USER MOD reduce.3.24.130724 H: found=0, std=0, add=1057, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 1057 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 100 MET CE :methyl -166:sc= -0.477 (180deg=-0.768) USER MOD Set 1.2: A 108 THR OG1 : rot 80:sc= 1.2 USER MOD Set 2.1: A 19 TYR OH : rot 13:sc= 0.163 USER MOD Set 2.2: A 102 THR OG1 : rot -81:sc= 1.09 USER MOD Set 3.1: A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 3.2: A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 GLN : amide:sc= -0.0284 K(o=-0.028,f=-1.1) USER MOD Single : A 9 HIS : no HD1:sc= -0.0167 X(o=-0.017,f=-0.022) USER MOD Single : A 13 THR OG1 : rot 180:sc= 0 USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 TYR OH : rot 180:sc= 0 USER MOD Single : A 29 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 30 SER OG : rot 65:sc= 1.6 USER MOD Single : A 31 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 32 GLN : amide:sc= -1.1 K(o=-1.1,f=-6.7!) USER MOD Single : A 34 SER OG : rot -95:sc= 1.12 USER MOD Single : A 48 THR OG1 : rot 180:sc= 0.0332 USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 GLN : amide:sc= -2.16 K(o=-2.2,f=0) USER MOD Single : A 56 TYR OH : rot 180:sc= 0 USER MOD Single : A 57 SER OG : rot 174:sc= 0.888 USER MOD Single : A 59 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 64 ASN : amide:sc= -1.16! K(o=-1.2!,f=-0.38) USER MOD Single : A 66 ASN : amide:sc= 0 X(o=0,f=-0.017) USER MOD Single : A 70 THR OG1 : rot 29:sc= 0.89 USER MOD Single : A 75 THR OG1 : rot 106:sc= 0.92 USER MOD Single : A 85 GLN : amide:sc= -0.619 K(o=-0.62,f=0) USER MOD Single : A 94 ASN : amide:sc= 0 K(o=0,f=-0.85) USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 101 GLN : amide:sc= 1.1 K(o=1.1,f=-0.0083) USER MOD Single : A 109 TYR OH : rot 180:sc= 0 USER MOD Single : A 110 ASN : amide:sc= -0.0859 K(o=-0.086,f=-1!) USER MOD Single : A 112 MET CE :methyl -163:sc= -0.0901 (180deg=-0.526) USER MOD Single : A 130 HIS : no HE2:sc= 1.05 K(o=1,f=-5.2!) USER MOD Single : A 131 HIS : no HD1:sc= 0 X(o=0,f=-0.0019) USER MOD Single : A 132 HIS : no HD1:sc= -0.0367 X(o=-0.037,f=-0.3) USER MOD Single : A 133 HIS : no HD1:sc= -0.0417 K(o=-0.042,f=-0.79) USER MOD Single : A 134 HIS : no HD1:sc= -0.0292 X(o=-0.029,f=-0.0096) USER MOD Single : A 135 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -30.777 1.069 -20.334 1.00 0.00 N ATOM 2 CA MET A 1 -30.018 2.303 -20.032 1.00 0.00 C ATOM 3 C MET A 1 -30.929 3.522 -20.127 1.00 0.00 C ATOM 4 O MET A 1 -31.622 3.712 -21.127 1.00 0.00 O ATOM 5 CB MET A 1 -28.827 2.429 -20.997 1.00 0.00 C ATOM 6 CG MET A 1 -28.029 3.721 -20.860 1.00 0.00 C ATOM 7 SD MET A 1 -28.741 5.092 -21.794 1.00 0.00 S ATOM 8 CE MET A 1 -27.565 6.396 -21.436 1.00 0.00 C ATOM 0 H1 MET A 1 -30.144 0.247 -20.266 1.00 0.00 H new ATOM 0 H2 MET A 1 -31.555 0.965 -19.652 1.00 0.00 H new ATOM 0 H3 MET A 1 -31.166 1.127 -21.297 1.00 0.00 H new ATOM 0 HA MET A 1 -29.635 2.249 -19.013 1.00 0.00 H new ATOM 0 HB2 MET A 1 -28.156 1.585 -20.836 1.00 0.00 H new ATOM 0 HB3 MET A 1 -29.196 2.353 -22.020 1.00 0.00 H new ATOM 0 HG2 MET A 1 -27.972 3.997 -19.807 1.00 0.00 H new ATOM 0 HG3 MET A 1 -27.008 3.549 -21.200 1.00 0.00 H new ATOM 0 HE1 MET A 1 -27.870 7.311 -21.945 1.00 0.00 H new ATOM 0 HE2 MET A 1 -27.533 6.572 -20.361 1.00 0.00 H new ATOM 0 HE3 MET A 1 -26.576 6.100 -21.785 1.00 0.00 H new ATOM 20 N ALA A 2 -30.938 4.332 -19.078 1.00 0.00 N ATOM 21 CA ALA A 2 -31.732 5.551 -19.059 1.00 0.00 C ATOM 22 C ALA A 2 -30.834 6.767 -19.237 1.00 0.00 C ATOM 23 O ALA A 2 -29.655 6.730 -18.876 1.00 0.00 O ATOM 24 CB ALA A 2 -32.518 5.656 -17.763 1.00 0.00 C ATOM 0 H ALA A 2 -30.402 4.166 -18.226 1.00 0.00 H new ATOM 0 HA ALA A 2 -32.440 5.516 -19.887 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -33.106 6.574 -17.767 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -33.185 4.799 -17.671 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -31.828 5.671 -16.919 1.00 0.00 H new ATOM 30 N GLN A 3 -31.396 7.845 -19.775 1.00 0.00 N ATOM 31 CA GLN A 3 -30.621 9.049 -20.067 1.00 0.00 C ATOM 32 C GLN A 3 -30.093 9.699 -18.793 1.00 0.00 C ATOM 33 O GLN A 3 -29.142 10.484 -18.836 1.00 0.00 O ATOM 34 CB GLN A 3 -31.462 10.067 -20.838 1.00 0.00 C ATOM 35 CG GLN A 3 -32.661 10.578 -20.058 1.00 0.00 C ATOM 36 CD GLN A 3 -33.262 11.828 -20.661 1.00 0.00 C ATOM 37 OE1 GLN A 3 -32.557 12.650 -21.255 1.00 0.00 O ATOM 38 NE2 GLN A 3 -34.566 11.979 -20.522 1.00 0.00 N ATOM 0 H GLN A 3 -32.384 7.911 -20.018 1.00 0.00 H new ATOM 0 HA GLN A 3 -29.774 8.740 -20.680 1.00 0.00 H new ATOM 0 HB2 GLN A 3 -30.832 10.912 -21.115 1.00 0.00 H new ATOM 0 HB3 GLN A 3 -31.809 9.611 -21.765 1.00 0.00 H new ATOM 0 HG2 GLN A 3 -33.421 9.798 -20.017 1.00 0.00 H new ATOM 0 HG3 GLN A 3 -32.360 10.784 -19.031 1.00 0.00 H new ATOM 0 HE21 GLN A 3 -35.111 11.275 -20.024 1.00 0.00 H new ATOM 0 HE22 GLN A 3 -35.029 12.799 -20.913 1.00 0.00 H new ATOM 47 N ARG A 4 -30.708 9.381 -17.660 1.00 0.00 N ATOM 48 CA ARG A 4 -30.293 9.957 -16.392 1.00 0.00 C ATOM 49 C ARG A 4 -29.017 9.285 -15.892 1.00 0.00 C ATOM 50 O ARG A 4 -29.036 8.513 -14.934 1.00 0.00 O ATOM 51 CB ARG A 4 -31.397 9.838 -15.338 1.00 0.00 C ATOM 52 CG ARG A 4 -31.137 10.684 -14.098 1.00 0.00 C ATOM 53 CD ARG A 4 -32.093 10.344 -12.966 1.00 0.00 C ATOM 54 NE ARG A 4 -31.895 8.982 -12.471 1.00 0.00 N ATOM 55 CZ ARG A 4 -31.275 8.687 -11.324 1.00 0.00 C ATOM 56 NH1 ARG A 4 -30.764 9.653 -10.570 1.00 0.00 N ATOM 57 NH2 ARG A 4 -31.157 7.427 -10.930 1.00 0.00 N ATOM 0 H ARG A 4 -31.491 8.731 -17.596 1.00 0.00 H new ATOM 0 HA ARG A 4 -30.095 11.016 -16.558 1.00 0.00 H new ATOM 0 HB2 ARG A 4 -32.347 10.137 -15.781 1.00 0.00 H new ATOM 0 HB3 ARG A 4 -31.497 8.794 -15.043 1.00 0.00 H new ATOM 0 HG2 ARG A 4 -30.111 10.532 -13.764 1.00 0.00 H new ATOM 0 HG3 ARG A 4 -31.236 11.739 -14.352 1.00 0.00 H new ATOM 0 HD2 ARG A 4 -31.952 11.051 -12.148 1.00 0.00 H new ATOM 0 HD3 ARG A 4 -33.120 10.458 -13.313 1.00 0.00 H new ATOM 0 HE ARG A 4 -32.252 8.211 -13.035 1.00 0.00 H new ATOM 0 HH11 ARG A 4 -30.843 10.626 -10.865 1.00 0.00 H new ATOM 0 HH12 ARG A 4 -30.292 9.422 -9.696 1.00 0.00 H new ATOM 0 HH21 ARG A 4 -31.540 6.675 -11.503 1.00 0.00 H new ATOM 0 HH22 ARG A 4 -30.683 7.209 -10.054 1.00 0.00 H new ATOM 71 N SER A 5 -27.924 9.541 -16.586 1.00 0.00 N ATOM 72 CA SER A 5 -26.618 9.084 -16.155 1.00 0.00 C ATOM 73 C SER A 5 -25.872 10.245 -15.514 1.00 0.00 C ATOM 74 O SER A 5 -25.477 10.176 -14.349 1.00 0.00 O ATOM 75 CB SER A 5 -25.832 8.546 -17.352 1.00 0.00 C ATOM 76 OG SER A 5 -26.606 7.617 -18.094 1.00 0.00 O ATOM 0 H SER A 5 -27.917 10.068 -17.459 1.00 0.00 H new ATOM 0 HA SER A 5 -26.732 8.281 -15.427 1.00 0.00 H new ATOM 0 HB2 SER A 5 -25.534 9.373 -17.997 1.00 0.00 H new ATOM 0 HB3 SER A 5 -24.917 8.066 -17.005 1.00 0.00 H new ATOM 0 HG SER A 5 -26.082 7.289 -18.855 1.00 0.00 H new ATOM 82 N GLU A 6 -25.726 11.318 -16.299 1.00 0.00 N ATOM 83 CA GLU A 6 -25.065 12.551 -15.878 1.00 0.00 C ATOM 84 C GLU A 6 -23.565 12.345 -15.688 1.00 0.00 C ATOM 85 O GLU A 6 -23.134 11.409 -15.012 1.00 0.00 O ATOM 86 CB GLU A 6 -25.702 13.123 -14.609 1.00 0.00 C ATOM 87 CG GLU A 6 -25.272 14.549 -14.321 1.00 0.00 C ATOM 88 CD GLU A 6 -25.436 15.444 -15.533 1.00 0.00 C ATOM 89 OE1 GLU A 6 -26.577 15.842 -15.834 1.00 0.00 O ATOM 90 OE2 GLU A 6 -24.418 15.742 -16.200 1.00 0.00 O ATOM 0 H GLU A 6 -26.070 11.351 -17.259 1.00 0.00 H new ATOM 0 HA GLU A 6 -25.203 13.279 -16.678 1.00 0.00 H new ATOM 0 HB2 GLU A 6 -26.787 13.089 -14.707 1.00 0.00 H new ATOM 0 HB3 GLU A 6 -25.439 12.492 -13.760 1.00 0.00 H new ATOM 0 HG2 GLU A 6 -25.861 14.946 -13.494 1.00 0.00 H new ATOM 0 HG3 GLU A 6 -24.230 14.557 -14.002 1.00 0.00 H new ATOM 97 N ILE A 7 -22.785 13.248 -16.281 1.00 0.00 N ATOM 98 CA ILE A 7 -21.326 13.160 -16.280 1.00 0.00 C ATOM 99 C ILE A 7 -20.868 11.924 -17.060 1.00 0.00 C ATOM 100 O ILE A 7 -20.860 10.811 -16.541 1.00 0.00 O ATOM 101 CB ILE A 7 -20.743 13.127 -14.847 1.00 0.00 C ATOM 102 CG1 ILE A 7 -21.347 14.248 -13.995 1.00 0.00 C ATOM 103 CG2 ILE A 7 -19.228 13.267 -14.897 1.00 0.00 C ATOM 104 CD1 ILE A 7 -20.924 14.205 -12.541 1.00 0.00 C ATOM 0 H ILE A 7 -23.148 14.062 -16.776 1.00 0.00 H new ATOM 0 HA ILE A 7 -20.949 14.059 -16.767 1.00 0.00 H new ATOM 0 HB ILE A 7 -20.997 12.170 -14.391 1.00 0.00 H new ATOM 0 HG12 ILE A 7 -21.059 15.210 -14.419 1.00 0.00 H new ATOM 0 HG13 ILE A 7 -22.434 14.188 -14.050 1.00 0.00 H new ATOM 0 HG21 ILE A 7 -18.827 13.243 -13.884 1.00 0.00 H new ATOM 0 HG22 ILE A 7 -18.805 12.445 -15.474 1.00 0.00 H new ATOM 0 HG23 ILE A 7 -18.965 14.214 -15.369 1.00 0.00 H new ATOM 0 HD11 ILE A 7 -21.391 15.029 -12.002 1.00 0.00 H new ATOM 0 HD12 ILE A 7 -21.236 13.259 -12.099 1.00 0.00 H new ATOM 0 HD13 ILE A 7 -19.840 14.296 -12.475 1.00 0.00 H new ATOM 116 N PRO A 8 -20.484 12.112 -18.335 1.00 0.00 N ATOM 117 CA PRO A 8 -20.131 11.011 -19.240 1.00 0.00 C ATOM 118 C PRO A 8 -18.758 10.400 -18.945 1.00 0.00 C ATOM 119 O PRO A 8 -18.235 9.622 -19.744 1.00 0.00 O ATOM 120 CB PRO A 8 -20.125 11.672 -20.633 1.00 0.00 C ATOM 121 CG PRO A 8 -20.646 13.060 -20.434 1.00 0.00 C ATOM 122 CD PRO A 8 -20.367 13.411 -19.003 1.00 0.00 C ATOM 0 HA PRO A 8 -20.832 10.183 -19.140 1.00 0.00 H new ATOM 0 HB2 PRO A 8 -19.119 11.689 -21.052 1.00 0.00 H new ATOM 0 HB3 PRO A 8 -20.751 11.117 -21.331 1.00 0.00 H new ATOM 0 HG2 PRO A 8 -20.155 13.761 -21.109 1.00 0.00 H new ATOM 0 HG3 PRO A 8 -21.714 13.109 -20.646 1.00 0.00 H new ATOM 0 HD2 PRO A 8 -19.375 13.846 -18.877 1.00 0.00 H new ATOM 0 HD3 PRO A 8 -21.084 14.134 -18.614 1.00 0.00 H new ATOM 130 N HIS A 9 -18.187 10.750 -17.802 1.00 0.00 N ATOM 131 CA HIS A 9 -16.861 10.279 -17.419 1.00 0.00 C ATOM 132 C HIS A 9 -16.711 10.293 -15.906 1.00 0.00 C ATOM 133 O HIS A 9 -17.610 10.723 -15.190 1.00 0.00 O ATOM 134 CB HIS A 9 -15.766 11.158 -18.035 1.00 0.00 C ATOM 135 CG HIS A 9 -15.438 10.829 -19.460 1.00 0.00 C ATOM 136 ND1 HIS A 9 -15.524 11.741 -20.486 1.00 0.00 N ATOM 137 CD2 HIS A 9 -14.993 9.681 -20.019 1.00 0.00 C ATOM 138 CE1 HIS A 9 -15.144 11.171 -21.613 1.00 0.00 C ATOM 139 NE2 HIS A 9 -14.814 9.917 -21.360 1.00 0.00 N ATOM 0 H HIS A 9 -18.625 11.365 -17.116 1.00 0.00 H new ATOM 0 HA HIS A 9 -16.752 9.260 -17.791 1.00 0.00 H new ATOM 0 HB2 HIS A 9 -16.079 12.201 -17.978 1.00 0.00 H new ATOM 0 HB3 HIS A 9 -14.861 11.064 -17.435 1.00 0.00 H new ATOM 0 HD2 HIS A 9 -14.811 8.749 -19.505 1.00 0.00 H new ATOM 0 HE1 HIS A 9 -15.109 11.649 -22.581 1.00 0.00 H new ATOM 0 HE2 HIS A 9 -14.482 9.238 -22.045 1.00 0.00 H new ATOM 148 N PHE A 10 -15.572 9.822 -15.428 1.00 0.00 N ATOM 149 CA PHE A 10 -15.236 9.923 -14.019 1.00 0.00 C ATOM 150 C PHE A 10 -13.936 10.700 -13.868 1.00 0.00 C ATOM 151 O PHE A 10 -12.865 10.115 -13.699 1.00 0.00 O ATOM 152 CB PHE A 10 -15.114 8.537 -13.377 1.00 0.00 C ATOM 153 CG PHE A 10 -16.412 7.781 -13.311 1.00 0.00 C ATOM 154 CD1 PHE A 10 -17.341 8.062 -12.322 1.00 0.00 C ATOM 155 CD2 PHE A 10 -16.702 6.789 -14.235 1.00 0.00 C ATOM 156 CE1 PHE A 10 -18.535 7.370 -12.254 1.00 0.00 C ATOM 157 CE2 PHE A 10 -17.895 6.092 -14.172 1.00 0.00 C ATOM 158 CZ PHE A 10 -18.812 6.384 -13.181 1.00 0.00 C ATOM 0 H PHE A 10 -14.861 9.364 -15.999 1.00 0.00 H new ATOM 0 HA PHE A 10 -16.037 10.452 -13.503 1.00 0.00 H new ATOM 0 HB2 PHE A 10 -14.390 7.948 -13.941 1.00 0.00 H new ATOM 0 HB3 PHE A 10 -14.718 8.648 -12.368 1.00 0.00 H new ATOM 0 HD1 PHE A 10 -17.129 8.832 -11.595 1.00 0.00 H new ATOM 0 HD2 PHE A 10 -15.989 6.558 -15.012 1.00 0.00 H new ATOM 0 HE1 PHE A 10 -19.250 7.599 -11.478 1.00 0.00 H new ATOM 0 HE2 PHE A 10 -18.109 5.320 -14.897 1.00 0.00 H new ATOM 0 HZ PHE A 10 -19.745 5.842 -13.131 1.00 0.00 H new ATOM 168 N PRO A 11 -14.006 12.034 -13.962 1.00 0.00 N ATOM 169 CA PRO A 11 -12.836 12.891 -13.980 1.00 0.00 C ATOM 170 C PRO A 11 -12.399 13.339 -12.588 1.00 0.00 C ATOM 171 O PRO A 11 -13.057 14.172 -11.958 1.00 0.00 O ATOM 172 CB PRO A 11 -13.300 14.098 -14.810 1.00 0.00 C ATOM 173 CG PRO A 11 -14.795 13.982 -14.935 1.00 0.00 C ATOM 174 CD PRO A 11 -15.229 12.829 -14.069 1.00 0.00 C ATOM 0 HA PRO A 11 -11.966 12.375 -14.386 1.00 0.00 H new ATOM 0 HB2 PRO A 11 -13.023 15.033 -14.323 1.00 0.00 H new ATOM 0 HB3 PRO A 11 -12.828 14.098 -15.792 1.00 0.00 H new ATOM 0 HG2 PRO A 11 -15.280 14.905 -14.617 1.00 0.00 H new ATOM 0 HG3 PRO A 11 -15.082 13.812 -15.973 1.00 0.00 H new ATOM 0 HD2 PRO A 11 -15.581 13.165 -13.094 1.00 0.00 H new ATOM 0 HD3 PRO A 11 -16.042 12.263 -14.524 1.00 0.00 H new ATOM 182 N ARG A 12 -11.292 12.764 -12.114 1.00 0.00 N ATOM 183 CA ARG A 12 -10.628 13.213 -10.884 1.00 0.00 C ATOM 184 C ARG A 12 -11.516 13.040 -9.658 1.00 0.00 C ATOM 185 O ARG A 12 -11.348 13.738 -8.659 1.00 0.00 O ATOM 186 CB ARG A 12 -10.225 14.685 -11.026 1.00 0.00 C ATOM 187 CG ARG A 12 -9.484 14.972 -12.316 1.00 0.00 C ATOM 188 CD ARG A 12 -9.397 16.459 -12.594 1.00 0.00 C ATOM 189 NE ARG A 12 -8.986 16.709 -13.970 1.00 0.00 N ATOM 190 CZ ARG A 12 -9.827 17.054 -14.940 1.00 0.00 C ATOM 191 NH1 ARG A 12 -11.118 17.227 -14.676 1.00 0.00 N ATOM 192 NH2 ARG A 12 -9.377 17.217 -16.174 1.00 0.00 N ATOM 0 H ARG A 12 -10.830 11.976 -12.569 1.00 0.00 H new ATOM 0 HA ARG A 12 -9.743 12.593 -10.740 1.00 0.00 H new ATOM 0 HB2 ARG A 12 -11.119 15.307 -10.980 1.00 0.00 H new ATOM 0 HB3 ARG A 12 -9.597 14.967 -10.181 1.00 0.00 H new ATOM 0 HG2 ARG A 12 -8.479 14.553 -12.259 1.00 0.00 H new ATOM 0 HG3 ARG A 12 -9.990 14.476 -13.144 1.00 0.00 H new ATOM 0 HD2 ARG A 12 -10.365 16.925 -12.409 1.00 0.00 H new ATOM 0 HD3 ARG A 12 -8.686 16.920 -11.909 1.00 0.00 H new ATOM 0 HE ARG A 12 -7.997 16.614 -14.202 1.00 0.00 H new ATOM 0 HH11 ARG A 12 -11.467 17.095 -13.727 1.00 0.00 H new ATOM 0 HH12 ARG A 12 -11.760 17.492 -15.423 1.00 0.00 H new ATOM 0 HH21 ARG A 12 -8.387 17.078 -16.379 1.00 0.00 H new ATOM 0 HH22 ARG A 12 -10.020 17.482 -16.920 1.00 0.00 H new ATOM 206 N THR A 13 -12.443 12.098 -9.726 1.00 0.00 N ATOM 207 CA THR A 13 -13.337 11.850 -8.614 1.00 0.00 C ATOM 208 C THR A 13 -12.740 10.802 -7.678 1.00 0.00 C ATOM 209 O THR A 13 -12.293 9.738 -8.111 1.00 0.00 O ATOM 210 CB THR A 13 -14.744 11.409 -9.096 1.00 0.00 C ATOM 211 OG1 THR A 13 -15.594 11.136 -7.974 1.00 0.00 O ATOM 212 CG2 THR A 13 -14.669 10.182 -9.993 1.00 0.00 C ATOM 0 H THR A 13 -12.593 11.497 -10.536 1.00 0.00 H new ATOM 0 HA THR A 13 -13.456 12.786 -8.069 1.00 0.00 H new ATOM 0 HB THR A 13 -15.163 12.231 -9.677 1.00 0.00 H new ATOM 0 HG1 THR A 13 -16.479 10.861 -8.293 1.00 0.00 H new ATOM 0 HG21 THR A 13 -15.673 9.902 -10.311 1.00 0.00 H new ATOM 0 HG22 THR A 13 -14.061 10.408 -10.869 1.00 0.00 H new ATOM 0 HG23 THR A 13 -14.219 9.356 -9.442 1.00 0.00 H new ATOM 220 N ALA A 14 -12.698 11.131 -6.395 1.00 0.00 N ATOM 221 CA ALA A 14 -12.146 10.238 -5.396 1.00 0.00 C ATOM 222 C ALA A 14 -13.101 10.099 -4.222 1.00 0.00 C ATOM 223 O ALA A 14 -13.086 10.911 -3.294 1.00 0.00 O ATOM 224 CB ALA A 14 -10.788 10.739 -4.927 1.00 0.00 C ATOM 0 H ALA A 14 -13.043 12.016 -6.023 1.00 0.00 H new ATOM 0 HA ALA A 14 -12.012 9.255 -5.847 1.00 0.00 H new ATOM 0 HB1 ALA A 14 -10.388 10.057 -4.177 1.00 0.00 H new ATOM 0 HB2 ALA A 14 -10.105 10.787 -5.775 1.00 0.00 H new ATOM 0 HB3 ALA A 14 -10.897 11.733 -4.492 1.00 0.00 H new ATOM 230 N ALA A 15 -13.951 9.087 -4.284 1.00 0.00 N ATOM 231 CA ALA A 15 -14.925 8.843 -3.234 1.00 0.00 C ATOM 232 C ALA A 15 -15.208 7.355 -3.090 1.00 0.00 C ATOM 233 O ALA A 15 -15.918 6.764 -3.903 1.00 0.00 O ATOM 234 CB ALA A 15 -16.211 9.608 -3.512 1.00 0.00 C ATOM 0 H ALA A 15 -13.986 8.419 -5.054 1.00 0.00 H new ATOM 0 HA ALA A 15 -14.506 9.200 -2.293 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -16.929 9.414 -2.716 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -15.997 10.676 -3.555 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -16.629 9.283 -4.465 1.00 0.00 H new ATOM 240 N ILE A 16 -14.625 6.749 -2.069 1.00 0.00 N ATOM 241 CA ILE A 16 -14.890 5.353 -1.760 1.00 0.00 C ATOM 242 C ILE A 16 -15.928 5.273 -0.649 1.00 0.00 C ATOM 243 O ILE A 16 -15.651 5.638 0.493 1.00 0.00 O ATOM 244 CB ILE A 16 -13.608 4.609 -1.324 1.00 0.00 C ATOM 245 CG1 ILE A 16 -12.523 4.722 -2.403 1.00 0.00 C ATOM 246 CG2 ILE A 16 -13.909 3.143 -1.029 1.00 0.00 C ATOM 247 CD1 ILE A 16 -12.922 4.129 -3.737 1.00 0.00 C ATOM 0 H ILE A 16 -13.964 7.203 -1.439 1.00 0.00 H new ATOM 0 HA ILE A 16 -15.263 4.871 -2.664 1.00 0.00 H new ATOM 0 HB ILE A 16 -13.239 5.077 -0.411 1.00 0.00 H new ATOM 0 HG12 ILE A 16 -12.272 5.773 -2.544 1.00 0.00 H new ATOM 0 HG13 ILE A 16 -11.620 4.224 -2.050 1.00 0.00 H new ATOM 0 HG21 ILE A 16 -12.993 2.638 -0.724 1.00 0.00 H new ATOM 0 HG22 ILE A 16 -14.644 3.077 -0.227 1.00 0.00 H new ATOM 0 HG23 ILE A 16 -14.305 2.666 -1.925 1.00 0.00 H new ATOM 0 HD11 ILE A 16 -12.104 4.247 -4.447 1.00 0.00 H new ATOM 0 HD12 ILE A 16 -13.144 3.069 -3.612 1.00 0.00 H new ATOM 0 HD13 ILE A 16 -13.806 4.643 -4.114 1.00 0.00 H new ATOM 259 N ASP A 17 -17.128 4.825 -0.989 1.00 0.00 N ATOM 260 CA ASP A 17 -18.218 4.780 -0.022 1.00 0.00 C ATOM 261 C ASP A 17 -18.180 3.487 0.779 1.00 0.00 C ATOM 262 O ASP A 17 -18.254 3.503 2.009 1.00 0.00 O ATOM 263 CB ASP A 17 -19.573 4.922 -0.718 1.00 0.00 C ATOM 264 CG ASP A 17 -20.723 4.922 0.270 1.00 0.00 C ATOM 265 OD1 ASP A 17 -20.900 5.937 0.980 1.00 0.00 O ATOM 266 OD2 ASP A 17 -21.453 3.917 0.345 1.00 0.00 O ATOM 0 H ASP A 17 -17.372 4.489 -1.921 1.00 0.00 H new ATOM 0 HA ASP A 17 -18.087 5.619 0.662 1.00 0.00 H new ATOM 0 HB2 ASP A 17 -19.590 5.848 -1.293 1.00 0.00 H new ATOM 0 HB3 ASP A 17 -19.704 4.104 -1.426 1.00 0.00 H new ATOM 271 N ALA A 18 -18.057 2.368 0.082 1.00 0.00 N ATOM 272 CA ALA A 18 -17.965 1.077 0.738 1.00 0.00 C ATOM 273 C ALA A 18 -16.762 0.299 0.227 1.00 0.00 C ATOM 274 O ALA A 18 -16.478 0.282 -0.974 1.00 0.00 O ATOM 275 CB ALA A 18 -19.248 0.278 0.550 1.00 0.00 C ATOM 0 H ALA A 18 -18.019 2.330 -0.937 1.00 0.00 H new ATOM 0 HA ALA A 18 -17.830 1.248 1.806 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -19.153 -0.685 1.051 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -20.086 0.829 0.978 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -19.424 0.118 -0.514 1.00 0.00 H new ATOM 281 N TYR A 19 -16.050 -0.325 1.151 1.00 0.00 N ATOM 282 CA TYR A 19 -14.860 -1.096 0.832 1.00 0.00 C ATOM 283 C TYR A 19 -14.834 -2.376 1.659 1.00 0.00 C ATOM 284 O TYR A 19 -15.204 -2.368 2.834 1.00 0.00 O ATOM 285 CB TYR A 19 -13.606 -0.242 1.095 1.00 0.00 C ATOM 286 CG TYR A 19 -12.431 -1.003 1.684 1.00 0.00 C ATOM 287 CD1 TYR A 19 -11.614 -1.799 0.888 1.00 0.00 C ATOM 288 CD2 TYR A 19 -12.146 -0.927 3.043 1.00 0.00 C ATOM 289 CE1 TYR A 19 -10.553 -2.497 1.433 1.00 0.00 C ATOM 290 CE2 TYR A 19 -11.086 -1.619 3.592 1.00 0.00 C ATOM 291 CZ TYR A 19 -10.293 -2.404 2.786 1.00 0.00 C ATOM 292 OH TYR A 19 -9.239 -3.101 3.335 1.00 0.00 O ATOM 0 H TYR A 19 -16.281 -0.311 2.144 1.00 0.00 H new ATOM 0 HA TYR A 19 -14.874 -1.373 -0.222 1.00 0.00 H new ATOM 0 HB2 TYR A 19 -13.291 0.215 0.157 1.00 0.00 H new ATOM 0 HB3 TYR A 19 -13.872 0.570 1.772 1.00 0.00 H new ATOM 0 HD1 TYR A 19 -11.812 -1.873 -0.171 1.00 0.00 H new ATOM 0 HD2 TYR A 19 -12.766 -0.315 3.681 1.00 0.00 H new ATOM 0 HE1 TYR A 19 -9.929 -3.113 0.803 1.00 0.00 H new ATOM 0 HE2 TYR A 19 -10.879 -1.545 4.649 1.00 0.00 H new ATOM 0 HH TYR A 19 -8.662 -3.439 2.619 1.00 0.00 H new ATOM 302 N GLY A 20 -14.422 -3.474 1.041 1.00 0.00 N ATOM 303 CA GLY A 20 -14.264 -4.707 1.776 1.00 0.00 C ATOM 304 C GLY A 20 -14.736 -5.921 1.005 1.00 0.00 C ATOM 305 O GLY A 20 -13.978 -6.514 0.240 1.00 0.00 O ATOM 0 H GLY A 20 -14.196 -3.531 0.048 1.00 0.00 H new ATOM 0 HA2 GLY A 20 -13.214 -4.835 2.037 1.00 0.00 H new ATOM 0 HA3 GLY A 20 -14.819 -4.639 2.712 1.00 0.00 H new ATOM 309 N LYS A 21 -15.995 -6.275 1.190 1.00 0.00 N ATOM 310 CA LYS A 21 -16.527 -7.509 0.639 1.00 0.00 C ATOM 311 C LYS A 21 -17.469 -7.235 -0.527 1.00 0.00 C ATOM 312 O LYS A 21 -18.479 -6.545 -0.376 1.00 0.00 O ATOM 313 CB LYS A 21 -17.258 -8.281 1.735 1.00 0.00 C ATOM 314 CG LYS A 21 -17.710 -9.669 1.320 1.00 0.00 C ATOM 315 CD LYS A 21 -18.403 -10.375 2.469 1.00 0.00 C ATOM 316 CE LYS A 21 -18.751 -11.810 2.121 1.00 0.00 C ATOM 317 NZ LYS A 21 -19.389 -12.507 3.267 1.00 0.00 N ATOM 0 H LYS A 21 -16.670 -5.724 1.719 1.00 0.00 H new ATOM 0 HA LYS A 21 -15.696 -8.105 0.261 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -16.603 -8.368 2.602 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -18.129 -7.706 2.050 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -18.388 -9.597 0.470 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -16.850 -10.254 0.993 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -17.757 -10.360 3.347 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -19.312 -9.834 2.733 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -19.424 -11.825 1.264 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -17.847 -12.344 1.826 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -19.614 -13.486 2.996 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -18.736 -12.513 4.077 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -20.264 -12.011 3.532 1.00 0.00 H new ATOM 331 N GLY A 22 -17.136 -7.789 -1.687 1.00 0.00 N ATOM 332 CA GLY A 22 -17.974 -7.623 -2.860 1.00 0.00 C ATOM 333 C GLY A 22 -17.322 -6.759 -3.920 1.00 0.00 C ATOM 334 O GLY A 22 -17.870 -6.579 -5.009 1.00 0.00 O ATOM 0 H GLY A 22 -16.298 -8.352 -1.836 1.00 0.00 H new ATOM 0 HA2 GLY A 22 -18.201 -8.602 -3.282 1.00 0.00 H new ATOM 0 HA3 GLY A 22 -18.923 -7.176 -2.564 1.00 0.00 H new ATOM 338 N GLY A 23 -16.151 -6.230 -3.602 1.00 0.00 N ATOM 339 CA GLY A 23 -15.446 -5.368 -4.527 1.00 0.00 C ATOM 340 C GLY A 23 -15.327 -3.964 -3.982 1.00 0.00 C ATOM 341 O GLY A 23 -15.071 -3.778 -2.788 1.00 0.00 O ATOM 0 H GLY A 23 -15.674 -6.384 -2.714 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -14.452 -5.772 -4.719 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -15.972 -5.347 -5.482 1.00 0.00 H new ATOM 345 N PHE A 24 -15.511 -2.979 -4.843 1.00 0.00 N ATOM 346 CA PHE A 24 -15.515 -1.589 -4.418 1.00 0.00 C ATOM 347 C PHE A 24 -16.856 -0.951 -4.727 1.00 0.00 C ATOM 348 O PHE A 24 -17.566 -1.377 -5.640 1.00 0.00 O ATOM 349 CB PHE A 24 -14.394 -0.800 -5.097 1.00 0.00 C ATOM 350 CG PHE A 24 -13.020 -1.162 -4.612 1.00 0.00 C ATOM 351 CD1 PHE A 24 -12.625 -0.854 -3.320 1.00 0.00 C ATOM 352 CD2 PHE A 24 -12.122 -1.804 -5.448 1.00 0.00 C ATOM 353 CE1 PHE A 24 -11.361 -1.180 -2.870 1.00 0.00 C ATOM 354 CE2 PHE A 24 -10.857 -2.133 -5.003 1.00 0.00 C ATOM 355 CZ PHE A 24 -10.476 -1.821 -3.713 1.00 0.00 C ATOM 0 H PHE A 24 -15.660 -3.116 -5.843 1.00 0.00 H new ATOM 0 HA PHE A 24 -15.345 -1.566 -3.342 1.00 0.00 H new ATOM 0 HB2 PHE A 24 -14.445 -0.967 -6.173 1.00 0.00 H new ATOM 0 HB3 PHE A 24 -14.559 0.265 -4.931 1.00 0.00 H new ATOM 0 HD1 PHE A 24 -13.314 -0.353 -2.657 1.00 0.00 H new ATOM 0 HD2 PHE A 24 -12.414 -2.050 -6.458 1.00 0.00 H new ATOM 0 HE1 PHE A 24 -11.066 -0.934 -1.861 1.00 0.00 H new ATOM 0 HE2 PHE A 24 -10.166 -2.634 -5.664 1.00 0.00 H new ATOM 0 HZ PHE A 24 -9.487 -2.078 -3.364 1.00 0.00 H new ATOM 365 N TYR A 25 -17.214 0.056 -3.955 1.00 0.00 N ATOM 366 CA TYR A 25 -18.452 0.769 -4.181 1.00 0.00 C ATOM 367 C TYR A 25 -18.215 2.271 -4.156 1.00 0.00 C ATOM 368 O TYR A 25 -17.932 2.855 -3.104 1.00 0.00 O ATOM 369 CB TYR A 25 -19.494 0.378 -3.134 1.00 0.00 C ATOM 370 CG TYR A 25 -20.820 1.088 -3.295 1.00 0.00 C ATOM 371 CD1 TYR A 25 -21.737 0.689 -4.260 1.00 0.00 C ATOM 372 CD2 TYR A 25 -21.154 2.161 -2.480 1.00 0.00 C ATOM 373 CE1 TYR A 25 -22.949 1.340 -4.406 1.00 0.00 C ATOM 374 CE2 TYR A 25 -22.361 2.815 -2.619 1.00 0.00 C ATOM 375 CZ TYR A 25 -23.254 2.403 -3.582 1.00 0.00 C ATOM 376 OH TYR A 25 -24.462 3.052 -3.716 1.00 0.00 O ATOM 0 H TYR A 25 -16.664 0.398 -3.167 1.00 0.00 H new ATOM 0 HA TYR A 25 -18.831 0.495 -5.166 1.00 0.00 H new ATOM 0 HB2 TYR A 25 -19.660 -0.698 -3.185 1.00 0.00 H new ATOM 0 HB3 TYR A 25 -19.096 0.592 -2.142 1.00 0.00 H new ATOM 0 HD1 TYR A 25 -21.500 -0.143 -4.907 1.00 0.00 H new ATOM 0 HD2 TYR A 25 -20.457 2.490 -1.724 1.00 0.00 H new ATOM 0 HE1 TYR A 25 -23.652 1.018 -5.160 1.00 0.00 H new ATOM 0 HE2 TYR A 25 -22.604 3.647 -1.975 1.00 0.00 H new ATOM 0 HH TYR A 25 -24.519 3.776 -3.058 1.00 0.00 H new ATOM 386 N PHE A 26 -18.305 2.880 -5.324 1.00 0.00 N ATOM 387 CA PHE A 26 -18.242 4.324 -5.439 1.00 0.00 C ATOM 388 C PHE A 26 -19.590 4.845 -5.912 1.00 0.00 C ATOM 389 O PHE A 26 -20.503 4.059 -6.174 1.00 0.00 O ATOM 390 CB PHE A 26 -17.116 4.757 -6.392 1.00 0.00 C ATOM 391 CG PHE A 26 -17.235 4.223 -7.795 1.00 0.00 C ATOM 392 CD1 PHE A 26 -17.928 4.929 -8.767 1.00 0.00 C ATOM 393 CD2 PHE A 26 -16.641 3.020 -8.145 1.00 0.00 C ATOM 394 CE1 PHE A 26 -18.027 4.445 -10.057 1.00 0.00 C ATOM 395 CE2 PHE A 26 -16.739 2.533 -9.434 1.00 0.00 C ATOM 396 CZ PHE A 26 -17.433 3.246 -10.391 1.00 0.00 C ATOM 0 H PHE A 26 -18.423 2.392 -6.212 1.00 0.00 H new ATOM 0 HA PHE A 26 -18.015 4.750 -4.462 1.00 0.00 H new ATOM 0 HB2 PHE A 26 -17.093 5.846 -6.434 1.00 0.00 H new ATOM 0 HB3 PHE A 26 -16.162 4.434 -5.975 1.00 0.00 H new ATOM 0 HD1 PHE A 26 -18.396 5.868 -8.512 1.00 0.00 H new ATOM 0 HD2 PHE A 26 -16.096 2.457 -7.402 1.00 0.00 H new ATOM 0 HE1 PHE A 26 -18.570 5.005 -10.804 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -16.272 1.594 -9.693 1.00 0.00 H new ATOM 0 HZ PHE A 26 -17.511 2.866 -11.399 1.00 0.00 H new ATOM 406 N ALA A 27 -19.722 6.158 -6.014 1.00 0.00 N ATOM 407 CA ALA A 27 -20.977 6.759 -6.438 1.00 0.00 C ATOM 408 C ALA A 27 -21.228 6.509 -7.923 1.00 0.00 C ATOM 409 O ALA A 27 -20.774 7.267 -8.780 1.00 0.00 O ATOM 410 CB ALA A 27 -20.984 8.252 -6.136 1.00 0.00 C ATOM 0 H ALA A 27 -18.979 6.826 -5.810 1.00 0.00 H new ATOM 0 HA ALA A 27 -21.784 6.290 -5.876 1.00 0.00 H new ATOM 0 HB1 ALA A 27 -21.931 8.684 -6.460 1.00 0.00 H new ATOM 0 HB2 ALA A 27 -20.862 8.407 -5.064 1.00 0.00 H new ATOM 0 HB3 ALA A 27 -20.164 8.735 -6.668 1.00 0.00 H new ATOM 416 N GLY A 28 -21.929 5.425 -8.222 1.00 0.00 N ATOM 417 CA GLY A 28 -22.244 5.104 -9.596 1.00 0.00 C ATOM 418 C GLY A 28 -22.365 3.615 -9.842 1.00 0.00 C ATOM 419 O GLY A 28 -23.470 3.078 -9.909 1.00 0.00 O ATOM 0 H GLY A 28 -22.285 4.761 -7.534 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -23.180 5.590 -9.871 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -21.470 5.512 -10.246 1.00 0.00 H new ATOM 423 N MET A 29 -21.231 2.939 -9.952 1.00 0.00 N ATOM 424 CA MET A 29 -21.216 1.532 -10.334 1.00 0.00 C ATOM 425 C MET A 29 -20.446 0.698 -9.316 1.00 0.00 C ATOM 426 O MET A 29 -19.550 1.202 -8.638 1.00 0.00 O ATOM 427 CB MET A 29 -20.582 1.380 -11.722 1.00 0.00 C ATOM 428 CG MET A 29 -20.655 -0.031 -12.286 1.00 0.00 C ATOM 429 SD MET A 29 -19.822 -0.186 -13.876 1.00 0.00 S ATOM 430 CE MET A 29 -20.171 -1.895 -14.278 1.00 0.00 C ATOM 0 H MET A 29 -20.309 3.341 -9.783 1.00 0.00 H new ATOM 0 HA MET A 29 -22.244 1.171 -10.362 1.00 0.00 H new ATOM 0 HB2 MET A 29 -21.077 2.062 -12.413 1.00 0.00 H new ATOM 0 HB3 MET A 29 -19.537 1.685 -11.668 1.00 0.00 H new ATOM 0 HG2 MET A 29 -20.206 -0.726 -11.576 1.00 0.00 H new ATOM 0 HG3 MET A 29 -21.700 -0.320 -12.398 1.00 0.00 H new ATOM 0 HE1 MET A 29 -19.719 -2.142 -15.239 1.00 0.00 H new ATOM 0 HE2 MET A 29 -19.757 -2.542 -13.505 1.00 0.00 H new ATOM 0 HE3 MET A 29 -21.249 -2.042 -14.336 1.00 0.00 H new ATOM 440 N SER A 30 -20.800 -0.573 -9.214 1.00 0.00 N ATOM 441 CA SER A 30 -20.115 -1.492 -8.323 1.00 0.00 C ATOM 442 C SER A 30 -20.037 -2.876 -8.973 1.00 0.00 C ATOM 443 O SER A 30 -20.305 -3.015 -10.169 1.00 0.00 O ATOM 444 CB SER A 30 -20.844 -1.559 -6.975 1.00 0.00 C ATOM 445 OG SER A 30 -20.101 -2.297 -6.017 1.00 0.00 O ATOM 0 H SER A 30 -21.564 -0.993 -9.743 1.00 0.00 H new ATOM 0 HA SER A 30 -19.101 -1.136 -8.142 1.00 0.00 H new ATOM 0 HB2 SER A 30 -21.017 -0.549 -6.603 1.00 0.00 H new ATOM 0 HB3 SER A 30 -21.822 -2.020 -7.112 1.00 0.00 H new ATOM 0 HG SER A 30 -19.266 -1.825 -5.816 1.00 0.00 H new ATOM 451 N HIS A 31 -19.661 -3.880 -8.179 1.00 0.00 N ATOM 452 CA HIS A 31 -19.532 -5.269 -8.638 1.00 0.00 C ATOM 453 C HIS A 31 -18.315 -5.450 -9.532 1.00 0.00 C ATOM 454 O HIS A 31 -18.256 -6.376 -10.342 1.00 0.00 O ATOM 455 CB HIS A 31 -20.795 -5.752 -9.368 1.00 0.00 C ATOM 456 CG HIS A 31 -22.000 -5.863 -8.489 1.00 0.00 C ATOM 457 ND1 HIS A 31 -23.222 -5.318 -8.812 1.00 0.00 N ATOM 458 CD2 HIS A 31 -22.168 -6.477 -7.296 1.00 0.00 C ATOM 459 CE1 HIS A 31 -24.087 -5.589 -7.855 1.00 0.00 C ATOM 460 NE2 HIS A 31 -23.476 -6.294 -6.922 1.00 0.00 N ATOM 0 H HIS A 31 -19.435 -3.754 -7.192 1.00 0.00 H new ATOM 0 HA HIS A 31 -19.402 -5.879 -7.744 1.00 0.00 H new ATOM 0 HB2 HIS A 31 -21.016 -5.065 -10.185 1.00 0.00 H new ATOM 0 HB3 HIS A 31 -20.594 -6.725 -9.816 1.00 0.00 H new ATOM 0 HD2 HIS A 31 -21.413 -7.012 -6.740 1.00 0.00 H new ATOM 0 HE1 HIS A 31 -25.123 -5.285 -7.838 1.00 0.00 H new ATOM 0 HE2 HIS A 31 -23.904 -6.645 -6.065 1.00 0.00 H new ATOM 469 N GLN A 32 -17.335 -4.585 -9.362 1.00 0.00 N ATOM 470 CA GLN A 32 -16.085 -4.700 -10.097 1.00 0.00 C ATOM 471 C GLN A 32 -14.936 -4.914 -9.124 1.00 0.00 C ATOM 472 O GLN A 32 -14.997 -4.481 -7.971 1.00 0.00 O ATOM 473 CB GLN A 32 -15.821 -3.467 -10.976 1.00 0.00 C ATOM 474 CG GLN A 32 -15.488 -2.196 -10.206 1.00 0.00 C ATOM 475 CD GLN A 32 -16.676 -1.616 -9.468 1.00 0.00 C ATOM 476 OE1 GLN A 32 -16.945 -1.975 -8.326 1.00 0.00 O ATOM 477 NE2 GLN A 32 -17.393 -0.714 -10.117 1.00 0.00 N ATOM 0 H GLN A 32 -17.377 -3.793 -8.721 1.00 0.00 H new ATOM 0 HA GLN A 32 -16.164 -5.560 -10.762 1.00 0.00 H new ATOM 0 HB2 GLN A 32 -14.998 -3.691 -11.654 1.00 0.00 H new ATOM 0 HB3 GLN A 32 -16.701 -3.282 -11.593 1.00 0.00 H new ATOM 0 HG2 GLN A 32 -14.694 -2.410 -9.491 1.00 0.00 H new ATOM 0 HG3 GLN A 32 -15.100 -1.450 -10.900 1.00 0.00 H new ATOM 0 HE21 GLN A 32 -17.135 -0.444 -11.066 1.00 0.00 H new ATOM 0 HE22 GLN A 32 -18.204 -0.289 -9.669 1.00 0.00 H new ATOM 486 N GLY A 33 -13.896 -5.590 -9.584 1.00 0.00 N ATOM 487 CA GLY A 33 -12.785 -5.903 -8.715 1.00 0.00 C ATOM 488 C GLY A 33 -11.500 -5.218 -9.119 1.00 0.00 C ATOM 489 O GLY A 33 -10.445 -5.503 -8.559 1.00 0.00 O ATOM 0 H GLY A 33 -13.802 -5.927 -10.542 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -13.038 -5.614 -7.695 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -12.628 -6.982 -8.711 1.00 0.00 H new ATOM 493 N SER A 34 -11.578 -4.311 -10.080 1.00 0.00 N ATOM 494 CA SER A 34 -10.388 -3.650 -10.589 1.00 0.00 C ATOM 495 C SER A 34 -10.702 -2.213 -11.008 1.00 0.00 C ATOM 496 O SER A 34 -11.466 -1.985 -11.948 1.00 0.00 O ATOM 497 CB SER A 34 -9.842 -4.435 -11.782 1.00 0.00 C ATOM 498 OG SER A 34 -9.782 -5.824 -11.500 1.00 0.00 O ATOM 0 H SER A 34 -12.449 -4.017 -10.521 1.00 0.00 H new ATOM 0 HA SER A 34 -9.639 -3.618 -9.798 1.00 0.00 H new ATOM 0 HB2 SER A 34 -10.476 -4.265 -12.653 1.00 0.00 H new ATOM 0 HB3 SER A 34 -8.847 -4.070 -12.036 1.00 0.00 H new ATOM 0 HG SER A 34 -8.885 -6.054 -11.179 1.00 0.00 H new ATOM 504 N LEU A 35 -10.115 -1.248 -10.309 1.00 0.00 N ATOM 505 CA LEU A 35 -10.365 0.161 -10.596 1.00 0.00 C ATOM 506 C LEU A 35 -9.072 0.968 -10.601 1.00 0.00 C ATOM 507 O LEU A 35 -8.209 0.787 -9.739 1.00 0.00 O ATOM 508 CB LEU A 35 -11.336 0.748 -9.569 1.00 0.00 C ATOM 509 CG LEU A 35 -12.776 0.242 -9.663 1.00 0.00 C ATOM 510 CD1 LEU A 35 -13.599 0.759 -8.494 1.00 0.00 C ATOM 511 CD2 LEU A 35 -13.405 0.666 -10.982 1.00 0.00 C ATOM 0 H LEU A 35 -9.464 -1.414 -9.541 1.00 0.00 H new ATOM 0 HA LEU A 35 -10.808 0.221 -11.590 1.00 0.00 H new ATOM 0 HB2 LEU A 35 -10.957 0.531 -8.570 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -11.342 1.832 -9.679 1.00 0.00 H new ATOM 0 HG LEU A 35 -12.761 -0.847 -9.621 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -14.621 0.389 -8.577 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -13.162 0.410 -7.559 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -13.605 1.849 -8.507 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -14.430 0.297 -11.032 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -13.407 1.754 -11.051 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -12.830 0.251 -11.810 1.00 0.00 H new ATOM 523 N LEU A 36 -8.946 1.855 -11.578 1.00 0.00 N ATOM 524 CA LEU A 36 -7.801 2.751 -11.667 1.00 0.00 C ATOM 525 C LEU A 36 -8.224 4.180 -11.355 1.00 0.00 C ATOM 526 O LEU A 36 -8.802 4.860 -12.204 1.00 0.00 O ATOM 527 CB LEU A 36 -7.178 2.699 -13.067 1.00 0.00 C ATOM 528 CG LEU A 36 -6.555 1.361 -13.466 1.00 0.00 C ATOM 529 CD1 LEU A 36 -6.100 1.407 -14.916 1.00 0.00 C ATOM 530 CD2 LEU A 36 -5.387 1.025 -12.554 1.00 0.00 C ATOM 0 H LEU A 36 -9.629 1.974 -12.326 1.00 0.00 H new ATOM 0 HA LEU A 36 -7.060 2.425 -10.938 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -7.947 2.953 -13.797 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -6.410 3.470 -13.132 1.00 0.00 H new ATOM 0 HG LEU A 36 -7.308 0.580 -13.360 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -5.658 0.449 -15.189 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -6.956 1.608 -15.560 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -5.359 2.197 -15.040 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -4.956 0.070 -12.852 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -4.629 1.805 -12.631 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -5.737 0.959 -11.524 1.00 0.00 H new ATOM 542 N PHE A 37 -7.952 4.628 -10.138 1.00 0.00 N ATOM 543 CA PHE A 37 -8.278 5.991 -9.741 1.00 0.00 C ATOM 544 C PHE A 37 -7.105 6.917 -10.026 1.00 0.00 C ATOM 545 O PHE A 37 -6.194 7.052 -9.209 1.00 0.00 O ATOM 546 CB PHE A 37 -8.652 6.059 -8.256 1.00 0.00 C ATOM 547 CG PHE A 37 -9.952 5.379 -7.926 1.00 0.00 C ATOM 548 CD1 PHE A 37 -11.143 6.084 -7.970 1.00 0.00 C ATOM 549 CD2 PHE A 37 -9.982 4.040 -7.572 1.00 0.00 C ATOM 550 CE1 PHE A 37 -12.342 5.466 -7.667 1.00 0.00 C ATOM 551 CE2 PHE A 37 -11.176 3.417 -7.268 1.00 0.00 C ATOM 552 CZ PHE A 37 -12.358 4.131 -7.316 1.00 0.00 C ATOM 0 H PHE A 37 -7.507 4.070 -9.409 1.00 0.00 H new ATOM 0 HA PHE A 37 -9.139 6.315 -10.325 1.00 0.00 H new ATOM 0 HB2 PHE A 37 -7.855 5.603 -7.669 1.00 0.00 H new ATOM 0 HB3 PHE A 37 -8.713 7.104 -7.954 1.00 0.00 H new ATOM 0 HD1 PHE A 37 -11.135 7.129 -8.244 1.00 0.00 H new ATOM 0 HD2 PHE A 37 -9.061 3.477 -7.533 1.00 0.00 H new ATOM 0 HE1 PHE A 37 -13.264 6.027 -7.705 1.00 0.00 H new ATOM 0 HE2 PHE A 37 -11.186 2.373 -6.993 1.00 0.00 H new ATOM 0 HZ PHE A 37 -13.293 3.645 -7.079 1.00 0.00 H new ATOM 562 N LEU A 38 -7.115 7.525 -11.200 1.00 0.00 N ATOM 563 CA LEU A 38 -6.048 8.431 -11.594 1.00 0.00 C ATOM 564 C LEU A 38 -6.455 9.872 -11.301 1.00 0.00 C ATOM 565 O LEU A 38 -7.644 10.172 -11.198 1.00 0.00 O ATOM 566 CB LEU A 38 -5.734 8.262 -13.086 1.00 0.00 C ATOM 567 CG LEU A 38 -5.419 6.833 -13.537 1.00 0.00 C ATOM 568 CD1 LEU A 38 -5.108 6.804 -15.024 1.00 0.00 C ATOM 569 CD2 LEU A 38 -4.263 6.257 -12.739 1.00 0.00 C ATOM 0 H LEU A 38 -7.850 7.408 -11.898 1.00 0.00 H new ATOM 0 HA LEU A 38 -5.152 8.193 -11.020 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -6.585 8.627 -13.662 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -4.885 8.898 -13.335 1.00 0.00 H new ATOM 0 HG LEU A 38 -6.298 6.215 -13.354 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -4.886 5.781 -15.329 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -5.969 7.171 -15.583 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -4.246 7.439 -15.228 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -4.058 5.241 -13.077 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -3.377 6.874 -12.885 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -4.524 6.241 -11.681 1.00 0.00 H new ATOM 581 N PRO A 39 -5.478 10.789 -11.179 1.00 0.00 N ATOM 582 CA PRO A 39 -5.744 12.210 -10.917 1.00 0.00 C ATOM 583 C PRO A 39 -6.350 12.921 -12.127 1.00 0.00 C ATOM 584 O PRO A 39 -6.512 14.142 -12.129 1.00 0.00 O ATOM 585 CB PRO A 39 -4.358 12.795 -10.601 1.00 0.00 C ATOM 586 CG PRO A 39 -3.451 11.621 -10.434 1.00 0.00 C ATOM 587 CD PRO A 39 -4.036 10.522 -11.265 1.00 0.00 C ATOM 0 HA PRO A 39 -6.467 12.338 -10.112 1.00 0.00 H new ATOM 0 HB2 PRO A 39 -4.014 13.444 -11.407 1.00 0.00 H new ATOM 0 HB3 PRO A 39 -4.386 13.400 -9.695 1.00 0.00 H new ATOM 0 HG2 PRO A 39 -2.439 11.861 -10.761 1.00 0.00 H new ATOM 0 HG3 PRO A 39 -3.386 11.325 -9.387 1.00 0.00 H new ATOM 0 HD2 PRO A 39 -3.678 10.557 -12.294 1.00 0.00 H new ATOM 0 HD3 PRO A 39 -3.782 9.537 -10.872 1.00 0.00 H new ATOM 595 N ASP A 40 -6.680 12.144 -13.148 1.00 0.00 N ATOM 596 CA ASP A 40 -7.279 12.667 -14.366 1.00 0.00 C ATOM 597 C ASP A 40 -8.618 11.986 -14.627 1.00 0.00 C ATOM 598 O ASP A 40 -9.655 12.644 -14.728 1.00 0.00 O ATOM 599 CB ASP A 40 -6.329 12.458 -15.549 1.00 0.00 C ATOM 600 CG ASP A 40 -6.954 12.810 -16.885 1.00 0.00 C ATOM 601 OD1 ASP A 40 -7.346 13.980 -17.078 1.00 0.00 O ATOM 602 OD2 ASP A 40 -7.031 11.916 -17.757 1.00 0.00 O ATOM 0 H ASP A 40 -6.540 11.134 -13.155 1.00 0.00 H new ATOM 0 HA ASP A 40 -7.454 13.736 -14.245 1.00 0.00 H new ATOM 0 HB2 ASP A 40 -5.436 13.065 -15.401 1.00 0.00 H new ATOM 0 HB3 ASP A 40 -6.007 11.417 -15.569 1.00 0.00 H new ATOM 607 N ALA A 41 -8.599 10.662 -14.704 1.00 0.00 N ATOM 608 CA ALA A 41 -9.810 9.897 -14.956 1.00 0.00 C ATOM 609 C ALA A 41 -9.792 8.578 -14.196 1.00 0.00 C ATOM 610 O ALA A 41 -8.727 8.060 -13.853 1.00 0.00 O ATOM 611 CB ALA A 41 -9.973 9.645 -16.448 1.00 0.00 C ATOM 0 H ALA A 41 -7.757 10.096 -14.595 1.00 0.00 H new ATOM 0 HA ALA A 41 -10.660 10.480 -14.601 1.00 0.00 H new ATOM 0 HB1 ALA A 41 -10.883 9.071 -16.623 1.00 0.00 H new ATOM 0 HB2 ALA A 41 -10.038 10.598 -16.973 1.00 0.00 H new ATOM 0 HB3 ALA A 41 -9.114 9.085 -16.818 1.00 0.00 H new ATOM 617 N VAL A 42 -10.974 8.056 -13.916 1.00 0.00 N ATOM 618 CA VAL A 42 -11.110 6.748 -13.299 1.00 0.00 C ATOM 619 C VAL A 42 -11.405 5.705 -14.369 1.00 0.00 C ATOM 620 O VAL A 42 -12.426 5.779 -15.055 1.00 0.00 O ATOM 621 CB VAL A 42 -12.231 6.731 -12.236 1.00 0.00 C ATOM 622 CG1 VAL A 42 -12.356 5.355 -11.599 1.00 0.00 C ATOM 623 CG2 VAL A 42 -11.975 7.790 -11.175 1.00 0.00 C ATOM 0 H VAL A 42 -11.860 8.523 -14.108 1.00 0.00 H new ATOM 0 HA VAL A 42 -10.170 6.515 -12.799 1.00 0.00 H new ATOM 0 HB VAL A 42 -13.174 6.960 -12.733 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -13.152 5.370 -10.854 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -12.591 4.618 -12.367 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -11.414 5.090 -11.118 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -12.774 7.764 -10.434 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -11.021 7.592 -10.686 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -11.946 8.774 -11.643 1.00 0.00 H new ATOM 633 N TRP A 43 -10.505 4.750 -14.520 1.00 0.00 N ATOM 634 CA TRP A 43 -10.636 3.740 -15.560 1.00 0.00 C ATOM 635 C TRP A 43 -10.974 2.381 -14.964 1.00 0.00 C ATOM 636 O TRP A 43 -10.595 2.075 -13.831 1.00 0.00 O ATOM 637 CB TRP A 43 -9.341 3.637 -16.371 1.00 0.00 C ATOM 638 CG TRP A 43 -8.979 4.897 -17.098 1.00 0.00 C ATOM 639 CD1 TRP A 43 -8.077 5.843 -16.703 1.00 0.00 C ATOM 640 CD2 TRP A 43 -9.507 5.345 -18.351 1.00 0.00 C ATOM 641 NE1 TRP A 43 -8.011 6.849 -17.636 1.00 0.00 N ATOM 642 CE2 TRP A 43 -8.881 6.569 -18.653 1.00 0.00 C ATOM 643 CE3 TRP A 43 -10.453 4.834 -19.244 1.00 0.00 C ATOM 644 CZ2 TRP A 43 -9.163 7.283 -19.812 1.00 0.00 C ATOM 645 CZ3 TRP A 43 -10.731 5.545 -20.396 1.00 0.00 C ATOM 646 CH2 TRP A 43 -10.090 6.759 -20.668 1.00 0.00 C ATOM 0 H TRP A 43 -9.674 4.651 -13.936 1.00 0.00 H new ATOM 0 HA TRP A 43 -11.450 4.044 -16.218 1.00 0.00 H new ATOM 0 HB2 TRP A 43 -8.524 3.368 -15.701 1.00 0.00 H new ATOM 0 HB3 TRP A 43 -9.440 2.827 -17.094 1.00 0.00 H new ATOM 0 HD1 TRP A 43 -7.500 5.806 -15.791 1.00 0.00 H new ATOM 0 HE1 TRP A 43 -7.410 7.671 -17.579 1.00 0.00 H new ATOM 0 HE3 TRP A 43 -10.957 3.901 -19.038 1.00 0.00 H new ATOM 0 HZ2 TRP A 43 -8.667 8.218 -20.028 1.00 0.00 H new ATOM 0 HZ3 TRP A 43 -11.455 5.157 -21.098 1.00 0.00 H new ATOM 0 HH2 TRP A 43 -10.333 7.293 -21.574 1.00 0.00 H new ATOM 657 N GLY A 44 -11.692 1.574 -15.733 1.00 0.00 N ATOM 658 CA GLY A 44 -11.958 0.209 -15.332 1.00 0.00 C ATOM 659 C GLY A 44 -10.820 -0.700 -15.737 1.00 0.00 C ATOM 660 O GLY A 44 -10.403 -0.695 -16.897 1.00 0.00 O ATOM 0 H GLY A 44 -12.096 1.843 -16.630 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -12.099 0.163 -14.252 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -12.885 -0.135 -15.790 1.00 0.00 H new ATOM 664 N TRP A 45 -10.305 -1.465 -14.792 1.00 0.00 N ATOM 665 CA TRP A 45 -9.144 -2.305 -15.041 1.00 0.00 C ATOM 666 C TRP A 45 -9.586 -3.743 -15.305 1.00 0.00 C ATOM 667 O TRP A 45 -10.625 -4.177 -14.810 1.00 0.00 O ATOM 668 CB TRP A 45 -8.202 -2.239 -13.837 1.00 0.00 C ATOM 669 CG TRP A 45 -6.747 -2.365 -14.178 1.00 0.00 C ATOM 670 CD1 TRP A 45 -6.167 -2.192 -15.404 1.00 0.00 C ATOM 671 CD2 TRP A 45 -5.683 -2.664 -13.268 1.00 0.00 C ATOM 672 NE1 TRP A 45 -4.806 -2.374 -15.309 1.00 0.00 N ATOM 673 CE2 TRP A 45 -4.486 -2.663 -14.007 1.00 0.00 C ATOM 674 CE3 TRP A 45 -5.628 -2.933 -11.896 1.00 0.00 C ATOM 675 CZ2 TRP A 45 -3.249 -2.923 -13.422 1.00 0.00 C ATOM 676 CZ3 TRP A 45 -4.399 -3.191 -11.316 1.00 0.00 C ATOM 677 CH2 TRP A 45 -3.224 -3.182 -12.078 1.00 0.00 C ATOM 0 H TRP A 45 -10.672 -1.523 -13.842 1.00 0.00 H new ATOM 0 HA TRP A 45 -8.614 -1.945 -15.923 1.00 0.00 H new ATOM 0 HB2 TRP A 45 -8.360 -1.293 -13.319 1.00 0.00 H new ATOM 0 HB3 TRP A 45 -8.469 -3.033 -13.139 1.00 0.00 H new ATOM 0 HD1 TRP A 45 -6.698 -1.949 -16.312 1.00 0.00 H new ATOM 0 HE1 TRP A 45 -4.143 -2.305 -16.081 1.00 0.00 H new ATOM 0 HE3 TRP A 45 -6.529 -2.939 -11.301 1.00 0.00 H new ATOM 0 HZ2 TRP A 45 -2.342 -2.920 -14.008 1.00 0.00 H new ATOM 0 HZ3 TRP A 45 -4.345 -3.403 -10.258 1.00 0.00 H new ATOM 0 HH2 TRP A 45 -2.279 -3.383 -11.596 1.00 0.00 H new ATOM 688 N ASP A 46 -8.804 -4.476 -16.086 1.00 0.00 N ATOM 689 CA ASP A 46 -9.148 -5.856 -16.433 1.00 0.00 C ATOM 690 C ASP A 46 -8.270 -6.834 -15.657 1.00 0.00 C ATOM 691 O ASP A 46 -8.283 -8.045 -15.878 1.00 0.00 O ATOM 692 CB ASP A 46 -9.008 -6.063 -17.948 1.00 0.00 C ATOM 693 CG ASP A 46 -9.391 -7.459 -18.406 1.00 0.00 C ATOM 694 OD1 ASP A 46 -10.520 -7.902 -18.118 1.00 0.00 O ATOM 695 OD2 ASP A 46 -8.553 -8.122 -19.057 1.00 0.00 O ATOM 0 H ASP A 46 -7.929 -4.143 -16.492 1.00 0.00 H new ATOM 0 HA ASP A 46 -10.184 -6.048 -16.156 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -9.633 -5.335 -18.466 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -7.977 -5.863 -18.240 1.00 0.00 H new ATOM 700 N VAL A 47 -7.536 -6.293 -14.710 1.00 0.00 N ATOM 701 CA VAL A 47 -6.621 -7.085 -13.905 1.00 0.00 C ATOM 702 C VAL A 47 -7.282 -7.487 -12.593 1.00 0.00 C ATOM 703 O VAL A 47 -7.290 -6.730 -11.623 1.00 0.00 O ATOM 704 CB VAL A 47 -5.313 -6.318 -13.630 1.00 0.00 C ATOM 705 CG1 VAL A 47 -4.378 -7.120 -12.742 1.00 0.00 C ATOM 706 CG2 VAL A 47 -4.627 -5.974 -14.938 1.00 0.00 C ATOM 0 H VAL A 47 -7.553 -5.301 -14.474 1.00 0.00 H new ATOM 0 HA VAL A 47 -6.373 -7.985 -14.467 1.00 0.00 H new ATOM 0 HB VAL A 47 -5.566 -5.397 -13.104 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -3.465 -6.551 -12.567 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -4.867 -7.324 -11.789 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -4.130 -8.062 -13.231 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -3.704 -5.432 -14.733 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -4.397 -6.891 -15.480 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -5.287 -5.351 -15.542 1.00 0.00 H new ATOM 716 N THR A 48 -7.853 -8.681 -12.584 1.00 0.00 N ATOM 717 CA THR A 48 -8.594 -9.174 -11.434 1.00 0.00 C ATOM 718 C THR A 48 -7.710 -9.996 -10.495 1.00 0.00 C ATOM 719 O THR A 48 -8.199 -10.620 -9.554 1.00 0.00 O ATOM 720 CB THR A 48 -9.790 -10.026 -11.897 1.00 0.00 C ATOM 721 OG1 THR A 48 -9.400 -10.848 -13.009 1.00 0.00 O ATOM 722 CG2 THR A 48 -10.962 -9.143 -12.302 1.00 0.00 C ATOM 0 H THR A 48 -7.816 -9.332 -13.368 1.00 0.00 H new ATOM 0 HA THR A 48 -8.953 -8.305 -10.882 1.00 0.00 H new ATOM 0 HB THR A 48 -10.103 -10.657 -11.065 1.00 0.00 H new ATOM 0 HG1 THR A 48 -10.164 -11.390 -13.299 1.00 0.00 H new ATOM 0 HG21 THR A 48 -11.794 -9.768 -12.625 1.00 0.00 H new ATOM 0 HG22 THR A 48 -11.272 -8.537 -11.451 1.00 0.00 H new ATOM 0 HG23 THR A 48 -10.660 -8.490 -13.121 1.00 0.00 H new ATOM 730 N LYS A 49 -6.407 -9.986 -10.750 1.00 0.00 N ATOM 731 CA LYS A 49 -5.462 -10.735 -9.931 1.00 0.00 C ATOM 732 C LYS A 49 -4.295 -9.851 -9.510 1.00 0.00 C ATOM 733 O LYS A 49 -3.707 -9.159 -10.341 1.00 0.00 O ATOM 734 CB LYS A 49 -4.936 -11.955 -10.693 1.00 0.00 C ATOM 735 CG LYS A 49 -5.966 -13.056 -10.880 1.00 0.00 C ATOM 736 CD LYS A 49 -5.426 -14.171 -11.757 1.00 0.00 C ATOM 737 CE LYS A 49 -6.399 -15.334 -11.839 1.00 0.00 C ATOM 738 NZ LYS A 49 -5.931 -16.379 -12.785 1.00 0.00 N ATOM 0 H LYS A 49 -5.981 -9.467 -11.518 1.00 0.00 H new ATOM 0 HA LYS A 49 -5.988 -11.074 -9.038 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -4.580 -11.634 -11.672 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -4.077 -12.362 -10.159 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -6.251 -13.460 -9.908 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -6.868 -12.641 -11.330 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -5.232 -13.786 -12.758 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -4.473 -14.520 -11.359 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -6.527 -15.771 -10.849 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -7.376 -14.969 -12.155 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -6.622 -17.156 -12.813 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -5.833 -15.968 -13.735 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -5.010 -16.746 -12.470 1.00 0.00 H new ATOM 752 N PRO A 50 -3.938 -9.874 -8.218 1.00 0.00 N ATOM 753 CA PRO A 50 -2.837 -9.064 -7.679 1.00 0.00 C ATOM 754 C PRO A 50 -1.504 -9.347 -8.370 1.00 0.00 C ATOM 755 O PRO A 50 -0.685 -8.451 -8.545 1.00 0.00 O ATOM 756 CB PRO A 50 -2.771 -9.477 -6.205 1.00 0.00 C ATOM 757 CG PRO A 50 -4.121 -10.025 -5.899 1.00 0.00 C ATOM 758 CD PRO A 50 -4.592 -10.676 -7.167 1.00 0.00 C ATOM 0 HA PRO A 50 -3.013 -7.999 -7.830 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -1.995 -10.224 -6.038 1.00 0.00 H new ATOM 0 HB3 PRO A 50 -2.536 -8.625 -5.566 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -4.075 -10.746 -5.083 1.00 0.00 H new ATOM 0 HG3 PRO A 50 -4.803 -9.234 -5.588 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -4.296 -11.724 -7.216 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -5.678 -10.648 -7.255 1.00 0.00 H new ATOM 766 N GLU A 51 -1.300 -10.592 -8.782 1.00 0.00 N ATOM 767 CA GLU A 51 -0.044 -10.988 -9.407 1.00 0.00 C ATOM 768 C GLU A 51 -0.159 -10.948 -10.935 1.00 0.00 C ATOM 769 O GLU A 51 0.723 -11.410 -11.660 1.00 0.00 O ATOM 770 CB GLU A 51 0.361 -12.383 -8.918 1.00 0.00 C ATOM 771 CG GLU A 51 1.794 -12.762 -9.255 1.00 0.00 C ATOM 772 CD GLU A 51 2.263 -13.982 -8.499 1.00 0.00 C ATOM 773 OE1 GLU A 51 1.865 -15.104 -8.863 1.00 0.00 O ATOM 774 OE2 GLU A 51 3.030 -13.822 -7.527 1.00 0.00 O ATOM 0 H GLU A 51 -1.985 -11.343 -8.695 1.00 0.00 H new ATOM 0 HA GLU A 51 0.733 -10.280 -9.119 1.00 0.00 H new ATOM 0 HB2 GLU A 51 0.227 -12.431 -7.837 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -0.312 -13.120 -9.356 1.00 0.00 H new ATOM 0 HG2 GLU A 51 1.875 -12.949 -10.326 1.00 0.00 H new ATOM 0 HG3 GLU A 51 2.451 -11.923 -9.028 1.00 0.00 H new ATOM 781 N GLN A 52 -1.248 -10.370 -11.422 1.00 0.00 N ATOM 782 CA GLN A 52 -1.447 -10.206 -12.857 1.00 0.00 C ATOM 783 C GLN A 52 -0.981 -8.809 -13.276 1.00 0.00 C ATOM 784 O GLN A 52 -1.164 -8.377 -14.415 1.00 0.00 O ATOM 785 CB GLN A 52 -2.921 -10.434 -13.216 1.00 0.00 C ATOM 786 CG GLN A 52 -3.217 -10.385 -14.710 1.00 0.00 C ATOM 787 CD GLN A 52 -4.684 -10.595 -15.031 1.00 0.00 C ATOM 788 OE1 GLN A 52 -5.196 -10.064 -16.014 1.00 0.00 O ATOM 789 NE2 GLN A 52 -5.368 -11.377 -14.212 1.00 0.00 N ATOM 0 H GLN A 52 -2.007 -10.007 -10.846 1.00 0.00 H new ATOM 0 HA GLN A 52 -0.857 -10.945 -13.398 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -3.232 -11.404 -12.827 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -3.526 -9.680 -12.713 1.00 0.00 H new ATOM 0 HG2 GLN A 52 -2.899 -9.421 -15.106 1.00 0.00 H new ATOM 0 HG3 GLN A 52 -2.627 -11.149 -15.217 1.00 0.00 H new ATOM 0 HE21 GLN A 52 -4.907 -11.799 -13.406 1.00 0.00 H new ATOM 0 HE22 GLN A 52 -6.357 -11.557 -14.386 1.00 0.00 H new ATOM 798 N ILE A 53 -0.370 -8.107 -12.332 1.00 0.00 N ATOM 799 CA ILE A 53 0.177 -6.789 -12.595 1.00 0.00 C ATOM 800 C ILE A 53 1.488 -6.909 -13.370 1.00 0.00 C ATOM 801 O ILE A 53 2.523 -7.284 -12.819 1.00 0.00 O ATOM 802 CB ILE A 53 0.412 -6.002 -11.288 1.00 0.00 C ATOM 803 CG1 ILE A 53 -0.908 -5.847 -10.520 1.00 0.00 C ATOM 804 CG2 ILE A 53 1.018 -4.637 -11.588 1.00 0.00 C ATOM 805 CD1 ILE A 53 -0.763 -5.132 -9.192 1.00 0.00 C ATOM 0 H ILE A 53 -0.242 -8.432 -11.374 1.00 0.00 H new ATOM 0 HA ILE A 53 -0.551 -6.241 -13.193 1.00 0.00 H new ATOM 0 HB ILE A 53 1.114 -6.559 -10.667 1.00 0.00 H new ATOM 0 HG12 ILE A 53 -1.617 -5.299 -11.141 1.00 0.00 H new ATOM 0 HG13 ILE A 53 -1.334 -6.835 -10.345 1.00 0.00 H new ATOM 0 HG21 ILE A 53 1.177 -4.096 -10.655 1.00 0.00 H new ATOM 0 HG22 ILE A 53 1.972 -4.767 -12.099 1.00 0.00 H new ATOM 0 HG23 ILE A 53 0.339 -4.070 -12.225 1.00 0.00 H new ATOM 0 HD11 ILE A 53 -1.737 -5.061 -8.709 1.00 0.00 H new ATOM 0 HD12 ILE A 53 -0.080 -5.690 -8.551 1.00 0.00 H new ATOM 0 HD13 ILE A 53 -0.367 -4.130 -9.359 1.00 0.00 H new ATOM 817 N ASP A 54 1.413 -6.622 -14.658 1.00 0.00 N ATOM 818 CA ASP A 54 2.571 -6.683 -15.538 1.00 0.00 C ATOM 819 C ASP A 54 2.723 -5.359 -16.283 1.00 0.00 C ATOM 820 O ASP A 54 1.833 -4.512 -16.225 1.00 0.00 O ATOM 821 CB ASP A 54 2.414 -7.851 -16.530 1.00 0.00 C ATOM 822 CG ASP A 54 3.491 -7.875 -17.598 1.00 0.00 C ATOM 823 OD1 ASP A 54 4.652 -8.208 -17.280 1.00 0.00 O ATOM 824 OD2 ASP A 54 3.191 -7.532 -18.757 1.00 0.00 O ATOM 0 H ASP A 54 0.550 -6.341 -15.124 1.00 0.00 H new ATOM 0 HA ASP A 54 3.469 -6.853 -14.944 1.00 0.00 H new ATOM 0 HB2 ASP A 54 2.435 -8.792 -15.980 1.00 0.00 H new ATOM 0 HB3 ASP A 54 1.437 -7.784 -17.009 1.00 0.00 H new ATOM 829 N ARG A 55 3.850 -5.188 -16.965 1.00 0.00 N ATOM 830 CA ARG A 55 4.113 -3.998 -17.768 1.00 0.00 C ATOM 831 C ARG A 55 2.969 -3.752 -18.747 1.00 0.00 C ATOM 832 O ARG A 55 2.547 -2.616 -18.951 1.00 0.00 O ATOM 833 CB ARG A 55 5.409 -4.176 -18.557 1.00 0.00 C ATOM 834 CG ARG A 55 6.553 -4.759 -17.744 1.00 0.00 C ATOM 835 CD ARG A 55 7.283 -5.824 -18.542 1.00 0.00 C ATOM 836 NE ARG A 55 6.367 -6.882 -18.979 1.00 0.00 N ATOM 837 CZ ARG A 55 6.247 -7.299 -20.237 1.00 0.00 C ATOM 838 NH1 ARG A 55 7.067 -6.851 -21.179 1.00 0.00 N ATOM 839 NH2 ARG A 55 5.310 -8.182 -20.550 1.00 0.00 N ATOM 0 H ARG A 55 4.608 -5.871 -16.977 1.00 0.00 H new ATOM 0 HA ARG A 55 4.203 -3.145 -17.095 1.00 0.00 H new ATOM 0 HB2 ARG A 55 5.216 -4.825 -19.411 1.00 0.00 H new ATOM 0 HB3 ARG A 55 5.716 -3.209 -18.955 1.00 0.00 H new ATOM 0 HG2 ARG A 55 7.247 -3.967 -17.462 1.00 0.00 H new ATOM 0 HG3 ARG A 55 6.168 -5.189 -16.819 1.00 0.00 H new ATOM 0 HD2 ARG A 55 7.758 -5.369 -19.411 1.00 0.00 H new ATOM 0 HD3 ARG A 55 8.078 -6.256 -17.934 1.00 0.00 H new ATOM 0 HE ARG A 55 5.783 -7.328 -18.272 1.00 0.00 H new ATOM 0 HH11 ARG A 55 7.798 -6.180 -20.942 1.00 0.00 H new ATOM 0 HH12 ARG A 55 6.966 -7.177 -22.140 1.00 0.00 H new ATOM 0 HH21 ARG A 55 4.684 -8.539 -19.828 1.00 0.00 H new ATOM 0 HH22 ARG A 55 5.214 -8.504 -21.513 1.00 0.00 H new ATOM 853 N TYR A 56 2.471 -4.833 -19.345 1.00 0.00 N ATOM 854 CA TYR A 56 1.371 -4.749 -20.300 1.00 0.00 C ATOM 855 C TYR A 56 0.090 -4.299 -19.604 1.00 0.00 C ATOM 856 O TYR A 56 -0.662 -3.479 -20.129 1.00 0.00 O ATOM 857 CB TYR A 56 1.158 -6.101 -20.984 1.00 0.00 C ATOM 858 CG TYR A 56 -0.019 -6.129 -21.935 1.00 0.00 C ATOM 859 CD1 TYR A 56 -0.036 -5.333 -23.073 1.00 0.00 C ATOM 860 CD2 TYR A 56 -1.116 -6.948 -21.693 1.00 0.00 C ATOM 861 CE1 TYR A 56 -1.111 -5.353 -23.941 1.00 0.00 C ATOM 862 CE2 TYR A 56 -2.193 -6.973 -22.557 1.00 0.00 C ATOM 863 CZ TYR A 56 -2.186 -6.175 -23.678 1.00 0.00 C ATOM 864 OH TYR A 56 -3.258 -6.196 -24.542 1.00 0.00 O ATOM 0 H TYR A 56 2.814 -5.780 -19.183 1.00 0.00 H new ATOM 0 HA TYR A 56 1.628 -4.010 -21.059 1.00 0.00 H new ATOM 0 HB2 TYR A 56 2.062 -6.366 -21.532 1.00 0.00 H new ATOM 0 HB3 TYR A 56 1.013 -6.865 -20.220 1.00 0.00 H new ATOM 0 HD1 TYR A 56 0.804 -4.688 -23.283 1.00 0.00 H new ATOM 0 HD2 TYR A 56 -1.126 -7.576 -20.814 1.00 0.00 H new ATOM 0 HE1 TYR A 56 -1.109 -4.728 -24.821 1.00 0.00 H new ATOM 0 HE2 TYR A 56 -3.037 -7.616 -22.354 1.00 0.00 H new ATOM 0 HH TYR A 56 -3.931 -6.828 -24.213 1.00 0.00 H new ATOM 874 N SER A 57 -0.141 -4.830 -18.412 1.00 0.00 N ATOM 875 CA SER A 57 -1.304 -4.463 -17.616 1.00 0.00 C ATOM 876 C SER A 57 -1.220 -2.999 -17.185 1.00 0.00 C ATOM 877 O SER A 57 -2.237 -2.351 -16.920 1.00 0.00 O ATOM 878 CB SER A 57 -1.387 -5.364 -16.386 1.00 0.00 C ATOM 879 OG SER A 57 -1.278 -6.732 -16.748 1.00 0.00 O ATOM 0 H SER A 57 0.466 -5.521 -17.972 1.00 0.00 H new ATOM 0 HA SER A 57 -2.200 -4.593 -18.223 1.00 0.00 H new ATOM 0 HB2 SER A 57 -0.592 -5.105 -15.687 1.00 0.00 H new ATOM 0 HB3 SER A 57 -2.332 -5.195 -15.870 1.00 0.00 H new ATOM 0 HG SER A 57 -1.238 -7.283 -15.938 1.00 0.00 H new ATOM 885 N LEU A 58 0.003 -2.484 -17.127 1.00 0.00 N ATOM 886 CA LEU A 58 0.254 -1.113 -16.710 1.00 0.00 C ATOM 887 C LEU A 58 0.553 -0.226 -17.913 1.00 0.00 C ATOM 888 O LEU A 58 1.073 0.878 -17.758 1.00 0.00 O ATOM 889 CB LEU A 58 1.434 -1.064 -15.735 1.00 0.00 C ATOM 890 CG LEU A 58 1.267 -1.883 -14.452 1.00 0.00 C ATOM 891 CD1 LEU A 58 2.535 -1.819 -13.615 1.00 0.00 C ATOM 892 CD2 LEU A 58 0.072 -1.385 -13.650 1.00 0.00 C ATOM 0 H LEU A 58 0.846 -3.006 -17.368 1.00 0.00 H new ATOM 0 HA LEU A 58 -0.643 -0.742 -16.214 1.00 0.00 H new ATOM 0 HB2 LEU A 58 2.326 -1.414 -16.254 1.00 0.00 H new ATOM 0 HB3 LEU A 58 1.612 -0.024 -15.460 1.00 0.00 H new ATOM 0 HG LEU A 58 1.085 -2.922 -14.727 1.00 0.00 H new ATOM 0 HD11 LEU A 58 2.401 -2.406 -12.706 1.00 0.00 H new ATOM 0 HD12 LEU A 58 3.370 -2.223 -14.188 1.00 0.00 H new ATOM 0 HD13 LEU A 58 2.744 -0.783 -13.350 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -0.030 -1.979 -12.742 1.00 0.00 H new ATOM 0 HD22 LEU A 58 0.223 -0.339 -13.384 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -0.833 -1.480 -14.249 1.00 0.00 H new ATOM 904 N GLN A 59 0.209 -0.698 -19.108 1.00 0.00 N ATOM 905 CA GLN A 59 0.487 0.048 -20.335 1.00 0.00 C ATOM 906 C GLN A 59 -0.186 1.420 -20.299 1.00 0.00 C ATOM 907 O GLN A 59 0.393 2.420 -20.726 1.00 0.00 O ATOM 908 CB GLN A 59 0.019 -0.744 -21.558 1.00 0.00 C ATOM 909 CG GLN A 59 0.483 -0.156 -22.881 1.00 0.00 C ATOM 910 CD GLN A 59 -0.047 -0.923 -24.075 1.00 0.00 C ATOM 911 OE1 GLN A 59 -1.115 -0.610 -24.602 1.00 0.00 O ATOM 912 NE2 GLN A 59 0.687 -1.937 -24.504 1.00 0.00 N ATOM 0 H GLN A 59 -0.262 -1.591 -19.254 1.00 0.00 H new ATOM 0 HA GLN A 59 1.564 0.198 -20.408 1.00 0.00 H new ATOM 0 HB2 GLN A 59 0.384 -1.768 -21.478 1.00 0.00 H new ATOM 0 HB3 GLN A 59 -1.070 -0.792 -21.554 1.00 0.00 H new ATOM 0 HG2 GLN A 59 0.158 0.882 -22.947 1.00 0.00 H new ATOM 0 HG3 GLN A 59 1.573 -0.152 -22.911 1.00 0.00 H new ATOM 0 HE21 GLN A 59 1.566 -2.163 -24.039 1.00 0.00 H new ATOM 0 HE22 GLN A 59 0.374 -2.493 -25.300 1.00 0.00 H new ATOM 921 N ARG A 60 -1.404 1.461 -19.768 1.00 0.00 N ATOM 922 CA ARG A 60 -2.125 2.718 -19.604 1.00 0.00 C ATOM 923 C ARG A 60 -1.465 3.580 -18.527 1.00 0.00 C ATOM 924 O ARG A 60 -1.523 4.807 -18.576 1.00 0.00 O ATOM 925 CB ARG A 60 -3.597 2.452 -19.263 1.00 0.00 C ATOM 926 CG ARG A 60 -4.355 3.684 -18.791 1.00 0.00 C ATOM 927 CD ARG A 60 -5.854 3.532 -18.981 1.00 0.00 C ATOM 928 NE ARG A 60 -6.236 3.674 -20.386 1.00 0.00 N ATOM 929 CZ ARG A 60 -7.401 3.274 -20.894 1.00 0.00 C ATOM 930 NH1 ARG A 60 -8.285 2.641 -20.133 1.00 0.00 N ATOM 931 NH2 ARG A 60 -7.675 3.498 -22.170 1.00 0.00 N ATOM 0 H ARG A 60 -1.912 0.638 -19.444 1.00 0.00 H new ATOM 0 HA ARG A 60 -2.086 3.264 -20.547 1.00 0.00 H new ATOM 0 HB2 ARG A 60 -4.096 2.046 -20.143 1.00 0.00 H new ATOM 0 HB3 ARG A 60 -3.647 1.688 -18.487 1.00 0.00 H new ATOM 0 HG2 ARG A 60 -4.139 3.862 -17.738 1.00 0.00 H new ATOM 0 HG3 ARG A 60 -4.006 4.558 -19.341 1.00 0.00 H new ATOM 0 HD2 ARG A 60 -6.171 2.556 -18.614 1.00 0.00 H new ATOM 0 HD3 ARG A 60 -6.375 4.281 -18.384 1.00 0.00 H new ATOM 0 HE ARG A 60 -5.565 4.109 -21.020 1.00 0.00 H new ATOM 0 HH11 ARG A 60 -8.075 2.458 -19.152 1.00 0.00 H new ATOM 0 HH12 ARG A 60 -9.175 2.338 -20.529 1.00 0.00 H new ATOM 0 HH21 ARG A 60 -6.995 3.976 -22.761 1.00 0.00 H new ATOM 0 HH22 ARG A 60 -8.566 3.193 -22.561 1.00 0.00 H new ATOM 945 N VAL A 61 -0.811 2.930 -17.577 1.00 0.00 N ATOM 946 CA VAL A 61 -0.122 3.634 -16.504 1.00 0.00 C ATOM 947 C VAL A 61 1.113 4.349 -17.045 1.00 0.00 C ATOM 948 O VAL A 61 1.429 5.456 -16.620 1.00 0.00 O ATOM 949 CB VAL A 61 0.277 2.673 -15.361 1.00 0.00 C ATOM 950 CG1 VAL A 61 1.024 3.410 -14.259 1.00 0.00 C ATOM 951 CG2 VAL A 61 -0.954 1.975 -14.800 1.00 0.00 C ATOM 0 H VAL A 61 -0.742 1.914 -17.526 1.00 0.00 H new ATOM 0 HA VAL A 61 -0.812 4.373 -16.096 1.00 0.00 H new ATOM 0 HB VAL A 61 0.948 1.919 -15.772 1.00 0.00 H new ATOM 0 HG11 VAL A 61 1.292 2.708 -13.469 1.00 0.00 H new ATOM 0 HG12 VAL A 61 1.929 3.857 -14.669 1.00 0.00 H new ATOM 0 HG13 VAL A 61 0.387 4.193 -13.848 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -0.656 1.302 -13.996 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -1.649 2.719 -14.411 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -1.440 1.403 -15.591 1.00 0.00 H new ATOM 961 N PHE A 62 1.799 3.716 -17.995 1.00 0.00 N ATOM 962 CA PHE A 62 2.928 4.352 -18.670 1.00 0.00 C ATOM 963 C PHE A 62 2.444 5.549 -19.481 1.00 0.00 C ATOM 964 O PHE A 62 3.082 6.600 -19.508 1.00 0.00 O ATOM 965 CB PHE A 62 3.643 3.371 -19.608 1.00 0.00 C ATOM 966 CG PHE A 62 4.383 2.258 -18.916 1.00 0.00 C ATOM 967 CD1 PHE A 62 5.588 2.501 -18.276 1.00 0.00 C ATOM 968 CD2 PHE A 62 3.886 0.965 -18.931 1.00 0.00 C ATOM 969 CE1 PHE A 62 6.281 1.474 -17.662 1.00 0.00 C ATOM 970 CE2 PHE A 62 4.571 -0.064 -18.315 1.00 0.00 C ATOM 971 CZ PHE A 62 5.770 0.189 -17.680 1.00 0.00 C ATOM 0 H PHE A 62 1.594 2.769 -18.313 1.00 0.00 H new ATOM 0 HA PHE A 62 3.630 4.678 -17.903 1.00 0.00 H new ATOM 0 HB2 PHE A 62 2.907 2.934 -20.283 1.00 0.00 H new ATOM 0 HB3 PHE A 62 4.348 3.929 -20.224 1.00 0.00 H new ATOM 0 HD1 PHE A 62 5.990 3.503 -18.257 1.00 0.00 H new ATOM 0 HD2 PHE A 62 2.951 0.759 -19.431 1.00 0.00 H new ATOM 0 HE1 PHE A 62 7.221 1.675 -17.169 1.00 0.00 H new ATOM 0 HE2 PHE A 62 4.169 -1.066 -18.330 1.00 0.00 H new ATOM 0 HZ PHE A 62 6.308 -0.614 -17.198 1.00 0.00 H new ATOM 981 N ASP A 63 1.302 5.373 -20.137 1.00 0.00 N ATOM 982 CA ASP A 63 0.730 6.407 -20.998 1.00 0.00 C ATOM 983 C ASP A 63 0.230 7.598 -20.184 1.00 0.00 C ATOM 984 O ASP A 63 0.424 8.750 -20.564 1.00 0.00 O ATOM 985 CB ASP A 63 -0.421 5.827 -21.826 1.00 0.00 C ATOM 986 CG ASP A 63 -1.103 6.871 -22.688 1.00 0.00 C ATOM 987 OD1 ASP A 63 -0.484 7.337 -23.669 1.00 0.00 O ATOM 988 OD2 ASP A 63 -2.266 7.224 -22.398 1.00 0.00 O ATOM 0 H ASP A 63 0.749 4.517 -20.089 1.00 0.00 H new ATOM 0 HA ASP A 63 1.518 6.757 -21.665 1.00 0.00 H new ATOM 0 HB2 ASP A 63 -0.039 5.029 -22.462 1.00 0.00 H new ATOM 0 HB3 ASP A 63 -1.155 5.378 -21.157 1.00 0.00 H new ATOM 993 N ASN A 64 -0.407 7.314 -19.060 1.00 0.00 N ATOM 994 CA ASN A 64 -0.968 8.359 -18.209 1.00 0.00 C ATOM 995 C ASN A 64 -0.013 8.717 -17.075 1.00 0.00 C ATOM 996 O ASN A 64 -0.408 9.353 -16.098 1.00 0.00 O ATOM 997 CB ASN A 64 -2.316 7.908 -17.636 1.00 0.00 C ATOM 998 CG ASN A 64 -3.412 7.833 -18.688 1.00 0.00 C ATOM 999 OD1 ASN A 64 -4.286 6.967 -18.631 1.00 0.00 O ATOM 1000 ND2 ASN A 64 -3.385 8.745 -19.649 1.00 0.00 N ATOM 0 H ASN A 64 -0.551 6.366 -18.712 1.00 0.00 H new ATOM 0 HA ASN A 64 -1.118 9.248 -18.822 1.00 0.00 H new ATOM 0 HB2 ASN A 64 -2.198 6.929 -17.171 1.00 0.00 H new ATOM 0 HB3 ASN A 64 -2.620 8.599 -16.850 1.00 0.00 H new ATOM 0 HD21 ASN A 64 -4.104 8.744 -20.373 1.00 0.00 H new ATOM 0 HD22 ASN A 64 -2.646 9.448 -19.665 1.00 0.00 H new ATOM 1007 N ALA A 65 1.251 8.335 -17.232 1.00 0.00 N ATOM 1008 CA ALA A 65 2.266 8.557 -16.204 1.00 0.00 C ATOM 1009 C ALA A 65 2.529 10.041 -15.971 1.00 0.00 C ATOM 1010 O ALA A 65 3.117 10.421 -14.959 1.00 0.00 O ATOM 1011 CB ALA A 65 3.560 7.856 -16.582 1.00 0.00 C ATOM 0 H ALA A 65 1.600 7.866 -18.068 1.00 0.00 H new ATOM 0 HA ALA A 65 1.882 8.138 -15.274 1.00 0.00 H new ATOM 0 HB1 ALA A 65 4.307 8.030 -15.808 1.00 0.00 H new ATOM 0 HB2 ALA A 65 3.379 6.785 -16.678 1.00 0.00 H new ATOM 0 HB3 ALA A 65 3.923 8.249 -17.531 1.00 0.00 H new ATOM 1017 N ASN A 66 2.090 10.874 -16.906 1.00 0.00 N ATOM 1018 CA ASN A 66 2.287 12.317 -16.801 1.00 0.00 C ATOM 1019 C ASN A 66 1.514 12.883 -15.616 1.00 0.00 C ATOM 1020 O ASN A 66 1.942 13.846 -14.986 1.00 0.00 O ATOM 1021 CB ASN A 66 1.848 13.020 -18.090 1.00 0.00 C ATOM 1022 CG ASN A 66 2.583 12.506 -19.313 1.00 0.00 C ATOM 1023 OD1 ASN A 66 2.124 11.581 -19.983 1.00 0.00 O ATOM 1024 ND2 ASN A 66 3.733 13.091 -19.606 1.00 0.00 N ATOM 0 H ASN A 66 1.595 10.576 -17.747 1.00 0.00 H new ATOM 0 HA ASN A 66 3.351 12.498 -16.646 1.00 0.00 H new ATOM 0 HB2 ASN A 66 0.776 12.880 -18.229 1.00 0.00 H new ATOM 0 HB3 ASN A 66 2.019 14.092 -17.991 1.00 0.00 H new ATOM 0 HD21 ASN A 66 4.273 12.778 -20.413 1.00 0.00 H new ATOM 0 HD22 ASN A 66 4.079 13.855 -19.025 1.00 0.00 H new ATOM 1031 N ALA A 67 0.380 12.265 -15.308 1.00 0.00 N ATOM 1032 CA ALA A 67 -0.451 12.706 -14.195 1.00 0.00 C ATOM 1033 C ALA A 67 -0.159 11.888 -12.945 1.00 0.00 C ATOM 1034 O ALA A 67 -0.694 12.159 -11.870 1.00 0.00 O ATOM 1035 CB ALA A 67 -1.925 12.597 -14.559 1.00 0.00 C ATOM 0 H ALA A 67 0.015 11.457 -15.813 1.00 0.00 H new ATOM 0 HA ALA A 67 -0.215 13.750 -13.987 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -2.533 12.930 -13.718 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -2.133 13.223 -15.427 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -2.166 11.560 -14.793 1.00 0.00 H new ATOM 1041 N ILE A 68 0.696 10.890 -13.088 1.00 0.00 N ATOM 1042 CA ILE A 68 0.984 9.977 -11.997 1.00 0.00 C ATOM 1043 C ILE A 68 2.376 10.221 -11.427 1.00 0.00 C ATOM 1044 O ILE A 68 3.386 9.980 -12.089 1.00 0.00 O ATOM 1045 CB ILE A 68 0.873 8.504 -12.450 1.00 0.00 C ATOM 1046 CG1 ILE A 68 -0.518 8.228 -13.028 1.00 0.00 C ATOM 1047 CG2 ILE A 68 1.161 7.566 -11.284 1.00 0.00 C ATOM 1048 CD1 ILE A 68 -0.676 6.831 -13.594 1.00 0.00 C ATOM 0 H ILE A 68 1.203 10.692 -13.950 1.00 0.00 H new ATOM 0 HA ILE A 68 0.241 10.167 -11.222 1.00 0.00 H new ATOM 0 HB ILE A 68 1.614 8.324 -13.229 1.00 0.00 H new ATOM 0 HG12 ILE A 68 -1.263 8.381 -12.247 1.00 0.00 H new ATOM 0 HG13 ILE A 68 -0.726 8.954 -13.814 1.00 0.00 H new ATOM 0 HG21 ILE A 68 1.079 6.532 -11.620 1.00 0.00 H new ATOM 0 HG22 ILE A 68 2.169 7.747 -10.912 1.00 0.00 H new ATOM 0 HG23 ILE A 68 0.441 7.747 -10.485 1.00 0.00 H new ATOM 0 HD11 ILE A 68 -1.686 6.709 -13.985 1.00 0.00 H new ATOM 0 HD12 ILE A 68 0.045 6.680 -14.398 1.00 0.00 H new ATOM 0 HD13 ILE A 68 -0.501 6.098 -12.807 1.00 0.00 H new ATOM 1060 N ASP A 69 2.421 10.726 -10.207 1.00 0.00 N ATOM 1061 CA ASP A 69 3.674 10.843 -9.476 1.00 0.00 C ATOM 1062 C ASP A 69 3.795 9.681 -8.511 1.00 0.00 C ATOM 1063 O ASP A 69 4.691 8.850 -8.627 1.00 0.00 O ATOM 1064 CB ASP A 69 3.741 12.163 -8.707 1.00 0.00 C ATOM 1065 CG ASP A 69 4.945 12.238 -7.785 1.00 0.00 C ATOM 1066 OD1 ASP A 69 4.860 11.737 -6.643 1.00 0.00 O ATOM 1067 OD2 ASP A 69 5.976 12.803 -8.198 1.00 0.00 O ATOM 0 H ASP A 69 1.603 11.063 -9.699 1.00 0.00 H new ATOM 0 HA ASP A 69 4.498 10.825 -10.189 1.00 0.00 H new ATOM 0 HB2 ASP A 69 3.777 12.991 -9.415 1.00 0.00 H new ATOM 0 HB3 ASP A 69 2.830 12.285 -8.121 1.00 0.00 H new ATOM 1072 N THR A 70 2.861 9.620 -7.576 1.00 0.00 N ATOM 1073 CA THR A 70 2.822 8.548 -6.602 1.00 0.00 C ATOM 1074 C THR A 70 1.706 7.568 -6.955 1.00 0.00 C ATOM 1075 O THR A 70 0.527 7.930 -6.967 1.00 0.00 O ATOM 1076 CB THR A 70 2.605 9.100 -5.179 1.00 0.00 C ATOM 1077 OG1 THR A 70 3.622 10.065 -4.865 1.00 0.00 O ATOM 1078 CG2 THR A 70 2.631 7.980 -4.145 1.00 0.00 C ATOM 0 H THR A 70 2.115 10.308 -7.473 1.00 0.00 H new ATOM 0 HA THR A 70 3.781 8.030 -6.624 1.00 0.00 H new ATOM 0 HB THR A 70 1.625 9.577 -5.149 1.00 0.00 H new ATOM 0 HG1 THR A 70 3.930 10.496 -5.690 1.00 0.00 H new ATOM 0 HG21 THR A 70 2.475 8.399 -3.151 1.00 0.00 H new ATOM 0 HG22 THR A 70 1.840 7.263 -4.365 1.00 0.00 H new ATOM 0 HG23 THR A 70 3.597 7.476 -4.179 1.00 0.00 H new ATOM 1086 N LEU A 71 2.085 6.340 -7.265 1.00 0.00 N ATOM 1087 CA LEU A 71 1.129 5.307 -7.621 1.00 0.00 C ATOM 1088 C LEU A 71 0.966 4.327 -6.469 1.00 0.00 C ATOM 1089 O LEU A 71 1.857 3.521 -6.191 1.00 0.00 O ATOM 1090 CB LEU A 71 1.581 4.569 -8.885 1.00 0.00 C ATOM 1091 CG LEU A 71 0.647 3.453 -9.366 1.00 0.00 C ATOM 1092 CD1 LEU A 71 -0.729 4.007 -9.700 1.00 0.00 C ATOM 1093 CD2 LEU A 71 1.243 2.744 -10.573 1.00 0.00 C ATOM 0 H LEU A 71 3.058 6.033 -7.277 1.00 0.00 H new ATOM 0 HA LEU A 71 0.167 5.778 -7.823 1.00 0.00 H new ATOM 0 HB2 LEU A 71 1.694 5.296 -9.689 1.00 0.00 H new ATOM 0 HB3 LEU A 71 2.567 4.141 -8.702 1.00 0.00 H new ATOM 0 HG LEU A 71 0.536 2.729 -8.558 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -1.375 3.197 -10.039 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -1.161 4.468 -8.812 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -0.639 4.754 -10.489 1.00 0.00 H new ATOM 0 HD21 LEU A 71 0.567 1.955 -10.902 1.00 0.00 H new ATOM 0 HD22 LEU A 71 1.385 3.460 -11.382 1.00 0.00 H new ATOM 0 HD23 LEU A 71 2.204 2.308 -10.301 1.00 0.00 H new ATOM 1105 N ILE A 72 -0.165 4.417 -5.795 1.00 0.00 N ATOM 1106 CA ILE A 72 -0.462 3.545 -4.676 1.00 0.00 C ATOM 1107 C ILE A 72 -1.272 2.353 -5.160 1.00 0.00 C ATOM 1108 O ILE A 72 -2.379 2.511 -5.676 1.00 0.00 O ATOM 1109 CB ILE A 72 -1.249 4.288 -3.578 1.00 0.00 C ATOM 1110 CG1 ILE A 72 -0.528 5.583 -3.189 1.00 0.00 C ATOM 1111 CG2 ILE A 72 -1.433 3.393 -2.363 1.00 0.00 C ATOM 1112 CD1 ILE A 72 -1.282 6.421 -2.178 1.00 0.00 C ATOM 0 H ILE A 72 -0.899 5.093 -6.007 1.00 0.00 H new ATOM 0 HA ILE A 72 0.483 3.208 -4.250 1.00 0.00 H new ATOM 0 HB ILE A 72 -2.233 4.546 -3.968 1.00 0.00 H new ATOM 0 HG12 ILE A 72 0.452 5.334 -2.782 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -0.359 6.178 -4.087 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -1.990 3.931 -1.596 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -1.984 2.497 -2.651 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -0.457 3.108 -1.970 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -0.710 7.321 -1.952 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -2.252 6.701 -2.589 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -1.428 5.845 -1.264 1.00 0.00 H new ATOM 1124 N VAL A 73 -0.715 1.166 -5.014 1.00 0.00 N ATOM 1125 CA VAL A 73 -1.379 -0.042 -5.469 1.00 0.00 C ATOM 1126 C VAL A 73 -1.893 -0.853 -4.289 1.00 0.00 C ATOM 1127 O VAL A 73 -1.155 -1.115 -3.338 1.00 0.00 O ATOM 1128 CB VAL A 73 -0.437 -0.920 -6.324 1.00 0.00 C ATOM 1129 CG1 VAL A 73 -1.146 -2.179 -6.801 1.00 0.00 C ATOM 1130 CG2 VAL A 73 0.097 -0.130 -7.507 1.00 0.00 C ATOM 0 H VAL A 73 0.197 1.012 -4.583 1.00 0.00 H new ATOM 0 HA VAL A 73 -2.221 0.269 -6.088 1.00 0.00 H new ATOM 0 HB VAL A 73 0.403 -1.222 -5.699 1.00 0.00 H new ATOM 0 HG11 VAL A 73 -0.460 -2.778 -7.400 1.00 0.00 H new ATOM 0 HG12 VAL A 73 -1.477 -2.759 -5.939 1.00 0.00 H new ATOM 0 HG13 VAL A 73 -2.010 -1.903 -7.406 1.00 0.00 H new ATOM 0 HG21 VAL A 73 0.759 -0.763 -8.098 1.00 0.00 H new ATOM 0 HG22 VAL A 73 -0.735 0.204 -8.127 1.00 0.00 H new ATOM 0 HG23 VAL A 73 0.651 0.736 -7.146 1.00 0.00 H new ATOM 1140 N GLY A 74 -3.162 -1.226 -4.352 1.00 0.00 N ATOM 1141 CA GLY A 74 -3.748 -2.074 -3.339 1.00 0.00 C ATOM 1142 C GLY A 74 -3.985 -3.468 -3.873 1.00 0.00 C ATOM 1143 O GLY A 74 -4.834 -3.665 -4.742 1.00 0.00 O ATOM 0 H GLY A 74 -3.802 -0.952 -5.097 1.00 0.00 H new ATOM 0 HA2 GLY A 74 -3.089 -2.120 -2.472 1.00 0.00 H new ATOM 0 HA3 GLY A 74 -4.691 -1.645 -3.001 1.00 0.00 H new ATOM 1147 N THR A 75 -3.224 -4.427 -3.366 1.00 0.00 N ATOM 1148 CA THR A 75 -3.272 -5.796 -3.859 1.00 0.00 C ATOM 1149 C THR A 75 -4.557 -6.507 -3.445 1.00 0.00 C ATOM 1150 O THR A 75 -5.105 -7.312 -4.196 1.00 0.00 O ATOM 1151 CB THR A 75 -2.057 -6.589 -3.350 1.00 0.00 C ATOM 1152 OG1 THR A 75 -1.914 -6.413 -1.930 1.00 0.00 O ATOM 1153 CG2 THR A 75 -0.790 -6.125 -4.051 1.00 0.00 C ATOM 0 H THR A 75 -2.560 -4.280 -2.606 1.00 0.00 H new ATOM 0 HA THR A 75 -3.250 -5.748 -4.948 1.00 0.00 H new ATOM 0 HB THR A 75 -2.217 -7.645 -3.569 1.00 0.00 H new ATOM 0 HG1 THR A 75 -2.203 -7.228 -1.469 1.00 0.00 H new ATOM 0 HG21 THR A 75 0.061 -6.696 -3.680 1.00 0.00 H new ATOM 0 HG22 THR A 75 -0.891 -6.281 -5.125 1.00 0.00 H new ATOM 0 HG23 THR A 75 -0.631 -5.065 -3.851 1.00 0.00 H new ATOM 1161 N GLY A 76 -5.031 -6.205 -2.245 1.00 0.00 N ATOM 1162 CA GLY A 76 -6.235 -6.828 -1.747 1.00 0.00 C ATOM 1163 C GLY A 76 -6.207 -6.964 -0.243 1.00 0.00 C ATOM 1164 O GLY A 76 -5.962 -5.985 0.469 1.00 0.00 O ATOM 0 H GLY A 76 -4.600 -5.537 -1.607 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -7.101 -6.237 -2.044 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -6.351 -7.813 -2.200 1.00 0.00 H new ATOM 1168 N ALA A 77 -6.449 -8.175 0.239 1.00 0.00 N ATOM 1169 CA ALA A 77 -6.400 -8.454 1.667 1.00 0.00 C ATOM 1170 C ALA A 77 -4.986 -8.826 2.065 1.00 0.00 C ATOM 1171 O ALA A 77 -4.438 -8.312 3.040 1.00 0.00 O ATOM 1172 CB ALA A 77 -7.355 -9.580 2.029 1.00 0.00 C ATOM 0 H ALA A 77 -6.682 -8.982 -0.340 1.00 0.00 H new ATOM 0 HA ALA A 77 -6.706 -7.559 2.208 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -7.302 -9.772 3.101 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -8.372 -9.294 1.761 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -7.076 -10.482 1.485 1.00 0.00 H new ATOM 1178 N ASP A 78 -4.401 -9.719 1.290 1.00 0.00 N ATOM 1179 CA ASP A 78 -3.032 -10.138 1.497 1.00 0.00 C ATOM 1180 C ASP A 78 -2.093 -9.128 0.865 1.00 0.00 C ATOM 1181 O ASP A 78 -2.501 -8.331 0.014 1.00 0.00 O ATOM 1182 CB ASP A 78 -2.807 -11.533 0.905 1.00 0.00 C ATOM 1183 CG ASP A 78 -3.084 -11.597 -0.587 1.00 0.00 C ATOM 1184 OD1 ASP A 78 -4.228 -11.297 -0.993 1.00 0.00 O ATOM 1185 OD2 ASP A 78 -2.162 -11.968 -1.345 1.00 0.00 O ATOM 0 H ASP A 78 -4.862 -10.172 0.501 1.00 0.00 H new ATOM 0 HA ASP A 78 -2.828 -10.189 2.567 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -1.777 -11.839 1.091 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -3.450 -12.248 1.419 1.00 0.00 H new ATOM 1190 N VAL A 79 -0.844 -9.138 1.293 1.00 0.00 N ATOM 1191 CA VAL A 79 0.121 -8.183 0.790 1.00 0.00 C ATOM 1192 C VAL A 79 1.073 -8.860 -0.198 1.00 0.00 C ATOM 1193 O VAL A 79 1.845 -9.754 0.156 1.00 0.00 O ATOM 1194 CB VAL A 79 0.895 -7.490 1.945 1.00 0.00 C ATOM 1195 CG1 VAL A 79 1.722 -8.478 2.752 1.00 0.00 C ATOM 1196 CG2 VAL A 79 1.767 -6.366 1.417 1.00 0.00 C ATOM 0 H VAL A 79 -0.477 -9.793 1.983 1.00 0.00 H new ATOM 0 HA VAL A 79 -0.421 -7.400 0.259 1.00 0.00 H new ATOM 0 HB VAL A 79 0.151 -7.064 2.618 1.00 0.00 H new ATOM 0 HG11 VAL A 79 2.246 -7.949 3.548 1.00 0.00 H new ATOM 0 HG12 VAL A 79 1.066 -9.232 3.187 1.00 0.00 H new ATOM 0 HG13 VAL A 79 2.448 -8.963 2.100 1.00 0.00 H new ATOM 0 HG21 VAL A 79 2.298 -5.897 2.246 1.00 0.00 H new ATOM 0 HG22 VAL A 79 2.488 -6.768 0.705 1.00 0.00 H new ATOM 0 HG23 VAL A 79 1.142 -5.624 0.920 1.00 0.00 H new ATOM 1206 N TRP A 80 0.978 -8.456 -1.454 1.00 0.00 N ATOM 1207 CA TRP A 80 1.802 -9.031 -2.502 1.00 0.00 C ATOM 1208 C TRP A 80 2.990 -8.125 -2.791 1.00 0.00 C ATOM 1209 O TRP A 80 2.825 -6.936 -3.065 1.00 0.00 O ATOM 1210 CB TRP A 80 0.963 -9.258 -3.765 1.00 0.00 C ATOM 1211 CG TRP A 80 1.734 -9.805 -4.929 1.00 0.00 C ATOM 1212 CD1 TRP A 80 2.204 -11.076 -5.081 1.00 0.00 C ATOM 1213 CD2 TRP A 80 2.109 -9.092 -6.113 1.00 0.00 C ATOM 1214 NE1 TRP A 80 2.853 -11.198 -6.286 1.00 0.00 N ATOM 1215 CE2 TRP A 80 2.807 -9.992 -6.937 1.00 0.00 C ATOM 1216 CE3 TRP A 80 1.922 -7.780 -6.555 1.00 0.00 C ATOM 1217 CZ2 TRP A 80 3.319 -9.622 -8.179 1.00 0.00 C ATOM 1218 CZ3 TRP A 80 2.430 -7.414 -7.787 1.00 0.00 C ATOM 1219 CH2 TRP A 80 3.120 -8.333 -8.587 1.00 0.00 C ATOM 0 H TRP A 80 0.336 -7.730 -1.772 1.00 0.00 H new ATOM 0 HA TRP A 80 2.184 -9.996 -2.168 1.00 0.00 H new ATOM 0 HB2 TRP A 80 0.150 -9.944 -3.528 1.00 0.00 H new ATOM 0 HB3 TRP A 80 0.507 -8.313 -4.059 1.00 0.00 H new ATOM 0 HD1 TRP A 80 2.084 -11.871 -4.360 1.00 0.00 H new ATOM 0 HE1 TRP A 80 3.296 -12.046 -6.638 1.00 0.00 H new ATOM 0 HE3 TRP A 80 1.390 -7.065 -5.945 1.00 0.00 H new ATOM 0 HZ2 TRP A 80 3.854 -10.328 -8.797 1.00 0.00 H new ATOM 0 HZ3 TRP A 80 2.292 -6.402 -8.139 1.00 0.00 H new ATOM 0 HH2 TRP A 80 3.503 -8.017 -9.546 1.00 0.00 H new ATOM 1230 N ILE A 81 4.186 -8.688 -2.699 1.00 0.00 N ATOM 1231 CA ILE A 81 5.407 -7.937 -2.948 1.00 0.00 C ATOM 1232 C ILE A 81 5.747 -7.968 -4.435 1.00 0.00 C ATOM 1233 O ILE A 81 5.956 -9.035 -5.014 1.00 0.00 O ATOM 1234 CB ILE A 81 6.611 -8.479 -2.124 1.00 0.00 C ATOM 1235 CG1 ILE A 81 6.419 -8.224 -0.620 1.00 0.00 C ATOM 1236 CG2 ILE A 81 7.918 -7.852 -2.595 1.00 0.00 C ATOM 1237 CD1 ILE A 81 5.416 -9.139 0.049 1.00 0.00 C ATOM 0 H ILE A 81 4.337 -9.666 -2.453 1.00 0.00 H new ATOM 0 HA ILE A 81 5.225 -6.910 -2.630 1.00 0.00 H new ATOM 0 HB ILE A 81 6.659 -9.556 -2.287 1.00 0.00 H new ATOM 0 HG12 ILE A 81 7.381 -8.333 -0.120 1.00 0.00 H new ATOM 0 HG13 ILE A 81 6.101 -7.191 -0.477 1.00 0.00 H new ATOM 0 HG21 ILE A 81 8.745 -8.247 -2.004 1.00 0.00 H new ATOM 0 HG22 ILE A 81 8.078 -8.090 -3.647 1.00 0.00 H new ATOM 0 HG23 ILE A 81 7.868 -6.770 -2.472 1.00 0.00 H new ATOM 0 HD11 ILE A 81 5.344 -8.888 1.107 1.00 0.00 H new ATOM 0 HD12 ILE A 81 4.440 -9.014 -0.420 1.00 0.00 H new ATOM 0 HD13 ILE A 81 5.740 -10.174 -0.058 1.00 0.00 H new ATOM 1249 N ALA A 82 5.792 -6.798 -5.047 1.00 0.00 N ATOM 1250 CA ALA A 82 6.079 -6.691 -6.466 1.00 0.00 C ATOM 1251 C ALA A 82 7.579 -6.572 -6.705 1.00 0.00 C ATOM 1252 O ALA A 82 8.296 -5.957 -5.910 1.00 0.00 O ATOM 1253 CB ALA A 82 5.350 -5.497 -7.060 1.00 0.00 C ATOM 0 H ALA A 82 5.633 -5.905 -4.581 1.00 0.00 H new ATOM 0 HA ALA A 82 5.727 -7.597 -6.959 1.00 0.00 H new ATOM 0 HB1 ALA A 82 5.573 -5.427 -8.125 1.00 0.00 H new ATOM 0 HB2 ALA A 82 4.276 -5.621 -6.922 1.00 0.00 H new ATOM 0 HB3 ALA A 82 5.677 -4.585 -6.560 1.00 0.00 H new ATOM 1259 N PRO A 83 8.078 -7.181 -7.792 1.00 0.00 N ATOM 1260 CA PRO A 83 9.490 -7.098 -8.167 1.00 0.00 C ATOM 1261 C PRO A 83 9.918 -5.663 -8.464 1.00 0.00 C ATOM 1262 O PRO A 83 9.247 -4.939 -9.214 1.00 0.00 O ATOM 1263 CB PRO A 83 9.585 -7.956 -9.434 1.00 0.00 C ATOM 1264 CG PRO A 83 8.369 -8.818 -9.414 1.00 0.00 C ATOM 1265 CD PRO A 83 7.307 -8.008 -8.733 1.00 0.00 C ATOM 0 HA PRO A 83 10.144 -7.438 -7.364 1.00 0.00 H new ATOM 0 HB2 PRO A 83 9.613 -7.335 -10.329 1.00 0.00 H new ATOM 0 HB3 PRO A 83 10.494 -8.557 -9.435 1.00 0.00 H new ATOM 0 HG2 PRO A 83 8.066 -9.090 -10.425 1.00 0.00 H new ATOM 0 HG3 PRO A 83 8.557 -9.747 -8.877 1.00 0.00 H new ATOM 0 HD2 PRO A 83 6.747 -7.398 -9.442 1.00 0.00 H new ATOM 0 HD3 PRO A 83 6.585 -8.641 -8.217 1.00 0.00 H new ATOM 1273 N ARG A 84 11.037 -5.254 -7.875 1.00 0.00 N ATOM 1274 CA ARG A 84 11.564 -3.909 -8.079 1.00 0.00 C ATOM 1275 C ARG A 84 11.831 -3.652 -9.554 1.00 0.00 C ATOM 1276 O ARG A 84 11.837 -2.515 -9.993 1.00 0.00 O ATOM 1277 CB ARG A 84 12.856 -3.695 -7.294 1.00 0.00 C ATOM 1278 CG ARG A 84 13.212 -2.226 -7.117 1.00 0.00 C ATOM 1279 CD ARG A 84 14.707 -2.022 -6.945 1.00 0.00 C ATOM 1280 NE ARG A 84 15.426 -2.180 -8.211 1.00 0.00 N ATOM 1281 CZ ARG A 84 16.647 -2.702 -8.315 1.00 0.00 C ATOM 1282 NH1 ARG A 84 17.268 -3.174 -7.242 1.00 0.00 N ATOM 1283 NH2 ARG A 84 17.244 -2.759 -9.499 1.00 0.00 N ATOM 0 H ARG A 84 11.597 -5.835 -7.252 1.00 0.00 H new ATOM 0 HA ARG A 84 10.810 -3.209 -7.718 1.00 0.00 H new ATOM 0 HB2 ARG A 84 12.759 -4.160 -6.313 1.00 0.00 H new ATOM 0 HB3 ARG A 84 13.674 -4.201 -7.807 1.00 0.00 H new ATOM 0 HG2 ARG A 84 12.866 -1.662 -7.983 1.00 0.00 H new ATOM 0 HG3 ARG A 84 12.689 -1.828 -6.247 1.00 0.00 H new ATOM 0 HD2 ARG A 84 14.894 -1.027 -6.542 1.00 0.00 H new ATOM 0 HD3 ARG A 84 15.090 -2.737 -6.217 1.00 0.00 H new ATOM 0 HE ARG A 84 14.963 -1.871 -9.066 1.00 0.00 H new ATOM 0 HH11 ARG A 84 16.811 -3.138 -6.331 1.00 0.00 H new ATOM 0 HH12 ARG A 84 18.203 -3.573 -7.328 1.00 0.00 H new ATOM 0 HH21 ARG A 84 16.768 -2.403 -10.328 1.00 0.00 H new ATOM 0 HH22 ARG A 84 18.179 -3.158 -9.580 1.00 0.00 H new ATOM 1297 N GLN A 85 12.052 -4.719 -10.310 1.00 0.00 N ATOM 1298 CA GLN A 85 12.279 -4.614 -11.747 1.00 0.00 C ATOM 1299 C GLN A 85 11.059 -4.011 -12.440 1.00 0.00 C ATOM 1300 O GLN A 85 11.187 -3.265 -13.411 1.00 0.00 O ATOM 1301 CB GLN A 85 12.594 -5.992 -12.327 1.00 0.00 C ATOM 1302 CG GLN A 85 13.843 -6.615 -11.730 1.00 0.00 C ATOM 1303 CD GLN A 85 14.075 -8.042 -12.187 1.00 0.00 C ATOM 1304 OE1 GLN A 85 14.641 -8.852 -11.451 1.00 0.00 O ATOM 1305 NE2 GLN A 85 13.645 -8.365 -13.396 1.00 0.00 N ATOM 0 H GLN A 85 12.079 -5.673 -9.950 1.00 0.00 H new ATOM 0 HA GLN A 85 13.130 -3.955 -11.920 1.00 0.00 H new ATOM 0 HB2 GLN A 85 11.746 -6.655 -12.155 1.00 0.00 H new ATOM 0 HB3 GLN A 85 12.718 -5.906 -13.407 1.00 0.00 H new ATOM 0 HG2 GLN A 85 14.708 -6.009 -11.999 1.00 0.00 H new ATOM 0 HG3 GLN A 85 13.767 -6.596 -10.643 1.00 0.00 H new ATOM 0 HE21 GLN A 85 13.181 -7.666 -13.976 1.00 0.00 H new ATOM 0 HE22 GLN A 85 13.778 -9.313 -13.748 1.00 0.00 H new ATOM 1314 N LEU A 86 9.875 -4.325 -11.922 1.00 0.00 N ATOM 1315 CA LEU A 86 8.640 -3.754 -12.439 1.00 0.00 C ATOM 1316 C LEU A 86 8.530 -2.296 -12.007 1.00 0.00 C ATOM 1317 O LEU A 86 8.164 -1.425 -12.797 1.00 0.00 O ATOM 1318 CB LEU A 86 7.429 -4.551 -11.940 1.00 0.00 C ATOM 1319 CG LEU A 86 6.069 -4.079 -12.465 1.00 0.00 C ATOM 1320 CD1 LEU A 86 5.991 -4.238 -13.977 1.00 0.00 C ATOM 1321 CD2 LEU A 86 4.943 -4.847 -11.789 1.00 0.00 C ATOM 0 H LEU A 86 9.747 -4.972 -11.144 1.00 0.00 H new ATOM 0 HA LEU A 86 8.655 -3.804 -13.528 1.00 0.00 H new ATOM 0 HB2 LEU A 86 7.564 -5.596 -12.218 1.00 0.00 H new ATOM 0 HB3 LEU A 86 7.413 -4.511 -10.851 1.00 0.00 H new ATOM 0 HG LEU A 86 5.958 -3.021 -12.227 1.00 0.00 H new ATOM 0 HD11 LEU A 86 5.017 -3.897 -14.329 1.00 0.00 H new ATOM 0 HD12 LEU A 86 6.775 -3.644 -14.446 1.00 0.00 H new ATOM 0 HD13 LEU A 86 6.125 -5.287 -14.240 1.00 0.00 H new ATOM 0 HD21 LEU A 86 3.984 -4.500 -12.173 1.00 0.00 H new ATOM 0 HD22 LEU A 86 5.053 -5.911 -11.996 1.00 0.00 H new ATOM 0 HD23 LEU A 86 4.984 -4.681 -10.713 1.00 0.00 H new ATOM 1333 N ARG A 87 8.872 -2.035 -10.746 1.00 0.00 N ATOM 1334 CA ARG A 87 8.878 -0.668 -10.230 1.00 0.00 C ATOM 1335 C ARG A 87 9.897 0.173 -10.991 1.00 0.00 C ATOM 1336 O ARG A 87 9.653 1.336 -11.287 1.00 0.00 O ATOM 1337 CB ARG A 87 9.186 -0.650 -8.721 1.00 0.00 C ATOM 1338 CG ARG A 87 8.981 0.711 -8.053 1.00 0.00 C ATOM 1339 CD ARG A 87 10.149 1.664 -8.286 1.00 0.00 C ATOM 1340 NE ARG A 87 9.696 3.034 -8.553 1.00 0.00 N ATOM 1341 CZ ARG A 87 10.442 4.125 -8.348 1.00 0.00 C ATOM 1342 NH1 ARG A 87 11.670 4.017 -7.860 1.00 0.00 N ATOM 1343 NH2 ARG A 87 9.963 5.330 -8.649 1.00 0.00 N ATOM 0 H ARG A 87 9.146 -2.746 -10.068 1.00 0.00 H new ATOM 0 HA ARG A 87 7.886 -0.241 -10.376 1.00 0.00 H new ATOM 0 HB2 ARG A 87 8.553 -1.385 -8.224 1.00 0.00 H new ATOM 0 HB3 ARG A 87 10.219 -0.964 -8.569 1.00 0.00 H new ATOM 0 HG2 ARG A 87 8.066 1.164 -8.435 1.00 0.00 H new ATOM 0 HG3 ARG A 87 8.843 0.568 -6.981 1.00 0.00 H new ATOM 0 HD2 ARG A 87 10.799 1.661 -7.411 1.00 0.00 H new ATOM 0 HD3 ARG A 87 10.745 1.309 -9.127 1.00 0.00 H new ATOM 0 HE ARG A 87 8.752 3.162 -8.918 1.00 0.00 H new ATOM 0 HH11 ARG A 87 12.052 3.097 -7.638 1.00 0.00 H new ATOM 0 HH12 ARG A 87 12.233 4.853 -7.706 1.00 0.00 H new ATOM 0 HH21 ARG A 87 9.024 5.423 -9.037 1.00 0.00 H new ATOM 0 HH22 ARG A 87 10.535 6.160 -8.491 1.00 0.00 H new ATOM 1357 N GLU A 88 11.032 -0.433 -11.310 1.00 0.00 N ATOM 1358 CA GLU A 88 12.124 0.256 -11.980 1.00 0.00 C ATOM 1359 C GLU A 88 11.734 0.604 -13.415 1.00 0.00 C ATOM 1360 O GLU A 88 12.194 1.601 -13.969 1.00 0.00 O ATOM 1361 CB GLU A 88 13.383 -0.616 -11.935 1.00 0.00 C ATOM 1362 CG GLU A 88 14.670 0.122 -12.260 1.00 0.00 C ATOM 1363 CD GLU A 88 15.896 -0.608 -11.747 1.00 0.00 C ATOM 1364 OE1 GLU A 88 15.843 -1.849 -11.600 1.00 0.00 O ATOM 1365 OE2 GLU A 88 16.915 0.057 -11.462 1.00 0.00 O ATOM 0 H GLU A 88 11.221 -1.415 -11.111 1.00 0.00 H new ATOM 0 HA GLU A 88 12.336 1.192 -11.463 1.00 0.00 H new ATOM 0 HB2 GLU A 88 13.471 -1.054 -10.941 1.00 0.00 H new ATOM 0 HB3 GLU A 88 13.264 -1.441 -12.638 1.00 0.00 H new ATOM 0 HG2 GLU A 88 14.751 0.249 -13.340 1.00 0.00 H new ATOM 0 HG3 GLU A 88 14.634 1.120 -11.823 1.00 0.00 H new ATOM 1372 N ALA A 89 10.859 -0.204 -14.002 1.00 0.00 N ATOM 1373 CA ALA A 89 10.289 0.116 -15.303 1.00 0.00 C ATOM 1374 C ALA A 89 9.458 1.392 -15.199 1.00 0.00 C ATOM 1375 O ALA A 89 9.532 2.272 -16.057 1.00 0.00 O ATOM 1376 CB ALA A 89 9.444 -1.040 -15.819 1.00 0.00 C ATOM 0 H ALA A 89 10.531 -1.082 -13.599 1.00 0.00 H new ATOM 0 HA ALA A 89 11.098 0.280 -16.015 1.00 0.00 H new ATOM 0 HB1 ALA A 89 9.027 -0.780 -16.792 1.00 0.00 H new ATOM 0 HB2 ALA A 89 10.066 -1.930 -15.916 1.00 0.00 H new ATOM 0 HB3 ALA A 89 8.633 -1.239 -15.119 1.00 0.00 H new ATOM 1382 N LEU A 90 8.684 1.493 -14.121 1.00 0.00 N ATOM 1383 CA LEU A 90 7.905 2.696 -13.841 1.00 0.00 C ATOM 1384 C LEU A 90 8.822 3.837 -13.397 1.00 0.00 C ATOM 1385 O LEU A 90 8.487 5.011 -13.534 1.00 0.00 O ATOM 1386 CB LEU A 90 6.859 2.417 -12.758 1.00 0.00 C ATOM 1387 CG LEU A 90 5.774 1.409 -13.141 1.00 0.00 C ATOM 1388 CD1 LEU A 90 4.869 1.130 -11.953 1.00 0.00 C ATOM 1389 CD2 LEU A 90 4.958 1.923 -14.318 1.00 0.00 C ATOM 0 H LEU A 90 8.580 0.754 -13.426 1.00 0.00 H new ATOM 0 HA LEU A 90 7.394 2.992 -14.757 1.00 0.00 H new ATOM 0 HB2 LEU A 90 7.371 2.054 -11.867 1.00 0.00 H new ATOM 0 HB3 LEU A 90 6.379 3.358 -12.489 1.00 0.00 H new ATOM 0 HG LEU A 90 6.258 0.478 -13.437 1.00 0.00 H new ATOM 0 HD11 LEU A 90 4.102 0.411 -12.241 1.00 0.00 H new ATOM 0 HD12 LEU A 90 5.460 0.721 -11.133 1.00 0.00 H new ATOM 0 HD13 LEU A 90 4.395 2.057 -11.631 1.00 0.00 H new ATOM 0 HD21 LEU A 90 4.191 1.192 -14.576 1.00 0.00 H new ATOM 0 HD22 LEU A 90 4.484 2.867 -14.048 1.00 0.00 H new ATOM 0 HD23 LEU A 90 5.614 2.079 -15.175 1.00 0.00 H new ATOM 1401 N ARG A 91 9.984 3.477 -12.865 1.00 0.00 N ATOM 1402 CA ARG A 91 10.987 4.451 -12.451 1.00 0.00 C ATOM 1403 C ARG A 91 11.496 5.197 -13.678 1.00 0.00 C ATOM 1404 O ARG A 91 11.854 6.375 -13.600 1.00 0.00 O ATOM 1405 CB ARG A 91 12.134 3.731 -11.717 1.00 0.00 C ATOM 1406 CG ARG A 91 13.063 4.636 -10.912 1.00 0.00 C ATOM 1407 CD ARG A 91 14.044 5.398 -11.790 1.00 0.00 C ATOM 1408 NE ARG A 91 14.957 6.219 -11.000 1.00 0.00 N ATOM 1409 CZ ARG A 91 15.098 7.535 -11.143 1.00 0.00 C ATOM 1410 NH1 ARG A 91 14.374 8.197 -12.039 1.00 0.00 N ATOM 1411 NH2 ARG A 91 15.964 8.184 -10.378 1.00 0.00 N ATOM 0 H ARG A 91 10.257 2.507 -12.709 1.00 0.00 H new ATOM 0 HA ARG A 91 10.549 5.175 -11.764 1.00 0.00 H new ATOM 0 HB2 ARG A 91 11.704 2.989 -11.044 1.00 0.00 H new ATOM 0 HB3 ARG A 91 12.729 3.188 -12.451 1.00 0.00 H new ATOM 0 HG2 ARG A 91 12.466 5.346 -10.340 1.00 0.00 H new ATOM 0 HG3 ARG A 91 13.617 4.033 -10.193 1.00 0.00 H new ATOM 0 HD2 ARG A 91 14.618 4.692 -12.391 1.00 0.00 H new ATOM 0 HD3 ARG A 91 13.493 6.033 -12.484 1.00 0.00 H new ATOM 0 HE ARG A 91 15.524 5.753 -10.292 1.00 0.00 H new ATOM 0 HH11 ARG A 91 13.704 7.697 -12.623 1.00 0.00 H new ATOM 0 HH12 ARG A 91 14.488 9.205 -12.142 1.00 0.00 H new ATOM 0 HH21 ARG A 91 16.515 7.675 -9.687 1.00 0.00 H new ATOM 0 HH22 ARG A 91 16.079 9.192 -10.480 1.00 0.00 H new ATOM 1425 N GLY A 92 11.498 4.507 -14.814 1.00 0.00 N ATOM 1426 CA GLY A 92 11.879 5.125 -16.069 1.00 0.00 C ATOM 1427 C GLY A 92 11.035 6.345 -16.389 1.00 0.00 C ATOM 1428 O GLY A 92 11.544 7.346 -16.890 1.00 0.00 O ATOM 0 H GLY A 92 11.240 3.523 -14.887 1.00 0.00 H new ATOM 0 HA2 GLY A 92 12.929 5.414 -16.025 1.00 0.00 H new ATOM 0 HA3 GLY A 92 11.782 4.397 -16.874 1.00 0.00 H new ATOM 1432 N VAL A 93 9.745 6.265 -16.080 1.00 0.00 N ATOM 1433 CA VAL A 93 8.832 7.387 -16.287 1.00 0.00 C ATOM 1434 C VAL A 93 8.586 8.133 -14.976 1.00 0.00 C ATOM 1435 O VAL A 93 7.644 8.918 -14.858 1.00 0.00 O ATOM 1436 CB VAL A 93 7.487 6.931 -16.898 1.00 0.00 C ATOM 1437 CG1 VAL A 93 7.668 6.577 -18.365 1.00 0.00 C ATOM 1438 CG2 VAL A 93 6.915 5.743 -16.140 1.00 0.00 C ATOM 0 H VAL A 93 9.306 5.434 -15.684 1.00 0.00 H new ATOM 0 HA VAL A 93 9.309 8.062 -16.997 1.00 0.00 H new ATOM 0 HB VAL A 93 6.782 7.758 -16.816 1.00 0.00 H new ATOM 0 HG11 VAL A 93 6.713 6.258 -18.783 1.00 0.00 H new ATOM 0 HG12 VAL A 93 8.028 7.451 -18.908 1.00 0.00 H new ATOM 0 HG13 VAL A 93 8.393 5.768 -18.457 1.00 0.00 H new ATOM 0 HG21 VAL A 93 5.969 5.444 -16.592 1.00 0.00 H new ATOM 0 HG22 VAL A 93 7.617 4.911 -16.184 1.00 0.00 H new ATOM 0 HG23 VAL A 93 6.748 6.022 -15.100 1.00 0.00 H new ATOM 1448 N ASN A 94 9.457 7.870 -14.001 1.00 0.00 N ATOM 1449 CA ASN A 94 9.478 8.581 -12.718 1.00 0.00 C ATOM 1450 C ASN A 94 8.209 8.358 -11.904 1.00 0.00 C ATOM 1451 O ASN A 94 7.816 9.214 -11.111 1.00 0.00 O ATOM 1452 CB ASN A 94 9.704 10.082 -12.925 1.00 0.00 C ATOM 1453 CG ASN A 94 11.044 10.383 -13.559 1.00 0.00 C ATOM 1454 OD1 ASN A 94 12.007 9.632 -13.399 1.00 0.00 O ATOM 1455 ND2 ASN A 94 11.116 11.483 -14.285 1.00 0.00 N ATOM 0 H ASN A 94 10.176 7.150 -14.079 1.00 0.00 H new ATOM 0 HA ASN A 94 10.311 8.165 -12.151 1.00 0.00 H new ATOM 0 HB2 ASN A 94 8.909 10.483 -13.555 1.00 0.00 H new ATOM 0 HB3 ASN A 94 9.637 10.592 -11.964 1.00 0.00 H new ATOM 0 HD21 ASN A 94 11.993 11.738 -14.739 1.00 0.00 H new ATOM 0 HD22 ASN A 94 10.294 12.078 -14.392 1.00 0.00 H new ATOM 1462 N VAL A 95 7.585 7.206 -12.074 1.00 0.00 N ATOM 1463 CA VAL A 95 6.417 6.862 -11.281 1.00 0.00 C ATOM 1464 C VAL A 95 6.846 6.218 -9.968 1.00 0.00 C ATOM 1465 O VAL A 95 7.515 5.179 -9.956 1.00 0.00 O ATOM 1466 CB VAL A 95 5.465 5.914 -12.043 1.00 0.00 C ATOM 1467 CG1 VAL A 95 4.326 5.450 -11.147 1.00 0.00 C ATOM 1468 CG2 VAL A 95 4.913 6.602 -13.280 1.00 0.00 C ATOM 0 H VAL A 95 7.865 6.496 -12.750 1.00 0.00 H new ATOM 0 HA VAL A 95 5.875 7.785 -11.076 1.00 0.00 H new ATOM 0 HB VAL A 95 6.035 5.038 -12.351 1.00 0.00 H new ATOM 0 HG11 VAL A 95 3.670 4.784 -11.708 1.00 0.00 H new ATOM 0 HG12 VAL A 95 4.733 4.919 -10.287 1.00 0.00 H new ATOM 0 HG13 VAL A 95 3.758 6.314 -10.804 1.00 0.00 H new ATOM 0 HG21 VAL A 95 4.244 5.922 -13.807 1.00 0.00 H new ATOM 0 HG22 VAL A 95 4.363 7.496 -12.985 1.00 0.00 H new ATOM 0 HG23 VAL A 95 5.736 6.883 -13.938 1.00 0.00 H new ATOM 1478 N VAL A 96 6.494 6.856 -8.864 1.00 0.00 N ATOM 1479 CA VAL A 96 6.781 6.320 -7.547 1.00 0.00 C ATOM 1480 C VAL A 96 5.762 5.245 -7.204 1.00 0.00 C ATOM 1481 O VAL A 96 4.627 5.542 -6.840 1.00 0.00 O ATOM 1482 CB VAL A 96 6.761 7.418 -6.463 1.00 0.00 C ATOM 1483 CG1 VAL A 96 7.171 6.852 -5.111 1.00 0.00 C ATOM 1484 CG2 VAL A 96 7.667 8.575 -6.859 1.00 0.00 C ATOM 0 H VAL A 96 6.006 7.752 -8.856 1.00 0.00 H new ATOM 0 HA VAL A 96 7.784 5.894 -7.570 1.00 0.00 H new ATOM 0 HB VAL A 96 5.741 7.794 -6.377 1.00 0.00 H new ATOM 0 HG11 VAL A 96 7.149 7.645 -4.363 1.00 0.00 H new ATOM 0 HG12 VAL A 96 6.478 6.062 -4.822 1.00 0.00 H new ATOM 0 HG13 VAL A 96 8.179 6.444 -5.178 1.00 0.00 H new ATOM 0 HG21 VAL A 96 7.640 9.340 -6.083 1.00 0.00 H new ATOM 0 HG22 VAL A 96 8.688 8.213 -6.977 1.00 0.00 H new ATOM 0 HG23 VAL A 96 7.322 9.002 -7.801 1.00 0.00 H new ATOM 1494 N LEU A 97 6.165 3.997 -7.355 1.00 0.00 N ATOM 1495 CA LEU A 97 5.271 2.874 -7.134 1.00 0.00 C ATOM 1496 C LEU A 97 5.325 2.429 -5.684 1.00 0.00 C ATOM 1497 O LEU A 97 6.391 2.081 -5.172 1.00 0.00 O ATOM 1498 CB LEU A 97 5.649 1.709 -8.053 1.00 0.00 C ATOM 1499 CG LEU A 97 4.791 0.452 -7.901 1.00 0.00 C ATOM 1500 CD1 LEU A 97 3.361 0.725 -8.337 1.00 0.00 C ATOM 1501 CD2 LEU A 97 5.385 -0.700 -8.696 1.00 0.00 C ATOM 0 H LEU A 97 7.111 3.734 -7.631 1.00 0.00 H new ATOM 0 HA LEU A 97 4.254 3.192 -7.364 1.00 0.00 H new ATOM 0 HB2 LEU A 97 5.587 2.048 -9.087 1.00 0.00 H new ATOM 0 HB3 LEU A 97 6.690 1.443 -7.867 1.00 0.00 H new ATOM 0 HG LEU A 97 4.779 0.170 -6.848 1.00 0.00 H new ATOM 0 HD11 LEU A 97 2.766 -0.181 -8.222 1.00 0.00 H new ATOM 0 HD12 LEU A 97 2.938 1.518 -7.720 1.00 0.00 H new ATOM 0 HD13 LEU A 97 3.352 1.034 -9.382 1.00 0.00 H new ATOM 0 HD21 LEU A 97 4.761 -1.585 -8.575 1.00 0.00 H new ATOM 0 HD22 LEU A 97 5.430 -0.429 -9.751 1.00 0.00 H new ATOM 0 HD23 LEU A 97 6.390 -0.913 -8.332 1.00 0.00 H new ATOM 1513 N ASP A 98 4.183 2.445 -5.022 1.00 0.00 N ATOM 1514 CA ASP A 98 4.101 1.990 -3.647 1.00 0.00 C ATOM 1515 C ASP A 98 3.010 0.942 -3.510 1.00 0.00 C ATOM 1516 O ASP A 98 1.833 1.220 -3.741 1.00 0.00 O ATOM 1517 CB ASP A 98 3.841 3.161 -2.700 1.00 0.00 C ATOM 1518 CG ASP A 98 3.958 2.756 -1.245 1.00 0.00 C ATOM 1519 OD1 ASP A 98 5.024 2.226 -0.859 1.00 0.00 O ATOM 1520 OD2 ASP A 98 3.001 2.983 -0.479 1.00 0.00 O ATOM 0 H ASP A 98 3.299 2.768 -5.415 1.00 0.00 H new ATOM 0 HA ASP A 98 5.056 1.542 -3.374 1.00 0.00 H new ATOM 0 HB2 ASP A 98 4.550 3.961 -2.911 1.00 0.00 H new ATOM 0 HB3 ASP A 98 2.844 3.562 -2.885 1.00 0.00 H new ATOM 1525 N THR A 99 3.406 -0.269 -3.164 1.00 0.00 N ATOM 1526 CA THR A 99 2.468 -1.367 -3.048 1.00 0.00 C ATOM 1527 C THR A 99 2.056 -1.574 -1.597 1.00 0.00 C ATOM 1528 O THR A 99 2.901 -1.769 -0.716 1.00 0.00 O ATOM 1529 CB THR A 99 3.075 -2.668 -3.597 1.00 0.00 C ATOM 1530 OG1 THR A 99 3.736 -2.405 -4.844 1.00 0.00 O ATOM 1531 CG2 THR A 99 1.999 -3.726 -3.807 1.00 0.00 C ATOM 0 H THR A 99 4.374 -0.516 -2.958 1.00 0.00 H new ATOM 0 HA THR A 99 1.587 -1.111 -3.637 1.00 0.00 H new ATOM 0 HB THR A 99 3.794 -3.044 -2.869 1.00 0.00 H new ATOM 0 HG1 THR A 99 4.123 -3.236 -5.191 1.00 0.00 H new ATOM 0 HG21 THR A 99 2.455 -4.636 -4.196 1.00 0.00 H new ATOM 0 HG22 THR A 99 1.511 -3.942 -2.857 1.00 0.00 H new ATOM 0 HG23 THR A 99 1.260 -3.357 -4.519 1.00 0.00 H new ATOM 1539 N MET A 100 0.760 -1.511 -1.347 1.00 0.00 N ATOM 1540 CA MET A 100 0.217 -1.734 -0.020 1.00 0.00 C ATOM 1541 C MET A 100 -1.070 -2.539 -0.111 1.00 0.00 C ATOM 1542 O MET A 100 -1.466 -2.979 -1.193 1.00 0.00 O ATOM 1543 CB MET A 100 -0.059 -0.408 0.702 1.00 0.00 C ATOM 1544 CG MET A 100 1.191 0.321 1.169 1.00 0.00 C ATOM 1545 SD MET A 100 0.809 1.791 2.140 1.00 0.00 S ATOM 1546 CE MET A 100 -0.021 2.803 0.917 1.00 0.00 C ATOM 0 H MET A 100 0.057 -1.304 -2.056 1.00 0.00 H new ATOM 0 HA MET A 100 0.959 -2.290 0.554 1.00 0.00 H new ATOM 0 HB2 MET A 100 -0.619 0.246 0.034 1.00 0.00 H new ATOM 0 HB3 MET A 100 -0.696 -0.603 1.565 1.00 0.00 H new ATOM 0 HG2 MET A 100 1.801 -0.357 1.766 1.00 0.00 H new ATOM 0 HG3 MET A 100 1.787 0.607 0.302 1.00 0.00 H new ATOM 0 HE1 MET A 100 -0.097 3.827 1.283 1.00 0.00 H new ATOM 0 HE2 MET A 100 0.548 2.791 -0.012 1.00 0.00 H new ATOM 0 HE3 MET A 100 -1.020 2.408 0.735 1.00 0.00 H new ATOM 1556 N GLN A 101 -1.711 -2.736 1.022 1.00 0.00 N ATOM 1557 CA GLN A 101 -2.994 -3.408 1.060 1.00 0.00 C ATOM 1558 C GLN A 101 -4.104 -2.394 0.821 1.00 0.00 C ATOM 1559 O GLN A 101 -3.881 -1.190 0.951 1.00 0.00 O ATOM 1560 CB GLN A 101 -3.157 -4.126 2.399 1.00 0.00 C ATOM 1561 CG GLN A 101 -2.038 -5.122 2.649 1.00 0.00 C ATOM 1562 CD GLN A 101 -1.962 -5.602 4.081 1.00 0.00 C ATOM 1563 OE1 GLN A 101 -1.310 -4.982 4.918 1.00 0.00 O ATOM 1564 NE2 GLN A 101 -2.604 -6.716 4.373 1.00 0.00 N ATOM 0 H GLN A 101 -1.363 -2.439 1.933 1.00 0.00 H new ATOM 0 HA GLN A 101 -3.051 -4.159 0.272 1.00 0.00 H new ATOM 0 HB2 GLN A 101 -3.176 -3.392 3.204 1.00 0.00 H new ATOM 0 HB3 GLN A 101 -4.115 -4.645 2.418 1.00 0.00 H new ATOM 0 HG2 GLN A 101 -2.175 -5.982 1.993 1.00 0.00 H new ATOM 0 HG3 GLN A 101 -1.087 -4.663 2.378 1.00 0.00 H new ATOM 0 HE21 GLN A 101 -3.135 -7.203 3.651 1.00 0.00 H new ATOM 0 HE22 GLN A 101 -2.570 -7.091 5.321 1.00 0.00 H new ATOM 1573 N THR A 102 -5.286 -2.879 0.471 1.00 0.00 N ATOM 1574 CA THR A 102 -6.387 -2.018 0.045 1.00 0.00 C ATOM 1575 C THR A 102 -6.720 -0.924 1.065 1.00 0.00 C ATOM 1576 O THR A 102 -6.872 0.242 0.697 1.00 0.00 O ATOM 1577 CB THR A 102 -7.640 -2.856 -0.250 1.00 0.00 C ATOM 1578 OG1 THR A 102 -7.745 -3.921 0.706 1.00 0.00 O ATOM 1579 CG2 THR A 102 -7.587 -3.429 -1.657 1.00 0.00 C ATOM 0 H THR A 102 -5.512 -3.874 0.473 1.00 0.00 H new ATOM 0 HA THR A 102 -6.055 -1.518 -0.865 1.00 0.00 H new ATOM 0 HB THR A 102 -8.515 -2.210 -0.174 1.00 0.00 H new ATOM 0 HG1 THR A 102 -7.161 -4.661 0.437 1.00 0.00 H new ATOM 0 HG21 THR A 102 -8.484 -4.019 -1.844 1.00 0.00 H new ATOM 0 HG22 THR A 102 -7.531 -2.615 -2.380 1.00 0.00 H new ATOM 0 HG23 THR A 102 -6.708 -4.065 -1.758 1.00 0.00 H new ATOM 1587 N GLY A 103 -6.822 -1.304 2.334 1.00 0.00 N ATOM 1588 CA GLY A 103 -7.113 -0.344 3.392 1.00 0.00 C ATOM 1589 C GLY A 103 -6.156 0.840 3.410 1.00 0.00 C ATOM 1590 O GLY A 103 -6.565 1.973 3.142 1.00 0.00 O ATOM 0 H GLY A 103 -6.708 -2.266 2.654 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -8.132 0.023 3.270 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -7.070 -0.852 4.356 1.00 0.00 H new ATOM 1594 N PRO A 104 -4.868 0.612 3.732 1.00 0.00 N ATOM 1595 CA PRO A 104 -3.847 1.673 3.756 1.00 0.00 C ATOM 1596 C PRO A 104 -3.755 2.446 2.441 1.00 0.00 C ATOM 1597 O PRO A 104 -3.456 3.644 2.436 1.00 0.00 O ATOM 1598 CB PRO A 104 -2.545 0.911 4.011 1.00 0.00 C ATOM 1599 CG PRO A 104 -2.967 -0.339 4.700 1.00 0.00 C ATOM 1600 CD PRO A 104 -4.307 -0.694 4.125 1.00 0.00 C ATOM 0 HA PRO A 104 -4.078 2.428 4.508 1.00 0.00 H new ATOM 0 HB2 PRO A 104 -2.025 0.693 3.078 1.00 0.00 H new ATOM 0 HB3 PRO A 104 -1.861 1.492 4.629 1.00 0.00 H new ATOM 0 HG2 PRO A 104 -2.246 -1.139 4.533 1.00 0.00 H new ATOM 0 HG3 PRO A 104 -3.032 -0.188 5.778 1.00 0.00 H new ATOM 0 HD2 PRO A 104 -4.213 -1.364 3.271 1.00 0.00 H new ATOM 0 HD3 PRO A 104 -4.938 -1.198 4.857 1.00 0.00 H new ATOM 1608 N ALA A 105 -4.013 1.762 1.332 1.00 0.00 N ATOM 1609 CA ALA A 105 -3.961 2.385 0.017 1.00 0.00 C ATOM 1610 C ALA A 105 -4.993 3.502 -0.101 1.00 0.00 C ATOM 1611 O ALA A 105 -4.662 4.629 -0.476 1.00 0.00 O ATOM 1612 CB ALA A 105 -4.175 1.344 -1.071 1.00 0.00 C ATOM 0 H ALA A 105 -4.261 0.773 1.319 1.00 0.00 H new ATOM 0 HA ALA A 105 -2.972 2.826 -0.111 1.00 0.00 H new ATOM 0 HB1 ALA A 105 -4.133 1.825 -2.048 1.00 0.00 H new ATOM 0 HB2 ALA A 105 -3.395 0.585 -1.007 1.00 0.00 H new ATOM 0 HB3 ALA A 105 -5.150 0.875 -0.939 1.00 0.00 H new ATOM 1618 N ILE A 106 -6.240 3.187 0.242 1.00 0.00 N ATOM 1619 CA ILE A 106 -7.326 4.157 0.165 1.00 0.00 C ATOM 1620 C ILE A 106 -7.071 5.334 1.103 1.00 0.00 C ATOM 1621 O ILE A 106 -7.245 6.493 0.722 1.00 0.00 O ATOM 1622 CB ILE A 106 -8.687 3.508 0.507 1.00 0.00 C ATOM 1623 CG1 ILE A 106 -8.992 2.368 -0.469 1.00 0.00 C ATOM 1624 CG2 ILE A 106 -9.801 4.547 0.475 1.00 0.00 C ATOM 1625 CD1 ILE A 106 -10.276 1.628 -0.162 1.00 0.00 C ATOM 0 H ILE A 106 -6.522 2.266 0.576 1.00 0.00 H new ATOM 0 HA ILE A 106 -7.362 4.520 -0.862 1.00 0.00 H new ATOM 0 HB ILE A 106 -8.630 3.098 1.515 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -9.050 2.773 -1.479 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -8.164 1.660 -0.456 1.00 0.00 H new ATOM 0 HG21 ILE A 106 -10.750 4.070 0.718 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -9.590 5.329 1.204 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -9.860 4.986 -0.521 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -10.424 0.836 -0.896 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -10.215 1.192 0.835 1.00 0.00 H new ATOM 0 HD13 ILE A 106 -11.115 2.322 -0.204 1.00 0.00 H new ATOM 1637 N ARG A 107 -6.633 5.026 2.320 1.00 0.00 N ATOM 1638 CA ARG A 107 -6.356 6.049 3.326 1.00 0.00 C ATOM 1639 C ARG A 107 -5.325 7.058 2.827 1.00 0.00 C ATOM 1640 O ARG A 107 -5.558 8.267 2.855 1.00 0.00 O ATOM 1641 CB ARG A 107 -5.855 5.402 4.620 1.00 0.00 C ATOM 1642 CG ARG A 107 -6.914 4.603 5.360 1.00 0.00 C ATOM 1643 CD ARG A 107 -6.339 3.941 6.600 1.00 0.00 C ATOM 1644 NE ARG A 107 -7.370 3.287 7.404 1.00 0.00 N ATOM 1645 CZ ARG A 107 -7.127 2.316 8.283 1.00 0.00 C ATOM 1646 NH1 ARG A 107 -5.897 1.831 8.421 1.00 0.00 N ATOM 1647 NH2 ARG A 107 -8.119 1.822 9.013 1.00 0.00 N ATOM 0 H ARG A 107 -6.461 4.071 2.636 1.00 0.00 H new ATOM 0 HA ARG A 107 -7.289 6.578 3.521 1.00 0.00 H new ATOM 0 HB2 ARG A 107 -5.017 4.746 4.385 1.00 0.00 H new ATOM 0 HB3 ARG A 107 -5.475 6.181 5.280 1.00 0.00 H new ATOM 0 HG2 ARG A 107 -7.736 5.260 5.644 1.00 0.00 H new ATOM 0 HG3 ARG A 107 -7.328 3.843 4.698 1.00 0.00 H new ATOM 0 HD2 ARG A 107 -5.591 3.206 6.304 1.00 0.00 H new ATOM 0 HD3 ARG A 107 -5.828 4.689 7.206 1.00 0.00 H new ATOM 0 HE ARG A 107 -8.336 3.593 7.284 1.00 0.00 H new ATOM 0 HH11 ARG A 107 -5.136 2.202 7.853 1.00 0.00 H new ATOM 0 HH12 ARG A 107 -5.715 1.088 9.095 1.00 0.00 H new ATOM 0 HH21 ARG A 107 -9.065 2.186 8.900 1.00 0.00 H new ATOM 0 HH22 ARG A 107 -7.935 1.078 9.687 1.00 0.00 H new ATOM 1661 N THR A 108 -4.193 6.552 2.357 1.00 0.00 N ATOM 1662 CA THR A 108 -3.107 7.405 1.900 1.00 0.00 C ATOM 1663 C THR A 108 -3.515 8.202 0.661 1.00 0.00 C ATOM 1664 O THR A 108 -3.169 9.378 0.522 1.00 0.00 O ATOM 1665 CB THR A 108 -1.852 6.564 1.601 1.00 0.00 C ATOM 1666 OG1 THR A 108 -1.602 5.678 2.703 1.00 0.00 O ATOM 1667 CG2 THR A 108 -0.635 7.451 1.376 1.00 0.00 C ATOM 0 H THR A 108 -4.004 5.553 2.283 1.00 0.00 H new ATOM 0 HA THR A 108 -2.878 8.111 2.698 1.00 0.00 H new ATOM 0 HB THR A 108 -2.029 5.992 0.690 1.00 0.00 H new ATOM 0 HG1 THR A 108 -2.189 4.896 2.634 1.00 0.00 H new ATOM 0 HG21 THR A 108 0.235 6.829 1.167 1.00 0.00 H new ATOM 0 HG22 THR A 108 -0.819 8.113 0.530 1.00 0.00 H new ATOM 0 HG23 THR A 108 -0.449 8.047 2.270 1.00 0.00 H new ATOM 1675 N TYR A 109 -4.272 7.563 -0.226 1.00 0.00 N ATOM 1676 CA TYR A 109 -4.752 8.218 -1.436 1.00 0.00 C ATOM 1677 C TYR A 109 -5.684 9.374 -1.090 1.00 0.00 C ATOM 1678 O TYR A 109 -5.553 10.470 -1.635 1.00 0.00 O ATOM 1679 CB TYR A 109 -5.473 7.209 -2.335 1.00 0.00 C ATOM 1680 CG TYR A 109 -6.058 7.820 -3.592 1.00 0.00 C ATOM 1681 CD1 TYR A 109 -5.235 8.242 -4.628 1.00 0.00 C ATOM 1682 CD2 TYR A 109 -7.431 7.976 -3.739 1.00 0.00 C ATOM 1683 CE1 TYR A 109 -5.763 8.804 -5.774 1.00 0.00 C ATOM 1684 CE2 TYR A 109 -7.966 8.537 -4.883 1.00 0.00 C ATOM 1685 CZ TYR A 109 -7.127 8.949 -5.898 1.00 0.00 C ATOM 1686 OH TYR A 109 -7.655 9.510 -7.038 1.00 0.00 O ATOM 0 H TYR A 109 -4.566 6.591 -0.128 1.00 0.00 H new ATOM 0 HA TYR A 109 -3.892 8.618 -1.973 1.00 0.00 H new ATOM 0 HB2 TYR A 109 -4.773 6.422 -2.616 1.00 0.00 H new ATOM 0 HB3 TYR A 109 -6.273 6.736 -1.766 1.00 0.00 H new ATOM 0 HD1 TYR A 109 -4.165 8.129 -4.536 1.00 0.00 H new ATOM 0 HD2 TYR A 109 -8.090 7.654 -2.947 1.00 0.00 H new ATOM 0 HE1 TYR A 109 -5.109 9.128 -6.570 1.00 0.00 H new ATOM 0 HE2 TYR A 109 -9.035 8.652 -4.982 1.00 0.00 H new ATOM 0 HH TYR A 109 -8.632 9.538 -6.966 1.00 0.00 H new ATOM 1696 N ASN A 110 -6.606 9.118 -0.166 1.00 0.00 N ATOM 1697 CA ASN A 110 -7.591 10.112 0.259 1.00 0.00 C ATOM 1698 C ASN A 110 -6.894 11.372 0.774 1.00 0.00 C ATOM 1699 O ASN A 110 -7.261 12.494 0.421 1.00 0.00 O ATOM 1700 CB ASN A 110 -8.485 9.514 1.355 1.00 0.00 C ATOM 1701 CG ASN A 110 -9.753 10.313 1.616 1.00 0.00 C ATOM 1702 OD1 ASN A 110 -9.804 11.526 1.423 1.00 0.00 O ATOM 1703 ND2 ASN A 110 -10.790 9.628 2.079 1.00 0.00 N ATOM 0 H ASN A 110 -6.693 8.219 0.309 1.00 0.00 H new ATOM 0 HA ASN A 110 -8.207 10.388 -0.597 1.00 0.00 H new ATOM 0 HB2 ASN A 110 -8.759 8.497 1.073 1.00 0.00 H new ATOM 0 HB3 ASN A 110 -7.913 9.445 2.280 1.00 0.00 H new ATOM 0 HD21 ASN A 110 -11.666 10.107 2.287 1.00 0.00 H new ATOM 0 HD22 ASN A 110 -10.712 8.622 2.227 1.00 0.00 H new ATOM 1710 N ILE A 111 -5.869 11.176 1.591 1.00 0.00 N ATOM 1711 CA ILE A 111 -5.116 12.290 2.149 1.00 0.00 C ATOM 1712 C ILE A 111 -4.360 13.043 1.055 1.00 0.00 C ATOM 1713 O ILE A 111 -4.427 14.270 0.973 1.00 0.00 O ATOM 1714 CB ILE A 111 -4.119 11.810 3.229 1.00 0.00 C ATOM 1715 CG1 ILE A 111 -4.866 11.097 4.359 1.00 0.00 C ATOM 1716 CG2 ILE A 111 -3.314 12.983 3.777 1.00 0.00 C ATOM 1717 CD1 ILE A 111 -3.957 10.517 5.422 1.00 0.00 C ATOM 0 H ILE A 111 -5.540 10.256 1.882 1.00 0.00 H new ATOM 0 HA ILE A 111 -5.836 12.964 2.613 1.00 0.00 H new ATOM 0 HB ILE A 111 -3.425 11.105 2.771 1.00 0.00 H new ATOM 0 HG12 ILE A 111 -5.554 11.800 4.827 1.00 0.00 H new ATOM 0 HG13 ILE A 111 -5.470 10.295 3.934 1.00 0.00 H new ATOM 0 HG21 ILE A 111 -2.618 12.624 4.536 1.00 0.00 H new ATOM 0 HG22 ILE A 111 -2.757 13.452 2.966 1.00 0.00 H new ATOM 0 HG23 ILE A 111 -3.991 13.713 4.222 1.00 0.00 H new ATOM 0 HD11 ILE A 111 -4.559 10.028 6.188 1.00 0.00 H new ATOM 0 HD12 ILE A 111 -3.285 9.788 4.968 1.00 0.00 H new ATOM 0 HD13 ILE A 111 -3.371 11.317 5.876 1.00 0.00 H new ATOM 1729 N MET A 112 -3.663 12.301 0.200 1.00 0.00 N ATOM 1730 CA MET A 112 -2.810 12.904 -0.823 1.00 0.00 C ATOM 1731 C MET A 112 -3.612 13.663 -1.875 1.00 0.00 C ATOM 1732 O MET A 112 -3.185 14.727 -2.331 1.00 0.00 O ATOM 1733 CB MET A 112 -1.939 11.843 -1.498 1.00 0.00 C ATOM 1734 CG MET A 112 -0.812 11.333 -0.615 1.00 0.00 C ATOM 1735 SD MET A 112 0.302 12.652 -0.089 1.00 0.00 S ATOM 1736 CE MET A 112 0.920 13.231 -1.669 1.00 0.00 C ATOM 0 H MET A 112 -3.671 11.281 0.194 1.00 0.00 H new ATOM 0 HA MET A 112 -2.171 13.624 -0.312 1.00 0.00 H new ATOM 0 HB2 MET A 112 -2.567 11.003 -1.793 1.00 0.00 H new ATOM 0 HB3 MET A 112 -1.514 12.260 -2.411 1.00 0.00 H new ATOM 0 HG2 MET A 112 -1.235 10.846 0.264 1.00 0.00 H new ATOM 0 HG3 MET A 112 -0.244 10.576 -1.156 1.00 0.00 H new ATOM 0 HE1 MET A 112 1.823 13.821 -1.512 1.00 0.00 H new ATOM 0 HE2 MET A 112 1.150 12.376 -2.305 1.00 0.00 H new ATOM 0 HE3 MET A 112 0.163 13.849 -2.152 1.00 0.00 H new ATOM 1746 N ILE A 113 -4.769 13.130 -2.257 1.00 0.00 N ATOM 1747 CA ILE A 113 -5.594 13.766 -3.282 1.00 0.00 C ATOM 1748 C ILE A 113 -6.194 15.069 -2.751 1.00 0.00 C ATOM 1749 O ILE A 113 -6.482 15.996 -3.515 1.00 0.00 O ATOM 1750 CB ILE A 113 -6.720 12.825 -3.788 1.00 0.00 C ATOM 1751 CG1 ILE A 113 -7.379 13.391 -5.048 1.00 0.00 C ATOM 1752 CG2 ILE A 113 -7.767 12.588 -2.711 1.00 0.00 C ATOM 1753 CD1 ILE A 113 -6.444 13.474 -6.235 1.00 0.00 C ATOM 0 H ILE A 113 -5.155 12.266 -1.876 1.00 0.00 H new ATOM 0 HA ILE A 113 -4.945 13.988 -4.129 1.00 0.00 H new ATOM 0 HB ILE A 113 -6.260 11.868 -4.034 1.00 0.00 H new ATOM 0 HG12 ILE A 113 -8.234 12.768 -5.312 1.00 0.00 H new ATOM 0 HG13 ILE A 113 -7.765 14.387 -4.830 1.00 0.00 H new ATOM 0 HG21 ILE A 113 -8.542 11.925 -3.096 1.00 0.00 H new ATOM 0 HG22 ILE A 113 -7.297 12.129 -1.841 1.00 0.00 H new ATOM 0 HG23 ILE A 113 -8.214 13.539 -2.422 1.00 0.00 H new ATOM 0 HD11 ILE A 113 -6.979 13.884 -7.092 1.00 0.00 H new ATOM 0 HD12 ILE A 113 -5.601 14.121 -5.990 1.00 0.00 H new ATOM 0 HD13 ILE A 113 -6.077 12.477 -6.480 1.00 0.00 H new ATOM 1765 N GLY A 114 -6.358 15.137 -1.435 1.00 0.00 N ATOM 1766 CA GLY A 114 -6.867 16.339 -0.813 1.00 0.00 C ATOM 1767 C GLY A 114 -5.798 17.403 -0.678 1.00 0.00 C ATOM 1768 O GLY A 114 -6.024 18.566 -1.018 1.00 0.00 O ATOM 0 H GLY A 114 -6.146 14.377 -0.788 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -7.695 16.730 -1.404 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -7.264 16.097 0.173 1.00 0.00 H new ATOM 1772 N GLU A 115 -4.630 17.003 -0.190 1.00 0.00 N ATOM 1773 CA GLU A 115 -3.522 17.932 0.002 1.00 0.00 C ATOM 1774 C GLU A 115 -3.084 18.544 -1.326 1.00 0.00 C ATOM 1775 O GLU A 115 -3.098 19.765 -1.489 1.00 0.00 O ATOM 1776 CB GLU A 115 -2.341 17.231 0.681 1.00 0.00 C ATOM 1777 CG GLU A 115 -2.665 16.690 2.066 1.00 0.00 C ATOM 1778 CD GLU A 115 -3.219 17.754 2.992 1.00 0.00 C ATOM 1779 OE1 GLU A 115 -2.420 18.457 3.648 1.00 0.00 O ATOM 1780 OE2 GLU A 115 -4.454 17.899 3.064 1.00 0.00 O ATOM 0 H GLU A 115 -4.425 16.041 0.080 1.00 0.00 H new ATOM 0 HA GLU A 115 -3.868 18.737 0.650 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -2.006 16.409 0.049 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -1.510 17.932 0.760 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -3.388 15.880 1.975 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -1.763 16.264 2.506 1.00 0.00 H new ATOM 1787 N ARG A 116 -2.709 17.698 -2.278 1.00 0.00 N ATOM 1788 CA ARG A 116 -2.313 18.171 -3.595 1.00 0.00 C ATOM 1789 C ARG A 116 -3.000 17.355 -4.685 1.00 0.00 C ATOM 1790 O ARG A 116 -4.200 17.506 -4.927 1.00 0.00 O ATOM 1791 CB ARG A 116 -0.790 18.104 -3.787 1.00 0.00 C ATOM 1792 CG ARG A 116 0.012 18.999 -2.856 1.00 0.00 C ATOM 1793 CD ARG A 116 1.487 18.990 -3.230 1.00 0.00 C ATOM 1794 NE ARG A 116 2.304 19.746 -2.284 1.00 0.00 N ATOM 1795 CZ ARG A 116 3.435 20.376 -2.603 1.00 0.00 C ATOM 1796 NH1 ARG A 116 3.903 20.337 -3.844 1.00 0.00 N ATOM 1797 NH2 ARG A 116 4.111 21.037 -1.674 1.00 0.00 N ATOM 0 H ARG A 116 -2.671 16.685 -2.162 1.00 0.00 H new ATOM 0 HA ARG A 116 -2.623 19.213 -3.671 1.00 0.00 H new ATOM 0 HB2 ARG A 116 -0.465 17.073 -3.645 1.00 0.00 H new ATOM 0 HB3 ARG A 116 -0.556 18.373 -4.817 1.00 0.00 H new ATOM 0 HG2 ARG A 116 -0.373 20.018 -2.904 1.00 0.00 H new ATOM 0 HG3 ARG A 116 -0.108 18.661 -1.827 1.00 0.00 H new ATOM 0 HD2 ARG A 116 1.843 17.960 -3.272 1.00 0.00 H new ATOM 0 HD3 ARG A 116 1.609 19.410 -4.228 1.00 0.00 H new ATOM 0 HE ARG A 116 1.988 19.795 -1.315 1.00 0.00 H new ATOM 0 HH11 ARG A 116 3.397 19.822 -4.564 1.00 0.00 H new ATOM 0 HH12 ARG A 116 4.769 20.822 -4.078 1.00 0.00 H new ATOM 0 HH21 ARG A 116 3.766 21.064 -0.714 1.00 0.00 H new ATOM 0 HH22 ARG A 116 4.976 21.519 -1.919 1.00 0.00 H new ATOM 1811 N ARG A 117 -2.235 16.460 -5.298 1.00 0.00 N ATOM 1812 CA ARG A 117 -2.691 15.660 -6.426 1.00 0.00 C ATOM 1813 C ARG A 117 -1.518 14.810 -6.910 1.00 0.00 C ATOM 1814 O ARG A 117 -0.605 14.536 -6.130 1.00 0.00 O ATOM 1815 CB ARG A 117 -3.202 16.568 -7.553 1.00 0.00 C ATOM 1816 CG ARG A 117 -4.230 15.907 -8.458 1.00 0.00 C ATOM 1817 CD ARG A 117 -5.535 16.685 -8.471 1.00 0.00 C ATOM 1818 NE ARG A 117 -6.099 16.829 -7.127 1.00 0.00 N ATOM 1819 CZ ARG A 117 -7.262 17.421 -6.863 1.00 0.00 C ATOM 1820 NH1 ARG A 117 -7.992 17.938 -7.847 1.00 0.00 N ATOM 1821 NH2 ARG A 117 -7.694 17.493 -5.611 1.00 0.00 N ATOM 0 H ARG A 117 -1.272 16.268 -5.023 1.00 0.00 H new ATOM 0 HA ARG A 117 -3.516 15.016 -6.121 1.00 0.00 H new ATOM 0 HB2 ARG A 117 -3.641 17.464 -7.114 1.00 0.00 H new ATOM 0 HB3 ARG A 117 -2.355 16.892 -8.158 1.00 0.00 H new ATOM 0 HG2 ARG A 117 -3.835 15.838 -9.472 1.00 0.00 H new ATOM 0 HG3 ARG A 117 -4.415 14.888 -8.118 1.00 0.00 H new ATOM 0 HD2 ARG A 117 -5.365 17.672 -8.901 1.00 0.00 H new ATOM 0 HD3 ARG A 117 -6.254 16.177 -9.114 1.00 0.00 H new ATOM 0 HE ARG A 117 -5.567 16.452 -6.343 1.00 0.00 H new ATOM 0 HH11 ARG A 117 -7.662 17.882 -8.810 1.00 0.00 H new ATOM 0 HH12 ARG A 117 -8.882 18.390 -7.638 1.00 0.00 H new ATOM 0 HH21 ARG A 117 -7.136 17.096 -4.855 1.00 0.00 H new ATOM 0 HH22 ARG A 117 -8.584 17.946 -5.404 1.00 0.00 H new ATOM 1835 N ARG A 118 -1.542 14.400 -8.181 1.00 0.00 N ATOM 1836 CA ARG A 118 -0.470 13.593 -8.771 1.00 0.00 C ATOM 1837 C ARG A 118 -0.344 12.246 -8.075 1.00 0.00 C ATOM 1838 O ARG A 118 0.687 11.577 -8.152 1.00 0.00 O ATOM 1839 CB ARG A 118 0.860 14.355 -8.739 1.00 0.00 C ATOM 1840 CG ARG A 118 0.958 15.431 -9.806 1.00 0.00 C ATOM 1841 CD ARG A 118 1.144 14.817 -11.185 1.00 0.00 C ATOM 1842 NE ARG A 118 1.020 15.800 -12.257 1.00 0.00 N ATOM 1843 CZ ARG A 118 2.054 16.403 -12.844 1.00 0.00 C ATOM 1844 NH1 ARG A 118 3.292 16.191 -12.415 1.00 0.00 N ATOM 1845 NH2 ARG A 118 1.842 17.235 -13.854 1.00 0.00 N ATOM 0 H ARG A 118 -2.301 14.617 -8.827 1.00 0.00 H new ATOM 0 HA ARG A 118 -0.729 13.401 -9.812 1.00 0.00 H new ATOM 0 HB2 ARG A 118 0.986 14.813 -7.758 1.00 0.00 H new ATOM 0 HB3 ARG A 118 1.680 13.648 -8.868 1.00 0.00 H new ATOM 0 HG2 ARG A 118 0.055 16.042 -9.795 1.00 0.00 H new ATOM 0 HG3 ARG A 118 1.794 16.094 -9.583 1.00 0.00 H new ATOM 0 HD2 ARG A 118 2.126 14.346 -11.240 1.00 0.00 H new ATOM 0 HD3 ARG A 118 0.404 14.030 -11.331 1.00 0.00 H new ATOM 0 HE ARG A 118 0.082 16.041 -12.577 1.00 0.00 H new ATOM 0 HH11 ARG A 118 3.459 15.562 -11.630 1.00 0.00 H new ATOM 0 HH12 ARG A 118 4.077 16.657 -12.871 1.00 0.00 H new ATOM 0 HH21 ARG A 118 0.891 17.411 -14.179 1.00 0.00 H new ATOM 0 HH22 ARG A 118 2.630 17.699 -14.307 1.00 0.00 H new ATOM 1859 N VAL A 119 -1.417 11.841 -7.434 1.00 0.00 N ATOM 1860 CA VAL A 119 -1.466 10.565 -6.754 1.00 0.00 C ATOM 1861 C VAL A 119 -2.515 9.677 -7.409 1.00 0.00 C ATOM 1862 O VAL A 119 -3.636 10.113 -7.673 1.00 0.00 O ATOM 1863 CB VAL A 119 -1.760 10.739 -5.242 1.00 0.00 C ATOM 1864 CG1 VAL A 119 -3.076 11.467 -5.016 1.00 0.00 C ATOM 1865 CG2 VAL A 119 -1.759 9.395 -4.528 1.00 0.00 C ATOM 0 H VAL A 119 -2.278 12.384 -7.369 1.00 0.00 H new ATOM 0 HA VAL A 119 -0.489 10.090 -6.841 1.00 0.00 H new ATOM 0 HB VAL A 119 -0.962 11.350 -4.819 1.00 0.00 H new ATOM 0 HG11 VAL A 119 -3.254 11.573 -3.946 1.00 0.00 H new ATOM 0 HG12 VAL A 119 -3.029 12.454 -5.476 1.00 0.00 H new ATOM 0 HG13 VAL A 119 -3.889 10.896 -5.464 1.00 0.00 H new ATOM 0 HG21 VAL A 119 -1.968 9.546 -3.469 1.00 0.00 H new ATOM 0 HG22 VAL A 119 -2.525 8.752 -4.961 1.00 0.00 H new ATOM 0 HG23 VAL A 119 -0.783 8.923 -4.642 1.00 0.00 H new ATOM 1875 N ALA A 120 -2.137 8.451 -7.711 1.00 0.00 N ATOM 1876 CA ALA A 120 -3.036 7.525 -8.370 1.00 0.00 C ATOM 1877 C ALA A 120 -3.198 6.265 -7.541 1.00 0.00 C ATOM 1878 O ALA A 120 -2.255 5.821 -6.888 1.00 0.00 O ATOM 1879 CB ALA A 120 -2.523 7.192 -9.760 1.00 0.00 C ATOM 0 H ALA A 120 -1.211 8.072 -7.510 1.00 0.00 H new ATOM 0 HA ALA A 120 -4.014 7.997 -8.469 1.00 0.00 H new ATOM 0 HB1 ALA A 120 -3.208 6.495 -10.243 1.00 0.00 H new ATOM 0 HB2 ALA A 120 -2.456 8.105 -10.352 1.00 0.00 H new ATOM 0 HB3 ALA A 120 -1.536 6.736 -9.684 1.00 0.00 H new ATOM 1885 N ALA A 121 -4.390 5.696 -7.566 1.00 0.00 N ATOM 1886 CA ALA A 121 -4.671 4.500 -6.798 1.00 0.00 C ATOM 1887 C ALA A 121 -5.072 3.349 -7.707 1.00 0.00 C ATOM 1888 O ALA A 121 -6.129 3.378 -8.339 1.00 0.00 O ATOM 1889 CB ALA A 121 -5.762 4.772 -5.772 1.00 0.00 C ATOM 0 H ALA A 121 -5.179 6.045 -8.111 1.00 0.00 H new ATOM 0 HA ALA A 121 -3.760 4.214 -6.272 1.00 0.00 H new ATOM 0 HB1 ALA A 121 -5.961 3.864 -5.203 1.00 0.00 H new ATOM 0 HB2 ALA A 121 -5.435 5.560 -5.094 1.00 0.00 H new ATOM 0 HB3 ALA A 121 -6.672 5.087 -6.283 1.00 0.00 H new ATOM 1895 N ALA A 122 -4.212 2.347 -7.780 1.00 0.00 N ATOM 1896 CA ALA A 122 -4.522 1.127 -8.502 1.00 0.00 C ATOM 1897 C ALA A 122 -5.090 0.112 -7.524 1.00 0.00 C ATOM 1898 O ALA A 122 -4.348 -0.536 -6.786 1.00 0.00 O ATOM 1899 CB ALA A 122 -3.285 0.578 -9.196 1.00 0.00 C ATOM 0 H ALA A 122 -3.289 2.356 -7.345 1.00 0.00 H new ATOM 0 HA ALA A 122 -5.260 1.340 -9.276 1.00 0.00 H new ATOM 0 HB1 ALA A 122 -3.543 -0.336 -9.730 1.00 0.00 H new ATOM 0 HB2 ALA A 122 -2.906 1.316 -9.903 1.00 0.00 H new ATOM 0 HB3 ALA A 122 -2.518 0.360 -8.453 1.00 0.00 H new ATOM 1905 N LEU A 123 -6.406 -0.002 -7.497 1.00 0.00 N ATOM 1906 CA LEU A 123 -7.071 -0.784 -6.470 1.00 0.00 C ATOM 1907 C LEU A 123 -7.657 -2.070 -7.030 1.00 0.00 C ATOM 1908 O LEU A 123 -8.550 -2.045 -7.881 1.00 0.00 O ATOM 1909 CB LEU A 123 -8.171 0.047 -5.804 1.00 0.00 C ATOM 1910 CG LEU A 123 -7.685 1.293 -5.058 1.00 0.00 C ATOM 1911 CD1 LEU A 123 -8.863 2.068 -4.489 1.00 0.00 C ATOM 1912 CD2 LEU A 123 -6.713 0.911 -3.949 1.00 0.00 C ATOM 0 H LEU A 123 -7.033 0.435 -8.172 1.00 0.00 H new ATOM 0 HA LEU A 123 -6.322 -1.057 -5.727 1.00 0.00 H new ATOM 0 HB2 LEU A 123 -8.884 0.356 -6.568 1.00 0.00 H new ATOM 0 HB3 LEU A 123 -8.711 -0.589 -5.103 1.00 0.00 H new ATOM 0 HG LEU A 123 -7.161 1.933 -5.768 1.00 0.00 H new ATOM 0 HD11 LEU A 123 -8.498 2.950 -3.962 1.00 0.00 H new ATOM 0 HD12 LEU A 123 -9.522 2.377 -5.301 1.00 0.00 H new ATOM 0 HD13 LEU A 123 -9.415 1.434 -3.795 1.00 0.00 H new ATOM 0 HD21 LEU A 123 -6.380 1.811 -3.431 1.00 0.00 H new ATOM 0 HD22 LEU A 123 -7.211 0.248 -3.241 1.00 0.00 H new ATOM 0 HD23 LEU A 123 -5.852 0.400 -4.380 1.00 0.00 H new ATOM 1924 N ILE A 124 -7.131 -3.188 -6.556 1.00 0.00 N ATOM 1925 CA ILE A 124 -7.705 -4.488 -6.842 1.00 0.00 C ATOM 1926 C ILE A 124 -8.558 -4.911 -5.653 1.00 0.00 C ATOM 1927 O ILE A 124 -8.092 -4.900 -4.511 1.00 0.00 O ATOM 1928 CB ILE A 124 -6.613 -5.548 -7.117 1.00 0.00 C ATOM 1929 CG1 ILE A 124 -5.734 -5.102 -8.290 1.00 0.00 C ATOM 1930 CG2 ILE A 124 -7.243 -6.906 -7.408 1.00 0.00 C ATOM 1931 CD1 ILE A 124 -4.594 -6.049 -8.595 1.00 0.00 C ATOM 0 H ILE A 124 -6.299 -3.218 -5.966 1.00 0.00 H new ATOM 0 HA ILE A 124 -8.315 -4.413 -7.742 1.00 0.00 H new ATOM 0 HB ILE A 124 -5.990 -5.646 -6.228 1.00 0.00 H new ATOM 0 HG12 ILE A 124 -6.356 -4.999 -9.179 1.00 0.00 H new ATOM 0 HG13 ILE A 124 -5.325 -4.115 -8.071 1.00 0.00 H new ATOM 0 HG21 ILE A 124 -6.458 -7.638 -7.599 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -7.835 -7.224 -6.550 1.00 0.00 H new ATOM 0 HG23 ILE A 124 -7.887 -6.828 -8.284 1.00 0.00 H new ATOM 0 HD11 ILE A 124 -4.018 -5.665 -9.437 1.00 0.00 H new ATOM 0 HD12 ILE A 124 -3.948 -6.134 -7.721 1.00 0.00 H new ATOM 0 HD13 ILE A 124 -4.994 -7.031 -8.847 1.00 0.00 H new ATOM 1943 N ALA A 125 -9.810 -5.248 -5.918 1.00 0.00 N ATOM 1944 CA ALA A 125 -10.759 -5.552 -4.857 1.00 0.00 C ATOM 1945 C ALA A 125 -10.371 -6.809 -4.102 1.00 0.00 C ATOM 1946 O ALA A 125 -9.788 -7.732 -4.670 1.00 0.00 O ATOM 1947 CB ALA A 125 -12.161 -5.693 -5.418 1.00 0.00 C ATOM 0 H ALA A 125 -10.194 -5.318 -6.860 1.00 0.00 H new ATOM 0 HA ALA A 125 -10.740 -4.719 -4.154 1.00 0.00 H new ATOM 0 HB1 ALA A 125 -12.855 -5.920 -4.609 1.00 0.00 H new ATOM 0 HB2 ALA A 125 -12.456 -4.760 -5.898 1.00 0.00 H new ATOM 0 HB3 ALA A 125 -12.180 -6.500 -6.150 1.00 0.00 H new ATOM 1953 N VAL A 126 -10.707 -6.830 -2.822 1.00 0.00 N ATOM 1954 CA VAL A 126 -10.415 -7.963 -1.963 1.00 0.00 C ATOM 1955 C VAL A 126 -11.186 -9.198 -2.419 1.00 0.00 C ATOM 1956 O VAL A 126 -12.415 -9.238 -2.336 1.00 0.00 O ATOM 1957 CB VAL A 126 -10.772 -7.650 -0.495 1.00 0.00 C ATOM 1958 CG1 VAL A 126 -10.510 -8.851 0.400 1.00 0.00 C ATOM 1959 CG2 VAL A 126 -9.999 -6.437 -0.001 1.00 0.00 C ATOM 0 H VAL A 126 -11.188 -6.064 -2.352 1.00 0.00 H new ATOM 0 HA VAL A 126 -9.345 -8.161 -2.032 1.00 0.00 H new ATOM 0 HB VAL A 126 -11.837 -7.422 -0.451 1.00 0.00 H new ATOM 0 HG11 VAL A 126 -10.770 -8.602 1.429 1.00 0.00 H new ATOM 0 HG12 VAL A 126 -11.116 -9.693 0.066 1.00 0.00 H new ATOM 0 HG13 VAL A 126 -9.455 -9.120 0.348 1.00 0.00 H new ATOM 0 HG21 VAL A 126 -10.265 -6.233 1.036 1.00 0.00 H new ATOM 0 HG22 VAL A 126 -8.929 -6.635 -0.069 1.00 0.00 H new ATOM 0 HG23 VAL A 126 -10.248 -5.572 -0.616 1.00 0.00 H new ATOM 1969 N PRO A 127 -10.473 -10.224 -2.907 1.00 0.00 N ATOM 1970 CA PRO A 127 -11.083 -11.473 -3.348 1.00 0.00 C ATOM 1971 C PRO A 127 -11.290 -12.441 -2.190 1.00 0.00 C ATOM 1972 O PRO A 127 -11.343 -13.657 -2.384 1.00 0.00 O ATOM 1973 CB PRO A 127 -10.050 -12.018 -4.332 1.00 0.00 C ATOM 1974 CG PRO A 127 -8.738 -11.542 -3.804 1.00 0.00 C ATOM 1975 CD PRO A 127 -9.003 -10.246 -3.074 1.00 0.00 C ATOM 0 HA PRO A 127 -12.074 -11.333 -3.780 1.00 0.00 H new ATOM 0 HB2 PRO A 127 -10.086 -13.106 -4.382 1.00 0.00 H new ATOM 0 HB3 PRO A 127 -10.229 -11.647 -5.341 1.00 0.00 H new ATOM 0 HG2 PRO A 127 -8.301 -12.281 -3.133 1.00 0.00 H new ATOM 0 HG3 PRO A 127 -8.027 -11.389 -4.616 1.00 0.00 H new ATOM 0 HD2 PRO A 127 -8.491 -10.218 -2.112 1.00 0.00 H new ATOM 0 HD3 PRO A 127 -8.653 -9.387 -3.646 1.00 0.00 H new ATOM 1983 N LEU A 128 -11.415 -11.874 -0.989 1.00 0.00 N ATOM 1984 CA LEU A 128 -11.532 -12.640 0.249 1.00 0.00 C ATOM 1985 C LEU A 128 -10.253 -13.433 0.503 1.00 0.00 C ATOM 1986 O LEU A 128 -9.249 -13.246 -0.183 1.00 0.00 O ATOM 1987 CB LEU A 128 -12.747 -13.579 0.201 1.00 0.00 C ATOM 1988 CG LEU A 128 -14.099 -12.888 0.001 1.00 0.00 C ATOM 1989 CD1 LEU A 128 -15.214 -13.918 -0.088 1.00 0.00 C ATOM 1990 CD2 LEU A 128 -14.369 -11.901 1.128 1.00 0.00 C ATOM 0 H LEU A 128 -11.438 -10.864 -0.849 1.00 0.00 H new ATOM 0 HA LEU A 128 -11.679 -11.940 1.072 1.00 0.00 H new ATOM 0 HB2 LEU A 128 -12.600 -14.295 -0.607 1.00 0.00 H new ATOM 0 HB3 LEU A 128 -12.782 -14.149 1.130 1.00 0.00 H new ATOM 0 HG LEU A 128 -14.067 -12.334 -0.937 1.00 0.00 H new ATOM 0 HD11 LEU A 128 -16.168 -13.410 -0.230 1.00 0.00 H new ATOM 0 HD12 LEU A 128 -15.028 -14.584 -0.931 1.00 0.00 H new ATOM 0 HD13 LEU A 128 -15.246 -14.500 0.833 1.00 0.00 H new ATOM 0 HD21 LEU A 128 -15.334 -11.421 0.967 1.00 0.00 H new ATOM 0 HD22 LEU A 128 -14.381 -12.431 2.080 1.00 0.00 H new ATOM 0 HD23 LEU A 128 -13.585 -11.144 1.144 1.00 0.00 H new ATOM 2002 N GLU A 129 -10.280 -14.293 1.505 1.00 0.00 N ATOM 2003 CA GLU A 129 -9.147 -15.160 1.792 1.00 0.00 C ATOM 2004 C GLU A 129 -9.408 -16.544 1.211 1.00 0.00 C ATOM 2005 O GLU A 129 -8.573 -17.446 1.297 1.00 0.00 O ATOM 2006 CB GLU A 129 -8.880 -15.249 3.307 1.00 0.00 C ATOM 2007 CG GLU A 129 -9.982 -15.932 4.116 1.00 0.00 C ATOM 2008 CD GLU A 129 -11.257 -15.119 4.200 1.00 0.00 C ATOM 2009 OE1 GLU A 129 -12.064 -15.181 3.253 1.00 0.00 O ATOM 2010 OE2 GLU A 129 -11.461 -14.423 5.211 1.00 0.00 O ATOM 0 H GLU A 129 -11.073 -14.411 2.135 1.00 0.00 H new ATOM 0 HA GLU A 129 -8.257 -14.735 1.328 1.00 0.00 H new ATOM 0 HB2 GLU A 129 -7.946 -15.788 3.465 1.00 0.00 H new ATOM 0 HB3 GLU A 129 -8.736 -14.241 3.696 1.00 0.00 H new ATOM 0 HG2 GLU A 129 -10.206 -16.900 3.667 1.00 0.00 H new ATOM 0 HG3 GLU A 129 -9.616 -16.125 5.124 1.00 0.00 H new ATOM 2017 N HIS A 130 -10.579 -16.694 0.604 1.00 0.00 N ATOM 2018 CA HIS A 130 -10.986 -17.955 0.009 1.00 0.00 C ATOM 2019 C HIS A 130 -11.787 -17.688 -1.259 1.00 0.00 C ATOM 2020 O HIS A 130 -12.248 -16.567 -1.479 1.00 0.00 O ATOM 2021 CB HIS A 130 -11.807 -18.791 1.009 1.00 0.00 C ATOM 2022 CG HIS A 130 -13.167 -18.236 1.338 1.00 0.00 C ATOM 2023 ND1 HIS A 130 -13.368 -17.136 2.146 1.00 0.00 N ATOM 2024 CD2 HIS A 130 -14.401 -18.652 0.970 1.00 0.00 C ATOM 2025 CE1 HIS A 130 -14.661 -16.906 2.259 1.00 0.00 C ATOM 2026 NE2 HIS A 130 -15.310 -17.809 1.557 1.00 0.00 N ATOM 0 H HIS A 130 -11.268 -15.948 0.512 1.00 0.00 H new ATOM 0 HA HIS A 130 -10.095 -18.528 -0.250 1.00 0.00 H new ATOM 0 HB2 HIS A 130 -11.930 -19.796 0.605 1.00 0.00 H new ATOM 0 HB3 HIS A 130 -11.237 -18.887 1.933 1.00 0.00 H new ATOM 0 HD1 HIS A 130 -12.631 -16.586 2.587 1.00 0.00 H new ATOM 0 HD2 HIS A 130 -14.628 -19.493 0.332 1.00 0.00 H new ATOM 0 HE1 HIS A 130 -15.112 -16.109 2.832 1.00 0.00 H new ATOM 2035 N HIS A 131 -11.943 -18.713 -2.088 1.00 0.00 N ATOM 2036 CA HIS A 131 -12.673 -18.584 -3.349 1.00 0.00 C ATOM 2037 C HIS A 131 -14.167 -18.347 -3.120 1.00 0.00 C ATOM 2038 O HIS A 131 -14.613 -18.193 -1.986 1.00 0.00 O ATOM 2039 CB HIS A 131 -12.458 -19.825 -4.220 1.00 0.00 C ATOM 2040 CG HIS A 131 -11.097 -19.893 -4.837 1.00 0.00 C ATOM 2041 ND1 HIS A 131 -10.247 -20.967 -4.680 1.00 0.00 N ATOM 2042 CD2 HIS A 131 -10.443 -19.013 -5.630 1.00 0.00 C ATOM 2043 CE1 HIS A 131 -9.132 -20.743 -5.348 1.00 0.00 C ATOM 2044 NE2 HIS A 131 -9.228 -19.567 -5.933 1.00 0.00 N ATOM 0 H HIS A 131 -11.573 -19.647 -1.911 1.00 0.00 H new ATOM 0 HA HIS A 131 -12.277 -17.711 -3.869 1.00 0.00 H new ATOM 0 HB2 HIS A 131 -12.618 -20.717 -3.614 1.00 0.00 H new ATOM 0 HB3 HIS A 131 -13.208 -19.838 -5.011 1.00 0.00 H new ATOM 0 HD2 HIS A 131 -10.811 -18.053 -5.962 1.00 0.00 H new ATOM 0 HE1 HIS A 131 -8.285 -21.410 -5.405 1.00 0.00 H new ATOM 0 HE2 HIS A 131 -8.512 -19.137 -6.518 1.00 0.00 H new ATOM 2053 N HIS A 132 -14.935 -18.353 -4.206 1.00 0.00 N ATOM 2054 CA HIS A 132 -16.350 -17.962 -4.177 1.00 0.00 C ATOM 2055 C HIS A 132 -17.257 -19.027 -3.542 1.00 0.00 C ATOM 2056 O HIS A 132 -18.446 -19.101 -3.852 1.00 0.00 O ATOM 2057 CB HIS A 132 -16.836 -17.644 -5.601 1.00 0.00 C ATOM 2058 CG HIS A 132 -16.792 -18.808 -6.551 1.00 0.00 C ATOM 2059 ND1 HIS A 132 -15.708 -19.080 -7.355 1.00 0.00 N ATOM 2060 CD2 HIS A 132 -17.708 -19.767 -6.827 1.00 0.00 C ATOM 2061 CE1 HIS A 132 -15.956 -20.151 -8.083 1.00 0.00 C ATOM 2062 NE2 HIS A 132 -17.163 -20.591 -7.782 1.00 0.00 N ATOM 0 H HIS A 132 -14.600 -18.627 -5.130 1.00 0.00 H new ATOM 0 HA HIS A 132 -16.418 -17.074 -3.549 1.00 0.00 H new ATOM 0 HB2 HIS A 132 -17.860 -17.274 -5.547 1.00 0.00 H new ATOM 0 HB3 HIS A 132 -16.226 -16.837 -6.007 1.00 0.00 H new ATOM 0 HD2 HIS A 132 -18.686 -19.866 -6.379 1.00 0.00 H new ATOM 0 HE1 HIS A 132 -15.285 -20.593 -8.804 1.00 0.00 H new ATOM 0 HE2 HIS A 132 -17.617 -21.408 -8.191 1.00 0.00 H new ATOM 2071 N HIS A 133 -16.711 -19.829 -2.646 1.00 0.00 N ATOM 2072 CA HIS A 133 -17.506 -20.821 -1.942 1.00 0.00 C ATOM 2073 C HIS A 133 -17.854 -20.309 -0.551 1.00 0.00 C ATOM 2074 O HIS A 133 -16.974 -20.141 0.291 1.00 0.00 O ATOM 2075 CB HIS A 133 -16.757 -22.149 -1.837 1.00 0.00 C ATOM 2076 CG HIS A 133 -17.605 -23.272 -1.321 1.00 0.00 C ATOM 2077 ND1 HIS A 133 -17.865 -23.471 0.020 1.00 0.00 N ATOM 2078 CD2 HIS A 133 -18.261 -24.255 -1.977 1.00 0.00 C ATOM 2079 CE1 HIS A 133 -18.640 -24.527 0.161 1.00 0.00 C ATOM 2080 NE2 HIS A 133 -18.900 -25.021 -1.033 1.00 0.00 N ATOM 0 H HIS A 133 -15.724 -19.814 -2.389 1.00 0.00 H new ATOM 0 HA HIS A 133 -18.423 -20.991 -2.506 1.00 0.00 H new ATOM 0 HB2 HIS A 133 -16.370 -22.418 -2.820 1.00 0.00 H new ATOM 0 HB3 HIS A 133 -15.897 -22.021 -1.180 1.00 0.00 H new ATOM 0 HD2 HIS A 133 -18.279 -24.409 -3.046 1.00 0.00 H new ATOM 0 HE1 HIS A 133 -19.002 -24.922 1.099 1.00 0.00 H new ATOM 0 HE2 HIS A 133 -19.480 -25.838 -1.224 1.00 0.00 H new ATOM 2089 N HIS A 134 -19.133 -20.068 -0.314 1.00 0.00 N ATOM 2090 CA HIS A 134 -19.580 -19.511 0.959 1.00 0.00 C ATOM 2091 C HIS A 134 -19.510 -20.558 2.067 1.00 0.00 C ATOM 2092 O HIS A 134 -19.353 -21.750 1.800 1.00 0.00 O ATOM 2093 CB HIS A 134 -21.009 -18.957 0.838 1.00 0.00 C ATOM 2094 CG HIS A 134 -22.069 -20.002 0.627 1.00 0.00 C ATOM 2095 ND1 HIS A 134 -22.520 -20.384 -0.617 1.00 0.00 N ATOM 2096 CD2 HIS A 134 -22.769 -20.741 1.519 1.00 0.00 C ATOM 2097 CE1 HIS A 134 -23.450 -21.311 -0.480 1.00 0.00 C ATOM 2098 NE2 HIS A 134 -23.618 -21.543 0.808 1.00 0.00 N ATOM 0 H HIS A 134 -19.882 -20.248 -0.983 1.00 0.00 H new ATOM 0 HA HIS A 134 -18.911 -18.691 1.220 1.00 0.00 H new ATOM 0 HB2 HIS A 134 -21.245 -18.396 1.742 1.00 0.00 H new ATOM 0 HB3 HIS A 134 -21.042 -18.252 0.008 1.00 0.00 H new ATOM 0 HD2 HIS A 134 -22.674 -20.704 2.594 1.00 0.00 H new ATOM 0 HE1 HIS A 134 -23.982 -21.796 -1.285 1.00 0.00 H new ATOM 0 HE2 HIS A 134 -24.275 -22.212 1.209 1.00 0.00 H new ATOM 2107 N HIS A 135 -19.617 -20.110 3.308 1.00 0.00 N ATOM 2108 CA HIS A 135 -19.620 -21.017 4.444 1.00 0.00 C ATOM 2109 C HIS A 135 -20.576 -20.506 5.515 1.00 0.00 C ATOM 2110 O HIS A 135 -20.159 -19.667 6.336 1.00 0.00 O ATOM 2111 CB HIS A 135 -18.204 -21.173 5.013 1.00 0.00 C ATOM 2112 CG HIS A 135 -18.102 -22.193 6.108 1.00 0.00 C ATOM 2113 ND1 HIS A 135 -17.988 -23.545 5.867 1.00 0.00 N ATOM 2114 CD2 HIS A 135 -18.094 -22.053 7.455 1.00 0.00 C ATOM 2115 CE1 HIS A 135 -17.916 -24.190 7.015 1.00 0.00 C ATOM 2116 NE2 HIS A 135 -17.978 -23.308 7.992 1.00 0.00 N ATOM 2117 OXT HIS A 135 -21.747 -20.935 5.515 1.00 0.00 O ATOM 0 H HIS A 135 -19.703 -19.124 3.554 1.00 0.00 H new ATOM 0 HA HIS A 135 -19.960 -21.997 4.110 1.00 0.00 H new ATOM 0 HB2 HIS A 135 -17.526 -21.451 4.206 1.00 0.00 H new ATOM 0 HB3 HIS A 135 -17.867 -20.209 5.394 1.00 0.00 H new ATOM 0 HD2 HIS A 135 -18.166 -21.125 8.003 1.00 0.00 H new ATOM 0 HE1 HIS A 135 -17.822 -25.259 7.134 1.00 0.00 H new ATOM 0 HE2 HIS A 135 -17.945 -23.525 8.988 1.00 0.00 H new TER 2126 HIS A 135