GLU A 113 0.874 3.644 -39.840 1.00 0.00 C ATOM 1697 CG GLU A 113 1.455 4.816 -40.618 1.00 0.00 C ATOM 1698 CD GLU A 113 1.423 6.114 -39.832 1.00 0.00 C ATOM 1699 OE1 GLU A 113 2.308 6.309 -38.971 1.00 0.00 O ATOM 1700 OE2 GLU A 113 0.516 6.935 -40.080 1.00 0.00 O ATOM 0 H GLU A 113 0.254 1.503 -38.755 1.00 0.00 H new ATOM 0 HA GLU A 113 2.448 2.275 -40.362 1.00 0.00 H new ATOM 0 HB2 GLU A 113 0.088 3.178 -40.434 1.00 0.00 H new ATOM 0 HB3 GLU A 113 0.405 4.019 -38.930 1.00 0.00 H new ATOM 0 HG2 GLU A 113 2.485 4.589 -40.894 1.00 0.00 H new ATOM 0 HG3 GLU A 113 0.897 4.944 -41.545 1.00 0.00 H new ATOM 1707 N GLU A 114 2.466 3.403 -37.237 1.00 0.00 N ATOM 1708 CA GLU A 114 3.329 3.969 -36.203 1.00 0.00 C ATOM 1709 C GLU A 114 4.550 3.086 -35.970 1.00 0.00 C ATOM 1710 O GLU A 114 5.684 3.569 -35.984 1.00 0.00 O ATOM 1711 CB GLU A 114 2.555 4.159 -34.897 1.00 0.00 C ATOM 1712 CG GLU A 114 2.853 5.479 -34.202 1.00 0.00 C ATOM 1713 CD GLU A 114 2.646 6.680 -35.108 1.00 0.00 C ATOM 1714 OE1 GLU A 114 1.483 7.095 -35.289 1.00 0.00 O ATOM 1715 OE2 GLU A 114 3.649 7.204 -35.641 1.00 0.00 O ATOM 0 H GLU A 114 1.515 3.202 -36.929 1.00 0.00 H new ATOM 0 HA GLU A 114 3.672 4.944 -36.549 1.00 0.00 H new ATOM 0 HB2 GLU A 114 1.487 4.100 -35.105 1.00 0.00 H new ATOM 0 HB3 GLU A 114 2.794 3.339 -34.220 1.00 0.00 H new ATOM 0 HG2 GLU A 114 2.212 5.576 -33.326 1.00 0.00 H new ATOM 0 HG3 GLU A 114 3.883 5.472 -33.845 1.00 0.00 H new ATOM 1722 N MET A 115 4.312 1.786 -35.777 1.00 0.00 N ATOM 1723 CA MET A 115 5.398 0.833 -35.564 1.00 0.00 C ATOM 1724 C MET A 115 6.256 0.692 -36.824 1.00 0.00 C ATOM 1725 O MET A 115 7.443 0.383 -36.733 1.00 0.00 O ATOM 1726 CB MET A 115 4.850 -0.537 -35.138 1.00 0.00 C ATOM 1727 CG MET A 115 3.987 -1.218 -36.191 1.00 0.00 C ATOM 1728 SD MET A 115 4.955 -2.175 -37.374 1.00 0.00 S ATOM 1729 CE MET A 115 4.608 -3.842 -36.824 1.00 0.00 C ATOM 0 H MET A 115 3.379 1.373 -35.764 1.00 0.00 H new ATOM 0 HA MET A 115 6.026 1.218 -34.760 1.00 0.00 H new ATOM 0 HB2 MET A 115 5.687 -1.190 -34.892 1.00 0.00 H new ATOM 0 HB3 MET A 115 4.264 -0.414 -34.227 1.00 0.00 H new ATOM 0 HG2 MET A 115 3.271 -1.875 -35.698 1.00 0.00 H new ATOM 0 HG3 MET A 115 3.411 -0.463 -36.726 1.00 0.00 H new ATOM 0 HE1 MET A 115 5.244 -4.543 -37.364 1.00 0.00 H new ATOM 0 HE2 MET A 115 4.806 -3.921 -35.755 1.00 0.00 H new ATOM 0 HE3 MET A 115 3.562 -4.079 -37.017 1.00 0.00 H new ATOM 1739 N ASP A 116 5.654 0.931 -37.999 1.00 0.00 N ATOM 1740 CA ASP A 116 6.379 0.841 -39.267 1.00 0.00 C ATOM 1741 C ASP A 116 7.562 1.805 -39.273 1.00 0.00 C ATOM 1742 O ASP A 116 8.684 1.419 -39.605 1.00 0.00 O ATOM 1743 CB ASP A 116 5.452 1.148 -40.449 1.00 0.00 C ATOM 1744 CG ASP A 116 5.256 -0.049 -41.359 1.00 0.00 C ATOM 1745 OD1 ASP A 116 6.248 -0.507 -41.963 1.00 0.00 O ATOM 1746 OD2 ASP A 116 4.110 -0.527 -41.471 1.00 0.00 O ATOM 0 H ASP A 116 4.671 1.187 -38.093 1.00 0.00 H new ATOM 0 HA ASP A 116 6.750 -0.179 -39.372 1.00 0.00 H new ATOM 0 HB2 ASP A 116 4.483 1.476 -40.071 1.00 0.00 H new ATOM 0 HB3 ASP A 116 5.866 1.975 -41.026 1.00 0.00 H new ATOM 1751 N GLU A 117 7.301 3.058 -38.888 1.00 0.00 N ATOM 1752 CA GLU A 117 8.343 4.083 -38.832 1.00 0.00 C ATOM 1753 C GLU A 117 9.367 3.753 -37.744 1.00 0.00 C ATOM 1754 O GLU A 117 10.573 3.898 -37.953 1.00 0.00 O ATOM 1755 CB GLU A 117 7.728 5.462 -38.568 1.00 0.00 C ATOM 1756 CG GLU A 117 6.776 5.927 -39.660 1.00 0.00 C ATOM 1757 CD GLU A 117 6.218 7.312 -39.394 1.00 0.00 C ATOM 1758 OE1 GLU A 117 6.867 8.300 -39.799 1.00 0.00 O ATOM 1759 OE2 GLU A 117 5.133 7.408 -38.781 1.00 0.00 O ATOM 0 H GLU A 117 6.376 3.385 -38.611 1.00 0.00 H new ATOM 0 HA GLU A 117 8.850 4.102 -39.797 1.00 0.00 H new ATOM 0 HB2 GLU A 117 7.193 5.435 -37.619 1.00 0.00 H new ATOM 0 HB3 GLU A 117 8.529 6.193 -38.462 1.00 0.00 H new ATOM 0 HG2 GLU A 117 7.298 5.927 -40.617 1.00 0.00 H new ATOM 0 HG3 GLU A 117 5.953 5.218 -39.746 1.00 0.00 H new ATOM 1766 N LEU A 118 8.874 3.298 -36.584 1.00 0.00 N ATOM 1767 CA LEU A 118 9.742 2.934 -35.465 1.00 0.00 C ATOM 1768 C LEU A 118 10.687 1.793 -35.857 1.00 0.00 C ATOM 1769 O LEU A 118 11.875 1.823 -35.530 1.00 0.00 O ATOM 1770 CB LEU A 118 8.895 2.555 -34.232 1.00 0.00 C ATOM 1771 CG LEU A 118 8.847 1.063 -33.862 1.00 0.00 C ATOM 1772 CD1 LEU A 118 10.126 0.639 -33.151 1.00 0.00 C ATOM 1773 CD2 LEU A 118 7.633 0.770 -32.992 1.00 0.00 C ATOM 0 H LEU A 118 7.878 3.175 -36.400 1.00 0.00 H new ATOM 0 HA LEU A 118 10.355 3.798 -35.206 1.00 0.00 H new ATOM 0 HB2 LEU A 118 9.277 3.107 -33.373 1.00 0.00 H new ATOM 0 HB3 LEU A 118 7.874 2.897 -34.402 1.00 0.00 H new ATOM 0 HG LEU A 118 8.763 0.486 -34.783 1.00 0.00 H new ATOM 0 HD11 LEU A 118 10.068 -0.420 -32.899 1.00 0.00 H new ATOM 0 HD12 LEU A 118 10.980 0.810 -33.806 1.00 0.00 H new ATOM 0 HD13 LEU A 118 10.246 1.223 -32.238 1.00 0.00 H new ATOM 0 HD21 LEU A 118 7.614 -0.290 -32.739 1.00 0.00 H new ATOM 0 HD22 LEU A 118 7.690 1.360 -32.077 1.00 0.00 H new ATOM 0 HD23 LEU A 118 6.725 1.030 -33.536 1.00 0.00 H new ATOM 1785 N LEU A 119 10.151 0.800 -36.569 1.00 0.00 N ATOM 1786 CA LEU A 119 10.941 -0.346 -37.016 1.00 0.00 C ATOM 1787 C LEU A 119 11.927 0.061 -38.111 1.00 0.00 C ATOM 1788 O LEU A 119 13.024 -0.489 -38.198 1.00 0.00 O ATOM 1789 CB LEU A 119 10.026 -1.466 -37.522 1.00 0.00 C ATOM 1790 CG LEU A 119 9.811 -2.615 -36.537 1.00 0.00 C ATOM 1791 CD1 LEU A 119 8.463 -3.282 -36.775 1.00 0.00 C ATOM 1792 CD2 LEU A 119 10.942 -3.625 -36.654 1.00 0.00 C ATOM 0 H LEU A 119 9.171 0.768 -36.848 1.00 0.00 H new ATOM 0 HA LEU A 119 11.509 -0.714 -36.162 1.00 0.00 H new ATOM 0 HB2 LEU A 119 9.056 -1.037 -37.775 1.00 0.00 H new ATOM 0 HB3 LEU A 119 10.446 -1.870 -38.443 1.00 0.00 H new ATOM 0 HG LEU A 119 9.812 -2.211 -35.525 1.00 0.00 H new ATOM 0 HD11 LEU A 119 8.330 -4.097 -36.064 1.00 0.00 H new ATOM 0 HD12 LEU A 119 7.666 -2.550 -36.642 1.00 0.00 H new ATOM 0 HD13 LEU A 119 8.427 -3.677 -37.790 1.00 0.00 H new ATOM 0 HD21 LEU A 119 10.778 -4.439 -35.948 1.00 0.00 H new ATOM 0 HD22 LEU A 119 10.970 -4.025 -37.668 1.00 0.00 H new ATOM 0 HD23 LEU A 119 11.891 -3.137 -36.431 1.00 0.00 H new ATOM 1804 N LYS A 120 11.533 1.030 -38.940 1.00 0.00 N ATOM 1805 CA LYS A 120 12.388 1.516 -40.022 1.00 0.00 C ATOM 1806 C LYS A 120 13.687 2.109 -39.470 1.00 0.00 C ATOM 1807 O LYS A 120 14.761 1.904 -40.039 1.00 0.00 O ATOM 1808 CB LYS A 120 11.648 2.565 -40.858 1.00 0.00 C ATOM 1809 CG LYS A 120 12.130 2.649 -42.299 1.00 0.00 C ATOM 1810 CD LYS A 120 10.970 2.602 -43.284 1.00 0.00 C ATOM 1811 CE LYS A 120 11.261 1.666 -44.448 1.00 0.00 C ATOM 1812 NZ LYS A 120 11.027 0.238 -44.089 1.00 0.00 N ATOM 0 H LYS A 120 10.626 1.493 -38.882 1.00 0.00 H new ATOM 0 HA LYS A 120 12.640 0.668 -40.658 1.00 0.00 H new ATOM 0 HB2 LYS A 120 10.583 2.335 -40.853 1.00 0.00 H new ATOM 0 HB3 LYS A 120 11.766 3.541 -40.387 1.00 0.00 H new ATOM 0 HG2 LYS A 120 12.692 3.572 -42.442 1.00 0.00 H new ATOM 0 HG3 LYS A 120 12.814 1.825 -42.503 1.00 0.00 H new ATOM 0 HD2 LYS A 120 10.068 2.273 -42.769 1.00 0.00 H new ATOM 0 HD3 LYS A 120 10.773 3.605 -43.663 1.00 0.00 H new ATOM 0 HE2 LYS A 120 10.630 1.935 -45.296 1.00 0.00 H new ATOM 0 HE3 LYS A 120 12.295 1.795 -44.767 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 11.237 -0.365 -44.910 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 11.647 -0.027 -43.297 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 10.034 0.109 -43.809 1.00 0.00 H new ATOM 1826 N GLY A 121 13.580 2.840 -38.356 1.00 0.00 N ATOM 1827 CA GLY A 121 14.748 3.451 -37.738 1.00 0.00 C ATOM 1828 C GLY A 121 15.653 2.439 -37.051 1.00 0.00 C ATOM 1829 O GLY A 121 16.871 2.469 -37.235 1.00 0.00 O ATOM 0 H GLY A 121 12.701 3.019 -37.871 1.00 0.00 H new ATOM 0 HA2 GLY A 121 15.319 3.983 -38.499 1.00 0.00 H new ATOM 0 HA3 GLY A 121 14.421 4.192 -37.009 1.00 0.00 H new ATOM 1833 N VAL A 122 15.058 1.544 -36.259 1.00 0.00 N ATOM 1834 CA VAL A 122 15.819 0.520 -35.544 1.00 0.00 C ATOM 1835 C VAL A 122 16.019 -0.722 -36.413 1.00 0.00 C ATOM 1836 O VAL A 122 15.048 -1.374 -36.796 1.00 0.00 O ATOM 1837 CB VAL A 122 15.113 0.100 -34.234 1.00 0.00 C ATOM 1838 CG1 VAL A 122 16.034 -0.758 -33.382 1.00 0.00 C ATOM 1839 CG2 VAL A 122 14.639 1.318 -33.453 1.00 0.00 C ATOM 0 H VAL A 122 14.051 1.509 -36.097 1.00 0.00 H new ATOM 0 HA VAL A 122 16.787 0.959 -35.304 1.00 0.00 H new ATOM 0 HB VAL A 122 14.236 -0.492 -34.498 1.00 0.00 H new ATOM 0 HG11 VAL A 122 15.520 -1.044 -32.464 1.00 0.00 H new ATOM 0 HG12 VAL A 122 16.312 -1.654 -33.936 1.00 0.00 H new ATOM 0 HG13 VAL A 122 16.932 -0.192 -33.133 1.00 0.00 H new ATOM 0 HG21 VAL A 122 14.146 0.993 -32.537 1.00 0.00 H new ATOM 0 HG22 VAL A 122 15.495 1.945 -33.202 1.00 0.00 H new ATOM 0 HG23 VAL A 122 13.936 1.889 -34.060 1.00 0.00 H new ATOM 1849 N PRO A 123 17.283 -1.074 -36.733 1.00 0.00 N ATOM 1850 CA PRO A 123 17.589 -2.250 -37.558 1.00 0.00 C ATOM 1851 C PRO A 123 17.416 -3.566 -36.790 1.00 0.00 C ATOM 1852 O PRO A 123 18.383 -4.299 -36.559 1.00 0.00 O ATOM 1853 CB PRO A 123 19.046 -2.027 -37.954 1.00 0.00 C ATOM 1854 CG PRO A 123 19.624 -1.228 -36.838 1.00 0.00 C ATOM 1855 CD PRO A 123 18.509 -0.359 -36.318 1.00 0.00 C ATOM 0 HA PRO A 123 16.916 -2.344 -38.411 1.00 0.00 H new ATOM 0 HB2 PRO A 123 19.572 -2.974 -38.077 1.00 0.00 H new ATOM 0 HB3 PRO A 123 19.121 -1.495 -38.902 1.00 0.00 H new ATOM 0 HG2 PRO A 123 20.008 -1.879 -36.052 1.00 0.00 H new ATOM 0 HG3 PRO A 123 20.460 -0.621 -37.187 1.00 0.00 H new ATOM 0 HD2 PRO A 123 18.560 -0.248 -35.235 1.00 0.00 H new ATOM 0 HD3 PRO A 123 18.551 0.644 -36.744 1.00 0.00 H new ATOM 1863 N VAL A 124 16.175 -3.856 -36.393 1.00 0.00 N ATOM 1864 CA VAL A 124 15.858 -5.074 -35.648 1.00 0.00 C ATOM 1865 C VAL A 124 14.656 -5.801 -36.261 1.00 0.00 C ATOM 1866 O VAL A 124 14.105 -5.363 -37.274 1.00 0.00 O ATOM 1867 CB VAL A 124 15.560 -4.764 -34.162 1.00 0.00 C ATOM 1868 CG1 VAL A 124 16.823 -4.312 -33.441 1.00 0.00 C ATOM 1869 CG2 VAL A 124 14.461 -3.716 -34.031 1.00 0.00 C ATOM 0 H VAL A 124 15.369 -3.259 -36.577 1.00 0.00 H new ATOM 0 HA VAL A 124 16.735 -5.719 -35.707 1.00 0.00 H new ATOM 0 HB VAL A 124 15.208 -5.682 -33.692 1.00 0.00 H new ATOM 0 HG11 VAL A 124 16.590 -4.099 -32.398 1.00 0.00 H new ATOM 0 HG12 VAL A 124 17.573 -5.101 -33.492 1.00 0.00 H new ATOM 0 HG13 VAL A 124 17.211 -3.411 -33.917 1.00 0.00 H new ATOM 0 HG21 VAL A 124 14.272 -3.517 -32.976 1.00 0.00 H new ATOM 0 HG22 VAL A 124 14.775 -2.796 -34.523 1.00 0.00 H new ATOM 0 HG23 VAL A 124 13.549 -4.085 -34.500 1.00 0.00 H new ATOM 1879 N LYS A 125 14.252 -6.912 -35.637 1.00 0.00 N ATOM 1880 CA LYS A 125 13.115 -7.697 -36.116 1.00 0.00 C ATOM 1881 C LYS A 125 12.015 -7.751 -35.059 1.00 0.00 C ATOM 1882 O LYS A 125 12.291 -7.945 -33.873 1.00 0.00 O ATOM 1883 CB LYS A 125 13.558 -9.117 -36.486 1.00 0.00 C ATOM 1884 CG LYS A 125 14.606 -9.169 -37.590 1.00 0.00 C ATOM 1885 CD LYS A 125 16.003 -9.375 -37.023 1.00 0.00 C ATOM 1886 CE LYS A 125 16.971 -9.874 -38.085 1.00 0.00 C ATOM 1887 NZ LYS A 125 18.199 -10.468 -37.487 1.00 0.00 N ATOM 0 H LYS A 125 14.697 -7.286 -34.799 1.00 0.00 H new ATOM 0 HA LYS A 125 12.719 -7.210 -37.007 1.00 0.00 H new ATOM 0 HB2 LYS A 125 13.957 -9.606 -35.597 1.00 0.00 H new ATOM 0 HB3 LYS A 125 12.685 -9.689 -36.800 1.00 0.00 H new ATOM 0 HG2 LYS A 125 14.369 -9.979 -38.280 1.00 0.00 H new ATOM 0 HG3 LYS A 125 14.578 -8.243 -38.164 1.00 0.00 H new ATOM 0 HD2 LYS A 125 16.370 -8.436 -36.608 1.00 0.00 H new ATOM 0 HD3 LYS A 125 15.961 -10.091 -36.203 1.00 0.00 H new ATOM 0 HE2 LYS A 125 16.474 -10.619 -38.707 1.00 0.00 H new ATOM 0 HE3 LYS A 125 17.250 -9.047 -38.739 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 18.831 -10.795 -38.245 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 18.688 -9.751 -36.914 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 17.937 -11.273 -36.884 1.00 0.00 H new ATOM 1901 N ASP A 126 10.768 -7.558 -35.501 1.00 0.00 N ATOM 1902 CA ASP A 126 9.606 -7.561 -34.606 1.00 0.00 C ATOM 1903 C ASP A 126 9.659 -6.397 -33.606 1.00 0.00 C ATOM 1904 O ASP A 126 8.958 -6.415 -32.594 1.00 0.00 O ATOM 1905 CB ASP A 126 9.500 -8.897 -33.857 1.00 0.00 C ATOM 1906 CG ASP A 126 8.060 -9.329 -33.647 1.00 0.00 C ATOM 1907 OD1 ASP A 126 7.437 -8.875 -32.663 1.00 0.00 O ATOM 1908 OD2 ASP A 126 7.553 -10.121 -34.469 1.00 0.00 O ATOM 0 H ASP A 126 10.537 -7.397 -36.481 1.00 0.00 H new ATOM 0 HA ASP A 126 8.718 -7.432 -35.226 1.00 0.00 H new ATOM 0 HB2 ASP A 126 10.030 -9.668 -34.417 1.00 0.00 H new ATOM 0 HB3 ASP A 126 9.995 -8.809 -32.890 1.00 0.00 H new ATOM 1913 N GLY A 127 10.485 -5.383 -33.897 1.00 0.00 N ATOM 1914 CA GLY A 127 10.601 -4.231 -33.017 1.00 0.00 C ATOM 1915 C GLY A 127 11.104 -4.592 -31.631 1.00 0.00 C ATOM 1916 O GLY A 127 10.383 -4.425 -30.648 1.00 0.00 O ATOM 0 H GLY A 127 11.074 -5.344 -34.729 1.00 0.00 H new ATOM 0 HA2 GLY A 127 11.279 -3.505 -33.466 1.00 0.00 H new ATOM 0 HA3 GLY A 127 9.628 -3.748 -32.930 1.00 0.00 H new ATOM 1920 N MET A 128 12.339 -5.087 -31.551 1.00 0.00 N ATOM 1921 CA MET A 128 12.924 -5.468 -30.270 1.00 0.00 C ATOM 1922 C MET A 128 14.062 -4.528 -29.886 1.00 0.00 C ATOM 1923 O MET A 128 15.084 -4.447 -30.572 1.00 0.00 O ATOM 1924 CB MET A 128 13.394 -6.933 -30.314 1.00 0.00 C ATOM 1925 CG MET A 128 14.723 -7.199 -29.624 1.00 0.00 C ATOM 1926 SD MET A 128 15.144 -8.952 -29.584 1.00 0.00 S ATOM 1927 CE MET A 128 16.913 -8.890 -29.856 1.00 0.00 C ATOM 0 H MET A 128 12.950 -5.232 -32.355 1.00 0.00 H new ATOM 0 HA MET A 128 12.158 -5.381 -29.499 1.00 0.00 H new ATOM 0 HB2 MET A 128 12.630 -7.559 -29.853 1.00 0.00 H new ATOM 0 HB3 MET A 128 13.474 -7.243 -31.356 1.00 0.00 H new ATOM 0 HG2 MET A 128 15.512 -6.651 -30.139 1.00 0.00 H new ATOM 0 HG3 MET A 128 14.682 -6.815 -28.605 1.00 0.00 H new ATOM 0 HE1 MET A 128 17.317 -9.903 -29.857 1.00 0.00 H new ATOM 0 HE2 MET A 128 17.117 -8.417 -30.816 1.00 0.00 H new ATOM 0 HE3 MET A 128 17.384 -8.313 -29.060 1.00 0.00 H new ATOM 1937 N VAL A 129 13.864 -3.820 -28.776 1.00 0.00 N ATOM 1938 CA VAL A 129 14.855 -2.877 -28.268 1.00 0.00 C ATOM 1939 C VAL A 129 14.913 -2.911 -26.729 1.00 0.00 C ATOM 1940 O VAL A 129 15.289 -1.928 -26.085 1.00 0.00 O ATOM 1941 CB VAL A 129 14.552 -1.441 -28.752 1.00 0.00 C ATOM 1942 CG1 VAL A 129 15.654 -0.486 -28.325 1.00 0.00 C ATOM 1943 CG2 VAL A 129 14.370 -1.401 -30.264 1.00 0.00 C ATOM 0 H VAL A 129 13.019 -3.883 -28.208 1.00 0.00 H new ATOM 0 HA VAL A 129 15.826 -3.180 -28.660 1.00 0.00 H new ATOM 0 HB VAL A 129 13.619 -1.122 -28.288 1.00 0.00 H new ATOM 0 HG11 VAL A 129 15.421 0.519 -28.676 1.00 0.00 H new ATOM 0 HG12 VAL A 129 15.731 -0.482 -27.238 1.00 0.00 H new ATOM 0 HG13 VAL A 129 16.602 -0.809 -28.755 1.00 0.00 H new ATOM 0 HG21 VAL A 129 14.158 -0.379 -30.578 1.00 0.00 H new ATOM 0 HG22 VAL A 129 15.282 -1.748 -30.750 1.00 0.00 H new ATOM 0 HG23 VAL A 129 13.540 -2.047 -30.548 1.00 0.00 H new ATOM 1953 N ASN A 130 14.540 -4.057 -26.145 1.00 0.00 N ATOM 1954 CA ASN A 130 14.550 -4.235 -24.690 1.00 0.00 C ATOM 1955 C ASN A 130 13.595 -3.259 -23.987 1.00 0.00 C ATOM 1956 O ASN A 130 13.800 -2.918 -22.818 1.00 0.00 O ATOM 1957 CB ASN A 130 15.975 -4.053 -24.154 1.00 0.00 C ATOM 1958 CG ASN A 130 16.189 -4.703 -22.794 1.00 0.00 C ATOM 1959 OD1 ASN A 130 15.304 -5.376 -22.265 1.00 0.00 O ATOM 1960 ND2 ASN A 130 17.367 -4.499 -22.217 1.00 0.00 N ATOM 0 H ASN A 130 14.226 -4.878 -26.663 1.00 0.00 H new ATOM 0 HA ASN A 130 14.203 -5.246 -24.476 1.00 0.00 H new ATOM 0 HB2 ASN A 130 16.682 -4.476 -24.868 1.00 0.00 H new ATOM 0 HB3 ASN A 130 16.196 -2.988 -24.080 1.00 0.00 H new ATOM 0 HD21 ASN A 130 17.564 -4.906 -21.303 1.00 0.00 H new ATOM 0 HD22 ASN A 130 18.075 -3.935 -22.688 1.00 0.00 H new ATOM 1967 N TYR A 131 12.552 -2.816 -24.702 1.00 0.00 N ATOM 1968 CA TYR A 131 11.568 -1.882 -24.150 1.00 0.00 C ATOM 1969 C TYR A 131 12.245 -0.711 -23.424 1.00 0.00 C ATOM 1970 O TYR A 131 11.846 -0.339 -22.317 1.00 0.00 O ATOM 1971 CB TYR A 131 10.615 -2.616 -23.200 1.00 0.00 C ATOM 1972 CG TYR A 131 9.224 -2.027 -23.183 1.00 0.00 C ATOM 1973 CD1 TYR A 131 8.556 -1.754 -24.368 1.00 0.00 C ATOM 1974 CD2 TYR A 131 8.584 -1.737 -21.986 1.00 0.00 C ATOM 1975 CE1 TYR A 131 7.289 -1.211 -24.364 1.00 0.00 C ATOM 1976 CE2 TYR A 131 7.313 -1.195 -21.972 1.00 0.00 C ATOM 1977 CZ TYR A 131 6.670 -0.931 -23.164 1.00 0.00 C ATOM 1978 OH TYR A 131 5.405 -0.391 -23.156 1.00 0.00 O ATOM 0 H TYR A 131 12.370 -3.092 -25.667 1.00 0.00 H new ATOM 0 HA TYR A 131 10.997 -1.471 -24.982 1.00 0.00 H new ATOM 0 HB2 TYR A 131 10.556 -3.664 -23.493 1.00 0.00 H new ATOM 0 HB3 TYR A 131 11.026 -2.590 -22.191 1.00 0.00 H new ATOM 0 HD1 TYR A 131 9.037 -1.971 -25.310 1.00 0.00 H new ATOM 0 HD2 TYR A 131 9.087 -1.938 -21.052 1.00 0.00 H new ATOM 0 HE1 TYR A 131 6.784 -1.006 -25.296 1.00 0.00 H new ATOM 0 HE2 TYR A 131 6.825 -0.979 -21.033 1.00 0.00 H new ATOM 0 HH TYR A 131 5.113 -0.255 -22.230 1.00 0.00 H new ATOM 1988 N HIS A 132 13.272 -0.138 -24.055 1.00 0.00 N ATOM 1989 CA HIS A 132 14.006 0.982 -23.468 1.00 0.00 C ATOM 1990 C HIS A 132 13.925 2.224 -24.352 1.00 0.00 C ATOM 1991 O HIS A 132 13.506 3.286 -23.896 1.00 0.00 O ATOM 1992 CB HIS A 132 15.471 0.598 -23.236 1.00 0.00 C ATOM 1993 CG HIS A 132 16.216 1.575 -22.378 1.00 0.00 C ATOM 1994 ND1 HIS A 132 16.911 2.625 -22.926 1.00 0.00 N ATOM 1995 CD2 HIS A 132 16.332 1.621 -21.029 1.00 0.00 C ATOM 1996 CE1 HIS A 132 17.431 3.284 -21.906 1.00 0.00 C ATOM 1997 NE2 HIS A 132 17.108 2.712 -20.737 1.00 0.00 N ATOM 0 H HIS A 132 13.613 -0.431 -24.971 1.00 0.00 H new ATOM 0 HA HIS A 132 13.542 1.217 -22.510 1.00 0.00 H new ATOM 0 HB2 HIS A 132 15.511 -0.387 -22.770 1.00 0.00 H new ATOM 0 HB3 HIS A 132 15.974 0.516 -24.200 1.00 0.00 H new ATOM 0 HD2 HIS A 132 15.897 0.931 -20.321 1.00 0.00 H new ATOM 0 HE1 HIS A 132 18.039 4.171 -22.002 1.00 0.00 H new ATOM 0 HE2 HIS A 132 17.387 3.028 -19.808 1.00 0.00 H new ATOM 2005 N ASP A 133 14.339 2.085 -25.613 1.00 0.00 N ATOM 2006 CA ASP A 133 14.325 3.202 -26.564 1.00 0.00 C ATOM 2007 C ASP A 133 12.913 3.751 -26.783 1.00 0.00 C ATOM 2008 O ASP A 133 12.737 4.956 -26.978 1.00 0.00 O ATOM 2009 CB ASP A 133 14.928 2.770 -27.902 1.00 0.00 C ATOM 2010 CG ASP A 133 16.443 2.843 -27.904 1.00 0.00 C ATOM 2011 OD1 ASP A 133 17.077 2.097 -27.126 1.00 0.00 O ATOM 2012 OD2 ASP A 133 16.997 3.645 -28.683 1.00 0.00 O ATOM 0 H ASP A 133 14.689 1.209 -26.001 1.00 0.00 H new ATOM 0 HA ASP A 133 14.929 4.000 -26.134 1.00 0.00 H new ATOM 0 HB2 ASP A 133 14.616 1.750 -28.126 1.00 0.00 H new ATOM 0 HB3 ASP A 133 14.535 3.405 -28.696 1.00 0.00 H new ATOM 2017 N PHE A 134 11.909 2.869 -26.745 1.00 0.00 N ATOM 2018 CA PHE A 134 10.517 3.283 -26.935 1.00 0.00 C ATOM 2019 C PHE A 134 10.055 4.142 -25.759 1.00 0.00 C ATOM 2020 O PHE A 134 9.603 5.274 -25.945 1.00 0.00 O ATOM 2021 CB PHE A 134 9.585 2.071 -27.087 1.00 0.00 C ATOM 2022 CG PHE A 134 10.188 0.897 -27.814 1.00 0.00 C ATOM 2023 CD1 PHE A 134 10.525 0.983 -29.157 1.00 0.00 C ATOM 2024 CD2 PHE A 134 10.408 -0.299 -27.149 1.00 0.00 C ATOM 2025 CE1 PHE A 134 11.069 -0.102 -29.819 1.00 0.00 C ATOM 2026 CE2 PHE A 134 10.954 -1.384 -27.805 1.00 0.00 C ATOM 2027 CZ PHE A 134 11.283 -1.287 -29.141 1.00 0.00 C ATOM 0 H PHE A 134 12.034 1.869 -26.585 1.00 0.00 H new ATOM 0 HA PHE A 134 10.469 3.868 -27.854 1.00 0.00 H new ATOM 0 HB2 PHE A 134 9.272 1.744 -26.095 1.00 0.00 H new ATOM 0 HB3 PHE A 134 8.686 2.386 -27.617 1.00 0.00 H new ATOM 0 HD1 PHE A 134 10.361 1.907 -29.691 1.00 0.00 H new ATOM 0 HD2 PHE A 134 10.149 -0.383 -26.104 1.00 0.00 H new ATOM 0 HE1 PHE A 134 11.326 -0.024 -30.865 1.00 0.00 H new ATOM 0 HE2 PHE A 134 11.123 -2.308 -27.272 1.00 0.00 H new ATOM 0 HZ PHE A 134 11.707 -2.136 -29.656 1.00 0.00 H new ATOM 2037 N VAL A 135 10.187 3.594 -24.547 1.00 0.00 N ATOM 2038 CA VAL A 135 9.801 4.303 -23.326 1.00 0.00 C ATOM 2039 C VAL A 135 10.647 5.567 -23.133 1.00 0.00 C ATOM 2040 O VAL A 135 10.158 6.576 -22.623 1.00 0.00 O ATOM 2041 CB VAL A 135 9.938 3.405 -22.074 1.00 0.00 C ATOM 2042 CG1 VAL A 135 9.338 4.090 -20.852 1.00 0.00 C ATOM 2043 CG2 VAL A 135 9.283 2.049 -22.306 1.00 0.00 C ATOM 0 H VAL A 135 10.560 2.658 -24.387 1.00 0.00 H new ATOM 0 HA VAL A 135 8.754 4.582 -23.443 1.00 0.00 H new ATOM 0 HB VAL A 135 11.000 3.242 -21.888 1.00 0.00 H new ATOM 0 HG11 VAL A 135 9.445 3.442 -19.982 1.00 0.00 H new ATOM 0 HG12 VAL A 135 9.859 5.030 -20.670 1.00 0.00 H new ATOM 0 HG13 VAL A 135 8.281 4.289 -21.029 1.00 0.00 H new ATOM 0 HG21 VAL A 135 9.392 1.435 -21.412 1.00 0.00 H new ATOM 0 HG22 VAL A 135 8.224 2.189 -22.523 1.00 0.00 H new ATOM 0 HG23 VAL A 135 9.764 1.552 -23.149 1.00 0.00 H new ATOM 2053 N GLN A 136 11.917 5.500 -23.552 1.00 0.00 N ATOM 2054 CA GLN A 136 12.837 6.634 -23.437 1.00 0.00 C ATOM 2055 C GLN A 136 12.303 7.842 -24.206 1.00 0.00 C ATOM 2056 O GLN A 136 12.196 8.938 -23.655 1.00 0.00 O ATOM 2057 CB GLN A 136 14.225 6.248 -23.961 1.00 0.00 C ATOM 2058 CG GLN A 136 15.261 7.353 -23.824 1.00 0.00 C ATOM 2059 CD GLN A 136 16.639 6.923 -24.295 1.00 0.00 C ATOM 2060 OE1 GLN A 136 17.450 6.433 -23.510 1.00 0.00 O ATOM 2061 NE2 GLN A 136 16.912 7.104 -25.584 1.00 0.00 N ATOM 0 H GLN A 136 12.330 4.669 -23.975 1.00 0.00 H new ATOM 0 HA GLN A 136 12.919 6.903 -22.384 1.00 0.00 H new ATOM 0 HB2 GLN A 136 14.574 5.367 -23.423 1.00 0.00 H new ATOM 0 HB3 GLN A 136 14.142 5.969 -25.011 1.00 0.00 H new ATOM 0 HG2 GLN A 136 14.939 8.221 -24.399 1.00 0.00 H new ATOM 0 HG3 GLN A 136 15.318 7.665 -22.781 1.00 0.00 H new ATOM 0 HE21 GLN A 136 16.211 7.514 -26.201 1.00 0.00 H new ATOM 0 HE22 GLN A 136 17.822 6.833 -25.955 1.00 0.00 H new ATOM 2070 N MET A 137 11.958 7.624 -25.477 1.00 0.00 N ATOM 2071 CA MET A 137 11.419 8.686 -26.325 1.00 0.00 C ATOM 2072 C MET A 137 10.050 9.147 -25.818 1.00 0.00 C ATOM 2073 O MET A 137 9.709 10.327 -25.920 1.00 0.00 O ATOM 2074 CB MET A 137 11.310 8.197 -27.772 1.00 0.00 C ATOM 2075 CG MET A 137 10.902 9.279 -28.761 1.00 0.00 C ATOM 2076 SD MET A 137 9.626 8.729 -29.911 1.00 0.00 S ATOM 2077 CE MET A 137 8.284 8.351 -28.786 1.00 0.00 C ATOM 0 H MET A 137 12.043 6.720 -25.941 1.00 0.00 H new ATOM 0 HA MET A 137 12.100 9.536 -26.286 1.00 0.00 H new ATOM 0 HB2 MET A 137 12.271 7.783 -28.078 1.00 0.00 H new ATOM 0 HB3 MET A 137 10.584 7.385 -27.817 1.00 0.00 H new ATOM 0 HG2 MET A 137 10.540 10.149 -28.212 1.00 0.00 H new ATOM 0 HG3 MET A 137 11.779 9.600 -29.324 1.00 0.00 H new ATOM 0 HE1 MET A 137 7.336 8.397 -29.322 1.00 0.00 H new ATOM 0 HE2 MET A 137 8.422 7.350 -28.378 1.00 0.00 H new ATOM 0 HE3 MET A 137 8.276 9.076 -27.972 1.00 0.00 H new