USER MOD reduce.3.24.130724 H: found=0, std=0, add=1057, rem=0, adj=21 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 19 TYR OH : rot 180:sc= -0.166 USER MOD Set 1.2: A 102 THR OG1 : rot 180:sc= 0.0952 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 165:sc= 1.31 (180deg=0.778) USER MOD Single : A 3 GLN : amide:sc= -0.898 K(o=-0.9,f=-0.073) USER MOD Single : A 5 SER OG : rot 180:sc= -0.0227 USER MOD Single : A 9 HIS : no HD1:sc= 0.597 K(o=0.6,f=-5.2!) USER MOD Single : A 13 THR OG1 : rot 180:sc= 0 USER MOD Single : A 21 LYS NZ :NH3+ 162:sc= -0.0611 (180deg=-0.395) 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 37:sc= 1.16 USER MOD Single : A 31 HIS : no HE2:sc= 0.177 K(o=0.18,f=-1.9) USER MOD Single : A 32 GLN : amide:sc= 0.0956 K(o=0.096,f=-3.9!) USER MOD Single : A 34 SER OG : rot 80:sc= 0.369 USER MOD Single : A 48 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 GLN : amide:sc= -0.369 X(o=-0.37,f=-0.15) USER MOD Single : A 56 TYR OH : rot 180:sc= 0 USER MOD Single : A 57 SER OG : rot -87:sc= 2.23 USER MOD Single : A 59 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 64 ASN : amide:sc= -1.56 K(o=-1.6,f=-3.9!) USER MOD Single : A 66 ASN : amide:sc= 0 K(o=0,f=-0.71) USER MOD Single : A 70 THR OG1 : rot 180:sc= 0 USER MOD Single : A 75 THR OG1 : rot -93:sc= 1.08 USER MOD Single : A 85 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 94 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 99 THR OG1 : rot -145:sc= 0.515 USER MOD Single : A 100 MET CE :methyl -156:sc= -0.179 (180deg=-0.937) USER MOD Single : A 101 GLN : amide:sc= 0 K(o=0,f=-0.57) USER MOD Single : A 108 THR OG1 : rot 73:sc= 0.238 USER MOD Single : A 109 TYR OH : rot 70:sc= 0.111 USER MOD Single : A 110 ASN : amide:sc= 0.986 K(o=0.99,f=0) USER MOD Single : A 112 MET CE :methyl 140:sc= -3.07! (180deg=-6.2!) USER MOD Single : A 130 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 131 HIS : no HD1:sc= 0 X(o=0,f=-0.014) USER MOD Single : A 132 HIS : no HE2:sc= -0.553 K(o=-0.55,f=-1.8) USER MOD Single : A 133 HIS : no HD1:sc=-0.00802 X(o=-0.008,f=0) USER MOD Single : A 134 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 135 HIS : no HD1:sc= 0 X(o=0,f=-0.0047) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -22.720 -3.704 -27.295 1.00 0.00 N ATOM 2 CA MET A 1 -21.371 -3.420 -26.756 1.00 0.00 C ATOM 3 C MET A 1 -21.333 -2.020 -26.164 1.00 0.00 C ATOM 4 O MET A 1 -22.366 -1.357 -26.062 1.00 0.00 O ATOM 5 CB MET A 1 -20.307 -3.550 -27.854 1.00 0.00 C ATOM 6 CG MET A 1 -20.101 -4.969 -28.364 1.00 0.00 C ATOM 7 SD MET A 1 -21.524 -5.611 -29.266 1.00 0.00 S ATOM 8 CE MET A 1 -20.948 -7.257 -29.675 1.00 0.00 C ATOM 0 H1 MET A 1 -22.678 -4.539 -27.914 1.00 0.00 H new ATOM 0 H2 MET A 1 -23.376 -3.888 -26.509 1.00 0.00 H new ATOM 0 H3 MET A 1 -23.055 -2.885 -27.841 1.00 0.00 H new ATOM 0 HA MET A 1 -21.153 -4.149 -25.975 1.00 0.00 H new ATOM 0 HB2 MET A 1 -20.588 -2.913 -28.692 1.00 0.00 H new ATOM 0 HB3 MET A 1 -19.359 -3.173 -27.471 1.00 0.00 H new ATOM 0 HG2 MET A 1 -19.226 -4.992 -29.014 1.00 0.00 H new ATOM 0 HG3 MET A 1 -19.888 -5.625 -27.520 1.00 0.00 H new ATOM 0 HE1 MET A 1 -21.720 -7.783 -30.237 1.00 0.00 H new ATOM 0 HE2 MET A 1 -20.044 -7.186 -30.280 1.00 0.00 H new ATOM 0 HE3 MET A 1 -20.729 -7.804 -28.758 1.00 0.00 H new ATOM 20 N ALA A 2 -20.146 -1.567 -25.775 1.00 0.00 N ATOM 21 CA ALA A 2 -19.998 -0.246 -25.190 1.00 0.00 C ATOM 22 C ALA A 2 -20.002 0.831 -26.270 1.00 0.00 C ATOM 23 O ALA A 2 -18.950 1.256 -26.751 1.00 0.00 O ATOM 24 CB ALA A 2 -18.727 -0.167 -24.356 1.00 0.00 C ATOM 0 H ALA A 2 -19.277 -2.095 -25.855 1.00 0.00 H new ATOM 0 HA ALA A 2 -20.850 -0.069 -24.533 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -18.635 0.831 -23.927 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -18.771 -0.904 -23.554 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -17.863 -0.371 -24.989 1.00 0.00 H new ATOM 30 N GLN A 3 -21.194 1.242 -26.672 1.00 0.00 N ATOM 31 CA GLN A 3 -21.347 2.304 -27.651 1.00 0.00 C ATOM 32 C GLN A 3 -22.430 3.272 -27.199 1.00 0.00 C ATOM 33 O GLN A 3 -23.622 3.045 -27.421 1.00 0.00 O ATOM 34 CB GLN A 3 -21.676 1.734 -29.035 1.00 0.00 C ATOM 35 CG GLN A 3 -21.840 2.798 -30.113 1.00 0.00 C ATOM 36 CD GLN A 3 -20.609 3.675 -30.281 1.00 0.00 C ATOM 37 OE1 GLN A 3 -20.716 4.855 -30.616 1.00 0.00 O ATOM 38 NE2 GLN A 3 -19.434 3.104 -30.077 1.00 0.00 N ATOM 0 H GLN A 3 -22.074 0.853 -26.333 1.00 0.00 H new ATOM 0 HA GLN A 3 -20.402 2.841 -27.729 1.00 0.00 H new ATOM 0 HB2 GLN A 3 -20.884 1.047 -29.333 1.00 0.00 H new ATOM 0 HB3 GLN A 3 -22.595 1.152 -28.969 1.00 0.00 H new ATOM 0 HG2 GLN A 3 -22.065 2.312 -31.063 1.00 0.00 H new ATOM 0 HG3 GLN A 3 -22.695 3.427 -29.867 1.00 0.00 H new ATOM 0 HE21 GLN A 3 -19.385 2.124 -29.800 1.00 0.00 H new ATOM 0 HE22 GLN A 3 -18.577 3.644 -30.196 1.00 0.00 H new ATOM 47 N ARG A 4 -22.002 4.332 -26.540 1.00 0.00 N ATOM 48 CA ARG A 4 -22.906 5.345 -26.024 1.00 0.00 C ATOM 49 C ARG A 4 -22.144 6.649 -25.850 1.00 0.00 C ATOM 50 O ARG A 4 -20.926 6.682 -26.030 1.00 0.00 O ATOM 51 CB ARG A 4 -23.505 4.898 -24.688 1.00 0.00 C ATOM 52 CG ARG A 4 -22.463 4.651 -23.610 1.00 0.00 C ATOM 53 CD ARG A 4 -23.101 4.202 -22.309 1.00 0.00 C ATOM 54 NE ARG A 4 -23.715 2.879 -22.418 1.00 0.00 N ATOM 55 CZ ARG A 4 -24.734 2.468 -21.665 1.00 0.00 C ATOM 56 NH1 ARG A 4 -25.349 3.318 -20.850 1.00 0.00 N ATOM 57 NH2 ARG A 4 -25.163 1.219 -21.752 1.00 0.00 N ATOM 0 H ARG A 4 -21.018 4.516 -26.347 1.00 0.00 H new ATOM 0 HA ARG A 4 -23.724 5.492 -26.730 1.00 0.00 H new ATOM 0 HB2 ARG A 4 -24.204 5.658 -24.339 1.00 0.00 H new ATOM 0 HB3 ARG A 4 -24.079 3.985 -24.844 1.00 0.00 H new ATOM 0 HG2 ARG A 4 -21.758 3.892 -23.951 1.00 0.00 H new ATOM 0 HG3 ARG A 4 -21.891 5.563 -23.440 1.00 0.00 H new ATOM 0 HD2 ARG A 4 -22.346 4.186 -21.523 1.00 0.00 H new ATOM 0 HD3 ARG A 4 -23.857 4.927 -22.009 1.00 0.00 H new ATOM 0 HE ARG A 4 -23.340 2.232 -23.112 1.00 0.00 H new ATOM 0 HH11 ARG A 4 -25.041 4.289 -20.799 1.00 0.00 H new ATOM 0 HH12 ARG A 4 -26.129 2.999 -20.275 1.00 0.00 H new ATOM 0 HH21 ARG A 4 -24.713 0.569 -22.397 1.00 0.00 H new ATOM 0 HH22 ARG A 4 -25.943 0.906 -21.174 1.00 0.00 H new ATOM 71 N SER A 5 -22.842 7.719 -25.512 1.00 0.00 N ATOM 72 CA SER A 5 -22.191 9.008 -25.335 1.00 0.00 C ATOM 73 C SER A 5 -22.915 9.866 -24.300 1.00 0.00 C ATOM 74 O SER A 5 -23.090 11.069 -24.490 1.00 0.00 O ATOM 75 CB SER A 5 -22.100 9.734 -26.682 1.00 0.00 C ATOM 76 OG SER A 5 -21.285 9.004 -27.589 1.00 0.00 O ATOM 0 H SER A 5 -23.850 7.723 -25.356 1.00 0.00 H new ATOM 0 HA SER A 5 -21.183 8.833 -24.958 1.00 0.00 H new ATOM 0 HB2 SER A 5 -23.098 9.860 -27.102 1.00 0.00 H new ATOM 0 HB3 SER A 5 -21.687 10.732 -26.536 1.00 0.00 H new ATOM 0 HG SER A 5 -21.239 9.481 -28.444 1.00 0.00 H new ATOM 82 N GLU A 6 -23.318 9.248 -23.195 1.00 0.00 N ATOM 83 CA GLU A 6 -23.898 9.993 -22.085 1.00 0.00 C ATOM 84 C GLU A 6 -22.795 10.799 -21.408 1.00 0.00 C ATOM 85 O GLU A 6 -22.750 12.026 -21.504 1.00 0.00 O ATOM 86 CB GLU A 6 -24.528 9.049 -21.064 1.00 0.00 C ATOM 87 CG GLU A 6 -25.493 8.034 -21.652 1.00 0.00 C ATOM 88 CD GLU A 6 -25.818 6.938 -20.660 1.00 0.00 C ATOM 89 OE1 GLU A 6 -25.066 5.944 -20.608 1.00 0.00 O ATOM 90 OE2 GLU A 6 -26.808 7.079 -19.908 1.00 0.00 O ATOM 0 H GLU A 6 -23.254 8.241 -23.045 1.00 0.00 H new ATOM 0 HA GLU A 6 -24.676 10.652 -22.470 1.00 0.00 H new ATOM 0 HB2 GLU A 6 -23.733 8.515 -20.543 1.00 0.00 H new ATOM 0 HB3 GLU A 6 -25.056 9.642 -20.317 1.00 0.00 H new ATOM 0 HG2 GLU A 6 -26.412 8.537 -21.954 1.00 0.00 H new ATOM 0 HG3 GLU A 6 -25.059 7.596 -22.551 1.00 0.00 H new ATOM 97 N ILE A 7 -21.902 10.084 -20.737 1.00 0.00 N ATOM 98 CA ILE A 7 -20.710 10.674 -20.149 1.00 0.00 C ATOM 99 C ILE A 7 -19.505 9.773 -20.416 1.00 0.00 C ATOM 100 O ILE A 7 -19.204 8.866 -19.643 1.00 0.00 O ATOM 101 CB ILE A 7 -20.859 10.926 -18.628 1.00 0.00 C ATOM 102 CG1 ILE A 7 -21.516 9.723 -17.933 1.00 0.00 C ATOM 103 CG2 ILE A 7 -21.656 12.197 -18.373 1.00 0.00 C ATOM 104 CD1 ILE A 7 -21.611 9.863 -16.427 1.00 0.00 C ATOM 0 H ILE A 7 -21.985 9.079 -20.586 1.00 0.00 H new ATOM 0 HA ILE A 7 -20.561 11.646 -20.619 1.00 0.00 H new ATOM 0 HB ILE A 7 -19.862 11.054 -18.206 1.00 0.00 H new ATOM 0 HG12 ILE A 7 -22.518 9.583 -18.339 1.00 0.00 H new ATOM 0 HG13 ILE A 7 -20.948 8.824 -18.170 1.00 0.00 H new ATOM 0 HG21 ILE A 7 -21.751 12.358 -17.299 1.00 0.00 H new ATOM 0 HG22 ILE A 7 -21.141 13.046 -18.823 1.00 0.00 H new ATOM 0 HG23 ILE A 7 -22.648 12.099 -18.814 1.00 0.00 H new ATOM 0 HD11 ILE A 7 -22.086 8.976 -16.008 1.00 0.00 H new ATOM 0 HD12 ILE A 7 -20.611 9.972 -16.008 1.00 0.00 H new ATOM 0 HD13 ILE A 7 -22.205 10.743 -16.180 1.00 0.00 H new ATOM 116 N PRO A 8 -18.814 10.003 -21.539 1.00 0.00 N ATOM 117 CA PRO A 8 -17.707 9.151 -21.980 1.00 0.00 C ATOM 118 C PRO A 8 -16.382 9.487 -21.298 1.00 0.00 C ATOM 119 O PRO A 8 -15.321 9.033 -21.727 1.00 0.00 O ATOM 120 CB PRO A 8 -17.631 9.454 -23.474 1.00 0.00 C ATOM 121 CG PRO A 8 -18.070 10.875 -23.594 1.00 0.00 C ATOM 122 CD PRO A 8 -19.060 11.114 -22.480 1.00 0.00 C ATOM 0 HA PRO A 8 -17.876 8.102 -21.737 1.00 0.00 H new ATOM 0 HB2 PRO A 8 -16.619 9.319 -23.855 1.00 0.00 H new ATOM 0 HB3 PRO A 8 -18.278 8.790 -24.046 1.00 0.00 H new ATOM 0 HG2 PRO A 8 -17.220 11.552 -23.509 1.00 0.00 H new ATOM 0 HG3 PRO A 8 -18.528 11.059 -24.566 1.00 0.00 H new ATOM 0 HD2 PRO A 8 -18.900 12.082 -22.005 1.00 0.00 H new ATOM 0 HD3 PRO A 8 -20.086 11.105 -22.849 1.00 0.00 H new ATOM 130 N HIS A 9 -16.445 10.277 -20.237 1.00 0.00 N ATOM 131 CA HIS A 9 -15.248 10.675 -19.515 1.00 0.00 C ATOM 132 C HIS A 9 -15.628 11.152 -18.119 1.00 0.00 C ATOM 133 O HIS A 9 -16.317 12.158 -17.970 1.00 0.00 O ATOM 134 CB HIS A 9 -14.514 11.781 -20.284 1.00 0.00 C ATOM 135 CG HIS A 9 -13.054 11.894 -19.958 1.00 0.00 C ATOM 136 ND1 HIS A 9 -12.294 12.995 -20.288 1.00 0.00 N ATOM 137 CD2 HIS A 9 -12.205 11.021 -19.361 1.00 0.00 C ATOM 138 CE1 HIS A 9 -11.045 12.793 -19.912 1.00 0.00 C ATOM 139 NE2 HIS A 9 -10.964 11.604 -19.346 1.00 0.00 N ATOM 0 H HIS A 9 -17.313 10.655 -19.857 1.00 0.00 H new ATOM 0 HA HIS A 9 -14.579 9.819 -19.423 1.00 0.00 H new ATOM 0 HB2 HIS A 9 -14.623 11.598 -21.353 1.00 0.00 H new ATOM 0 HB3 HIS A 9 -14.996 12.736 -20.074 1.00 0.00 H new ATOM 0 HD2 HIS A 9 -12.459 10.047 -18.970 1.00 0.00 H new ATOM 0 HE1 HIS A 9 -10.227 13.485 -20.045 1.00 0.00 H new ATOM 0 HE2 HIS A 9 -10.117 11.187 -18.960 1.00 0.00 H new ATOM 148 N PHE A 10 -15.197 10.410 -17.106 1.00 0.00 N ATOM 149 CA PHE A 10 -15.515 10.737 -15.719 1.00 0.00 C ATOM 150 C PHE A 10 -14.874 12.061 -15.309 1.00 0.00 C ATOM 151 O PHE A 10 -13.711 12.318 -15.613 1.00 0.00 O ATOM 152 CB PHE A 10 -15.050 9.617 -14.785 1.00 0.00 C ATOM 153 CG PHE A 10 -15.755 8.310 -15.016 1.00 0.00 C ATOM 154 CD1 PHE A 10 -15.292 7.414 -15.967 1.00 0.00 C ATOM 155 CD2 PHE A 10 -16.879 7.977 -14.279 1.00 0.00 C ATOM 156 CE1 PHE A 10 -15.940 6.212 -16.179 1.00 0.00 C ATOM 157 CE2 PHE A 10 -17.530 6.777 -14.486 1.00 0.00 C ATOM 158 CZ PHE A 10 -17.060 5.893 -15.437 1.00 0.00 C ATOM 0 H PHE A 10 -14.624 9.574 -17.219 1.00 0.00 H new ATOM 0 HA PHE A 10 -16.597 10.839 -15.637 1.00 0.00 H new ATOM 0 HB2 PHE A 10 -13.978 9.470 -14.914 1.00 0.00 H new ATOM 0 HB3 PHE A 10 -15.207 9.928 -13.752 1.00 0.00 H new ATOM 0 HD1 PHE A 10 -14.415 7.658 -16.549 1.00 0.00 H new ATOM 0 HD2 PHE A 10 -17.251 8.664 -13.533 1.00 0.00 H new ATOM 0 HE1 PHE A 10 -15.571 5.523 -16.924 1.00 0.00 H new ATOM 0 HE2 PHE A 10 -18.406 6.530 -13.905 1.00 0.00 H new ATOM 0 HZ PHE A 10 -17.568 4.954 -15.600 1.00 0.00 H new ATOM 168 N PRO A 11 -15.632 12.910 -14.600 1.00 0.00 N ATOM 169 CA PRO A 11 -15.200 14.257 -14.214 1.00 0.00 C ATOM 170 C PRO A 11 -14.316 14.275 -12.963 1.00 0.00 C ATOM 171 O PRO A 11 -14.451 15.166 -12.123 1.00 0.00 O ATOM 172 CB PRO A 11 -16.526 14.989 -13.933 1.00 0.00 C ATOM 173 CG PRO A 11 -17.620 14.001 -14.208 1.00 0.00 C ATOM 174 CD PRO A 11 -16.991 12.644 -14.131 1.00 0.00 C ATOM 0 HA PRO A 11 -14.588 14.714 -14.992 1.00 0.00 H new ATOM 0 HB2 PRO A 11 -16.567 15.337 -12.901 1.00 0.00 H new ATOM 0 HB3 PRO A 11 -16.627 15.868 -14.570 1.00 0.00 H new ATOM 0 HG2 PRO A 11 -18.424 14.099 -13.479 1.00 0.00 H new ATOM 0 HG3 PRO A 11 -18.059 14.171 -15.191 1.00 0.00 H new ATOM 0 HD2 PRO A 11 -17.002 12.247 -13.116 1.00 0.00 H new ATOM 0 HD3 PRO A 11 -17.506 11.920 -14.762 1.00 0.00 H new ATOM 182 N ARG A 12 -13.401 13.306 -12.867 1.00 0.00 N ATOM 183 CA ARG A 12 -12.457 13.207 -11.748 1.00 0.00 C ATOM 184 C ARG A 12 -13.173 12.847 -10.449 1.00 0.00 C ATOM 185 O ARG A 12 -13.856 13.673 -9.844 1.00 0.00 O ATOM 186 CB ARG A 12 -11.665 14.511 -11.572 1.00 0.00 C ATOM 187 CG ARG A 12 -10.911 14.941 -12.819 1.00 0.00 C ATOM 188 CD ARG A 12 -10.184 16.255 -12.606 1.00 0.00 C ATOM 189 NE ARG A 12 -9.540 16.725 -13.830 1.00 0.00 N ATOM 190 CZ ARG A 12 -9.361 18.005 -14.134 1.00 0.00 C ATOM 191 NH1 ARG A 12 -9.793 18.955 -13.314 1.00 0.00 N ATOM 192 NH2 ARG A 12 -8.752 18.336 -15.266 1.00 0.00 N ATOM 0 H ARG A 12 -13.293 12.568 -13.562 1.00 0.00 H new ATOM 0 HA ARG A 12 -11.756 12.407 -11.987 1.00 0.00 H new ATOM 0 HB2 ARG A 12 -12.351 15.306 -11.281 1.00 0.00 H new ATOM 0 HB3 ARG A 12 -10.956 14.387 -10.754 1.00 0.00 H new ATOM 0 HG2 ARG A 12 -10.194 14.168 -13.096 1.00 0.00 H new ATOM 0 HG3 ARG A 12 -11.609 15.041 -13.650 1.00 0.00 H new ATOM 0 HD2 ARG A 12 -10.890 17.008 -12.255 1.00 0.00 H new ATOM 0 HD3 ARG A 12 -9.434 16.133 -11.825 1.00 0.00 H new ATOM 0 HE ARG A 12 -9.207 16.025 -14.493 1.00 0.00 H new ATOM 0 HH11 ARG A 12 -10.265 18.703 -12.446 1.00 0.00 H new ATOM 0 HH12 ARG A 12 -9.653 19.937 -13.552 1.00 0.00 H new ATOM 0 HH21 ARG A 12 -8.423 17.608 -15.900 1.00 0.00 H new ATOM 0 HH22 ARG A 12 -8.613 19.319 -15.502 1.00 0.00 H new ATOM 206 N THR A 13 -13.031 11.600 -10.033 1.00 0.00 N ATOM 207 CA THR A 13 -13.642 11.140 -8.795 1.00 0.00 C ATOM 208 C THR A 13 -12.676 10.253 -8.011 1.00 0.00 C ATOM 209 O THR A 13 -12.258 9.202 -8.492 1.00 0.00 O ATOM 210 CB THR A 13 -14.944 10.366 -9.082 1.00 0.00 C ATOM 211 OG1 THR A 13 -15.798 11.163 -9.915 1.00 0.00 O ATOM 212 CG2 THR A 13 -15.673 10.019 -7.790 1.00 0.00 C ATOM 0 H THR A 13 -12.499 10.888 -10.533 1.00 0.00 H new ATOM 0 HA THR A 13 -13.880 12.018 -8.195 1.00 0.00 H new ATOM 0 HB THR A 13 -14.687 9.436 -9.590 1.00 0.00 H new ATOM 0 HG1 THR A 13 -16.626 10.672 -10.100 1.00 0.00 H new ATOM 0 HG21 THR A 13 -16.587 9.474 -8.023 1.00 0.00 H new ATOM 0 HG22 THR A 13 -15.030 9.399 -7.165 1.00 0.00 H new ATOM 0 HG23 THR A 13 -15.924 10.936 -7.256 1.00 0.00 H new ATOM 220 N ALA A 14 -12.312 10.693 -6.815 1.00 0.00 N ATOM 221 CA ALA A 14 -11.394 9.942 -5.970 1.00 0.00 C ATOM 222 C ALA A 14 -12.043 9.608 -4.632 1.00 0.00 C ATOM 223 O ALA A 14 -11.377 9.161 -3.698 1.00 0.00 O ATOM 224 CB ALA A 14 -10.114 10.735 -5.755 1.00 0.00 C ATOM 0 H ALA A 14 -12.639 11.569 -6.407 1.00 0.00 H new ATOM 0 HA ALA A 14 -11.148 9.006 -6.472 1.00 0.00 H new ATOM 0 HB1 ALA A 14 -9.435 10.164 -5.122 1.00 0.00 H new ATOM 0 HB2 ALA A 14 -9.639 10.927 -6.717 1.00 0.00 H new ATOM 0 HB3 ALA A 14 -10.350 11.683 -5.272 1.00 0.00 H new ATOM 230 N ALA A 15 -13.350 9.821 -4.551 1.00 0.00 N ATOM 231 CA ALA A 15 -14.087 9.608 -3.313 1.00 0.00 C ATOM 232 C ALA A 15 -14.635 8.189 -3.231 1.00 0.00 C ATOM 233 O ALA A 15 -15.486 7.792 -4.031 1.00 0.00 O ATOM 234 CB ALA A 15 -15.218 10.621 -3.197 1.00 0.00 C ATOM 0 H ALA A 15 -13.923 10.142 -5.331 1.00 0.00 H new ATOM 0 HA ALA A 15 -13.397 9.747 -2.480 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -15.763 10.453 -2.268 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -14.805 11.630 -3.198 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -15.897 10.506 -4.042 1.00 0.00 H new ATOM 240 N ILE A 16 -14.148 7.435 -2.258 1.00 0.00 N ATOM 241 CA ILE A 16 -14.596 6.067 -2.040 1.00 0.00 C ATOM 242 C ILE A 16 -15.456 6.004 -0.784 1.00 0.00 C ATOM 243 O ILE A 16 -15.039 6.447 0.287 1.00 0.00 O ATOM 244 CB ILE A 16 -13.403 5.096 -1.918 1.00 0.00 C ATOM 245 CG1 ILE A 16 -12.554 5.160 -3.191 1.00 0.00 C ATOM 246 CG2 ILE A 16 -13.890 3.671 -1.671 1.00 0.00 C ATOM 247 CD1 ILE A 16 -11.300 4.316 -3.136 1.00 0.00 C ATOM 0 H ILE A 16 -13.435 7.751 -1.600 1.00 0.00 H new ATOM 0 HA ILE A 16 -15.187 5.759 -2.903 1.00 0.00 H new ATOM 0 HB ILE A 16 -12.791 5.395 -1.067 1.00 0.00 H new ATOM 0 HG12 ILE A 16 -13.161 4.837 -4.037 1.00 0.00 H new ATOM 0 HG13 ILE A 16 -12.274 6.197 -3.377 1.00 0.00 H new ATOM 0 HG21 ILE A 16 -13.033 3.003 -1.588 1.00 0.00 H new ATOM 0 HG22 ILE A 16 -14.466 3.639 -0.746 1.00 0.00 H new ATOM 0 HG23 ILE A 16 -14.519 3.352 -2.502 1.00 0.00 H new ATOM 0 HD11 ILE A 16 -10.754 4.415 -4.074 1.00 0.00 H new ATOM 0 HD12 ILE A 16 -10.671 4.653 -2.312 1.00 0.00 H new ATOM 0 HD13 ILE A 16 -11.571 3.271 -2.982 1.00 0.00 H new ATOM 259 N ASP A 17 -16.649 5.451 -0.920 1.00 0.00 N ATOM 260 CA ASP A 17 -17.644 5.512 0.142 1.00 0.00 C ATOM 261 C ASP A 17 -17.427 4.414 1.174 1.00 0.00 C ATOM 262 O ASP A 17 -17.268 4.694 2.364 1.00 0.00 O ATOM 263 CB ASP A 17 -19.055 5.407 -0.446 1.00 0.00 C ATOM 264 CG ASP A 17 -20.134 5.654 0.589 1.00 0.00 C ATOM 265 OD1 ASP A 17 -20.402 6.836 0.898 1.00 0.00 O ATOM 266 OD2 ASP A 17 -20.722 4.676 1.090 1.00 0.00 O ATOM 0 H ASP A 17 -16.955 4.953 -1.756 1.00 0.00 H new ATOM 0 HA ASP A 17 -17.534 6.473 0.645 1.00 0.00 H new ATOM 0 HB2 ASP A 17 -19.162 6.128 -1.257 1.00 0.00 H new ATOM 0 HB3 ASP A 17 -19.192 4.416 -0.880 1.00 0.00 H new ATOM 271 N ALA A 18 -17.398 3.171 0.715 1.00 0.00 N ATOM 272 CA ALA A 18 -17.282 2.033 1.611 1.00 0.00 C ATOM 273 C ALA A 18 -16.340 0.980 1.047 1.00 0.00 C ATOM 274 O ALA A 18 -16.200 0.839 -0.171 1.00 0.00 O ATOM 275 CB ALA A 18 -18.654 1.427 1.868 1.00 0.00 C ATOM 0 H ALA A 18 -17.453 2.926 -0.274 1.00 0.00 H new ATOM 0 HA ALA A 18 -16.865 2.387 2.554 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -18.555 0.575 2.541 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -19.303 2.175 2.323 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -19.088 1.096 0.925 1.00 0.00 H new ATOM 281 N TYR A 19 -15.691 0.254 1.942 1.00 0.00 N ATOM 282 CA TYR A 19 -14.802 -0.829 1.566 1.00 0.00 C ATOM 283 C TYR A 19 -15.191 -2.104 2.307 1.00 0.00 C ATOM 284 O TYR A 19 -15.168 -2.147 3.539 1.00 0.00 O ATOM 285 CB TYR A 19 -13.349 -0.444 1.875 1.00 0.00 C ATOM 286 CG TYR A 19 -12.365 -1.588 1.772 1.00 0.00 C ATOM 287 CD1 TYR A 19 -12.095 -2.200 0.556 1.00 0.00 C ATOM 288 CD2 TYR A 19 -11.700 -2.049 2.901 1.00 0.00 C ATOM 289 CE1 TYR A 19 -11.192 -3.243 0.469 1.00 0.00 C ATOM 290 CE2 TYR A 19 -10.797 -3.089 2.821 1.00 0.00 C ATOM 291 CZ TYR A 19 -10.546 -3.682 1.605 1.00 0.00 C ATOM 292 OH TYR A 19 -9.644 -4.720 1.526 1.00 0.00 O ATOM 0 H TYR A 19 -15.766 0.400 2.949 1.00 0.00 H new ATOM 0 HA TYR A 19 -14.891 -1.012 0.495 1.00 0.00 H new ATOM 0 HB2 TYR A 19 -13.042 0.346 1.190 1.00 0.00 H new ATOM 0 HB3 TYR A 19 -13.302 -0.030 2.882 1.00 0.00 H new ATOM 0 HD1 TYR A 19 -12.598 -1.856 -0.336 1.00 0.00 H new ATOM 0 HD2 TYR A 19 -11.893 -1.586 3.857 1.00 0.00 H new ATOM 0 HE1 TYR A 19 -10.994 -3.711 -0.484 1.00 0.00 H new ATOM 0 HE2 TYR A 19 -10.289 -3.436 3.709 1.00 0.00 H new ATOM 0 HH TYR A 19 -9.278 -4.904 2.416 1.00 0.00 H new ATOM 302 N GLY A 20 -15.562 -3.131 1.559 1.00 0.00 N ATOM 303 CA GLY A 20 -15.955 -4.382 2.170 1.00 0.00 C ATOM 304 C GLY A 20 -16.768 -5.250 1.236 1.00 0.00 C ATOM 305 O GLY A 20 -16.226 -5.837 0.298 1.00 0.00 O ATOM 0 H GLY A 20 -15.598 -3.120 0.540 1.00 0.00 H new ATOM 0 HA2 GLY A 20 -15.064 -4.926 2.483 1.00 0.00 H new ATOM 0 HA3 GLY A 20 -16.536 -4.177 3.069 1.00 0.00 H new ATOM 309 N LYS A 21 -18.071 -5.322 1.482 1.00 0.00 N ATOM 310 CA LYS A 21 -18.950 -6.156 0.676 1.00 0.00 C ATOM 311 C LYS A 21 -19.066 -5.606 -0.740 1.00 0.00 C ATOM 312 O LYS A 21 -19.362 -4.428 -0.936 1.00 0.00 O ATOM 313 CB LYS A 21 -20.336 -6.265 1.314 1.00 0.00 C ATOM 314 CG LYS A 21 -21.268 -7.192 0.552 1.00 0.00 C ATOM 315 CD LYS A 21 -22.581 -7.412 1.283 1.00 0.00 C ATOM 316 CE LYS A 21 -23.455 -8.413 0.545 1.00 0.00 C ATOM 317 NZ LYS A 21 -22.800 -9.745 0.433 1.00 0.00 N ATOM 0 H LYS A 21 -18.540 -4.814 2.232 1.00 0.00 H new ATOM 0 HA LYS A 21 -18.513 -7.153 0.628 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -20.232 -6.625 2.338 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -20.784 -5.273 1.369 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -21.469 -6.773 -0.434 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -20.776 -8.152 0.396 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -22.383 -7.772 2.293 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -23.110 -6.464 1.380 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -24.406 -8.519 1.067 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -23.679 -8.034 -0.452 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -23.515 -10.466 0.210 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -22.087 -9.719 -0.324 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -22.339 -9.982 1.335 1.00 0.00 H new ATOM 331 N GLY A 22 -18.819 -6.464 -1.720 1.00 0.00 N ATOM 332 CA GLY A 22 -18.894 -6.050 -3.106 1.00 0.00 C ATOM 333 C GLY A 22 -17.556 -5.565 -3.624 1.00 0.00 C ATOM 334 O GLY A 22 -17.408 -5.275 -4.810 1.00 0.00 O ATOM 0 H GLY A 22 -18.567 -7.442 -1.579 1.00 0.00 H new ATOM 0 HA2 GLY A 22 -19.238 -6.885 -3.716 1.00 0.00 H new ATOM 0 HA3 GLY A 22 -19.633 -5.255 -3.208 1.00 0.00 H new ATOM 338 N GLY A 23 -16.581 -5.485 -2.732 1.00 0.00 N ATOM 339 CA GLY A 23 -15.270 -5.010 -3.109 1.00 0.00 C ATOM 340 C GLY A 23 -15.135 -3.520 -2.898 1.00 0.00 C ATOM 341 O GLY A 23 -14.667 -3.074 -1.850 1.00 0.00 O ATOM 0 H GLY A 23 -16.677 -5.742 -1.750 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -14.512 -5.531 -2.524 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -15.084 -5.248 -4.156 1.00 0.00 H new ATOM 345 N PHE A 24 -15.567 -2.747 -3.883 1.00 0.00 N ATOM 346 CA PHE A 24 -15.501 -1.298 -3.796 1.00 0.00 C ATOM 347 C PHE A 24 -16.886 -0.689 -3.910 1.00 0.00 C ATOM 348 O PHE A 24 -17.689 -1.102 -4.750 1.00 0.00 O ATOM 349 CB PHE A 24 -14.609 -0.728 -4.898 1.00 0.00 C ATOM 350 CG PHE A 24 -13.184 -1.174 -4.810 1.00 0.00 C ATOM 351 CD1 PHE A 24 -12.357 -0.689 -3.813 1.00 0.00 C ATOM 352 CD2 PHE A 24 -12.672 -2.080 -5.723 1.00 0.00 C ATOM 353 CE1 PHE A 24 -11.045 -1.098 -3.727 1.00 0.00 C ATOM 354 CE2 PHE A 24 -11.360 -2.492 -5.643 1.00 0.00 C ATOM 355 CZ PHE A 24 -10.546 -2.002 -4.643 1.00 0.00 C ATOM 0 H PHE A 24 -15.967 -3.100 -4.752 1.00 0.00 H new ATOM 0 HA PHE A 24 -15.076 -1.045 -2.825 1.00 0.00 H new ATOM 0 HB2 PHE A 24 -15.013 -1.020 -5.867 1.00 0.00 H new ATOM 0 HB3 PHE A 24 -14.643 0.361 -4.854 1.00 0.00 H new ATOM 0 HD1 PHE A 24 -12.744 0.018 -3.094 1.00 0.00 H new ATOM 0 HD2 PHE A 24 -13.307 -2.468 -6.506 1.00 0.00 H new ATOM 0 HE1 PHE A 24 -10.408 -0.712 -2.945 1.00 0.00 H new ATOM 0 HE2 PHE A 24 -10.969 -3.197 -6.362 1.00 0.00 H new ATOM 0 HZ PHE A 24 -9.518 -2.326 -4.577 1.00 0.00 H new ATOM 365 N TYR A 25 -17.165 0.282 -3.059 1.00 0.00 N ATOM 366 CA TYR A 25 -18.399 1.033 -3.137 1.00 0.00 C ATOM 367 C TYR A 25 -18.098 2.518 -3.022 1.00 0.00 C ATOM 368 O TYR A 25 -17.435 2.957 -2.083 1.00 0.00 O ATOM 369 CB TYR A 25 -19.375 0.594 -2.042 1.00 0.00 C ATOM 370 CG TYR A 25 -20.721 1.279 -2.123 1.00 0.00 C ATOM 371 CD1 TYR A 25 -21.408 1.359 -3.328 1.00 0.00 C ATOM 372 CD2 TYR A 25 -21.304 1.846 -0.999 1.00 0.00 C ATOM 373 CE1 TYR A 25 -22.635 1.984 -3.412 1.00 0.00 C ATOM 374 CE2 TYR A 25 -22.531 2.474 -1.075 1.00 0.00 C ATOM 375 CZ TYR A 25 -23.194 2.538 -2.283 1.00 0.00 C ATOM 376 OH TYR A 25 -24.416 3.163 -2.361 1.00 0.00 O ATOM 0 H TYR A 25 -16.546 0.569 -2.301 1.00 0.00 H new ATOM 0 HA TYR A 25 -18.871 0.838 -4.100 1.00 0.00 H new ATOM 0 HB2 TYR A 25 -19.521 -0.484 -2.107 1.00 0.00 H new ATOM 0 HB3 TYR A 25 -18.931 0.797 -1.068 1.00 0.00 H new ATOM 0 HD1 TYR A 25 -20.973 0.924 -4.216 1.00 0.00 H new ATOM 0 HD2 TYR A 25 -20.790 1.795 -0.050 1.00 0.00 H new ATOM 0 HE1 TYR A 25 -23.154 2.038 -4.358 1.00 0.00 H new ATOM 0 HE2 TYR A 25 -22.970 2.914 -0.192 1.00 0.00 H new ATOM 0 HH TYR A 25 -24.669 3.499 -1.476 1.00 0.00 H new ATOM 386 N PHE A 26 -18.566 3.283 -3.992 1.00 0.00 N ATOM 387 CA PHE A 26 -18.341 4.719 -4.010 1.00 0.00 C ATOM 388 C PHE A 26 -19.603 5.431 -4.459 1.00 0.00 C ATOM 389 O PHE A 26 -20.602 4.778 -4.762 1.00 0.00 O ATOM 390 CB PHE A 26 -17.158 5.075 -4.922 1.00 0.00 C ATOM 391 CG PHE A 26 -17.274 4.541 -6.325 1.00 0.00 C ATOM 392 CD1 PHE A 26 -17.903 5.282 -7.314 1.00 0.00 C ATOM 393 CD2 PHE A 26 -16.747 3.303 -6.654 1.00 0.00 C ATOM 394 CE1 PHE A 26 -18.004 4.796 -8.603 1.00 0.00 C ATOM 395 CE2 PHE A 26 -16.846 2.813 -7.942 1.00 0.00 C ATOM 396 CZ PHE A 26 -17.474 3.560 -8.917 1.00 0.00 C ATOM 0 H PHE A 26 -19.107 2.932 -4.782 1.00 0.00 H new ATOM 0 HA PHE A 26 -18.092 5.049 -3.001 1.00 0.00 H new ATOM 0 HB2 PHE A 26 -17.062 6.160 -4.966 1.00 0.00 H new ATOM 0 HB3 PHE A 26 -16.241 4.691 -4.474 1.00 0.00 H new ATOM 0 HD1 PHE A 26 -18.318 6.250 -7.074 1.00 0.00 H new ATOM 0 HD2 PHE A 26 -16.253 2.714 -5.895 1.00 0.00 H new ATOM 0 HE1 PHE A 26 -18.497 5.382 -9.365 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -16.432 1.846 -8.185 1.00 0.00 H new ATOM 0 HZ PHE A 26 -17.551 3.179 -9.925 1.00 0.00 H new ATOM 406 N ALA A 27 -19.564 6.759 -4.473 1.00 0.00 N ATOM 407 CA ALA A 27 -20.693 7.554 -4.931 1.00 0.00 C ATOM 408 C ALA A 27 -20.998 7.245 -6.393 1.00 0.00 C ATOM 409 O ALA A 27 -20.426 7.846 -7.302 1.00 0.00 O ATOM 410 CB ALA A 27 -20.413 9.038 -4.743 1.00 0.00 C ATOM 0 H ALA A 27 -18.759 7.307 -4.171 1.00 0.00 H new ATOM 0 HA ALA A 27 -21.567 7.294 -4.333 1.00 0.00 H new ATOM 0 HB1 ALA A 27 -21.269 9.617 -5.091 1.00 0.00 H new ATOM 0 HB2 ALA A 27 -20.241 9.245 -3.687 1.00 0.00 H new ATOM 0 HB3 ALA A 27 -19.529 9.317 -5.316 1.00 0.00 H new ATOM 416 N GLY A 28 -21.870 6.270 -6.604 1.00 0.00 N ATOM 417 CA GLY A 28 -22.201 5.836 -7.939 1.00 0.00 C ATOM 418 C GLY A 28 -22.591 4.375 -7.978 1.00 0.00 C ATOM 419 O GLY A 28 -23.775 4.048 -8.047 1.00 0.00 O ATOM 0 H GLY A 28 -22.358 5.768 -5.862 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -23.022 6.441 -8.324 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -21.347 6.001 -8.596 1.00 0.00 H new ATOM 423 N MET A 29 -21.605 3.486 -7.901 1.00 0.00 N ATOM 424 CA MET A 29 -21.866 2.053 -8.025 1.00 0.00 C ATOM 425 C MET A 29 -20.897 1.228 -7.179 1.00 0.00 C ATOM 426 O MET A 29 -19.982 1.770 -6.554 1.00 0.00 O ATOM 427 CB MET A 29 -21.763 1.622 -9.493 1.00 0.00 C ATOM 428 CG MET A 29 -20.381 1.828 -10.093 1.00 0.00 C ATOM 429 SD MET A 29 -20.265 1.232 -11.791 1.00 0.00 S ATOM 430 CE MET A 29 -18.569 1.656 -12.185 1.00 0.00 C ATOM 0 H MET A 29 -20.625 3.728 -7.755 1.00 0.00 H new ATOM 0 HA MET A 29 -22.876 1.870 -7.659 1.00 0.00 H new ATOM 0 HB2 MET A 29 -22.031 0.569 -9.573 1.00 0.00 H new ATOM 0 HB3 MET A 29 -22.492 2.182 -10.079 1.00 0.00 H new ATOM 0 HG2 MET A 29 -20.132 2.889 -10.067 1.00 0.00 H new ATOM 0 HG3 MET A 29 -19.642 1.312 -9.480 1.00 0.00 H new ATOM 0 HE1 MET A 29 -18.345 1.349 -13.207 1.00 0.00 H new ATOM 0 HE2 MET A 29 -18.432 2.733 -12.091 1.00 0.00 H new ATOM 0 HE3 MET A 29 -17.897 1.144 -11.497 1.00 0.00 H new ATOM 440 N SER A 30 -21.116 -0.083 -7.170 1.00 0.00 N ATOM 441 CA SER A 30 -20.247 -1.022 -6.478 1.00 0.00 C ATOM 442 C SER A 30 -19.871 -2.160 -7.427 1.00 0.00 C ATOM 443 O SER A 30 -20.703 -2.608 -8.219 1.00 0.00 O ATOM 444 CB SER A 30 -20.961 -1.588 -5.246 1.00 0.00 C ATOM 445 OG SER A 30 -20.107 -2.427 -4.486 1.00 0.00 O ATOM 0 H SER A 30 -21.904 -0.523 -7.645 1.00 0.00 H new ATOM 0 HA SER A 30 -19.344 -0.505 -6.155 1.00 0.00 H new ATOM 0 HB2 SER A 30 -21.316 -0.768 -4.622 1.00 0.00 H new ATOM 0 HB3 SER A 30 -21.839 -2.152 -5.561 1.00 0.00 H new ATOM 0 HG SER A 30 -19.197 -2.064 -4.498 1.00 0.00 H new ATOM 451 N HIS A 31 -18.623 -2.618 -7.360 1.00 0.00 N ATOM 452 CA HIS A 31 -18.166 -3.701 -8.225 1.00 0.00 C ATOM 453 C HIS A 31 -16.817 -4.240 -7.754 1.00 0.00 C ATOM 454 O HIS A 31 -16.050 -3.529 -7.102 1.00 0.00 O ATOM 455 CB HIS A 31 -18.051 -3.212 -9.675 1.00 0.00 C ATOM 456 CG HIS A 31 -17.921 -4.321 -10.676 1.00 0.00 C ATOM 457 ND1 HIS A 31 -16.727 -4.680 -11.262 1.00 0.00 N ATOM 458 CD2 HIS A 31 -18.854 -5.153 -11.197 1.00 0.00 C ATOM 459 CE1 HIS A 31 -16.930 -5.680 -12.096 1.00 0.00 C ATOM 460 NE2 HIS A 31 -18.212 -5.987 -12.076 1.00 0.00 N ATOM 0 H HIS A 31 -17.915 -2.258 -6.720 1.00 0.00 H new ATOM 0 HA HIS A 31 -18.900 -4.506 -8.175 1.00 0.00 H new ATOM 0 HB2 HIS A 31 -18.930 -2.615 -9.919 1.00 0.00 H new ATOM 0 HB3 HIS A 31 -17.186 -2.554 -9.760 1.00 0.00 H new ATOM 0 HD1 HIS A 31 -15.825 -4.240 -11.079 1.00 0.00 H new ATOM 0 HD2 HIS A 31 -19.908 -5.159 -10.963 1.00 0.00 H new ATOM 0 HE1 HIS A 31 -16.174 -6.166 -12.695 1.00 0.00 H new ATOM 469 N GLN A 32 -16.544 -5.501 -8.076 1.00 0.00 N ATOM 470 CA GLN A 32 -15.256 -6.115 -7.771 1.00 0.00 C ATOM 471 C GLN A 32 -14.255 -5.794 -8.882 1.00 0.00 C ATOM 472 O GLN A 32 -14.475 -4.886 -9.685 1.00 0.00 O ATOM 473 CB GLN A 32 -15.383 -7.642 -7.635 1.00 0.00 C ATOM 474 CG GLN A 32 -16.690 -8.125 -7.024 1.00 0.00 C ATOM 475 CD GLN A 32 -17.775 -8.332 -8.067 1.00 0.00 C ATOM 476 OE1 GLN A 32 -18.551 -7.423 -8.370 1.00 0.00 O ATOM 477 NE2 GLN A 32 -17.821 -9.525 -8.638 1.00 0.00 N ATOM 0 H GLN A 32 -17.201 -6.120 -8.550 1.00 0.00 H new ATOM 0 HA GLN A 32 -14.907 -5.709 -6.821 1.00 0.00 H new ATOM 0 HB2 GLN A 32 -15.273 -8.090 -8.622 1.00 0.00 H new ATOM 0 HB3 GLN A 32 -14.557 -8.008 -7.025 1.00 0.00 H new ATOM 0 HG2 GLN A 32 -16.516 -9.061 -6.494 1.00 0.00 H new ATOM 0 HG3 GLN A 32 -17.033 -7.400 -6.286 1.00 0.00 H new ATOM 0 HE21 GLN A 32 -17.160 -10.250 -8.358 1.00 0.00 H new ATOM 0 HE22 GLN A 32 -18.517 -9.719 -9.358 1.00 0.00 H new ATOM 486 N GLY A 33 -13.164 -6.547 -8.932 1.00 0.00 N ATOM 487 CA GLY A 33 -12.175 -6.348 -9.971 1.00 0.00 C ATOM 488 C GLY A 33 -11.134 -5.325 -9.569 1.00 0.00 C ATOM 489 O GLY A 33 -10.797 -5.211 -8.393 1.00 0.00 O ATOM 0 H GLY A 33 -12.947 -7.292 -8.271 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -11.686 -7.296 -10.193 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -12.670 -6.023 -10.886 1.00 0.00 H new ATOM 493 N SER A 34 -10.631 -4.585 -10.541 1.00 0.00 N ATOM 494 CA SER A 34 -9.643 -3.556 -10.277 1.00 0.00 C ATOM 495 C SER A 34 -10.106 -2.222 -10.849 1.00 0.00 C ATOM 496 O SER A 34 -10.691 -2.168 -11.937 1.00 0.00 O ATOM 497 CB SER A 34 -8.296 -3.952 -10.879 1.00 0.00 C ATOM 498 OG SER A 34 -7.853 -5.196 -10.363 1.00 0.00 O ATOM 0 H SER A 34 -10.892 -4.678 -11.523 1.00 0.00 H new ATOM 0 HA SER A 34 -9.526 -3.451 -9.198 1.00 0.00 H new ATOM 0 HB2 SER A 34 -8.383 -4.015 -11.964 1.00 0.00 H new ATOM 0 HB3 SER A 34 -7.557 -3.181 -10.663 1.00 0.00 H new ATOM 0 HG SER A 34 -8.314 -5.926 -10.828 1.00 0.00 H new ATOM 504 N LEU A 35 -9.856 -1.154 -10.113 1.00 0.00 N ATOM 505 CA LEU A 35 -10.259 0.178 -10.537 1.00 0.00 C ATOM 506 C LEU A 35 -9.052 1.090 -10.659 1.00 0.00 C ATOM 507 O LEU A 35 -8.153 1.063 -9.813 1.00 0.00 O ATOM 508 CB LEU A 35 -11.268 0.771 -9.549 1.00 0.00 C ATOM 509 CG LEU A 35 -12.584 0.001 -9.408 1.00 0.00 C ATOM 510 CD1 LEU A 35 -13.471 0.651 -8.361 1.00 0.00 C ATOM 511 CD2 LEU A 35 -13.309 -0.075 -10.746 1.00 0.00 C ATOM 0 H LEU A 35 -9.374 -1.182 -9.215 1.00 0.00 H new ATOM 0 HA LEU A 35 -10.732 0.095 -11.516 1.00 0.00 H new ATOM 0 HB2 LEU A 35 -10.796 0.832 -8.568 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -11.496 1.791 -9.858 1.00 0.00 H new ATOM 0 HG LEU A 35 -12.353 -1.014 -9.085 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -14.402 0.091 -8.274 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -12.958 0.653 -7.400 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -13.691 1.677 -8.657 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -14.241 -0.626 -10.624 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -13.527 0.933 -11.100 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -12.678 -0.586 -11.473 1.00 0.00 H new ATOM 523 N LEU A 36 -9.029 1.889 -11.711 1.00 0.00 N ATOM 524 CA LEU A 36 -7.952 2.836 -11.933 1.00 0.00 C ATOM 525 C LEU A 36 -8.384 4.220 -11.493 1.00 0.00 C ATOM 526 O LEU A 36 -9.055 4.939 -12.239 1.00 0.00 O ATOM 527 CB LEU A 36 -7.553 2.874 -13.414 1.00 0.00 C ATOM 528 CG LEU A 36 -6.940 1.589 -13.970 1.00 0.00 C ATOM 529 CD1 LEU A 36 -6.869 1.656 -15.485 1.00 0.00 C ATOM 530 CD2 LEU A 36 -5.553 1.367 -13.388 1.00 0.00 C ATOM 0 H LEU A 36 -9.752 1.900 -12.431 1.00 0.00 H new ATOM 0 HA LEU A 36 -7.091 2.515 -11.347 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -8.437 3.117 -14.003 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -6.841 3.686 -13.558 1.00 0.00 H new ATOM 0 HG LEU A 36 -7.574 0.750 -13.684 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -6.431 0.735 -15.870 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -7.873 1.777 -15.891 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -6.252 2.504 -15.783 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -5.131 0.448 -13.794 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -4.910 2.208 -13.649 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -5.622 1.286 -12.303 1.00 0.00 H new ATOM 542 N PHE A 37 -8.020 4.585 -10.279 1.00 0.00 N ATOM 543 CA PHE A 37 -8.307 5.912 -9.777 1.00 0.00 C ATOM 544 C PHE A 37 -7.212 6.862 -10.220 1.00 0.00 C ATOM 545 O PHE A 37 -6.170 6.978 -9.578 1.00 0.00 O ATOM 546 CB PHE A 37 -8.445 5.911 -8.253 1.00 0.00 C ATOM 547 CG PHE A 37 -9.694 5.228 -7.772 1.00 0.00 C ATOM 548 CD1 PHE A 37 -10.885 5.927 -7.684 1.00 0.00 C ATOM 549 CD2 PHE A 37 -9.679 3.889 -7.416 1.00 0.00 C ATOM 550 CE1 PHE A 37 -12.040 5.306 -7.247 1.00 0.00 C ATOM 551 CE2 PHE A 37 -10.830 3.262 -6.980 1.00 0.00 C ATOM 552 CZ PHE A 37 -12.012 3.972 -6.895 1.00 0.00 C ATOM 0 H PHE A 37 -7.525 3.980 -9.623 1.00 0.00 H new ATOM 0 HA PHE A 37 -9.260 6.246 -10.187 1.00 0.00 H new ATOM 0 HB2 PHE A 37 -7.577 5.417 -7.816 1.00 0.00 H new ATOM 0 HB3 PHE A 37 -8.440 6.940 -7.894 1.00 0.00 H new ATOM 0 HD1 PHE A 37 -10.912 6.971 -7.960 1.00 0.00 H new ATOM 0 HD2 PHE A 37 -8.757 3.330 -7.480 1.00 0.00 H new ATOM 0 HE1 PHE A 37 -12.963 5.864 -7.181 1.00 0.00 H new ATOM 0 HE2 PHE A 37 -10.806 2.218 -6.706 1.00 0.00 H new ATOM 0 HZ PHE A 37 -12.913 3.484 -6.554 1.00 0.00 H new ATOM 562 N LEU A 38 -7.439 7.491 -11.358 1.00 0.00 N ATOM 563 CA LEU A 38 -6.480 8.418 -11.920 1.00 0.00 C ATOM 564 C LEU A 38 -6.932 9.846 -11.655 1.00 0.00 C ATOM 565 O LEU A 38 -8.121 10.092 -11.445 1.00 0.00 O ATOM 566 CB LEU A 38 -6.343 8.179 -13.428 1.00 0.00 C ATOM 567 CG LEU A 38 -5.950 6.756 -13.837 1.00 0.00 C ATOM 568 CD1 LEU A 38 -5.885 6.635 -15.350 1.00 0.00 C ATOM 569 CD2 LEU A 38 -4.617 6.366 -13.219 1.00 0.00 C ATOM 0 H LEU A 38 -8.286 7.374 -11.913 1.00 0.00 H new ATOM 0 HA LEU A 38 -5.509 8.259 -11.450 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -7.291 8.427 -13.905 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -5.598 8.870 -13.822 1.00 0.00 H new ATOM 0 HG LEU A 38 -6.714 6.073 -13.466 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -5.604 5.617 -15.622 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -6.861 6.868 -15.776 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -5.143 7.332 -15.739 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -4.358 5.352 -13.523 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -3.843 7.055 -13.558 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -4.693 6.411 -12.133 1.00 0.00 H new ATOM 581 N PRO A 39 -5.996 10.810 -11.661 1.00 0.00 N ATOM 582 CA PRO A 39 -6.325 12.230 -11.491 1.00 0.00 C ATOM 583 C PRO A 39 -7.212 12.749 -12.623 1.00 0.00 C ATOM 584 O PRO A 39 -7.759 13.847 -12.544 1.00 0.00 O ATOM 585 CB PRO A 39 -4.959 12.928 -11.513 1.00 0.00 C ATOM 586 CG PRO A 39 -4.035 11.956 -12.169 1.00 0.00 C ATOM 587 CD PRO A 39 -4.547 10.592 -11.809 1.00 0.00 C ATOM 0 HA PRO A 39 -6.887 12.412 -10.575 1.00 0.00 H new ATOM 0 HB2 PRO A 39 -5.004 13.865 -12.068 1.00 0.00 H new ATOM 0 HB3 PRO A 39 -4.624 13.171 -10.504 1.00 0.00 H new ATOM 0 HG2 PRO A 39 -4.024 12.096 -13.250 1.00 0.00 H new ATOM 0 HG3 PRO A 39 -3.012 12.094 -11.820 1.00 0.00 H new ATOM 0 HD2 PRO A 39 -4.326 9.860 -12.586 1.00 0.00 H new ATOM 0 HD3 PRO A 39 -4.098 10.223 -10.887 1.00 0.00 H new ATOM 595 N ASP A 40 -7.338 11.949 -13.674 1.00 0.00 N ATOM 596 CA ASP A 40 -8.190 12.286 -14.804 1.00 0.00 C ATOM 597 C ASP A 40 -9.601 11.744 -14.607 1.00 0.00 C ATOM 598 O ASP A 40 -10.574 12.496 -14.617 1.00 0.00 O ATOM 599 CB ASP A 40 -7.604 11.728 -16.101 1.00 0.00 C ATOM 600 CG ASP A 40 -8.587 11.811 -17.252 1.00 0.00 C ATOM 601 OD1 ASP A 40 -8.930 12.937 -17.665 1.00 0.00 O ATOM 602 OD2 ASP A 40 -9.046 10.748 -17.728 1.00 0.00 O ATOM 0 H ASP A 40 -6.856 11.055 -13.766 1.00 0.00 H new ATOM 0 HA ASP A 40 -8.239 13.373 -14.870 1.00 0.00 H new ATOM 0 HB2 ASP A 40 -6.699 12.280 -16.357 1.00 0.00 H new ATOM 0 HB3 ASP A 40 -7.311 10.689 -15.949 1.00 0.00 H new ATOM 607 N ALA A 41 -9.710 10.437 -14.423 1.00 0.00 N ATOM 608 CA ALA A 41 -11.009 9.796 -14.308 1.00 0.00 C ATOM 609 C ALA A 41 -10.884 8.421 -13.672 1.00 0.00 C ATOM 610 O ALA A 41 -9.777 7.929 -13.444 1.00 0.00 O ATOM 611 CB ALA A 41 -11.660 9.680 -15.680 1.00 0.00 C ATOM 0 H ALA A 41 -8.916 9.801 -14.350 1.00 0.00 H new ATOM 0 HA ALA A 41 -11.637 10.413 -13.665 1.00 0.00 H new ATOM 0 HB1 ALA A 41 -12.633 9.198 -15.582 1.00 0.00 H new ATOM 0 HB2 ALA A 41 -11.789 10.675 -16.107 1.00 0.00 H new ATOM 0 HB3 ALA A 41 -11.025 9.084 -16.335 1.00 0.00 H new ATOM 617 N VAL A 42 -12.026 7.811 -13.387 1.00 0.00 N ATOM 618 CA VAL A 42 -12.063 6.461 -12.853 1.00 0.00 C ATOM 619 C VAL A 42 -12.172 5.468 -13.999 1.00 0.00 C ATOM 620 O VAL A 42 -13.244 5.280 -14.572 1.00 0.00 O ATOM 621 CB VAL A 42 -13.254 6.255 -11.890 1.00 0.00 C ATOM 622 CG1 VAL A 42 -13.175 4.893 -11.216 1.00 0.00 C ATOM 623 CG2 VAL A 42 -13.306 7.366 -10.851 1.00 0.00 C ATOM 0 H VAL A 42 -12.944 8.235 -13.519 1.00 0.00 H new ATOM 0 HA VAL A 42 -11.143 6.300 -12.292 1.00 0.00 H new ATOM 0 HB VAL A 42 -14.173 6.292 -12.475 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -14.023 4.770 -10.543 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -13.197 4.110 -11.974 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -12.248 4.822 -10.648 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -14.152 7.201 -10.184 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -12.382 7.367 -10.272 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -13.421 8.327 -11.352 1.00 0.00 H new ATOM 633 N TRP A 43 -11.058 4.856 -14.349 1.00 0.00 N ATOM 634 CA TRP A 43 -11.028 3.930 -15.464 1.00 0.00 C ATOM 635 C TRP A 43 -11.100 2.492 -14.965 1.00 0.00 C ATOM 636 O TRP A 43 -10.710 2.196 -13.835 1.00 0.00 O ATOM 637 CB TRP A 43 -9.765 4.149 -16.300 1.00 0.00 C ATOM 638 CG TRP A 43 -9.741 5.474 -17.012 1.00 0.00 C ATOM 639 CD1 TRP A 43 -9.280 6.665 -16.524 1.00 0.00 C ATOM 640 CD2 TRP A 43 -10.195 5.738 -18.346 1.00 0.00 C ATOM 641 NE1 TRP A 43 -9.424 7.653 -17.472 1.00 0.00 N ATOM 642 CE2 TRP A 43 -9.982 7.107 -18.598 1.00 0.00 C ATOM 643 CE3 TRP A 43 -10.759 4.947 -19.352 1.00 0.00 C ATOM 644 CZ2 TRP A 43 -10.316 7.702 -19.815 1.00 0.00 C ATOM 645 CZ3 TRP A 43 -11.091 5.539 -20.557 1.00 0.00 C ATOM 646 CH2 TRP A 43 -10.867 6.903 -20.779 1.00 0.00 C ATOM 0 H TRP A 43 -10.162 4.983 -13.878 1.00 0.00 H new ATOM 0 HA TRP A 43 -11.897 4.116 -16.095 1.00 0.00 H new ATOM 0 HB2 TRP A 43 -8.892 4.078 -15.651 1.00 0.00 H new ATOM 0 HB3 TRP A 43 -9.682 3.349 -17.035 1.00 0.00 H new ATOM 0 HD1 TRP A 43 -8.863 6.810 -15.538 1.00 0.00 H new ATOM 0 HE1 TRP A 43 -9.159 8.631 -17.355 1.00 0.00 H new ATOM 0 HE3 TRP A 43 -10.932 3.893 -19.191 1.00 0.00 H new ATOM 0 HZ2 TRP A 43 -10.146 8.754 -19.989 1.00 0.00 H new ATOM 0 HZ3 TRP A 43 -11.531 4.939 -21.340 1.00 0.00 H new ATOM 0 HH2 TRP A 43 -11.135 7.334 -21.732 1.00 0.00 H new ATOM 657 N GLY A 44 -11.612 1.607 -15.803 1.00 0.00 N ATOM 658 CA GLY A 44 -11.748 0.219 -15.418 1.00 0.00 C ATOM 659 C GLY A 44 -10.514 -0.587 -15.756 1.00 0.00 C ATOM 660 O GLY A 44 -10.051 -0.576 -16.899 1.00 0.00 O ATOM 0 H GLY A 44 -11.937 1.825 -16.745 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -11.939 0.157 -14.347 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -12.613 -0.214 -15.921 1.00 0.00 H new ATOM 664 N TRP A 45 -9.973 -1.277 -14.766 1.00 0.00 N ATOM 665 CA TRP A 45 -8.792 -2.098 -14.968 1.00 0.00 C ATOM 666 C TRP A 45 -9.197 -3.567 -14.964 1.00 0.00 C ATOM 667 O TRP A 45 -9.538 -4.125 -13.919 1.00 0.00 O ATOM 668 CB TRP A 45 -7.760 -1.815 -13.875 1.00 0.00 C ATOM 669 CG TRP A 45 -6.358 -2.202 -14.246 1.00 0.00 C ATOM 670 CD1 TRP A 45 -5.796 -2.157 -15.490 1.00 0.00 C ATOM 671 CD2 TRP A 45 -5.331 -2.662 -13.359 1.00 0.00 C ATOM 672 NE1 TRP A 45 -4.489 -2.572 -15.432 1.00 0.00 N ATOM 673 CE2 TRP A 45 -4.179 -2.885 -14.134 1.00 0.00 C ATOM 674 CE3 TRP A 45 -5.274 -2.907 -11.982 1.00 0.00 C ATOM 675 CZ2 TRP A 45 -2.986 -3.345 -13.580 1.00 0.00 C ATOM 676 CZ3 TRP A 45 -4.090 -3.362 -11.435 1.00 0.00 C ATOM 677 CH2 TRP A 45 -2.960 -3.575 -12.233 1.00 0.00 C ATOM 0 H TRP A 45 -10.334 -1.285 -13.812 1.00 0.00 H new ATOM 0 HA TRP A 45 -8.338 -1.858 -15.929 1.00 0.00 H new ATOM 0 HB2 TRP A 45 -7.781 -0.752 -13.635 1.00 0.00 H new ATOM 0 HB3 TRP A 45 -8.047 -2.351 -12.971 1.00 0.00 H new ATOM 0 HD1 TRP A 45 -6.306 -1.841 -16.388 1.00 0.00 H new ATOM 0 HE1 TRP A 45 -3.852 -2.637 -16.226 1.00 0.00 H new ATOM 0 HE3 TRP A 45 -6.140 -2.743 -11.358 1.00 0.00 H new ATOM 0 HZ2 TRP A 45 -2.113 -3.514 -14.193 1.00 0.00 H new ATOM 0 HZ3 TRP A 45 -4.035 -3.557 -10.374 1.00 0.00 H new ATOM 0 HH2 TRP A 45 -2.048 -3.929 -11.775 1.00 0.00 H new ATOM 688 N ASP A 46 -9.186 -4.180 -16.140 1.00 0.00 N ATOM 689 CA ASP A 46 -9.642 -5.557 -16.284 1.00 0.00 C ATOM 690 C ASP A 46 -8.575 -6.536 -15.806 1.00 0.00 C ATOM 691 O ASP A 46 -7.885 -7.176 -16.603 1.00 0.00 O ATOM 692 CB ASP A 46 -10.038 -5.847 -17.736 1.00 0.00 C ATOM 693 CG ASP A 46 -10.649 -7.225 -17.909 1.00 0.00 C ATOM 694 OD1 ASP A 46 -11.355 -7.685 -16.989 1.00 0.00 O ATOM 695 OD2 ASP A 46 -10.424 -7.855 -18.965 1.00 0.00 O ATOM 0 H ASP A 46 -8.867 -3.747 -17.007 1.00 0.00 H new ATOM 0 HA ASP A 46 -10.524 -5.690 -15.658 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -10.750 -5.093 -18.072 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -9.158 -5.761 -18.373 1.00 0.00 H new ATOM 700 N VAL A 47 -8.416 -6.600 -14.494 1.00 0.00 N ATOM 701 CA VAL A 47 -7.492 -7.523 -13.856 1.00 0.00 C ATOM 702 C VAL A 47 -8.139 -8.091 -12.597 1.00 0.00 C ATOM 703 O VAL A 47 -8.655 -7.344 -11.767 1.00 0.00 O ATOM 704 CB VAL A 47 -6.155 -6.837 -13.480 1.00 0.00 C ATOM 705 CG1 VAL A 47 -5.221 -7.814 -12.782 1.00 0.00 C ATOM 706 CG2 VAL A 47 -5.475 -6.251 -14.709 1.00 0.00 C ATOM 0 H VAL A 47 -8.927 -6.010 -13.838 1.00 0.00 H new ATOM 0 HA VAL A 47 -7.270 -8.319 -14.566 1.00 0.00 H new ATOM 0 HB VAL A 47 -6.385 -6.023 -12.792 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -4.289 -7.308 -12.528 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -5.694 -8.182 -11.871 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -5.010 -8.653 -13.446 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -4.539 -5.776 -14.415 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -5.269 -7.047 -15.425 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -6.129 -5.510 -15.168 1.00 0.00 H new ATOM 716 N THR A 48 -8.146 -9.408 -12.472 1.00 0.00 N ATOM 717 CA THR A 48 -8.743 -10.050 -11.309 1.00 0.00 C ATOM 718 C THR A 48 -7.667 -10.587 -10.359 1.00 0.00 C ATOM 719 O THR A 48 -7.961 -11.024 -9.247 1.00 0.00 O ATOM 720 CB THR A 48 -9.675 -11.197 -11.748 1.00 0.00 C ATOM 721 OG1 THR A 48 -10.452 -10.778 -12.879 1.00 0.00 O ATOM 722 CG2 THR A 48 -10.615 -11.606 -10.622 1.00 0.00 C ATOM 0 H THR A 48 -7.748 -10.051 -13.156 1.00 0.00 H new ATOM 0 HA THR A 48 -9.326 -9.299 -10.776 1.00 0.00 H new ATOM 0 HB THR A 48 -9.056 -12.054 -12.012 1.00 0.00 H new ATOM 0 HG1 THR A 48 -11.043 -11.508 -13.159 1.00 0.00 H new ATOM 0 HG21 THR A 48 -11.259 -12.417 -10.962 1.00 0.00 H new ATOM 0 HG22 THR A 48 -10.031 -11.942 -9.765 1.00 0.00 H new ATOM 0 HG23 THR A 48 -11.228 -10.753 -10.332 1.00 0.00 H new ATOM 730 N LYS A 49 -6.414 -10.529 -10.790 1.00 0.00 N ATOM 731 CA LYS A 49 -5.314 -11.070 -10.001 1.00 0.00 C ATOM 732 C LYS A 49 -4.258 -10.004 -9.719 1.00 0.00 C ATOM 733 O LYS A 49 -3.629 -9.497 -10.646 1.00 0.00 O ATOM 734 CB LYS A 49 -4.648 -12.236 -10.734 1.00 0.00 C ATOM 735 CG LYS A 49 -5.553 -13.430 -10.978 1.00 0.00 C ATOM 736 CD LYS A 49 -4.821 -14.503 -11.767 1.00 0.00 C ATOM 737 CE LYS A 49 -5.646 -15.768 -11.907 1.00 0.00 C ATOM 738 NZ LYS A 49 -4.928 -16.811 -12.684 1.00 0.00 N ATOM 0 H LYS A 49 -6.134 -10.114 -11.679 1.00 0.00 H new ATOM 0 HA LYS A 49 -5.735 -11.417 -9.057 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -4.274 -11.878 -11.693 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -3.783 -12.564 -10.157 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -5.891 -13.838 -10.025 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -6.443 -13.114 -11.523 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -4.574 -14.120 -12.757 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -3.879 -14.738 -11.272 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -5.889 -16.155 -10.917 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -6.590 -15.534 -12.399 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -5.524 -17.660 -12.758 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -4.718 -16.451 -13.637 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -4.039 -17.053 -12.202 1.00 0.00 H new ATOM 752 N PRO A 50 -4.034 -9.664 -8.440 1.00 0.00 N ATOM 753 CA PRO A 50 -2.972 -8.727 -8.046 1.00 0.00 C ATOM 754 C PRO A 50 -1.588 -9.261 -8.403 1.00 0.00 C ATOM 755 O PRO A 50 -0.633 -8.506 -8.556 1.00 0.00 O ATOM 756 CB PRO A 50 -3.127 -8.611 -6.524 1.00 0.00 C ATOM 757 CG PRO A 50 -3.901 -9.819 -6.118 1.00 0.00 C ATOM 758 CD PRO A 50 -4.799 -10.148 -7.277 1.00 0.00 C ATOM 0 HA PRO A 50 -3.060 -7.770 -8.560 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -2.156 -8.581 -6.030 1.00 0.00 H new ATOM 0 HB3 PRO A 50 -3.652 -7.696 -6.250 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -3.234 -10.651 -5.893 1.00 0.00 H new ATOM 0 HG3 PRO A 50 -4.483 -9.624 -5.217 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -4.998 -11.218 -7.342 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -5.764 -9.649 -7.193 1.00 0.00 H new ATOM 766 N GLU A 51 -1.506 -10.575 -8.551 1.00 0.00 N ATOM 767 CA GLU A 51 -0.265 -11.251 -8.907 1.00 0.00 C ATOM 768 C GLU A 51 0.112 -10.959 -10.362 1.00 0.00 C ATOM 769 O GLU A 51 1.272 -11.077 -10.755 1.00 0.00 O ATOM 770 CB GLU A 51 -0.447 -12.758 -8.707 1.00 0.00 C ATOM 771 CG GLU A 51 0.810 -13.582 -8.923 1.00 0.00 C ATOM 772 CD GLU A 51 0.527 -15.069 -8.919 1.00 0.00 C ATOM 773 OE1 GLU A 51 -0.051 -15.567 -7.931 1.00 0.00 O ATOM 774 OE2 GLU A 51 0.853 -15.744 -9.917 1.00 0.00 O ATOM 0 H GLU A 51 -2.299 -11.205 -8.428 1.00 0.00 H new ATOM 0 HA GLU A 51 0.539 -10.885 -8.268 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -0.812 -12.935 -7.695 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -1.219 -13.111 -9.391 1.00 0.00 H new ATOM 0 HG2 GLU A 51 1.266 -13.303 -9.873 1.00 0.00 H new ATOM 0 HG3 GLU A 51 1.533 -13.350 -8.142 1.00 0.00 H new ATOM 781 N GLN A 52 -0.877 -10.559 -11.151 1.00 0.00 N ATOM 782 CA GLN A 52 -0.689 -10.386 -12.586 1.00 0.00 C ATOM 783 C GLN A 52 -0.444 -8.928 -12.953 1.00 0.00 C ATOM 784 O GLN A 52 -0.622 -8.533 -14.103 1.00 0.00 O ATOM 785 CB GLN A 52 -1.903 -10.923 -13.346 1.00 0.00 C ATOM 786 CG GLN A 52 -2.100 -12.420 -13.178 1.00 0.00 C ATOM 787 CD GLN A 52 -0.921 -13.226 -13.690 1.00 0.00 C ATOM 788 OE1 GLN A 52 -0.881 -13.607 -14.856 1.00 0.00 O ATOM 789 NE2 GLN A 52 0.045 -13.489 -12.824 1.00 0.00 N ATOM 0 H GLN A 52 -1.819 -10.348 -10.821 1.00 0.00 H new ATOM 0 HA GLN A 52 0.197 -10.953 -12.873 1.00 0.00 H new ATOM 0 HB2 GLN A 52 -2.798 -10.404 -13.002 1.00 0.00 H new ATOM 0 HB3 GLN A 52 -1.790 -10.695 -14.406 1.00 0.00 H new ATOM 0 HG2 GLN A 52 -2.259 -12.645 -12.123 1.00 0.00 H new ATOM 0 HG3 GLN A 52 -3.002 -12.726 -13.709 1.00 0.00 H new ATOM 0 HE21 GLN A 52 -0.026 -13.154 -11.863 1.00 0.00 H new ATOM 0 HE22 GLN A 52 0.861 -14.027 -13.118 1.00 0.00 H new ATOM 798 N ILE A 53 -0.033 -8.132 -11.978 1.00 0.00 N ATOM 799 CA ILE A 53 0.343 -6.754 -12.244 1.00 0.00 C ATOM 800 C ILE A 53 1.718 -6.722 -12.900 1.00 0.00 C ATOM 801 O ILE A 53 2.719 -7.094 -12.284 1.00 0.00 O ATOM 802 CB ILE A 53 0.356 -5.903 -10.955 1.00 0.00 C ATOM 803 CG1 ILE A 53 -1.030 -5.905 -10.306 1.00 0.00 C ATOM 804 CG2 ILE A 53 0.803 -4.479 -11.256 1.00 0.00 C ATOM 805 CD1 ILE A 53 -1.092 -5.140 -9.002 1.00 0.00 C ATOM 0 H ILE A 53 0.048 -8.415 -11.001 1.00 0.00 H new ATOM 0 HA ILE A 53 -0.401 -6.324 -12.914 1.00 0.00 H new ATOM 0 HB ILE A 53 1.068 -6.343 -10.257 1.00 0.00 H new ATOM 0 HG12 ILE A 53 -1.749 -5.475 -11.004 1.00 0.00 H new ATOM 0 HG13 ILE A 53 -1.336 -6.936 -10.127 1.00 0.00 H new ATOM 0 HG21 ILE A 53 0.805 -3.896 -10.335 1.00 0.00 H new ATOM 0 HG22 ILE A 53 1.808 -4.495 -11.678 1.00 0.00 H new ATOM 0 HG23 ILE A 53 0.116 -4.025 -11.971 1.00 0.00 H new ATOM 0 HD11 ILE A 53 -2.105 -5.185 -8.601 1.00 0.00 H new ATOM 0 HD12 ILE A 53 -0.399 -5.583 -8.287 1.00 0.00 H new ATOM 0 HD13 ILE A 53 -0.817 -4.100 -9.177 1.00 0.00 H new ATOM 817 N ASP A 54 1.760 -6.305 -14.156 1.00 0.00 N ATOM 818 CA ASP A 54 2.995 -6.324 -14.924 1.00 0.00 C ATOM 819 C ASP A 54 3.056 -5.126 -15.868 1.00 0.00 C ATOM 820 O ASP A 54 2.190 -4.256 -15.832 1.00 0.00 O ATOM 821 CB ASP A 54 3.100 -7.630 -15.721 1.00 0.00 C ATOM 822 CG ASP A 54 2.369 -7.575 -17.050 1.00 0.00 C ATOM 823 OD1 ASP A 54 1.124 -7.471 -17.056 1.00 0.00 O ATOM 824 OD2 ASP A 54 3.050 -7.608 -18.097 1.00 0.00 O ATOM 0 H ASP A 54 0.952 -5.949 -14.666 1.00 0.00 H new ATOM 0 HA ASP A 54 3.835 -6.263 -14.232 1.00 0.00 H new ATOM 0 HB2 ASP A 54 4.151 -7.856 -15.900 1.00 0.00 H new ATOM 0 HB3 ASP A 54 2.695 -8.447 -15.124 1.00 0.00 H new ATOM 829 N ARG A 55 4.069 -5.101 -16.724 1.00 0.00 N ATOM 830 CA ARG A 55 4.287 -3.986 -17.641 1.00 0.00 C ATOM 831 C ARG A 55 3.154 -3.877 -18.659 1.00 0.00 C ATOM 832 O ARG A 55 2.751 -2.778 -19.035 1.00 0.00 O ATOM 833 CB ARG A 55 5.615 -4.177 -18.365 1.00 0.00 C ATOM 834 CG ARG A 55 6.790 -4.353 -17.420 1.00 0.00 C ATOM 835 CD ARG A 55 8.024 -4.869 -18.142 1.00 0.00 C ATOM 836 NE ARG A 55 8.543 -3.911 -19.117 1.00 0.00 N ATOM 837 CZ ARG A 55 8.533 -4.105 -20.434 1.00 0.00 C ATOM 838 NH1 ARG A 55 7.976 -5.197 -20.944 1.00 0.00 N ATOM 839 NH2 ARG A 55 9.076 -3.199 -21.237 1.00 0.00 N ATOM 0 H ARG A 55 4.760 -5.847 -16.804 1.00 0.00 H new ATOM 0 HA ARG A 55 4.310 -3.063 -17.061 1.00 0.00 H new ATOM 0 HB2 ARG A 55 5.545 -5.050 -19.015 1.00 0.00 H new ATOM 0 HB3 ARG A 55 5.799 -3.316 -19.007 1.00 0.00 H new ATOM 0 HG2 ARG A 55 7.020 -3.400 -16.944 1.00 0.00 H new ATOM 0 HG3 ARG A 55 6.517 -5.048 -16.626 1.00 0.00 H new ATOM 0 HD2 ARG A 55 8.800 -5.096 -17.411 1.00 0.00 H new ATOM 0 HD3 ARG A 55 7.781 -5.803 -18.649 1.00 0.00 H new ATOM 0 HE ARG A 55 8.938 -3.039 -18.766 1.00 0.00 H new ATOM 0 HH11 ARG A 55 7.554 -5.890 -20.326 1.00 0.00 H new ATOM 0 HH12 ARG A 55 7.970 -5.343 -21.954 1.00 0.00 H new ATOM 0 HH21 ARG A 55 9.499 -2.358 -20.845 1.00 0.00 H new ATOM 0 HH22 ARG A 55 9.071 -3.344 -22.247 1.00 0.00 H new ATOM 853 N TYR A 56 2.645 -5.022 -19.092 1.00 0.00 N ATOM 854 CA TYR A 56 1.585 -5.062 -20.092 1.00 0.00 C ATOM 855 C TYR A 56 0.272 -4.542 -19.511 1.00 0.00 C ATOM 856 O TYR A 56 -0.439 -3.767 -20.150 1.00 0.00 O ATOM 857 CB TYR A 56 1.402 -6.492 -20.620 1.00 0.00 C ATOM 858 CG TYR A 56 0.359 -6.620 -21.710 1.00 0.00 C ATOM 859 CD1 TYR A 56 0.682 -6.369 -23.038 1.00 0.00 C ATOM 860 CD2 TYR A 56 -0.947 -6.991 -21.413 1.00 0.00 C ATOM 861 CE1 TYR A 56 -0.266 -6.483 -24.037 1.00 0.00 C ATOM 862 CE2 TYR A 56 -1.901 -7.106 -22.407 1.00 0.00 C ATOM 863 CZ TYR A 56 -1.555 -6.851 -23.717 1.00 0.00 C ATOM 864 OH TYR A 56 -2.504 -6.966 -24.709 1.00 0.00 O ATOM 0 H TYR A 56 2.950 -5.939 -18.766 1.00 0.00 H new ATOM 0 HA TYR A 56 1.874 -4.416 -20.921 1.00 0.00 H new ATOM 0 HB2 TYR A 56 2.357 -6.852 -21.002 1.00 0.00 H new ATOM 0 HB3 TYR A 56 1.126 -7.142 -19.790 1.00 0.00 H new ATOM 0 HD1 TYR A 56 1.691 -6.080 -23.294 1.00 0.00 H new ATOM 0 HD2 TYR A 56 -1.221 -7.193 -20.388 1.00 0.00 H new ATOM 0 HE1 TYR A 56 0.002 -6.285 -25.064 1.00 0.00 H new ATOM 0 HE2 TYR A 56 -2.912 -7.394 -22.159 1.00 0.00 H new ATOM 0 HH TYR A 56 -3.360 -7.235 -24.314 1.00 0.00 H new ATOM 874 N SER A 57 -0.042 -4.967 -18.296 1.00 0.00 N ATOM 875 CA SER A 57 -1.276 -4.551 -17.641 1.00 0.00 C ATOM 876 C SER A 57 -1.193 -3.099 -17.168 1.00 0.00 C ATOM 877 O SER A 57 -2.206 -2.398 -17.103 1.00 0.00 O ATOM 878 CB SER A 57 -1.591 -5.489 -16.476 1.00 0.00 C ATOM 879 OG SER A 57 -0.426 -5.783 -15.728 1.00 0.00 O ATOM 0 H SER A 57 0.538 -5.598 -17.744 1.00 0.00 H new ATOM 0 HA SER A 57 -2.087 -4.610 -18.367 1.00 0.00 H new ATOM 0 HB2 SER A 57 -2.337 -5.030 -15.827 1.00 0.00 H new ATOM 0 HB3 SER A 57 -2.025 -6.413 -16.857 1.00 0.00 H new ATOM 0 HG SER A 57 0.031 -6.554 -16.124 1.00 0.00 H new ATOM 885 N LEU A 58 0.017 -2.643 -16.862 1.00 0.00 N ATOM 886 CA LEU A 58 0.228 -1.271 -16.414 1.00 0.00 C ATOM 887 C LEU A 58 0.473 -0.331 -17.588 1.00 0.00 C ATOM 888 O LEU A 58 0.918 0.800 -17.395 1.00 0.00 O ATOM 889 CB LEU A 58 1.408 -1.192 -15.442 1.00 0.00 C ATOM 890 CG LEU A 58 1.195 -1.884 -14.094 1.00 0.00 C ATOM 891 CD1 LEU A 58 2.443 -1.761 -13.234 1.00 0.00 C ATOM 892 CD2 LEU A 58 -0.008 -1.295 -13.372 1.00 0.00 C ATOM 0 H LEU A 58 0.867 -3.204 -16.916 1.00 0.00 H new ATOM 0 HA LEU A 58 -0.682 -0.956 -15.902 1.00 0.00 H new ATOM 0 HB2 LEU A 58 2.283 -1.631 -15.922 1.00 0.00 H new ATOM 0 HB3 LEU A 58 1.637 -0.142 -15.260 1.00 0.00 H new ATOM 0 HG LEU A 58 1.001 -2.941 -14.277 1.00 0.00 H new ATOM 0 HD11 LEU A 58 2.277 -2.258 -12.278 1.00 0.00 H new ATOM 0 HD12 LEU A 58 3.284 -2.229 -13.745 1.00 0.00 H new ATOM 0 HD13 LEU A 58 2.664 -0.708 -13.062 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -0.142 -1.801 -12.416 1.00 0.00 H new ATOM 0 HD22 LEU A 58 0.156 -0.231 -13.200 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -0.901 -1.430 -13.982 1.00 0.00 H new ATOM 904 N GLN A 59 0.161 -0.791 -18.798 1.00 0.00 N ATOM 905 CA GLN A 59 0.321 0.026 -20.000 1.00 0.00 C ATOM 906 C GLN A 59 -0.425 1.350 -19.853 1.00 0.00 C ATOM 907 O GLN A 59 0.051 2.399 -20.285 1.00 0.00 O ATOM 908 CB GLN A 59 -0.196 -0.725 -21.229 1.00 0.00 C ATOM 909 CG GLN A 59 0.090 -0.014 -22.541 1.00 0.00 C ATOM 910 CD GLN A 59 -0.551 -0.698 -23.731 1.00 0.00 C ATOM 911 OE1 GLN A 59 0.037 -1.590 -24.341 1.00 0.00 O ATOM 912 NE2 GLN A 59 -1.756 -0.273 -24.081 1.00 0.00 N ATOM 0 H GLN A 59 -0.205 -1.727 -18.973 1.00 0.00 H new ATOM 0 HA GLN A 59 1.383 0.233 -20.131 1.00 0.00 H new ATOM 0 HB2 GLN A 59 0.257 -1.716 -21.256 1.00 0.00 H new ATOM 0 HB3 GLN A 59 -1.272 -0.869 -21.130 1.00 0.00 H new ATOM 0 HG2 GLN A 59 -0.272 1.012 -22.479 1.00 0.00 H new ATOM 0 HG3 GLN A 59 1.168 0.037 -22.694 1.00 0.00 H new ATOM 0 HE21 GLN A 59 -2.210 0.469 -23.548 1.00 0.00 H new ATOM 0 HE22 GLN A 59 -2.230 -0.688 -24.883 1.00 0.00 H new ATOM 921 N ARG A 60 -1.586 1.287 -19.206 1.00 0.00 N ATOM 922 CA ARG A 60 -2.424 2.461 -18.997 1.00 0.00 C ATOM 923 C ARG A 60 -1.706 3.485 -18.119 1.00 0.00 C ATOM 924 O ARG A 60 -1.921 4.690 -18.247 1.00 0.00 O ATOM 925 CB ARG A 60 -3.746 2.056 -18.337 1.00 0.00 C ATOM 926 CG ARG A 60 -4.827 3.124 -18.416 1.00 0.00 C ATOM 927 CD ARG A 60 -5.554 3.094 -19.756 1.00 0.00 C ATOM 928 NE ARG A 60 -4.648 3.260 -20.895 1.00 0.00 N ATOM 929 CZ ARG A 60 -4.937 2.882 -22.140 1.00 0.00 C ATOM 930 NH1 ARG A 60 -6.119 2.344 -22.423 1.00 0.00 N ATOM 931 NH2 ARG A 60 -4.037 3.045 -23.098 1.00 0.00 N ATOM 0 H ARG A 60 -1.969 0.426 -18.815 1.00 0.00 H new ATOM 0 HA ARG A 60 -2.629 2.911 -19.968 1.00 0.00 H new ATOM 0 HB2 ARG A 60 -4.113 1.145 -18.811 1.00 0.00 H new ATOM 0 HB3 ARG A 60 -3.560 1.818 -17.290 1.00 0.00 H new ATOM 0 HG2 ARG A 60 -5.545 2.975 -17.609 1.00 0.00 H new ATOM 0 HG3 ARG A 60 -4.379 4.107 -18.267 1.00 0.00 H new ATOM 0 HD2 ARG A 60 -6.086 2.148 -19.855 1.00 0.00 H new ATOM 0 HD3 ARG A 60 -6.304 3.885 -19.775 1.00 0.00 H new ATOM 0 HE ARG A 60 -3.740 3.692 -20.725 1.00 0.00 H new ATOM 0 HH11 ARG A 60 -6.812 2.218 -21.685 1.00 0.00 H new ATOM 0 HH12 ARG A 60 -6.333 2.057 -23.378 1.00 0.00 H new ATOM 0 HH21 ARG A 60 -3.130 3.457 -22.881 1.00 0.00 H new ATOM 0 HH22 ARG A 60 -4.251 2.758 -24.053 1.00 0.00 H new ATOM 945 N VAL A 61 -0.850 2.992 -17.233 1.00 0.00 N ATOM 946 CA VAL A 61 -0.107 3.848 -16.322 1.00 0.00 C ATOM 947 C VAL A 61 1.007 4.570 -17.068 1.00 0.00 C ATOM 948 O VAL A 61 1.282 5.738 -16.810 1.00 0.00 O ATOM 949 CB VAL A 61 0.494 3.042 -15.147 1.00 0.00 C ATOM 950 CG1 VAL A 61 1.246 3.953 -14.187 1.00 0.00 C ATOM 951 CG2 VAL A 61 -0.599 2.279 -14.413 1.00 0.00 C ATOM 0 H VAL A 61 -0.653 1.997 -17.127 1.00 0.00 H new ATOM 0 HA VAL A 61 -0.806 4.577 -15.913 1.00 0.00 H new ATOM 0 HB VAL A 61 1.205 2.325 -15.557 1.00 0.00 H new ATOM 0 HG11 VAL A 61 1.658 3.360 -13.370 1.00 0.00 H new ATOM 0 HG12 VAL A 61 2.056 4.452 -14.718 1.00 0.00 H new ATOM 0 HG13 VAL A 61 0.563 4.700 -13.784 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -0.160 1.717 -13.589 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -1.334 2.983 -14.021 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -1.088 1.590 -15.102 1.00 0.00 H new ATOM 961 N PHE A 62 1.635 3.868 -18.008 1.00 0.00 N ATOM 962 CA PHE A 62 2.675 4.466 -18.838 1.00 0.00 C ATOM 963 C PHE A 62 2.109 5.627 -19.652 1.00 0.00 C ATOM 964 O PHE A 62 2.779 6.640 -19.851 1.00 0.00 O ATOM 965 CB PHE A 62 3.295 3.425 -19.777 1.00 0.00 C ATOM 966 CG PHE A 62 4.149 2.401 -19.081 1.00 0.00 C ATOM 967 CD1 PHE A 62 5.454 2.699 -18.727 1.00 0.00 C ATOM 968 CD2 PHE A 62 3.652 1.141 -18.793 1.00 0.00 C ATOM 969 CE1 PHE A 62 6.248 1.759 -18.097 1.00 0.00 C ATOM 970 CE2 PHE A 62 4.441 0.196 -18.165 1.00 0.00 C ATOM 971 CZ PHE A 62 5.740 0.505 -17.816 1.00 0.00 C ATOM 0 H PHE A 62 1.442 2.888 -18.213 1.00 0.00 H new ATOM 0 HA PHE A 62 3.455 4.843 -18.176 1.00 0.00 H new ATOM 0 HB2 PHE A 62 2.496 2.912 -20.312 1.00 0.00 H new ATOM 0 HB3 PHE A 62 3.900 3.940 -20.524 1.00 0.00 H new ATOM 0 HD1 PHE A 62 5.856 3.677 -18.946 1.00 0.00 H new ATOM 0 HD2 PHE A 62 2.636 0.894 -19.062 1.00 0.00 H new ATOM 0 HE1 PHE A 62 7.264 2.004 -17.825 1.00 0.00 H new ATOM 0 HE2 PHE A 62 4.041 -0.783 -17.948 1.00 0.00 H new ATOM 0 HZ PHE A 62 6.358 -0.232 -17.324 1.00 0.00 H new ATOM 981 N ASP A 63 0.867 5.471 -20.106 1.00 0.00 N ATOM 982 CA ASP A 63 0.184 6.516 -20.868 1.00 0.00 C ATOM 983 C ASP A 63 0.162 7.833 -20.107 1.00 0.00 C ATOM 984 O ASP A 63 0.683 8.846 -20.573 1.00 0.00 O ATOM 985 CB ASP A 63 -1.262 6.115 -21.180 1.00 0.00 C ATOM 986 CG ASP A 63 -1.383 5.126 -22.317 1.00 0.00 C ATOM 987 OD1 ASP A 63 -1.068 5.499 -23.467 1.00 0.00 O ATOM 988 OD2 ASP A 63 -1.822 3.985 -22.071 1.00 0.00 O ATOM 0 H ASP A 63 0.311 4.628 -19.959 1.00 0.00 H new ATOM 0 HA ASP A 63 0.741 6.641 -21.796 1.00 0.00 H new ATOM 0 HB2 ASP A 63 -1.712 5.685 -20.285 1.00 0.00 H new ATOM 0 HB3 ASP A 63 -1.834 7.010 -21.425 1.00 0.00 H new ATOM 993 N ASN A 64 -0.424 7.805 -18.919 1.00 0.00 N ATOM 994 CA ASN A 64 -0.665 9.021 -18.155 1.00 0.00 C ATOM 995 C ASN A 64 0.446 9.259 -17.134 1.00 0.00 C ATOM 996 O ASN A 64 0.295 10.049 -16.208 1.00 0.00 O ATOM 997 CB ASN A 64 -2.037 8.929 -17.470 1.00 0.00 C ATOM 998 CG ASN A 64 -2.558 10.269 -16.984 1.00 0.00 C ATOM 999 OD1 ASN A 64 -2.441 10.613 -15.809 1.00 0.00 O ATOM 1000 ND2 ASN A 64 -3.127 11.043 -17.895 1.00 0.00 N ATOM 0 H ASN A 64 -0.742 6.951 -18.462 1.00 0.00 H new ATOM 0 HA ASN A 64 -0.665 9.873 -18.835 1.00 0.00 H new ATOM 0 HB2 ASN A 64 -2.756 8.500 -18.168 1.00 0.00 H new ATOM 0 HB3 ASN A 64 -1.967 8.246 -16.624 1.00 0.00 H new ATOM 0 HD21 ASN A 64 -3.487 11.960 -17.632 1.00 0.00 H new ATOM 0 HD22 ASN A 64 -3.205 10.722 -18.860 1.00 0.00 H new ATOM 1007 N ALA A 65 1.585 8.603 -17.336 1.00 0.00 N ATOM 1008 CA ALA A 65 2.725 8.724 -16.425 1.00 0.00 C ATOM 1009 C ALA A 65 3.211 10.169 -16.312 1.00 0.00 C ATOM 1010 O ALA A 65 3.840 10.550 -15.326 1.00 0.00 O ATOM 1011 CB ALA A 65 3.861 7.824 -16.881 1.00 0.00 C ATOM 0 H ALA A 65 1.746 7.978 -18.126 1.00 0.00 H new ATOM 0 HA ALA A 65 2.391 8.409 -15.437 1.00 0.00 H new ATOM 0 HB1 ALA A 65 4.702 7.924 -16.195 1.00 0.00 H new ATOM 0 HB2 ALA A 65 3.522 6.788 -16.892 1.00 0.00 H new ATOM 0 HB3 ALA A 65 4.175 8.114 -17.884 1.00 0.00 H new ATOM 1017 N ASN A 66 2.900 10.974 -17.322 1.00 0.00 N ATOM 1018 CA ASN A 66 3.278 12.386 -17.328 1.00 0.00 C ATOM 1019 C ASN A 66 2.478 13.167 -16.290 1.00 0.00 C ATOM 1020 O ASN A 66 2.832 14.290 -15.934 1.00 0.00 O ATOM 1021 CB ASN A 66 3.056 12.995 -18.716 1.00 0.00 C ATOM 1022 CG ASN A 66 3.955 12.389 -19.776 1.00 0.00 C ATOM 1023 OD1 ASN A 66 5.080 11.972 -19.494 1.00 0.00 O ATOM 1024 ND2 ASN A 66 3.469 12.345 -21.007 1.00 0.00 N ATOM 0 H ASN A 66 2.386 10.674 -18.150 1.00 0.00 H new ATOM 0 HA ASN A 66 4.336 12.450 -17.075 1.00 0.00 H new ATOM 0 HB2 ASN A 66 2.015 12.855 -19.006 1.00 0.00 H new ATOM 0 HB3 ASN A 66 3.232 14.070 -18.668 1.00 0.00 H new ATOM 0 HD21 ASN A 66 4.031 11.955 -21.764 1.00 0.00 H new ATOM 0 HD22 ASN A 66 2.532 12.701 -21.199 1.00 0.00 H new ATOM 1031 N ALA A 67 1.397 12.568 -15.809 1.00 0.00 N ATOM 1032 CA ALA A 67 0.558 13.191 -14.797 1.00 0.00 C ATOM 1033 C ALA A 67 0.527 12.347 -13.531 1.00 0.00 C ATOM 1034 O ALA A 67 -0.192 12.659 -12.578 1.00 0.00 O ATOM 1035 CB ALA A 67 -0.850 13.389 -15.329 1.00 0.00 C ATOM 0 H ALA A 67 1.080 11.645 -16.106 1.00 0.00 H new ATOM 0 HA ALA A 67 0.982 14.165 -14.552 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -1.467 13.856 -14.561 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -0.819 14.031 -16.210 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -1.276 12.423 -15.599 1.00 0.00 H new ATOM 1041 N ILE A 68 1.312 11.280 -13.520 1.00 0.00 N ATOM 1042 CA ILE A 68 1.359 10.382 -12.380 1.00 0.00 C ATOM 1043 C ILE A 68 2.746 10.389 -11.752 1.00 0.00 C ATOM 1044 O ILE A 68 3.718 9.938 -12.351 1.00 0.00 O ATOM 1045 CB ILE A 68 0.974 8.935 -12.768 1.00 0.00 C ATOM 1046 CG1 ILE A 68 -0.429 8.902 -13.381 1.00 0.00 C ATOM 1047 CG2 ILE A 68 1.038 8.029 -11.546 1.00 0.00 C ATOM 1048 CD1 ILE A 68 -0.851 7.533 -13.871 1.00 0.00 C ATOM 0 H ILE A 68 1.926 11.016 -14.291 1.00 0.00 H new ATOM 0 HA ILE A 68 0.629 10.744 -11.657 1.00 0.00 H new ATOM 0 HB ILE A 68 1.685 8.572 -13.511 1.00 0.00 H new ATOM 0 HG12 ILE A 68 -1.148 9.249 -12.639 1.00 0.00 H new ATOM 0 HG13 ILE A 68 -0.468 9.603 -14.214 1.00 0.00 H new ATOM 0 HG21 ILE A 68 0.765 7.013 -11.832 1.00 0.00 H new ATOM 0 HG22 ILE A 68 2.051 8.033 -11.143 1.00 0.00 H new ATOM 0 HG23 ILE A 68 0.344 8.392 -10.788 1.00 0.00 H new ATOM 0 HD11 ILE A 68 -1.855 7.591 -14.291 1.00 0.00 H new ATOM 0 HD12 ILE A 68 -0.156 7.191 -14.637 1.00 0.00 H new ATOM 0 HD13 ILE A 68 -0.846 6.831 -13.037 1.00 0.00 H new ATOM 1060 N ASP A 69 2.828 10.940 -10.554 1.00 0.00 N ATOM 1061 CA ASP A 69 4.073 10.982 -9.802 1.00 0.00 C ATOM 1062 C ASP A 69 4.119 9.811 -8.840 1.00 0.00 C ATOM 1063 O ASP A 69 5.042 8.998 -8.863 1.00 0.00 O ATOM 1064 CB ASP A 69 4.174 12.295 -9.021 1.00 0.00 C ATOM 1065 CG ASP A 69 5.488 12.444 -8.282 1.00 0.00 C ATOM 1066 OD1 ASP A 69 5.645 11.831 -7.208 1.00 0.00 O ATOM 1067 OD2 ASP A 69 6.364 13.190 -8.771 1.00 0.00 O ATOM 0 H ASP A 69 2.037 11.370 -10.075 1.00 0.00 H new ATOM 0 HA ASP A 69 4.912 10.920 -10.495 1.00 0.00 H new ATOM 0 HB2 ASP A 69 4.054 13.131 -9.710 1.00 0.00 H new ATOM 0 HB3 ASP A 69 3.353 12.350 -8.306 1.00 0.00 H new ATOM 1072 N THR A 70 3.095 9.723 -8.007 1.00 0.00 N ATOM 1073 CA THR A 70 2.992 8.658 -7.031 1.00 0.00 C ATOM 1074 C THR A 70 1.852 7.711 -7.403 1.00 0.00 C ATOM 1075 O THR A 70 0.742 8.152 -7.711 1.00 0.00 O ATOM 1076 CB THR A 70 2.762 9.235 -5.618 1.00 0.00 C ATOM 1077 OG1 THR A 70 3.749 10.243 -5.340 1.00 0.00 O ATOM 1078 CG2 THR A 70 2.837 8.144 -4.558 1.00 0.00 C ATOM 0 H THR A 70 2.318 10.384 -7.990 1.00 0.00 H new ATOM 0 HA THR A 70 3.929 8.101 -7.029 1.00 0.00 H new ATOM 0 HB THR A 70 1.765 9.674 -5.589 1.00 0.00 H new ATOM 0 HG1 THR A 70 3.599 10.609 -4.443 1.00 0.00 H new ATOM 0 HG21 THR A 70 2.671 8.581 -3.573 1.00 0.00 H new ATOM 0 HG22 THR A 70 2.073 7.392 -4.755 1.00 0.00 H new ATOM 0 HG23 THR A 70 3.821 7.676 -4.586 1.00 0.00 H new ATOM 1086 N LEU A 71 2.136 6.418 -7.400 1.00 0.00 N ATOM 1087 CA LEU A 71 1.145 5.413 -7.746 1.00 0.00 C ATOM 1088 C LEU A 71 0.914 4.469 -6.572 1.00 0.00 C ATOM 1089 O LEU A 71 1.812 3.729 -6.170 1.00 0.00 O ATOM 1090 CB LEU A 71 1.593 4.624 -8.981 1.00 0.00 C ATOM 1091 CG LEU A 71 0.616 3.543 -9.454 1.00 0.00 C ATOM 1092 CD1 LEU A 71 -0.711 4.159 -9.869 1.00 0.00 C ATOM 1093 CD2 LEU A 71 1.218 2.755 -10.605 1.00 0.00 C ATOM 0 H LEU A 71 3.052 6.039 -7.160 1.00 0.00 H new ATOM 0 HA LEU A 71 0.207 5.918 -7.977 1.00 0.00 H new ATOM 0 HB2 LEU A 71 1.759 5.325 -9.799 1.00 0.00 H new ATOM 0 HB3 LEU A 71 2.552 4.154 -8.764 1.00 0.00 H new ATOM 0 HG LEU A 71 0.430 2.862 -8.624 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -1.389 3.373 -10.201 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -1.151 4.682 -9.020 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -0.546 4.864 -10.684 1.00 0.00 H new ATOM 0 HD21 LEU A 71 0.513 1.990 -10.931 1.00 0.00 H new ATOM 0 HD22 LEU A 71 1.432 3.429 -11.435 1.00 0.00 H new ATOM 0 HD23 LEU A 71 2.142 2.280 -10.276 1.00 0.00 H new ATOM 1105 N ILE A 72 -0.287 4.510 -6.025 1.00 0.00 N ATOM 1106 CA ILE A 72 -0.648 3.676 -4.891 1.00 0.00 C ATOM 1107 C ILE A 72 -1.351 2.414 -5.375 1.00 0.00 C ATOM 1108 O ILE A 72 -2.364 2.491 -6.067 1.00 0.00 O ATOM 1109 CB ILE A 72 -1.575 4.444 -3.922 1.00 0.00 C ATOM 1110 CG1 ILE A 72 -0.887 5.723 -3.439 1.00 0.00 C ATOM 1111 CG2 ILE A 72 -1.965 3.566 -2.741 1.00 0.00 C ATOM 1112 CD1 ILE A 72 -1.768 6.600 -2.574 1.00 0.00 C ATOM 0 H ILE A 72 -1.037 5.119 -6.352 1.00 0.00 H new ATOM 0 HA ILE A 72 0.265 3.404 -4.362 1.00 0.00 H new ATOM 0 HB ILE A 72 -2.486 4.717 -4.455 1.00 0.00 H new ATOM 0 HG12 ILE A 72 0.007 5.454 -2.876 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -0.557 6.297 -4.305 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -2.618 4.126 -2.071 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -2.489 2.681 -3.103 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -1.068 3.261 -2.202 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -1.212 7.487 -2.270 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -2.650 6.901 -3.140 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -2.077 6.044 -1.689 1.00 0.00 H new ATOM 1124 N VAL A 73 -0.803 1.257 -5.036 1.00 0.00 N ATOM 1125 CA VAL A 73 -1.400 -0.009 -5.432 1.00 0.00 C ATOM 1126 C VAL A 73 -2.061 -0.685 -4.239 1.00 0.00 C ATOM 1127 O VAL A 73 -1.411 -0.955 -3.230 1.00 0.00 O ATOM 1128 CB VAL A 73 -0.354 -0.961 -6.052 1.00 0.00 C ATOM 1129 CG1 VAL A 73 -0.986 -2.293 -6.430 1.00 0.00 C ATOM 1130 CG2 VAL A 73 0.299 -0.320 -7.265 1.00 0.00 C ATOM 0 H VAL A 73 0.053 1.169 -4.488 1.00 0.00 H new ATOM 0 HA VAL A 73 -2.154 0.211 -6.187 1.00 0.00 H new ATOM 0 HB VAL A 73 0.415 -1.150 -5.303 1.00 0.00 H new ATOM 0 HG11 VAL A 73 -0.228 -2.945 -6.864 1.00 0.00 H new ATOM 0 HG12 VAL A 73 -1.403 -2.764 -5.540 1.00 0.00 H new ATOM 0 HG13 VAL A 73 -1.780 -2.125 -7.157 1.00 0.00 H new ATOM 0 HG21 VAL A 73 1.033 -1.006 -7.688 1.00 0.00 H new ATOM 0 HG22 VAL A 73 -0.462 -0.097 -8.013 1.00 0.00 H new ATOM 0 HG23 VAL A 73 0.795 0.603 -6.966 1.00 0.00 H new ATOM 1140 N GLY A 74 -3.352 -0.948 -4.362 1.00 0.00 N ATOM 1141 CA GLY A 74 -4.088 -1.585 -3.290 1.00 0.00 C ATOM 1142 C GLY A 74 -4.302 -3.057 -3.553 1.00 0.00 C ATOM 1143 O GLY A 74 -5.287 -3.444 -4.185 1.00 0.00 O ATOM 0 H GLY A 74 -3.907 -0.730 -5.190 1.00 0.00 H new ATOM 0 HA2 GLY A 74 -3.547 -1.458 -2.352 1.00 0.00 H new ATOM 0 HA3 GLY A 74 -5.053 -1.093 -3.170 1.00 0.00 H new ATOM 1147 N THR A 75 -3.376 -3.870 -3.076 1.00 0.00 N ATOM 1148 CA THR A 75 -3.434 -5.306 -3.283 1.00 0.00 C ATOM 1149 C THR A 75 -4.421 -5.954 -2.313 1.00 0.00 C ATOM 1150 O THR A 75 -4.392 -5.697 -1.105 1.00 0.00 O ATOM 1151 CB THR A 75 -2.029 -5.947 -3.148 1.00 0.00 C ATOM 1152 OG1 THR A 75 -2.117 -7.377 -3.203 1.00 0.00 O ATOM 1153 CG2 THR A 75 -1.353 -5.528 -1.851 1.00 0.00 C ATOM 0 H THR A 75 -2.568 -3.556 -2.538 1.00 0.00 H new ATOM 0 HA THR A 75 -3.787 -5.484 -4.299 1.00 0.00 H new ATOM 0 HB THR A 75 -1.427 -5.592 -3.984 1.00 0.00 H new ATOM 0 HG1 THR A 75 -2.186 -7.736 -2.294 1.00 0.00 H new ATOM 0 HG21 THR A 75 -0.370 -5.994 -1.786 1.00 0.00 H new ATOM 0 HG22 THR A 75 -1.243 -4.444 -1.832 1.00 0.00 H new ATOM 0 HG23 THR A 75 -1.962 -5.846 -1.004 1.00 0.00 H new ATOM 1161 N GLY A 76 -5.310 -6.773 -2.855 1.00 0.00 N ATOM 1162 CA GLY A 76 -6.312 -7.430 -2.046 1.00 0.00 C ATOM 1163 C GLY A 76 -5.912 -8.836 -1.647 1.00 0.00 C ATOM 1164 O GLY A 76 -5.014 -9.422 -2.251 1.00 0.00 O ATOM 0 H GLY A 76 -5.354 -6.995 -3.850 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -6.492 -6.839 -1.148 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -7.251 -7.467 -2.597 1.00 0.00 H new ATOM 1168 N ALA A 77 -6.578 -9.351 -0.605 1.00 0.00 N ATOM 1169 CA ALA A 77 -6.362 -10.705 -0.074 1.00 0.00 C ATOM 1170 C ALA A 77 -5.078 -10.782 0.740 1.00 0.00 C ATOM 1171 O ALA A 77 -5.055 -11.362 1.824 1.00 0.00 O ATOM 1172 CB ALA A 77 -6.363 -11.758 -1.176 1.00 0.00 C ATOM 0 H ALA A 77 -7.294 -8.830 -0.098 1.00 0.00 H new ATOM 0 HA ALA A 77 -7.201 -10.921 0.588 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -6.200 -12.743 -0.738 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -7.323 -11.744 -1.691 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -5.566 -11.541 -1.887 1.00 0.00 H new ATOM 1178 N ASP A 78 -4.027 -10.176 0.221 1.00 0.00 N ATOM 1179 CA ASP A 78 -2.728 -10.187 0.876 1.00 0.00 C ATOM 1180 C ASP A 78 -1.855 -9.091 0.278 1.00 0.00 C ATOM 1181 O ASP A 78 -2.316 -8.316 -0.563 1.00 0.00 O ATOM 1182 CB ASP A 78 -2.059 -11.559 0.718 1.00 0.00 C ATOM 1183 CG ASP A 78 -0.992 -11.816 1.767 1.00 0.00 C ATOM 1184 OD1 ASP A 78 0.170 -11.424 1.553 1.00 0.00 O ATOM 1185 OD2 ASP A 78 -1.316 -12.407 2.818 1.00 0.00 O ATOM 0 H ASP A 78 -4.046 -9.664 -0.661 1.00 0.00 H new ATOM 0 HA ASP A 78 -2.859 -9.999 1.942 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -2.819 -12.338 0.780 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -1.612 -11.628 -0.274 1.00 0.00 H new ATOM 1190 N VAL A 79 -0.601 -9.028 0.699 1.00 0.00 N ATOM 1191 CA VAL A 79 0.310 -7.995 0.240 1.00 0.00 C ATOM 1192 C VAL A 79 1.191 -8.520 -0.888 1.00 0.00 C ATOM 1193 O VAL A 79 2.131 -9.282 -0.653 1.00 0.00 O ATOM 1194 CB VAL A 79 1.210 -7.477 1.385 1.00 0.00 C ATOM 1195 CG1 VAL A 79 2.082 -6.323 0.909 1.00 0.00 C ATOM 1196 CG2 VAL A 79 0.372 -7.061 2.583 1.00 0.00 C ATOM 0 H VAL A 79 -0.191 -9.685 1.362 1.00 0.00 H new ATOM 0 HA VAL A 79 -0.301 -7.169 -0.123 1.00 0.00 H new ATOM 0 HB VAL A 79 1.865 -8.291 1.695 1.00 0.00 H new ATOM 0 HG11 VAL A 79 2.706 -5.975 1.732 1.00 0.00 H new ATOM 0 HG12 VAL A 79 2.717 -6.660 0.089 1.00 0.00 H new ATOM 0 HG13 VAL A 79 1.448 -5.506 0.564 1.00 0.00 H new ATOM 0 HG21 VAL A 79 1.026 -6.700 3.377 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -0.314 -6.267 2.289 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -0.197 -7.918 2.944 1.00 0.00 H new ATOM 1206 N TRP A 80 0.862 -8.140 -2.111 1.00 0.00 N ATOM 1207 CA TRP A 80 1.682 -8.478 -3.260 1.00 0.00 C ATOM 1208 C TRP A 80 2.752 -7.409 -3.463 1.00 0.00 C ATOM 1209 O TRP A 80 2.441 -6.222 -3.595 1.00 0.00 O ATOM 1210 CB TRP A 80 0.812 -8.612 -4.514 1.00 0.00 C ATOM 1211 CG TRP A 80 1.588 -8.965 -5.747 1.00 0.00 C ATOM 1212 CD1 TRP A 80 2.008 -10.209 -6.124 1.00 0.00 C ATOM 1213 CD2 TRP A 80 2.035 -8.065 -6.766 1.00 0.00 C ATOM 1214 NE1 TRP A 80 2.690 -10.134 -7.312 1.00 0.00 N ATOM 1215 CE2 TRP A 80 2.720 -8.829 -7.727 1.00 0.00 C ATOM 1216 CE3 TRP A 80 1.920 -6.685 -6.958 1.00 0.00 C ATOM 1217 CZ2 TRP A 80 3.290 -8.258 -8.862 1.00 0.00 C ATOM 1218 CZ3 TRP A 80 2.487 -6.121 -8.084 1.00 0.00 C ATOM 1219 CH2 TRP A 80 3.164 -6.907 -9.024 1.00 0.00 C ATOM 0 H TRP A 80 0.029 -7.595 -2.333 1.00 0.00 H new ATOM 0 HA TRP A 80 2.171 -9.435 -3.079 1.00 0.00 H new ATOM 0 HB2 TRP A 80 0.054 -9.376 -4.340 1.00 0.00 H new ATOM 0 HB3 TRP A 80 0.285 -7.673 -4.683 1.00 0.00 H new ATOM 0 HD1 TRP A 80 1.829 -11.118 -5.569 1.00 0.00 H new ATOM 0 HE1 TRP A 80 3.107 -10.923 -7.806 1.00 0.00 H new ATOM 0 HE3 TRP A 80 1.397 -6.071 -6.239 1.00 0.00 H new ATOM 0 HZ2 TRP A 80 3.813 -8.862 -9.589 1.00 0.00 H new ATOM 0 HZ3 TRP A 80 2.407 -5.056 -8.242 1.00 0.00 H new ATOM 0 HH2 TRP A 80 3.595 -6.436 -9.895 1.00 0.00 H new ATOM 1230 N ILE A 81 4.007 -7.830 -3.466 1.00 0.00 N ATOM 1231 CA ILE A 81 5.118 -6.913 -3.657 1.00 0.00 C ATOM 1232 C ILE A 81 5.544 -6.905 -5.120 1.00 0.00 C ATOM 1233 O ILE A 81 5.895 -7.944 -5.677 1.00 0.00 O ATOM 1234 CB ILE A 81 6.341 -7.273 -2.771 1.00 0.00 C ATOM 1235 CG1 ILE A 81 6.011 -7.143 -1.276 1.00 0.00 C ATOM 1236 CG2 ILE A 81 7.534 -6.392 -3.116 1.00 0.00 C ATOM 1237 CD1 ILE A 81 5.249 -8.318 -0.701 1.00 0.00 C ATOM 0 H ILE A 81 4.281 -8.804 -3.338 1.00 0.00 H new ATOM 0 HA ILE A 81 4.769 -5.924 -3.360 1.00 0.00 H new ATOM 0 HB ILE A 81 6.595 -8.313 -2.975 1.00 0.00 H new ATOM 0 HG12 ILE A 81 6.941 -7.021 -0.720 1.00 0.00 H new ATOM 0 HG13 ILE A 81 5.426 -6.236 -1.123 1.00 0.00 H new ATOM 0 HG21 ILE A 81 8.380 -6.661 -2.483 1.00 0.00 H new ATOM 0 HG22 ILE A 81 7.803 -6.537 -4.162 1.00 0.00 H new ATOM 0 HG23 ILE A 81 7.274 -5.347 -2.949 1.00 0.00 H new ATOM 0 HD11 ILE A 81 5.058 -8.144 0.358 1.00 0.00 H new ATOM 0 HD12 ILE A 81 4.301 -8.430 -1.228 1.00 0.00 H new ATOM 0 HD13 ILE A 81 5.839 -9.227 -0.819 1.00 0.00 H new ATOM 1249 N ALA A 82 5.491 -5.731 -5.739 1.00 0.00 N ATOM 1250 CA ALA A 82 5.923 -5.573 -7.121 1.00 0.00 C ATOM 1251 C ALA A 82 7.420 -5.840 -7.249 1.00 0.00 C ATOM 1252 O ALA A 82 8.222 -5.251 -6.517 1.00 0.00 O ATOM 1253 CB ALA A 82 5.590 -4.175 -7.622 1.00 0.00 C ATOM 0 H ALA A 82 5.152 -4.873 -5.303 1.00 0.00 H new ATOM 0 HA ALA A 82 5.390 -6.300 -7.734 1.00 0.00 H new ATOM 0 HB1 ALA A 82 5.919 -4.071 -8.656 1.00 0.00 H new ATOM 0 HB2 ALA A 82 4.513 -4.015 -7.566 1.00 0.00 H new ATOM 0 HB3 ALA A 82 6.099 -3.436 -7.004 1.00 0.00 H new ATOM 1259 N PRO A 83 7.807 -6.740 -8.175 1.00 0.00 N ATOM 1260 CA PRO A 83 9.213 -7.091 -8.417 1.00 0.00 C ATOM 1261 C PRO A 83 10.061 -5.864 -8.738 1.00 0.00 C ATOM 1262 O PRO A 83 9.550 -4.855 -9.235 1.00 0.00 O ATOM 1263 CB PRO A 83 9.149 -8.028 -9.626 1.00 0.00 C ATOM 1264 CG PRO A 83 7.769 -8.584 -9.604 1.00 0.00 C ATOM 1265 CD PRO A 83 6.897 -7.489 -9.060 1.00 0.00 C ATOM 0 HA PRO A 83 9.678 -7.543 -7.541 1.00 0.00 H new ATOM 0 HB2 PRO A 83 9.344 -7.490 -10.554 1.00 0.00 H new ATOM 0 HB3 PRO A 83 9.895 -8.819 -9.553 1.00 0.00 H new ATOM 0 HG2 PRO A 83 7.450 -8.878 -10.604 1.00 0.00 H new ATOM 0 HG3 PRO A 83 7.716 -9.474 -8.977 1.00 0.00 H new ATOM 0 HD2 PRO A 83 6.500 -6.858 -9.855 1.00 0.00 H new ATOM 0 HD3 PRO A 83 6.043 -7.889 -8.514 1.00 0.00 H new ATOM 1273 N ARG A 84 11.360 -5.956 -8.470 1.00 0.00 N ATOM 1274 CA ARG A 84 12.243 -4.808 -8.625 1.00 0.00 C ATOM 1275 C ARG A 84 12.288 -4.344 -10.078 1.00 0.00 C ATOM 1276 O ARG A 84 12.288 -3.150 -10.339 1.00 0.00 O ATOM 1277 CB ARG A 84 13.658 -5.113 -8.118 1.00 0.00 C ATOM 1278 CG ARG A 84 14.426 -6.111 -8.965 1.00 0.00 C ATOM 1279 CD ARG A 84 15.891 -6.145 -8.576 1.00 0.00 C ATOM 1280 NE ARG A 84 16.677 -6.990 -9.472 1.00 0.00 N ATOM 1281 CZ ARG A 84 17.585 -6.521 -10.328 1.00 0.00 C ATOM 1282 NH1 ARG A 84 17.730 -5.212 -10.493 1.00 0.00 N ATOM 1283 NH2 ARG A 84 18.313 -7.364 -11.049 1.00 0.00 N ATOM 0 H ARG A 84 11.820 -6.807 -8.147 1.00 0.00 H new ATOM 0 HA ARG A 84 11.834 -4.001 -8.016 1.00 0.00 H new ATOM 0 HB2 ARG A 84 14.223 -4.182 -8.073 1.00 0.00 H new ATOM 0 HB3 ARG A 84 13.591 -5.495 -7.099 1.00 0.00 H new ATOM 0 HG2 ARG A 84 13.992 -7.104 -8.846 1.00 0.00 H new ATOM 0 HG3 ARG A 84 14.332 -5.847 -10.018 1.00 0.00 H new ATOM 0 HD2 ARG A 84 16.293 -5.132 -8.588 1.00 0.00 H new ATOM 0 HD3 ARG A 84 15.986 -6.513 -7.554 1.00 0.00 H new ATOM 0 HE ARG A 84 16.522 -7.998 -9.441 1.00 0.00 H new ATOM 0 HH11 ARG A 84 17.146 -4.564 -9.965 1.00 0.00 H new ATOM 0 HH12 ARG A 84 18.425 -4.854 -11.148 1.00 0.00 H new ATOM 0 HH21 ARG A 84 18.178 -8.370 -10.948 1.00 0.00 H new ATOM 0 HH22 ARG A 84 19.008 -7.006 -11.704 1.00 0.00 H new ATOM 1297 N GLN A 85 12.290 -5.286 -11.018 1.00 0.00 N ATOM 1298 CA GLN A 85 12.354 -4.947 -12.437 1.00 0.00 C ATOM 1299 C GLN A 85 11.179 -4.067 -12.849 1.00 0.00 C ATOM 1300 O GLN A 85 11.357 -3.056 -13.529 1.00 0.00 O ATOM 1301 CB GLN A 85 12.389 -6.214 -13.293 1.00 0.00 C ATOM 1302 CG GLN A 85 12.359 -5.934 -14.786 1.00 0.00 C ATOM 1303 CD GLN A 85 12.592 -7.175 -15.620 1.00 0.00 C ATOM 1304 OE1 GLN A 85 11.656 -7.891 -15.971 1.00 0.00 O ATOM 1305 NE2 GLN A 85 13.846 -7.430 -15.952 1.00 0.00 N ATOM 0 H GLN A 85 12.248 -6.286 -10.824 1.00 0.00 H new ATOM 0 HA GLN A 85 13.274 -4.385 -12.602 1.00 0.00 H new ATOM 0 HB2 GLN A 85 13.290 -6.780 -13.055 1.00 0.00 H new ATOM 0 HB3 GLN A 85 11.539 -6.844 -13.032 1.00 0.00 H new ATOM 0 HG2 GLN A 85 11.395 -5.500 -15.050 1.00 0.00 H new ATOM 0 HG3 GLN A 85 13.120 -5.192 -15.027 1.00 0.00 H new ATOM 0 HE21 GLN A 85 14.593 -6.809 -15.639 1.00 0.00 H new ATOM 0 HE22 GLN A 85 14.067 -8.247 -16.521 1.00 0.00 H new ATOM 1314 N LEU A 86 9.982 -4.449 -12.422 1.00 0.00 N ATOM 1315 CA LEU A 86 8.783 -3.679 -12.720 1.00 0.00 C ATOM 1316 C LEU A 86 8.868 -2.303 -12.068 1.00 0.00 C ATOM 1317 O LEU A 86 8.492 -1.292 -12.661 1.00 0.00 O ATOM 1318 CB LEU A 86 7.540 -4.426 -12.220 1.00 0.00 C ATOM 1319 CG LEU A 86 6.207 -3.711 -12.454 1.00 0.00 C ATOM 1320 CD1 LEU A 86 5.949 -3.526 -13.941 1.00 0.00 C ATOM 1321 CD2 LEU A 86 5.070 -4.484 -11.805 1.00 0.00 C ATOM 0 H LEU A 86 9.816 -5.289 -11.867 1.00 0.00 H new ATOM 0 HA LEU A 86 8.705 -3.551 -13.800 1.00 0.00 H new ATOM 0 HB2 LEU A 86 7.501 -5.400 -12.708 1.00 0.00 H new ATOM 0 HB3 LEU A 86 7.652 -4.609 -11.151 1.00 0.00 H new ATOM 0 HG LEU A 86 6.261 -2.724 -11.994 1.00 0.00 H new ATOM 0 HD11 LEU A 86 4.996 -3.016 -14.084 1.00 0.00 H new ATOM 0 HD12 LEU A 86 6.750 -2.929 -14.378 1.00 0.00 H new ATOM 0 HD13 LEU A 86 5.916 -4.500 -14.428 1.00 0.00 H new ATOM 0 HD21 LEU A 86 4.129 -3.963 -11.980 1.00 0.00 H new ATOM 0 HD22 LEU A 86 5.017 -5.484 -12.236 1.00 0.00 H new ATOM 0 HD23 LEU A 86 5.248 -4.561 -10.732 1.00 0.00 H new ATOM 1333 N ARG A 87 9.398 -2.279 -10.854 1.00 0.00 N ATOM 1334 CA ARG A 87 9.499 -1.052 -10.081 1.00 0.00 C ATOM 1335 C ARG A 87 10.549 -0.114 -10.677 1.00 0.00 C ATOM 1336 O ARG A 87 10.313 1.082 -10.811 1.00 0.00 O ATOM 1337 CB ARG A 87 9.845 -1.380 -8.629 1.00 0.00 C ATOM 1338 CG ARG A 87 9.683 -0.208 -7.677 1.00 0.00 C ATOM 1339 CD ARG A 87 10.016 -0.603 -6.249 1.00 0.00 C ATOM 1340 NE ARG A 87 9.284 -1.798 -5.822 1.00 0.00 N ATOM 1341 CZ ARG A 87 8.513 -1.852 -4.738 1.00 0.00 C ATOM 1342 NH1 ARG A 87 8.301 -0.759 -4.012 1.00 0.00 N ATOM 1343 NH2 ARG A 87 7.937 -2.997 -4.390 1.00 0.00 N ATOM 0 H ARG A 87 9.767 -3.104 -10.381 1.00 0.00 H new ATOM 0 HA ARG A 87 8.535 -0.544 -10.114 1.00 0.00 H new ATOM 0 HB2 ARG A 87 9.211 -2.200 -8.291 1.00 0.00 H new ATOM 0 HB3 ARG A 87 10.875 -1.733 -8.582 1.00 0.00 H new ATOM 0 HG2 ARG A 87 10.332 0.610 -7.991 1.00 0.00 H new ATOM 0 HG3 ARG A 87 8.659 0.162 -7.724 1.00 0.00 H new ATOM 0 HD2 ARG A 87 11.087 -0.785 -6.164 1.00 0.00 H new ATOM 0 HD3 ARG A 87 9.780 0.225 -5.580 1.00 0.00 H new ATOM 0 HE ARG A 87 9.370 -2.641 -6.390 1.00 0.00 H new ATOM 0 HH11 ARG A 87 8.730 0.125 -4.285 1.00 0.00 H new ATOM 0 HH12 ARG A 87 7.710 -0.805 -3.182 1.00 0.00 H new ATOM 0 HH21 ARG A 87 8.085 -3.834 -4.953 1.00 0.00 H new ATOM 0 HH22 ARG A 87 7.346 -3.039 -3.560 1.00 0.00 H new ATOM 1357 N GLU A 88 11.699 -0.670 -11.045 1.00 0.00 N ATOM 1358 CA GLU A 88 12.797 0.114 -11.605 1.00 0.00 C ATOM 1359 C GLU A 88 12.435 0.657 -12.985 1.00 0.00 C ATOM 1360 O GLU A 88 12.898 1.727 -13.380 1.00 0.00 O ATOM 1361 CB GLU A 88 14.070 -0.732 -11.686 1.00 0.00 C ATOM 1362 CG GLU A 88 14.609 -1.150 -10.324 1.00 0.00 C ATOM 1363 CD GLU A 88 15.803 -2.078 -10.422 1.00 0.00 C ATOM 1364 OE1 GLU A 88 16.933 -1.582 -10.603 1.00 0.00 O ATOM 1365 OE2 GLU A 88 15.623 -3.308 -10.313 1.00 0.00 O ATOM 0 H GLU A 88 11.896 -1.668 -10.965 1.00 0.00 H new ATOM 0 HA GLU A 88 12.978 0.961 -10.943 1.00 0.00 H new ATOM 0 HB2 GLU A 88 13.866 -1.625 -12.277 1.00 0.00 H new ATOM 0 HB3 GLU A 88 14.839 -0.168 -12.215 1.00 0.00 H new ATOM 0 HG2 GLU A 88 14.892 -0.260 -9.762 1.00 0.00 H new ATOM 0 HG3 GLU A 88 13.817 -1.644 -9.761 1.00 0.00 H new ATOM 1372 N ALA A 89 11.606 -0.084 -13.714 1.00 0.00 N ATOM 1373 CA ALA A 89 11.126 0.364 -15.014 1.00 0.00 C ATOM 1374 C ALA A 89 10.248 1.599 -14.856 1.00 0.00 C ATOM 1375 O ALA A 89 10.436 2.605 -15.543 1.00 0.00 O ATOM 1376 CB ALA A 89 10.358 -0.749 -15.713 1.00 0.00 C ATOM 0 H ALA A 89 11.254 -0.997 -13.426 1.00 0.00 H new ATOM 0 HA ALA A 89 11.987 0.625 -15.629 1.00 0.00 H new ATOM 0 HB1 ALA A 89 10.007 -0.396 -16.683 1.00 0.00 H new ATOM 0 HB2 ALA A 89 11.013 -1.609 -15.855 1.00 0.00 H new ATOM 0 HB3 ALA A 89 9.504 -1.041 -15.102 1.00 0.00 H new ATOM 1382 N LEU A 90 9.301 1.518 -13.931 1.00 0.00 N ATOM 1383 CA LEU A 90 8.415 2.637 -13.637 1.00 0.00 C ATOM 1384 C LEU A 90 9.191 3.783 -13.002 1.00 0.00 C ATOM 1385 O LEU A 90 8.948 4.952 -13.300 1.00 0.00 O ATOM 1386 CB LEU A 90 7.285 2.189 -12.710 1.00 0.00 C ATOM 1387 CG LEU A 90 6.319 1.167 -13.312 1.00 0.00 C ATOM 1388 CD1 LEU A 90 5.354 0.663 -12.256 1.00 0.00 C ATOM 1389 CD2 LEU A 90 5.555 1.779 -14.477 1.00 0.00 C ATOM 0 H LEU A 90 9.126 0.685 -13.369 1.00 0.00 H new ATOM 0 HA LEU A 90 7.983 2.989 -14.574 1.00 0.00 H new ATOM 0 HB2 LEU A 90 7.723 1.764 -11.807 1.00 0.00 H new ATOM 0 HB3 LEU A 90 6.716 3.067 -12.405 1.00 0.00 H new ATOM 0 HG LEU A 90 6.899 0.322 -13.683 1.00 0.00 H new ATOM 0 HD11 LEU A 90 4.674 -0.063 -12.701 1.00 0.00 H new ATOM 0 HD12 LEU A 90 5.913 0.189 -11.449 1.00 0.00 H new ATOM 0 HD13 LEU A 90 4.781 1.500 -11.858 1.00 0.00 H new ATOM 0 HD21 LEU A 90 4.872 1.038 -14.894 1.00 0.00 H new ATOM 0 HD22 LEU A 90 4.986 2.640 -14.127 1.00 0.00 H new ATOM 0 HD23 LEU A 90 6.258 2.097 -15.246 1.00 0.00 H new ATOM 1401 N ARG A 91 10.141 3.437 -12.140 1.00 0.00 N ATOM 1402 CA ARG A 91 10.970 4.429 -11.471 1.00 0.00 C ATOM 1403 C ARG A 91 11.819 5.192 -12.484 1.00 0.00 C ATOM 1404 O ARG A 91 12.193 6.341 -12.254 1.00 0.00 O ATOM 1405 CB ARG A 91 11.872 3.766 -10.426 1.00 0.00 C ATOM 1406 CG ARG A 91 12.581 4.764 -9.529 1.00 0.00 C ATOM 1407 CD ARG A 91 11.586 5.547 -8.691 1.00 0.00 C ATOM 1408 NE ARG A 91 12.147 6.803 -8.201 1.00 0.00 N ATOM 1409 CZ ARG A 91 11.798 7.382 -7.054 1.00 0.00 C ATOM 1410 NH1 ARG A 91 10.987 6.759 -6.205 1.00 0.00 N ATOM 1411 NH2 ARG A 91 12.284 8.577 -6.751 1.00 0.00 N ATOM 0 H ARG A 91 10.355 2.472 -11.888 1.00 0.00 H new ATOM 0 HA ARG A 91 10.310 5.134 -10.965 1.00 0.00 H new ATOM 0 HB2 ARG A 91 11.272 3.096 -9.810 1.00 0.00 H new ATOM 0 HB3 ARG A 91 12.615 3.152 -10.934 1.00 0.00 H new ATOM 0 HG2 ARG A 91 13.278 4.240 -8.876 1.00 0.00 H new ATOM 0 HG3 ARG A 91 13.169 5.451 -10.137 1.00 0.00 H new ATOM 0 HD2 ARG A 91 10.697 5.756 -9.286 1.00 0.00 H new ATOM 0 HD3 ARG A 91 11.268 4.938 -7.845 1.00 0.00 H new ATOM 0 HE ARG A 91 12.852 7.267 -8.774 1.00 0.00 H new ATOM 0 HH11 ARG A 91 10.628 5.831 -6.430 1.00 0.00 H new ATOM 0 HH12 ARG A 91 10.724 7.209 -5.328 1.00 0.00 H new ATOM 0 HH21 ARG A 91 12.921 9.047 -7.395 1.00 0.00 H new ATOM 0 HH22 ARG A 91 12.021 9.027 -5.874 1.00 0.00 H new ATOM 1425 N GLY A 92 12.104 4.550 -13.613 1.00 0.00 N ATOM 1426 CA GLY A 92 12.830 5.208 -14.683 1.00 0.00 C ATOM 1427 C GLY A 92 12.051 6.374 -15.260 1.00 0.00 C ATOM 1428 O GLY A 92 12.627 7.305 -15.824 1.00 0.00 O ATOM 0 H GLY A 92 11.844 3.583 -13.806 1.00 0.00 H new ATOM 0 HA2 GLY A 92 13.789 5.563 -14.306 1.00 0.00 H new ATOM 0 HA3 GLY A 92 13.044 4.488 -15.473 1.00 0.00 H new ATOM 1432 N VAL A 93 10.733 6.321 -15.112 1.00 0.00 N ATOM 1433 CA VAL A 93 9.858 7.399 -15.556 1.00 0.00 C ATOM 1434 C VAL A 93 9.487 8.284 -14.360 1.00 0.00 C ATOM 1435 O VAL A 93 8.665 9.193 -14.468 1.00 0.00 O ATOM 1436 CB VAL A 93 8.572 6.837 -16.214 1.00 0.00 C ATOM 1437 CG1 VAL A 93 7.839 7.911 -17.007 1.00 0.00 C ATOM 1438 CG2 VAL A 93 8.900 5.647 -17.104 1.00 0.00 C ATOM 0 H VAL A 93 10.243 5.535 -14.684 1.00 0.00 H new ATOM 0 HA VAL A 93 10.390 7.991 -16.301 1.00 0.00 H new ATOM 0 HB VAL A 93 7.911 6.502 -15.415 1.00 0.00 H new ATOM 0 HG11 VAL A 93 6.942 7.484 -17.455 1.00 0.00 H new ATOM 0 HG12 VAL A 93 7.558 8.727 -16.341 1.00 0.00 H new ATOM 0 HG13 VAL A 93 8.491 8.292 -17.793 1.00 0.00 H new ATOM 0 HG21 VAL A 93 7.984 5.267 -17.556 1.00 0.00 H new ATOM 0 HG22 VAL A 93 9.590 5.958 -17.888 1.00 0.00 H new ATOM 0 HG23 VAL A 93 9.362 4.862 -16.506 1.00 0.00 H new ATOM 1448 N ASN A 94 10.130 8.004 -13.221 1.00 0.00 N ATOM 1449 CA ASN A 94 9.890 8.719 -11.961 1.00 0.00 C ATOM 1450 C ASN A 94 8.507 8.413 -11.398 1.00 0.00 C ATOM 1451 O ASN A 94 7.988 9.153 -10.563 1.00 0.00 O ATOM 1452 CB ASN A 94 10.078 10.236 -12.122 1.00 0.00 C ATOM 1453 CG ASN A 94 11.537 10.636 -12.261 1.00 0.00 C ATOM 1454 OD1 ASN A 94 12.232 10.865 -11.267 1.00 0.00 O ATOM 1455 ND2 ASN A 94 12.008 10.735 -13.494 1.00 0.00 N ATOM 0 H ASN A 94 10.835 7.271 -13.146 1.00 0.00 H new ATOM 0 HA ASN A 94 10.635 8.361 -11.250 1.00 0.00 H new ATOM 0 HB2 ASN A 94 9.528 10.575 -13.000 1.00 0.00 H new ATOM 0 HB3 ASN A 94 9.647 10.745 -11.260 1.00 0.00 H new ATOM 0 HD21 ASN A 94 12.978 11.009 -13.649 1.00 0.00 H new ATOM 0 HD22 ASN A 94 11.401 10.537 -14.289 1.00 0.00 H new ATOM 1462 N VAL A 95 7.926 7.306 -11.837 1.00 0.00 N ATOM 1463 CA VAL A 95 6.648 6.860 -11.310 1.00 0.00 C ATOM 1464 C VAL A 95 6.873 6.064 -10.029 1.00 0.00 C ATOM 1465 O VAL A 95 7.367 4.934 -10.063 1.00 0.00 O ATOM 1466 CB VAL A 95 5.875 5.992 -12.328 1.00 0.00 C ATOM 1467 CG1 VAL A 95 4.519 5.584 -11.769 1.00 0.00 C ATOM 1468 CG2 VAL A 95 5.711 6.732 -13.649 1.00 0.00 C ATOM 0 H VAL A 95 8.321 6.701 -12.557 1.00 0.00 H new ATOM 0 HA VAL A 95 6.047 7.746 -11.103 1.00 0.00 H new ATOM 0 HB VAL A 95 6.453 5.087 -12.512 1.00 0.00 H new ATOM 0 HG11 VAL A 95 3.992 4.974 -12.502 1.00 0.00 H new ATOM 0 HG12 VAL A 95 4.661 5.010 -10.853 1.00 0.00 H new ATOM 0 HG13 VAL A 95 3.932 6.476 -11.551 1.00 0.00 H new ATOM 0 HG21 VAL A 95 5.164 6.104 -14.352 1.00 0.00 H new ATOM 0 HG22 VAL A 95 5.158 7.656 -13.482 1.00 0.00 H new ATOM 0 HG23 VAL A 95 6.693 6.966 -14.059 1.00 0.00 H new ATOM 1478 N VAL A 96 6.537 6.667 -8.900 1.00 0.00 N ATOM 1479 CA VAL A 96 6.748 6.038 -7.609 1.00 0.00 C ATOM 1480 C VAL A 96 5.597 5.096 -7.278 1.00 0.00 C ATOM 1481 O VAL A 96 4.583 5.510 -6.715 1.00 0.00 O ATOM 1482 CB VAL A 96 6.890 7.086 -6.483 1.00 0.00 C ATOM 1483 CG1 VAL A 96 7.280 6.418 -5.173 1.00 0.00 C ATOM 1484 CG2 VAL A 96 7.904 8.155 -6.868 1.00 0.00 C ATOM 0 H VAL A 96 6.116 7.595 -8.853 1.00 0.00 H new ATOM 0 HA VAL A 96 7.677 5.471 -7.674 1.00 0.00 H new ATOM 0 HB VAL A 96 5.923 7.570 -6.343 1.00 0.00 H new ATOM 0 HG11 VAL A 96 7.375 7.174 -4.393 1.00 0.00 H new ATOM 0 HG12 VAL A 96 6.512 5.698 -4.889 1.00 0.00 H new ATOM 0 HG13 VAL A 96 8.233 5.903 -5.297 1.00 0.00 H new ATOM 0 HG21 VAL A 96 7.989 8.883 -6.061 1.00 0.00 H new ATOM 0 HG22 VAL A 96 8.875 7.690 -7.041 1.00 0.00 H new ATOM 0 HG23 VAL A 96 7.575 8.658 -7.778 1.00 0.00 H new ATOM 1494 N LEU A 97 5.740 3.838 -7.664 1.00 0.00 N ATOM 1495 CA LEU A 97 4.736 2.832 -7.353 1.00 0.00 C ATOM 1496 C LEU A 97 4.973 2.278 -5.956 1.00 0.00 C ATOM 1497 O LEU A 97 6.079 1.838 -5.631 1.00 0.00 O ATOM 1498 CB LEU A 97 4.758 1.703 -8.397 1.00 0.00 C ATOM 1499 CG LEU A 97 3.727 0.575 -8.194 1.00 0.00 C ATOM 1500 CD1 LEU A 97 3.372 -0.069 -9.524 1.00 0.00 C ATOM 1501 CD2 LEU A 97 4.254 -0.491 -7.240 1.00 0.00 C ATOM 0 H LEU A 97 6.540 3.489 -8.192 1.00 0.00 H new ATOM 0 HA LEU A 97 3.751 3.298 -7.382 1.00 0.00 H new ATOM 0 HB2 LEU A 97 4.597 2.142 -9.382 1.00 0.00 H new ATOM 0 HB3 LEU A 97 5.754 1.261 -8.404 1.00 0.00 H new ATOM 0 HG LEU A 97 2.834 1.023 -7.758 1.00 0.00 H new ATOM 0 HD11 LEU A 97 2.643 -0.863 -9.361 1.00 0.00 H new ATOM 0 HD12 LEU A 97 2.947 0.682 -10.190 1.00 0.00 H new ATOM 0 HD13 LEU A 97 4.270 -0.489 -9.976 1.00 0.00 H new ATOM 0 HD21 LEU A 97 3.504 -1.272 -7.117 1.00 0.00 H new ATOM 0 HD22 LEU A 97 5.167 -0.925 -7.648 1.00 0.00 H new ATOM 0 HD23 LEU A 97 4.468 -0.039 -6.272 1.00 0.00 H new ATOM 1513 N ASP A 98 3.939 2.314 -5.134 1.00 0.00 N ATOM 1514 CA ASP A 98 4.007 1.756 -3.794 1.00 0.00 C ATOM 1515 C ASP A 98 2.766 0.914 -3.530 1.00 0.00 C ATOM 1516 O ASP A 98 1.641 1.381 -3.709 1.00 0.00 O ATOM 1517 CB ASP A 98 4.135 2.870 -2.754 1.00 0.00 C ATOM 1518 CG ASP A 98 4.533 2.343 -1.391 1.00 0.00 C ATOM 1519 OD1 ASP A 98 5.377 1.423 -1.332 1.00 0.00 O ATOM 1520 OD2 ASP A 98 4.037 2.867 -0.374 1.00 0.00 O ATOM 0 H ASP A 98 3.037 2.726 -5.373 1.00 0.00 H new ATOM 0 HA ASP A 98 4.890 1.121 -3.716 1.00 0.00 H new ATOM 0 HB2 ASP A 98 4.876 3.595 -3.091 1.00 0.00 H new ATOM 0 HB3 ASP A 98 3.185 3.399 -2.673 1.00 0.00 H new ATOM 1525 N THR A 99 2.972 -0.328 -3.128 1.00 0.00 N ATOM 1526 CA THR A 99 1.875 -1.268 -2.968 1.00 0.00 C ATOM 1527 C THR A 99 1.627 -1.597 -1.494 1.00 0.00 C ATOM 1528 O THR A 99 2.566 -1.764 -0.711 1.00 0.00 O ATOM 1529 CB THR A 99 2.142 -2.567 -3.770 1.00 0.00 C ATOM 1530 OG1 THR A 99 1.119 -3.542 -3.528 1.00 0.00 O ATOM 1531 CG2 THR A 99 3.498 -3.154 -3.418 1.00 0.00 C ATOM 0 H THR A 99 3.891 -0.710 -2.906 1.00 0.00 H new ATOM 0 HA THR A 99 0.977 -0.791 -3.362 1.00 0.00 H new ATOM 0 HB THR A 99 2.134 -2.304 -4.828 1.00 0.00 H new ATOM 0 HG1 THR A 99 1.512 -4.439 -3.543 1.00 0.00 H new ATOM 0 HG21 THR A 99 3.661 -4.065 -3.994 1.00 0.00 H new ATOM 0 HG22 THR A 99 4.279 -2.431 -3.653 1.00 0.00 H new ATOM 0 HG23 THR A 99 3.528 -3.388 -2.354 1.00 0.00 H new ATOM 1539 N MET A 100 0.356 -1.655 -1.125 1.00 0.00 N ATOM 1540 CA MET A 100 -0.054 -2.037 0.218 1.00 0.00 C ATOM 1541 C MET A 100 -1.462 -2.609 0.164 1.00 0.00 C ATOM 1542 O MET A 100 -2.072 -2.652 -0.903 1.00 0.00 O ATOM 1543 CB MET A 100 -0.007 -0.842 1.185 1.00 0.00 C ATOM 1544 CG MET A 100 -1.039 0.243 0.901 1.00 0.00 C ATOM 1545 SD MET A 100 -0.679 1.196 -0.586 1.00 0.00 S ATOM 1546 CE MET A 100 0.894 1.930 -0.144 1.00 0.00 C ATOM 0 H MET A 100 -0.421 -1.438 -1.749 1.00 0.00 H new ATOM 0 HA MET A 100 0.641 -2.789 0.592 1.00 0.00 H new ATOM 0 HB2 MET A 100 -0.153 -1.208 2.201 1.00 0.00 H new ATOM 0 HB3 MET A 100 0.988 -0.398 1.146 1.00 0.00 H new ATOM 0 HG2 MET A 100 -2.022 -0.217 0.800 1.00 0.00 H new ATOM 0 HG3 MET A 100 -1.090 0.919 1.754 1.00 0.00 H new ATOM 0 HE1 MET A 100 1.047 2.840 -0.724 1.00 0.00 H new ATOM 0 HE2 MET A 100 0.897 2.173 0.919 1.00 0.00 H new ATOM 0 HE3 MET A 100 1.697 1.225 -0.357 1.00 0.00 H new ATOM 1556 N GLN A 101 -1.975 -3.049 1.306 1.00 0.00 N ATOM 1557 CA GLN A 101 -3.324 -3.609 1.369 1.00 0.00 C ATOM 1558 C GLN A 101 -4.363 -2.566 0.958 1.00 0.00 C ATOM 1559 O GLN A 101 -4.168 -1.367 1.174 1.00 0.00 O ATOM 1560 CB GLN A 101 -3.627 -4.133 2.774 1.00 0.00 C ATOM 1561 CG GLN A 101 -2.749 -5.303 3.186 1.00 0.00 C ATOM 1562 CD GLN A 101 -3.081 -5.833 4.567 1.00 0.00 C ATOM 1563 OE1 GLN A 101 -3.526 -5.090 5.442 1.00 0.00 O ATOM 1564 NE2 GLN A 101 -2.872 -7.126 4.775 1.00 0.00 N ATOM 0 H GLN A 101 -1.482 -3.030 2.199 1.00 0.00 H new ATOM 0 HA GLN A 101 -3.376 -4.443 0.669 1.00 0.00 H new ATOM 0 HB2 GLN A 101 -3.499 -3.322 3.491 1.00 0.00 H new ATOM 0 HB3 GLN A 101 -4.672 -4.439 2.822 1.00 0.00 H new ATOM 0 HG2 GLN A 101 -2.859 -6.107 2.458 1.00 0.00 H new ATOM 0 HG3 GLN A 101 -1.704 -4.992 3.163 1.00 0.00 H new ATOM 0 HE21 GLN A 101 -2.502 -7.710 4.025 1.00 0.00 H new ATOM 0 HE22 GLN A 101 -3.081 -7.537 5.685 1.00 0.00 H new ATOM 1573 N THR A 102 -5.457 -3.036 0.364 1.00 0.00 N ATOM 1574 CA THR A 102 -6.502 -2.167 -0.171 1.00 0.00 C ATOM 1575 C THR A 102 -6.993 -1.133 0.852 1.00 0.00 C ATOM 1576 O THR A 102 -7.238 0.023 0.502 1.00 0.00 O ATOM 1577 CB THR A 102 -7.701 -3.003 -0.645 1.00 0.00 C ATOM 1578 OG1 THR A 102 -7.249 -4.270 -1.139 1.00 0.00 O ATOM 1579 CG2 THR A 102 -8.460 -2.279 -1.744 1.00 0.00 C ATOM 0 H THR A 102 -5.644 -4.031 0.240 1.00 0.00 H new ATOM 0 HA THR A 102 -6.057 -1.629 -1.008 1.00 0.00 H new ATOM 0 HB THR A 102 -8.367 -3.156 0.204 1.00 0.00 H new ATOM 0 HG1 THR A 102 -8.019 -4.798 -1.438 1.00 0.00 H new ATOM 0 HG21 THR A 102 -9.305 -2.888 -2.065 1.00 0.00 H new ATOM 0 HG22 THR A 102 -8.824 -1.324 -1.366 1.00 0.00 H new ATOM 0 HG23 THR A 102 -7.796 -2.105 -2.591 1.00 0.00 H new ATOM 1587 N GLY A 103 -7.134 -1.555 2.105 1.00 0.00 N ATOM 1588 CA GLY A 103 -7.605 -0.660 3.154 1.00 0.00 C ATOM 1589 C GLY A 103 -6.731 0.577 3.312 1.00 0.00 C ATOM 1590 O GLY A 103 -7.180 1.691 3.035 1.00 0.00 O ATOM 0 H GLY A 103 -6.930 -2.505 2.416 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -8.626 -0.351 2.930 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -7.635 -1.201 4.100 1.00 0.00 H new ATOM 1594 N PRO A 104 -5.473 0.410 3.768 1.00 0.00 N ATOM 1595 CA PRO A 104 -4.519 1.521 3.898 1.00 0.00 C ATOM 1596 C PRO A 104 -4.336 2.304 2.598 1.00 0.00 C ATOM 1597 O PRO A 104 -4.077 3.505 2.625 1.00 0.00 O ATOM 1598 CB PRO A 104 -3.211 0.827 4.286 1.00 0.00 C ATOM 1599 CG PRO A 104 -3.635 -0.449 4.925 1.00 0.00 C ATOM 1600 CD PRO A 104 -4.893 -0.868 4.218 1.00 0.00 C ATOM 0 HA PRO A 104 -4.863 2.258 4.623 1.00 0.00 H new ATOM 0 HB2 PRO A 104 -2.586 0.644 3.412 1.00 0.00 H new ATOM 0 HB3 PRO A 104 -2.627 1.439 4.973 1.00 0.00 H new ATOM 0 HG2 PRO A 104 -2.861 -1.210 4.828 1.00 0.00 H new ATOM 0 HG3 PRO A 104 -3.814 -0.311 5.991 1.00 0.00 H new ATOM 0 HD2 PRO A 104 -4.681 -1.531 3.379 1.00 0.00 H new ATOM 0 HD3 PRO A 104 -5.569 -1.404 4.884 1.00 0.00 H new ATOM 1608 N ALA A 105 -4.480 1.621 1.466 1.00 0.00 N ATOM 1609 CA ALA A 105 -4.328 2.256 0.162 1.00 0.00 C ATOM 1610 C ALA A 105 -5.374 3.350 -0.042 1.00 0.00 C ATOM 1611 O ALA A 105 -5.045 4.468 -0.440 1.00 0.00 O ATOM 1612 CB ALA A 105 -4.422 1.220 -0.947 1.00 0.00 C ATOM 0 H ALA A 105 -4.702 0.626 1.426 1.00 0.00 H new ATOM 0 HA ALA A 105 -3.342 2.720 0.126 1.00 0.00 H new ATOM 0 HB1 ALA A 105 -4.307 1.710 -1.914 1.00 0.00 H new ATOM 0 HB2 ALA A 105 -3.633 0.478 -0.820 1.00 0.00 H new ATOM 0 HB3 ALA A 105 -5.394 0.728 -0.904 1.00 0.00 H new ATOM 1618 N ILE A 106 -6.633 3.025 0.243 1.00 0.00 N ATOM 1619 CA ILE A 106 -7.721 3.994 0.139 1.00 0.00 C ATOM 1620 C ILE A 106 -7.480 5.161 1.094 1.00 0.00 C ATOM 1621 O ILE A 106 -7.727 6.325 0.762 1.00 0.00 O ATOM 1622 CB ILE A 106 -9.084 3.341 0.460 1.00 0.00 C ATOM 1623 CG1 ILE A 106 -9.374 2.203 -0.524 1.00 0.00 C ATOM 1624 CG2 ILE A 106 -10.201 4.377 0.432 1.00 0.00 C ATOM 1625 CD1 ILE A 106 -10.657 1.452 -0.228 1.00 0.00 C ATOM 0 H ILE A 106 -6.925 2.097 0.548 1.00 0.00 H new ATOM 0 HA ILE A 106 -7.744 4.359 -0.888 1.00 0.00 H new ATOM 0 HB ILE A 106 -9.037 2.924 1.466 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -9.428 2.612 -1.533 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -8.541 1.501 -0.509 1.00 0.00 H new ATOM 0 HG21 ILE A 106 -11.151 3.894 0.661 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -9.999 5.150 1.173 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -10.253 4.829 -0.558 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -10.795 0.662 -0.966 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -10.600 1.012 0.768 1.00 0.00 H new ATOM 0 HD13 ILE A 106 -11.500 2.141 -0.272 1.00 0.00 H new ATOM 1637 N ARG A 107 -6.976 4.828 2.274 1.00 0.00 N ATOM 1638 CA ARG A 107 -6.655 5.815 3.294 1.00 0.00 C ATOM 1639 C ARG A 107 -5.597 6.800 2.792 1.00 0.00 C ATOM 1640 O ARG A 107 -5.835 8.009 2.746 1.00 0.00 O ATOM 1641 CB ARG A 107 -6.163 5.095 4.550 1.00 0.00 C ATOM 1642 CG ARG A 107 -5.657 6.014 5.646 1.00 0.00 C ATOM 1643 CD ARG A 107 -5.217 5.209 6.853 1.00 0.00 C ATOM 1644 NE ARG A 107 -4.647 6.046 7.904 1.00 0.00 N ATOM 1645 CZ ARG A 107 -4.655 5.724 9.194 1.00 0.00 C ATOM 1646 NH1 ARG A 107 -5.258 4.615 9.608 1.00 0.00 N ATOM 1647 NH2 ARG A 107 -4.067 6.520 10.074 1.00 0.00 N ATOM 0 H ARG A 107 -6.778 3.866 2.551 1.00 0.00 H new ATOM 0 HA ARG A 107 -7.552 6.387 3.529 1.00 0.00 H new ATOM 0 HB2 ARG A 107 -6.977 4.489 4.948 1.00 0.00 H new ATOM 0 HB3 ARG A 107 -5.363 4.409 4.270 1.00 0.00 H new ATOM 0 HG2 ARG A 107 -4.822 6.608 5.274 1.00 0.00 H new ATOM 0 HG3 ARG A 107 -6.442 6.713 5.934 1.00 0.00 H new ATOM 0 HD2 ARG A 107 -6.071 4.662 7.252 1.00 0.00 H new ATOM 0 HD3 ARG A 107 -4.480 4.468 6.543 1.00 0.00 H new ATOM 0 HE ARG A 107 -4.217 6.930 7.633 1.00 0.00 H new ATOM 0 HH11 ARG A 107 -5.719 4.003 8.934 1.00 0.00 H new ATOM 0 HH12 ARG A 107 -5.260 4.375 10.599 1.00 0.00 H new ATOM 0 HH21 ARG A 107 -3.610 7.377 9.761 1.00 0.00 H new ATOM 0 HH22 ARG A 107 -4.071 6.276 11.064 1.00 0.00 H new ATOM 1661 N THR A 108 -4.442 6.272 2.397 1.00 0.00 N ATOM 1662 CA THR A 108 -3.338 7.098 1.923 1.00 0.00 C ATOM 1663 C THR A 108 -3.736 7.905 0.685 1.00 0.00 C ATOM 1664 O THR A 108 -3.337 9.062 0.531 1.00 0.00 O ATOM 1665 CB THR A 108 -2.104 6.226 1.605 1.00 0.00 C ATOM 1666 OG1 THR A 108 -1.728 5.482 2.773 1.00 0.00 O ATOM 1667 CG2 THR A 108 -0.925 7.075 1.145 1.00 0.00 C ATOM 0 H THR A 108 -4.247 5.271 2.396 1.00 0.00 H new ATOM 0 HA THR A 108 -3.086 7.797 2.721 1.00 0.00 H new ATOM 0 HB THR A 108 -2.371 5.546 0.796 1.00 0.00 H new ATOM 0 HG1 THR A 108 -2.375 4.762 2.925 1.00 0.00 H new ATOM 0 HG21 THR A 108 -0.074 6.429 0.930 1.00 0.00 H new ATOM 0 HG22 THR A 108 -1.201 7.624 0.245 1.00 0.00 H new ATOM 0 HG23 THR A 108 -0.656 7.780 1.931 1.00 0.00 H new ATOM 1675 N TYR A 109 -4.542 7.303 -0.184 1.00 0.00 N ATOM 1676 CA TYR A 109 -4.979 7.970 -1.405 1.00 0.00 C ATOM 1677 C TYR A 109 -5.789 9.222 -1.079 1.00 0.00 C ATOM 1678 O TYR A 109 -5.587 10.275 -1.685 1.00 0.00 O ATOM 1679 CB TYR A 109 -5.797 7.015 -2.276 1.00 0.00 C ATOM 1680 CG TYR A 109 -6.136 7.577 -3.639 1.00 0.00 C ATOM 1681 CD1 TYR A 109 -5.132 7.982 -4.510 1.00 0.00 C ATOM 1682 CD2 TYR A 109 -7.455 7.704 -4.052 1.00 0.00 C ATOM 1683 CE1 TYR A 109 -5.434 8.497 -5.757 1.00 0.00 C ATOM 1684 CE2 TYR A 109 -7.764 8.218 -5.297 1.00 0.00 C ATOM 1685 CZ TYR A 109 -6.750 8.613 -6.146 1.00 0.00 C ATOM 1686 OH TYR A 109 -7.055 9.128 -7.385 1.00 0.00 O ATOM 0 H TYR A 109 -4.905 6.357 -0.066 1.00 0.00 H new ATOM 0 HA TYR A 109 -4.093 8.273 -1.962 1.00 0.00 H new ATOM 0 HB2 TYR A 109 -5.241 6.086 -2.403 1.00 0.00 H new ATOM 0 HB3 TYR A 109 -6.721 6.764 -1.756 1.00 0.00 H new ATOM 0 HD1 TYR A 109 -4.099 7.893 -4.208 1.00 0.00 H new ATOM 0 HD2 TYR A 109 -8.252 7.397 -3.391 1.00 0.00 H new ATOM 0 HE1 TYR A 109 -4.642 8.807 -6.423 1.00 0.00 H new ATOM 0 HE2 TYR A 109 -8.795 8.310 -5.605 1.00 0.00 H new ATOM 0 HH TYR A 109 -6.792 8.488 -8.079 1.00 0.00 H new ATOM 1696 N ASN A 110 -6.685 9.110 -0.102 1.00 0.00 N ATOM 1697 CA ASN A 110 -7.500 10.246 0.326 1.00 0.00 C ATOM 1698 C ASN A 110 -6.620 11.376 0.848 1.00 0.00 C ATOM 1699 O ASN A 110 -6.879 12.552 0.580 1.00 0.00 O ATOM 1700 CB ASN A 110 -8.499 9.825 1.407 1.00 0.00 C ATOM 1701 CG ASN A 110 -9.832 9.391 0.832 1.00 0.00 C ATOM 1702 OD1 ASN A 110 -10.744 10.203 0.673 1.00 0.00 O ATOM 1703 ND2 ASN A 110 -9.963 8.111 0.520 1.00 0.00 N ATOM 0 H ASN A 110 -6.866 8.246 0.408 1.00 0.00 H new ATOM 0 HA ASN A 110 -8.054 10.603 -0.542 1.00 0.00 H new ATOM 0 HB2 ASN A 110 -8.075 9.007 1.989 1.00 0.00 H new ATOM 0 HB3 ASN A 110 -8.657 10.656 2.094 1.00 0.00 H new ATOM 0 HD21 ASN A 110 -10.842 7.768 0.134 1.00 0.00 H new ATOM 0 HD22 ASN A 110 -9.185 7.468 0.666 1.00 0.00 H new ATOM 1710 N ILE A 111 -5.577 11.008 1.581 1.00 0.00 N ATOM 1711 CA ILE A 111 -4.634 11.976 2.127 1.00 0.00 C ATOM 1712 C ILE A 111 -3.874 12.688 1.008 1.00 0.00 C ATOM 1713 O ILE A 111 -3.706 13.908 1.036 1.00 0.00 O ATOM 1714 CB ILE A 111 -3.627 11.295 3.084 1.00 0.00 C ATOM 1715 CG1 ILE A 111 -4.370 10.600 4.229 1.00 0.00 C ATOM 1716 CG2 ILE A 111 -2.633 12.312 3.632 1.00 0.00 C ATOM 1717 CD1 ILE A 111 -3.467 9.805 5.150 1.00 0.00 C ATOM 0 H ILE A 111 -5.362 10.038 1.813 1.00 0.00 H new ATOM 0 HA ILE A 111 -5.211 12.711 2.689 1.00 0.00 H new ATOM 0 HB ILE A 111 -3.071 10.544 2.523 1.00 0.00 H new ATOM 0 HG12 ILE A 111 -4.900 11.351 4.815 1.00 0.00 H new ATOM 0 HG13 ILE A 111 -5.123 9.933 3.809 1.00 0.00 H new ATOM 0 HG21 ILE A 111 -1.934 11.813 4.303 1.00 0.00 H new ATOM 0 HG22 ILE A 111 -2.083 12.765 2.807 1.00 0.00 H new ATOM 0 HG23 ILE A 111 -3.170 13.087 4.179 1.00 0.00 H new ATOM 0 HD11 ILE A 111 -4.065 9.342 5.935 1.00 0.00 H new ATOM 0 HD12 ILE A 111 -2.956 9.030 4.579 1.00 0.00 H new ATOM 0 HD13 ILE A 111 -2.730 10.470 5.600 1.00 0.00 H new ATOM 1729 N MET A 112 -3.434 11.918 0.018 1.00 0.00 N ATOM 1730 CA MET A 112 -2.677 12.465 -1.107 1.00 0.00 C ATOM 1731 C MET A 112 -3.542 13.387 -1.962 1.00 0.00 C ATOM 1732 O MET A 112 -3.102 14.465 -2.369 1.00 0.00 O ATOM 1733 CB MET A 112 -2.103 11.336 -1.967 1.00 0.00 C ATOM 1734 CG MET A 112 -1.018 10.509 -1.282 1.00 0.00 C ATOM 1735 SD MET A 112 0.544 11.398 -1.075 1.00 0.00 S ATOM 1736 CE MET A 112 0.161 12.522 0.269 1.00 0.00 C ATOM 0 H MET A 112 -3.588 10.911 -0.030 1.00 0.00 H new ATOM 0 HA MET A 112 -1.855 13.053 -0.699 1.00 0.00 H new ATOM 0 HB2 MET A 112 -2.916 10.673 -2.263 1.00 0.00 H new ATOM 0 HB3 MET A 112 -1.693 11.765 -2.881 1.00 0.00 H new ATOM 0 HG2 MET A 112 -1.378 10.191 -0.304 1.00 0.00 H new ATOM 0 HG3 MET A 112 -0.838 9.606 -1.865 1.00 0.00 H new ATOM 0 HE1 MET A 112 1.015 12.586 0.944 1.00 0.00 H new ATOM 0 HE2 MET A 112 -0.058 13.511 -0.135 1.00 0.00 H new ATOM 0 HE3 MET A 112 -0.707 12.153 0.816 1.00 0.00 H new ATOM 1746 N ILE A 113 -4.772 12.960 -2.227 1.00 0.00 N ATOM 1747 CA ILE A 113 -5.717 13.771 -2.988 1.00 0.00 C ATOM 1748 C ILE A 113 -6.061 15.044 -2.219 1.00 0.00 C ATOM 1749 O ILE A 113 -6.264 16.106 -2.806 1.00 0.00 O ATOM 1750 CB ILE A 113 -7.011 12.978 -3.301 1.00 0.00 C ATOM 1751 CG1 ILE A 113 -6.700 11.805 -4.236 1.00 0.00 C ATOM 1752 CG2 ILE A 113 -8.078 13.878 -3.914 1.00 0.00 C ATOM 1753 CD1 ILE A 113 -6.127 12.226 -5.576 1.00 0.00 C ATOM 0 H ILE A 113 -5.138 12.057 -1.926 1.00 0.00 H new ATOM 0 HA ILE A 113 -5.243 14.039 -3.932 1.00 0.00 H new ATOM 0 HB ILE A 113 -7.403 12.588 -2.362 1.00 0.00 H new ATOM 0 HG12 ILE A 113 -5.994 11.137 -3.743 1.00 0.00 H new ATOM 0 HG13 ILE A 113 -7.614 11.235 -4.405 1.00 0.00 H new ATOM 0 HG21 ILE A 113 -8.973 13.292 -4.122 1.00 0.00 H new ATOM 0 HG22 ILE A 113 -8.323 14.679 -3.217 1.00 0.00 H new ATOM 0 HG23 ILE A 113 -7.702 14.308 -4.843 1.00 0.00 H new ATOM 0 HD11 ILE A 113 -5.933 11.342 -6.183 1.00 0.00 H new ATOM 0 HD12 ILE A 113 -6.840 12.870 -6.091 1.00 0.00 H new ATOM 0 HD13 ILE A 113 -5.196 12.770 -5.419 1.00 0.00 H new ATOM 1765 N GLY A 114 -6.084 14.933 -0.897 1.00 0.00 N ATOM 1766 CA GLY A 114 -6.378 16.077 -0.058 1.00 0.00 C ATOM 1767 C GLY A 114 -5.150 16.920 0.221 1.00 0.00 C ATOM 1768 O GLY A 114 -5.142 17.730 1.147 1.00 0.00 O ATOM 0 H GLY A 114 -5.903 14.067 -0.390 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -7.136 16.693 -0.541 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -6.801 15.733 0.886 1.00 0.00 H new ATOM 1772 N GLU A 115 -4.109 16.725 -0.573 1.00 0.00 N ATOM 1773 CA GLU A 115 -2.886 17.490 -0.424 1.00 0.00 C ATOM 1774 C GLU A 115 -2.583 18.228 -1.726 1.00 0.00 C ATOM 1775 O GLU A 115 -2.551 19.458 -1.760 1.00 0.00 O ATOM 1776 CB GLU A 115 -1.725 16.564 -0.040 1.00 0.00 C ATOM 1777 CG GLU A 115 -0.669 17.214 0.846 1.00 0.00 C ATOM 1778 CD GLU A 115 0.077 18.344 0.166 1.00 0.00 C ATOM 1779 OE1 GLU A 115 1.046 18.063 -0.567 1.00 0.00 O ATOM 1780 OE2 GLU A 115 -0.295 19.519 0.370 1.00 0.00 O ATOM 0 H GLU A 115 -4.089 16.041 -1.329 1.00 0.00 H new ATOM 0 HA GLU A 115 -3.013 18.223 0.373 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -2.127 15.691 0.475 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -1.246 16.204 -0.951 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -1.148 17.596 1.748 1.00 0.00 H new ATOM 0 HG3 GLU A 115 0.047 16.455 1.162 1.00 0.00 H new ATOM 1787 N ARG A 116 -2.389 17.472 -2.800 1.00 0.00 N ATOM 1788 CA ARG A 116 -2.092 18.057 -4.100 1.00 0.00 C ATOM 1789 C ARG A 116 -2.814 17.314 -5.221 1.00 0.00 C ATOM 1790 O ARG A 116 -4.018 17.472 -5.415 1.00 0.00 O ATOM 1791 CB ARG A 116 -0.584 18.042 -4.372 1.00 0.00 C ATOM 1792 CG ARG A 116 0.210 19.076 -3.595 1.00 0.00 C ATOM 1793 CD ARG A 116 1.704 18.916 -3.836 1.00 0.00 C ATOM 1794 NE ARG A 116 2.031 18.858 -5.262 1.00 0.00 N ATOM 1795 CZ ARG A 116 3.264 18.687 -5.742 1.00 0.00 C ATOM 1796 NH1 ARG A 116 4.304 18.640 -4.920 1.00 0.00 N ATOM 1797 NH2 ARG A 116 3.454 18.571 -7.051 1.00 0.00 N ATOM 0 H ARG A 116 -2.432 16.453 -2.795 1.00 0.00 H new ATOM 0 HA ARG A 116 -2.445 19.088 -4.078 1.00 0.00 H new ATOM 0 HB2 ARG A 116 -0.195 17.052 -4.135 1.00 0.00 H new ATOM 0 HB3 ARG A 116 -0.419 18.202 -5.437 1.00 0.00 H new ATOM 0 HG2 ARG A 116 -0.104 20.077 -3.891 1.00 0.00 H new ATOM 0 HG3 ARG A 116 -0.002 18.977 -2.530 1.00 0.00 H new ATOM 0 HD2 ARG A 116 2.236 19.749 -3.377 1.00 0.00 H new ATOM 0 HD3 ARG A 116 2.054 18.007 -3.347 1.00 0.00 H new ATOM 0 HE ARG A 116 1.267 18.954 -5.931 1.00 0.00 H new ATOM 0 HH11 ARG A 116 4.164 18.735 -3.914 1.00 0.00 H new ATOM 0 HH12 ARG A 116 5.244 18.509 -5.294 1.00 0.00 H new ATOM 0 HH21 ARG A 116 2.658 18.613 -7.688 1.00 0.00 H new ATOM 0 HH22 ARG A 116 4.396 18.440 -7.420 1.00 0.00 H new ATOM 1811 N ARG A 117 -2.055 16.482 -5.927 1.00 0.00 N ATOM 1812 CA ARG A 117 -2.528 15.752 -7.095 1.00 0.00 C ATOM 1813 C ARG A 117 -1.356 14.973 -7.674 1.00 0.00 C ATOM 1814 O ARG A 117 -0.370 14.745 -6.974 1.00 0.00 O ATOM 1815 CB ARG A 117 -3.117 16.700 -8.155 1.00 0.00 C ATOM 1816 CG ARG A 117 -2.169 17.803 -8.603 1.00 0.00 C ATOM 1817 CD ARG A 117 -2.813 18.703 -9.649 1.00 0.00 C ATOM 1818 NE ARG A 117 -2.964 18.041 -10.948 1.00 0.00 N ATOM 1819 CZ ARG A 117 -3.927 18.335 -11.829 1.00 0.00 C ATOM 1820 NH1 ARG A 117 -4.874 19.213 -11.519 1.00 0.00 N ATOM 1821 NH2 ARG A 117 -3.945 17.736 -13.017 1.00 0.00 N ATOM 0 H ARG A 117 -1.079 16.294 -5.699 1.00 0.00 H new ATOM 0 HA ARG A 117 -3.327 15.073 -6.795 1.00 0.00 H new ATOM 0 HB2 ARG A 117 -3.412 16.114 -9.026 1.00 0.00 H new ATOM 0 HB3 ARG A 117 -4.023 17.155 -7.755 1.00 0.00 H new ATOM 0 HG2 ARG A 117 -1.871 18.400 -7.741 1.00 0.00 H new ATOM 0 HG3 ARG A 117 -1.261 17.360 -9.012 1.00 0.00 H new ATOM 0 HD2 ARG A 117 -3.792 19.024 -9.293 1.00 0.00 H new ATOM 0 HD3 ARG A 117 -2.208 19.601 -9.772 1.00 0.00 H new ATOM 0 HE ARG A 117 -2.295 17.312 -11.195 1.00 0.00 H new ATOM 0 HH11 ARG A 117 -4.869 19.667 -10.606 1.00 0.00 H new ATOM 0 HH12 ARG A 117 -5.606 19.434 -12.194 1.00 0.00 H new ATOM 0 HH21 ARG A 117 -3.225 17.054 -13.255 1.00 0.00 H new ATOM 0 HH22 ARG A 117 -4.679 17.959 -13.690 1.00 0.00 H new ATOM 1835 N ARG A 118 -1.472 14.561 -8.937 1.00 0.00 N ATOM 1836 CA ARG A 118 -0.405 13.829 -9.627 1.00 0.00 C ATOM 1837 C ARG A 118 -0.202 12.468 -8.968 1.00 0.00 C ATOM 1838 O ARG A 118 0.874 11.874 -9.038 1.00 0.00 O ATOM 1839 CB ARG A 118 0.908 14.628 -9.612 1.00 0.00 C ATOM 1840 CG ARG A 118 1.708 14.532 -10.905 1.00 0.00 C ATOM 1841 CD ARG A 118 3.114 15.093 -10.736 1.00 0.00 C ATOM 1842 NE ARG A 118 3.779 15.344 -12.019 1.00 0.00 N ATOM 1843 CZ ARG A 118 4.406 14.417 -12.750 1.00 0.00 C ATOM 1844 NH1 ARG A 118 4.424 13.147 -12.367 1.00 0.00 N ATOM 1845 NH2 ARG A 118 5.016 14.778 -13.872 1.00 0.00 N ATOM 0 H ARG A 118 -2.301 14.723 -9.509 1.00 0.00 H new ATOM 0 HA ARG A 118 -0.701 13.684 -10.666 1.00 0.00 H new ATOM 0 HB2 ARG A 118 0.681 15.676 -9.414 1.00 0.00 H new ATOM 0 HB3 ARG A 118 1.527 14.275 -8.787 1.00 0.00 H new ATOM 0 HG2 ARG A 118 1.767 13.490 -11.221 1.00 0.00 H new ATOM 0 HG3 ARG A 118 1.191 15.076 -11.695 1.00 0.00 H new ATOM 0 HD2 ARG A 118 3.065 16.022 -10.169 1.00 0.00 H new ATOM 0 HD3 ARG A 118 3.712 14.394 -10.151 1.00 0.00 H new ATOM 0 HE ARG A 118 3.762 16.298 -12.381 1.00 0.00 H new ATOM 0 HH11 ARG A 118 3.956 12.868 -11.505 1.00 0.00 H new ATOM 0 HH12 ARG A 118 4.906 12.450 -12.934 1.00 0.00 H new ATOM 0 HH21 ARG A 118 5.003 15.754 -14.168 1.00 0.00 H new ATOM 0 HH22 ARG A 118 5.498 14.080 -14.438 1.00 0.00 H new ATOM 1859 N VAL A 119 -1.253 11.978 -8.343 1.00 0.00 N ATOM 1860 CA VAL A 119 -1.218 10.700 -7.658 1.00 0.00 C ATOM 1861 C VAL A 119 -2.377 9.834 -8.135 1.00 0.00 C ATOM 1862 O VAL A 119 -3.480 10.332 -8.359 1.00 0.00 O ATOM 1863 CB VAL A 119 -1.268 10.880 -6.119 1.00 0.00 C ATOM 1864 CG1 VAL A 119 -2.493 11.680 -5.699 1.00 0.00 C ATOM 1865 CG2 VAL A 119 -1.238 9.536 -5.404 1.00 0.00 C ATOM 0 H VAL A 119 -2.155 12.453 -8.295 1.00 0.00 H new ATOM 0 HA VAL A 119 -0.276 10.206 -7.897 1.00 0.00 H new ATOM 0 HB VAL A 119 -0.379 11.439 -5.827 1.00 0.00 H new ATOM 0 HG11 VAL A 119 -2.501 11.790 -4.615 1.00 0.00 H new ATOM 0 HG12 VAL A 119 -2.461 12.665 -6.164 1.00 0.00 H new ATOM 0 HG13 VAL A 119 -3.395 11.158 -6.018 1.00 0.00 H new ATOM 0 HG21 VAL A 119 -1.274 9.696 -4.326 1.00 0.00 H new ATOM 0 HG22 VAL A 119 -2.098 8.941 -5.712 1.00 0.00 H new ATOM 0 HG23 VAL A 119 -0.320 9.007 -5.661 1.00 0.00 H new ATOM 1875 N ALA A 120 -2.113 8.552 -8.318 1.00 0.00 N ATOM 1876 CA ALA A 120 -3.123 7.629 -8.805 1.00 0.00 C ATOM 1877 C ALA A 120 -3.177 6.388 -7.927 1.00 0.00 C ATOM 1878 O ALA A 120 -2.204 6.061 -7.245 1.00 0.00 O ATOM 1879 CB ALA A 120 -2.837 7.248 -10.249 1.00 0.00 C ATOM 0 H ALA A 120 -1.204 8.126 -8.136 1.00 0.00 H new ATOM 0 HA ALA A 120 -4.094 8.122 -8.762 1.00 0.00 H new ATOM 0 HB1 ALA A 120 -3.602 6.556 -10.601 1.00 0.00 H new ATOM 0 HB2 ALA A 120 -2.845 8.144 -10.870 1.00 0.00 H new ATOM 0 HB3 ALA A 120 -1.859 6.771 -10.313 1.00 0.00 H new ATOM 1885 N ALA A 121 -4.310 5.705 -7.941 1.00 0.00 N ATOM 1886 CA ALA A 121 -4.482 4.505 -7.143 1.00 0.00 C ATOM 1887 C ALA A 121 -5.002 3.347 -7.984 1.00 0.00 C ATOM 1888 O ALA A 121 -6.066 3.435 -8.597 1.00 0.00 O ATOM 1889 CB ALA A 121 -5.425 4.769 -5.980 1.00 0.00 C ATOM 0 H ALA A 121 -5.125 5.963 -8.498 1.00 0.00 H new ATOM 0 HA ALA A 121 -3.504 4.227 -6.752 1.00 0.00 H new ATOM 0 HB1 ALA A 121 -5.542 3.858 -5.393 1.00 0.00 H new ATOM 0 HB2 ALA A 121 -5.013 5.557 -5.349 1.00 0.00 H new ATOM 0 HB3 ALA A 121 -6.397 5.081 -6.363 1.00 0.00 H new ATOM 1895 N ALA A 122 -4.241 2.269 -8.013 1.00 0.00 N ATOM 1896 CA ALA A 122 -4.669 1.045 -8.664 1.00 0.00 C ATOM 1897 C ALA A 122 -5.168 0.076 -7.606 1.00 0.00 C ATOM 1898 O ALA A 122 -4.381 -0.618 -6.962 1.00 0.00 O ATOM 1899 CB ALA A 122 -3.531 0.435 -9.468 1.00 0.00 C ATOM 0 H ALA A 122 -3.315 2.217 -7.589 1.00 0.00 H new ATOM 0 HA ALA A 122 -5.477 1.266 -9.361 1.00 0.00 H new ATOM 0 HB1 ALA A 122 -3.875 -0.482 -9.947 1.00 0.00 H new ATOM 0 HB2 ALA A 122 -3.204 1.142 -10.230 1.00 0.00 H new ATOM 0 HB3 ALA A 122 -2.698 0.207 -8.804 1.00 0.00 H new ATOM 1905 N LEU A 123 -6.472 0.061 -7.399 1.00 0.00 N ATOM 1906 CA LEU A 123 -7.055 -0.705 -6.310 1.00 0.00 C ATOM 1907 C LEU A 123 -7.689 -1.988 -6.821 1.00 0.00 C ATOM 1908 O LEU A 123 -8.460 -1.968 -7.781 1.00 0.00 O ATOM 1909 CB LEU A 123 -8.091 0.138 -5.564 1.00 0.00 C ATOM 1910 CG LEU A 123 -7.553 1.422 -4.934 1.00 0.00 C ATOM 1911 CD1 LEU A 123 -8.664 2.169 -4.223 1.00 0.00 C ATOM 1912 CD2 LEU A 123 -6.421 1.113 -3.966 1.00 0.00 C ATOM 0 H LEU A 123 -7.148 0.569 -7.969 1.00 0.00 H new ATOM 0 HA LEU A 123 -6.255 -0.975 -5.620 1.00 0.00 H new ATOM 0 HB2 LEU A 123 -8.890 0.400 -6.257 1.00 0.00 H new ATOM 0 HB3 LEU A 123 -8.537 -0.474 -4.780 1.00 0.00 H new ATOM 0 HG LEU A 123 -7.161 2.055 -5.730 1.00 0.00 H new ATOM 0 HD11 LEU A 123 -8.264 3.081 -3.780 1.00 0.00 H new ATOM 0 HD12 LEU A 123 -9.445 2.426 -4.938 1.00 0.00 H new ATOM 0 HD13 LEU A 123 -9.083 1.538 -3.439 1.00 0.00 H new ATOM 0 HD21 LEU A 123 -6.053 2.041 -3.529 1.00 0.00 H new ATOM 0 HD22 LEU A 123 -6.787 0.459 -3.174 1.00 0.00 H new ATOM 0 HD23 LEU A 123 -5.611 0.617 -4.500 1.00 0.00 H new ATOM 1924 N ILE A 124 -7.355 -3.096 -6.178 1.00 0.00 N ATOM 1925 CA ILE A 124 -7.888 -4.396 -6.549 1.00 0.00 C ATOM 1926 C ILE A 124 -8.784 -4.935 -5.437 1.00 0.00 C ATOM 1927 O ILE A 124 -8.431 -4.867 -4.255 1.00 0.00 O ATOM 1928 CB ILE A 124 -6.747 -5.398 -6.834 1.00 0.00 C ATOM 1929 CG1 ILE A 124 -5.794 -4.814 -7.882 1.00 0.00 C ATOM 1930 CG2 ILE A 124 -7.307 -6.737 -7.302 1.00 0.00 C ATOM 1931 CD1 ILE A 124 -4.602 -5.694 -8.183 1.00 0.00 C ATOM 0 H ILE A 124 -6.710 -3.119 -5.388 1.00 0.00 H new ATOM 0 HA ILE A 124 -8.477 -4.274 -7.458 1.00 0.00 H new ATOM 0 HB ILE A 124 -6.193 -5.572 -5.911 1.00 0.00 H new ATOM 0 HG12 ILE A 124 -6.347 -4.640 -8.805 1.00 0.00 H new ATOM 0 HG13 ILE A 124 -5.439 -3.844 -7.535 1.00 0.00 H new ATOM 0 HG21 ILE A 124 -6.486 -7.427 -7.497 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -7.953 -7.151 -6.528 1.00 0.00 H new ATOM 0 HG23 ILE A 124 -7.883 -6.591 -8.216 1.00 0.00 H new ATOM 0 HD11 ILE A 124 -3.975 -5.213 -8.933 1.00 0.00 H new ATOM 0 HD12 ILE A 124 -4.024 -5.848 -7.272 1.00 0.00 H new ATOM 0 HD13 ILE A 124 -4.947 -6.656 -8.561 1.00 0.00 H new ATOM 1943 N ALA A 125 -9.950 -5.442 -5.817 1.00 0.00 N ATOM 1944 CA ALA A 125 -10.912 -5.967 -4.859 1.00 0.00 C ATOM 1945 C ALA A 125 -10.384 -7.225 -4.180 1.00 0.00 C ATOM 1946 O ALA A 125 -9.545 -7.939 -4.732 1.00 0.00 O ATOM 1947 CB ALA A 125 -12.238 -6.253 -5.545 1.00 0.00 C ATOM 0 H ALA A 125 -10.253 -5.500 -6.789 1.00 0.00 H new ATOM 0 HA ALA A 125 -11.068 -5.211 -4.090 1.00 0.00 H new ATOM 0 HB1 ALA A 125 -12.948 -6.645 -4.816 1.00 0.00 H new ATOM 0 HB2 ALA A 125 -12.631 -5.332 -5.975 1.00 0.00 H new ATOM 0 HB3 ALA A 125 -12.087 -6.987 -6.336 1.00 0.00 H new ATOM 1953 N VAL A 126 -10.883 -7.492 -2.986 1.00 0.00 N ATOM 1954 CA VAL A 126 -10.432 -8.632 -2.210 1.00 0.00 C ATOM 1955 C VAL A 126 -11.264 -9.879 -2.511 1.00 0.00 C ATOM 1956 O VAL A 126 -12.480 -9.891 -2.323 1.00 0.00 O ATOM 1957 CB VAL A 126 -10.467 -8.334 -0.694 1.00 0.00 C ATOM 1958 CG1 VAL A 126 -9.382 -7.336 -0.326 1.00 0.00 C ATOM 1959 CG2 VAL A 126 -11.830 -7.806 -0.268 1.00 0.00 C ATOM 0 H VAL A 126 -11.604 -6.932 -2.532 1.00 0.00 H new ATOM 0 HA VAL A 126 -9.400 -8.824 -2.503 1.00 0.00 H new ATOM 0 HB VAL A 126 -10.284 -9.269 -0.165 1.00 0.00 H new ATOM 0 HG11 VAL A 126 -9.419 -7.136 0.745 1.00 0.00 H new ATOM 0 HG12 VAL A 126 -8.406 -7.747 -0.584 1.00 0.00 H new ATOM 0 HG13 VAL A 126 -9.541 -6.407 -0.874 1.00 0.00 H new ATOM 0 HG21 VAL A 126 -11.824 -7.606 0.803 1.00 0.00 H new ATOM 0 HG22 VAL A 126 -12.048 -6.885 -0.808 1.00 0.00 H new ATOM 0 HG23 VAL A 126 -12.595 -8.549 -0.494 1.00 0.00 H new ATOM 1969 N PRO A 127 -10.612 -10.929 -3.032 1.00 0.00 N ATOM 1970 CA PRO A 127 -11.241 -12.239 -3.222 1.00 0.00 C ATOM 1971 C PRO A 127 -11.741 -12.812 -1.901 1.00 0.00 C ATOM 1972 O PRO A 127 -10.950 -13.191 -1.037 1.00 0.00 O ATOM 1973 CB PRO A 127 -10.114 -13.111 -3.791 1.00 0.00 C ATOM 1974 CG PRO A 127 -9.119 -12.148 -4.343 1.00 0.00 C ATOM 1975 CD PRO A 127 -9.219 -10.909 -3.501 1.00 0.00 C ATOM 0 HA PRO A 127 -12.113 -12.186 -3.874 1.00 0.00 H new ATOM 0 HB2 PRO A 127 -9.670 -13.736 -3.016 1.00 0.00 H new ATOM 0 HB3 PRO A 127 -10.487 -13.781 -4.566 1.00 0.00 H new ATOM 0 HG2 PRO A 127 -8.112 -12.564 -4.304 1.00 0.00 H new ATOM 0 HG3 PRO A 127 -9.332 -11.926 -5.389 1.00 0.00 H new ATOM 0 HD2 PRO A 127 -8.514 -10.930 -2.670 1.00 0.00 H new ATOM 0 HD3 PRO A 127 -9.002 -10.011 -4.080 1.00 0.00 H new ATOM 1983 N LEU A 128 -13.056 -12.872 -1.749 1.00 0.00 N ATOM 1984 CA LEU A 128 -13.670 -13.306 -0.499 1.00 0.00 C ATOM 1985 C LEU A 128 -13.821 -14.825 -0.444 1.00 0.00 C ATOM 1986 O LEU A 128 -14.614 -15.347 0.341 1.00 0.00 O ATOM 1987 CB LEU A 128 -15.042 -12.644 -0.333 1.00 0.00 C ATOM 1988 CG LEU A 128 -15.028 -11.115 -0.262 1.00 0.00 C ATOM 1989 CD1 LEU A 128 -16.448 -10.574 -0.213 1.00 0.00 C ATOM 1990 CD2 LEU A 128 -14.238 -10.643 0.951 1.00 0.00 C ATOM 0 H LEU A 128 -13.723 -12.624 -2.480 1.00 0.00 H new ATOM 0 HA LEU A 128 -13.014 -13.003 0.317 1.00 0.00 H new ATOM 0 HB2 LEU A 128 -15.676 -12.946 -1.167 1.00 0.00 H new ATOM 0 HB3 LEU A 128 -15.505 -13.029 0.576 1.00 0.00 H new ATOM 0 HG LEU A 128 -14.541 -10.733 -1.159 1.00 0.00 H new ATOM 0 HD11 LEU A 128 -16.421 -9.485 -0.163 1.00 0.00 H new ATOM 0 HD12 LEU A 128 -16.986 -10.883 -1.109 1.00 0.00 H new ATOM 0 HD13 LEU A 128 -16.956 -10.965 0.668 1.00 0.00 H new ATOM 0 HD21 LEU A 128 -14.239 -9.554 0.985 1.00 0.00 H new ATOM 0 HD22 LEU A 128 -14.697 -11.035 1.859 1.00 0.00 H new ATOM 0 HD23 LEU A 128 -13.212 -11.003 0.879 1.00 0.00 H new ATOM 2002 N GLU A 129 -13.051 -15.534 -1.258 1.00 0.00 N ATOM 2003 CA GLU A 129 -13.142 -16.986 -1.298 1.00 0.00 C ATOM 2004 C GLU A 129 -11.788 -17.645 -1.022 1.00 0.00 C ATOM 2005 O GLU A 129 -11.253 -17.518 0.081 1.00 0.00 O ATOM 2006 CB GLU A 129 -13.717 -17.462 -2.636 1.00 0.00 C ATOM 2007 CG GLU A 129 -15.172 -17.072 -2.847 1.00 0.00 C ATOM 2008 CD GLU A 129 -15.769 -17.694 -4.093 1.00 0.00 C ATOM 2009 OE1 GLU A 129 -15.961 -18.930 -4.106 1.00 0.00 O ATOM 2010 OE2 GLU A 129 -16.055 -16.956 -5.054 1.00 0.00 O ATOM 0 H GLU A 129 -12.362 -15.132 -1.894 1.00 0.00 H new ATOM 0 HA GLU A 129 -13.824 -17.292 -0.504 1.00 0.00 H new ATOM 0 HB2 GLU A 129 -13.118 -17.049 -3.447 1.00 0.00 H new ATOM 0 HB3 GLU A 129 -13.628 -18.547 -2.695 1.00 0.00 H new ATOM 0 HG2 GLU A 129 -15.755 -17.377 -1.978 1.00 0.00 H new ATOM 0 HG3 GLU A 129 -15.247 -15.987 -2.916 1.00 0.00 H new ATOM 2017 N HIS A 130 -11.242 -18.338 -2.032 1.00 0.00 N ATOM 2018 CA HIS A 130 -10.023 -19.155 -1.899 1.00 0.00 C ATOM 2019 C HIS A 130 -10.298 -20.383 -1.025 1.00 0.00 C ATOM 2020 O HIS A 130 -10.001 -21.514 -1.408 1.00 0.00 O ATOM 2021 CB HIS A 130 -8.845 -18.345 -1.337 1.00 0.00 C ATOM 2022 CG HIS A 130 -7.500 -18.918 -1.685 1.00 0.00 C ATOM 2023 ND1 HIS A 130 -6.832 -19.829 -0.893 1.00 0.00 N ATOM 2024 CD2 HIS A 130 -6.693 -18.693 -2.751 1.00 0.00 C ATOM 2025 CE1 HIS A 130 -5.677 -20.136 -1.457 1.00 0.00 C ATOM 2026 NE2 HIS A 130 -5.569 -19.462 -2.584 1.00 0.00 N ATOM 0 H HIS A 130 -11.636 -18.348 -2.973 1.00 0.00 H new ATOM 0 HA HIS A 130 -9.740 -19.486 -2.898 1.00 0.00 H new ATOM 0 HB2 HIS A 130 -8.904 -17.324 -1.714 1.00 0.00 H new ATOM 0 HB3 HIS A 130 -8.937 -18.290 -0.252 1.00 0.00 H new ATOM 0 HD2 HIS A 130 -6.897 -18.030 -3.579 1.00 0.00 H new ATOM 0 HE1 HIS A 130 -4.945 -20.824 -1.061 1.00 0.00 H new ATOM 0 HE2 HIS A 130 -4.779 -19.505 -3.227 1.00 0.00 H new ATOM 2035 N HIS A 131 -10.858 -20.147 0.151 1.00 0.00 N ATOM 2036 CA HIS A 131 -11.317 -21.212 1.027 1.00 0.00 C ATOM 2037 C HIS A 131 -12.638 -20.799 1.661 1.00 0.00 C ATOM 2038 O HIS A 131 -12.659 -20.092 2.668 1.00 0.00 O ATOM 2039 CB HIS A 131 -10.285 -21.519 2.117 1.00 0.00 C ATOM 2040 CG HIS A 131 -10.657 -22.682 2.988 1.00 0.00 C ATOM 2041 ND1 HIS A 131 -10.922 -22.564 4.335 1.00 0.00 N ATOM 2042 CD2 HIS A 131 -10.805 -23.993 2.693 1.00 0.00 C ATOM 2043 CE1 HIS A 131 -11.211 -23.753 4.830 1.00 0.00 C ATOM 2044 NE2 HIS A 131 -11.149 -24.638 3.855 1.00 0.00 N ATOM 0 H HIS A 131 -11.007 -19.210 0.525 1.00 0.00 H new ATOM 0 HA HIS A 131 -11.454 -22.117 0.435 1.00 0.00 H new ATOM 0 HB2 HIS A 131 -9.322 -21.721 1.647 1.00 0.00 H new ATOM 0 HB3 HIS A 131 -10.155 -20.635 2.742 1.00 0.00 H new ATOM 0 HD2 HIS A 131 -10.676 -24.449 1.722 1.00 0.00 H new ATOM 0 HE1 HIS A 131 -11.457 -23.965 5.860 1.00 0.00 H new ATOM 0 HE2 HIS A 131 -11.327 -25.638 3.949 1.00 0.00 H new ATOM 2053 N HIS A 132 -13.735 -21.218 1.054 1.00 0.00 N ATOM 2054 CA HIS A 132 -15.054 -20.855 1.549 1.00 0.00 C ATOM 2055 C HIS A 132 -15.749 -22.065 2.148 1.00 0.00 C ATOM 2056 O HIS A 132 -15.271 -23.191 2.022 1.00 0.00 O ATOM 2057 CB HIS A 132 -15.922 -20.240 0.430 1.00 0.00 C ATOM 2058 CG HIS A 132 -16.217 -21.158 -0.732 1.00 0.00 C ATOM 2059 ND1 HIS A 132 -15.962 -20.817 -2.044 1.00 0.00 N ATOM 2060 CD2 HIS A 132 -16.757 -22.403 -0.774 1.00 0.00 C ATOM 2061 CE1 HIS A 132 -16.333 -21.806 -2.836 1.00 0.00 C ATOM 2062 NE2 HIS A 132 -16.814 -22.778 -2.091 1.00 0.00 N ATOM 0 H HIS A 132 -13.740 -21.807 0.221 1.00 0.00 H new ATOM 0 HA HIS A 132 -14.923 -20.103 2.327 1.00 0.00 H new ATOM 0 HB2 HIS A 132 -16.867 -19.913 0.863 1.00 0.00 H new ATOM 0 HB3 HIS A 132 -15.420 -19.350 0.051 1.00 0.00 H new ATOM 0 HD1 HIS A 132 -15.550 -19.937 -2.354 1.00 0.00 H new ATOM 0 HD2 HIS A 132 -17.081 -22.989 0.073 1.00 0.00 H new ATOM 0 HE1 HIS A 132 -16.255 -21.816 -3.913 1.00 0.00 H new ATOM 2071 N HIS A 133 -16.867 -21.825 2.806 1.00 0.00 N ATOM 2072 CA HIS A 133 -17.707 -22.901 3.303 1.00 0.00 C ATOM 2073 C HIS A 133 -18.971 -22.974 2.460 1.00 0.00 C ATOM 2074 O HIS A 133 -19.253 -22.068 1.674 1.00 0.00 O ATOM 2075 CB HIS A 133 -18.088 -22.679 4.772 1.00 0.00 C ATOM 2076 CG HIS A 133 -16.926 -22.622 5.721 1.00 0.00 C ATOM 2077 ND1 HIS A 133 -17.049 -22.206 7.027 1.00 0.00 N ATOM 2078 CD2 HIS A 133 -15.616 -22.931 5.554 1.00 0.00 C ATOM 2079 CE1 HIS A 133 -15.873 -22.257 7.620 1.00 0.00 C ATOM 2080 NE2 HIS A 133 -14.985 -22.695 6.750 1.00 0.00 N ATOM 0 H HIS A 133 -17.217 -20.889 3.010 1.00 0.00 H new ATOM 0 HA HIS A 133 -17.148 -23.834 3.235 1.00 0.00 H new ATOM 0 HB2 HIS A 133 -18.649 -21.748 4.851 1.00 0.00 H new ATOM 0 HB3 HIS A 133 -18.756 -23.482 5.085 1.00 0.00 H new ATOM 0 HD2 HIS A 133 -15.155 -23.295 4.648 1.00 0.00 H new ATOM 0 HE1 HIS A 133 -15.671 -21.986 8.646 1.00 0.00 H new ATOM 0 HE2 HIS A 133 -13.992 -22.836 6.935 1.00 0.00 H new ATOM 2089 N HIS A 134 -19.719 -24.049 2.612 1.00 0.00 N ATOM 2090 CA HIS A 134 -21.008 -24.173 1.959 1.00 0.00 C ATOM 2091 C HIS A 134 -22.096 -23.736 2.929 1.00 0.00 C ATOM 2092 O HIS A 134 -22.744 -22.709 2.728 1.00 0.00 O ATOM 2093 CB HIS A 134 -21.241 -25.615 1.500 1.00 0.00 C ATOM 2094 CG HIS A 134 -22.556 -25.831 0.813 1.00 0.00 C ATOM 2095 ND1 HIS A 134 -23.631 -26.431 1.430 1.00 0.00 N ATOM 2096 CD2 HIS A 134 -22.964 -25.535 -0.445 1.00 0.00 C ATOM 2097 CE1 HIS A 134 -24.643 -26.494 0.583 1.00 0.00 C ATOM 2098 NE2 HIS A 134 -24.267 -25.957 -0.564 1.00 0.00 N ATOM 0 H HIS A 134 -19.456 -24.852 3.184 1.00 0.00 H new ATOM 0 HA HIS A 134 -21.032 -23.535 1.076 1.00 0.00 H new ATOM 0 HB2 HIS A 134 -20.437 -25.904 0.823 1.00 0.00 H new ATOM 0 HB3 HIS A 134 -21.182 -26.275 2.365 1.00 0.00 H new ATOM 0 HD2 HIS A 134 -22.374 -25.056 -1.213 1.00 0.00 H new ATOM 0 HE1 HIS A 134 -25.615 -26.914 0.793 1.00 0.00 H new ATOM 0 HE2 HIS A 134 -24.847 -25.870 -1.399 1.00 0.00 H new ATOM 2107 N HIS A 135 -22.260 -24.520 3.988 1.00 0.00 N ATOM 2108 CA HIS A 135 -23.207 -24.226 5.057 1.00 0.00 C ATOM 2109 C HIS A 135 -23.191 -25.369 6.062 1.00 0.00 C ATOM 2110 O HIS A 135 -23.986 -26.318 5.895 1.00 0.00 O ATOM 2111 CB HIS A 135 -24.631 -24.030 4.518 1.00 0.00 C ATOM 2112 CG HIS A 135 -25.609 -23.600 5.569 1.00 0.00 C ATOM 2113 ND1 HIS A 135 -26.699 -24.357 5.938 1.00 0.00 N ATOM 2114 CD2 HIS A 135 -25.656 -22.482 6.331 1.00 0.00 C ATOM 2115 CE1 HIS A 135 -27.372 -23.725 6.880 1.00 0.00 C ATOM 2116 NE2 HIS A 135 -26.760 -22.586 7.137 1.00 0.00 N ATOM 2117 OXT HIS A 135 -22.362 -25.336 6.987 1.00 0.00 O ATOM 0 H HIS A 135 -21.736 -25.384 4.130 1.00 0.00 H new ATOM 0 HA HIS A 135 -22.905 -23.295 5.536 1.00 0.00 H new ATOM 0 HB2 HIS A 135 -24.612 -23.285 3.723 1.00 0.00 H new ATOM 0 HB3 HIS A 135 -24.975 -24.963 4.072 1.00 0.00 H new ATOM 0 HD2 HIS A 135 -24.954 -21.661 6.308 1.00 0.00 H new ATOM 0 HE1 HIS A 135 -28.272 -24.080 7.360 1.00 0.00 H new ATOM 0 HE2 HIS A 135 -27.059 -21.894 7.824 1.00 0.00 H new TER 2126 HIS A 135