USER MOD reduce.3.24.130724 H: found=0, std=0, add=823, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 822 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 Single : A 1 MET CE :methyl 166:sc= -0.458 (180deg=-1.48!) USER MOD Single : A 1 MET N :NH3+ 145:sc= 0.0321 (180deg=-0.0204) USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 ASN :FLIP amide:sc= -1.55 F(o=-5.1!,f=-1.6) USER MOD Single : A 13 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.0543) USER MOD Single : A 16 SER OG : rot -80:sc= -0.873 USER MOD Single : A 17 TYR OH : rot 180:sc= -0.419 USER MOD Single : A 22 LYS NZ :NH3+ -159:sc= 1.08 (180deg=0.766) USER MOD Single : A 23 MET CE :methyl 154:sc= -1.11 (180deg=-2.42) USER MOD Single : A 26 THR OG1 : rot 180:sc= 0 USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 34 MET CE :methyl 170:sc= -0.186 (180deg=-0.285) USER MOD Single : A 37 TYR OH : rot 180:sc=-0.000363 USER MOD Single : A 41 ASN : amide:sc= 0.979 K(o=0.98,f=0) USER MOD Single : A 47 LYS NZ :NH3+ 170:sc= -0.0314 (180deg=-0.172) USER MOD Single : A 48 GLN :FLIP amide:sc= -1.99! C(o=-3.5!,f=-2!) USER MOD Single : A 49 THR OG1 : rot -37:sc= 0.749 USER MOD Single : B 101 MET CE :methyl 170:sc= -0.0622 (180deg=-0.323) USER MOD Single : B 103 SER OG : rot 180:sc= 0 USER MOD Single : B 105 ASN : amide:sc= -2.1 K(o=-2.1,f=-4.2!) USER MOD Single : B 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 116 SER OG : rot -84:sc= 0.735 USER MOD Single : B 117 TYR OH : rot 180:sc= -0.0712 USER MOD Single : B 122 LYS NZ :NH3+ -154:sc= -1.62! (180deg=-3.23!) USER MOD Single : B 123 MET CE :methyl -170:sc= -5.16! (180deg=-5.56!) USER MOD Single : B 126 THR OG1 : rot 180:sc= 0 USER MOD Single : B 128 SER OG : rot 180:sc= 0 USER MOD Single : B 134 MET CE :methyl 153:sc= -0.247 (180deg=-0.517) USER MOD Single : B 137 TYR OH : rot 180:sc= 0 USER MOD Single : B 141 ASN : amide:sc= 1.02 K(o=1,f=0) USER MOD Single : B 147 LYS NZ :NH3+ 136:sc= -0.136 (180deg=-4.86!) USER MOD Single : B 148 GLN :FLIP amide:sc= -0.116 F(o=-2.2,f=-0.12) USER MOD Single : B 149 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -2.714 13.259 11.500 1.00 0.00 N ATOM 2 CA MET A 1 -2.553 11.902 10.937 1.00 0.00 C ATOM 3 C MET A 1 -2.988 10.834 11.928 1.00 0.00 C ATOM 4 O MET A 1 -3.314 11.145 13.070 1.00 0.00 O ATOM 5 CB MET A 1 -1.110 11.641 10.491 1.00 0.00 C ATOM 6 CG MET A 1 -0.019 11.958 11.503 1.00 0.00 C ATOM 7 SD MET A 1 1.618 11.594 10.855 1.00 0.00 S ATOM 8 CE MET A 1 1.502 12.324 9.208 1.00 0.00 C ATOM 0 H1 MET A 1 -1.948 13.871 11.155 1.00 0.00 H new ATOM 0 H2 MET A 1 -3.631 13.651 11.204 1.00 0.00 H new ATOM 0 H3 MET A 1 -2.677 13.211 12.538 1.00 0.00 H new ATOM 0 HA MET A 1 -3.199 11.848 10.061 1.00 0.00 H new ATOM 0 HB2 MET A 1 -1.023 10.590 10.214 1.00 0.00 H new ATOM 0 HB3 MET A 1 -0.920 12.225 9.590 1.00 0.00 H new ATOM 0 HG2 MET A 1 -0.075 13.011 11.780 1.00 0.00 H new ATOM 0 HG3 MET A 1 -0.187 11.380 12.412 1.00 0.00 H new ATOM 0 HE1 MET A 1 2.499 12.404 8.775 1.00 0.00 H new ATOM 0 HE2 MET A 1 0.880 11.693 8.573 1.00 0.00 H new ATOM 0 HE3 MET A 1 1.057 13.316 9.280 1.00 0.00 H new ATOM 18 N GLY A 2 -3.006 9.595 11.471 1.00 0.00 N ATOM 19 CA GLY A 2 -3.359 8.481 12.310 1.00 0.00 C ATOM 20 C GLY A 2 -2.527 7.259 11.995 1.00 0.00 C ATOM 21 O GLY A 2 -2.006 7.123 10.881 1.00 0.00 O ATOM 0 H GLY A 2 -2.776 9.341 10.510 1.00 0.00 H new ATOM 0 HA2 GLY A 2 -3.222 8.755 13.356 1.00 0.00 H new ATOM 0 HA3 GLY A 2 -4.415 8.246 12.178 1.00 0.00 H new ATOM 25 N SER A 3 -2.401 6.366 12.964 1.00 0.00 N ATOM 26 CA SER A 3 -1.618 5.148 12.807 1.00 0.00 C ATOM 27 C SER A 3 -2.511 3.921 12.667 1.00 0.00 C ATOM 28 O SER A 3 -3.593 3.858 13.253 1.00 0.00 O ATOM 29 CB SER A 3 -0.658 4.985 14.000 1.00 0.00 C ATOM 30 OG SER A 3 -1.366 5.068 15.223 1.00 0.00 O ATOM 0 H SER A 3 -2.838 6.464 13.881 1.00 0.00 H new ATOM 0 HA SER A 3 -1.037 5.235 11.889 1.00 0.00 H new ATOM 0 HB2 SER A 3 -0.147 4.025 13.934 1.00 0.00 H new ATOM 0 HB3 SER A 3 0.110 5.758 13.965 1.00 0.00 H new ATOM 0 HG SER A 3 -0.741 4.961 15.971 1.00 0.00 H new ATOM 36 N ILE A 4 -2.060 2.974 11.861 1.00 0.00 N ATOM 37 CA ILE A 4 -2.740 1.689 11.676 1.00 0.00 C ATOM 38 C ILE A 4 -1.763 0.549 11.828 1.00 0.00 C ATOM 39 O ILE A 4 -0.556 0.728 11.636 1.00 0.00 O ATOM 40 CB ILE A 4 -3.443 1.608 10.294 1.00 0.00 C ATOM 41 CG1 ILE A 4 -2.420 1.609 9.128 1.00 0.00 C ATOM 42 CG2 ILE A 4 -4.446 2.747 10.135 1.00 0.00 C ATOM 43 CD1 ILE A 4 -2.033 0.230 8.615 1.00 0.00 C ATOM 0 H ILE A 4 -1.207 3.069 11.310 1.00 0.00 H new ATOM 0 HA ILE A 4 -3.506 1.609 12.447 1.00 0.00 H new ATOM 0 HB ILE A 4 -3.982 0.661 10.253 1.00 0.00 H new ATOM 0 HG12 ILE A 4 -2.834 2.185 8.301 1.00 0.00 H new ATOM 0 HG13 ILE A 4 -1.518 2.125 9.456 1.00 0.00 H new ATOM 0 HG21 ILE A 4 -4.929 2.673 9.160 1.00 0.00 H new ATOM 0 HG22 ILE A 4 -5.200 2.680 10.919 1.00 0.00 H new ATOM 0 HG23 ILE A 4 -3.927 3.702 10.212 1.00 0.00 H new ATOM 0 HD11 ILE A 4 -1.315 0.333 7.802 1.00 0.00 H new ATOM 0 HD12 ILE A 4 -1.585 -0.347 9.424 1.00 0.00 H new ATOM 0 HD13 ILE A 4 -2.922 -0.285 8.251 1.00 0.00 H new ATOM 55 N ASN A 5 -2.279 -0.632 12.173 1.00 0.00 N ATOM 56 CA ASN A 5 -1.484 -1.842 12.242 1.00 0.00 C ATOM 57 C ASN A 5 -1.587 -2.612 10.932 1.00 0.00 C ATOM 58 O ASN A 5 -2.672 -2.909 10.447 1.00 0.00 O ATOM 59 CB ASN A 5 -1.939 -2.706 13.432 1.00 0.00 C ATOM 60 CG ASN A 5 -1.520 -4.163 13.335 1.00 0.00 C ATOM 61 OD1 ASN A 5 -0.364 -4.445 12.755 1.00 0.00 O flip ATOM 62 ND2 ASN A 5 -2.239 -5.059 13.792 1.00 0.00 N flip ATOM 0 H ASN A 5 -3.261 -0.768 12.411 1.00 0.00 H new ATOM 0 HA ASN A 5 -0.438 -1.576 12.396 1.00 0.00 H new ATOM 0 HB2 ASN A 5 -1.533 -2.283 14.351 1.00 0.00 H new ATOM 0 HB3 ASN A 5 -3.025 -2.656 13.510 1.00 0.00 H new ATOM 0 HD21 ASN A 5 -3.127 -4.824 14.236 1.00 0.00 H new ATOM 0 HD22 ASN A 5 -1.944 -6.033 13.725 1.00 0.00 H new ATOM 69 N LEU A 6 -0.433 -2.913 10.363 1.00 0.00 N ATOM 70 CA LEU A 6 -0.328 -3.679 9.138 1.00 0.00 C ATOM 71 C LEU A 6 0.374 -4.998 9.463 1.00 0.00 C ATOM 72 O LEU A 6 1.229 -5.021 10.344 1.00 0.00 O ATOM 73 CB LEU A 6 0.437 -2.827 8.094 1.00 0.00 C ATOM 74 CG LEU A 6 0.654 -3.421 6.702 1.00 0.00 C ATOM 75 CD1 LEU A 6 1.833 -4.385 6.684 1.00 0.00 C ATOM 76 CD2 LEU A 6 -0.620 -4.094 6.219 1.00 0.00 C ATOM 0 H LEU A 6 0.468 -2.627 10.746 1.00 0.00 H new ATOM 0 HA LEU A 6 -1.303 -3.918 8.712 1.00 0.00 H new ATOM 0 HB2 LEU A 6 -0.098 -1.885 7.975 1.00 0.00 H new ATOM 0 HB3 LEU A 6 1.415 -2.587 8.511 1.00 0.00 H new ATOM 0 HG LEU A 6 0.897 -2.609 6.016 1.00 0.00 H new ATOM 0 HD11 LEU A 6 1.958 -4.788 5.679 1.00 0.00 H new ATOM 0 HD12 LEU A 6 2.740 -3.856 6.978 1.00 0.00 H new ATOM 0 HD13 LEU A 6 1.646 -5.201 7.382 1.00 0.00 H new ATOM 0 HD21 LEU A 6 -0.456 -4.514 5.227 1.00 0.00 H new ATOM 0 HD22 LEU A 6 -0.895 -4.891 6.910 1.00 0.00 H new ATOM 0 HD23 LEU A 6 -1.425 -3.360 6.174 1.00 0.00 H new ATOM 88 N ARG A 7 0.000 -6.104 8.811 1.00 0.00 N ATOM 89 CA ARG A 7 0.547 -7.412 9.138 1.00 0.00 C ATOM 90 C ARG A 7 0.843 -8.139 7.831 1.00 0.00 C ATOM 91 O ARG A 7 -0.061 -8.323 7.017 1.00 0.00 O ATOM 92 CB ARG A 7 -0.435 -8.253 9.956 1.00 0.00 C ATOM 93 CG ARG A 7 -0.492 -7.911 11.433 1.00 0.00 C ATOM 94 CD ARG A 7 -1.259 -8.980 12.198 1.00 0.00 C ATOM 95 NE ARG A 7 -2.645 -9.096 11.746 1.00 0.00 N ATOM 96 CZ ARG A 7 -3.713 -9.096 12.543 1.00 0.00 C ATOM 97 NH1 ARG A 7 -3.574 -8.989 13.866 1.00 0.00 N ATOM 98 NH2 ARG A 7 -4.919 -9.238 12.021 1.00 0.00 N ATOM 0 H ARG A 7 -0.682 -6.112 8.052 1.00 0.00 H new ATOM 0 HA ARG A 7 1.447 -7.273 9.736 1.00 0.00 H new ATOM 0 HB2 ARG A 7 -1.432 -8.136 9.532 1.00 0.00 H new ATOM 0 HB3 ARG A 7 -0.166 -9.304 9.851 1.00 0.00 H new ATOM 0 HG2 ARG A 7 0.519 -7.825 11.832 1.00 0.00 H new ATOM 0 HG3 ARG A 7 -0.972 -6.942 11.570 1.00 0.00 H new ATOM 0 HD2 ARG A 7 -0.758 -9.940 12.078 1.00 0.00 H new ATOM 0 HD3 ARG A 7 -1.244 -8.744 13.262 1.00 0.00 H new ATOM 0 HE ARG A 7 -2.807 -9.184 10.743 1.00 0.00 H new ATOM 0 HH11 ARG A 7 -2.644 -8.906 14.276 1.00 0.00 H new ATOM 0 HH12 ARG A 7 -4.398 -8.990 14.467 1.00 0.00 H new ATOM 0 HH21 ARG A 7 -5.029 -9.347 11.013 1.00 0.00 H new ATOM 0 HH22 ARG A 7 -5.740 -9.239 12.626 1.00 0.00 H new ATOM 112 N ILE A 8 2.082 -8.534 7.613 1.00 0.00 N ATOM 113 CA ILE A 8 2.452 -9.285 6.417 1.00 0.00 C ATOM 114 C ILE A 8 3.467 -10.341 6.761 1.00 0.00 C ATOM 115 O ILE A 8 4.008 -10.375 7.878 1.00 0.00 O ATOM 116 CB ILE A 8 3.027 -8.421 5.265 1.00 0.00 C ATOM 117 CG1 ILE A 8 4.446 -7.906 5.610 1.00 0.00 C ATOM 118 CG2 ILE A 8 2.082 -7.271 4.887 1.00 0.00 C ATOM 119 CD1 ILE A 8 4.506 -6.975 6.803 1.00 0.00 C ATOM 0 H ILE A 8 2.857 -8.349 8.249 1.00 0.00 H new ATOM 0 HA ILE A 8 1.519 -9.720 6.058 1.00 0.00 H new ATOM 0 HB ILE A 8 3.112 -9.061 4.387 1.00 0.00 H new ATOM 0 HG12 ILE A 8 5.093 -8.762 5.801 1.00 0.00 H new ATOM 0 HG13 ILE A 8 4.852 -7.388 4.741 1.00 0.00 H new ATOM 0 HG21 ILE A 8 2.522 -6.690 4.076 1.00 0.00 H new ATOM 0 HG22 ILE A 8 1.124 -7.679 4.563 1.00 0.00 H new ATOM 0 HG23 ILE A 8 1.928 -6.627 5.753 1.00 0.00 H new ATOM 0 HD11 ILE A 8 5.537 -6.665 6.971 1.00 0.00 H new ATOM 0 HD12 ILE A 8 3.890 -6.097 6.611 1.00 0.00 H new ATOM 0 HD13 ILE A 8 4.134 -7.492 7.687 1.00 0.00 H new ATOM 131 N ASP A 9 3.736 -11.207 5.801 1.00 0.00 N ATOM 132 CA ASP A 9 4.774 -12.204 5.915 1.00 0.00 C ATOM 133 C ASP A 9 6.098 -11.512 6.245 1.00 0.00 C ATOM 134 O ASP A 9 6.611 -10.745 5.446 1.00 0.00 O ATOM 135 CB ASP A 9 4.880 -12.960 4.592 1.00 0.00 C ATOM 136 CG ASP A 9 3.565 -13.617 4.186 1.00 0.00 C ATOM 137 OD1 ASP A 9 2.599 -12.887 3.843 1.00 0.00 O ATOM 138 OD2 ASP A 9 3.482 -14.860 4.192 1.00 0.00 O ATOM 0 H ASP A 9 3.233 -11.235 4.914 1.00 0.00 H new ATOM 0 HA ASP A 9 4.539 -12.911 6.711 1.00 0.00 H new ATOM 0 HB2 ASP A 9 5.195 -12.271 3.808 1.00 0.00 H new ATOM 0 HB3 ASP A 9 5.653 -13.724 4.675 1.00 0.00 H new ATOM 143 N ASP A 10 6.624 -11.786 7.429 1.00 0.00 N ATOM 144 CA ASP A 10 7.825 -11.120 7.913 1.00 0.00 C ATOM 145 C ASP A 10 9.002 -11.268 6.956 1.00 0.00 C ATOM 146 O ASP A 10 9.915 -10.440 6.921 1.00 0.00 O ATOM 147 CB ASP A 10 8.202 -11.664 9.313 1.00 0.00 C ATOM 148 CG ASP A 10 8.217 -13.187 9.376 1.00 0.00 C ATOM 149 OD1 ASP A 10 7.133 -13.794 9.478 1.00 0.00 O ATOM 150 OD2 ASP A 10 9.317 -13.783 9.337 1.00 0.00 O ATOM 0 H ASP A 10 6.235 -12.470 8.077 1.00 0.00 H new ATOM 0 HA ASP A 10 7.601 -10.055 7.979 1.00 0.00 H new ATOM 0 HB2 ASP A 10 9.185 -11.285 9.591 1.00 0.00 H new ATOM 0 HB3 ASP A 10 7.493 -11.282 10.048 1.00 0.00 H new ATOM 155 N GLU A 11 8.989 -12.345 6.171 1.00 0.00 N ATOM 156 CA GLU A 11 10.007 -12.566 5.148 1.00 0.00 C ATOM 157 C GLU A 11 9.908 -11.509 4.040 1.00 0.00 C ATOM 158 O GLU A 11 10.919 -10.991 3.561 1.00 0.00 O ATOM 159 CB GLU A 11 9.879 -13.976 4.547 1.00 0.00 C ATOM 160 CG GLU A 11 8.532 -14.228 3.859 1.00 0.00 C ATOM 161 CD GLU A 11 8.336 -15.685 3.454 1.00 0.00 C ATOM 162 OE1 GLU A 11 7.868 -16.475 4.292 1.00 0.00 O ATOM 163 OE2 GLU A 11 8.703 -16.036 2.311 1.00 0.00 O ATOM 0 H GLU A 11 8.282 -13.079 6.225 1.00 0.00 H new ATOM 0 HA GLU A 11 10.983 -12.478 5.624 1.00 0.00 H new ATOM 0 HB2 GLU A 11 10.681 -14.129 3.825 1.00 0.00 H new ATOM 0 HB3 GLU A 11 10.018 -14.713 5.338 1.00 0.00 H new ATOM 0 HG2 GLU A 11 7.726 -13.931 4.530 1.00 0.00 H new ATOM 0 HG3 GLU A 11 8.458 -13.597 2.973 1.00 0.00 H new ATOM 170 N LEU A 12 8.675 -11.161 3.699 1.00 0.00 N ATOM 171 CA LEU A 12 8.414 -10.199 2.623 1.00 0.00 C ATOM 172 C LEU A 12 8.712 -8.798 3.151 1.00 0.00 C ATOM 173 O LEU A 12 9.257 -7.957 2.434 1.00 0.00 O ATOM 174 CB LEU A 12 6.959 -10.292 2.195 1.00 0.00 C ATOM 175 CG LEU A 12 6.549 -9.308 1.075 1.00 0.00 C ATOM 176 CD1 LEU A 12 7.220 -9.700 -0.241 1.00 0.00 C ATOM 177 CD2 LEU A 12 5.038 -9.260 0.933 1.00 0.00 C ATOM 0 H LEU A 12 7.836 -11.527 4.148 1.00 0.00 H new ATOM 0 HA LEU A 12 9.045 -10.416 1.761 1.00 0.00 H new ATOM 0 HB2 LEU A 12 6.758 -11.309 1.857 1.00 0.00 H new ATOM 0 HB3 LEU A 12 6.327 -10.114 3.065 1.00 0.00 H new ATOM 0 HG LEU A 12 6.887 -8.307 1.343 1.00 0.00 H new ATOM 0 HD11 LEU A 12 6.924 -9.000 -1.023 1.00 0.00 H new ATOM 0 HD12 LEU A 12 8.303 -9.672 -0.120 1.00 0.00 H new ATOM 0 HD13 LEU A 12 6.912 -10.708 -0.520 1.00 0.00 H new ATOM 0 HD21 LEU A 12 4.769 -8.562 0.140 1.00 0.00 H new ATOM 0 HD22 LEU A 12 4.664 -10.253 0.684 1.00 0.00 H new ATOM 0 HD23 LEU A 12 4.595 -8.930 1.872 1.00 0.00 H new ATOM 189 N LYS A 13 8.331 -8.579 4.401 1.00 0.00 N ATOM 190 CA LYS A 13 8.600 -7.334 5.104 1.00 0.00 C ATOM 191 C LYS A 13 10.075 -6.955 4.999 1.00 0.00 C ATOM 192 O LYS A 13 10.421 -5.813 4.717 1.00 0.00 O ATOM 193 CB LYS A 13 8.165 -7.488 6.575 1.00 0.00 C ATOM 194 CG LYS A 13 8.539 -6.329 7.499 1.00 0.00 C ATOM 195 CD LYS A 13 9.898 -6.518 8.174 1.00 0.00 C ATOM 196 CE LYS A 13 10.173 -5.438 9.207 1.00 0.00 C ATOM 197 NZ LYS A 13 9.326 -5.589 10.420 1.00 0.00 N ATOM 0 H LYS A 13 7.823 -9.265 4.959 1.00 0.00 H new ATOM 0 HA LYS A 13 8.030 -6.526 4.645 1.00 0.00 H new ATOM 0 HB2 LYS A 13 7.083 -7.617 6.604 1.00 0.00 H new ATOM 0 HB3 LYS A 13 8.606 -8.402 6.972 1.00 0.00 H new ATOM 0 HG2 LYS A 13 8.550 -5.403 6.925 1.00 0.00 H new ATOM 0 HG3 LYS A 13 7.771 -6.220 8.265 1.00 0.00 H new ATOM 0 HD2 LYS A 13 9.932 -7.496 8.654 1.00 0.00 H new ATOM 0 HD3 LYS A 13 10.683 -6.506 7.418 1.00 0.00 H new ATOM 0 HE2 LYS A 13 11.224 -5.472 9.494 1.00 0.00 H new ATOM 0 HE3 LYS A 13 9.995 -4.459 8.762 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 9.662 -4.941 11.161 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 8.339 -5.363 10.184 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 9.384 -6.569 10.765 1.00 0.00 H new ATOM 211 N ALA A 14 10.939 -7.947 5.230 1.00 0.00 N ATOM 212 CA ALA A 14 12.378 -7.733 5.209 1.00 0.00 C ATOM 213 C ALA A 14 12.859 -7.179 3.864 1.00 0.00 C ATOM 214 O ALA A 14 13.600 -6.199 3.815 1.00 0.00 O ATOM 215 CB ALA A 14 13.095 -9.033 5.534 1.00 0.00 C ATOM 0 H ALA A 14 10.660 -8.907 5.434 1.00 0.00 H new ATOM 0 HA ALA A 14 12.615 -6.986 5.966 1.00 0.00 H new ATOM 0 HB1 ALA A 14 14.172 -8.868 5.517 1.00 0.00 H new ATOM 0 HB2 ALA A 14 12.796 -9.376 6.524 1.00 0.00 H new ATOM 0 HB3 ALA A 14 12.832 -9.789 4.794 1.00 0.00 H new ATOM 221 N ARG A 15 12.410 -7.794 2.771 1.00 0.00 N ATOM 222 CA ARG A 15 12.860 -7.392 1.433 1.00 0.00 C ATOM 223 C ARG A 15 12.272 -6.048 1.000 1.00 0.00 C ATOM 224 O ARG A 15 12.950 -5.238 0.379 1.00 0.00 O ATOM 225 CB ARG A 15 12.527 -8.456 0.375 1.00 0.00 C ATOM 226 CG ARG A 15 13.397 -9.712 0.425 1.00 0.00 C ATOM 227 CD ARG A 15 13.144 -10.550 1.669 1.00 0.00 C ATOM 228 NE ARG A 15 13.966 -11.750 1.696 1.00 0.00 N ATOM 229 CZ ARG A 15 13.523 -12.966 2.021 1.00 0.00 C ATOM 230 NH1 ARG A 15 12.237 -13.158 2.298 1.00 0.00 N ATOM 231 NH2 ARG A 15 14.362 -13.993 2.021 1.00 0.00 N ATOM 0 H ARG A 15 11.742 -8.565 2.781 1.00 0.00 H new ATOM 0 HA ARG A 15 13.943 -7.288 1.504 1.00 0.00 H new ATOM 0 HB2 ARG A 15 11.484 -8.750 0.493 1.00 0.00 H new ATOM 0 HB3 ARG A 15 12.622 -8.006 -0.613 1.00 0.00 H new ATOM 0 HG2 ARG A 15 13.206 -10.317 -0.461 1.00 0.00 H new ATOM 0 HG3 ARG A 15 14.448 -9.423 0.393 1.00 0.00 H new ATOM 0 HD2 ARG A 15 13.348 -9.951 2.557 1.00 0.00 H new ATOM 0 HD3 ARG A 15 12.092 -10.831 1.709 1.00 0.00 H new ATOM 0 HE ARG A 15 14.951 -11.655 1.449 1.00 0.00 H new ATOM 0 HH11 ARG A 15 11.585 -12.374 2.262 1.00 0.00 H new ATOM 0 HH12 ARG A 15 11.902 -14.089 2.546 1.00 0.00 H new ATOM 0 HH21 ARG A 15 15.341 -13.852 1.773 1.00 0.00 H new ATOM 0 HH22 ARG A 15 14.028 -14.924 2.269 1.00 0.00 H new ATOM 245 N SER A 16 11.008 -5.830 1.344 1.00 0.00 N ATOM 246 CA SER A 16 10.322 -4.594 1.008 1.00 0.00 C ATOM 247 C SER A 16 10.993 -3.400 1.694 1.00 0.00 C ATOM 248 O SER A 16 11.409 -2.448 1.046 1.00 0.00 O ATOM 249 CB SER A 16 8.849 -4.679 1.418 1.00 0.00 C ATOM 250 OG SER A 16 8.177 -3.466 1.161 1.00 0.00 O ATOM 0 H SER A 16 10.437 -6.500 1.859 1.00 0.00 H new ATOM 0 HA SER A 16 10.381 -4.450 -0.071 1.00 0.00 H new ATOM 0 HB2 SER A 16 8.364 -5.489 0.874 1.00 0.00 H new ATOM 0 HB3 SER A 16 8.777 -4.920 2.479 1.00 0.00 H new ATOM 0 HG SER A 16 8.371 -2.827 1.878 1.00 0.00 H new ATOM 256 N TYR A 17 11.091 -3.476 3.019 1.00 0.00 N ATOM 257 CA TYR A 17 11.731 -2.426 3.798 1.00 0.00 C ATOM 258 C TYR A 17 13.163 -2.204 3.340 1.00 0.00 C ATOM 259 O TYR A 17 13.629 -1.077 3.306 1.00 0.00 O ATOM 260 CB TYR A 17 11.678 -2.763 5.288 1.00 0.00 C ATOM 261 CG TYR A 17 10.346 -2.444 5.922 1.00 0.00 C ATOM 262 CD1 TYR A 17 9.158 -2.953 5.413 1.00 0.00 C ATOM 263 CD2 TYR A 17 10.272 -1.622 7.054 1.00 0.00 C ATOM 264 CE1 TYR A 17 7.937 -2.645 5.993 1.00 0.00 C ATOM 265 CE2 TYR A 17 9.061 -1.334 7.645 1.00 0.00 C ATOM 266 CZ TYR A 17 7.901 -1.842 7.105 1.00 0.00 C ATOM 267 OH TYR A 17 6.695 -1.541 7.674 1.00 0.00 O ATOM 0 H TYR A 17 10.735 -4.255 3.573 1.00 0.00 H new ATOM 0 HA TYR A 17 11.185 -1.497 3.637 1.00 0.00 H new ATOM 0 HB2 TYR A 17 11.892 -3.823 5.422 1.00 0.00 H new ATOM 0 HB3 TYR A 17 12.462 -2.211 5.807 1.00 0.00 H new ATOM 0 HD1 TYR A 17 9.186 -3.601 4.549 1.00 0.00 H new ATOM 0 HD2 TYR A 17 11.178 -1.208 7.470 1.00 0.00 H new ATOM 0 HE1 TYR A 17 7.021 -3.034 5.573 1.00 0.00 H new ATOM 0 HE2 TYR A 17 9.022 -0.713 8.528 1.00 0.00 H new ATOM 0 HH TYR A 17 6.836 -0.964 8.454 1.00 0.00 H new ATOM 277 N ALA A 18 13.841 -3.300 2.973 1.00 0.00 N ATOM 278 CA ALA A 18 15.192 -3.214 2.450 1.00 0.00 C ATOM 279 C ALA A 18 15.231 -2.362 1.195 1.00 0.00 C ATOM 280 O ALA A 18 16.082 -1.480 1.058 1.00 0.00 O ATOM 281 CB ALA A 18 15.748 -4.617 2.162 1.00 0.00 C ATOM 0 H ALA A 18 13.469 -4.248 3.032 1.00 0.00 H new ATOM 0 HA ALA A 18 15.819 -2.740 3.205 1.00 0.00 H new ATOM 0 HB1 ALA A 18 16.762 -4.533 1.770 1.00 0.00 H new ATOM 0 HB2 ALA A 18 15.762 -5.199 3.083 1.00 0.00 H new ATOM 0 HB3 ALA A 18 15.115 -5.115 1.427 1.00 0.00 H new ATOM 287 N ALA A 19 14.287 -2.598 0.311 1.00 0.00 N ATOM 288 CA ALA A 19 14.213 -1.894 -0.975 1.00 0.00 C ATOM 289 C ALA A 19 14.002 -0.390 -0.767 1.00 0.00 C ATOM 290 O ALA A 19 14.720 0.443 -1.331 1.00 0.00 O ATOM 291 CB ALA A 19 13.093 -2.463 -1.814 1.00 0.00 C ATOM 0 H ALA A 19 13.543 -3.281 0.452 1.00 0.00 H new ATOM 0 HA ALA A 19 15.160 -2.037 -1.496 1.00 0.00 H new ATOM 0 HB1 ALA A 19 13.047 -1.934 -2.766 1.00 0.00 H new ATOM 0 HB2 ALA A 19 13.277 -3.522 -1.996 1.00 0.00 H new ATOM 0 HB3 ALA A 19 12.147 -2.344 -1.286 1.00 0.00 H new ATOM 297 N LEU A 20 13.026 -0.055 0.050 1.00 0.00 N ATOM 298 CA LEU A 20 12.635 1.340 0.228 1.00 0.00 C ATOM 299 C LEU A 20 13.705 2.115 1.011 1.00 0.00 C ATOM 300 O LEU A 20 13.920 3.297 0.759 1.00 0.00 O ATOM 301 CB LEU A 20 11.241 1.443 0.893 1.00 0.00 C ATOM 302 CG LEU A 20 11.047 0.692 2.236 1.00 0.00 C ATOM 303 CD1 LEU A 20 11.615 1.498 3.408 1.00 0.00 C ATOM 304 CD2 LEU A 20 9.564 0.378 2.478 1.00 0.00 C ATOM 0 H LEU A 20 12.487 -0.722 0.602 1.00 0.00 H new ATOM 0 HA LEU A 20 12.558 1.803 -0.756 1.00 0.00 H new ATOM 0 HB2 LEU A 20 11.022 2.498 1.059 1.00 0.00 H new ATOM 0 HB3 LEU A 20 10.500 1.071 0.186 1.00 0.00 H new ATOM 0 HG LEU A 20 11.595 -0.248 2.170 1.00 0.00 H new ATOM 0 HD11 LEU A 20 11.464 0.946 4.336 1.00 0.00 H new ATOM 0 HD12 LEU A 20 12.681 1.663 3.253 1.00 0.00 H new ATOM 0 HD13 LEU A 20 11.104 2.459 3.470 1.00 0.00 H new ATOM 0 HD21 LEU A 20 9.454 -0.149 3.426 1.00 0.00 H new ATOM 0 HD22 LEU A 20 8.996 1.308 2.511 1.00 0.00 H new ATOM 0 HD23 LEU A 20 9.188 -0.248 1.669 1.00 0.00 H new ATOM 316 N GLU A 21 14.413 1.447 1.921 1.00 0.00 N ATOM 317 CA GLU A 21 15.488 2.104 2.669 1.00 0.00 C ATOM 318 C GLU A 21 16.718 2.252 1.779 1.00 0.00 C ATOM 319 O GLU A 21 17.586 3.097 2.037 1.00 0.00 O ATOM 320 CB GLU A 21 15.845 1.348 3.946 1.00 0.00 C ATOM 321 CG GLU A 21 16.402 -0.051 3.706 1.00 0.00 C ATOM 322 CD GLU A 21 17.168 -0.577 4.891 1.00 0.00 C ATOM 323 OE1 GLU A 21 16.548 -0.930 5.915 1.00 0.00 O ATOM 324 OE2 GLU A 21 18.420 -0.629 4.823 1.00 0.00 O ATOM 0 H GLU A 21 14.266 0.466 2.157 1.00 0.00 H new ATOM 0 HA GLU A 21 15.131 3.089 2.968 1.00 0.00 H new ATOM 0 HB2 GLU A 21 16.578 1.928 4.506 1.00 0.00 H new ATOM 0 HB3 GLU A 21 14.955 1.271 4.571 1.00 0.00 H new ATOM 0 HG2 GLU A 21 15.582 -0.731 3.477 1.00 0.00 H new ATOM 0 HG3 GLU A 21 17.055 -0.034 2.834 1.00 0.00 H new ATOM 331 N LYS A 22 16.794 1.452 0.719 1.00 0.00 N ATOM 332 CA LYS A 22 17.847 1.583 -0.287 1.00 0.00 C ATOM 333 C LYS A 22 17.647 2.906 -1.016 1.00 0.00 C ATOM 334 O LYS A 22 18.564 3.710 -1.182 1.00 0.00 O ATOM 335 CB LYS A 22 17.807 0.434 -1.306 1.00 0.00 C ATOM 336 CG LYS A 22 18.296 -0.903 -0.799 1.00 0.00 C ATOM 337 CD LYS A 22 17.994 -1.997 -1.819 1.00 0.00 C ATOM 338 CE LYS A 22 18.464 -3.374 -1.354 1.00 0.00 C ATOM 339 NZ LYS A 22 18.220 -4.404 -2.385 1.00 0.00 N ATOM 0 H LYS A 22 16.132 0.699 0.533 1.00 0.00 H new ATOM 0 HA LYS A 22 18.815 1.549 0.213 1.00 0.00 H new ATOM 0 HB2 LYS A 22 16.781 0.317 -1.656 1.00 0.00 H new ATOM 0 HB3 LYS A 22 18.408 0.717 -2.170 1.00 0.00 H new ATOM 0 HG2 LYS A 22 19.369 -0.858 -0.610 1.00 0.00 H new ATOM 0 HG3 LYS A 22 17.815 -1.138 0.150 1.00 0.00 H new ATOM 0 HD2 LYS A 22 16.921 -2.027 -2.008 1.00 0.00 H new ATOM 0 HD3 LYS A 22 18.477 -1.752 -2.765 1.00 0.00 H new ATOM 0 HE2 LYS A 22 19.528 -3.337 -1.119 1.00 0.00 H new ATOM 0 HE3 LYS A 22 17.944 -3.646 -0.435 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 18.207 -5.344 -1.940 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 17.304 -4.225 -2.844 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 18.977 -4.368 -3.097 1.00 0.00 H new ATOM 353 N MET A 23 16.412 3.134 -1.429 1.00 0.00 N ATOM 354 CA MET A 23 15.999 4.369 -2.064 1.00 0.00 C ATOM 355 C MET A 23 15.997 5.516 -1.049 1.00 0.00 C ATOM 356 O MET A 23 15.880 6.684 -1.394 1.00 0.00 O ATOM 357 CB MET A 23 14.600 4.204 -2.670 1.00 0.00 C ATOM 358 CG MET A 23 14.531 3.072 -3.702 1.00 0.00 C ATOM 359 SD MET A 23 12.844 2.485 -3.985 1.00 0.00 S ATOM 360 CE MET A 23 11.963 4.027 -4.226 1.00 0.00 C ATOM 0 H MET A 23 15.658 2.454 -1.330 1.00 0.00 H new ATOM 0 HA MET A 23 16.706 4.607 -2.858 1.00 0.00 H new ATOM 0 HB2 MET A 23 13.884 4.007 -1.872 1.00 0.00 H new ATOM 0 HB3 MET A 23 14.301 5.140 -3.143 1.00 0.00 H new ATOM 0 HG2 MET A 23 14.953 3.420 -4.645 1.00 0.00 H new ATOM 0 HG3 MET A 23 15.149 2.240 -3.364 1.00 0.00 H new ATOM 0 HE1 MET A 23 11.080 3.849 -4.839 1.00 0.00 H new ATOM 0 HE2 MET A 23 11.659 4.427 -3.259 1.00 0.00 H new ATOM 0 HE3 MET A 23 12.614 4.744 -4.727 1.00 0.00 H new ATOM 370 N GLY A 24 16.121 5.147 0.234 1.00 0.00 N ATOM 371 CA GLY A 24 16.195 6.124 1.309 1.00 0.00 C ATOM 372 C GLY A 24 14.859 6.756 1.641 1.00 0.00 C ATOM 373 O GLY A 24 14.793 7.870 2.166 1.00 0.00 O ATOM 0 H GLY A 24 16.171 4.177 0.544 1.00 0.00 H new ATOM 0 HA2 GLY A 24 16.592 5.641 2.202 1.00 0.00 H new ATOM 0 HA3 GLY A 24 16.900 6.907 1.030 1.00 0.00 H new ATOM 377 N VAL A 25 13.779 6.051 1.335 1.00 0.00 N ATOM 378 CA VAL A 25 12.439 6.531 1.622 1.00 0.00 C ATOM 379 C VAL A 25 11.887 5.911 2.907 1.00 0.00 C ATOM 380 O VAL A 25 12.197 4.751 3.207 1.00 0.00 O ATOM 381 CB VAL A 25 11.460 6.265 0.444 1.00 0.00 C ATOM 382 CG1 VAL A 25 11.340 4.775 0.153 1.00 0.00 C ATOM 383 CG2 VAL A 25 10.083 6.882 0.727 1.00 0.00 C ATOM 0 H VAL A 25 13.808 5.137 0.884 1.00 0.00 H new ATOM 0 HA VAL A 25 12.520 7.609 1.759 1.00 0.00 H new ATOM 0 HB VAL A 25 11.870 6.745 -0.445 1.00 0.00 H new ATOM 0 HG11 VAL A 25 10.649 4.621 -0.675 1.00 0.00 H new ATOM 0 HG12 VAL A 25 12.319 4.376 -0.112 1.00 0.00 H new ATOM 0 HG13 VAL A 25 10.966 4.260 1.038 1.00 0.00 H new ATOM 0 HG21 VAL A 25 9.416 6.683 -0.111 1.00 0.00 H new ATOM 0 HG22 VAL A 25 9.667 6.443 1.634 1.00 0.00 H new ATOM 0 HG23 VAL A 25 10.187 7.959 0.860 1.00 0.00 H new ATOM 393 N THR A 26 11.124 6.684 3.659 1.00 0.00 N ATOM 394 CA THR A 26 10.483 6.203 4.862 1.00 0.00 C ATOM 395 C THR A 26 9.359 5.231 4.505 1.00 0.00 C ATOM 396 O THR A 26 8.576 5.513 3.599 1.00 0.00 O ATOM 397 CB THR A 26 9.921 7.402 5.653 1.00 0.00 C ATOM 398 OG1 THR A 26 10.989 8.302 5.992 1.00 0.00 O ATOM 399 CG2 THR A 26 9.209 6.969 6.918 1.00 0.00 C ATOM 0 H THR A 26 10.933 7.664 3.449 1.00 0.00 H new ATOM 0 HA THR A 26 11.213 5.676 5.477 1.00 0.00 H new ATOM 0 HB THR A 26 9.192 7.902 5.015 1.00 0.00 H new ATOM 0 HG1 THR A 26 10.629 9.063 6.493 1.00 0.00 H new ATOM 0 HG21 THR A 26 8.831 7.847 7.441 1.00 0.00 H new ATOM 0 HG22 THR A 26 8.377 6.313 6.661 1.00 0.00 H new ATOM 0 HG23 THR A 26 9.906 6.435 7.563 1.00 0.00 H new ATOM 407 N PRO A 27 9.263 4.072 5.202 1.00 0.00 N ATOM 408 CA PRO A 27 8.209 3.084 4.930 1.00 0.00 C ATOM 409 C PRO A 27 6.829 3.715 5.024 1.00 0.00 C ATOM 410 O PRO A 27 5.949 3.447 4.184 1.00 0.00 O ATOM 411 CB PRO A 27 8.405 2.022 6.027 1.00 0.00 C ATOM 412 CG PRO A 27 9.296 2.654 7.042 1.00 0.00 C ATOM 413 CD PRO A 27 10.156 3.646 6.290 1.00 0.00 C ATOM 0 HA PRO A 27 8.275 2.668 3.925 1.00 0.00 H new ATOM 0 HB2 PRO A 27 7.451 1.733 6.468 1.00 0.00 H new ATOM 0 HB3 PRO A 27 8.855 1.116 5.620 1.00 0.00 H new ATOM 0 HG2 PRO A 27 8.712 3.153 7.816 1.00 0.00 H new ATOM 0 HG3 PRO A 27 9.911 1.905 7.540 1.00 0.00 H new ATOM 0 HD2 PRO A 27 10.457 4.483 6.920 1.00 0.00 H new ATOM 0 HD3 PRO A 27 11.069 3.187 5.911 1.00 0.00 H new ATOM 421 N SER A 28 6.640 4.591 6.012 1.00 0.00 N ATOM 422 CA SER A 28 5.384 5.286 6.202 1.00 0.00 C ATOM 423 C SER A 28 5.004 6.098 4.964 1.00 0.00 C ATOM 424 O SER A 28 3.824 6.327 4.693 1.00 0.00 O ATOM 425 CB SER A 28 5.476 6.202 7.421 1.00 0.00 C ATOM 426 OG SER A 28 5.927 5.484 8.549 1.00 0.00 O ATOM 0 H SER A 28 7.357 4.832 6.697 1.00 0.00 H new ATOM 0 HA SER A 28 4.606 4.540 6.366 1.00 0.00 H new ATOM 0 HB2 SER A 28 6.157 7.027 7.212 1.00 0.00 H new ATOM 0 HB3 SER A 28 4.499 6.640 7.628 1.00 0.00 H new ATOM 0 HG SER A 28 5.982 6.087 9.320 1.00 0.00 H new ATOM 432 N GLU A 29 6.010 6.520 4.205 1.00 0.00 N ATOM 433 CA GLU A 29 5.790 7.315 3.009 1.00 0.00 C ATOM 434 C GLU A 29 5.438 6.435 1.818 1.00 0.00 C ATOM 435 O GLU A 29 4.496 6.727 1.094 1.00 0.00 O ATOM 436 CB GLU A 29 7.027 8.169 2.700 1.00 0.00 C ATOM 437 CG GLU A 29 7.340 9.189 3.784 1.00 0.00 C ATOM 438 CD GLU A 29 6.152 10.075 4.137 1.00 0.00 C ATOM 439 OE1 GLU A 29 5.376 9.699 5.047 1.00 0.00 O ATOM 440 OE2 GLU A 29 5.991 11.159 3.522 1.00 0.00 O ATOM 0 H GLU A 29 6.991 6.321 4.402 1.00 0.00 H new ATOM 0 HA GLU A 29 4.945 7.977 3.196 1.00 0.00 H new ATOM 0 HB2 GLU A 29 7.888 7.514 2.568 1.00 0.00 H new ATOM 0 HB3 GLU A 29 6.874 8.689 1.755 1.00 0.00 H new ATOM 0 HG2 GLU A 29 7.674 8.666 4.680 1.00 0.00 H new ATOM 0 HG3 GLU A 29 8.168 9.817 3.455 1.00 0.00 H new ATOM 447 N ALA A 30 6.190 5.358 1.610 1.00 0.00 N ATOM 448 CA ALA A 30 5.917 4.424 0.525 1.00 0.00 C ATOM 449 C ALA A 30 4.501 3.849 0.631 1.00 0.00 C ATOM 450 O ALA A 30 3.804 3.675 -0.377 1.00 0.00 O ATOM 451 CB ALA A 30 6.945 3.311 0.509 1.00 0.00 C ATOM 0 H ALA A 30 6.997 5.111 2.183 1.00 0.00 H new ATOM 0 HA ALA A 30 5.985 4.973 -0.414 1.00 0.00 H new ATOM 0 HB1 ALA A 30 6.725 2.624 -0.308 1.00 0.00 H new ATOM 0 HB2 ALA A 30 7.939 3.736 0.368 1.00 0.00 H new ATOM 0 HB3 ALA A 30 6.912 2.772 1.456 1.00 0.00 H new ATOM 457 N LEU A 31 4.058 3.564 1.851 1.00 0.00 N ATOM 458 CA LEU A 31 2.712 3.062 2.078 1.00 0.00 C ATOM 459 C LEU A 31 1.684 4.199 1.881 1.00 0.00 C ATOM 460 O LEU A 31 0.543 3.941 1.496 1.00 0.00 O ATOM 461 CB LEU A 31 2.603 2.444 3.477 1.00 0.00 C ATOM 462 CG LEU A 31 3.512 1.218 3.711 1.00 0.00 C ATOM 463 CD1 LEU A 31 3.371 0.680 5.129 1.00 0.00 C ATOM 464 CD2 LEU A 31 3.226 0.136 2.687 1.00 0.00 C ATOM 0 H LEU A 31 4.615 3.673 2.699 1.00 0.00 H new ATOM 0 HA LEU A 31 2.493 2.279 1.352 1.00 0.00 H new ATOM 0 HB2 LEU A 31 2.846 3.207 4.217 1.00 0.00 H new ATOM 0 HB3 LEU A 31 1.568 2.151 3.651 1.00 0.00 H new ATOM 0 HG LEU A 31 4.545 1.542 3.587 1.00 0.00 H new ATOM 0 HD11 LEU A 31 4.025 -0.182 5.258 1.00 0.00 H new ATOM 0 HD12 LEU A 31 3.649 1.456 5.842 1.00 0.00 H new ATOM 0 HD13 LEU A 31 2.338 0.381 5.304 1.00 0.00 H new ATOM 0 HD21 LEU A 31 3.877 -0.719 2.870 1.00 0.00 H new ATOM 0 HD22 LEU A 31 2.185 -0.177 2.769 1.00 0.00 H new ATOM 0 HD23 LEU A 31 3.410 0.525 1.686 1.00 0.00 H new ATOM 476 N ARG A 32 2.105 5.446 2.117 1.00 0.00 N ATOM 477 CA ARG A 32 1.221 6.609 1.922 1.00 0.00 C ATOM 478 C ARG A 32 0.790 6.689 0.466 1.00 0.00 C ATOM 479 O ARG A 32 -0.415 6.741 0.170 1.00 0.00 O ATOM 480 CB ARG A 32 1.920 7.910 2.323 1.00 0.00 C ATOM 481 CG ARG A 32 0.999 9.131 2.321 1.00 0.00 C ATOM 482 CD ARG A 32 1.770 10.442 2.330 1.00 0.00 C ATOM 483 NE ARG A 32 0.890 11.571 2.625 1.00 0.00 N ATOM 484 CZ ARG A 32 0.619 12.580 1.785 1.00 0.00 C ATOM 485 NH1 ARG A 32 1.130 12.579 0.555 1.00 0.00 N ATOM 486 NH2 ARG A 32 -0.179 13.570 2.174 1.00 0.00 N ATOM 0 H ARG A 32 3.044 5.679 2.441 1.00 0.00 H new ATOM 0 HA ARG A 32 0.346 6.480 2.559 1.00 0.00 H new ATOM 0 HB2 ARG A 32 2.347 7.790 3.319 1.00 0.00 H new ATOM 0 HB3 ARG A 32 2.750 8.091 1.640 1.00 0.00 H new ATOM 0 HG2 ARG A 32 0.357 9.097 1.441 1.00 0.00 H new ATOM 0 HG3 ARG A 32 0.346 9.091 3.193 1.00 0.00 H new ATOM 0 HD2 ARG A 32 2.566 10.394 3.073 1.00 0.00 H new ATOM 0 HD3 ARG A 32 2.247 10.593 1.362 1.00 0.00 H new ATOM 0 HE ARG A 32 0.447 11.593 3.543 1.00 0.00 H new ATOM 0 HH11 ARG A 32 1.728 11.810 0.252 1.00 0.00 H new ATOM 0 HH12 ARG A 32 0.923 13.347 -0.084 1.00 0.00 H new ATOM 0 HH21 ARG A 32 -0.584 13.561 3.110 1.00 0.00 H new ATOM 0 HH22 ARG A 32 -0.386 14.339 1.536 1.00 0.00 H new ATOM 500 N LEU A 33 1.769 6.665 -0.447 1.00 0.00 N ATOM 501 CA LEU A 33 1.473 6.844 -1.869 1.00 0.00 C ATOM 502 C LEU A 33 0.653 5.675 -2.390 1.00 0.00 C ATOM 503 O LEU A 33 -0.078 5.784 -3.371 1.00 0.00 O ATOM 504 CB LEU A 33 2.743 7.013 -2.721 1.00 0.00 C ATOM 505 CG LEU A 33 3.810 5.909 -2.577 1.00 0.00 C ATOM 506 CD1 LEU A 33 4.077 5.217 -3.909 1.00 0.00 C ATOM 507 CD2 LEU A 33 5.084 6.499 -1.996 1.00 0.00 C ATOM 0 H LEU A 33 2.756 6.526 -0.230 1.00 0.00 H new ATOM 0 HA LEU A 33 0.897 7.765 -1.958 1.00 0.00 H new ATOM 0 HB2 LEU A 33 2.448 7.070 -3.769 1.00 0.00 H new ATOM 0 HB3 LEU A 33 3.202 7.968 -2.467 1.00 0.00 H new ATOM 0 HG LEU A 33 3.434 5.148 -1.893 1.00 0.00 H new ATOM 0 HD11 LEU A 33 4.834 4.445 -3.772 1.00 0.00 H new ATOM 0 HD12 LEU A 33 3.156 4.762 -4.274 1.00 0.00 H new ATOM 0 HD13 LEU A 33 4.432 5.949 -4.634 1.00 0.00 H new ATOM 0 HD21 LEU A 33 5.835 5.716 -1.896 1.00 0.00 H new ATOM 0 HD22 LEU A 33 5.459 7.279 -2.659 1.00 0.00 H new ATOM 0 HD23 LEU A 33 4.873 6.927 -1.016 1.00 0.00 H new ATOM 519 N MET A 34 0.783 4.536 -1.697 1.00 0.00 N ATOM 520 CA MET A 34 -0.041 3.377 -1.997 1.00 0.00 C ATOM 521 C MET A 34 -1.495 3.690 -1.664 1.00 0.00 C ATOM 522 O MET A 34 -2.396 3.438 -2.465 1.00 0.00 O ATOM 523 CB MET A 34 0.444 2.122 -1.246 1.00 0.00 C ATOM 524 CG MET A 34 -0.559 0.985 -1.254 1.00 0.00 C ATOM 525 SD MET A 34 -1.926 1.218 -0.091 1.00 0.00 S ATOM 526 CE MET A 34 -2.919 -0.230 -0.428 1.00 0.00 C ATOM 0 H MET A 34 1.446 4.401 -0.934 1.00 0.00 H new ATOM 0 HA MET A 34 0.043 3.157 -3.061 1.00 0.00 H new ATOM 0 HB2 MET A 34 1.375 1.777 -1.695 1.00 0.00 H new ATOM 0 HB3 MET A 34 0.668 2.390 -0.214 1.00 0.00 H new ATOM 0 HG2 MET A 34 -0.964 0.875 -2.260 1.00 0.00 H new ATOM 0 HG3 MET A 34 -0.044 0.055 -1.015 1.00 0.00 H new ATOM 0 HE1 MET A 34 -3.699 -0.321 0.328 1.00 0.00 H new ATOM 0 HE2 MET A 34 -3.377 -0.136 -1.412 1.00 0.00 H new ATOM 0 HE3 MET A 34 -2.287 -1.118 -0.406 1.00 0.00 H new ATOM 536 N LEU A 35 -1.713 4.272 -0.491 1.00 0.00 N ATOM 537 CA LEU A 35 -3.062 4.573 -0.022 1.00 0.00 C ATOM 538 C LEU A 35 -3.706 5.601 -0.953 1.00 0.00 C ATOM 539 O LEU A 35 -4.929 5.639 -1.110 1.00 0.00 O ATOM 540 CB LEU A 35 -3.063 5.075 1.421 1.00 0.00 C ATOM 541 CG LEU A 35 -2.675 4.018 2.467 1.00 0.00 C ATOM 542 CD1 LEU A 35 -2.763 4.594 3.869 1.00 0.00 C ATOM 543 CD2 LEU A 35 -3.567 2.783 2.341 1.00 0.00 C ATOM 0 H LEU A 35 -0.972 4.546 0.155 1.00 0.00 H new ATOM 0 HA LEU A 35 -3.644 3.652 -0.039 1.00 0.00 H new ATOM 0 HB2 LEU A 35 -2.373 5.915 1.500 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -4.057 5.455 1.659 1.00 0.00 H new ATOM 0 HG LEU A 35 -1.643 3.719 2.282 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -2.484 3.830 4.595 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -2.084 5.442 3.957 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -3.784 4.924 4.063 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -3.276 2.046 3.090 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -4.607 3.068 2.497 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -3.454 2.353 1.346 1.00 0.00 H new ATOM 555 N GLU A 36 -2.863 6.435 -1.551 1.00 0.00 N ATOM 556 CA GLU A 36 -3.325 7.419 -2.523 1.00 0.00 C ATOM 557 C GLU A 36 -3.876 6.722 -3.771 1.00 0.00 C ATOM 558 O GLU A 36 -4.976 7.042 -4.225 1.00 0.00 O ATOM 559 CB GLU A 36 -2.195 8.379 -2.910 1.00 0.00 C ATOM 560 CG GLU A 36 -1.497 9.011 -1.716 1.00 0.00 C ATOM 561 CD GLU A 36 -0.601 10.189 -2.070 1.00 0.00 C ATOM 562 OE1 GLU A 36 -1.134 11.318 -2.247 1.00 0.00 O ATOM 563 OE2 GLU A 36 0.621 10.006 -2.170 1.00 0.00 O ATOM 0 H GLU A 36 -1.857 6.450 -1.380 1.00 0.00 H new ATOM 0 HA GLU A 36 -4.125 7.998 -2.062 1.00 0.00 H new ATOM 0 HB2 GLU A 36 -1.459 7.839 -3.506 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -2.601 9.168 -3.543 1.00 0.00 H new ATOM 0 HG2 GLU A 36 -2.251 9.344 -1.003 1.00 0.00 H new ATOM 0 HG3 GLU A 36 -0.898 8.251 -1.215 1.00 0.00 H new ATOM 570 N TYR A 37 -3.104 5.771 -4.334 1.00 0.00 N ATOM 571 CA TYR A 37 -3.479 5.162 -5.613 1.00 0.00 C ATOM 572 C TYR A 37 -4.722 4.294 -5.467 1.00 0.00 C ATOM 573 O TYR A 37 -5.523 4.203 -6.391 1.00 0.00 O ATOM 574 CB TYR A 37 -2.304 4.380 -6.259 1.00 0.00 C ATOM 575 CG TYR A 37 -2.119 2.947 -5.808 1.00 0.00 C ATOM 576 CD1 TYR A 37 -3.038 1.962 -6.129 1.00 0.00 C ATOM 577 CD2 TYR A 37 -1.008 2.561 -5.084 1.00 0.00 C ATOM 578 CE1 TYR A 37 -2.874 0.646 -5.742 1.00 0.00 C ATOM 579 CE2 TYR A 37 -0.831 1.245 -4.690 1.00 0.00 C ATOM 580 CZ TYR A 37 -1.761 0.289 -5.015 1.00 0.00 C ATOM 581 OH TYR A 37 -1.593 -1.017 -4.617 1.00 0.00 O ATOM 0 H TYR A 37 -2.237 5.418 -3.929 1.00 0.00 H new ATOM 0 HA TYR A 37 -3.722 5.976 -6.296 1.00 0.00 H new ATOM 0 HB2 TYR A 37 -2.446 4.382 -7.340 1.00 0.00 H new ATOM 0 HB3 TYR A 37 -1.381 4.923 -6.058 1.00 0.00 H new ATOM 0 HD1 TYR A 37 -3.913 2.232 -6.702 1.00 0.00 H new ATOM 0 HD2 TYR A 37 -0.264 3.298 -4.820 1.00 0.00 H new ATOM 0 HE1 TYR A 37 -3.612 -0.096 -6.007 1.00 0.00 H new ATOM 0 HE2 TYR A 37 0.046 0.969 -4.123 1.00 0.00 H new ATOM 0 HH TYR A 37 -0.756 -1.101 -4.114 1.00 0.00 H new ATOM 591 N ILE A 38 -4.878 3.639 -4.321 1.00 0.00 N ATOM 592 CA ILE A 38 -6.041 2.799 -4.080 1.00 0.00 C ATOM 593 C ILE A 38 -7.292 3.663 -3.887 1.00 0.00 C ATOM 594 O ILE A 38 -8.383 3.300 -4.328 1.00 0.00 O ATOM 595 CB ILE A 38 -5.852 1.838 -2.867 1.00 0.00 C ATOM 596 CG1 ILE A 38 -7.176 1.190 -2.448 1.00 0.00 C ATOM 597 CG2 ILE A 38 -5.237 2.557 -1.691 1.00 0.00 C ATOM 598 CD1 ILE A 38 -7.832 0.347 -3.518 1.00 0.00 C ATOM 0 H ILE A 38 -4.214 3.675 -3.547 1.00 0.00 H new ATOM 0 HA ILE A 38 -6.166 2.172 -4.963 1.00 0.00 H new ATOM 0 HB ILE A 38 -5.172 1.050 -3.190 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -6.999 0.567 -1.571 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -7.870 1.975 -2.146 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -5.118 1.861 -0.861 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -4.262 2.953 -1.976 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -5.887 3.377 -1.386 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -8.762 -0.071 -3.133 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -8.046 0.966 -4.389 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -7.162 -0.463 -3.805 1.00 0.00 H new ATOM 610 N ALA A 39 -7.114 4.828 -3.261 1.00 0.00 N ATOM 611 CA ALA A 39 -8.228 5.756 -3.032 1.00 0.00 C ATOM 612 C ALA A 39 -8.790 6.285 -4.348 1.00 0.00 C ATOM 613 O ALA A 39 -10.003 6.443 -4.509 1.00 0.00 O ATOM 614 CB ALA A 39 -7.745 6.905 -2.155 1.00 0.00 C ATOM 0 H ALA A 39 -6.215 5.152 -2.904 1.00 0.00 H new ATOM 0 HA ALA A 39 -9.034 5.223 -2.527 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -8.567 7.599 -1.980 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -7.393 6.512 -1.201 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -6.929 7.427 -2.656 1.00 0.00 H new ATOM 620 N ASP A 40 -7.892 6.551 -5.302 1.00 0.00 N ATOM 621 CA ASP A 40 -8.279 7.095 -6.603 1.00 0.00 C ATOM 622 C ASP A 40 -8.775 6.008 -7.557 1.00 0.00 C ATOM 623 O ASP A 40 -9.823 6.154 -8.182 1.00 0.00 O ATOM 624 CB ASP A 40 -7.086 7.839 -7.230 1.00 0.00 C ATOM 625 CG ASP A 40 -7.425 8.462 -8.572 1.00 0.00 C ATOM 626 OD1 ASP A 40 -8.111 9.501 -8.591 1.00 0.00 O ATOM 627 OD2 ASP A 40 -7.015 7.901 -9.608 1.00 0.00 O ATOM 0 H ASP A 40 -6.889 6.397 -5.195 1.00 0.00 H new ATOM 0 HA ASP A 40 -9.105 7.787 -6.440 1.00 0.00 H new ATOM 0 HB2 ASP A 40 -6.749 8.619 -6.547 1.00 0.00 H new ATOM 0 HB3 ASP A 40 -6.255 7.145 -7.356 1.00 0.00 H new ATOM 632 N ASN A 41 -8.010 4.931 -7.663 1.00 0.00 N ATOM 633 CA ASN A 41 -8.268 3.883 -8.652 1.00 0.00 C ATOM 634 C ASN A 41 -9.301 2.878 -8.139 1.00 0.00 C ATOM 635 O ASN A 41 -10.106 2.384 -8.925 1.00 0.00 O ATOM 636 CB ASN A 41 -6.972 3.162 -9.018 1.00 0.00 C ATOM 637 CG ASN A 41 -6.006 4.033 -9.812 1.00 0.00 C ATOM 638 OD1 ASN A 41 -5.998 4.008 -11.044 1.00 0.00 O ATOM 639 ND2 ASN A 41 -5.192 4.810 -9.133 1.00 0.00 N ATOM 0 H ASN A 41 -7.197 4.755 -7.072 1.00 0.00 H new ATOM 0 HA ASN A 41 -8.672 4.361 -9.544 1.00 0.00 H new ATOM 0 HB2 ASN A 41 -6.481 2.825 -8.105 1.00 0.00 H new ATOM 0 HB3 ASN A 41 -7.211 2.272 -9.600 1.00 0.00 H new ATOM 0 HD21 ASN A 41 -4.532 5.412 -9.626 1.00 0.00 H new ATOM 0 HD22 ASN A 41 -5.220 4.811 -8.113 1.00 0.00 H new ATOM 646 N GLU A 42 -9.253 2.610 -6.833 1.00 0.00 N ATOM 647 CA GLU A 42 -10.181 1.677 -6.188 1.00 0.00 C ATOM 648 C GLU A 42 -10.205 0.337 -6.941 1.00 0.00 C ATOM 649 O GLU A 42 -11.278 -0.189 -7.255 1.00 0.00 O ATOM 650 CB GLU A 42 -11.579 2.292 -6.112 1.00 0.00 C ATOM 651 CG GLU A 42 -11.591 3.696 -5.506 1.00 0.00 C ATOM 652 CD GLU A 42 -12.975 4.267 -5.369 1.00 0.00 C ATOM 653 OE1 GLU A 42 -13.635 3.990 -4.343 1.00 0.00 O ATOM 654 OE2 GLU A 42 -13.439 4.996 -6.278 1.00 0.00 O ATOM 0 H GLU A 42 -8.576 3.029 -6.196 1.00 0.00 H new ATOM 0 HA GLU A 42 -9.838 1.484 -5.171 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -12.005 2.333 -7.114 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -12.222 1.642 -5.519 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -11.118 3.666 -4.524 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -10.991 4.359 -6.129 1.00 0.00 H new ATOM 661 N ARG A 43 -9.025 -0.208 -7.234 1.00 0.00 N ATOM 662 CA ARG A 43 -8.919 -1.469 -7.963 1.00 0.00 C ATOM 663 C ARG A 43 -7.666 -2.269 -7.582 1.00 0.00 C ATOM 664 O ARG A 43 -7.688 -3.496 -7.582 1.00 0.00 O ATOM 665 CB ARG A 43 -8.913 -1.210 -9.483 1.00 0.00 C ATOM 666 CG ARG A 43 -7.697 -0.441 -9.989 1.00 0.00 C ATOM 667 CD ARG A 43 -7.739 -0.264 -11.507 1.00 0.00 C ATOM 668 NE ARG A 43 -8.861 0.583 -11.948 1.00 0.00 N ATOM 669 CZ ARG A 43 -9.404 0.523 -13.159 1.00 0.00 C ATOM 670 NH1 ARG A 43 -8.954 -0.342 -14.076 1.00 0.00 N ATOM 671 NH2 ARG A 43 -10.381 1.367 -13.501 1.00 0.00 N ATOM 0 H ARG A 43 -8.129 0.205 -6.977 1.00 0.00 H new ATOM 0 HA ARG A 43 -9.790 -2.063 -7.685 1.00 0.00 H new ATOM 0 HB2 ARG A 43 -8.963 -2.167 -10.002 1.00 0.00 H new ATOM 0 HB3 ARG A 43 -9.813 -0.656 -9.748 1.00 0.00 H new ATOM 0 HG2 ARG A 43 -7.657 0.537 -9.508 1.00 0.00 H new ATOM 0 HG3 ARG A 43 -6.787 -0.971 -9.708 1.00 0.00 H new ATOM 0 HD2 ARG A 43 -6.801 0.178 -11.844 1.00 0.00 H new ATOM 0 HD3 ARG A 43 -7.819 -1.242 -11.981 1.00 0.00 H new ATOM 0 HE ARG A 43 -9.244 1.256 -11.284 1.00 0.00 H new ATOM 0 HH11 ARG A 43 -8.182 -0.969 -13.850 1.00 0.00 H new ATOM 0 HH12 ARG A 43 -9.383 -0.374 -15.001 1.00 0.00 H new ATOM 0 HH21 ARG A 43 -10.713 2.061 -12.831 1.00 0.00 H new ATOM 0 HH22 ARG A 43 -10.795 1.317 -14.432 1.00 0.00 H new ATOM 685 N LEU A 44 -6.570 -1.566 -7.259 1.00 0.00 N ATOM 686 CA LEU A 44 -5.277 -2.193 -6.954 1.00 0.00 C ATOM 687 C LEU A 44 -4.663 -2.806 -8.218 1.00 0.00 C ATOM 688 O LEU A 44 -5.377 -3.189 -9.148 1.00 0.00 O ATOM 689 CB LEU A 44 -5.425 -3.260 -5.839 1.00 0.00 C ATOM 690 CG LEU A 44 -5.835 -2.712 -4.465 1.00 0.00 C ATOM 691 CD1 LEU A 44 -6.129 -3.856 -3.490 1.00 0.00 C ATOM 692 CD2 LEU A 44 -4.751 -1.795 -3.906 1.00 0.00 C ATOM 0 H LEU A 44 -6.556 -0.548 -7.202 1.00 0.00 H new ATOM 0 HA LEU A 44 -4.603 -1.418 -6.587 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -6.166 -3.994 -6.156 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -4.477 -3.788 -5.734 1.00 0.00 H new ATOM 0 HG LEU A 44 -6.747 -2.128 -4.590 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -6.418 -3.445 -2.523 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -6.942 -4.468 -3.881 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -5.237 -4.471 -3.371 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -5.061 -1.417 -2.932 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -3.821 -2.354 -3.799 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -4.595 -0.958 -4.587 1.00 0.00 H new ATOM 704 N PRO A 45 -3.315 -2.911 -8.279 1.00 0.00 N ATOM 705 CA PRO A 45 -2.616 -3.441 -9.461 1.00 0.00 C ATOM 706 C PRO A 45 -2.974 -4.897 -9.739 1.00 0.00 C ATOM 707 O PRO A 45 -2.971 -5.340 -10.887 1.00 0.00 O ATOM 708 CB PRO A 45 -1.119 -3.316 -9.077 1.00 0.00 C ATOM 709 CG PRO A 45 -1.104 -3.247 -7.588 1.00 0.00 C ATOM 710 CD PRO A 45 -2.359 -2.513 -7.213 1.00 0.00 C ATOM 0 HA PRO A 45 -2.884 -2.903 -10.370 1.00 0.00 H new ATOM 0 HB2 PRO A 45 -0.547 -4.171 -9.438 1.00 0.00 H new ATOM 0 HB3 PRO A 45 -0.672 -2.425 -9.517 1.00 0.00 H new ATOM 0 HG2 PRO A 45 -1.085 -4.244 -7.148 1.00 0.00 H new ATOM 0 HG3 PRO A 45 -0.219 -2.723 -7.227 1.00 0.00 H new ATOM 0 HD2 PRO A 45 -2.715 -2.802 -6.224 1.00 0.00 H new ATOM 0 HD3 PRO A 45 -2.204 -1.434 -7.193 1.00 0.00 H new ATOM 718 N PHE A 46 -3.291 -5.622 -8.675 1.00 0.00 N ATOM 719 CA PHE A 46 -3.600 -7.048 -8.757 1.00 0.00 C ATOM 720 C PHE A 46 -4.932 -7.336 -8.072 1.00 0.00 C ATOM 721 O PHE A 46 -5.905 -7.722 -8.714 1.00 0.00 O ATOM 722 CB PHE A 46 -2.490 -7.884 -8.095 1.00 0.00 C ATOM 723 CG PHE A 46 -1.150 -7.777 -8.785 1.00 0.00 C ATOM 724 CD1 PHE A 46 -0.873 -8.478 -9.949 1.00 0.00 C ATOM 725 CD2 PHE A 46 -0.169 -6.938 -8.276 1.00 0.00 C ATOM 726 CE1 PHE A 46 0.355 -8.372 -10.579 1.00 0.00 C ATOM 727 CE2 PHE A 46 1.062 -6.816 -8.897 1.00 0.00 C ATOM 728 CZ PHE A 46 1.322 -7.536 -10.053 1.00 0.00 C ATOM 0 H PHE A 46 -3.342 -5.241 -7.730 1.00 0.00 H new ATOM 0 HA PHE A 46 -3.667 -7.322 -9.810 1.00 0.00 H new ATOM 0 HB2 PHE A 46 -2.380 -7.568 -7.058 1.00 0.00 H new ATOM 0 HB3 PHE A 46 -2.797 -8.930 -8.079 1.00 0.00 H new ATOM 0 HD1 PHE A 46 -1.631 -9.120 -10.373 1.00 0.00 H new ATOM 0 HD2 PHE A 46 -0.369 -6.370 -7.379 1.00 0.00 H new ATOM 0 HE1 PHE A 46 0.556 -8.939 -11.476 1.00 0.00 H new ATOM 0 HE2 PHE A 46 1.816 -6.163 -8.483 1.00 0.00 H new ATOM 0 HZ PHE A 46 2.280 -7.444 -10.543 1.00 0.00 H new ATOM 738 N LYS A 47 -4.942 -7.140 -6.749 1.00 0.00 N ATOM 739 CA LYS A 47 -6.122 -7.392 -5.937 1.00 0.00 C ATOM 740 C LYS A 47 -6.500 -8.873 -6.016 1.00 0.00 C ATOM 741 O LYS A 47 -7.680 -9.234 -6.020 1.00 0.00 O ATOM 742 CB LYS A 47 -7.276 -6.472 -6.369 1.00 0.00 C ATOM 743 CG LYS A 47 -8.531 -6.582 -5.505 1.00 0.00 C ATOM 744 CD LYS A 47 -9.534 -5.457 -5.775 1.00 0.00 C ATOM 745 CE LYS A 47 -10.033 -5.466 -7.225 1.00 0.00 C ATOM 746 NZ LYS A 47 -10.677 -6.742 -7.586 1.00 0.00 N ATOM 0 H LYS A 47 -4.136 -6.805 -6.221 1.00 0.00 H new ATOM 0 HA LYS A 47 -5.904 -7.162 -4.894 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -6.927 -5.440 -6.351 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -7.540 -6.701 -7.401 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -9.011 -7.543 -5.689 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -8.246 -6.564 -4.453 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -10.383 -5.559 -5.099 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -9.067 -4.496 -5.558 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -10.742 -4.650 -7.368 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -9.195 -5.282 -7.897 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -11.146 -6.645 -8.509 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -9.957 -7.491 -7.640 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -11.383 -6.991 -6.864 1.00 0.00 H new ATOM 760 N GLN A 48 -5.483 -9.717 -6.084 1.00 0.00 N ATOM 761 CA GLN A 48 -5.672 -11.158 -6.128 1.00 0.00 C ATOM 762 C GLN A 48 -6.280 -11.663 -4.810 1.00 0.00 C ATOM 763 O GLN A 48 -6.261 -10.964 -3.797 1.00 0.00 O ATOM 764 CB GLN A 48 -4.333 -11.859 -6.391 1.00 0.00 C ATOM 765 CG GLN A 48 -3.331 -11.797 -5.235 1.00 0.00 C ATOM 766 CD GLN A 48 -2.876 -10.387 -4.899 1.00 0.00 C ATOM 767 OE1 GLN A 48 -3.600 -9.731 -4.017 1.00 0.00 O flip ATOM 768 NE2 GLN A 48 -1.888 -9.892 -5.440 1.00 0.00 N flip ATOM 0 H GLN A 48 -4.506 -9.424 -6.110 1.00 0.00 H new ATOM 0 HA GLN A 48 -6.360 -11.391 -6.940 1.00 0.00 H new ATOM 0 HB2 GLN A 48 -4.528 -12.905 -6.627 1.00 0.00 H new ATOM 0 HB3 GLN A 48 -3.874 -11.413 -7.274 1.00 0.00 H new ATOM 0 HG2 GLN A 48 -3.782 -12.245 -4.350 1.00 0.00 H new ATOM 0 HG3 GLN A 48 -2.459 -12.400 -5.488 1.00 0.00 H new ATOM 0 HE21 GLN A 48 -1.353 -10.434 -6.119 1.00 0.00 H new ATOM 0 HE22 GLN A 48 -1.604 -8.940 -5.210 1.00 0.00 H new ATOM 777 N THR A 49 -6.836 -12.864 -4.860 1.00 0.00 N ATOM 778 CA THR A 49 -7.458 -13.484 -3.692 1.00 0.00 C ATOM 779 C THR A 49 -6.473 -14.420 -2.982 1.00 0.00 C ATOM 780 O THR A 49 -6.849 -15.190 -2.101 1.00 0.00 O ATOM 781 CB THR A 49 -8.747 -14.251 -4.085 1.00 0.00 C ATOM 782 OG1 THR A 49 -9.419 -14.762 -2.927 1.00 0.00 O ATOM 783 CG2 THR A 49 -8.443 -15.414 -5.039 1.00 0.00 C ATOM 0 H THR A 49 -6.871 -13.436 -5.704 1.00 0.00 H new ATOM 0 HA THR A 49 -7.735 -12.687 -3.002 1.00 0.00 H new ATOM 0 HB THR A 49 -9.394 -13.536 -4.593 1.00 0.00 H new ATOM 0 HG1 THR A 49 -8.756 -15.058 -2.268 1.00 0.00 H new ATOM 0 HG21 THR A 49 -9.370 -15.928 -5.293 1.00 0.00 H new ATOM 0 HG22 THR A 49 -7.982 -15.028 -5.948 1.00 0.00 H new ATOM 0 HG23 THR A 49 -7.761 -16.113 -4.555 1.00 0.00 H new ATOM 791 N LEU A 50 -5.195 -14.317 -3.384 1.00 0.00 N ATOM 792 CA LEU A 50 -4.105 -15.108 -2.806 1.00 0.00 C ATOM 793 C LEU A 50 -4.286 -16.589 -3.116 1.00 0.00 C ATOM 794 O LEU A 50 -4.701 -17.367 -2.224 1.00 0.00 O ATOM 795 CB LEU A 50 -3.977 -14.864 -1.277 1.00 0.00 C ATOM 796 CG LEU A 50 -3.397 -13.502 -0.840 1.00 0.00 C ATOM 797 CD1 LEU A 50 -2.010 -13.324 -1.402 1.00 0.00 C ATOM 798 CD2 LEU A 50 -4.308 -12.349 -1.262 1.00 0.00 C ATOM 799 OXT LEU A 50 -4.037 -16.984 -4.286 1.00 0.00 O ATOM 0 H LEU A 50 -4.892 -13.680 -4.121 1.00 0.00 H new ATOM 0 HA LEU A 50 -3.174 -14.780 -3.267 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -4.966 -14.972 -0.831 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -3.350 -15.651 -0.858 1.00 0.00 H new ATOM 0 HG LEU A 50 -3.337 -13.490 0.248 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -1.611 -12.360 -1.087 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -1.364 -14.121 -1.035 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -2.051 -13.362 -2.491 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -3.872 -11.404 -0.940 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -4.415 -12.348 -2.347 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -5.288 -12.472 -0.801 1.00 0.00 H new TER 811 LEU A 50 ATOM 812 N MET B 101 4.267 -14.102 10.515 1.00 0.00 N ATOM 813 CA MET B 101 4.102 -12.705 10.049 1.00 0.00 C ATOM 814 C MET B 101 4.506 -11.738 11.153 1.00 0.00 C ATOM 815 O MET B 101 4.779 -12.140 12.294 1.00 0.00 O ATOM 816 CB MET B 101 2.639 -12.404 9.658 1.00 0.00 C ATOM 817 CG MET B 101 1.935 -13.533 8.932 1.00 0.00 C ATOM 818 SD MET B 101 0.185 -13.200 8.601 1.00 0.00 S ATOM 819 CE MET B 101 0.291 -11.848 7.440 1.00 0.00 C ATOM 0 HA MET B 101 4.738 -12.580 9.173 1.00 0.00 H new ATOM 0 HB2 MET B 101 2.077 -12.164 10.561 1.00 0.00 H new ATOM 0 HB3 MET B 101 2.621 -11.516 9.026 1.00 0.00 H new ATOM 0 HG2 MET B 101 2.446 -13.721 7.988 1.00 0.00 H new ATOM 0 HG3 MET B 101 2.017 -14.443 9.526 1.00 0.00 H new ATOM 0 HE1 MET B 101 -0.694 -11.656 7.014 1.00 0.00 H new ATOM 0 HE2 MET B 101 0.645 -10.954 7.954 1.00 0.00 H new ATOM 0 HE3 MET B 101 0.987 -12.107 6.642 1.00 0.00 H new ATOM 829 N GLY B 102 4.531 -10.451 10.809 1.00 0.00 N ATOM 830 CA GLY B 102 4.837 -9.425 11.784 1.00 0.00 C ATOM 831 C GLY B 102 4.016 -8.170 11.524 1.00 0.00 C ATOM 832 O GLY B 102 3.540 -7.947 10.399 1.00 0.00 O ATOM 0 H GLY B 102 4.344 -10.104 9.868 1.00 0.00 H new ATOM 0 HA2 GLY B 102 4.632 -9.798 12.787 1.00 0.00 H new ATOM 0 HA3 GLY B 102 5.899 -9.185 11.744 1.00 0.00 H new ATOM 836 N SER B 103 3.848 -7.358 12.548 1.00 0.00 N ATOM 837 CA SER B 103 3.064 -6.135 12.451 1.00 0.00 C ATOM 838 C SER B 103 3.964 -4.894 12.469 1.00 0.00 C ATOM 839 O SER B 103 5.013 -4.882 13.106 1.00 0.00 O ATOM 840 CB SER B 103 2.049 -6.068 13.591 1.00 0.00 C ATOM 841 OG SER B 103 2.664 -6.289 14.842 1.00 0.00 O ATOM 0 H SER B 103 4.249 -7.523 13.471 1.00 0.00 H new ATOM 0 HA SER B 103 2.532 -6.150 11.500 1.00 0.00 H new ATOM 0 HB2 SER B 103 1.563 -5.092 13.590 1.00 0.00 H new ATOM 0 HB3 SER B 103 1.270 -6.813 13.430 1.00 0.00 H new ATOM 0 HG SER B 103 1.990 -6.238 15.551 1.00 0.00 H new ATOM 847 N ILE B 104 3.551 -3.881 11.718 1.00 0.00 N ATOM 848 CA ILE B 104 4.230 -2.588 11.685 1.00 0.00 C ATOM 849 C ILE B 104 3.230 -1.465 11.891 1.00 0.00 C ATOM 850 O ILE B 104 2.024 -1.626 11.619 1.00 0.00 O ATOM 851 CB ILE B 104 4.996 -2.374 10.347 1.00 0.00 C ATOM 852 CG1 ILE B 104 4.034 -2.266 9.147 1.00 0.00 C ATOM 853 CG2 ILE B 104 5.985 -3.505 10.122 1.00 0.00 C ATOM 854 CD1 ILE B 104 3.581 -0.855 8.826 1.00 0.00 C ATOM 0 H ILE B 104 2.732 -3.931 11.111 1.00 0.00 H new ATOM 0 HA ILE B 104 4.959 -2.579 12.495 1.00 0.00 H new ATOM 0 HB ILE B 104 5.536 -1.431 10.425 1.00 0.00 H new ATOM 0 HG12 ILE B 104 4.523 -2.686 8.268 1.00 0.00 H new ATOM 0 HG13 ILE B 104 3.155 -2.879 9.346 1.00 0.00 H new ATOM 0 HG21 ILE B 104 6.515 -3.344 9.183 1.00 0.00 H new ATOM 0 HG22 ILE B 104 6.702 -3.530 10.943 1.00 0.00 H new ATOM 0 HG23 ILE B 104 5.449 -4.453 10.078 1.00 0.00 H new ATOM 0 HD11 ILE B 104 2.908 -0.875 7.969 1.00 0.00 H new ATOM 0 HD12 ILE B 104 3.060 -0.435 9.687 1.00 0.00 H new ATOM 0 HD13 ILE B 104 4.449 -0.239 8.591 1.00 0.00 H new ATOM 866 N ASN B 105 3.721 -0.316 12.352 1.00 0.00 N ATOM 867 CA ASN B 105 2.899 0.864 12.488 1.00 0.00 C ATOM 868 C ASN B 105 3.075 1.762 11.254 1.00 0.00 C ATOM 869 O ASN B 105 4.192 2.102 10.854 1.00 0.00 O ATOM 870 CB ASN B 105 3.300 1.643 13.748 1.00 0.00 C ATOM 871 CG ASN B 105 2.375 2.810 14.020 1.00 0.00 C ATOM 872 OD1 ASN B 105 1.382 2.675 14.755 1.00 0.00 O ATOM 873 ND2 ASN B 105 2.668 3.962 13.440 1.00 0.00 N ATOM 0 H ASN B 105 4.692 -0.187 12.637 1.00 0.00 H new ATOM 0 HA ASN B 105 1.856 0.560 12.572 1.00 0.00 H new ATOM 0 HB2 ASN B 105 3.295 0.970 14.606 1.00 0.00 H new ATOM 0 HB3 ASN B 105 4.321 2.009 13.637 1.00 0.00 H new ATOM 0 HD21 ASN B 105 2.071 4.775 13.590 1.00 0.00 H new ATOM 0 HD22 ASN B 105 3.491 4.037 12.843 1.00 0.00 H new ATOM 880 N LEU B 106 1.965 2.108 10.651 1.00 0.00 N ATOM 881 CA LEU B 106 1.912 2.975 9.495 1.00 0.00 C ATOM 882 C LEU B 106 1.193 4.262 9.893 1.00 0.00 C ATOM 883 O LEU B 106 0.291 4.212 10.722 1.00 0.00 O ATOM 884 CB LEU B 106 1.179 2.213 8.361 1.00 0.00 C ATOM 885 CG LEU B 106 1.016 2.919 7.004 1.00 0.00 C ATOM 886 CD1 LEU B 106 -0.194 3.848 7.007 1.00 0.00 C ATOM 887 CD2 LEU B 106 2.286 3.669 6.598 1.00 0.00 C ATOM 0 H LEU B 106 1.047 1.787 10.957 1.00 0.00 H new ATOM 0 HA LEU B 106 2.904 3.247 9.135 1.00 0.00 H new ATOM 0 HB2 LEU B 106 1.712 1.278 8.189 1.00 0.00 H new ATOM 0 HB3 LEU B 106 0.185 1.952 8.723 1.00 0.00 H new ATOM 0 HG LEU B 106 0.843 2.145 6.256 1.00 0.00 H new ATOM 0 HD11 LEU B 106 -0.283 4.333 6.035 1.00 0.00 H new ATOM 0 HD12 LEU B 106 -1.096 3.270 7.208 1.00 0.00 H new ATOM 0 HD13 LEU B 106 -0.069 4.606 7.780 1.00 0.00 H new ATOM 0 HD21 LEU B 106 2.130 4.154 5.634 1.00 0.00 H new ATOM 0 HD22 LEU B 106 2.519 4.423 7.350 1.00 0.00 H new ATOM 0 HD23 LEU B 106 3.115 2.965 6.520 1.00 0.00 H new ATOM 899 N ARG B 107 1.606 5.417 9.347 1.00 0.00 N ATOM 900 CA ARG B 107 1.034 6.692 9.771 1.00 0.00 C ATOM 901 C ARG B 107 0.786 7.538 8.519 1.00 0.00 C ATOM 902 O ARG B 107 1.748 7.795 7.784 1.00 0.00 O ATOM 903 CB ARG B 107 1.962 7.456 10.713 1.00 0.00 C ATOM 904 CG ARG B 107 2.248 6.738 12.021 1.00 0.00 C ATOM 905 CD ARG B 107 2.965 7.646 13.013 1.00 0.00 C ATOM 906 NE ARG B 107 4.168 8.254 12.423 1.00 0.00 N ATOM 907 CZ ARG B 107 4.803 9.325 12.937 1.00 0.00 C ATOM 908 NH1 ARG B 107 4.374 9.888 14.056 1.00 0.00 N ATOM 909 NH2 ARG B 107 5.869 9.826 12.327 1.00 0.00 N ATOM 0 H ARG B 107 2.322 5.489 8.624 1.00 0.00 H new ATOM 0 HA ARG B 107 0.109 6.494 10.313 1.00 0.00 H new ATOM 0 HB2 ARG B 107 2.906 7.645 10.201 1.00 0.00 H new ATOM 0 HB3 ARG B 107 1.519 8.427 10.934 1.00 0.00 H new ATOM 0 HG2 ARG B 107 1.312 6.388 12.457 1.00 0.00 H new ATOM 0 HG3 ARG B 107 2.858 5.856 11.827 1.00 0.00 H new ATOM 0 HD2 ARG B 107 2.286 8.431 13.344 1.00 0.00 H new ATOM 0 HD3 ARG B 107 3.243 7.072 13.897 1.00 0.00 H new ATOM 0 HE ARG B 107 4.545 7.838 11.571 1.00 0.00 H new ATOM 0 HH11 ARG B 107 3.557 9.511 14.536 1.00 0.00 H new ATOM 0 HH12 ARG B 107 4.861 10.699 14.438 1.00 0.00 H new ATOM 0 HH21 ARG B 107 6.211 9.400 11.465 1.00 0.00 H new ATOM 0 HH22 ARG B 107 6.347 10.637 12.719 1.00 0.00 H new ATOM 923 N ILE B 108 -0.444 7.936 8.271 1.00 0.00 N ATOM 924 CA ILE B 108 -0.744 8.800 7.121 1.00 0.00 C ATOM 925 C ILE B 108 -1.796 9.823 7.510 1.00 0.00 C ATOM 926 O ILE B 108 -2.394 9.749 8.571 1.00 0.00 O ATOM 927 CB ILE B 108 -1.264 8.042 5.878 1.00 0.00 C ATOM 928 CG1 ILE B 108 -2.687 7.471 6.091 1.00 0.00 C ATOM 929 CG2 ILE B 108 -0.291 6.939 5.446 1.00 0.00 C ATOM 930 CD1 ILE B 108 -2.815 6.432 7.185 1.00 0.00 C ATOM 0 H ILE B 108 -1.254 7.684 8.838 1.00 0.00 H new ATOM 0 HA ILE B 108 0.204 9.265 6.851 1.00 0.00 H new ATOM 0 HB ILE B 108 -1.327 8.773 5.072 1.00 0.00 H new ATOM 0 HG12 ILE B 108 -3.361 8.297 6.318 1.00 0.00 H new ATOM 0 HG13 ILE B 108 -3.027 7.030 5.154 1.00 0.00 H new ATOM 0 HG21 ILE B 108 -0.688 6.427 4.570 1.00 0.00 H new ATOM 0 HG22 ILE B 108 0.675 7.381 5.201 1.00 0.00 H new ATOM 0 HG23 ILE B 108 -0.167 6.224 6.259 1.00 0.00 H new ATOM 0 HD11 ILE B 108 -3.851 6.099 7.251 1.00 0.00 H new ATOM 0 HD12 ILE B 108 -2.174 5.581 6.955 1.00 0.00 H new ATOM 0 HD13 ILE B 108 -2.513 6.867 8.137 1.00 0.00 H new ATOM 942 N ASP B 109 -2.009 10.764 6.613 1.00 0.00 N ATOM 943 CA ASP B 109 -3.066 11.736 6.748 1.00 0.00 C ATOM 944 C ASP B 109 -4.389 11.018 6.961 1.00 0.00 C ATOM 945 O ASP B 109 -4.854 10.307 6.071 1.00 0.00 O ATOM 946 CB ASP B 109 -3.113 12.608 5.505 1.00 0.00 C ATOM 947 CG ASP B 109 -1.853 13.453 5.322 1.00 0.00 C ATOM 948 OD1 ASP B 109 -0.852 12.926 4.774 1.00 0.00 O ATOM 949 OD2 ASP B 109 -1.844 14.634 5.718 1.00 0.00 O ATOM 0 H ASP B 109 -1.449 10.874 5.767 1.00 0.00 H new ATOM 0 HA ASP B 109 -2.878 12.375 7.610 1.00 0.00 H new ATOM 0 HB2 ASP B 109 -3.250 11.975 4.628 1.00 0.00 H new ATOM 0 HB3 ASP B 109 -3.980 13.266 5.562 1.00 0.00 H new ATOM 954 N ASP B 110 -4.999 11.205 8.121 1.00 0.00 N ATOM 955 CA ASP B 110 -6.218 10.486 8.506 1.00 0.00 C ATOM 956 C ASP B 110 -7.336 10.725 7.493 1.00 0.00 C ATOM 957 O ASP B 110 -8.218 9.892 7.328 1.00 0.00 O ATOM 958 CB ASP B 110 -6.673 10.920 9.911 1.00 0.00 C ATOM 959 CG ASP B 110 -6.798 12.424 10.055 1.00 0.00 C ATOM 960 OD1 ASP B 110 -5.800 13.085 10.396 1.00 0.00 O ATOM 961 OD2 ASP B 110 -7.910 12.958 9.843 1.00 0.00 O ATOM 0 H ASP B 110 -4.667 11.860 8.829 1.00 0.00 H new ATOM 0 HA ASP B 110 -5.993 9.420 8.521 1.00 0.00 H new ATOM 0 HB2 ASP B 110 -7.635 10.458 10.134 1.00 0.00 H new ATOM 0 HB3 ASP B 110 -5.962 10.548 10.648 1.00 0.00 H new ATOM 966 N GLU B 111 -7.288 11.850 6.808 1.00 0.00 N ATOM 967 CA GLU B 111 -8.252 12.161 5.750 1.00 0.00 C ATOM 968 C GLU B 111 -8.087 11.187 4.574 1.00 0.00 C ATOM 969 O GLU B 111 -9.071 10.728 4.010 1.00 0.00 O ATOM 970 CB GLU B 111 -8.082 13.604 5.276 1.00 0.00 C ATOM 971 CG GLU B 111 -6.664 13.968 4.807 1.00 0.00 C ATOM 972 CD GLU B 111 -6.571 15.362 4.229 1.00 0.00 C ATOM 973 OE1 GLU B 111 -6.813 16.346 4.958 1.00 0.00 O ATOM 974 OE2 GLU B 111 -6.246 15.493 3.031 1.00 0.00 O ATOM 0 H GLU B 111 -6.588 12.576 6.961 1.00 0.00 H new ATOM 0 HA GLU B 111 -9.258 12.049 6.155 1.00 0.00 H new ATOM 0 HB2 GLU B 111 -8.778 13.787 4.457 1.00 0.00 H new ATOM 0 HB3 GLU B 111 -8.363 14.274 6.089 1.00 0.00 H new ATOM 0 HG2 GLU B 111 -5.976 13.883 5.648 1.00 0.00 H new ATOM 0 HG3 GLU B 111 -6.340 13.247 4.056 1.00 0.00 H new ATOM 981 N LEU B 112 -6.851 10.870 4.257 1.00 0.00 N ATOM 982 CA LEU B 112 -6.526 10.006 3.126 1.00 0.00 C ATOM 983 C LEU B 112 -6.833 8.569 3.507 1.00 0.00 C ATOM 984 O LEU B 112 -7.339 7.787 2.707 1.00 0.00 O ATOM 985 CB LEU B 112 -5.054 10.157 2.756 1.00 0.00 C ATOM 986 CG LEU B 112 -4.554 9.269 1.588 1.00 0.00 C ATOM 987 CD1 LEU B 112 -5.208 9.681 0.269 1.00 0.00 C ATOM 988 CD2 LEU B 112 -3.036 9.303 1.512 1.00 0.00 C ATOM 0 H LEU B 112 -6.036 11.201 4.773 1.00 0.00 H new ATOM 0 HA LEU B 112 -7.124 10.289 2.260 1.00 0.00 H new ATOM 0 HB2 LEU B 112 -4.869 11.200 2.498 1.00 0.00 H new ATOM 0 HB3 LEU B 112 -4.453 9.935 3.638 1.00 0.00 H new ATOM 0 HG LEU B 112 -4.850 8.237 1.778 1.00 0.00 H new ATOM 0 HD11 LEU B 112 -4.840 9.043 -0.534 1.00 0.00 H new ATOM 0 HD12 LEU B 112 -6.290 9.575 0.351 1.00 0.00 H new ATOM 0 HD13 LEU B 112 -4.961 10.720 0.049 1.00 0.00 H new ATOM 0 HD21 LEU B 112 -2.699 8.675 0.687 1.00 0.00 H new ATOM 0 HD22 LEU B 112 -2.703 10.328 1.348 1.00 0.00 H new ATOM 0 HD23 LEU B 112 -2.616 8.931 2.447 1.00 0.00 H new ATOM 1000 N LYS B 113 -6.501 8.234 4.747 1.00 0.00 N ATOM 1001 CA LYS B 113 -6.814 6.948 5.349 1.00 0.00 C ATOM 1002 C LYS B 113 -8.283 6.598 5.130 1.00 0.00 C ATOM 1003 O LYS B 113 -8.620 5.480 4.737 1.00 0.00 O ATOM 1004 CB LYS B 113 -6.505 6.985 6.834 1.00 0.00 C ATOM 1005 CG LYS B 113 -7.115 5.836 7.624 1.00 0.00 C ATOM 1006 CD LYS B 113 -7.387 6.220 9.073 1.00 0.00 C ATOM 1007 CE LYS B 113 -8.122 5.132 9.843 1.00 0.00 C ATOM 1008 NZ LYS B 113 -8.394 5.544 11.243 1.00 0.00 N ATOM 0 H LYS B 113 -5.997 8.862 5.373 1.00 0.00 H new ATOM 0 HA LYS B 113 -6.201 6.182 4.874 1.00 0.00 H new ATOM 0 HB2 LYS B 113 -5.424 6.971 6.970 1.00 0.00 H new ATOM 0 HB3 LYS B 113 -6.866 7.927 7.246 1.00 0.00 H new ATOM 0 HG2 LYS B 113 -8.046 5.525 7.151 1.00 0.00 H new ATOM 0 HG3 LYS B 113 -6.442 4.979 7.596 1.00 0.00 H new ATOM 0 HD2 LYS B 113 -6.442 6.436 9.571 1.00 0.00 H new ATOM 0 HD3 LYS B 113 -7.976 7.137 9.097 1.00 0.00 H new ATOM 0 HE2 LYS B 113 -9.062 4.902 9.341 1.00 0.00 H new ATOM 0 HE3 LYS B 113 -7.527 4.218 9.841 1.00 0.00 H new ATOM 0 HZ1 LYS B 113 -8.896 4.780 11.739 1.00 0.00 H new ATOM 0 HZ2 LYS B 113 -7.495 5.740 11.728 1.00 0.00 H new ATOM 0 HZ3 LYS B 113 -8.982 6.402 11.244 1.00 0.00 H new ATOM 1022 N ALA B 114 -9.161 7.542 5.410 1.00 0.00 N ATOM 1023 CA ALA B 114 -10.608 7.347 5.286 1.00 0.00 C ATOM 1024 C ALA B 114 -11.002 6.910 3.872 1.00 0.00 C ATOM 1025 O ALA B 114 -11.736 5.936 3.704 1.00 0.00 O ATOM 1026 CB ALA B 114 -11.348 8.621 5.685 1.00 0.00 C ATOM 0 H ALA B 114 -8.898 8.473 5.732 1.00 0.00 H new ATOM 0 HA ALA B 114 -10.897 6.545 5.965 1.00 0.00 H new ATOM 0 HB1 ALA B 114 -12.422 8.463 5.589 1.00 0.00 H new ATOM 0 HB2 ALA B 114 -11.109 8.872 6.719 1.00 0.00 H new ATOM 0 HB3 ALA B 114 -11.042 9.439 5.033 1.00 0.00 H new ATOM 1032 N ARG B 115 -10.513 7.613 2.857 1.00 0.00 N ATOM 1033 CA ARG B 115 -10.887 7.339 1.476 1.00 0.00 C ATOM 1034 C ARG B 115 -10.268 6.031 0.966 1.00 0.00 C ATOM 1035 O ARG B 115 -10.908 5.269 0.252 1.00 0.00 O ATOM 1036 CB ARG B 115 -10.517 8.504 0.533 1.00 0.00 C ATOM 1037 CG ARG B 115 -11.409 9.746 0.692 1.00 0.00 C ATOM 1038 CD ARG B 115 -11.270 10.397 2.054 1.00 0.00 C ATOM 1039 NE ARG B 115 -12.279 11.449 2.268 1.00 0.00 N ATOM 1040 CZ ARG B 115 -12.014 12.735 2.514 1.00 0.00 C ATOM 1041 NH1 ARG B 115 -10.749 13.188 2.479 1.00 0.00 N ATOM 1042 NH2 ARG B 115 -13.010 13.551 2.773 1.00 0.00 N ATOM 0 H ARG B 115 -9.852 8.382 2.967 1.00 0.00 H new ATOM 0 HA ARG B 115 -11.972 7.230 1.470 1.00 0.00 H new ATOM 0 HB2 ARG B 115 -9.480 8.789 0.714 1.00 0.00 H new ATOM 0 HB3 ARG B 115 -10.577 8.156 -0.498 1.00 0.00 H new ATOM 0 HG2 ARG B 115 -11.155 10.472 -0.080 1.00 0.00 H new ATOM 0 HG3 ARG B 115 -12.450 9.463 0.534 1.00 0.00 H new ATOM 0 HD2 ARG B 115 -11.367 9.638 2.830 1.00 0.00 H new ATOM 0 HD3 ARG B 115 -10.273 10.826 2.151 1.00 0.00 H new ATOM 0 HE ARG B 115 -13.260 11.173 2.225 1.00 0.00 H new ATOM 0 HH11 ARG B 115 -9.984 12.549 2.264 1.00 0.00 H new ATOM 0 HH12 ARG B 115 -10.554 14.171 2.668 1.00 0.00 H new ATOM 0 HH21 ARG B 115 -13.968 13.200 2.784 1.00 0.00 H new ATOM 0 HH22 ARG B 115 -12.826 14.536 2.963 1.00 0.00 H new ATOM 1056 N SER B 116 -9.024 5.761 1.357 1.00 0.00 N ATOM 1057 CA SER B 116 -8.320 4.570 0.935 1.00 0.00 C ATOM 1058 C SER B 116 -9.009 3.322 1.476 1.00 0.00 C ATOM 1059 O SER B 116 -9.377 2.422 0.716 1.00 0.00 O ATOM 1060 CB SER B 116 -6.872 4.624 1.418 1.00 0.00 C ATOM 1061 OG SER B 116 -6.796 5.010 2.766 1.00 0.00 O ATOM 0 H SER B 116 -8.483 6.366 1.975 1.00 0.00 H new ATOM 0 HA SER B 116 -8.331 4.524 -0.154 1.00 0.00 H new ATOM 0 HB2 SER B 116 -6.408 3.646 1.291 1.00 0.00 H new ATOM 0 HB3 SER B 116 -6.308 5.326 0.804 1.00 0.00 H new ATOM 0 HG SER B 116 -6.828 5.987 2.829 1.00 0.00 H new ATOM 1067 N TYR B 117 -9.191 3.285 2.798 1.00 0.00 N ATOM 1068 CA TYR B 117 -9.858 2.174 3.460 1.00 0.00 C ATOM 1069 C TYR B 117 -11.269 1.993 2.913 1.00 0.00 C ATOM 1070 O TYR B 117 -11.748 0.867 2.750 1.00 0.00 O ATOM 1071 CB TYR B 117 -9.882 2.368 4.982 1.00 0.00 C ATOM 1072 CG TYR B 117 -8.592 1.952 5.666 1.00 0.00 C ATOM 1073 CD1 TYR B 117 -7.381 2.504 5.302 1.00 0.00 C ATOM 1074 CD2 TYR B 117 -8.610 0.979 6.667 1.00 0.00 C ATOM 1075 CE1 TYR B 117 -6.204 2.114 5.915 1.00 0.00 C ATOM 1076 CE2 TYR B 117 -7.438 0.586 7.280 1.00 0.00 C ATOM 1077 CZ TYR B 117 -6.240 1.153 6.905 1.00 0.00 C ATOM 1078 OH TYR B 117 -5.070 0.755 7.527 1.00 0.00 O ATOM 0 H TYR B 117 -8.881 4.022 3.432 1.00 0.00 H new ATOM 0 HA TYR B 117 -9.290 1.267 3.251 1.00 0.00 H new ATOM 0 HB2 TYR B 117 -10.080 3.417 5.204 1.00 0.00 H new ATOM 0 HB3 TYR B 117 -10.708 1.793 5.401 1.00 0.00 H new ATOM 0 HD1 TYR B 117 -7.352 3.254 4.525 1.00 0.00 H new ATOM 0 HD2 TYR B 117 -9.547 0.531 6.963 1.00 0.00 H new ATOM 0 HE1 TYR B 117 -5.264 2.558 5.621 1.00 0.00 H new ATOM 0 HE2 TYR B 117 -7.460 -0.167 8.054 1.00 0.00 H new ATOM 0 HH TYR B 117 -5.273 0.072 8.200 1.00 0.00 H new ATOM 1088 N ALA B 118 -11.940 3.111 2.609 1.00 0.00 N ATOM 1089 CA ALA B 118 -13.258 3.068 2.024 1.00 0.00 C ATOM 1090 C ALA B 118 -13.230 2.324 0.693 1.00 0.00 C ATOM 1091 O ALA B 118 -14.077 1.480 0.425 1.00 0.00 O ATOM 1092 CB ALA B 118 -13.796 4.492 1.828 1.00 0.00 C ATOM 0 H ALA B 118 -11.579 4.052 2.764 1.00 0.00 H new ATOM 0 HA ALA B 118 -13.921 2.532 2.703 1.00 0.00 H new ATOM 0 HB1 ALA B 118 -14.791 4.447 1.386 1.00 0.00 H new ATOM 0 HB2 ALA B 118 -13.850 4.997 2.793 1.00 0.00 H new ATOM 0 HB3 ALA B 118 -13.129 5.045 1.166 1.00 0.00 H new ATOM 1098 N ALA B 119 -12.237 2.641 -0.128 1.00 0.00 N ATOM 1099 CA ALA B 119 -12.101 2.037 -1.457 1.00 0.00 C ATOM 1100 C ALA B 119 -11.900 0.541 -1.363 1.00 0.00 C ATOM 1101 O ALA B 119 -12.575 -0.238 -2.034 1.00 0.00 O ATOM 1102 CB ALA B 119 -10.936 2.692 -2.192 1.00 0.00 C ATOM 0 H ALA B 119 -11.508 3.316 0.101 1.00 0.00 H new ATOM 0 HA ALA B 119 -13.022 2.206 -2.015 1.00 0.00 H new ATOM 0 HB1 ALA B 119 -10.832 2.245 -3.181 1.00 0.00 H new ATOM 0 HB2 ALA B 119 -11.125 3.761 -2.295 1.00 0.00 H new ATOM 0 HB3 ALA B 119 -10.017 2.539 -1.626 1.00 0.00 H new ATOM 1108 N LEU B 120 -10.940 0.125 -0.541 1.00 0.00 N ATOM 1109 CA LEU B 120 -10.571 -1.280 -0.459 1.00 0.00 C ATOM 1110 C LEU B 120 -11.669 -2.111 0.203 1.00 0.00 C ATOM 1111 O LEU B 120 -11.849 -3.280 -0.142 1.00 0.00 O ATOM 1112 CB LEU B 120 -9.199 -1.440 0.259 1.00 0.00 C ATOM 1113 CG LEU B 120 -9.122 -0.961 1.718 1.00 0.00 C ATOM 1114 CD1 LEU B 120 -9.626 -2.023 2.690 1.00 0.00 C ATOM 1115 CD2 LEU B 120 -7.706 -0.516 2.080 1.00 0.00 C ATOM 0 H LEU B 120 -10.407 0.740 0.074 1.00 0.00 H new ATOM 0 HA LEU B 120 -10.461 -1.666 -1.473 1.00 0.00 H new ATOM 0 HB2 LEU B 120 -8.922 -2.494 0.232 1.00 0.00 H new ATOM 0 HB3 LEU B 120 -8.449 -0.898 -0.317 1.00 0.00 H new ATOM 0 HG LEU B 120 -9.781 -0.097 1.808 1.00 0.00 H new ATOM 0 HD11 LEU B 120 -9.555 -1.646 3.710 1.00 0.00 H new ATOM 0 HD12 LEU B 120 -10.665 -2.261 2.462 1.00 0.00 H new ATOM 0 HD13 LEU B 120 -9.018 -2.923 2.593 1.00 0.00 H new ATOM 0 HD21 LEU B 120 -7.683 -0.183 3.118 1.00 0.00 H new ATOM 0 HD22 LEU B 120 -7.018 -1.352 1.952 1.00 0.00 H new ATOM 0 HD23 LEU B 120 -7.405 0.305 1.429 1.00 0.00 H new ATOM 1127 N GLU B 121 -12.435 -1.514 1.124 1.00 0.00 N ATOM 1128 CA GLU B 121 -13.543 -2.240 1.763 1.00 0.00 C ATOM 1129 C GLU B 121 -14.719 -2.314 0.799 1.00 0.00 C ATOM 1130 O GLU B 121 -15.596 -3.174 0.951 1.00 0.00 O ATOM 1131 CB GLU B 121 -13.948 -1.589 3.094 1.00 0.00 C ATOM 1132 CG GLU B 121 -14.586 -0.189 2.990 1.00 0.00 C ATOM 1133 CD GLU B 121 -16.078 -0.240 2.698 1.00 0.00 C ATOM 1134 OE1 GLU B 121 -16.822 -0.836 3.483 1.00 0.00 O ATOM 1135 OE2 GLU B 121 -16.512 0.346 1.684 1.00 0.00 O ATOM 0 H GLU B 121 -12.314 -0.552 1.439 1.00 0.00 H new ATOM 0 HA GLU B 121 -13.214 -3.252 1.997 1.00 0.00 H new ATOM 0 HB2 GLU B 121 -14.650 -2.251 3.601 1.00 0.00 H new ATOM 0 HB3 GLU B 121 -13.063 -1.518 3.726 1.00 0.00 H new ATOM 0 HG2 GLU B 121 -14.421 0.350 3.923 1.00 0.00 H new ATOM 0 HG3 GLU B 121 -14.086 0.375 2.203 1.00 0.00 H new ATOM 1142 N LYS B 122 -14.727 -1.428 -0.194 1.00 0.00 N ATOM 1143 CA LYS B 122 -15.738 -1.463 -1.248 1.00 0.00 C ATOM 1144 C LYS B 122 -15.499 -2.715 -2.081 1.00 0.00 C ATOM 1145 O LYS B 122 -16.412 -3.491 -2.368 1.00 0.00 O ATOM 1146 CB LYS B 122 -15.629 -0.220 -2.138 1.00 0.00 C ATOM 1147 CG LYS B 122 -16.929 0.167 -2.834 1.00 0.00 C ATOM 1148 CD LYS B 122 -18.007 0.579 -1.830 1.00 0.00 C ATOM 1149 CE LYS B 122 -17.798 1.992 -1.279 1.00 0.00 C ATOM 1150 NZ LYS B 122 -16.573 2.109 -0.425 1.00 0.00 N ATOM 0 H LYS B 122 -14.044 -0.676 -0.291 1.00 0.00 H new ATOM 0 HA LYS B 122 -16.735 -1.477 -0.808 1.00 0.00 H new ATOM 0 HB2 LYS B 122 -15.292 0.620 -1.530 1.00 0.00 H new ATOM 0 HB3 LYS B 122 -14.863 -0.394 -2.894 1.00 0.00 H new ATOM 0 HG2 LYS B 122 -16.741 0.989 -3.524 1.00 0.00 H new ATOM 0 HG3 LYS B 122 -17.288 -0.673 -3.429 1.00 0.00 H new ATOM 0 HD2 LYS B 122 -18.984 0.522 -2.310 1.00 0.00 H new ATOM 0 HD3 LYS B 122 -18.016 -0.131 -1.003 1.00 0.00 H new ATOM 0 HE2 LYS B 122 -17.724 2.693 -2.110 1.00 0.00 H new ATOM 0 HE3 LYS B 122 -18.671 2.282 -0.695 1.00 0.00 H new ATOM 0 HZ1 LYS B 122 -16.695 2.889 0.252 1.00 0.00 H new ATOM 0 HZ2 LYS B 122 -16.425 1.220 0.094 1.00 0.00 H new ATOM 0 HZ3 LYS B 122 -15.747 2.300 -1.027 1.00 0.00 H new ATOM 1164 N MET B 123 -14.238 -2.912 -2.437 1.00 0.00 N ATOM 1165 CA MET B 123 -13.796 -4.100 -3.161 1.00 0.00 C ATOM 1166 C MET B 123 -13.836 -5.326 -2.240 1.00 0.00 C ATOM 1167 O MET B 123 -13.692 -6.456 -2.703 1.00 0.00 O ATOM 1168 CB MET B 123 -12.385 -3.892 -3.706 1.00 0.00 C ATOM 1169 CG MET B 123 -12.261 -2.720 -4.668 1.00 0.00 C ATOM 1170 SD MET B 123 -10.613 -2.581 -5.367 1.00 0.00 S ATOM 1171 CE MET B 123 -9.615 -2.485 -3.891 1.00 0.00 C ATOM 0 H MET B 123 -13.488 -2.251 -2.232 1.00 0.00 H new ATOM 0 HA MET B 123 -14.471 -4.271 -4.000 1.00 0.00 H new ATOM 0 HB2 MET B 123 -11.703 -3.737 -2.870 1.00 0.00 H new ATOM 0 HB3 MET B 123 -12.065 -4.802 -4.214 1.00 0.00 H new ATOM 0 HG2 MET B 123 -12.986 -2.836 -5.474 1.00 0.00 H new ATOM 0 HG3 MET B 123 -12.510 -1.796 -4.146 1.00 0.00 H new ATOM 0 HE1 MET B 123 -8.593 -2.219 -4.160 1.00 0.00 H new ATOM 0 HE2 MET B 123 -10.024 -1.726 -3.224 1.00 0.00 H new ATOM 0 HE3 MET B 123 -9.617 -3.451 -3.387 1.00 0.00 H new ATOM 1181 N GLY B 124 -14.030 -5.073 -0.946 1.00 0.00 N ATOM 1182 CA GLY B 124 -14.155 -6.155 0.025 1.00 0.00 C ATOM 1183 C GLY B 124 -12.819 -6.796 0.376 1.00 0.00 C ATOM 1184 O GLY B 124 -12.778 -7.953 0.795 1.00 0.00 O ATOM 0 H GLY B 124 -14.103 -4.136 -0.550 1.00 0.00 H new ATOM 0 HA2 GLY B 124 -14.616 -5.769 0.934 1.00 0.00 H new ATOM 0 HA3 GLY B 124 -14.824 -6.918 -0.373 1.00 0.00 H new ATOM 1188 N VAL B 125 -11.745 -6.055 0.200 1.00 0.00 N ATOM 1189 CA VAL B 125 -10.402 -6.563 0.493 1.00 0.00 C ATOM 1190 C VAL B 125 -9.940 -6.056 1.859 1.00 0.00 C ATOM 1191 O VAL B 125 -10.255 -4.929 2.244 1.00 0.00 O ATOM 1192 CB VAL B 125 -9.376 -6.112 -0.582 1.00 0.00 C ATOM 1193 CG1 VAL B 125 -8.038 -6.835 -0.409 1.00 0.00 C ATOM 1194 CG2 VAL B 125 -9.932 -6.308 -1.983 1.00 0.00 C ATOM 0 H VAL B 125 -11.766 -5.095 -0.145 1.00 0.00 H new ATOM 0 HA VAL B 125 -10.454 -7.652 0.491 1.00 0.00 H new ATOM 0 HB VAL B 125 -9.194 -5.046 -0.443 1.00 0.00 H new ATOM 0 HG11 VAL B 125 -7.341 -6.498 -1.176 1.00 0.00 H new ATOM 0 HG12 VAL B 125 -7.629 -6.612 0.576 1.00 0.00 H new ATOM 0 HG13 VAL B 125 -8.190 -7.910 -0.504 1.00 0.00 H new ATOM 0 HG21 VAL B 125 -9.193 -5.984 -2.716 1.00 0.00 H new ATOM 0 HG22 VAL B 125 -10.161 -7.362 -2.139 1.00 0.00 H new ATOM 0 HG23 VAL B 125 -10.841 -5.718 -2.099 1.00 0.00 H new ATOM 1204 N THR B 126 -9.195 -6.894 2.572 1.00 0.00 N ATOM 1205 CA THR B 126 -8.634 -6.512 3.858 1.00 0.00 C ATOM 1206 C THR B 126 -7.487 -5.519 3.633 1.00 0.00 C ATOM 1207 O THR B 126 -6.661 -5.712 2.758 1.00 0.00 O ATOM 1208 CB THR B 126 -8.101 -7.778 4.578 1.00 0.00 C ATOM 1209 OG1 THR B 126 -9.170 -8.708 4.810 1.00 0.00 O ATOM 1210 CG2 THR B 126 -7.428 -7.435 5.894 1.00 0.00 C ATOM 0 H THR B 126 -8.967 -7.844 2.278 1.00 0.00 H new ATOM 0 HA THR B 126 -9.401 -6.043 4.474 1.00 0.00 H new ATOM 0 HB THR B 126 -7.356 -8.234 3.926 1.00 0.00 H new ATOM 0 HG1 THR B 126 -8.819 -9.503 5.263 1.00 0.00 H new ATOM 0 HG21 THR B 126 -7.068 -8.348 6.368 1.00 0.00 H new ATOM 0 HG22 THR B 126 -6.587 -6.767 5.709 1.00 0.00 H new ATOM 0 HG23 THR B 126 -8.145 -6.943 6.552 1.00 0.00 H new ATOM 1218 N PRO B 127 -7.435 -4.423 4.427 1.00 0.00 N ATOM 1219 CA PRO B 127 -6.375 -3.421 4.298 1.00 0.00 C ATOM 1220 C PRO B 127 -4.992 -4.051 4.407 1.00 0.00 C ATOM 1221 O PRO B 127 -4.083 -3.711 3.657 1.00 0.00 O ATOM 1222 CB PRO B 127 -6.626 -2.443 5.462 1.00 0.00 C ATOM 1223 CG PRO B 127 -7.578 -3.148 6.373 1.00 0.00 C ATOM 1224 CD PRO B 127 -8.387 -4.073 5.498 1.00 0.00 C ATOM 0 HA PRO B 127 -6.397 -2.929 3.326 1.00 0.00 H new ATOM 0 HB2 PRO B 127 -5.697 -2.198 5.977 1.00 0.00 H new ATOM 0 HB3 PRO B 127 -7.048 -1.504 5.103 1.00 0.00 H new ATOM 0 HG2 PRO B 127 -7.042 -3.707 7.140 1.00 0.00 H new ATOM 0 HG3 PRO B 127 -8.223 -2.437 6.889 1.00 0.00 H new ATOM 0 HD2 PRO B 127 -8.724 -4.954 6.044 1.00 0.00 H new ATOM 0 HD3 PRO B 127 -9.277 -3.582 5.104 1.00 0.00 H new ATOM 1232 N SER B 128 -4.863 -5.002 5.322 1.00 0.00 N ATOM 1233 CA SER B 128 -3.603 -5.711 5.518 1.00 0.00 C ATOM 1234 C SER B 128 -3.154 -6.414 4.232 1.00 0.00 C ATOM 1235 O SER B 128 -1.963 -6.614 3.994 1.00 0.00 O ATOM 1236 CB SER B 128 -3.767 -6.728 6.662 1.00 0.00 C ATOM 1237 OG SER B 128 -4.365 -6.116 7.796 1.00 0.00 O ATOM 0 H SER B 128 -5.616 -5.302 5.942 1.00 0.00 H new ATOM 0 HA SER B 128 -2.830 -4.988 5.781 1.00 0.00 H new ATOM 0 HB2 SER B 128 -4.382 -7.564 6.327 1.00 0.00 H new ATOM 0 HB3 SER B 128 -2.794 -7.137 6.934 1.00 0.00 H new ATOM 0 HG SER B 128 -4.463 -6.778 8.512 1.00 0.00 H new ATOM 1243 N GLU B 129 -4.130 -6.765 3.395 1.00 0.00 N ATOM 1244 CA GLU B 129 -3.842 -7.456 2.154 1.00 0.00 C ATOM 1245 C GLU B 129 -3.434 -6.474 1.066 1.00 0.00 C ATOM 1246 O GLU B 129 -2.441 -6.707 0.370 1.00 0.00 O ATOM 1247 CB GLU B 129 -5.075 -8.263 1.689 1.00 0.00 C ATOM 1248 CG GLU B 129 -5.523 -9.313 2.673 1.00 0.00 C ATOM 1249 CD GLU B 129 -6.653 -10.171 2.122 1.00 0.00 C ATOM 1250 OE1 GLU B 129 -7.783 -9.651 2.011 1.00 0.00 O ATOM 1251 OE2 GLU B 129 -6.409 -11.349 1.769 1.00 0.00 O ATOM 0 H GLU B 129 -5.120 -6.580 3.559 1.00 0.00 H new ATOM 0 HA GLU B 129 -3.012 -8.139 2.336 1.00 0.00 H new ATOM 0 HB2 GLU B 129 -5.900 -7.574 1.506 1.00 0.00 H new ATOM 0 HB3 GLU B 129 -4.845 -8.744 0.738 1.00 0.00 H new ATOM 0 HG2 GLU B 129 -4.678 -9.951 2.932 1.00 0.00 H new ATOM 0 HG3 GLU B 129 -5.851 -8.830 3.593 1.00 0.00 H new ATOM 1258 N ALA B 130 -4.175 -5.391 0.910 1.00 0.00 N ATOM 1259 CA ALA B 130 -3.851 -4.367 -0.084 1.00 0.00 C ATOM 1260 C ALA B 130 -2.440 -3.800 0.146 1.00 0.00 C ATOM 1261 O ALA B 130 -1.700 -3.545 -0.805 1.00 0.00 O ATOM 1262 CB ALA B 130 -4.894 -3.246 -0.066 1.00 0.00 C ATOM 0 H ALA B 130 -5.011 -5.192 1.459 1.00 0.00 H new ATOM 0 HA ALA B 130 -3.868 -4.836 -1.068 1.00 0.00 H new ATOM 0 HB1 ALA B 130 -4.634 -2.495 -0.812 1.00 0.00 H new ATOM 0 HB2 ALA B 130 -5.876 -3.659 -0.294 1.00 0.00 H new ATOM 0 HB3 ALA B 130 -4.915 -2.784 0.921 1.00 0.00 H new ATOM 1268 N LEU B 131 -2.071 -3.624 1.417 1.00 0.00 N ATOM 1269 CA LEU B 131 -0.728 -3.147 1.739 1.00 0.00 C ATOM 1270 C LEU B 131 0.303 -4.250 1.496 1.00 0.00 C ATOM 1271 O LEU B 131 1.447 -3.971 1.175 1.00 0.00 O ATOM 1272 CB LEU B 131 -0.663 -2.666 3.203 1.00 0.00 C ATOM 1273 CG LEU B 131 -1.185 -1.241 3.491 1.00 0.00 C ATOM 1274 CD1 LEU B 131 -0.435 -0.214 2.642 1.00 0.00 C ATOM 1275 CD2 LEU B 131 -2.688 -1.151 3.257 1.00 0.00 C ATOM 0 H LEU B 131 -2.670 -3.801 2.223 1.00 0.00 H new ATOM 0 HA LEU B 131 -0.496 -2.305 1.087 1.00 0.00 H new ATOM 0 HB2 LEU B 131 -1.230 -3.366 3.816 1.00 0.00 H new ATOM 0 HB3 LEU B 131 0.374 -2.721 3.533 1.00 0.00 H new ATOM 0 HG LEU B 131 -1.000 -1.016 4.541 1.00 0.00 H new ATOM 0 HD11 LEU B 131 -0.816 0.784 2.858 1.00 0.00 H new ATOM 0 HD12 LEU B 131 0.629 -0.255 2.877 1.00 0.00 H new ATOM 0 HD13 LEU B 131 -0.583 -0.438 1.586 1.00 0.00 H new ATOM 0 HD21 LEU B 131 -3.029 -0.137 3.467 1.00 0.00 H new ATOM 0 HD22 LEU B 131 -2.910 -1.401 2.220 1.00 0.00 H new ATOM 0 HD23 LEU B 131 -3.201 -1.850 3.917 1.00 0.00 H new ATOM 1287 N ARG B 132 -0.130 -5.514 1.627 1.00 0.00 N ATOM 1288 CA ARG B 132 0.764 -6.642 1.358 1.00 0.00 C ATOM 1289 C ARG B 132 1.273 -6.603 -0.082 1.00 0.00 C ATOM 1290 O ARG B 132 2.477 -6.628 -0.325 1.00 0.00 O ATOM 1291 CB ARG B 132 0.062 -7.990 1.612 1.00 0.00 C ATOM 1292 CG ARG B 132 0.758 -9.187 0.942 1.00 0.00 C ATOM 1293 CD ARG B 132 -0.026 -10.477 1.079 1.00 0.00 C ATOM 1294 NE ARG B 132 0.274 -11.168 2.336 1.00 0.00 N ATOM 1295 CZ ARG B 132 -0.648 -11.699 3.129 1.00 0.00 C ATOM 1296 NH1 ARG B 132 -1.936 -11.541 2.850 1.00 0.00 N ATOM 1297 NH2 ARG B 132 -0.276 -12.413 4.183 1.00 0.00 N ATOM 0 H ARG B 132 -1.074 -5.774 1.912 1.00 0.00 H new ATOM 0 HA ARG B 132 1.608 -6.551 2.042 1.00 0.00 H new ATOM 0 HB2 ARG B 132 0.011 -8.166 2.687 1.00 0.00 H new ATOM 0 HB3 ARG B 132 -0.964 -7.929 1.250 1.00 0.00 H new ATOM 0 HG2 ARG B 132 0.907 -8.969 -0.115 1.00 0.00 H new ATOM 0 HG3 ARG B 132 1.746 -9.320 1.383 1.00 0.00 H new ATOM 0 HD2 ARG B 132 -1.093 -10.260 1.030 1.00 0.00 H new ATOM 0 HD3 ARG B 132 0.205 -11.133 0.240 1.00 0.00 H new ATOM 0 HE ARG B 132 1.251 -11.246 2.619 1.00 0.00 H new ATOM 0 HH11 ARG B 132 -2.218 -11.011 2.025 1.00 0.00 H new ATOM 0 HH12 ARG B 132 -2.644 -11.950 3.460 1.00 0.00 H new ATOM 0 HH21 ARG B 132 0.715 -12.552 4.381 1.00 0.00 H new ATOM 0 HH22 ARG B 132 -0.981 -12.823 4.796 1.00 0.00 H new ATOM 1311 N LEU B 133 0.331 -6.514 -1.032 1.00 0.00 N ATOM 1312 CA LEU B 133 0.714 -6.562 -2.453 1.00 0.00 C ATOM 1313 C LEU B 133 1.548 -5.351 -2.822 1.00 0.00 C ATOM 1314 O LEU B 133 2.323 -5.391 -3.791 1.00 0.00 O ATOM 1315 CB LEU B 133 -0.526 -6.670 -3.355 1.00 0.00 C ATOM 1316 CG LEU B 133 -1.687 -5.734 -3.024 1.00 0.00 C ATOM 1317 CD1 LEU B 133 -1.774 -4.560 -4.000 1.00 0.00 C ATOM 1318 CD2 LEU B 133 -2.985 -6.533 -2.979 1.00 0.00 C ATOM 0 H LEU B 133 -0.668 -6.412 -0.854 1.00 0.00 H new ATOM 0 HA LEU B 133 1.320 -7.454 -2.611 1.00 0.00 H new ATOM 0 HB2 LEU B 133 -0.218 -6.483 -4.384 1.00 0.00 H new ATOM 0 HB3 LEU B 133 -0.891 -7.696 -3.313 1.00 0.00 H new ATOM 0 HG LEU B 133 -1.511 -5.295 -2.042 1.00 0.00 H new ATOM 0 HD11 LEU B 133 -2.614 -3.921 -3.726 1.00 0.00 H new ATOM 0 HD12 LEU B 133 -0.850 -3.983 -3.958 1.00 0.00 H new ATOM 0 HD13 LEU B 133 -1.920 -4.938 -5.012 1.00 0.00 H new ATOM 0 HD21 LEU B 133 -3.815 -5.866 -2.743 1.00 0.00 H new ATOM 0 HD22 LEU B 133 -3.159 -6.999 -3.949 1.00 0.00 H new ATOM 0 HD23 LEU B 133 -2.911 -7.305 -2.213 1.00 0.00 H new ATOM 1330 N MET B 134 1.402 -4.287 -2.052 1.00 0.00 N ATOM 1331 CA MET B 134 2.230 -3.101 -2.212 1.00 0.00 C ATOM 1332 C MET B 134 3.669 -3.437 -1.829 1.00 0.00 C ATOM 1333 O MET B 134 4.606 -3.117 -2.569 1.00 0.00 O ATOM 1334 CB MET B 134 1.707 -1.925 -1.377 1.00 0.00 C ATOM 1335 CG MET B 134 2.694 -0.764 -1.267 1.00 0.00 C ATOM 1336 SD MET B 134 4.050 -1.073 -0.132 1.00 0.00 S ATOM 1337 CE MET B 134 5.086 0.361 -0.430 1.00 0.00 C ATOM 0 H MET B 134 0.712 -4.219 -1.304 1.00 0.00 H new ATOM 0 HA MET B 134 2.192 -2.791 -3.256 1.00 0.00 H new ATOM 0 HB2 MET B 134 0.779 -1.561 -1.819 1.00 0.00 H new ATOM 0 HB3 MET B 134 1.465 -2.281 -0.376 1.00 0.00 H new ATOM 0 HG2 MET B 134 3.101 -0.550 -2.255 1.00 0.00 H new ATOM 0 HG3 MET B 134 2.157 0.128 -0.943 1.00 0.00 H new ATOM 0 HE1 MET B 134 5.670 0.580 0.464 1.00 0.00 H new ATOM 0 HE2 MET B 134 5.759 0.157 -1.262 1.00 0.00 H new ATOM 0 HE3 MET B 134 4.459 1.219 -0.673 1.00 0.00 H new ATOM 1347 N LEU B 135 3.816 -4.113 -0.693 1.00 0.00 N ATOM 1348 CA LEU B 135 5.141 -4.468 -0.196 1.00 0.00 C ATOM 1349 C LEU B 135 5.832 -5.416 -1.155 1.00 0.00 C ATOM 1350 O LEU B 135 7.063 -5.443 -1.257 1.00 0.00 O ATOM 1351 CB LEU B 135 5.055 -5.090 1.219 1.00 0.00 C ATOM 1352 CG LEU B 135 4.545 -4.155 2.324 1.00 0.00 C ATOM 1353 CD1 LEU B 135 4.608 -4.839 3.684 1.00 0.00 C ATOM 1354 CD2 LEU B 135 5.346 -2.850 2.338 1.00 0.00 C ATOM 0 H LEU B 135 3.043 -4.423 -0.105 1.00 0.00 H new ATOM 0 HA LEU B 135 5.732 -3.555 -0.127 1.00 0.00 H new ATOM 0 HB2 LEU B 135 4.401 -5.961 1.174 1.00 0.00 H new ATOM 0 HB3 LEU B 135 6.045 -5.449 1.500 1.00 0.00 H new ATOM 0 HG LEU B 135 3.503 -3.916 2.113 1.00 0.00 H new ATOM 0 HD11 LEU B 135 4.242 -4.157 4.451 1.00 0.00 H new ATOM 0 HD12 LEU B 135 3.988 -5.736 3.669 1.00 0.00 H new ATOM 0 HD13 LEU B 135 5.639 -5.114 3.905 1.00 0.00 H new ATOM 0 HD21 LEU B 135 4.969 -2.200 3.128 1.00 0.00 H new ATOM 0 HD22 LEU B 135 6.398 -3.071 2.520 1.00 0.00 H new ATOM 0 HD23 LEU B 135 5.242 -2.349 1.376 1.00 0.00 H new ATOM 1366 N GLU B 136 5.022 -6.197 -1.877 1.00 0.00 N ATOM 1367 CA GLU B 136 5.543 -7.078 -2.900 1.00 0.00 C ATOM 1368 C GLU B 136 6.142 -6.289 -4.060 1.00 0.00 C ATOM 1369 O GLU B 136 7.282 -6.560 -4.470 1.00 0.00 O ATOM 1370 CB GLU B 136 4.445 -8.021 -3.397 1.00 0.00 C ATOM 1371 CG GLU B 136 3.670 -8.699 -2.259 1.00 0.00 C ATOM 1372 CD GLU B 136 2.767 -9.819 -2.736 1.00 0.00 C ATOM 1373 OE1 GLU B 136 1.786 -9.554 -3.472 1.00 0.00 O ATOM 1374 OE2 GLU B 136 3.024 -10.989 -2.363 1.00 0.00 O ATOM 0 H GLU B 136 4.009 -6.230 -1.765 1.00 0.00 H new ATOM 0 HA GLU B 136 6.342 -7.673 -2.458 1.00 0.00 H new ATOM 0 HB2 GLU B 136 3.748 -7.460 -4.019 1.00 0.00 H new ATOM 0 HB3 GLU B 136 4.892 -8.787 -4.030 1.00 0.00 H new ATOM 0 HG2 GLU B 136 4.378 -9.097 -1.532 1.00 0.00 H new ATOM 0 HG3 GLU B 136 3.069 -7.951 -1.742 1.00 0.00 H new ATOM 1381 N TYR B 137 5.408 -5.294 -4.570 1.00 0.00 N ATOM 1382 CA TYR B 137 5.834 -4.577 -5.775 1.00 0.00 C ATOM 1383 C TYR B 137 7.071 -3.731 -5.490 1.00 0.00 C ATOM 1384 O TYR B 137 7.928 -3.573 -6.361 1.00 0.00 O ATOM 1385 CB TYR B 137 4.693 -3.729 -6.390 1.00 0.00 C ATOM 1386 CG TYR B 137 4.476 -2.335 -5.822 1.00 0.00 C ATOM 1387 CD1 TYR B 137 5.438 -1.345 -5.975 1.00 0.00 C ATOM 1388 CD2 TYR B 137 3.309 -2.001 -5.156 1.00 0.00 C ATOM 1389 CE1 TYR B 137 5.244 -0.073 -5.472 1.00 0.00 C ATOM 1390 CE2 TYR B 137 3.100 -0.727 -4.647 1.00 0.00 C ATOM 1391 CZ TYR B 137 4.073 0.232 -4.811 1.00 0.00 C ATOM 1392 OH TYR B 137 3.886 1.504 -4.325 1.00 0.00 O ATOM 0 H TYR B 137 4.526 -4.970 -4.172 1.00 0.00 H new ATOM 0 HA TYR B 137 6.098 -5.325 -6.522 1.00 0.00 H new ATOM 0 HB2 TYR B 137 4.883 -3.632 -7.459 1.00 0.00 H new ATOM 0 HB3 TYR B 137 3.762 -4.286 -6.281 1.00 0.00 H new ATOM 0 HD1 TYR B 137 6.355 -1.574 -6.497 1.00 0.00 H new ATOM 0 HD2 TYR B 137 2.542 -2.751 -5.029 1.00 0.00 H new ATOM 0 HE1 TYR B 137 6.008 0.681 -5.596 1.00 0.00 H new ATOM 0 HE2 TYR B 137 2.183 -0.491 -4.128 1.00 0.00 H new ATOM 0 HH TYR B 137 3.012 1.561 -3.886 1.00 0.00 H new ATOM 1402 N ILE B 138 7.161 -3.168 -4.288 1.00 0.00 N ATOM 1403 CA ILE B 138 8.322 -2.344 -3.920 1.00 0.00 C ATOM 1404 C ILE B 138 9.556 -3.228 -3.738 1.00 0.00 C ATOM 1405 O ILE B 138 10.662 -2.831 -4.101 1.00 0.00 O ATOM 1406 CB ILE B 138 8.077 -1.478 -2.648 1.00 0.00 C ATOM 1407 CG1 ILE B 138 9.394 -0.882 -2.107 1.00 0.00 C ATOM 1408 CG2 ILE B 138 7.368 -2.269 -1.556 1.00 0.00 C ATOM 1409 CD1 ILE B 138 10.081 0.102 -3.047 1.00 0.00 C ATOM 0 H ILE B 138 6.457 -3.262 -3.556 1.00 0.00 H new ATOM 0 HA ILE B 138 8.489 -1.646 -4.740 1.00 0.00 H new ATOM 0 HB ILE B 138 7.427 -0.656 -2.947 1.00 0.00 H new ATOM 0 HG12 ILE B 138 9.188 -0.378 -1.163 1.00 0.00 H new ATOM 0 HG13 ILE B 138 10.084 -1.698 -1.889 1.00 0.00 H new ATOM 0 HG21 ILE B 138 7.215 -1.631 -0.686 1.00 0.00 H new ATOM 0 HG22 ILE B 138 6.403 -2.616 -1.926 1.00 0.00 H new ATOM 0 HG23 ILE B 138 7.978 -3.127 -1.274 1.00 0.00 H new ATOM 0 HD11 ILE B 138 10.997 0.469 -2.584 1.00 0.00 H new ATOM 0 HD12 ILE B 138 10.324 -0.399 -3.984 1.00 0.00 H new ATOM 0 HD13 ILE B 138 9.414 0.941 -3.246 1.00 0.00 H new ATOM 1421 N ALA B 139 9.351 -4.439 -3.222 1.00 0.00 N ATOM 1422 CA ALA B 139 10.448 -5.376 -3.019 1.00 0.00 C ATOM 1423 C ALA B 139 11.087 -5.795 -4.353 1.00 0.00 C ATOM 1424 O ALA B 139 12.303 -5.940 -4.448 1.00 0.00 O ATOM 1425 CB ALA B 139 9.935 -6.602 -2.278 1.00 0.00 C ATOM 0 H ALA B 139 8.437 -4.791 -2.938 1.00 0.00 H new ATOM 0 HA ALA B 139 11.217 -4.880 -2.426 1.00 0.00 H new ATOM 0 HB1 ALA B 139 10.755 -7.304 -2.125 1.00 0.00 H new ATOM 0 HB2 ALA B 139 9.531 -6.300 -1.312 1.00 0.00 H new ATOM 0 HB3 ALA B 139 9.152 -7.081 -2.865 1.00 0.00 H new ATOM 1431 N ASP B 140 10.248 -5.982 -5.365 1.00 0.00 N ATOM 1432 CA ASP B 140 10.697 -6.413 -6.696 1.00 0.00 C ATOM 1433 C ASP B 140 11.245 -5.250 -7.511 1.00 0.00 C ATOM 1434 O ASP B 140 12.330 -5.327 -8.081 1.00 0.00 O ATOM 1435 CB ASP B 140 9.553 -7.091 -7.459 1.00 0.00 C ATOM 1436 CG ASP B 140 9.925 -7.449 -8.895 1.00 0.00 C ATOM 1437 OD1 ASP B 140 10.853 -8.260 -9.090 1.00 0.00 O ATOM 1438 OD2 ASP B 140 9.299 -6.907 -9.834 1.00 0.00 O ATOM 0 H ASP B 140 9.240 -5.842 -5.293 1.00 0.00 H new ATOM 0 HA ASP B 140 11.504 -7.131 -6.548 1.00 0.00 H new ATOM 0 HB2 ASP B 140 9.257 -7.997 -6.930 1.00 0.00 H new ATOM 0 HB3 ASP B 140 8.687 -6.429 -7.468 1.00 0.00 H new ATOM 1443 N ASN B 141 10.465 -4.169 -7.580 1.00 0.00 N ATOM 1444 CA ASN B 141 10.768 -3.041 -8.451 1.00 0.00 C ATOM 1445 C ASN B 141 11.778 -2.092 -7.819 1.00 0.00 C ATOM 1446 O ASN B 141 12.601 -1.518 -8.530 1.00 0.00 O ATOM 1447 CB ASN B 141 9.486 -2.280 -8.802 1.00 0.00 C ATOM 1448 CG ASN B 141 8.577 -3.074 -9.729 1.00 0.00 C ATOM 1449 OD1 ASN B 141 8.670 -2.972 -10.948 1.00 0.00 O ATOM 1450 ND2 ASN B 141 7.692 -3.875 -9.160 1.00 0.00 N ATOM 0 H ASN B 141 9.610 -4.055 -7.035 1.00 0.00 H new ATOM 0 HA ASN B 141 11.212 -3.443 -9.362 1.00 0.00 H new ATOM 0 HB2 ASN B 141 8.946 -2.040 -7.886 1.00 0.00 H new ATOM 0 HB3 ASN B 141 9.746 -1.333 -9.276 1.00 0.00 H new ATOM 0 HD21 ASN B 141 7.061 -4.431 -9.738 1.00 0.00 H new ATOM 0 HD22 ASN B 141 7.640 -3.937 -8.143 1.00 0.00 H new ATOM 1457 N GLU B 142 11.712 -1.941 -6.498 1.00 0.00 N ATOM 1458 CA GLU B 142 12.612 -1.042 -5.768 1.00 0.00 C ATOM 1459 C GLU B 142 12.693 0.340 -6.451 1.00 0.00 C ATOM 1460 O GLU B 142 13.788 0.843 -6.709 1.00 0.00 O ATOM 1461 CB GLU B 142 14.008 -1.669 -5.656 1.00 0.00 C ATOM 1462 CG GLU B 142 13.978 -3.101 -5.112 1.00 0.00 C ATOM 1463 CD GLU B 142 15.373 -3.664 -4.865 1.00 0.00 C ATOM 1464 OE1 GLU B 142 16.122 -3.836 -5.847 1.00 0.00 O ATOM 1465 OE2 GLU B 142 15.715 -3.957 -3.694 1.00 0.00 O ATOM 0 H GLU B 142 11.042 -2.431 -5.906 1.00 0.00 H new ATOM 0 HA GLU B 142 12.209 -0.896 -4.766 1.00 0.00 H new ATOM 0 HB2 GLU B 142 14.480 -1.669 -6.638 1.00 0.00 H new ATOM 0 HB3 GLU B 142 14.627 -1.051 -5.005 1.00 0.00 H new ATOM 0 HG2 GLU B 142 13.412 -3.120 -4.180 1.00 0.00 H new ATOM 0 HG3 GLU B 142 13.451 -3.743 -5.818 1.00 0.00 H new ATOM 1472 N ARG B 143 11.540 0.937 -6.732 1.00 0.00 N ATOM 1473 CA ARG B 143 11.498 2.204 -7.458 1.00 0.00 C ATOM 1474 C ARG B 143 10.226 2.998 -7.144 1.00 0.00 C ATOM 1475 O ARG B 143 10.258 4.234 -7.149 1.00 0.00 O ATOM 1476 CB ARG B 143 11.596 1.952 -8.968 1.00 0.00 C ATOM 1477 CG ARG B 143 10.420 1.179 -9.516 1.00 0.00 C ATOM 1478 CD ARG B 143 10.631 0.787 -10.991 1.00 0.00 C ATOM 1479 NE ARG B 143 11.759 -0.121 -11.150 1.00 0.00 N ATOM 1480 CZ ARG B 143 11.859 -0.999 -12.142 1.00 0.00 C ATOM 1481 NH1 ARG B 143 10.903 -1.110 -13.053 1.00 0.00 N ATOM 1482 NH2 ARG B 143 12.937 -1.794 -12.230 1.00 0.00 N ATOM 0 H ARG B 143 10.626 0.568 -6.470 1.00 0.00 H new ATOM 0 HA ARG B 143 12.352 2.798 -7.131 1.00 0.00 H new ATOM 0 HB2 ARG B 143 11.668 2.908 -9.486 1.00 0.00 H new ATOM 0 HB3 ARG B 143 12.514 1.404 -9.180 1.00 0.00 H new ATOM 0 HG2 ARG B 143 10.266 0.280 -8.919 1.00 0.00 H new ATOM 0 HG3 ARG B 143 9.515 1.780 -9.425 1.00 0.00 H new ATOM 0 HD2 ARG B 143 9.727 0.315 -11.375 1.00 0.00 H new ATOM 0 HD3 ARG B 143 10.800 1.685 -11.586 1.00 0.00 H new ATOM 0 HE ARG B 143 12.512 -0.081 -10.463 1.00 0.00 H new ATOM 0 HH11 ARG B 143 10.075 -0.516 -12.999 1.00 0.00 H new ATOM 0 HH12 ARG B 143 10.995 -1.789 -13.809 1.00 0.00 H new ATOM 0 HH21 ARG B 143 13.680 -1.724 -11.535 1.00 0.00 H new ATOM 0 HH22 ARG B 143 13.013 -2.468 -12.992 1.00 0.00 H new ATOM 1496 N LEU B 144 9.125 2.294 -6.899 1.00 0.00 N ATOM 1497 CA LEU B 144 7.807 2.931 -6.645 1.00 0.00 C ATOM 1498 C LEU B 144 7.276 3.580 -7.924 1.00 0.00 C ATOM 1499 O LEU B 144 7.967 4.376 -8.560 1.00 0.00 O ATOM 1500 CB LEU B 144 7.897 3.978 -5.519 1.00 0.00 C ATOM 1501 CG LEU B 144 8.262 3.427 -4.114 1.00 0.00 C ATOM 1502 CD1 LEU B 144 8.492 4.562 -3.129 1.00 0.00 C ATOM 1503 CD2 LEU B 144 7.167 2.494 -3.608 1.00 0.00 C ATOM 0 H LEU B 144 9.105 1.275 -6.868 1.00 0.00 H new ATOM 0 HA LEU B 144 7.116 2.151 -6.326 1.00 0.00 H new ATOM 0 HB2 LEU B 144 8.640 4.724 -5.801 1.00 0.00 H new ATOM 0 HB3 LEU B 144 6.939 4.493 -5.449 1.00 0.00 H new ATOM 0 HG LEU B 144 9.189 2.861 -4.201 1.00 0.00 H new ATOM 0 HD11 LEU B 144 8.746 4.150 -2.152 1.00 0.00 H new ATOM 0 HD12 LEU B 144 9.310 5.190 -3.482 1.00 0.00 H new ATOM 0 HD13 LEU B 144 7.585 5.161 -3.045 1.00 0.00 H new ATOM 0 HD21 LEU B 144 7.438 2.116 -2.622 1.00 0.00 H new ATOM 0 HD22 LEU B 144 6.226 3.040 -3.541 1.00 0.00 H new ATOM 0 HD23 LEU B 144 7.054 1.658 -4.298 1.00 0.00 H new ATOM 1515 N PRO B 145 6.033 3.268 -8.317 1.00 0.00 N ATOM 1516 CA PRO B 145 5.403 3.840 -9.517 1.00 0.00 C ATOM 1517 C PRO B 145 5.166 5.334 -9.355 1.00 0.00 C ATOM 1518 O PRO B 145 5.357 6.125 -10.296 1.00 0.00 O ATOM 1519 CB PRO B 145 4.071 3.081 -9.615 1.00 0.00 C ATOM 1520 CG PRO B 145 3.784 2.652 -8.223 1.00 0.00 C ATOM 1521 CD PRO B 145 5.103 2.333 -7.616 1.00 0.00 C ATOM 0 HA PRO B 145 6.021 3.737 -10.409 1.00 0.00 H new ATOM 0 HB2 PRO B 145 3.278 3.719 -10.005 1.00 0.00 H new ATOM 0 HB3 PRO B 145 4.150 2.225 -10.286 1.00 0.00 H new ATOM 0 HG2 PRO B 145 3.279 3.442 -7.667 1.00 0.00 H new ATOM 0 HG3 PRO B 145 3.127 1.782 -8.210 1.00 0.00 H new ATOM 0 HD2 PRO B 145 5.102 2.498 -6.539 1.00 0.00 H new ATOM 0 HD3 PRO B 145 5.380 1.291 -7.778 1.00 0.00 H new ATOM 1529 N PHE B 146 4.745 5.730 -8.154 1.00 0.00 N ATOM 1530 CA PHE B 146 4.502 7.134 -7.847 1.00 0.00 C ATOM 1531 C PHE B 146 5.696 7.718 -7.123 1.00 0.00 C ATOM 1532 O PHE B 146 6.131 8.816 -7.435 1.00 0.00 O ATOM 1533 CB PHE B 146 3.258 7.261 -6.945 1.00 0.00 C ATOM 1534 CG PHE B 146 1.973 6.892 -7.625 1.00 0.00 C ATOM 1535 CD1 PHE B 146 1.579 5.557 -7.717 1.00 0.00 C ATOM 1536 CD2 PHE B 146 1.150 7.862 -8.167 1.00 0.00 C ATOM 1537 CE1 PHE B 146 0.405 5.213 -8.352 1.00 0.00 C ATOM 1538 CE2 PHE B 146 -0.033 7.516 -8.797 1.00 0.00 C ATOM 1539 CZ PHE B 146 -0.414 6.193 -8.881 1.00 0.00 C ATOM 0 H PHE B 146 4.565 5.094 -7.377 1.00 0.00 H new ATOM 0 HA PHE B 146 4.339 7.675 -8.779 1.00 0.00 H new ATOM 0 HB2 PHE B 146 3.390 6.625 -6.070 1.00 0.00 H new ATOM 0 HB3 PHE B 146 3.185 8.287 -6.585 1.00 0.00 H new ATOM 0 HD1 PHE B 146 2.200 4.785 -7.286 1.00 0.00 H new ATOM 0 HD2 PHE B 146 1.434 8.902 -8.098 1.00 0.00 H new ATOM 0 HE1 PHE B 146 0.124 4.174 -8.437 1.00 0.00 H new ATOM 0 HE2 PHE B 146 -0.660 8.285 -9.224 1.00 0.00 H new ATOM 0 HZ PHE B 146 -1.346 5.925 -9.357 1.00 0.00 H new ATOM 1549 N LYS B 147 6.196 6.956 -6.161 1.00 0.00 N ATOM 1550 CA LYS B 147 7.277 7.414 -5.302 1.00 0.00 C ATOM 1551 C LYS B 147 6.888 8.719 -4.610 1.00 0.00 C ATOM 1552 O LYS B 147 7.730 9.579 -4.347 1.00 0.00 O ATOM 1553 CB LYS B 147 8.580 7.579 -6.090 1.00 0.00 C ATOM 1554 CG LYS B 147 9.801 7.767 -5.211 1.00 0.00 C ATOM 1555 CD LYS B 147 11.060 8.131 -5.992 1.00 0.00 C ATOM 1556 CE LYS B 147 11.627 6.976 -6.822 1.00 0.00 C ATOM 1557 NZ LYS B 147 10.769 6.602 -7.972 1.00 0.00 N ATOM 0 H LYS B 147 5.868 6.012 -5.955 1.00 0.00 H new ATOM 0 HA LYS B 147 7.449 6.656 -4.538 1.00 0.00 H new ATOM 0 HB2 LYS B 147 8.728 6.702 -6.720 1.00 0.00 H new ATOM 0 HB3 LYS B 147 8.486 8.437 -6.756 1.00 0.00 H new ATOM 0 HG2 LYS B 147 9.597 8.550 -4.481 1.00 0.00 H new ATOM 0 HG3 LYS B 147 9.982 6.849 -4.652 1.00 0.00 H new ATOM 0 HD2 LYS B 147 10.836 8.967 -6.655 1.00 0.00 H new ATOM 0 HD3 LYS B 147 11.824 8.473 -5.293 1.00 0.00 H new ATOM 0 HE2 LYS B 147 12.615 7.253 -7.190 1.00 0.00 H new ATOM 0 HE3 LYS B 147 11.759 6.106 -6.178 1.00 0.00 H new ATOM 0 HZ1 LYS B 147 11.361 6.458 -8.815 1.00 0.00 H new ATOM 0 HZ2 LYS B 147 10.258 5.723 -7.753 1.00 0.00 H new ATOM 0 HZ3 LYS B 147 10.085 7.363 -8.156 1.00 0.00 H new ATOM 1571 N GLN B 148 5.588 8.843 -4.335 1.00 0.00 N ATOM 1572 CA GLN B 148 4.985 10.013 -3.678 1.00 0.00 C ATOM 1573 C GLN B 148 5.269 11.316 -4.435 1.00 0.00 C ATOM 1574 O GLN B 148 6.093 11.359 -5.353 1.00 0.00 O ATOM 1575 CB GLN B 148 5.399 10.167 -2.197 1.00 0.00 C ATOM 1576 CG GLN B 148 6.743 10.856 -1.957 1.00 0.00 C ATOM 1577 CD GLN B 148 7.781 9.970 -1.288 1.00 0.00 C ATOM 1578 OE1 GLN B 148 7.751 8.693 -1.594 1.00 0.00 O flip ATOM 1579 NE2 GLN B 148 8.618 10.438 -0.529 1.00 0.00 N flip ATOM 0 H GLN B 148 4.907 8.119 -4.566 1.00 0.00 H new ATOM 0 HA GLN B 148 3.912 9.822 -3.700 1.00 0.00 H new ATOM 0 HB2 GLN B 148 4.624 10.731 -1.678 1.00 0.00 H new ATOM 0 HB3 GLN B 148 5.432 9.177 -1.742 1.00 0.00 H new ATOM 0 HG2 GLN B 148 7.138 11.203 -2.912 1.00 0.00 H new ATOM 0 HG3 GLN B 148 6.582 11.739 -1.339 1.00 0.00 H new ATOM 0 HE21 GLN B 148 8.611 11.435 -0.314 1.00 0.00 H new ATOM 0 HE22 GLN B 148 9.323 9.831 -0.111 1.00 0.00 H new ATOM 1588 N THR B 149 4.546 12.351 -4.048 1.00 0.00 N ATOM 1589 CA THR B 149 4.774 13.684 -4.557 1.00 0.00 C ATOM 1590 C THR B 149 4.316 14.701 -3.500 1.00 0.00 C ATOM 1591 O THR B 149 3.266 15.341 -3.617 1.00 0.00 O ATOM 1592 CB THR B 149 4.080 13.918 -5.930 1.00 0.00 C ATOM 1593 OG1 THR B 149 4.268 15.264 -6.374 1.00 0.00 O ATOM 1594 CG2 THR B 149 2.590 13.590 -5.875 1.00 0.00 C ATOM 0 H THR B 149 3.785 12.287 -3.372 1.00 0.00 H new ATOM 0 HA THR B 149 5.840 13.814 -4.744 1.00 0.00 H new ATOM 0 HB THR B 149 4.548 13.241 -6.644 1.00 0.00 H new ATOM 0 HG1 THR B 149 3.825 15.388 -7.239 1.00 0.00 H new ATOM 0 HG21 THR B 149 2.142 13.766 -6.853 1.00 0.00 H new ATOM 0 HG22 THR B 149 2.458 12.544 -5.599 1.00 0.00 H new ATOM 0 HG23 THR B 149 2.105 14.225 -5.134 1.00 0.00 H new ATOM 1602 N LEU B 150 5.097 14.781 -2.424 1.00 0.00 N ATOM 1603 CA LEU B 150 4.846 15.705 -1.327 1.00 0.00 C ATOM 1604 C LEU B 150 4.992 17.153 -1.808 1.00 0.00 C ATOM 1605 O LEU B 150 3.965 17.800 -2.100 1.00 0.00 O ATOM 1606 CB LEU B 150 5.816 15.420 -0.156 1.00 0.00 C ATOM 1607 CG LEU B 150 5.802 13.982 0.384 1.00 0.00 C ATOM 1608 CD1 LEU B 150 6.863 13.799 1.477 1.00 0.00 C ATOM 1609 CD2 LEU B 150 4.415 13.625 0.936 1.00 0.00 C ATOM 1610 OXT LEU B 150 6.142 17.637 -1.904 1.00 0.00 O ATOM 0 H LEU B 150 5.926 14.202 -2.291 1.00 0.00 H new ATOM 0 HA LEU B 150 3.825 15.561 -0.973 1.00 0.00 H new ATOM 0 HB2 LEU B 150 6.829 15.657 -0.481 1.00 0.00 H new ATOM 0 HB3 LEU B 150 5.577 16.099 0.663 1.00 0.00 H new ATOM 0 HG LEU B 150 6.035 13.311 -0.443 1.00 0.00 H new ATOM 0 HD11 LEU B 150 6.834 12.773 1.844 1.00 0.00 H new ATOM 0 HD12 LEU B 150 7.850 14.009 1.065 1.00 0.00 H new ATOM 0 HD13 LEU B 150 6.660 14.485 2.300 1.00 0.00 H new ATOM 0 HD21 LEU B 150 4.426 12.603 1.314 1.00 0.00 H new ATOM 0 HD22 LEU B 150 4.159 14.308 1.746 1.00 0.00 H new ATOM 0 HD23 LEU B 150 3.674 13.710 0.141 1.00 0.00 H new TER 1622 LEU B 150