USER MOD reduce.3.24.130724 H: found=0, std=0, add=838, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 837 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 28 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET CE :methyl -138:sc= 0 (180deg=-0.00927) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 LYS NZ :NH3+ 163:sc= 0 (180deg=-0.28) USER MOD Single : A 4 GLN : amide:sc= -2.14 K(o=-2.1,f=-5.5!) USER MOD Single : A 7 SER OG : rot 26:sc= 0.736 USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 THR OG1 : rot 180:sc= 0 USER MOD Single : A 12 GLN : amide:sc= -0.417 X(o=-0.42,f=-0.028) USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 THR OG1 : rot 180:sc= 0.0425 USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 43 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 46 SER OG : rot -99:sc= -1.35 USER MOD Single : A 48 LYS NZ :NH3+ 166:sc= 0 (180deg=-0.103) USER MOD Single : A 49 TYR OH : rot 180:sc= -1.07 USER MOD Single : A 50 SER OG : rot -61:sc= 0.233 USER MOD Single : A 51 ASN : amide:sc= -0.179 K(o=-0.18,f=-2!) USER MOD Single : A 63 GLN : amide:sc= 0 K(o=0,f=-0.81) USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 TYR OH : rot -75:sc= 1.12 USER MOD Single : A 76 THR OG1 : rot -81:sc= 0.516 USER MOD Single : A 81 LYS NZ :NH3+ -167:sc= -0.171 (180deg=-0.594) USER MOD Single : A 82 ASN : amide:sc= -0.0141 X(o=-0.014,f=-0.014) USER MOD Single : A 88 THR OG1 : rot 180:sc= 0 USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 SER OG : rot 180:sc= 0.011 USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 GLN : amide:sc= 0.0746 K(o=0.075,f=-1.7!) USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 ASN : amide:sc= -0.164 K(o=-0.16,f=-1.7!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 2.659 -7.099 -1.694 1.00 0.00 N ATOM 2 CA MET A 1 2.323 -5.688 -2.014 1.00 0.00 C ATOM 3 C MET A 1 0.849 -5.540 -2.372 1.00 0.00 C ATOM 4 O MET A 1 0.154 -6.527 -2.616 1.00 0.00 O ATOM 5 CB MET A 1 3.200 -5.232 -3.183 1.00 0.00 C ATOM 6 CG MET A 1 4.522 -4.621 -2.748 1.00 0.00 C ATOM 7 SD MET A 1 5.425 -3.865 -4.114 1.00 0.00 S ATOM 8 CE MET A 1 4.566 -2.301 -4.266 1.00 0.00 C ATOM 0 H1 MET A 1 3.668 -7.170 -1.454 1.00 0.00 H new ATOM 0 H2 MET A 1 2.088 -7.417 -0.885 1.00 0.00 H new ATOM 0 H3 MET A 1 2.456 -7.700 -2.518 1.00 0.00 H new ATOM 0 HA MET A 1 2.511 -5.067 -1.138 1.00 0.00 H new ATOM 0 HB2 MET A 1 3.399 -6.085 -3.832 1.00 0.00 H new ATOM 0 HB3 MET A 1 2.649 -4.502 -3.777 1.00 0.00 H new ATOM 0 HG2 MET A 1 4.335 -3.869 -1.982 1.00 0.00 H new ATOM 0 HG3 MET A 1 5.142 -5.393 -2.292 1.00 0.00 H new ATOM 0 HE1 MET A 1 4.413 -2.071 -5.320 1.00 0.00 H new ATOM 0 HE2 MET A 1 3.600 -2.366 -3.765 1.00 0.00 H new ATOM 0 HE3 MET A 1 5.161 -1.513 -3.805 1.00 0.00 H new ATOM 20 N VAL A 2 0.376 -4.299 -2.404 1.00 0.00 N ATOM 21 CA VAL A 2 -1.014 -4.017 -2.735 1.00 0.00 C ATOM 22 C VAL A 2 -1.136 -3.525 -4.170 1.00 0.00 C ATOM 23 O VAL A 2 -0.252 -2.831 -4.674 1.00 0.00 O ATOM 24 CB VAL A 2 -1.613 -2.958 -1.784 1.00 0.00 C ATOM 25 CG1 VAL A 2 -3.092 -2.732 -2.079 1.00 0.00 C ATOM 26 CG2 VAL A 2 -1.407 -3.372 -0.331 1.00 0.00 C ATOM 0 H VAL A 2 0.937 -3.471 -2.204 1.00 0.00 H new ATOM 0 HA VAL A 2 -1.569 -4.948 -2.621 1.00 0.00 H new ATOM 0 HB VAL A 2 -1.092 -2.015 -1.951 1.00 0.00 H new ATOM 0 HG11 VAL A 2 -3.489 -1.982 -1.395 1.00 0.00 H new ATOM 0 HG12 VAL A 2 -3.209 -2.385 -3.106 1.00 0.00 H new ATOM 0 HG13 VAL A 2 -3.636 -3.667 -1.947 1.00 0.00 H new ATOM 0 HG21 VAL A 2 -1.835 -2.615 0.327 1.00 0.00 H new ATOM 0 HG22 VAL A 2 -1.898 -4.328 -0.152 1.00 0.00 H new ATOM 0 HG23 VAL A 2 -0.340 -3.469 -0.128 1.00 0.00 H new ATOM 36 N LYS A 3 -2.228 -3.894 -4.829 1.00 0.00 N ATOM 37 CA LYS A 3 -2.445 -3.490 -6.206 1.00 0.00 C ATOM 38 C LYS A 3 -3.917 -3.212 -6.451 1.00 0.00 C ATOM 39 O LYS A 3 -4.769 -4.080 -6.265 1.00 0.00 O ATOM 40 CB LYS A 3 -1.950 -4.580 -7.164 1.00 0.00 C ATOM 41 CG LYS A 3 -2.344 -5.989 -6.744 1.00 0.00 C ATOM 42 CD LYS A 3 -1.677 -7.044 -7.616 1.00 0.00 C ATOM 43 CE LYS A 3 -2.095 -6.915 -9.074 1.00 0.00 C ATOM 44 NZ LYS A 3 -1.323 -7.834 -9.958 1.00 0.00 N ATOM 0 H LYS A 3 -2.971 -4.469 -4.432 1.00 0.00 H new ATOM 0 HA LYS A 3 -1.881 -2.576 -6.390 1.00 0.00 H new ATOM 0 HB2 LYS A 3 -2.346 -4.383 -8.160 1.00 0.00 H new ATOM 0 HB3 LYS A 3 -0.864 -4.522 -7.236 1.00 0.00 H new ATOM 0 HG2 LYS A 3 -2.066 -6.149 -5.702 1.00 0.00 H new ATOM 0 HG3 LYS A 3 -3.427 -6.098 -6.805 1.00 0.00 H new ATOM 0 HD2 LYS A 3 -0.594 -6.949 -7.538 1.00 0.00 H new ATOM 0 HD3 LYS A 3 -1.937 -8.037 -7.249 1.00 0.00 H new ATOM 0 HE2 LYS A 3 -3.159 -7.131 -9.167 1.00 0.00 H new ATOM 0 HE3 LYS A 3 -1.949 -5.886 -9.404 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 -1.814 -7.933 -10.869 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 -0.372 -7.444 -10.118 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 -1.243 -8.766 -9.504 1.00 0.00 H new ATOM 58 N GLN A 4 -4.212 -1.986 -6.861 1.00 0.00 N ATOM 59 CA GLN A 4 -5.582 -1.589 -7.130 1.00 0.00 C ATOM 60 C GLN A 4 -6.057 -2.241 -8.429 1.00 0.00 C ATOM 61 O GLN A 4 -5.409 -2.121 -9.470 1.00 0.00 O ATOM 62 CB GLN A 4 -5.681 -0.060 -7.204 1.00 0.00 C ATOM 63 CG GLN A 4 -6.981 0.458 -7.801 1.00 0.00 C ATOM 64 CD GLN A 4 -8.209 -0.021 -7.051 1.00 0.00 C ATOM 65 OE1 GLN A 4 -8.947 -0.878 -7.533 1.00 0.00 O ATOM 66 NE2 GLN A 4 -8.440 0.536 -5.867 1.00 0.00 N ATOM 0 H GLN A 4 -3.520 -1.252 -7.014 1.00 0.00 H new ATOM 0 HA GLN A 4 -6.229 -1.927 -6.320 1.00 0.00 H new ATOM 0 HB2 GLN A 4 -5.569 0.348 -6.200 1.00 0.00 H new ATOM 0 HB3 GLN A 4 -4.848 0.318 -7.796 1.00 0.00 H new ATOM 0 HG2 GLN A 4 -6.965 1.548 -7.802 1.00 0.00 H new ATOM 0 HG3 GLN A 4 -7.050 0.139 -8.841 1.00 0.00 H new ATOM 0 HE21 GLN A 4 -7.802 1.244 -5.503 1.00 0.00 H new ATOM 0 HE22 GLN A 4 -9.255 0.256 -5.322 1.00 0.00 H new ATOM 75 N ILE A 5 -7.181 -2.941 -8.354 1.00 0.00 N ATOM 76 CA ILE A 5 -7.736 -3.626 -9.514 1.00 0.00 C ATOM 77 C ILE A 5 -8.845 -2.788 -10.152 1.00 0.00 C ATOM 78 O ILE A 5 -9.938 -2.653 -9.603 1.00 0.00 O ATOM 79 CB ILE A 5 -8.238 -5.041 -9.116 1.00 0.00 C ATOM 80 CG1 ILE A 5 -7.142 -6.082 -9.373 1.00 0.00 C ATOM 81 CG2 ILE A 5 -9.509 -5.430 -9.859 1.00 0.00 C ATOM 82 CD1 ILE A 5 -5.757 -5.638 -8.947 1.00 0.00 C ATOM 0 H ILE A 5 -7.728 -3.050 -7.500 1.00 0.00 H new ATOM 0 HA ILE A 5 -6.952 -3.752 -10.260 1.00 0.00 H new ATOM 0 HB ILE A 5 -8.475 -5.014 -8.052 1.00 0.00 H new ATOM 0 HG12 ILE A 5 -7.397 -7.000 -8.844 1.00 0.00 H new ATOM 0 HG13 ILE A 5 -7.125 -6.321 -10.436 1.00 0.00 H new ATOM 0 HG21 ILE A 5 -9.822 -6.427 -9.548 1.00 0.00 H new ATOM 0 HG22 ILE A 5 -10.298 -4.714 -9.630 1.00 0.00 H new ATOM 0 HG23 ILE A 5 -9.318 -5.428 -10.932 1.00 0.00 H new ATOM 0 HD11 ILE A 5 -5.039 -6.429 -9.162 1.00 0.00 H new ATOM 0 HD12 ILE A 5 -5.479 -4.737 -9.495 1.00 0.00 H new ATOM 0 HD13 ILE A 5 -5.755 -5.427 -7.878 1.00 0.00 H new ATOM 94 N GLU A 6 -8.542 -2.214 -11.313 1.00 0.00 N ATOM 95 CA GLU A 6 -9.493 -1.372 -12.027 1.00 0.00 C ATOM 96 C GLU A 6 -10.241 -2.128 -13.122 1.00 0.00 C ATOM 97 O GLU A 6 -10.807 -1.516 -14.027 1.00 0.00 O ATOM 98 CB GLU A 6 -8.772 -0.166 -12.627 1.00 0.00 C ATOM 99 CG GLU A 6 -8.273 0.828 -11.591 1.00 0.00 C ATOM 100 CD GLU A 6 -9.398 1.519 -10.847 1.00 0.00 C ATOM 101 OE1 GLU A 6 -9.867 0.964 -9.831 1.00 0.00 O ATOM 102 OE2 GLU A 6 -9.809 2.617 -11.280 1.00 0.00 O ATOM 0 H GLU A 6 -7.641 -2.318 -11.780 1.00 0.00 H new ATOM 0 HA GLU A 6 -10.236 -1.040 -11.301 1.00 0.00 H new ATOM 0 HB2 GLU A 6 -7.926 -0.517 -13.217 1.00 0.00 H new ATOM 0 HB3 GLU A 6 -9.448 0.346 -13.312 1.00 0.00 H new ATOM 0 HG2 GLU A 6 -7.635 0.310 -10.875 1.00 0.00 H new ATOM 0 HG3 GLU A 6 -7.655 1.579 -12.083 1.00 0.00 H new ATOM 109 N SER A 7 -10.242 -3.450 -13.047 1.00 0.00 N ATOM 110 CA SER A 7 -10.926 -4.260 -14.049 1.00 0.00 C ATOM 111 C SER A 7 -11.297 -5.631 -13.493 1.00 0.00 C ATOM 112 O SER A 7 -10.735 -6.082 -12.494 1.00 0.00 O ATOM 113 CB SER A 7 -10.044 -4.421 -15.288 1.00 0.00 C ATOM 114 OG SER A 7 -10.148 -3.290 -16.138 1.00 0.00 O ATOM 0 H SER A 7 -9.781 -3.984 -12.310 1.00 0.00 H new ATOM 0 HA SER A 7 -11.846 -3.745 -14.326 1.00 0.00 H new ATOM 0 HB2 SER A 7 -9.006 -4.558 -14.984 1.00 0.00 H new ATOM 0 HB3 SER A 7 -10.337 -5.318 -15.833 1.00 0.00 H new ATOM 0 HG SER A 7 -10.400 -2.505 -15.608 1.00 0.00 H new ATOM 120 N LYS A 8 -12.237 -6.297 -14.156 1.00 0.00 N ATOM 121 CA LYS A 8 -12.675 -7.624 -13.736 1.00 0.00 C ATOM 122 C LYS A 8 -11.605 -8.667 -14.055 1.00 0.00 C ATOM 123 O LYS A 8 -11.499 -9.689 -13.377 1.00 0.00 O ATOM 124 CB LYS A 8 -13.996 -7.986 -14.421 1.00 0.00 C ATOM 125 CG LYS A 8 -14.531 -9.360 -14.044 1.00 0.00 C ATOM 126 CD LYS A 8 -15.019 -10.123 -15.265 1.00 0.00 C ATOM 127 CE LYS A 8 -13.861 -10.707 -16.056 1.00 0.00 C ATOM 128 NZ LYS A 8 -13.438 -12.031 -15.523 1.00 0.00 N ATOM 0 H LYS A 8 -12.710 -5.940 -14.986 1.00 0.00 H new ATOM 0 HA LYS A 8 -12.833 -7.613 -12.658 1.00 0.00 H new ATOM 0 HB2 LYS A 8 -14.743 -7.234 -14.167 1.00 0.00 H new ATOM 0 HB3 LYS A 8 -13.857 -7.945 -15.501 1.00 0.00 H new ATOM 0 HG2 LYS A 8 -13.748 -9.932 -13.545 1.00 0.00 H new ATOM 0 HG3 LYS A 8 -15.349 -9.250 -13.332 1.00 0.00 H new ATOM 0 HD2 LYS A 8 -15.688 -10.925 -14.951 1.00 0.00 H new ATOM 0 HD3 LYS A 8 -15.598 -9.457 -15.904 1.00 0.00 H new ATOM 0 HE2 LYS A 8 -14.152 -10.812 -17.101 1.00 0.00 H new ATOM 0 HE3 LYS A 8 -13.017 -10.018 -16.028 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 -12.646 -12.396 -16.089 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 -13.137 -11.927 -14.533 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 -14.236 -12.697 -15.574 1.00 0.00 H new ATOM 142 N THR A 9 -10.804 -8.394 -15.087 1.00 0.00 N ATOM 143 CA THR A 9 -9.734 -9.301 -15.488 1.00 0.00 C ATOM 144 C THR A 9 -8.519 -9.126 -14.584 1.00 0.00 C ATOM 145 O THR A 9 -7.777 -10.075 -14.331 1.00 0.00 O ATOM 146 CB THR A 9 -9.339 -9.055 -16.944 1.00 0.00 C ATOM 147 OG1 THR A 9 -10.468 -8.689 -17.715 1.00 0.00 O ATOM 148 CG2 THR A 9 -8.706 -10.262 -17.601 1.00 0.00 C ATOM 0 H THR A 9 -10.878 -7.552 -15.658 1.00 0.00 H new ATOM 0 HA THR A 9 -10.101 -10.323 -15.392 1.00 0.00 H new ATOM 0 HB THR A 9 -8.605 -8.250 -16.914 1.00 0.00 H new ATOM 0 HG1 THR A 9 -10.194 -8.534 -18.643 1.00 0.00 H new ATOM 0 HG21 THR A 9 -8.449 -10.022 -18.633 1.00 0.00 H new ATOM 0 HG22 THR A 9 -7.803 -10.540 -17.057 1.00 0.00 H new ATOM 0 HG23 THR A 9 -9.409 -11.095 -17.587 1.00 0.00 H new ATOM 156 N ALA A 10 -8.322 -7.901 -14.100 1.00 0.00 N ATOM 157 CA ALA A 10 -7.199 -7.597 -13.226 1.00 0.00 C ATOM 158 C ALA A 10 -7.328 -8.355 -11.909 1.00 0.00 C ATOM 159 O ALA A 10 -6.341 -8.860 -11.376 1.00 0.00 O ATOM 160 CB ALA A 10 -7.113 -6.095 -12.982 1.00 0.00 C ATOM 0 H ALA A 10 -8.928 -7.105 -14.300 1.00 0.00 H new ATOM 0 HA ALA A 10 -6.278 -7.919 -13.713 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -6.269 -5.881 -12.327 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -6.975 -5.579 -13.932 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -8.034 -5.749 -12.512 1.00 0.00 H new ATOM 166 N PHE A 11 -8.556 -8.465 -11.407 1.00 0.00 N ATOM 167 CA PHE A 11 -8.811 -9.187 -10.163 1.00 0.00 C ATOM 168 C PHE A 11 -8.341 -10.630 -10.292 1.00 0.00 C ATOM 169 O PHE A 11 -7.724 -11.178 -9.380 1.00 0.00 O ATOM 170 CB PHE A 11 -10.304 -9.137 -9.814 1.00 0.00 C ATOM 171 CG PHE A 11 -10.599 -9.416 -8.366 1.00 0.00 C ATOM 172 CD1 PHE A 11 -9.822 -8.850 -7.365 1.00 0.00 C ATOM 173 CD2 PHE A 11 -11.644 -10.251 -8.006 1.00 0.00 C ATOM 174 CE1 PHE A 11 -10.084 -9.112 -6.037 1.00 0.00 C ATOM 175 CE2 PHE A 11 -11.912 -10.514 -6.677 1.00 0.00 C ATOM 176 CZ PHE A 11 -11.130 -9.945 -5.690 1.00 0.00 C ATOM 0 H PHE A 11 -9.388 -8.065 -11.841 1.00 0.00 H new ATOM 0 HA PHE A 11 -8.254 -8.709 -9.357 1.00 0.00 H new ATOM 0 HB2 PHE A 11 -10.695 -8.153 -10.072 1.00 0.00 H new ATOM 0 HB3 PHE A 11 -10.836 -9.862 -10.430 1.00 0.00 H new ATOM 0 HD1 PHE A 11 -9.003 -8.197 -7.629 1.00 0.00 H new ATOM 0 HD2 PHE A 11 -12.256 -10.701 -8.773 1.00 0.00 H new ATOM 0 HE1 PHE A 11 -9.471 -8.666 -5.268 1.00 0.00 H new ATOM 0 HE2 PHE A 11 -12.732 -11.164 -6.409 1.00 0.00 H new ATOM 0 HZ PHE A 11 -11.336 -10.151 -4.650 1.00 0.00 H new ATOM 186 N GLN A 12 -8.614 -11.228 -11.445 1.00 0.00 N ATOM 187 CA GLN A 12 -8.194 -12.597 -11.705 1.00 0.00 C ATOM 188 C GLN A 12 -6.673 -12.664 -11.801 1.00 0.00 C ATOM 189 O GLN A 12 -6.042 -13.557 -11.236 1.00 0.00 O ATOM 190 CB GLN A 12 -8.841 -13.120 -12.991 1.00 0.00 C ATOM 191 CG GLN A 12 -10.357 -12.986 -13.006 1.00 0.00 C ATOM 192 CD GLN A 12 -11.027 -13.793 -11.911 1.00 0.00 C ATOM 193 OE1 GLN A 12 -11.501 -14.904 -12.145 1.00 0.00 O ATOM 194 NE2 GLN A 12 -11.073 -13.238 -10.705 1.00 0.00 N ATOM 0 H GLN A 12 -9.123 -10.788 -12.212 1.00 0.00 H new ATOM 0 HA GLN A 12 -8.520 -13.230 -10.880 1.00 0.00 H new ATOM 0 HB2 GLN A 12 -8.428 -12.579 -13.842 1.00 0.00 H new ATOM 0 HB3 GLN A 12 -8.576 -14.169 -13.121 1.00 0.00 H new ATOM 0 HG2 GLN A 12 -10.626 -11.936 -12.894 1.00 0.00 H new ATOM 0 HG3 GLN A 12 -10.737 -13.310 -13.975 1.00 0.00 H new ATOM 0 HE21 GLN A 12 -10.668 -12.314 -10.553 1.00 0.00 H new ATOM 0 HE22 GLN A 12 -11.513 -13.736 -9.931 1.00 0.00 H new ATOM 203 N GLU A 13 -6.092 -11.702 -12.517 1.00 0.00 N ATOM 204 CA GLU A 13 -4.644 -11.634 -12.694 1.00 0.00 C ATOM 205 C GLU A 13 -3.926 -11.550 -11.350 1.00 0.00 C ATOM 206 O GLU A 13 -2.958 -12.271 -11.106 1.00 0.00 O ATOM 207 CB GLU A 13 -4.272 -10.418 -13.551 1.00 0.00 C ATOM 208 CG GLU A 13 -4.248 -10.702 -15.045 1.00 0.00 C ATOM 209 CD GLU A 13 -3.710 -9.534 -15.851 1.00 0.00 C ATOM 210 OE1 GLU A 13 -3.995 -8.375 -15.482 1.00 0.00 O ATOM 211 OE2 GLU A 13 -3.006 -9.780 -16.852 1.00 0.00 O ATOM 0 H GLU A 13 -6.606 -10.956 -12.986 1.00 0.00 H new ATOM 0 HA GLU A 13 -4.327 -12.547 -13.199 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -4.984 -9.616 -13.355 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -3.291 -10.056 -13.244 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -3.634 -11.583 -15.234 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -5.257 -10.938 -15.383 1.00 0.00 H new ATOM 218 N ALA A 14 -4.406 -10.667 -10.479 1.00 0.00 N ATOM 219 CA ALA A 14 -3.806 -10.492 -9.160 1.00 0.00 C ATOM 220 C ALA A 14 -3.964 -11.750 -8.316 1.00 0.00 C ATOM 221 O ALA A 14 -3.112 -12.062 -7.483 1.00 0.00 O ATOM 222 CB ALA A 14 -4.427 -9.299 -8.450 1.00 0.00 C ATOM 0 H ALA A 14 -5.207 -10.063 -10.662 1.00 0.00 H new ATOM 0 HA ALA A 14 -2.741 -10.306 -9.295 1.00 0.00 H new ATOM 0 HB1 ALA A 14 -3.969 -9.181 -7.468 1.00 0.00 H new ATOM 0 HB2 ALA A 14 -4.259 -8.397 -9.039 1.00 0.00 H new ATOM 0 HB3 ALA A 14 -5.498 -9.462 -8.334 1.00 0.00 H new ATOM 228 N LEU A 15 -5.057 -12.467 -8.539 1.00 0.00 N ATOM 229 CA LEU A 15 -5.328 -13.695 -7.802 1.00 0.00 C ATOM 230 C LEU A 15 -4.335 -14.788 -8.196 1.00 0.00 C ATOM 231 O LEU A 15 -3.876 -15.572 -7.357 1.00 0.00 O ATOM 232 CB LEU A 15 -6.763 -14.157 -8.070 1.00 0.00 C ATOM 233 CG LEU A 15 -7.817 -13.567 -7.131 1.00 0.00 C ATOM 234 CD1 LEU A 15 -9.206 -14.039 -7.528 1.00 0.00 C ATOM 235 CD2 LEU A 15 -7.513 -13.943 -5.690 1.00 0.00 C ATOM 0 H LEU A 15 -5.771 -12.220 -9.224 1.00 0.00 H new ATOM 0 HA LEU A 15 -5.213 -13.497 -6.736 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -7.026 -13.899 -9.096 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -6.799 -15.244 -7.995 1.00 0.00 H new ATOM 0 HG LEU A 15 -7.788 -12.481 -7.215 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -9.944 -13.610 -6.850 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -9.421 -13.719 -8.548 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -9.251 -15.127 -7.472 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -8.272 -13.516 -5.035 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -7.516 -15.028 -5.589 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -6.533 -13.555 -5.412 1.00 0.00 H new ATOM 247 N ASP A 16 -3.999 -14.824 -9.480 1.00 0.00 N ATOM 248 CA ASP A 16 -3.058 -15.810 -9.994 1.00 0.00 C ATOM 249 C ASP A 16 -1.708 -15.653 -9.310 1.00 0.00 C ATOM 250 O ASP A 16 -1.019 -16.636 -9.037 1.00 0.00 O ATOM 251 CB ASP A 16 -2.892 -15.649 -11.505 1.00 0.00 C ATOM 252 CG ASP A 16 -4.189 -15.872 -12.258 1.00 0.00 C ATOM 253 OD1 ASP A 16 -4.887 -16.866 -11.960 1.00 0.00 O ATOM 254 OD2 ASP A 16 -4.510 -15.054 -13.147 1.00 0.00 O ATOM 0 H ASP A 16 -4.364 -14.182 -10.183 1.00 0.00 H new ATOM 0 HA ASP A 16 -3.451 -16.805 -9.785 1.00 0.00 H new ATOM 0 HB2 ASP A 16 -2.517 -14.649 -11.722 1.00 0.00 H new ATOM 0 HB3 ASP A 16 -2.142 -16.355 -11.862 1.00 0.00 H new ATOM 259 N ALA A 17 -1.348 -14.407 -9.024 1.00 0.00 N ATOM 260 CA ALA A 17 -0.096 -14.105 -8.350 1.00 0.00 C ATOM 261 C ALA A 17 -0.187 -14.421 -6.859 1.00 0.00 C ATOM 262 O ALA A 17 0.826 -14.631 -6.193 1.00 0.00 O ATOM 263 CB ALA A 17 0.283 -12.649 -8.571 1.00 0.00 C ATOM 0 H ALA A 17 -1.911 -13.587 -9.251 1.00 0.00 H new ATOM 0 HA ALA A 17 0.684 -14.735 -8.777 1.00 0.00 H new ATOM 0 HB1 ALA A 17 1.222 -12.436 -8.061 1.00 0.00 H new ATOM 0 HB2 ALA A 17 0.399 -12.461 -9.638 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -0.500 -12.005 -8.172 1.00 0.00 H new ATOM 269 N ALA A 18 -1.414 -14.451 -6.339 1.00 0.00 N ATOM 270 CA ALA A 18 -1.637 -14.742 -4.928 1.00 0.00 C ATOM 271 C ALA A 18 -1.244 -16.171 -4.596 1.00 0.00 C ATOM 272 O ALA A 18 -0.745 -16.444 -3.504 1.00 0.00 O ATOM 273 CB ALA A 18 -3.085 -14.481 -4.546 1.00 0.00 C ATOM 0 H ALA A 18 -2.265 -14.278 -6.874 1.00 0.00 H new ATOM 0 HA ALA A 18 -1.003 -14.074 -4.344 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -3.228 -14.705 -3.489 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -3.327 -13.435 -4.731 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -3.739 -15.116 -5.143 1.00 0.00 H new ATOM 279 N GLY A 19 -1.448 -17.091 -5.540 1.00 0.00 N ATOM 280 CA GLY A 19 -1.079 -18.478 -5.311 1.00 0.00 C ATOM 281 C GLY A 19 -1.709 -19.074 -4.073 1.00 0.00 C ATOM 282 O GLY A 19 -2.932 -19.146 -3.961 1.00 0.00 O ATOM 0 H GLY A 19 -1.860 -16.901 -6.454 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -1.370 -19.071 -6.178 1.00 0.00 H new ATOM 0 HA3 GLY A 19 0.005 -18.548 -5.226 1.00 0.00 H new ATOM 286 N ASP A 20 -0.866 -19.519 -3.150 1.00 0.00 N ATOM 287 CA ASP A 20 -1.336 -20.134 -1.919 1.00 0.00 C ATOM 288 C ASP A 20 -1.404 -19.124 -0.776 1.00 0.00 C ATOM 289 O ASP A 20 -1.709 -19.486 0.360 1.00 0.00 O ATOM 290 CB ASP A 20 -0.419 -21.298 -1.538 1.00 0.00 C ATOM 291 CG ASP A 20 0.990 -20.845 -1.212 1.00 0.00 C ATOM 292 OD1 ASP A 20 1.495 -19.930 -1.897 1.00 0.00 O ATOM 293 OD2 ASP A 20 1.590 -21.406 -0.271 1.00 0.00 O ATOM 0 H ASP A 20 0.149 -19.464 -3.233 1.00 0.00 H new ATOM 0 HA ASP A 20 -2.346 -20.506 -2.093 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -0.838 -21.819 -0.677 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -0.386 -22.014 -2.359 1.00 0.00 H new ATOM 298 N LYS A 21 -1.137 -17.854 -1.079 1.00 0.00 N ATOM 299 CA LYS A 21 -1.190 -16.809 -0.076 1.00 0.00 C ATOM 300 C LYS A 21 -2.632 -16.390 0.163 1.00 0.00 C ATOM 301 O LYS A 21 -3.458 -16.425 -0.751 1.00 0.00 O ATOM 302 CB LYS A 21 -0.361 -15.602 -0.525 1.00 0.00 C ATOM 303 CG LYS A 21 1.114 -15.918 -0.717 1.00 0.00 C ATOM 304 CD LYS A 21 1.708 -15.131 -1.873 1.00 0.00 C ATOM 305 CE LYS A 21 3.225 -15.072 -1.785 1.00 0.00 C ATOM 306 NZ LYS A 21 3.787 -13.928 -2.558 1.00 0.00 N ATOM 0 H LYS A 21 -0.883 -17.531 -2.013 1.00 0.00 H new ATOM 0 HA LYS A 21 -0.774 -17.194 0.855 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -0.768 -15.220 -1.461 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -0.461 -14.807 0.214 1.00 0.00 H new ATOM 0 HG2 LYS A 21 1.658 -15.688 0.199 1.00 0.00 H new ATOM 0 HG3 LYS A 21 1.237 -16.985 -0.901 1.00 0.00 H new ATOM 0 HD2 LYS A 21 1.415 -15.591 -2.817 1.00 0.00 H new ATOM 0 HD3 LYS A 21 1.303 -14.119 -1.872 1.00 0.00 H new ATOM 0 HE2 LYS A 21 3.524 -14.985 -0.740 1.00 0.00 H new ATOM 0 HE3 LYS A 21 3.646 -16.005 -2.161 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 4.823 -13.926 -2.471 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 3.524 -14.023 -3.560 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 3.406 -13.036 -2.184 1.00 0.00 H new ATOM 320 N LEU A 22 -2.927 -15.965 1.380 1.00 0.00 N ATOM 321 CA LEU A 22 -4.272 -15.514 1.715 1.00 0.00 C ATOM 322 C LEU A 22 -4.484 -14.115 1.155 1.00 0.00 C ATOM 323 O LEU A 22 -3.621 -13.247 1.288 1.00 0.00 O ATOM 324 CB LEU A 22 -4.480 -15.525 3.236 1.00 0.00 C ATOM 325 CG LEU A 22 -5.754 -14.837 3.748 1.00 0.00 C ATOM 326 CD1 LEU A 22 -6.953 -15.175 2.872 1.00 0.00 C ATOM 327 CD2 LEU A 22 -6.021 -15.243 5.188 1.00 0.00 C ATOM 0 H LEU A 22 -2.259 -15.922 2.150 1.00 0.00 H new ATOM 0 HA LEU A 22 -5.001 -16.193 1.273 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -4.490 -16.561 3.574 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -3.620 -15.046 3.704 1.00 0.00 H new ATOM 0 HG LEU A 22 -5.600 -13.759 3.703 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -7.840 -14.673 3.260 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -6.764 -14.841 1.852 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -7.115 -16.253 2.877 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -6.926 -14.750 5.543 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -6.150 -16.324 5.243 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -5.178 -14.946 5.812 1.00 0.00 H new ATOM 339 N VAL A 23 -5.617 -13.905 0.501 1.00 0.00 N ATOM 340 CA VAL A 23 -5.902 -12.614 -0.099 1.00 0.00 C ATOM 341 C VAL A 23 -7.074 -11.921 0.572 1.00 0.00 C ATOM 342 O VAL A 23 -8.229 -12.320 0.422 1.00 0.00 O ATOM 343 CB VAL A 23 -6.180 -12.745 -1.610 1.00 0.00 C ATOM 344 CG1 VAL A 23 -6.128 -11.382 -2.284 1.00 0.00 C ATOM 345 CG2 VAL A 23 -5.186 -13.702 -2.258 1.00 0.00 C ATOM 0 H VAL A 23 -6.347 -14.606 0.374 1.00 0.00 H new ATOM 0 HA VAL A 23 -5.011 -12.004 0.048 1.00 0.00 H new ATOM 0 HB VAL A 23 -7.182 -13.153 -1.739 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -6.327 -11.495 -3.350 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -6.880 -10.729 -1.842 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -5.140 -10.944 -2.144 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -5.399 -13.781 -3.324 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -4.173 -13.325 -2.117 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -5.274 -14.686 -1.797 1.00 0.00 H new ATOM 355 N VAL A 24 -6.761 -10.854 1.292 1.00 0.00 N ATOM 356 CA VAL A 24 -7.774 -10.068 1.960 1.00 0.00 C ATOM 357 C VAL A 24 -7.963 -8.784 1.177 1.00 0.00 C ATOM 358 O VAL A 24 -7.040 -7.980 1.045 1.00 0.00 O ATOM 359 CB VAL A 24 -7.401 -9.752 3.423 1.00 0.00 C ATOM 360 CG1 VAL A 24 -6.097 -8.970 3.494 1.00 0.00 C ATOM 361 CG2 VAL A 24 -8.526 -8.992 4.110 1.00 0.00 C ATOM 0 H VAL A 24 -5.808 -10.516 1.426 1.00 0.00 H new ATOM 0 HA VAL A 24 -8.699 -10.643 1.994 1.00 0.00 H new ATOM 0 HB VAL A 24 -7.256 -10.696 3.949 1.00 0.00 H new ATOM 0 HG11 VAL A 24 -5.855 -8.759 4.536 1.00 0.00 H new ATOM 0 HG12 VAL A 24 -5.295 -9.558 3.047 1.00 0.00 H new ATOM 0 HG13 VAL A 24 -6.205 -8.032 2.950 1.00 0.00 H new ATOM 0 HG21 VAL A 24 -8.244 -8.778 5.141 1.00 0.00 H new ATOM 0 HG22 VAL A 24 -8.708 -8.056 3.582 1.00 0.00 H new ATOM 0 HG23 VAL A 24 -9.433 -9.597 4.100 1.00 0.00 H new ATOM 371 N VAL A 25 -9.149 -8.616 0.625 1.00 0.00 N ATOM 372 CA VAL A 25 -9.438 -7.449 -0.188 1.00 0.00 C ATOM 373 C VAL A 25 -10.639 -6.673 0.338 1.00 0.00 C ATOM 374 O VAL A 25 -11.383 -7.152 1.193 1.00 0.00 O ATOM 375 CB VAL A 25 -9.667 -7.858 -1.656 1.00 0.00 C ATOM 376 CG1 VAL A 25 -8.344 -8.161 -2.336 1.00 0.00 C ATOM 377 CG2 VAL A 25 -10.570 -9.071 -1.745 1.00 0.00 C ATOM 0 H VAL A 25 -9.926 -9.270 0.724 1.00 0.00 H new ATOM 0 HA VAL A 25 -8.571 -6.791 -0.133 1.00 0.00 H new ATOM 0 HB VAL A 25 -10.149 -7.022 -2.163 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -8.525 -8.448 -3.372 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -7.710 -7.274 -2.310 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -7.846 -8.978 -1.815 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -10.716 -9.340 -2.791 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -10.110 -9.906 -1.217 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -11.534 -8.841 -1.291 1.00 0.00 H new ATOM 387 N ASP A 26 -10.810 -5.461 -0.173 1.00 0.00 N ATOM 388 CA ASP A 26 -11.907 -4.603 0.252 1.00 0.00 C ATOM 389 C ASP A 26 -12.624 -3.971 -0.936 1.00 0.00 C ATOM 390 O ASP A 26 -11.991 -3.427 -1.841 1.00 0.00 O ATOM 391 CB ASP A 26 -11.387 -3.507 1.181 1.00 0.00 C ATOM 392 CG ASP A 26 -12.494 -2.877 2.007 1.00 0.00 C ATOM 393 OD1 ASP A 26 -13.669 -2.967 1.591 1.00 0.00 O ATOM 394 OD2 ASP A 26 -12.186 -2.293 3.068 1.00 0.00 O ATOM 0 H ASP A 26 -10.203 -5.050 -0.882 1.00 0.00 H new ATOM 0 HA ASP A 26 -12.624 -5.227 0.785 1.00 0.00 H new ATOM 0 HB2 ASP A 26 -10.633 -3.926 1.848 1.00 0.00 H new ATOM 0 HB3 ASP A 26 -10.895 -2.735 0.589 1.00 0.00 H new ATOM 399 N PHE A 27 -13.952 -4.015 -0.900 1.00 0.00 N ATOM 400 CA PHE A 27 -14.775 -3.423 -1.951 1.00 0.00 C ATOM 401 C PHE A 27 -15.208 -2.024 -1.520 1.00 0.00 C ATOM 402 O PHE A 27 -16.028 -1.878 -0.614 1.00 0.00 O ATOM 403 CB PHE A 27 -16.005 -4.295 -2.216 1.00 0.00 C ATOM 404 CG PHE A 27 -15.821 -5.221 -3.381 1.00 0.00 C ATOM 405 CD1 PHE A 27 -15.168 -6.432 -3.220 1.00 0.00 C ATOM 406 CD2 PHE A 27 -16.278 -4.871 -4.642 1.00 0.00 C ATOM 407 CE1 PHE A 27 -14.974 -7.280 -4.294 1.00 0.00 C ATOM 408 CE2 PHE A 27 -16.090 -5.715 -5.721 1.00 0.00 C ATOM 409 CZ PHE A 27 -15.436 -6.921 -5.547 1.00 0.00 C ATOM 0 H PHE A 27 -14.484 -4.457 -0.150 1.00 0.00 H new ATOM 0 HA PHE A 27 -14.194 -3.358 -2.871 1.00 0.00 H new ATOM 0 HB2 PHE A 27 -16.229 -4.881 -1.324 1.00 0.00 H new ATOM 0 HB3 PHE A 27 -16.867 -3.653 -2.400 1.00 0.00 H new ATOM 0 HD1 PHE A 27 -14.806 -6.717 -2.243 1.00 0.00 H new ATOM 0 HD2 PHE A 27 -16.786 -3.929 -4.783 1.00 0.00 H new ATOM 0 HE1 PHE A 27 -14.463 -8.221 -4.155 1.00 0.00 H new ATOM 0 HE2 PHE A 27 -16.453 -5.433 -6.698 1.00 0.00 H new ATOM 0 HZ PHE A 27 -15.286 -7.581 -6.388 1.00 0.00 H new ATOM 419 N SER A 28 -14.641 -0.998 -2.145 1.00 0.00 N ATOM 420 CA SER A 28 -14.966 0.377 -1.780 1.00 0.00 C ATOM 421 C SER A 28 -15.649 1.129 -2.918 1.00 0.00 C ATOM 422 O SER A 28 -16.062 0.540 -3.917 1.00 0.00 O ATOM 423 CB SER A 28 -13.695 1.118 -1.356 1.00 0.00 C ATOM 424 OG SER A 28 -12.923 1.494 -2.483 1.00 0.00 O ATOM 0 H SER A 28 -13.961 -1.090 -2.899 1.00 0.00 H new ATOM 0 HA SER A 28 -15.667 0.337 -0.947 1.00 0.00 H new ATOM 0 HB2 SER A 28 -13.962 2.005 -0.782 1.00 0.00 H new ATOM 0 HB3 SER A 28 -13.101 0.481 -0.700 1.00 0.00 H new ATOM 0 HG SER A 28 -12.118 1.967 -2.185 1.00 0.00 H new ATOM 430 N ALA A 29 -15.754 2.443 -2.745 1.00 0.00 N ATOM 431 CA ALA A 29 -16.372 3.317 -3.735 1.00 0.00 C ATOM 432 C ALA A 29 -15.769 4.713 -3.647 1.00 0.00 C ATOM 433 O ALA A 29 -15.327 5.133 -2.577 1.00 0.00 O ATOM 434 CB ALA A 29 -17.883 3.371 -3.530 1.00 0.00 C ATOM 0 H ALA A 29 -15.414 2.931 -1.916 1.00 0.00 H new ATOM 0 HA ALA A 29 -16.177 2.915 -4.729 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -18.328 4.028 -4.277 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -18.300 2.369 -3.633 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -18.101 3.755 -2.533 1.00 0.00 H new ATOM 440 N THR A 30 -15.781 5.448 -4.752 1.00 0.00 N ATOM 441 CA THR A 30 -15.257 6.808 -4.752 1.00 0.00 C ATOM 442 C THR A 30 -16.202 7.721 -3.974 1.00 0.00 C ATOM 443 O THR A 30 -15.777 8.635 -3.268 1.00 0.00 O ATOM 444 CB THR A 30 -15.087 7.318 -6.184 1.00 0.00 C ATOM 445 OG1 THR A 30 -16.112 6.815 -7.023 1.00 0.00 O ATOM 446 CG2 THR A 30 -13.758 6.936 -6.801 1.00 0.00 C ATOM 0 H THR A 30 -16.144 5.130 -5.651 1.00 0.00 H new ATOM 0 HA THR A 30 -14.279 6.810 -4.271 1.00 0.00 H new ATOM 0 HB THR A 30 -15.137 8.404 -6.111 1.00 0.00 H new ATOM 0 HG1 THR A 30 -15.985 7.154 -7.934 1.00 0.00 H new ATOM 0 HG21 THR A 30 -13.702 7.329 -7.816 1.00 0.00 H new ATOM 0 HG22 THR A 30 -12.947 7.354 -6.205 1.00 0.00 H new ATOM 0 HG23 THR A 30 -13.667 5.850 -6.826 1.00 0.00 H new ATOM 454 N TRP A 31 -17.494 7.454 -4.135 1.00 0.00 N ATOM 455 CA TRP A 31 -18.549 8.232 -3.490 1.00 0.00 C ATOM 456 C TRP A 31 -18.870 7.716 -2.080 1.00 0.00 C ATOM 457 O TRP A 31 -19.883 8.098 -1.493 1.00 0.00 O ATOM 458 CB TRP A 31 -19.812 8.156 -4.351 1.00 0.00 C ATOM 459 CG TRP A 31 -20.372 6.766 -4.422 1.00 0.00 C ATOM 460 CD1 TRP A 31 -19.980 5.759 -5.261 1.00 0.00 C ATOM 461 CD2 TRP A 31 -21.412 6.224 -3.604 1.00 0.00 C ATOM 462 NE1 TRP A 31 -20.712 4.624 -5.004 1.00 0.00 N ATOM 463 CE2 TRP A 31 -21.597 4.888 -3.993 1.00 0.00 C ATOM 464 CE3 TRP A 31 -22.204 6.740 -2.576 1.00 0.00 C ATOM 465 CZ2 TRP A 31 -22.538 4.060 -3.392 1.00 0.00 C ATOM 466 CZ3 TRP A 31 -23.139 5.918 -1.978 1.00 0.00 C ATOM 467 CH2 TRP A 31 -23.299 4.589 -2.389 1.00 0.00 C ATOM 0 H TRP A 31 -17.841 6.691 -4.717 1.00 0.00 H new ATOM 0 HA TRP A 31 -18.200 9.260 -3.394 1.00 0.00 H new ATOM 0 HB2 TRP A 31 -20.567 8.829 -3.944 1.00 0.00 H new ATOM 0 HB3 TRP A 31 -19.584 8.505 -5.358 1.00 0.00 H new ATOM 0 HD1 TRP A 31 -19.210 5.843 -6.013 1.00 0.00 H new ATOM 0 HE1 TRP A 31 -20.612 3.731 -5.487 1.00 0.00 H new ATOM 0 HE3 TRP A 31 -22.087 7.764 -2.254 1.00 0.00 H new ATOM 0 HZ2 TRP A 31 -22.663 3.035 -3.707 1.00 0.00 H new ATOM 0 HZ3 TRP A 31 -23.756 6.306 -1.181 1.00 0.00 H new ATOM 0 HH2 TRP A 31 -24.039 3.970 -1.903 1.00 0.00 H new ATOM 478 N CYS A 32 -18.018 6.849 -1.540 1.00 0.00 N ATOM 479 CA CYS A 32 -18.241 6.301 -0.204 1.00 0.00 C ATOM 480 C CYS A 32 -17.493 7.095 0.861 1.00 0.00 C ATOM 481 O CYS A 32 -16.514 7.782 0.570 1.00 0.00 O ATOM 482 CB CYS A 32 -17.824 4.829 -0.149 1.00 0.00 C ATOM 483 SG CYS A 32 -18.388 3.958 1.351 1.00 0.00 S ATOM 0 H CYS A 32 -17.173 6.512 -2.002 1.00 0.00 H new ATOM 0 HA CYS A 32 -19.308 6.377 0.006 1.00 0.00 H new ATOM 0 HB2 CYS A 32 -18.220 4.316 -1.026 1.00 0.00 H new ATOM 0 HB3 CYS A 32 -16.737 4.767 -0.207 1.00 0.00 H new ATOM 488 N GLY A 33 -17.961 6.984 2.103 1.00 0.00 N ATOM 489 CA GLY A 33 -17.327 7.685 3.204 1.00 0.00 C ATOM 490 C GLY A 33 -16.563 6.751 4.128 1.00 0.00 C ATOM 491 O GLY A 33 -15.336 6.816 4.202 1.00 0.00 O ATOM 0 H GLY A 33 -18.769 6.420 2.365 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -16.644 8.436 2.807 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -18.087 8.216 3.777 1.00 0.00 H new ATOM 495 N PRO A 34 -17.265 5.861 4.855 1.00 0.00 N ATOM 496 CA PRO A 34 -16.626 4.914 5.777 1.00 0.00 C ATOM 497 C PRO A 34 -15.683 3.956 5.057 1.00 0.00 C ATOM 498 O PRO A 34 -14.783 3.380 5.669 1.00 0.00 O ATOM 499 CB PRO A 34 -17.803 4.143 6.393 1.00 0.00 C ATOM 500 CG PRO A 34 -19.005 4.983 6.126 1.00 0.00 C ATOM 501 CD PRO A 34 -18.728 5.710 4.841 1.00 0.00 C ATOM 0 HA PRO A 34 -16.010 5.427 6.516 1.00 0.00 H new ATOM 0 HB2 PRO A 34 -17.905 3.156 5.943 1.00 0.00 H new ATOM 0 HB3 PRO A 34 -17.658 3.992 7.463 1.00 0.00 H new ATOM 0 HG2 PRO A 34 -19.900 4.367 6.040 1.00 0.00 H new ATOM 0 HG3 PRO A 34 -19.179 5.685 6.941 1.00 0.00 H new ATOM 0 HD2 PRO A 34 -19.067 5.142 3.975 1.00 0.00 H new ATOM 0 HD3 PRO A 34 -19.233 6.675 4.806 1.00 0.00 H new ATOM 509 N CYS A 35 -15.889 3.793 3.754 1.00 0.00 N ATOM 510 CA CYS A 35 -15.051 2.911 2.953 1.00 0.00 C ATOM 511 C CYS A 35 -13.617 3.420 2.950 1.00 0.00 C ATOM 512 O CYS A 35 -12.665 2.649 3.062 1.00 0.00 O ATOM 513 CB CYS A 35 -15.573 2.833 1.516 1.00 0.00 C ATOM 514 SG CYS A 35 -17.293 2.248 1.372 1.00 0.00 S ATOM 0 H CYS A 35 -16.629 4.261 3.231 1.00 0.00 H new ATOM 0 HA CYS A 35 -15.080 1.913 3.391 1.00 0.00 H new ATOM 0 HB2 CYS A 35 -15.498 3.821 1.061 1.00 0.00 H new ATOM 0 HB3 CYS A 35 -14.927 2.168 0.943 1.00 0.00 H new ATOM 519 N LYS A 36 -13.482 4.733 2.818 1.00 0.00 N ATOM 520 CA LYS A 36 -12.178 5.380 2.794 1.00 0.00 C ATOM 521 C LYS A 36 -11.459 5.233 4.133 1.00 0.00 C ATOM 522 O LYS A 36 -10.230 5.218 4.189 1.00 0.00 O ATOM 523 CB LYS A 36 -12.345 6.862 2.453 1.00 0.00 C ATOM 524 CG LYS A 36 -13.326 7.115 1.317 1.00 0.00 C ATOM 525 CD LYS A 36 -12.760 8.079 0.288 1.00 0.00 C ATOM 526 CE LYS A 36 -12.449 9.434 0.903 1.00 0.00 C ATOM 527 NZ LYS A 36 -11.198 10.022 0.349 1.00 0.00 N ATOM 0 H LYS A 36 -14.269 5.376 2.725 1.00 0.00 H new ATOM 0 HA LYS A 36 -11.571 4.893 2.031 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -12.684 7.395 3.341 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -11.374 7.277 2.183 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -13.573 6.170 0.833 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -14.254 7.518 1.721 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -11.852 7.658 -0.145 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -13.474 8.203 -0.526 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -13.281 10.114 0.722 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -12.353 9.329 1.984 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -11.022 10.945 0.794 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -10.399 9.385 0.544 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -11.298 10.147 -0.679 1.00 0.00 H new ATOM 541 N MET A 37 -12.230 5.146 5.213 1.00 0.00 N ATOM 542 CA MET A 37 -11.662 5.027 6.553 1.00 0.00 C ATOM 543 C MET A 37 -10.962 3.685 6.775 1.00 0.00 C ATOM 544 O MET A 37 -10.159 3.551 7.698 1.00 0.00 O ATOM 545 CB MET A 37 -12.756 5.218 7.608 1.00 0.00 C ATOM 546 CG MET A 37 -13.432 6.578 7.546 1.00 0.00 C ATOM 547 SD MET A 37 -14.851 6.700 8.652 1.00 0.00 S ATOM 548 CE MET A 37 -15.115 8.472 8.679 1.00 0.00 C ATOM 0 H MET A 37 -13.250 5.156 5.187 1.00 0.00 H new ATOM 0 HA MET A 37 -10.909 5.809 6.651 1.00 0.00 H new ATOM 0 HB2 MET A 37 -13.510 4.441 7.482 1.00 0.00 H new ATOM 0 HB3 MET A 37 -12.321 5.083 8.598 1.00 0.00 H new ATOM 0 HG2 MET A 37 -12.708 7.351 7.804 1.00 0.00 H new ATOM 0 HG3 MET A 37 -13.756 6.772 6.523 1.00 0.00 H new ATOM 0 HE1 MET A 37 -15.963 8.704 9.324 1.00 0.00 H new ATOM 0 HE2 MET A 37 -14.222 8.967 9.061 1.00 0.00 H new ATOM 0 HE3 MET A 37 -15.321 8.825 7.668 1.00 0.00 H new ATOM 558 N ILE A 38 -11.258 2.693 5.937 1.00 0.00 N ATOM 559 CA ILE A 38 -10.639 1.374 6.078 1.00 0.00 C ATOM 560 C ILE A 38 -9.318 1.291 5.313 1.00 0.00 C ATOM 561 O ILE A 38 -8.457 0.475 5.639 1.00 0.00 O ATOM 562 CB ILE A 38 -11.576 0.257 5.568 1.00 0.00 C ATOM 563 CG1 ILE A 38 -12.968 0.392 6.196 1.00 0.00 C ATOM 564 CG2 ILE A 38 -10.981 -1.115 5.864 1.00 0.00 C ATOM 565 CD1 ILE A 38 -13.029 -0.027 7.650 1.00 0.00 C ATOM 0 H ILE A 38 -11.915 2.774 5.161 1.00 0.00 H new ATOM 0 HA ILE A 38 -10.449 1.232 7.142 1.00 0.00 H new ATOM 0 HB ILE A 38 -11.679 0.360 4.488 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -13.294 1.429 6.113 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -13.674 -0.211 5.624 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -11.654 -1.890 5.498 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -10.016 -1.208 5.366 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -10.847 -1.229 6.940 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -14.046 0.097 8.022 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -12.735 -1.073 7.740 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -12.350 0.592 8.236 1.00 0.00 H new ATOM 577 N LYS A 39 -9.164 2.140 4.298 1.00 0.00 N ATOM 578 CA LYS A 39 -7.949 2.159 3.485 1.00 0.00 C ATOM 579 C LYS A 39 -6.688 2.289 4.346 1.00 0.00 C ATOM 580 O LYS A 39 -5.751 1.505 4.202 1.00 0.00 O ATOM 581 CB LYS A 39 -8.008 3.298 2.462 1.00 0.00 C ATOM 582 CG LYS A 39 -8.411 2.845 1.065 1.00 0.00 C ATOM 583 CD LYS A 39 -9.092 3.964 0.292 1.00 0.00 C ATOM 584 CE LYS A 39 -9.478 3.521 -1.111 1.00 0.00 C ATOM 585 NZ LYS A 39 -10.764 4.131 -1.554 1.00 0.00 N ATOM 0 H LYS A 39 -9.867 2.825 4.019 1.00 0.00 H new ATOM 0 HA LYS A 39 -7.894 1.206 2.959 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -8.717 4.050 2.809 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -7.032 3.780 2.411 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -7.528 2.510 0.521 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -9.083 1.990 1.138 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -9.983 4.289 0.830 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -8.425 4.824 0.232 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -8.687 3.796 -1.809 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -9.564 2.435 -1.138 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -10.991 3.804 -2.515 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -11.525 3.849 -0.903 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -10.675 5.167 -1.553 1.00 0.00 H new ATOM 599 N PRO A 40 -6.642 3.291 5.243 1.00 0.00 N ATOM 600 CA PRO A 40 -5.480 3.527 6.110 1.00 0.00 C ATOM 601 C PRO A 40 -5.019 2.280 6.859 1.00 0.00 C ATOM 602 O PRO A 40 -3.829 1.963 6.874 1.00 0.00 O ATOM 603 CB PRO A 40 -5.984 4.578 7.097 1.00 0.00 C ATOM 604 CG PRO A 40 -7.044 5.310 6.352 1.00 0.00 C ATOM 605 CD PRO A 40 -7.707 4.287 5.473 1.00 0.00 C ATOM 0 HA PRO A 40 -4.610 3.835 5.529 1.00 0.00 H new ATOM 0 HB2 PRO A 40 -6.381 4.116 8.001 1.00 0.00 H new ATOM 0 HB3 PRO A 40 -5.182 5.248 7.407 1.00 0.00 H new ATOM 0 HG2 PRO A 40 -7.762 5.762 7.036 1.00 0.00 H new ATOM 0 HG3 PRO A 40 -6.617 6.118 5.758 1.00 0.00 H new ATOM 0 HD2 PRO A 40 -8.575 3.842 5.959 1.00 0.00 H new ATOM 0 HD3 PRO A 40 -8.055 4.726 4.538 1.00 0.00 H new ATOM 613 N PHE A 41 -5.954 1.588 7.504 1.00 0.00 N ATOM 614 CA PHE A 41 -5.613 0.401 8.285 1.00 0.00 C ATOM 615 C PHE A 41 -5.427 -0.828 7.402 1.00 0.00 C ATOM 616 O PHE A 41 -4.638 -1.715 7.729 1.00 0.00 O ATOM 617 CB PHE A 41 -6.709 0.111 9.312 1.00 0.00 C ATOM 618 CG PHE A 41 -7.223 1.329 10.027 1.00 0.00 C ATOM 619 CD1 PHE A 41 -6.444 1.978 10.970 1.00 0.00 C ATOM 620 CD2 PHE A 41 -8.491 1.820 9.758 1.00 0.00 C ATOM 621 CE1 PHE A 41 -6.920 3.093 11.632 1.00 0.00 C ATOM 622 CE2 PHE A 41 -8.972 2.935 10.416 1.00 0.00 C ATOM 623 CZ PHE A 41 -8.185 3.572 11.355 1.00 0.00 C ATOM 0 H PHE A 41 -6.946 1.825 7.502 1.00 0.00 H new ATOM 0 HA PHE A 41 -4.669 0.610 8.789 1.00 0.00 H new ATOM 0 HB2 PHE A 41 -7.542 -0.379 8.809 1.00 0.00 H new ATOM 0 HB3 PHE A 41 -6.323 -0.593 10.049 1.00 0.00 H new ATOM 0 HD1 PHE A 41 -5.453 1.608 11.190 1.00 0.00 H new ATOM 0 HD2 PHE A 41 -9.110 1.325 9.025 1.00 0.00 H new ATOM 0 HE1 PHE A 41 -6.303 3.590 12.366 1.00 0.00 H new ATOM 0 HE2 PHE A 41 -9.962 3.308 10.197 1.00 0.00 H new ATOM 0 HZ PHE A 41 -8.558 4.444 11.872 1.00 0.00 H new ATOM 633 N PHE A 42 -6.140 -0.880 6.283 1.00 0.00 N ATOM 634 CA PHE A 42 -6.025 -2.010 5.371 1.00 0.00 C ATOM 635 C PHE A 42 -4.630 -2.058 4.763 1.00 0.00 C ATOM 636 O PHE A 42 -4.001 -3.115 4.697 1.00 0.00 O ATOM 637 CB PHE A 42 -7.077 -1.907 4.266 1.00 0.00 C ATOM 638 CG PHE A 42 -7.523 -3.234 3.720 1.00 0.00 C ATOM 639 CD1 PHE A 42 -8.399 -4.036 4.438 1.00 0.00 C ATOM 640 CD2 PHE A 42 -7.079 -3.674 2.483 1.00 0.00 C ATOM 641 CE1 PHE A 42 -8.822 -5.250 3.933 1.00 0.00 C ATOM 642 CE2 PHE A 42 -7.498 -4.890 1.975 1.00 0.00 C ATOM 643 CZ PHE A 42 -8.371 -5.677 2.700 1.00 0.00 C ATOM 0 H PHE A 42 -6.798 -0.159 5.988 1.00 0.00 H new ATOM 0 HA PHE A 42 -6.194 -2.929 5.932 1.00 0.00 H new ATOM 0 HB2 PHE A 42 -7.946 -1.375 4.654 1.00 0.00 H new ATOM 0 HB3 PHE A 42 -6.674 -1.307 3.450 1.00 0.00 H new ATOM 0 HD1 PHE A 42 -8.754 -3.707 5.403 1.00 0.00 H new ATOM 0 HD2 PHE A 42 -6.399 -3.061 1.910 1.00 0.00 H new ATOM 0 HE1 PHE A 42 -9.504 -5.864 4.502 1.00 0.00 H new ATOM 0 HE2 PHE A 42 -7.143 -5.224 1.011 1.00 0.00 H new ATOM 0 HZ PHE A 42 -8.701 -6.626 2.303 1.00 0.00 H new ATOM 653 N HIS A 43 -4.155 -0.901 4.314 1.00 0.00 N ATOM 654 CA HIS A 43 -2.837 -0.798 3.702 1.00 0.00 C ATOM 655 C HIS A 43 -1.733 -1.087 4.714 1.00 0.00 C ATOM 656 O HIS A 43 -0.736 -1.730 4.386 1.00 0.00 O ATOM 657 CB HIS A 43 -2.640 0.595 3.098 1.00 0.00 C ATOM 658 CG HIS A 43 -1.974 0.575 1.758 1.00 0.00 C ATOM 659 ND1 HIS A 43 -2.602 0.908 0.578 1.00 0.00 N ATOM 660 CD2 HIS A 43 -0.702 0.239 1.423 1.00 0.00 C ATOM 661 CE1 HIS A 43 -1.712 0.766 -0.414 1.00 0.00 C ATOM 662 NE2 HIS A 43 -0.544 0.362 0.046 1.00 0.00 N ATOM 0 H HIS A 43 -4.666 -0.019 4.363 1.00 0.00 H new ATOM 0 HA HIS A 43 -2.777 -1.545 2.910 1.00 0.00 H new ATOM 0 HB2 HIS A 43 -3.610 1.083 3.006 1.00 0.00 H new ATOM 0 HB3 HIS A 43 -2.044 1.198 3.783 1.00 0.00 H new ATOM 0 HD2 HIS A 43 0.065 -0.074 2.115 1.00 0.00 H new ATOM 0 HE1 HIS A 43 -1.924 0.958 -1.455 1.00 0.00 H new ATOM 0 HE2 HIS A 43 0.301 0.178 -0.496 1.00 0.00 H new ATOM 670 N SER A 44 -1.909 -0.607 5.943 1.00 0.00 N ATOM 671 CA SER A 44 -0.915 -0.816 6.991 1.00 0.00 C ATOM 672 C SER A 44 -0.706 -2.304 7.262 1.00 0.00 C ATOM 673 O SER A 44 0.427 -2.772 7.403 1.00 0.00 O ATOM 674 CB SER A 44 -1.344 -0.108 8.278 1.00 0.00 C ATOM 675 OG SER A 44 -0.540 -0.509 9.374 1.00 0.00 O ATOM 0 H SER A 44 -2.727 -0.073 6.236 1.00 0.00 H new ATOM 0 HA SER A 44 0.029 -0.394 6.647 1.00 0.00 H new ATOM 0 HB2 SER A 44 -1.270 0.971 8.145 1.00 0.00 H new ATOM 0 HB3 SER A 44 -2.390 -0.332 8.489 1.00 0.00 H new ATOM 0 HG SER A 44 -0.834 -0.041 10.184 1.00 0.00 H new ATOM 681 N LEU A 45 -1.803 -3.049 7.337 1.00 0.00 N ATOM 682 CA LEU A 45 -1.725 -4.479 7.593 1.00 0.00 C ATOM 683 C LEU A 45 -0.915 -5.167 6.500 1.00 0.00 C ATOM 684 O LEU A 45 -0.143 -6.087 6.769 1.00 0.00 O ATOM 685 CB LEU A 45 -3.129 -5.088 7.665 1.00 0.00 C ATOM 686 CG LEU A 45 -3.924 -4.741 8.927 1.00 0.00 C ATOM 687 CD1 LEU A 45 -5.420 -4.798 8.649 1.00 0.00 C ATOM 688 CD2 LEU A 45 -3.554 -5.686 10.062 1.00 0.00 C ATOM 0 H LEU A 45 -2.750 -2.688 7.225 1.00 0.00 H new ATOM 0 HA LEU A 45 -1.228 -4.631 8.551 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -3.696 -4.758 6.795 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -3.042 -6.172 7.596 1.00 0.00 H new ATOM 0 HG LEU A 45 -3.671 -3.724 9.227 1.00 0.00 H new ATOM 0 HD11 LEU A 45 -5.969 -4.549 9.557 1.00 0.00 H new ATOM 0 HD12 LEU A 45 -5.672 -4.084 7.865 1.00 0.00 H new ATOM 0 HD13 LEU A 45 -5.692 -5.803 8.325 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -4.127 -5.427 10.952 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -3.781 -6.711 9.770 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -2.489 -5.597 10.277 1.00 0.00 H new ATOM 700 N SER A 46 -1.095 -4.708 5.266 1.00 0.00 N ATOM 701 CA SER A 46 -0.382 -5.267 4.122 1.00 0.00 C ATOM 702 C SER A 46 1.132 -5.212 4.311 1.00 0.00 C ATOM 703 O SER A 46 1.856 -6.069 3.801 1.00 0.00 O ATOM 704 CB SER A 46 -0.761 -4.514 2.845 1.00 0.00 C ATOM 705 OG SER A 46 -0.251 -5.167 1.696 1.00 0.00 O ATOM 0 H SER A 46 -1.732 -3.947 5.031 1.00 0.00 H new ATOM 0 HA SER A 46 -0.675 -6.313 4.038 1.00 0.00 H new ATOM 0 HB2 SER A 46 -1.846 -4.439 2.772 1.00 0.00 H new ATOM 0 HB3 SER A 46 -0.373 -3.496 2.891 1.00 0.00 H new ATOM 0 HG SER A 46 0.574 -4.724 1.407 1.00 0.00 H new ATOM 711 N GLU A 47 1.617 -4.202 5.036 1.00 0.00 N ATOM 712 CA GLU A 47 3.053 -4.060 5.260 1.00 0.00 C ATOM 713 C GLU A 47 3.515 -4.869 6.468 1.00 0.00 C ATOM 714 O GLU A 47 4.703 -5.156 6.611 1.00 0.00 O ATOM 715 CB GLU A 47 3.435 -2.584 5.421 1.00 0.00 C ATOM 716 CG GLU A 47 2.942 -1.949 6.712 1.00 0.00 C ATOM 717 CD GLU A 47 3.947 -0.978 7.301 1.00 0.00 C ATOM 718 OE1 GLU A 47 4.743 -0.407 6.527 1.00 0.00 O ATOM 719 OE2 GLU A 47 3.941 -0.790 8.535 1.00 0.00 O ATOM 0 H GLU A 47 1.043 -3.480 5.472 1.00 0.00 H new ATOM 0 HA GLU A 47 3.563 -4.456 4.382 1.00 0.00 H new ATOM 0 HB2 GLU A 47 4.520 -2.494 5.377 1.00 0.00 H new ATOM 0 HB3 GLU A 47 3.034 -2.023 4.577 1.00 0.00 H new ATOM 0 HG2 GLU A 47 2.005 -1.426 6.521 1.00 0.00 H new ATOM 0 HG3 GLU A 47 2.728 -2.732 7.440 1.00 0.00 H new ATOM 726 N LYS A 48 2.577 -5.251 7.328 1.00 0.00 N ATOM 727 CA LYS A 48 2.912 -6.045 8.506 1.00 0.00 C ATOM 728 C LYS A 48 2.687 -7.531 8.222 1.00 0.00 C ATOM 729 O LYS A 48 3.251 -8.396 8.892 1.00 0.00 O ATOM 730 CB LYS A 48 2.076 -5.601 9.708 1.00 0.00 C ATOM 731 CG LYS A 48 2.436 -6.316 11.001 1.00 0.00 C ATOM 732 CD LYS A 48 1.251 -6.379 11.949 1.00 0.00 C ATOM 733 CE LYS A 48 0.309 -7.517 11.591 1.00 0.00 C ATOM 734 NZ LYS A 48 0.876 -8.843 11.957 1.00 0.00 N ATOM 0 H LYS A 48 1.587 -5.026 7.234 1.00 0.00 H new ATOM 0 HA LYS A 48 3.965 -5.888 8.742 1.00 0.00 H new ATOM 0 HB2 LYS A 48 2.201 -4.528 9.850 1.00 0.00 H new ATOM 0 HB3 LYS A 48 1.022 -5.773 9.490 1.00 0.00 H new ATOM 0 HG2 LYS A 48 2.778 -7.326 10.777 1.00 0.00 H new ATOM 0 HG3 LYS A 48 3.264 -5.799 11.486 1.00 0.00 H new ATOM 0 HD2 LYS A 48 1.608 -6.509 12.971 1.00 0.00 H new ATOM 0 HD3 LYS A 48 0.709 -5.434 11.918 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -0.643 -7.375 12.103 1.00 0.00 H new ATOM 0 HE3 LYS A 48 0.102 -7.494 10.521 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 0.126 -9.563 11.921 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 1.631 -9.095 11.287 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 1.268 -8.799 12.919 1.00 0.00 H new ATOM 748 N TYR A 49 1.867 -7.815 7.212 1.00 0.00 N ATOM 749 CA TYR A 49 1.568 -9.189 6.820 1.00 0.00 C ATOM 750 C TYR A 49 2.433 -9.617 5.639 1.00 0.00 C ATOM 751 O TYR A 49 2.073 -9.400 4.482 1.00 0.00 O ATOM 752 CB TYR A 49 0.092 -9.322 6.444 1.00 0.00 C ATOM 753 CG TYR A 49 -0.813 -9.621 7.618 1.00 0.00 C ATOM 754 CD1 TYR A 49 -1.234 -8.611 8.475 1.00 0.00 C ATOM 755 CD2 TYR A 49 -1.241 -10.919 7.874 1.00 0.00 C ATOM 756 CE1 TYR A 49 -2.055 -8.886 9.551 1.00 0.00 C ATOM 757 CE2 TYR A 49 -2.062 -11.200 8.950 1.00 0.00 C ATOM 758 CZ TYR A 49 -2.466 -10.180 9.785 1.00 0.00 C ATOM 759 OH TYR A 49 -3.285 -10.453 10.855 1.00 0.00 O ATOM 0 H TYR A 49 1.396 -7.107 6.648 1.00 0.00 H new ATOM 0 HA TYR A 49 1.786 -9.837 7.669 1.00 0.00 H new ATOM 0 HB2 TYR A 49 -0.237 -8.397 5.970 1.00 0.00 H new ATOM 0 HB3 TYR A 49 -0.015 -10.115 5.704 1.00 0.00 H new ATOM 0 HD1 TYR A 49 -0.914 -7.595 8.297 1.00 0.00 H new ATOM 0 HD2 TYR A 49 -0.927 -11.720 7.222 1.00 0.00 H new ATOM 0 HE1 TYR A 49 -2.374 -8.089 10.207 1.00 0.00 H new ATOM 0 HE2 TYR A 49 -2.385 -12.214 9.136 1.00 0.00 H new ATOM 0 HH TYR A 49 -3.484 -11.412 10.879 1.00 0.00 H new ATOM 769 N SER A 50 3.573 -10.232 5.935 1.00 0.00 N ATOM 770 CA SER A 50 4.483 -10.695 4.892 1.00 0.00 C ATOM 771 C SER A 50 4.131 -12.116 4.460 1.00 0.00 C ATOM 772 O SER A 50 4.998 -12.985 4.364 1.00 0.00 O ATOM 773 CB SER A 50 5.928 -10.636 5.392 1.00 0.00 C ATOM 774 OG SER A 50 6.845 -10.864 4.337 1.00 0.00 O ATOM 0 H SER A 50 3.889 -10.421 6.886 1.00 0.00 H new ATOM 0 HA SER A 50 4.380 -10.039 4.027 1.00 0.00 H new ATOM 0 HB2 SER A 50 6.121 -9.661 5.841 1.00 0.00 H new ATOM 0 HB3 SER A 50 6.076 -11.381 6.173 1.00 0.00 H new ATOM 0 HG SER A 50 6.696 -11.757 3.961 1.00 0.00 H new ATOM 780 N ASN A 51 2.848 -12.339 4.193 1.00 0.00 N ATOM 781 CA ASN A 51 2.361 -13.643 3.760 1.00 0.00 C ATOM 782 C ASN A 51 1.101 -13.493 2.912 1.00 0.00 C ATOM 783 O ASN A 51 0.937 -14.165 1.895 1.00 0.00 O ATOM 784 CB ASN A 51 2.070 -14.535 4.971 1.00 0.00 C ATOM 785 CG ASN A 51 2.502 -15.973 4.752 1.00 0.00 C ATOM 786 OD1 ASN A 51 3.406 -16.251 3.964 1.00 0.00 O ATOM 787 ND2 ASN A 51 1.854 -16.898 5.449 1.00 0.00 N ATOM 0 H ASN A 51 2.122 -11.627 4.270 1.00 0.00 H new ATOM 0 HA ASN A 51 3.137 -14.111 3.154 1.00 0.00 H new ATOM 0 HB2 ASN A 51 2.583 -14.134 5.845 1.00 0.00 H new ATOM 0 HB3 ASN A 51 1.002 -14.509 5.189 1.00 0.00 H new ATOM 0 HD21 ASN A 51 2.099 -17.882 5.342 1.00 0.00 H new ATOM 0 HD22 ASN A 51 1.111 -16.625 6.092 1.00 0.00 H new ATOM 794 N VAL A 52 0.207 -12.608 3.353 1.00 0.00 N ATOM 795 CA VAL A 52 -1.053 -12.367 2.657 1.00 0.00 C ATOM 796 C VAL A 52 -0.951 -11.193 1.694 1.00 0.00 C ATOM 797 O VAL A 52 -0.146 -10.283 1.886 1.00 0.00 O ATOM 798 CB VAL A 52 -2.190 -12.075 3.659 1.00 0.00 C ATOM 799 CG1 VAL A 52 -2.253 -13.152 4.726 1.00 0.00 C ATOM 800 CG2 VAL A 52 -2.012 -10.705 4.295 1.00 0.00 C ATOM 0 H VAL A 52 0.335 -12.044 4.194 1.00 0.00 H new ATOM 0 HA VAL A 52 -1.274 -13.274 2.094 1.00 0.00 H new ATOM 0 HB VAL A 52 -3.132 -12.077 3.111 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -3.061 -12.927 5.422 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -2.436 -14.119 4.257 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -1.307 -13.185 5.266 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -2.825 -10.521 4.997 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -1.060 -10.671 4.825 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -2.023 -9.939 3.519 1.00 0.00 H new ATOM 810 N ILE A 53 -1.782 -11.223 0.659 1.00 0.00 N ATOM 811 CA ILE A 53 -1.795 -10.162 -0.335 1.00 0.00 C ATOM 812 C ILE A 53 -3.005 -9.250 -0.147 1.00 0.00 C ATOM 813 O ILE A 53 -4.153 -9.672 -0.294 1.00 0.00 O ATOM 814 CB ILE A 53 -1.770 -10.738 -1.776 1.00 0.00 C ATOM 815 CG1 ILE A 53 -1.160 -9.725 -2.743 1.00 0.00 C ATOM 816 CG2 ILE A 53 -3.158 -11.150 -2.247 1.00 0.00 C ATOM 817 CD1 ILE A 53 0.336 -9.571 -2.593 1.00 0.00 C ATOM 0 H ILE A 53 -2.454 -11.971 0.488 1.00 0.00 H new ATOM 0 HA ILE A 53 -0.892 -9.569 -0.192 1.00 0.00 H new ATOM 0 HB ILE A 53 -1.150 -11.634 -1.760 1.00 0.00 H new ATOM 0 HG12 ILE A 53 -1.385 -10.030 -3.765 1.00 0.00 H new ATOM 0 HG13 ILE A 53 -1.634 -8.756 -2.588 1.00 0.00 H new ATOM 0 HG21 ILE A 53 -3.095 -11.548 -3.260 1.00 0.00 H new ATOM 0 HG22 ILE A 53 -3.556 -11.915 -1.581 1.00 0.00 H new ATOM 0 HG23 ILE A 53 -3.818 -10.282 -2.238 1.00 0.00 H new ATOM 0 HD11 ILE A 53 0.700 -8.836 -3.311 1.00 0.00 H new ATOM 0 HD12 ILE A 53 0.568 -9.236 -1.582 1.00 0.00 H new ATOM 0 HD13 ILE A 53 0.821 -10.530 -2.778 1.00 0.00 H new ATOM 829 N PHE A 54 -2.731 -7.995 0.187 1.00 0.00 N ATOM 830 CA PHE A 54 -3.776 -7.004 0.403 1.00 0.00 C ATOM 831 C PHE A 54 -3.958 -6.170 -0.862 1.00 0.00 C ATOM 832 O PHE A 54 -3.048 -5.438 -1.247 1.00 0.00 O ATOM 833 CB PHE A 54 -3.363 -6.044 1.530 1.00 0.00 C ATOM 834 CG PHE A 54 -3.735 -6.444 2.937 1.00 0.00 C ATOM 835 CD1 PHE A 54 -3.209 -7.581 3.546 1.00 0.00 C ATOM 836 CD2 PHE A 54 -4.598 -5.641 3.668 1.00 0.00 C ATOM 837 CE1 PHE A 54 -3.547 -7.900 4.853 1.00 0.00 C ATOM 838 CE2 PHE A 54 -4.939 -5.962 4.967 1.00 0.00 C ATOM 839 CZ PHE A 54 -4.414 -7.090 5.560 1.00 0.00 C ATOM 0 H PHE A 54 -1.784 -7.638 0.315 1.00 0.00 H new ATOM 0 HA PHE A 54 -4.697 -7.525 0.662 1.00 0.00 H new ATOM 0 HB2 PHE A 54 -2.281 -5.917 1.488 1.00 0.00 H new ATOM 0 HB3 PHE A 54 -3.807 -5.070 1.326 1.00 0.00 H new ATOM 0 HD1 PHE A 54 -2.533 -8.219 2.996 1.00 0.00 H new ATOM 0 HD2 PHE A 54 -5.009 -4.751 3.214 1.00 0.00 H new ATOM 0 HE1 PHE A 54 -3.132 -8.782 5.318 1.00 0.00 H new ATOM 0 HE2 PHE A 54 -5.618 -5.329 5.519 1.00 0.00 H new ATOM 0 HZ PHE A 54 -4.680 -7.340 6.576 1.00 0.00 H new ATOM 849 N LEU A 55 -5.125 -6.243 -1.498 1.00 0.00 N ATOM 850 CA LEU A 55 -5.353 -5.443 -2.693 1.00 0.00 C ATOM 851 C LEU A 55 -6.625 -4.625 -2.581 1.00 0.00 C ATOM 852 O LEU A 55 -7.442 -4.841 -1.688 1.00 0.00 O ATOM 853 CB LEU A 55 -5.325 -6.291 -3.966 1.00 0.00 C ATOM 854 CG LEU A 55 -6.666 -6.645 -4.612 1.00 0.00 C ATOM 855 CD1 LEU A 55 -6.920 -5.749 -5.814 1.00 0.00 C ATOM 856 CD2 LEU A 55 -6.665 -8.104 -5.040 1.00 0.00 C ATOM 0 H LEU A 55 -5.907 -6.832 -1.214 1.00 0.00 H new ATOM 0 HA LEU A 55 -4.525 -4.739 -2.771 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -4.724 -5.764 -4.707 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -4.806 -7.222 -3.738 1.00 0.00 H new ATOM 0 HG LEU A 55 -7.462 -6.489 -3.884 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -7.877 -6.009 -6.266 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -6.942 -4.707 -5.493 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -6.124 -5.887 -6.545 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -7.623 -8.349 -5.499 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -5.864 -8.271 -5.760 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -6.508 -8.739 -4.168 1.00 0.00 H new ATOM 868 N GLU A 56 -6.754 -3.644 -3.460 1.00 0.00 N ATOM 869 CA GLU A 56 -7.887 -2.740 -3.425 1.00 0.00 C ATOM 870 C GLU A 56 -8.760 -2.831 -4.664 1.00 0.00 C ATOM 871 O GLU A 56 -8.310 -2.556 -5.775 1.00 0.00 O ATOM 872 CB GLU A 56 -7.352 -1.324 -3.316 1.00 0.00 C ATOM 873 CG GLU A 56 -8.229 -0.379 -2.508 1.00 0.00 C ATOM 874 CD GLU A 56 -8.230 -0.706 -1.027 1.00 0.00 C ATOM 875 OE1 GLU A 56 -7.336 -0.209 -0.309 1.00 0.00 O ATOM 876 OE2 GLU A 56 -9.124 -1.460 -0.585 1.00 0.00 O ATOM 0 H GLU A 56 -6.085 -3.455 -4.207 1.00 0.00 H new ATOM 0 HA GLU A 56 -8.507 -3.017 -2.573 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -6.361 -1.357 -2.862 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -7.230 -0.917 -4.320 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -7.881 0.644 -2.650 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -9.250 -0.424 -2.887 1.00 0.00 H new ATOM 883 N VAL A 57 -10.018 -3.190 -4.465 1.00 0.00 N ATOM 884 CA VAL A 57 -10.952 -3.281 -5.573 1.00 0.00 C ATOM 885 C VAL A 57 -12.069 -2.256 -5.429 1.00 0.00 C ATOM 886 O VAL A 57 -12.840 -2.285 -4.472 1.00 0.00 O ATOM 887 CB VAL A 57 -11.576 -4.682 -5.706 1.00 0.00 C ATOM 888 CG1 VAL A 57 -12.054 -4.886 -7.128 1.00 0.00 C ATOM 889 CG2 VAL A 57 -10.585 -5.767 -5.311 1.00 0.00 C ATOM 0 H VAL A 57 -10.413 -3.421 -3.553 1.00 0.00 H new ATOM 0 HA VAL A 57 -10.373 -3.077 -6.474 1.00 0.00 H new ATOM 0 HB VAL A 57 -12.425 -4.753 -5.026 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -12.496 -5.878 -7.224 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -12.800 -4.130 -7.373 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -11.210 -4.797 -7.812 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -11.055 -6.745 -5.416 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -9.710 -5.714 -5.959 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -10.279 -5.621 -4.275 1.00 0.00 H new ATOM 899 N ASP A 58 -12.146 -1.347 -6.388 1.00 0.00 N ATOM 900 CA ASP A 58 -13.168 -0.313 -6.383 1.00 0.00 C ATOM 901 C ASP A 58 -14.308 -0.736 -7.303 1.00 0.00 C ATOM 902 O ASP A 58 -14.099 -0.976 -8.493 1.00 0.00 O ATOM 903 CB ASP A 58 -12.566 1.021 -6.837 1.00 0.00 C ATOM 904 CG ASP A 58 -13.587 2.144 -6.880 1.00 0.00 C ATOM 905 OD1 ASP A 58 -14.481 2.168 -6.007 1.00 0.00 O ATOM 906 OD2 ASP A 58 -13.491 3.003 -7.784 1.00 0.00 O ATOM 0 H ASP A 58 -11.509 -1.305 -7.184 1.00 0.00 H new ATOM 0 HA ASP A 58 -13.557 -0.181 -5.373 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -11.757 1.298 -6.161 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -12.127 0.898 -7.827 1.00 0.00 H new ATOM 911 N VAL A 59 -15.502 -0.872 -6.738 1.00 0.00 N ATOM 912 CA VAL A 59 -16.663 -1.314 -7.502 1.00 0.00 C ATOM 913 C VAL A 59 -16.996 -0.359 -8.646 1.00 0.00 C ATOM 914 O VAL A 59 -17.693 -0.734 -9.589 1.00 0.00 O ATOM 915 CB VAL A 59 -17.898 -1.483 -6.596 1.00 0.00 C ATOM 916 CG1 VAL A 59 -18.297 -0.152 -5.977 1.00 0.00 C ATOM 917 CG2 VAL A 59 -19.055 -2.092 -7.371 1.00 0.00 C ATOM 0 H VAL A 59 -15.692 -0.683 -5.754 1.00 0.00 H new ATOM 0 HA VAL A 59 -16.399 -2.281 -7.930 1.00 0.00 H new ATOM 0 HB VAL A 59 -17.638 -2.166 -5.788 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -19.171 -0.294 -5.341 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -17.471 0.233 -5.378 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -18.535 0.560 -6.767 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -19.916 -2.202 -6.712 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -19.317 -1.441 -8.205 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -18.762 -3.070 -7.753 1.00 0.00 H new ATOM 927 N ASP A 60 -16.492 0.868 -8.571 1.00 0.00 N ATOM 928 CA ASP A 60 -16.739 1.843 -9.625 1.00 0.00 C ATOM 929 C ASP A 60 -16.103 1.363 -10.923 1.00 0.00 C ATOM 930 O ASP A 60 -16.672 1.509 -12.006 1.00 0.00 O ATOM 931 CB ASP A 60 -16.178 3.213 -9.234 1.00 0.00 C ATOM 932 CG ASP A 60 -16.931 4.358 -9.883 1.00 0.00 C ATOM 933 OD1 ASP A 60 -16.800 4.537 -11.114 1.00 0.00 O ATOM 934 OD2 ASP A 60 -17.652 5.078 -9.161 1.00 0.00 O ATOM 0 H ASP A 60 -15.916 1.208 -7.800 1.00 0.00 H new ATOM 0 HA ASP A 60 -17.815 1.944 -9.768 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -16.220 3.323 -8.150 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -15.127 3.266 -9.519 1.00 0.00 H new ATOM 939 N ASP A 61 -14.918 0.774 -10.794 1.00 0.00 N ATOM 940 CA ASP A 61 -14.182 0.248 -11.940 1.00 0.00 C ATOM 941 C ASP A 61 -14.363 -1.264 -12.046 1.00 0.00 C ATOM 942 O ASP A 61 -14.375 -1.827 -13.140 1.00 0.00 O ATOM 943 CB ASP A 61 -12.696 0.589 -11.818 1.00 0.00 C ATOM 944 CG ASP A 61 -12.441 2.082 -11.878 1.00 0.00 C ATOM 945 OD1 ASP A 61 -12.848 2.792 -10.933 1.00 0.00 O ATOM 946 OD2 ASP A 61 -11.835 2.542 -12.868 1.00 0.00 O ATOM 0 H ASP A 61 -14.443 0.648 -9.900 1.00 0.00 H new ATOM 0 HA ASP A 61 -14.578 0.711 -12.844 1.00 0.00 H new ATOM 0 HB2 ASP A 61 -12.311 0.195 -10.878 1.00 0.00 H new ATOM 0 HB3 ASP A 61 -12.146 0.096 -12.619 1.00 0.00 H new ATOM 951 N ALA A 62 -14.496 -1.913 -10.895 1.00 0.00 N ATOM 952 CA ALA A 62 -14.673 -3.356 -10.842 1.00 0.00 C ATOM 953 C ALA A 62 -16.150 -3.717 -10.728 1.00 0.00 C ATOM 954 O ALA A 62 -16.537 -4.592 -9.950 1.00 0.00 O ATOM 955 CB ALA A 62 -13.889 -3.934 -9.675 1.00 0.00 C ATOM 0 H ALA A 62 -14.484 -1.458 -9.982 1.00 0.00 H new ATOM 0 HA ALA A 62 -14.292 -3.787 -11.768 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -14.028 -5.015 -9.643 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -12.830 -3.707 -9.800 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -14.246 -3.495 -8.744 1.00 0.00 H new ATOM 961 N GLN A 63 -16.972 -3.026 -11.508 1.00 0.00 N ATOM 962 CA GLN A 63 -18.412 -3.253 -11.502 1.00 0.00 C ATOM 963 C GLN A 63 -18.771 -4.610 -12.103 1.00 0.00 C ATOM 964 O GLN A 63 -19.918 -5.044 -12.017 1.00 0.00 O ATOM 965 CB GLN A 63 -19.119 -2.141 -12.279 1.00 0.00 C ATOM 966 CG GLN A 63 -20.559 -1.913 -11.847 1.00 0.00 C ATOM 967 CD GLN A 63 -21.237 -0.808 -12.636 1.00 0.00 C ATOM 968 OE1 GLN A 63 -20.578 -0.028 -13.324 1.00 0.00 O ATOM 969 NE2 GLN A 63 -22.560 -0.734 -12.538 1.00 0.00 N ATOM 0 H GLN A 63 -16.664 -2.301 -12.156 1.00 0.00 H new ATOM 0 HA GLN A 63 -18.745 -3.246 -10.464 1.00 0.00 H new ATOM 0 HB2 GLN A 63 -18.561 -1.213 -12.156 1.00 0.00 H new ATOM 0 HB3 GLN A 63 -19.102 -2.385 -13.341 1.00 0.00 H new ATOM 0 HG2 GLN A 63 -21.122 -2.839 -11.968 1.00 0.00 H new ATOM 0 HG3 GLN A 63 -20.581 -1.663 -10.786 1.00 0.00 H new ATOM 0 HE21 GLN A 63 -23.066 -1.401 -11.956 1.00 0.00 H new ATOM 0 HE22 GLN A 63 -23.069 -0.010 -13.045 1.00 0.00 H new ATOM 978 N ASP A 64 -17.796 -5.278 -12.718 1.00 0.00 N ATOM 979 CA ASP A 64 -18.044 -6.577 -13.330 1.00 0.00 C ATOM 980 C ASP A 64 -17.690 -7.715 -12.378 1.00 0.00 C ATOM 981 O ASP A 64 -18.201 -8.825 -12.518 1.00 0.00 O ATOM 982 CB ASP A 64 -17.249 -6.716 -14.630 1.00 0.00 C ATOM 983 CG ASP A 64 -18.033 -6.246 -15.839 1.00 0.00 C ATOM 984 OD1 ASP A 64 -19.226 -6.600 -15.947 1.00 0.00 O ATOM 985 OD2 ASP A 64 -17.453 -5.527 -16.681 1.00 0.00 O ATOM 0 H ASP A 64 -16.836 -4.943 -12.804 1.00 0.00 H new ATOM 0 HA ASP A 64 -19.109 -6.640 -13.555 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -16.327 -6.140 -14.552 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -16.963 -7.759 -14.768 1.00 0.00 H new ATOM 990 N VAL A 65 -16.828 -7.443 -11.399 1.00 0.00 N ATOM 991 CA VAL A 65 -16.448 -8.472 -10.439 1.00 0.00 C ATOM 992 C VAL A 65 -17.540 -8.660 -9.391 1.00 0.00 C ATOM 993 O VAL A 65 -17.927 -9.789 -9.089 1.00 0.00 O ATOM 994 CB VAL A 65 -15.092 -8.181 -9.751 1.00 0.00 C ATOM 995 CG1 VAL A 65 -13.943 -8.581 -10.660 1.00 0.00 C ATOM 996 CG2 VAL A 65 -14.969 -6.721 -9.353 1.00 0.00 C ATOM 0 H VAL A 65 -16.388 -6.535 -11.253 1.00 0.00 H new ATOM 0 HA VAL A 65 -16.327 -9.395 -11.006 1.00 0.00 H new ATOM 0 HB VAL A 65 -15.047 -8.777 -8.839 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -12.996 -8.371 -10.163 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -14.008 -9.646 -10.881 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -13.999 -8.013 -11.589 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -14.005 -6.555 -8.873 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -15.045 -6.094 -10.241 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -15.769 -6.465 -8.658 1.00 0.00 H new ATOM 1006 N ALA A 66 -18.034 -7.555 -8.824 1.00 0.00 N ATOM 1007 CA ALA A 66 -19.072 -7.623 -7.797 1.00 0.00 C ATOM 1008 C ALA A 66 -20.248 -8.499 -8.229 1.00 0.00 C ATOM 1009 O ALA A 66 -20.574 -9.481 -7.561 1.00 0.00 O ATOM 1010 CB ALA A 66 -19.563 -6.218 -7.478 1.00 0.00 C ATOM 0 H ALA A 66 -17.733 -6.609 -9.059 1.00 0.00 H new ATOM 0 HA ALA A 66 -18.634 -8.077 -6.908 1.00 0.00 H new ATOM 0 HB1 ALA A 66 -20.337 -6.268 -6.712 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -18.731 -5.616 -7.114 1.00 0.00 H new ATOM 0 HB3 ALA A 66 -19.973 -5.763 -8.379 1.00 0.00 H new ATOM 1016 N PRO A 67 -20.905 -8.157 -9.351 1.00 0.00 N ATOM 1017 CA PRO A 67 -22.047 -8.925 -9.860 1.00 0.00 C ATOM 1018 C PRO A 67 -21.744 -10.416 -9.938 1.00 0.00 C ATOM 1019 O PRO A 67 -22.637 -11.253 -9.803 1.00 0.00 O ATOM 1020 CB PRO A 67 -22.257 -8.351 -11.261 1.00 0.00 C ATOM 1021 CG PRO A 67 -21.748 -6.954 -11.166 1.00 0.00 C ATOM 1022 CD PRO A 67 -20.596 -6.996 -10.205 1.00 0.00 C ATOM 0 HA PRO A 67 -22.921 -8.842 -9.214 1.00 0.00 H new ATOM 0 HB2 PRO A 67 -21.711 -8.923 -12.011 1.00 0.00 H new ATOM 0 HB3 PRO A 67 -23.309 -8.373 -11.546 1.00 0.00 H new ATOM 0 HG2 PRO A 67 -21.428 -6.588 -12.142 1.00 0.00 H new ATOM 0 HG3 PRO A 67 -22.527 -6.279 -10.812 1.00 0.00 H new ATOM 0 HD2 PRO A 67 -19.645 -7.120 -10.723 1.00 0.00 H new ATOM 0 HD3 PRO A 67 -20.524 -6.077 -9.623 1.00 0.00 H new ATOM 1030 N LYS A 68 -20.471 -10.737 -10.137 1.00 0.00 N ATOM 1031 CA LYS A 68 -20.033 -12.123 -10.217 1.00 0.00 C ATOM 1032 C LYS A 68 -19.956 -12.753 -8.827 1.00 0.00 C ATOM 1033 O LYS A 68 -20.033 -13.973 -8.691 1.00 0.00 O ATOM 1034 CB LYS A 68 -18.667 -12.211 -10.901 1.00 0.00 C ATOM 1035 CG LYS A 68 -18.747 -12.398 -12.409 1.00 0.00 C ATOM 1036 CD LYS A 68 -17.367 -12.368 -13.049 1.00 0.00 C ATOM 1037 CE LYS A 68 -17.280 -13.307 -14.243 1.00 0.00 C ATOM 1038 NZ LYS A 68 -18.038 -12.790 -15.416 1.00 0.00 N ATOM 0 H LYS A 68 -19.723 -10.053 -10.246 1.00 0.00 H new ATOM 0 HA LYS A 68 -20.766 -12.673 -10.807 1.00 0.00 H new ATOM 0 HB2 LYS A 68 -18.104 -11.303 -10.686 1.00 0.00 H new ATOM 0 HB3 LYS A 68 -18.108 -13.042 -10.470 1.00 0.00 H new ATOM 0 HG2 LYS A 68 -19.233 -13.348 -12.634 1.00 0.00 H new ATOM 0 HG3 LYS A 68 -19.367 -11.613 -12.842 1.00 0.00 H new ATOM 0 HD2 LYS A 68 -17.136 -11.352 -13.368 1.00 0.00 H new ATOM 0 HD3 LYS A 68 -16.617 -12.649 -12.310 1.00 0.00 H new ATOM 0 HE2 LYS A 68 -16.235 -13.446 -14.519 1.00 0.00 H new ATOM 0 HE3 LYS A 68 -17.669 -14.286 -13.963 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 -17.953 -13.460 -16.207 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 -19.040 -12.681 -15.161 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 -17.651 -11.867 -15.700 1.00 0.00 H new ATOM 1052 N TYR A 69 -19.794 -11.915 -7.797 1.00 0.00 N ATOM 1053 CA TYR A 69 -19.687 -12.386 -6.411 1.00 0.00 C ATOM 1054 C TYR A 69 -20.956 -12.092 -5.605 1.00 0.00 C ATOM 1055 O TYR A 69 -21.077 -12.492 -4.447 1.00 0.00 O ATOM 1056 CB TYR A 69 -18.499 -11.708 -5.736 1.00 0.00 C ATOM 1057 CG TYR A 69 -17.158 -12.213 -6.220 1.00 0.00 C ATOM 1058 CD1 TYR A 69 -16.739 -13.509 -5.945 1.00 0.00 C ATOM 1059 CD2 TYR A 69 -16.316 -11.396 -6.965 1.00 0.00 C ATOM 1060 CE1 TYR A 69 -15.521 -13.976 -6.402 1.00 0.00 C ATOM 1061 CE2 TYR A 69 -15.095 -11.854 -7.422 1.00 0.00 C ATOM 1062 CZ TYR A 69 -14.702 -13.144 -7.138 1.00 0.00 C ATOM 1063 OH TYR A 69 -13.490 -13.604 -7.597 1.00 0.00 O ATOM 0 H TYR A 69 -19.734 -10.902 -7.898 1.00 0.00 H new ATOM 0 HA TYR A 69 -19.549 -13.467 -6.439 1.00 0.00 H new ATOM 0 HB2 TYR A 69 -18.558 -10.634 -5.910 1.00 0.00 H new ATOM 0 HB3 TYR A 69 -18.568 -11.861 -4.659 1.00 0.00 H new ATOM 0 HD1 TYR A 69 -17.375 -14.162 -5.365 1.00 0.00 H new ATOM 0 HD2 TYR A 69 -16.621 -10.385 -7.191 1.00 0.00 H new ATOM 0 HE1 TYR A 69 -15.212 -14.988 -6.184 1.00 0.00 H new ATOM 0 HE2 TYR A 69 -14.452 -11.205 -7.998 1.00 0.00 H new ATOM 0 HH TYR A 69 -12.855 -13.652 -6.852 1.00 0.00 H new ATOM 1073 N GLY A 70 -21.901 -11.411 -6.232 1.00 0.00 N ATOM 1074 CA GLY A 70 -23.155 -11.091 -5.575 1.00 0.00 C ATOM 1075 C GLY A 70 -23.009 -10.136 -4.402 1.00 0.00 C ATOM 1076 O GLY A 70 -23.745 -10.247 -3.419 1.00 0.00 O ATOM 0 H GLY A 70 -21.823 -11.071 -7.191 1.00 0.00 H new ATOM 0 HA2 GLY A 70 -23.835 -10.653 -6.305 1.00 0.00 H new ATOM 0 HA3 GLY A 70 -23.616 -12.014 -5.224 1.00 0.00 H new ATOM 1080 N ILE A 71 -22.078 -9.191 -4.497 1.00 0.00 N ATOM 1081 CA ILE A 71 -21.873 -8.216 -3.426 1.00 0.00 C ATOM 1082 C ILE A 71 -22.958 -7.139 -3.462 1.00 0.00 C ATOM 1083 O ILE A 71 -23.309 -6.639 -4.532 1.00 0.00 O ATOM 1084 CB ILE A 71 -20.490 -7.537 -3.528 1.00 0.00 C ATOM 1085 CG1 ILE A 71 -19.372 -8.580 -3.468 1.00 0.00 C ATOM 1086 CG2 ILE A 71 -20.312 -6.513 -2.414 1.00 0.00 C ATOM 1087 CD1 ILE A 71 -17.998 -8.001 -3.721 1.00 0.00 C ATOM 0 H ILE A 71 -21.457 -9.078 -5.298 1.00 0.00 H new ATOM 0 HA ILE A 71 -21.926 -8.763 -2.485 1.00 0.00 H new ATOM 0 HB ILE A 71 -20.435 -7.022 -4.487 1.00 0.00 H new ATOM 0 HG12 ILE A 71 -19.382 -9.057 -2.488 1.00 0.00 H new ATOM 0 HG13 ILE A 71 -19.571 -9.359 -4.204 1.00 0.00 H new ATOM 0 HG21 ILE A 71 -19.331 -6.045 -2.503 1.00 0.00 H new ATOM 0 HG22 ILE A 71 -21.086 -5.750 -2.494 1.00 0.00 H new ATOM 0 HG23 ILE A 71 -20.391 -7.010 -1.447 1.00 0.00 H new ATOM 0 HD11 ILE A 71 -17.253 -8.794 -3.664 1.00 0.00 H new ATOM 0 HD12 ILE A 71 -17.971 -7.548 -4.712 1.00 0.00 H new ATOM 0 HD13 ILE A 71 -17.779 -7.242 -2.970 1.00 0.00 H new ATOM 1099 N ARG A 72 -23.496 -6.792 -2.294 1.00 0.00 N ATOM 1100 CA ARG A 72 -24.547 -5.780 -2.215 1.00 0.00 C ATOM 1101 C ARG A 72 -24.404 -4.923 -0.961 1.00 0.00 C ATOM 1102 O ARG A 72 -25.200 -5.023 -0.028 1.00 0.00 O ATOM 1103 CB ARG A 72 -25.928 -6.440 -2.239 1.00 0.00 C ATOM 1104 CG ARG A 72 -27.056 -5.470 -2.556 1.00 0.00 C ATOM 1105 CD ARG A 72 -28.234 -6.174 -3.206 1.00 0.00 C ATOM 1106 NE ARG A 72 -29.219 -6.616 -2.222 1.00 0.00 N ATOM 1107 CZ ARG A 72 -30.029 -5.793 -1.561 1.00 0.00 C ATOM 1108 NH1 ARG A 72 -29.974 -4.484 -1.773 1.00 0.00 N ATOM 1109 NH2 ARG A 72 -30.898 -6.280 -0.685 1.00 0.00 N ATOM 0 H ARG A 72 -23.224 -7.193 -1.396 1.00 0.00 H new ATOM 0 HA ARG A 72 -24.444 -5.131 -3.084 1.00 0.00 H new ATOM 0 HB2 ARG A 72 -25.927 -7.240 -2.980 1.00 0.00 H new ATOM 0 HB3 ARG A 72 -26.118 -6.903 -1.271 1.00 0.00 H new ATOM 0 HG2 ARG A 72 -27.385 -4.981 -1.639 1.00 0.00 H new ATOM 0 HG3 ARG A 72 -26.688 -4.688 -3.220 1.00 0.00 H new ATOM 0 HD2 ARG A 72 -28.710 -5.501 -3.918 1.00 0.00 H new ATOM 0 HD3 ARG A 72 -27.875 -7.034 -3.771 1.00 0.00 H new ATOM 0 HE ARG A 72 -29.290 -7.615 -2.030 1.00 0.00 H new ATOM 0 HH11 ARG A 72 -29.308 -4.104 -2.446 1.00 0.00 H new ATOM 0 HH12 ARG A 72 -30.598 -3.858 -1.263 1.00 0.00 H new ATOM 0 HH21 ARG A 72 -30.945 -7.285 -0.518 1.00 0.00 H new ATOM 0 HH22 ARG A 72 -31.519 -5.649 -0.178 1.00 0.00 H new ATOM 1123 N GLY A 73 -23.382 -4.073 -0.956 1.00 0.00 N ATOM 1124 CA GLY A 73 -23.145 -3.200 0.180 1.00 0.00 C ATOM 1125 C GLY A 73 -21.691 -2.790 0.306 1.00 0.00 C ATOM 1126 O GLY A 73 -20.814 -3.408 -0.295 1.00 0.00 O ATOM 0 H GLY A 73 -22.713 -3.973 -1.719 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -23.763 -2.308 0.083 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -23.457 -3.706 1.094 1.00 0.00 H new ATOM 1130 N ILE A 74 -21.437 -1.745 1.086 1.00 0.00 N ATOM 1131 CA ILE A 74 -20.081 -1.249 1.287 1.00 0.00 C ATOM 1132 C ILE A 74 -19.919 -0.650 2.684 1.00 0.00 C ATOM 1133 O ILE A 74 -20.878 -0.128 3.250 1.00 0.00 O ATOM 1134 CB ILE A 74 -19.719 -0.184 0.234 1.00 0.00 C ATOM 1135 CG1 ILE A 74 -20.697 0.990 0.305 1.00 0.00 C ATOM 1136 CG2 ILE A 74 -19.725 -0.796 -1.160 1.00 0.00 C ATOM 1137 CD1 ILE A 74 -20.302 2.159 -0.569 1.00 0.00 C ATOM 0 H ILE A 74 -22.154 -1.224 1.590 1.00 0.00 H new ATOM 0 HA ILE A 74 -19.407 -2.099 1.181 1.00 0.00 H new ATOM 0 HB ILE A 74 -18.717 0.188 0.446 1.00 0.00 H new ATOM 0 HG12 ILE A 74 -21.688 0.645 0.010 1.00 0.00 H new ATOM 0 HG13 ILE A 74 -20.771 1.328 1.338 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -19.468 -0.032 -1.894 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -18.995 -1.604 -1.206 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -20.717 -1.191 -1.380 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -21.041 2.954 -0.468 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -19.325 2.530 -0.260 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -20.256 1.836 -1.609 1.00 0.00 H new ATOM 1149 N PRO A 75 -18.706 -0.714 3.269 1.00 0.00 N ATOM 1150 CA PRO A 75 -17.529 -1.323 2.646 1.00 0.00 C ATOM 1151 C PRO A 75 -17.449 -2.830 2.887 1.00 0.00 C ATOM 1152 O PRO A 75 -17.384 -3.280 4.032 1.00 0.00 O ATOM 1153 CB PRO A 75 -16.373 -0.617 3.353 1.00 0.00 C ATOM 1154 CG PRO A 75 -16.893 -0.295 4.715 1.00 0.00 C ATOM 1155 CD PRO A 75 -18.395 -0.173 4.605 1.00 0.00 C ATOM 0 HA PRO A 75 -17.534 -1.211 1.562 1.00 0.00 H new ATOM 0 HB2 PRO A 75 -15.493 -1.258 3.408 1.00 0.00 H new ATOM 0 HB3 PRO A 75 -16.077 0.286 2.820 1.00 0.00 H new ATOM 0 HG2 PRO A 75 -16.622 -1.077 5.425 1.00 0.00 H new ATOM 0 HG3 PRO A 75 -16.458 0.634 5.083 1.00 0.00 H new ATOM 0 HD2 PRO A 75 -18.899 -0.737 5.390 1.00 0.00 H new ATOM 0 HD3 PRO A 75 -18.718 0.864 4.700 1.00 0.00 H new ATOM 1163 N THR A 76 -17.451 -3.608 1.807 1.00 0.00 N ATOM 1164 CA THR A 76 -17.368 -5.061 1.911 1.00 0.00 C ATOM 1165 C THR A 76 -15.923 -5.543 1.969 1.00 0.00 C ATOM 1166 O THR A 76 -15.072 -5.084 1.208 1.00 0.00 O ATOM 1167 CB THR A 76 -18.073 -5.726 0.727 1.00 0.00 C ATOM 1168 OG1 THR A 76 -18.833 -4.782 -0.003 1.00 0.00 O ATOM 1169 CG2 THR A 76 -19.002 -6.849 1.133 1.00 0.00 C ATOM 0 H THR A 76 -17.509 -3.256 0.851 1.00 0.00 H new ATOM 0 HA THR A 76 -17.863 -5.343 2.840 1.00 0.00 H new ATOM 0 HB THR A 76 -17.272 -6.143 0.117 1.00 0.00 H new ATOM 0 HG1 THR A 76 -19.693 -4.639 0.444 1.00 0.00 H new ATOM 0 HG21 THR A 76 -19.468 -7.275 0.244 1.00 0.00 H new ATOM 0 HG22 THR A 76 -18.434 -7.622 1.651 1.00 0.00 H new ATOM 0 HG23 THR A 76 -19.774 -6.460 1.797 1.00 0.00 H new ATOM 1177 N LEU A 77 -15.663 -6.502 2.844 1.00 0.00 N ATOM 1178 CA LEU A 77 -14.339 -7.085 2.962 1.00 0.00 C ATOM 1179 C LEU A 77 -14.395 -8.504 2.410 1.00 0.00 C ATOM 1180 O LEU A 77 -15.192 -9.324 2.863 1.00 0.00 O ATOM 1181 CB LEU A 77 -13.863 -7.071 4.422 1.00 0.00 C ATOM 1182 CG LEU A 77 -12.593 -6.255 4.690 1.00 0.00 C ATOM 1183 CD1 LEU A 77 -12.912 -4.770 4.772 1.00 0.00 C ATOM 1184 CD2 LEU A 77 -11.926 -6.726 5.975 1.00 0.00 C ATOM 0 H LEU A 77 -16.355 -6.893 3.484 1.00 0.00 H new ATOM 0 HA LEU A 77 -13.619 -6.499 2.391 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -14.666 -6.677 5.045 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -13.688 -8.099 4.740 1.00 0.00 H new ATOM 0 HG LEU A 77 -11.904 -6.410 3.860 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -11.996 -4.211 4.963 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -13.349 -4.439 3.830 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -13.620 -4.594 5.582 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -11.025 -6.139 6.154 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -12.614 -6.598 6.810 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -11.660 -7.779 5.882 1.00 0.00 H new ATOM 1196 N LEU A 78 -13.573 -8.780 1.404 1.00 0.00 N ATOM 1197 CA LEU A 78 -13.572 -10.094 0.769 1.00 0.00 C ATOM 1198 C LEU A 78 -12.255 -10.829 0.999 1.00 0.00 C ATOM 1199 O LEU A 78 -11.173 -10.262 0.849 1.00 0.00 O ATOM 1200 CB LEU A 78 -13.821 -9.948 -0.743 1.00 0.00 C ATOM 1201 CG LEU A 78 -15.293 -9.886 -1.193 1.00 0.00 C ATOM 1202 CD1 LEU A 78 -15.402 -10.188 -2.679 1.00 0.00 C ATOM 1203 CD2 LEU A 78 -16.161 -10.851 -0.399 1.00 0.00 C ATOM 0 H LEU A 78 -12.903 -8.118 1.012 1.00 0.00 H new ATOM 0 HA LEU A 78 -14.372 -10.680 1.221 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -13.321 -9.042 -1.085 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -13.344 -10.787 -1.250 1.00 0.00 H new ATOM 0 HG LEU A 78 -15.656 -8.876 -1.004 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -16.447 -10.141 -2.984 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -14.826 -9.454 -3.243 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -15.011 -11.186 -2.877 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -17.193 -10.780 -0.743 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -15.799 -11.869 -0.544 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -16.114 -10.596 0.660 1.00 0.00 H new ATOM 1215 N LEU A 79 -12.362 -12.105 1.355 1.00 0.00 N ATOM 1216 CA LEU A 79 -11.194 -12.939 1.596 1.00 0.00 C ATOM 1217 C LEU A 79 -11.124 -14.043 0.549 1.00 0.00 C ATOM 1218 O LEU A 79 -12.096 -14.767 0.341 1.00 0.00 O ATOM 1219 CB LEU A 79 -11.263 -13.561 2.993 1.00 0.00 C ATOM 1220 CG LEU A 79 -10.518 -12.804 4.095 1.00 0.00 C ATOM 1221 CD1 LEU A 79 -9.014 -12.935 3.912 1.00 0.00 C ATOM 1222 CD2 LEU A 79 -10.937 -11.342 4.116 1.00 0.00 C ATOM 0 H LEU A 79 -13.253 -12.585 1.483 1.00 0.00 H new ATOM 0 HA LEU A 79 -10.301 -12.317 1.530 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -12.311 -13.646 3.281 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -10.864 -14.574 2.940 1.00 0.00 H new ATOM 0 HG LEU A 79 -10.782 -13.246 5.056 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -8.502 -12.390 4.705 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -8.733 -13.987 3.955 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -8.728 -12.522 2.945 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -10.397 -10.820 4.906 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -10.706 -10.884 3.154 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -12.009 -11.273 4.303 1.00 0.00 H new ATOM 1234 N PHE A 80 -9.980 -14.165 -0.112 1.00 0.00 N ATOM 1235 CA PHE A 80 -9.806 -15.176 -1.148 1.00 0.00 C ATOM 1236 C PHE A 80 -8.693 -16.160 -0.784 1.00 0.00 C ATOM 1237 O PHE A 80 -7.709 -15.794 -0.142 1.00 0.00 O ATOM 1238 CB PHE A 80 -9.496 -14.489 -2.481 1.00 0.00 C ATOM 1239 CG PHE A 80 -10.714 -13.940 -3.166 1.00 0.00 C ATOM 1240 CD1 PHE A 80 -11.180 -12.672 -2.852 1.00 0.00 C ATOM 1241 CD2 PHE A 80 -11.395 -14.684 -4.119 1.00 0.00 C ATOM 1242 CE1 PHE A 80 -12.301 -12.158 -3.473 1.00 0.00 C ATOM 1243 CE2 PHE A 80 -12.517 -14.171 -4.744 1.00 0.00 C ATOM 1244 CZ PHE A 80 -12.969 -12.907 -4.420 1.00 0.00 C ATOM 0 H PHE A 80 -9.161 -13.579 0.050 1.00 0.00 H new ATOM 0 HA PHE A 80 -10.731 -15.745 -1.237 1.00 0.00 H new ATOM 0 HB2 PHE A 80 -8.789 -13.678 -2.307 1.00 0.00 H new ATOM 0 HB3 PHE A 80 -9.006 -15.202 -3.144 1.00 0.00 H new ATOM 0 HD1 PHE A 80 -10.660 -12.080 -2.113 1.00 0.00 H new ATOM 0 HD2 PHE A 80 -11.045 -15.673 -4.375 1.00 0.00 H new ATOM 0 HE1 PHE A 80 -12.655 -11.170 -3.218 1.00 0.00 H new ATOM 0 HE2 PHE A 80 -13.039 -14.758 -5.485 1.00 0.00 H new ATOM 0 HZ PHE A 80 -13.845 -12.505 -4.908 1.00 0.00 H new ATOM 1254 N LYS A 81 -8.867 -17.411 -1.200 1.00 0.00 N ATOM 1255 CA LYS A 81 -7.893 -18.465 -0.930 1.00 0.00 C ATOM 1256 C LYS A 81 -7.861 -19.453 -2.087 1.00 0.00 C ATOM 1257 O LYS A 81 -8.850 -20.134 -2.356 1.00 0.00 O ATOM 1258 CB LYS A 81 -8.250 -19.200 0.365 1.00 0.00 C ATOM 1259 CG LYS A 81 -7.052 -19.528 1.241 1.00 0.00 C ATOM 1260 CD LYS A 81 -7.312 -19.147 2.691 1.00 0.00 C ATOM 1261 CE LYS A 81 -6.149 -19.526 3.594 1.00 0.00 C ATOM 1262 NZ LYS A 81 -5.655 -20.903 3.323 1.00 0.00 N ATOM 0 H LYS A 81 -9.681 -17.722 -1.730 1.00 0.00 H new ATOM 0 HA LYS A 81 -6.909 -18.009 -0.819 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -8.948 -18.589 0.937 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -8.768 -20.126 0.114 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -6.831 -20.593 1.176 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -6.173 -18.997 0.874 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -7.489 -18.074 2.758 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -8.218 -19.642 3.039 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -5.335 -18.815 3.453 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -6.460 -19.452 4.636 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -5.022 -21.202 4.092 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -6.462 -21.556 3.265 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -5.135 -20.914 2.422 1.00 0.00 H new ATOM 1276 N ASN A 82 -6.731 -19.528 -2.779 1.00 0.00 N ATOM 1277 CA ASN A 82 -6.606 -20.438 -3.909 1.00 0.00 C ATOM 1278 C ASN A 82 -7.647 -20.102 -4.977 1.00 0.00 C ATOM 1279 O ASN A 82 -8.289 -20.993 -5.537 1.00 0.00 O ATOM 1280 CB ASN A 82 -6.781 -21.883 -3.442 1.00 0.00 C ATOM 1281 CG ASN A 82 -6.000 -22.190 -2.176 1.00 0.00 C ATOM 1282 OD1 ASN A 82 -6.561 -22.653 -1.183 1.00 0.00 O ATOM 1283 ND2 ASN A 82 -4.699 -21.929 -2.207 1.00 0.00 N ATOM 0 H ASN A 82 -5.897 -18.976 -2.580 1.00 0.00 H new ATOM 0 HA ASN A 82 -5.612 -20.324 -4.341 1.00 0.00 H new ATOM 0 HB2 ASN A 82 -7.839 -22.078 -3.267 1.00 0.00 H new ATOM 0 HB3 ASN A 82 -6.459 -22.558 -4.235 1.00 0.00 H new ATOM 0 HD21 ASN A 82 -4.122 -22.112 -1.386 1.00 0.00 H new ATOM 0 HD22 ASN A 82 -4.276 -21.545 -3.052 1.00 0.00 H new ATOM 1290 N GLY A 83 -7.784 -18.811 -5.273 1.00 0.00 N ATOM 1291 CA GLY A 83 -8.724 -18.369 -6.287 1.00 0.00 C ATOM 1292 C GLY A 83 -10.185 -18.494 -5.871 1.00 0.00 C ATOM 1293 O GLY A 83 -11.080 -18.228 -6.673 1.00 0.00 O ATOM 0 H GLY A 83 -7.257 -18.061 -4.825 1.00 0.00 H new ATOM 0 HA2 GLY A 83 -8.514 -17.328 -6.534 1.00 0.00 H new ATOM 0 HA3 GLY A 83 -8.564 -18.950 -7.195 1.00 0.00 H new ATOM 1297 N GLU A 84 -10.438 -18.907 -4.632 1.00 0.00 N ATOM 1298 CA GLU A 84 -11.808 -19.069 -4.155 1.00 0.00 C ATOM 1299 C GLU A 84 -12.058 -18.256 -2.887 1.00 0.00 C ATOM 1300 O GLU A 84 -11.205 -18.182 -2.005 1.00 0.00 O ATOM 1301 CB GLU A 84 -12.099 -20.547 -3.884 1.00 0.00 C ATOM 1302 CG GLU A 84 -13.531 -20.954 -4.200 1.00 0.00 C ATOM 1303 CD GLU A 84 -14.289 -21.427 -2.974 1.00 0.00 C ATOM 1304 OE1 GLU A 84 -14.096 -22.594 -2.570 1.00 0.00 O ATOM 1305 OE2 GLU A 84 -15.077 -20.633 -2.417 1.00 0.00 O ATOM 0 H GLU A 84 -9.719 -19.134 -3.945 1.00 0.00 H new ATOM 0 HA GLU A 84 -12.476 -18.701 -4.933 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -11.418 -21.157 -4.477 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -11.891 -20.763 -2.836 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -14.056 -20.107 -4.642 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -13.522 -21.749 -4.946 1.00 0.00 H new ATOM 1312 N VAL A 85 -13.248 -17.670 -2.793 1.00 0.00 N ATOM 1313 CA VAL A 85 -13.618 -16.878 -1.621 1.00 0.00 C ATOM 1314 C VAL A 85 -13.767 -17.779 -0.392 1.00 0.00 C ATOM 1315 O VAL A 85 -14.611 -18.677 -0.374 1.00 0.00 O ATOM 1316 CB VAL A 85 -14.936 -16.110 -1.844 1.00 0.00 C ATOM 1317 CG1 VAL A 85 -15.240 -15.216 -0.653 1.00 0.00 C ATOM 1318 CG2 VAL A 85 -14.862 -15.294 -3.125 1.00 0.00 C ATOM 0 H VAL A 85 -13.971 -17.727 -3.510 1.00 0.00 H new ATOM 0 HA VAL A 85 -12.819 -16.155 -1.457 1.00 0.00 H new ATOM 0 HB VAL A 85 -15.747 -16.832 -1.943 1.00 0.00 H new ATOM 0 HG11 VAL A 85 -16.174 -14.682 -0.828 1.00 0.00 H new ATOM 0 HG12 VAL A 85 -15.334 -15.826 0.245 1.00 0.00 H new ATOM 0 HG13 VAL A 85 -14.431 -14.498 -0.521 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -15.800 -14.757 -3.269 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -14.042 -14.579 -3.054 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -14.691 -15.960 -3.971 1.00 0.00 H new ATOM 1328 N ALA A 86 -12.948 -17.548 0.631 1.00 0.00 N ATOM 1329 CA ALA A 86 -13.012 -18.360 1.844 1.00 0.00 C ATOM 1330 C ALA A 86 -13.507 -17.558 3.045 1.00 0.00 C ATOM 1331 O ALA A 86 -13.452 -18.024 4.184 1.00 0.00 O ATOM 1332 CB ALA A 86 -11.654 -18.981 2.134 1.00 0.00 C ATOM 0 H ALA A 86 -12.240 -16.814 0.646 1.00 0.00 H new ATOM 0 HA ALA A 86 -13.736 -19.156 1.670 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -11.715 -19.583 3.040 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -11.357 -19.613 1.297 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -10.915 -18.192 2.272 1.00 0.00 H new ATOM 1338 N ALA A 87 -13.997 -16.359 2.779 1.00 0.00 N ATOM 1339 CA ALA A 87 -14.516 -15.486 3.826 1.00 0.00 C ATOM 1340 C ALA A 87 -15.112 -14.215 3.230 1.00 0.00 C ATOM 1341 O ALA A 87 -14.536 -13.618 2.320 1.00 0.00 O ATOM 1342 CB ALA A 87 -13.422 -15.154 4.831 1.00 0.00 C ATOM 0 H ALA A 87 -14.048 -15.963 1.840 1.00 0.00 H new ATOM 0 HA ALA A 87 -15.313 -16.014 4.349 1.00 0.00 H new ATOM 0 HB1 ALA A 87 -13.825 -14.502 5.606 1.00 0.00 H new ATOM 0 HB2 ALA A 87 -13.055 -16.074 5.286 1.00 0.00 H new ATOM 0 HB3 ALA A 87 -12.602 -14.648 4.322 1.00 0.00 H new ATOM 1348 N THR A 88 -16.257 -13.793 3.753 1.00 0.00 N ATOM 1349 CA THR A 88 -16.910 -12.583 3.266 1.00 0.00 C ATOM 1350 C THR A 88 -17.447 -11.750 4.424 1.00 0.00 C ATOM 1351 O THR A 88 -18.232 -12.235 5.241 1.00 0.00 O ATOM 1352 CB THR A 88 -18.045 -12.941 2.309 1.00 0.00 C ATOM 1353 OG1 THR A 88 -17.645 -13.969 1.419 1.00 0.00 O ATOM 1354 CG2 THR A 88 -18.515 -11.770 1.474 1.00 0.00 C ATOM 0 H THR A 88 -16.750 -14.267 4.510 1.00 0.00 H new ATOM 0 HA THR A 88 -16.168 -11.990 2.731 1.00 0.00 H new ATOM 0 HB THR A 88 -18.868 -13.267 2.946 1.00 0.00 H new ATOM 0 HG1 THR A 88 -18.386 -14.185 0.815 1.00 0.00 H new ATOM 0 HG21 THR A 88 -19.322 -12.093 0.816 1.00 0.00 H new ATOM 0 HG22 THR A 88 -18.876 -10.977 2.129 1.00 0.00 H new ATOM 0 HG23 THR A 88 -17.686 -11.395 0.874 1.00 0.00 H new ATOM 1362 N LYS A 89 -17.024 -10.490 4.490 1.00 0.00 N ATOM 1363 CA LYS A 89 -17.465 -9.588 5.547 1.00 0.00 C ATOM 1364 C LYS A 89 -18.090 -8.323 4.959 1.00 0.00 C ATOM 1365 O LYS A 89 -17.625 -7.803 3.946 1.00 0.00 O ATOM 1366 CB LYS A 89 -16.284 -9.222 6.451 1.00 0.00 C ATOM 1367 CG LYS A 89 -16.587 -9.368 7.933 1.00 0.00 C ATOM 1368 CD LYS A 89 -17.421 -8.206 8.445 1.00 0.00 C ATOM 1369 CE LYS A 89 -17.164 -7.942 9.919 1.00 0.00 C ATOM 1370 NZ LYS A 89 -17.784 -6.664 10.365 1.00 0.00 N ATOM 0 H LYS A 89 -16.376 -10.072 3.823 1.00 0.00 H new ATOM 0 HA LYS A 89 -18.224 -10.099 6.140 1.00 0.00 H new ATOM 0 HB2 LYS A 89 -15.433 -9.855 6.198 1.00 0.00 H new ATOM 0 HB3 LYS A 89 -15.987 -8.193 6.249 1.00 0.00 H new ATOM 0 HG2 LYS A 89 -17.118 -10.304 8.107 1.00 0.00 H new ATOM 0 HG3 LYS A 89 -15.654 -9.423 8.493 1.00 0.00 H new ATOM 0 HD2 LYS A 89 -17.191 -7.310 7.868 1.00 0.00 H new ATOM 0 HD3 LYS A 89 -18.479 -8.421 8.292 1.00 0.00 H new ATOM 0 HE2 LYS A 89 -17.562 -8.766 10.511 1.00 0.00 H new ATOM 0 HE3 LYS A 89 -16.090 -7.909 10.101 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 -17.588 -6.517 11.376 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 -17.386 -5.875 9.817 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 -18.812 -6.706 10.214 1.00 0.00 H new ATOM 1384 N VAL A 90 -19.145 -7.837 5.603 1.00 0.00 N ATOM 1385 CA VAL A 90 -19.839 -6.636 5.150 1.00 0.00 C ATOM 1386 C VAL A 90 -19.749 -5.522 6.187 1.00 0.00 C ATOM 1387 O VAL A 90 -19.758 -5.785 7.391 1.00 0.00 O ATOM 1388 CB VAL A 90 -21.324 -6.917 4.856 1.00 0.00 C ATOM 1389 CG1 VAL A 90 -21.975 -5.708 4.201 1.00 0.00 C ATOM 1390 CG2 VAL A 90 -21.475 -8.153 3.985 1.00 0.00 C ATOM 0 H VAL A 90 -19.540 -8.258 6.444 1.00 0.00 H new ATOM 0 HA VAL A 90 -19.345 -6.320 4.231 1.00 0.00 H new ATOM 0 HB VAL A 90 -21.832 -7.107 5.801 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -23.024 -5.924 4.000 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -21.903 -4.849 4.869 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -21.465 -5.483 3.264 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -22.532 -8.333 3.789 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -20.952 -7.999 3.041 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -21.049 -9.015 4.499 1.00 0.00 H new ATOM 1400 N GLY A 91 -19.677 -4.277 5.723 1.00 0.00 N ATOM 1401 CA GLY A 91 -19.598 -3.156 6.633 1.00 0.00 C ATOM 1402 C GLY A 91 -18.205 -2.930 7.178 1.00 0.00 C ATOM 1403 O GLY A 91 -17.348 -3.811 7.116 1.00 0.00 O ATOM 0 H GLY A 91 -19.672 -4.029 4.734 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -19.931 -2.254 6.119 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -20.284 -3.321 7.464 1.00 0.00 H new ATOM 1407 N ALA A 92 -17.984 -1.730 7.700 1.00 0.00 N ATOM 1408 CA ALA A 92 -16.689 -1.355 8.250 1.00 0.00 C ATOM 1409 C ALA A 92 -16.339 -2.202 9.467 1.00 0.00 C ATOM 1410 O ALA A 92 -17.170 -2.957 9.972 1.00 0.00 O ATOM 1411 CB ALA A 92 -16.690 0.123 8.611 1.00 0.00 C ATOM 0 H ALA A 92 -18.690 -0.996 7.754 1.00 0.00 H new ATOM 0 HA ALA A 92 -15.928 -1.537 7.491 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -15.719 0.398 9.022 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -16.887 0.716 7.718 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -17.465 0.316 9.352 1.00 0.00 H new ATOM 1417 N LEU A 93 -15.101 -2.073 9.925 1.00 0.00 N ATOM 1418 CA LEU A 93 -14.628 -2.831 11.075 1.00 0.00 C ATOM 1419 C LEU A 93 -13.348 -2.221 11.631 1.00 0.00 C ATOM 1420 O LEU A 93 -12.535 -1.678 10.883 1.00 0.00 O ATOM 1421 CB LEU A 93 -14.382 -4.291 10.685 1.00 0.00 C ATOM 1422 CG LEU A 93 -13.811 -4.505 9.281 1.00 0.00 C ATOM 1423 CD1 LEU A 93 -12.874 -5.704 9.260 1.00 0.00 C ATOM 1424 CD2 LEU A 93 -14.936 -4.693 8.276 1.00 0.00 C ATOM 0 H LEU A 93 -14.405 -1.449 9.517 1.00 0.00 H new ATOM 0 HA LEU A 93 -15.397 -2.794 11.847 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -13.698 -4.733 11.409 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -15.324 -4.835 10.763 1.00 0.00 H new ATOM 0 HG LEU A 93 -13.240 -3.619 9.003 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -12.479 -5.839 8.253 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -12.050 -5.534 9.953 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -13.421 -6.598 9.558 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -14.515 -4.844 7.282 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -15.531 -5.563 8.554 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -15.571 -3.807 8.270 1.00 0.00 H new ATOM 1436 N SER A 94 -13.172 -2.314 12.943 1.00 0.00 N ATOM 1437 CA SER A 94 -11.985 -1.769 13.588 1.00 0.00 C ATOM 1438 C SER A 94 -10.732 -2.505 13.127 1.00 0.00 C ATOM 1439 O SER A 94 -10.805 -3.439 12.330 1.00 0.00 O ATOM 1440 CB SER A 94 -12.116 -1.862 15.109 1.00 0.00 C ATOM 1441 OG SER A 94 -11.295 -0.901 15.752 1.00 0.00 O ATOM 0 H SER A 94 -13.833 -2.760 13.579 1.00 0.00 H new ATOM 0 HA SER A 94 -11.895 -0.721 13.303 1.00 0.00 H new ATOM 0 HB2 SER A 94 -13.156 -1.708 15.398 1.00 0.00 H new ATOM 0 HB3 SER A 94 -11.838 -2.862 15.441 1.00 0.00 H new ATOM 0 HG SER A 94 -11.398 -0.980 16.723 1.00 0.00 H new ATOM 1447 N LYS A 95 -9.582 -2.078 13.638 1.00 0.00 N ATOM 1448 CA LYS A 95 -8.309 -2.692 13.281 1.00 0.00 C ATOM 1449 C LYS A 95 -8.160 -4.064 13.929 1.00 0.00 C ATOM 1450 O LYS A 95 -7.494 -4.945 13.383 1.00 0.00 O ATOM 1451 CB LYS A 95 -7.146 -1.788 13.699 1.00 0.00 C ATOM 1452 CG LYS A 95 -5.777 -2.346 13.337 1.00 0.00 C ATOM 1453 CD LYS A 95 -4.872 -1.271 12.755 1.00 0.00 C ATOM 1454 CE LYS A 95 -3.475 -1.806 12.479 1.00 0.00 C ATOM 1455 NZ LYS A 95 -2.614 -1.761 13.694 1.00 0.00 N ATOM 0 H LYS A 95 -9.506 -1.307 14.302 1.00 0.00 H new ATOM 0 HA LYS A 95 -8.291 -2.820 12.199 1.00 0.00 H new ATOM 0 HB2 LYS A 95 -7.268 -0.813 13.227 1.00 0.00 H new ATOM 0 HB3 LYS A 95 -7.190 -1.629 14.776 1.00 0.00 H new ATOM 0 HG2 LYS A 95 -5.311 -2.774 14.225 1.00 0.00 H new ATOM 0 HG3 LYS A 95 -5.892 -3.155 12.616 1.00 0.00 H new ATOM 0 HD2 LYS A 95 -5.306 -0.890 11.830 1.00 0.00 H new ATOM 0 HD3 LYS A 95 -4.811 -0.432 13.448 1.00 0.00 H new ATOM 0 HE2 LYS A 95 -3.544 -2.833 12.120 1.00 0.00 H new ATOM 0 HE3 LYS A 95 -3.012 -1.221 11.684 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 -1.671 -2.134 13.465 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 -2.527 -0.778 14.022 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 -3.042 -2.340 14.444 1.00 0.00 H new ATOM 1469 N GLY A 96 -8.759 -4.233 15.103 1.00 0.00 N ATOM 1470 CA GLY A 96 -8.661 -5.497 15.796 1.00 0.00 C ATOM 1471 C GLY A 96 -9.570 -6.560 15.213 1.00 0.00 C ATOM 1472 O GLY A 96 -9.239 -7.745 15.237 1.00 0.00 O ATOM 0 H GLY A 96 -9.307 -3.519 15.582 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -7.630 -5.847 15.758 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -8.910 -5.350 16.847 1.00 0.00 H new ATOM 1476 N GLN A 97 -10.710 -6.144 14.675 1.00 0.00 N ATOM 1477 CA GLN A 97 -11.651 -7.086 14.078 1.00 0.00 C ATOM 1478 C GLN A 97 -11.157 -7.543 12.712 1.00 0.00 C ATOM 1479 O GLN A 97 -11.394 -8.678 12.303 1.00 0.00 O ATOM 1480 CB GLN A 97 -13.038 -6.457 13.951 1.00 0.00 C ATOM 1481 CG GLN A 97 -13.521 -5.785 15.225 1.00 0.00 C ATOM 1482 CD GLN A 97 -14.932 -5.243 15.100 1.00 0.00 C ATOM 1483 OE1 GLN A 97 -15.135 -4.046 14.891 1.00 0.00 O ATOM 1484 NE2 GLN A 97 -15.917 -6.126 15.217 1.00 0.00 N ATOM 0 H GLN A 97 -11.005 -5.168 14.639 1.00 0.00 H new ATOM 0 HA GLN A 97 -11.722 -7.954 14.733 1.00 0.00 H new ATOM 0 HB2 GLN A 97 -13.022 -5.722 13.146 1.00 0.00 H new ATOM 0 HB3 GLN A 97 -13.753 -7.228 13.664 1.00 0.00 H new ATOM 0 HG2 GLN A 97 -13.482 -6.501 16.046 1.00 0.00 H new ATOM 0 HG3 GLN A 97 -12.844 -4.970 15.481 1.00 0.00 H new ATOM 0 HE21 GLN A 97 -15.703 -7.108 15.390 1.00 0.00 H new ATOM 0 HE22 GLN A 97 -16.887 -5.822 15.134 1.00 0.00 H new ATOM 1493 N LEU A 98 -10.459 -6.656 12.016 1.00 0.00 N ATOM 1494 CA LEU A 98 -9.921 -6.986 10.705 1.00 0.00 C ATOM 1495 C LEU A 98 -8.777 -7.982 10.850 1.00 0.00 C ATOM 1496 O LEU A 98 -8.748 -9.018 10.186 1.00 0.00 O ATOM 1497 CB LEU A 98 -9.444 -5.730 9.972 1.00 0.00 C ATOM 1498 CG LEU A 98 -9.788 -5.699 8.480 1.00 0.00 C ATOM 1499 CD1 LEU A 98 -10.121 -4.284 8.031 1.00 0.00 C ATOM 1500 CD2 LEU A 98 -8.641 -6.267 7.657 1.00 0.00 C ATOM 0 H LEU A 98 -10.253 -5.709 12.335 1.00 0.00 H new ATOM 0 HA LEU A 98 -10.716 -7.438 10.112 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -9.883 -4.855 10.452 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -8.363 -5.647 10.085 1.00 0.00 H new ATOM 0 HG LEU A 98 -10.669 -6.321 8.320 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -10.362 -4.287 6.968 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -10.977 -3.915 8.596 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -9.263 -3.635 8.207 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -8.903 -6.237 6.599 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -7.743 -5.673 7.826 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -8.455 -7.299 7.956 1.00 0.00 H new ATOM 1512 N LYS A 99 -7.832 -7.652 11.724 1.00 0.00 N ATOM 1513 CA LYS A 99 -6.675 -8.505 11.969 1.00 0.00 C ATOM 1514 C LYS A 99 -7.100 -9.867 12.511 1.00 0.00 C ATOM 1515 O LYS A 99 -6.574 -10.900 12.096 1.00 0.00 O ATOM 1516 CB LYS A 99 -5.721 -7.828 12.954 1.00 0.00 C ATOM 1517 CG LYS A 99 -4.252 -8.072 12.646 1.00 0.00 C ATOM 1518 CD LYS A 99 -3.362 -7.637 13.800 1.00 0.00 C ATOM 1519 CE LYS A 99 -3.598 -8.492 15.035 1.00 0.00 C ATOM 1520 NZ LYS A 99 -2.561 -8.256 16.079 1.00 0.00 N ATOM 0 H LYS A 99 -7.845 -6.795 12.277 1.00 0.00 H new ATOM 0 HA LYS A 99 -6.163 -8.660 11.019 1.00 0.00 H new ATOM 0 HB2 LYS A 99 -5.911 -6.755 12.951 1.00 0.00 H new ATOM 0 HB3 LYS A 99 -5.937 -8.187 13.960 1.00 0.00 H new ATOM 0 HG2 LYS A 99 -4.093 -9.131 12.441 1.00 0.00 H new ATOM 0 HG3 LYS A 99 -3.973 -7.527 11.744 1.00 0.00 H new ATOM 0 HD2 LYS A 99 -2.316 -7.707 13.501 1.00 0.00 H new ATOM 0 HD3 LYS A 99 -3.556 -6.591 14.037 1.00 0.00 H new ATOM 0 HE2 LYS A 99 -4.584 -8.273 15.446 1.00 0.00 H new ATOM 0 HE3 LYS A 99 -3.597 -9.545 14.753 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 -2.757 -8.857 16.905 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 -1.623 -8.489 15.695 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 -2.579 -7.257 16.366 1.00 0.00 H new ATOM 1534 N GLU A 100 -8.060 -9.869 13.434 1.00 0.00 N ATOM 1535 CA GLU A 100 -8.544 -11.118 14.009 1.00 0.00 C ATOM 1536 C GLU A 100 -9.151 -11.998 12.919 1.00 0.00 C ATOM 1537 O GLU A 100 -8.949 -13.212 12.900 1.00 0.00 O ATOM 1538 CB GLU A 100 -9.546 -10.851 15.150 1.00 0.00 C ATOM 1539 CG GLU A 100 -10.990 -10.654 14.705 1.00 0.00 C ATOM 1540 CD GLU A 100 -11.826 -11.910 14.865 1.00 0.00 C ATOM 1541 OE1 GLU A 100 -11.861 -12.725 13.920 1.00 0.00 O ATOM 1542 OE2 GLU A 100 -12.444 -12.077 15.936 1.00 0.00 O ATOM 0 H GLU A 100 -8.512 -9.029 13.795 1.00 0.00 H new ATOM 0 HA GLU A 100 -7.700 -11.653 14.444 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -9.508 -11.686 15.850 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -9.225 -9.963 15.695 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -11.438 -9.847 15.285 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -11.005 -10.342 13.661 1.00 0.00 H new ATOM 1549 N PHE A 101 -9.860 -11.365 11.986 1.00 0.00 N ATOM 1550 CA PHE A 101 -10.468 -12.071 10.866 1.00 0.00 C ATOM 1551 C PHE A 101 -9.389 -12.732 10.017 1.00 0.00 C ATOM 1552 O PHE A 101 -9.537 -13.867 9.560 1.00 0.00 O ATOM 1553 CB PHE A 101 -11.290 -11.095 10.015 1.00 0.00 C ATOM 1554 CG PHE A 101 -12.193 -11.766 9.017 1.00 0.00 C ATOM 1555 CD1 PHE A 101 -13.012 -12.819 9.398 1.00 0.00 C ATOM 1556 CD2 PHE A 101 -12.219 -11.344 7.699 1.00 0.00 C ATOM 1557 CE1 PHE A 101 -13.837 -13.437 8.478 1.00 0.00 C ATOM 1558 CE2 PHE A 101 -13.043 -11.959 6.775 1.00 0.00 C ATOM 1559 CZ PHE A 101 -13.852 -13.007 7.166 1.00 0.00 C ATOM 0 H PHE A 101 -10.027 -10.359 11.986 1.00 0.00 H new ATOM 0 HA PHE A 101 -11.132 -12.845 11.252 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -11.894 -10.473 10.675 1.00 0.00 H new ATOM 0 HB3 PHE A 101 -10.609 -10.429 9.484 1.00 0.00 H new ATOM 0 HD1 PHE A 101 -13.005 -13.159 10.423 1.00 0.00 H new ATOM 0 HD2 PHE A 101 -11.588 -10.524 7.389 1.00 0.00 H new ATOM 0 HE1 PHE A 101 -14.470 -14.256 8.785 1.00 0.00 H new ATOM 0 HE2 PHE A 101 -13.054 -11.620 5.750 1.00 0.00 H new ATOM 0 HZ PHE A 101 -14.496 -13.490 6.446 1.00 0.00 H new ATOM 1569 N LEU A 102 -8.289 -12.006 9.822 1.00 0.00 N ATOM 1570 CA LEU A 102 -7.170 -12.504 9.034 1.00 0.00 C ATOM 1571 C LEU A 102 -6.530 -13.698 9.728 1.00 0.00 C ATOM 1572 O LEU A 102 -6.503 -14.799 9.186 1.00 0.00 O ATOM 1573 CB LEU A 102 -6.133 -11.395 8.823 1.00 0.00 C ATOM 1574 CG LEU A 102 -6.106 -10.789 7.417 1.00 0.00 C ATOM 1575 CD1 LEU A 102 -4.969 -9.785 7.287 1.00 0.00 C ATOM 1576 CD2 LEU A 102 -5.977 -11.881 6.366 1.00 0.00 C ATOM 0 H LEU A 102 -8.152 -11.069 10.201 1.00 0.00 H new ATOM 0 HA LEU A 102 -7.542 -12.822 8.060 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -6.325 -10.598 9.541 1.00 0.00 H new ATOM 0 HB3 LEU A 102 -5.145 -11.796 9.048 1.00 0.00 H new ATOM 0 HG LEU A 102 -7.047 -10.264 7.253 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -4.967 -9.366 6.281 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -5.106 -8.984 8.014 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -4.019 -10.285 7.473 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -5.960 -11.431 5.374 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -5.053 -12.436 6.529 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -6.826 -12.560 6.441 1.00 0.00 H new ATOM 1588 N ASP A 103 -6.023 -13.477 10.936 1.00 0.00 N ATOM 1589 CA ASP A 103 -5.389 -14.548 11.700 1.00 0.00 C ATOM 1590 C ASP A 103 -6.267 -15.802 11.724 1.00 0.00 C ATOM 1591 O ASP A 103 -5.763 -16.926 11.730 1.00 0.00 O ATOM 1592 CB ASP A 103 -5.102 -14.081 13.131 1.00 0.00 C ATOM 1593 CG ASP A 103 -3.807 -14.651 13.678 1.00 0.00 C ATOM 1594 OD1 ASP A 103 -3.632 -15.885 13.623 1.00 0.00 O ATOM 1595 OD2 ASP A 103 -2.968 -13.861 14.161 1.00 0.00 O ATOM 0 H ASP A 103 -6.038 -12.572 11.406 1.00 0.00 H new ATOM 0 HA ASP A 103 -4.448 -14.799 11.211 1.00 0.00 H new ATOM 0 HB2 ASP A 103 -5.054 -12.992 13.152 1.00 0.00 H new ATOM 0 HB3 ASP A 103 -5.928 -14.376 13.779 1.00 0.00 H new ATOM 1600 N ALA A 104 -7.583 -15.601 11.736 1.00 0.00 N ATOM 1601 CA ALA A 104 -8.532 -16.711 11.761 1.00 0.00 C ATOM 1602 C ALA A 104 -8.605 -17.447 10.422 1.00 0.00 C ATOM 1603 O ALA A 104 -9.014 -18.607 10.373 1.00 0.00 O ATOM 1604 CB ALA A 104 -9.914 -16.215 12.153 1.00 0.00 C ATOM 0 H ALA A 104 -8.017 -14.678 11.729 1.00 0.00 H new ATOM 0 HA ALA A 104 -8.171 -17.421 12.505 1.00 0.00 H new ATOM 0 HB1 ALA A 104 -10.611 -17.053 12.167 1.00 0.00 H new ATOM 0 HB2 ALA A 104 -9.871 -15.762 13.143 1.00 0.00 H new ATOM 0 HB3 ALA A 104 -10.253 -15.474 11.430 1.00 0.00 H new ATOM 1610 N ASN A 105 -8.236 -16.771 9.336 1.00 0.00 N ATOM 1611 CA ASN A 105 -8.297 -17.385 8.006 1.00 0.00 C ATOM 1612 C ASN A 105 -6.905 -17.664 7.440 1.00 0.00 C ATOM 1613 O ASN A 105 -6.720 -18.606 6.669 1.00 0.00 O ATOM 1614 CB ASN A 105 -9.067 -16.474 7.049 1.00 0.00 C ATOM 1615 CG ASN A 105 -9.951 -17.251 6.092 1.00 0.00 C ATOM 1616 OD1 ASN A 105 -10.407 -18.351 6.403 1.00 0.00 O ATOM 1617 ND2 ASN A 105 -10.198 -16.679 4.918 1.00 0.00 N ATOM 0 H ASN A 105 -7.895 -15.810 9.346 1.00 0.00 H new ATOM 0 HA ASN A 105 -8.812 -18.340 8.108 1.00 0.00 H new ATOM 0 HB2 ASN A 105 -9.681 -15.783 7.626 1.00 0.00 H new ATOM 0 HB3 ASN A 105 -8.360 -15.872 6.478 1.00 0.00 H new ATOM 0 HD21 ASN A 105 -10.786 -17.154 4.233 1.00 0.00 H new ATOM 0 HD22 ASN A 105 -9.799 -15.765 4.702 1.00 0.00 H new ATOM 1624 N LEU A 106 -5.934 -16.847 7.821 1.00 0.00 N ATOM 1625 CA LEU A 106 -4.565 -17.013 7.348 1.00 0.00 C ATOM 1626 C LEU A 106 -3.982 -18.336 7.836 1.00 0.00 C ATOM 1627 O LEU A 106 -3.519 -19.154 7.040 1.00 0.00 O ATOM 1628 CB LEU A 106 -3.704 -15.846 7.835 1.00 0.00 C ATOM 1629 CG LEU A 106 -2.225 -15.907 7.442 1.00 0.00 C ATOM 1630 CD1 LEU A 106 -2.072 -16.077 5.938 1.00 0.00 C ATOM 1631 CD2 LEU A 106 -1.501 -14.655 7.914 1.00 0.00 C ATOM 0 H LEU A 106 -6.068 -16.061 8.457 1.00 0.00 H new ATOM 0 HA LEU A 106 -4.572 -17.024 6.258 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -4.127 -14.919 7.447 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -3.771 -15.797 8.922 1.00 0.00 H new ATOM 0 HG LEU A 106 -1.776 -16.773 7.928 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -1.013 -16.118 5.682 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -2.557 -17.002 5.625 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -2.536 -15.233 5.427 1.00 0.00 H new ATOM 0 HD21 LEU A 106 -0.451 -14.712 7.628 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -1.955 -13.777 7.454 1.00 0.00 H new ATOM 0 HD23 LEU A 106 -1.578 -14.577 8.999 1.00 0.00 H new ATOM 1643 N VAL A 107 -4.012 -18.532 9.152 1.00 0.00 N ATOM 1644 CA VAL A 107 -3.491 -19.748 9.773 1.00 0.00 C ATOM 1645 C VAL A 107 -2.129 -20.137 9.205 1.00 0.00 C ATOM 1646 O VAL A 107 -1.744 -21.317 9.350 1.00 0.00 O ATOM 1647 CB VAL A 107 -4.472 -20.929 9.620 1.00 0.00 C ATOM 1648 CG1 VAL A 107 -5.847 -20.541 10.137 1.00 0.00 C ATOM 1649 CG2 VAL A 107 -4.557 -21.398 8.172 1.00 0.00 C ATOM 0 H VAL A 107 -4.395 -17.858 9.814 1.00 0.00 H new ATOM 0 HA VAL A 107 -3.373 -19.525 10.833 1.00 0.00 H new ATOM 0 HB VAL A 107 -4.093 -21.760 10.215 1.00 0.00 H new ATOM 0 HG11 VAL A 107 -6.530 -21.383 10.023 1.00 0.00 H new ATOM 0 HG12 VAL A 107 -5.777 -20.271 11.191 1.00 0.00 H new ATOM 0 HG13 VAL A 107 -6.223 -19.690 9.569 1.00 0.00 H new ATOM 0 HG21 VAL A 107 -5.257 -22.231 8.100 1.00 0.00 H new ATOM 0 HG22 VAL A 107 -4.903 -20.578 7.544 1.00 0.00 H new ATOM 0 HG23 VAL A 107 -3.572 -21.722 7.836 1.00 0.00 H new TER 1659 VAL A 107