USER MOD reduce.3.24.130724 H: found=0, std=0, add=723, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 723 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 67 SER OG : rot 32:sc= 0.557 USER MOD Set 1.2: A 68 ASN : amide:sc= -0.543 K(o=0.014,f=-5.6!) USER MOD Set 2.1: A 7 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Set 2.2: A 9 SER OG : rot 160:sc= 0 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 151:sc= 0.798 (180deg=-0.0965!) USER MOD Single : A 2 HIS : no HD1:sc= -0.0606 X(o=-0.061,f=-0.18) USER MOD Single : A 3 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 4 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 5 HIS : no HD1:sc= -0.0363 X(o=-0.036,f=-0.11) USER MOD Single : A 6 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 8 SER OG : rot 180:sc= 0 USER MOD Single : A 13 ASN : amide:sc= 0 K(o=0,f=-0.55) USER MOD Single : A 15 TYR OH : rot 180:sc= 0 USER MOD Single : A 17 GLN : amide:sc= -0.984 K(o=-0.98,f=-3.8!) USER MOD Single : A 19 HIS : no HD1:sc= 0 X(o=0,f=-0.001) USER MOD Single : A 20 MET CE :methyl 162:sc= -0.144 (180deg=-0.559) USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 24 SER OG : rot 180:sc= 0 USER MOD Single : A 30 SER OG : rot 29:sc= 0.115 USER MOD Single : A 37 SER OG : rot 180:sc= 0 USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 LYS NZ :NH3+ 150:sc= -2.83 (180deg=-5.68!) USER MOD Single : A 44 TYR OH : rot 30:sc= 0 USER MOD Single : A 46 ASN : amide:sc= 0.849 K(o=0.85,f=-2.9!) USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 SER OG : rot 180:sc= 0 USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 THR OG1 : rot 180:sc= 0 USER MOD Single : A 62 THR OG1 : rot -40:sc= 0.725 USER MOD Single : A 70 LYS NZ :NH3+ -171:sc= -0.0139 (180deg=-0.117) USER MOD Single : A 71 GLN : amide:sc= -0.0595 X(o=-0.06,f=-0.28) USER MOD Single : A 74 GLN : amide:sc= -0.0178 K(o=-0.018,f=-0.74) USER MOD Single : A 75 TYR OH : rot 180:sc= -0.554 USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 79 HIS : +bothHN:sc= 0.227 K(o=0.23,f=-3.5!) USER MOD Single : A 82 ASN : amide:sc= 0.0707 K(o=0.071,f=-1.8!) USER MOD Single : A 91 THR OG1 : rot -41:sc= 0.607 USER MOD Single : A 92 THR OG1 : rot -140:sc= 0 USER MOD Single : A 93 SER OG : rot -67:sc= 0.869 USER MOD Single : A 95 THR OG1 : rot 40:sc= 0.231 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 27.009 12.572 -1.098 1.00 0.00 N ATOM 2 CA MET A 1 27.085 11.172 -1.578 1.00 0.00 C ATOM 3 C MET A 1 27.803 11.142 -2.933 1.00 0.00 C ATOM 4 O MET A 1 27.335 11.770 -3.891 1.00 0.00 O ATOM 5 CB MET A 1 25.664 10.538 -1.714 1.00 0.00 C ATOM 6 CG MET A 1 24.790 10.633 -0.457 1.00 0.00 C ATOM 7 SD MET A 1 24.352 12.344 -0.057 1.00 0.00 S ATOM 8 CE MET A 1 23.432 12.145 1.467 1.00 0.00 C ATOM 0 H1 MET A 1 26.165 12.689 -0.502 1.00 0.00 H new ATOM 0 H2 MET A 1 27.859 12.795 -0.542 1.00 0.00 H new ATOM 0 H3 MET A 1 26.950 13.216 -1.913 1.00 0.00 H new ATOM 0 HA MET A 1 27.642 10.585 -0.847 1.00 0.00 H new ATOM 0 HB2 MET A 1 25.143 11.024 -2.539 1.00 0.00 H new ATOM 0 HB3 MET A 1 25.775 9.487 -1.983 1.00 0.00 H new ATOM 0 HG2 MET A 1 23.880 10.052 -0.604 1.00 0.00 H new ATOM 0 HG3 MET A 1 25.319 10.188 0.386 1.00 0.00 H new ATOM 0 HE1 MET A 1 23.103 13.121 1.823 1.00 0.00 H new ATOM 0 HE2 MET A 1 22.563 11.512 1.287 1.00 0.00 H new ATOM 0 HE3 MET A 1 24.070 11.680 2.219 1.00 0.00 H new ATOM 20 N HIS A 2 28.940 10.423 -3.008 1.00 0.00 N ATOM 21 CA HIS A 2 29.710 10.273 -4.262 1.00 0.00 C ATOM 22 C HIS A 2 30.577 8.998 -4.214 1.00 0.00 C ATOM 23 O HIS A 2 31.498 8.879 -3.398 1.00 0.00 O ATOM 24 CB HIS A 2 30.581 11.535 -4.559 1.00 0.00 C ATOM 25 CG HIS A 2 31.608 11.882 -3.502 1.00 0.00 C ATOM 26 ND1 HIS A 2 32.931 11.504 -3.583 1.00 0.00 N ATOM 27 CD2 HIS A 2 31.502 12.598 -2.356 1.00 0.00 C ATOM 28 CE1 HIS A 2 33.588 11.967 -2.542 1.00 0.00 C ATOM 29 NE2 HIS A 2 32.746 12.630 -1.777 1.00 0.00 N ATOM 0 H HIS A 2 29.348 9.934 -2.211 1.00 0.00 H new ATOM 0 HA HIS A 2 28.998 10.174 -5.081 1.00 0.00 H new ATOM 0 HB2 HIS A 2 31.098 11.383 -5.507 1.00 0.00 H new ATOM 0 HB3 HIS A 2 29.918 12.390 -4.691 1.00 0.00 H new ATOM 0 HD2 HIS A 2 30.605 13.058 -1.970 1.00 0.00 H new ATOM 0 HE1 HIS A 2 34.641 11.827 -2.347 1.00 0.00 H new ATOM 0 HE2 HIS A 2 32.980 13.092 -0.898 1.00 0.00 H new ATOM 38 N HIS A 3 30.222 8.016 -5.061 1.00 0.00 N ATOM 39 CA HIS A 3 31.027 6.802 -5.294 1.00 0.00 C ATOM 40 C HIS A 3 31.146 6.586 -6.809 1.00 0.00 C ATOM 41 O HIS A 3 30.184 6.815 -7.558 1.00 0.00 O ATOM 42 CB HIS A 3 30.413 5.559 -4.593 1.00 0.00 C ATOM 43 CG HIS A 3 30.359 5.674 -3.089 1.00 0.00 C ATOM 44 ND1 HIS A 3 31.456 5.463 -2.279 1.00 0.00 N ATOM 45 CD2 HIS A 3 29.346 6.008 -2.255 1.00 0.00 C ATOM 46 CE1 HIS A 3 31.119 5.661 -1.021 1.00 0.00 C ATOM 47 NE2 HIS A 3 29.845 5.991 -0.975 1.00 0.00 N ATOM 0 H HIS A 3 29.361 8.042 -5.608 1.00 0.00 H new ATOM 0 HA HIS A 3 32.018 6.937 -4.860 1.00 0.00 H new ATOM 0 HB2 HIS A 3 29.404 5.401 -4.973 1.00 0.00 H new ATOM 0 HB3 HIS A 3 30.996 4.678 -4.860 1.00 0.00 H new ATOM 0 HD2 HIS A 3 28.332 6.244 -2.543 1.00 0.00 H new ATOM 0 HE1 HIS A 3 31.777 5.568 -0.170 1.00 0.00 H new ATOM 0 HE2 HIS A 3 29.316 6.200 -0.128 1.00 0.00 H new ATOM 56 N HIS A 4 32.334 6.147 -7.244 1.00 0.00 N ATOM 57 CA HIS A 4 32.681 6.052 -8.671 1.00 0.00 C ATOM 58 C HIS A 4 32.065 4.794 -9.300 1.00 0.00 C ATOM 59 O HIS A 4 32.336 3.670 -8.854 1.00 0.00 O ATOM 60 CB HIS A 4 34.219 6.044 -8.850 1.00 0.00 C ATOM 61 CG HIS A 4 34.918 7.269 -8.320 1.00 0.00 C ATOM 62 ND1 HIS A 4 36.021 7.213 -7.493 1.00 0.00 N ATOM 63 CD2 HIS A 4 34.668 8.582 -8.517 1.00 0.00 C ATOM 64 CE1 HIS A 4 36.414 8.437 -7.204 1.00 0.00 C ATOM 65 NE2 HIS A 4 35.612 9.289 -7.815 1.00 0.00 N ATOM 0 H HIS A 4 33.082 5.848 -6.619 1.00 0.00 H new ATOM 0 HA HIS A 4 32.272 6.924 -9.181 1.00 0.00 H new ATOM 0 HB2 HIS A 4 34.625 5.165 -8.350 1.00 0.00 H new ATOM 0 HB3 HIS A 4 34.448 5.942 -9.911 1.00 0.00 H new ATOM 0 HD2 HIS A 4 33.872 8.999 -9.116 1.00 0.00 H new ATOM 0 HE1 HIS A 4 37.251 8.699 -6.574 1.00 0.00 H new ATOM 0 HE2 HIS A 4 35.682 10.306 -7.772 1.00 0.00 H new ATOM 74 N HIS A 5 31.228 5.008 -10.325 1.00 0.00 N ATOM 75 CA HIS A 5 30.637 3.939 -11.156 1.00 0.00 C ATOM 76 C HIS A 5 31.348 3.905 -12.522 1.00 0.00 C ATOM 77 O HIS A 5 31.911 4.919 -12.963 1.00 0.00 O ATOM 78 CB HIS A 5 29.107 4.157 -11.330 1.00 0.00 C ATOM 79 CG HIS A 5 28.728 5.501 -11.897 1.00 0.00 C ATOM 80 ND1 HIS A 5 28.454 6.590 -11.102 1.00 0.00 N ATOM 81 CD2 HIS A 5 28.555 5.922 -13.175 1.00 0.00 C ATOM 82 CE1 HIS A 5 28.117 7.614 -11.858 1.00 0.00 C ATOM 83 NE2 HIS A 5 28.172 7.238 -13.117 1.00 0.00 N ATOM 0 H HIS A 5 30.935 5.943 -10.608 1.00 0.00 H new ATOM 0 HA HIS A 5 30.776 2.979 -10.659 1.00 0.00 H new ATOM 0 HB2 HIS A 5 28.714 3.377 -11.982 1.00 0.00 H new ATOM 0 HB3 HIS A 5 28.623 4.036 -10.361 1.00 0.00 H new ATOM 0 HD2 HIS A 5 28.693 5.332 -14.069 1.00 0.00 H new ATOM 0 HE1 HIS A 5 27.842 8.597 -11.504 1.00 0.00 H new ATOM 0 HE2 HIS A 5 27.963 7.830 -13.921 1.00 0.00 H new ATOM 92 N HIS A 6 31.327 2.731 -13.173 1.00 0.00 N ATOM 93 CA HIS A 6 31.926 2.535 -14.511 1.00 0.00 C ATOM 94 C HIS A 6 30.989 3.097 -15.599 1.00 0.00 C ATOM 95 O HIS A 6 29.760 3.130 -15.422 1.00 0.00 O ATOM 96 CB HIS A 6 32.248 1.029 -14.760 1.00 0.00 C ATOM 97 CG HIS A 6 33.304 0.468 -13.832 1.00 0.00 C ATOM 98 ND1 HIS A 6 34.618 0.282 -14.213 1.00 0.00 N ATOM 99 CD2 HIS A 6 33.235 0.056 -12.540 1.00 0.00 C ATOM 100 CE1 HIS A 6 35.306 -0.211 -13.200 1.00 0.00 C ATOM 101 NE2 HIS A 6 34.494 -0.358 -12.171 1.00 0.00 N ATOM 0 H HIS A 6 30.896 1.889 -12.791 1.00 0.00 H new ATOM 0 HA HIS A 6 32.868 3.082 -14.557 1.00 0.00 H new ATOM 0 HB2 HIS A 6 31.333 0.448 -14.647 1.00 0.00 H new ATOM 0 HB3 HIS A 6 32.580 0.904 -15.791 1.00 0.00 H new ATOM 0 HD2 HIS A 6 32.353 0.054 -11.916 1.00 0.00 H new ATOM 0 HE1 HIS A 6 36.358 -0.454 -13.212 1.00 0.00 H new ATOM 0 HE2 HIS A 6 34.756 -0.719 -11.254 1.00 0.00 H new ATOM 110 N HIS A 7 31.593 3.558 -16.709 1.00 0.00 N ATOM 111 CA HIS A 7 30.878 4.210 -17.820 1.00 0.00 C ATOM 112 C HIS A 7 29.879 3.234 -18.478 1.00 0.00 C ATOM 113 O HIS A 7 30.269 2.376 -19.280 1.00 0.00 O ATOM 114 CB HIS A 7 31.895 4.753 -18.859 1.00 0.00 C ATOM 115 CG HIS A 7 31.276 5.490 -20.030 1.00 0.00 C ATOM 116 ND1 HIS A 7 31.596 5.225 -21.349 1.00 0.00 N ATOM 117 CD2 HIS A 7 30.362 6.497 -20.072 1.00 0.00 C ATOM 118 CE1 HIS A 7 30.914 6.030 -22.144 1.00 0.00 C ATOM 119 NE2 HIS A 7 30.157 6.810 -21.398 1.00 0.00 N ATOM 0 H HIS A 7 32.599 3.488 -16.861 1.00 0.00 H new ATOM 0 HA HIS A 7 30.306 5.050 -17.424 1.00 0.00 H new ATOM 0 HB2 HIS A 7 32.588 5.424 -18.351 1.00 0.00 H new ATOM 0 HB3 HIS A 7 32.482 3.918 -19.242 1.00 0.00 H new ATOM 0 HD2 HIS A 7 29.885 6.964 -19.223 1.00 0.00 H new ATOM 0 HE1 HIS A 7 30.968 6.046 -23.223 1.00 0.00 H new ATOM 0 HE2 HIS A 7 29.522 7.529 -21.746 1.00 0.00 H new ATOM 128 N SER A 8 28.603 3.361 -18.093 1.00 0.00 N ATOM 129 CA SER A 8 27.504 2.550 -18.629 1.00 0.00 C ATOM 130 C SER A 8 27.010 3.183 -19.943 1.00 0.00 C ATOM 131 O SER A 8 26.458 4.292 -19.933 1.00 0.00 O ATOM 132 CB SER A 8 26.364 2.474 -17.586 1.00 0.00 C ATOM 133 OG SER A 8 26.857 2.048 -16.322 1.00 0.00 O ATOM 0 H SER A 8 28.302 4.038 -17.392 1.00 0.00 H new ATOM 0 HA SER A 8 27.846 1.536 -18.835 1.00 0.00 H new ATOM 0 HB2 SER A 8 25.892 3.452 -17.486 1.00 0.00 H new ATOM 0 HB3 SER A 8 25.595 1.783 -17.932 1.00 0.00 H new ATOM 0 HG SER A 8 26.118 2.009 -15.679 1.00 0.00 H new ATOM 139 N SER A 9 27.240 2.486 -21.063 1.00 0.00 N ATOM 140 CA SER A 9 26.877 2.964 -22.398 1.00 0.00 C ATOM 141 C SER A 9 26.727 1.778 -23.369 1.00 0.00 C ATOM 142 O SER A 9 27.536 0.834 -23.337 1.00 0.00 O ATOM 143 CB SER A 9 27.946 3.962 -22.907 1.00 0.00 C ATOM 144 OG SER A 9 29.255 3.401 -22.853 1.00 0.00 O ATOM 0 H SER A 9 27.686 1.569 -21.065 1.00 0.00 H new ATOM 0 HA SER A 9 25.918 3.480 -22.344 1.00 0.00 H new ATOM 0 HB2 SER A 9 27.716 4.251 -23.932 1.00 0.00 H new ATOM 0 HB3 SER A 9 27.913 4.870 -22.305 1.00 0.00 H new ATOM 0 HG SER A 9 29.848 3.897 -23.455 1.00 0.00 H new ATOM 150 N GLY A 10 25.685 1.829 -24.216 1.00 0.00 N ATOM 151 CA GLY A 10 25.443 0.807 -25.238 1.00 0.00 C ATOM 152 C GLY A 10 26.162 1.161 -26.532 1.00 0.00 C ATOM 153 O GLY A 10 26.318 2.348 -26.847 1.00 0.00 O ATOM 0 H GLY A 10 24.992 2.578 -24.209 1.00 0.00 H new ATOM 0 HA2 GLY A 10 25.787 -0.163 -24.878 1.00 0.00 H new ATOM 0 HA3 GLY A 10 24.373 0.717 -25.423 1.00 0.00 H new ATOM 157 N ARG A 11 26.585 0.136 -27.285 1.00 0.00 N ATOM 158 CA ARG A 11 27.370 0.299 -28.523 1.00 0.00 C ATOM 159 C ARG A 11 26.855 -0.685 -29.591 1.00 0.00 C ATOM 160 O ARG A 11 26.249 -0.277 -30.593 1.00 0.00 O ATOM 161 CB ARG A 11 28.883 0.077 -28.216 1.00 0.00 C ATOM 162 CG ARG A 11 29.838 0.090 -29.439 1.00 0.00 C ATOM 163 CD ARG A 11 29.762 1.390 -30.265 1.00 0.00 C ATOM 164 NE ARG A 11 30.782 1.420 -31.331 1.00 0.00 N ATOM 165 CZ ARG A 11 30.660 2.023 -32.523 1.00 0.00 C ATOM 166 NH1 ARG A 11 29.544 2.658 -32.863 1.00 0.00 N ATOM 167 NH2 ARG A 11 31.665 1.977 -33.369 1.00 0.00 N ATOM 0 H ARG A 11 26.392 -0.838 -27.053 1.00 0.00 H new ATOM 0 HA ARG A 11 27.252 1.310 -28.912 1.00 0.00 H new ATOM 0 HB2 ARG A 11 29.208 0.849 -27.519 1.00 0.00 H new ATOM 0 HB3 ARG A 11 28.992 -0.880 -27.706 1.00 0.00 H new ATOM 0 HG2 ARG A 11 30.862 -0.051 -29.092 1.00 0.00 H new ATOM 0 HG3 ARG A 11 29.600 -0.756 -30.084 1.00 0.00 H new ATOM 0 HD2 ARG A 11 28.770 1.482 -30.708 1.00 0.00 H new ATOM 0 HD3 ARG A 11 29.898 2.248 -29.607 1.00 0.00 H new ATOM 0 HE ARG A 11 31.661 0.938 -31.144 1.00 0.00 H new ATOM 0 HH11 ARG A 11 28.759 2.694 -32.213 1.00 0.00 H new ATOM 0 HH12 ARG A 11 29.472 3.110 -33.775 1.00 0.00 H new ATOM 0 HH21 ARG A 11 32.523 1.487 -33.115 1.00 0.00 H new ATOM 0 HH22 ARG A 11 31.587 2.431 -34.279 1.00 0.00 H new ATOM 181 N GLU A 12 27.072 -1.993 -29.355 1.00 0.00 N ATOM 182 CA GLU A 12 26.719 -3.050 -30.313 1.00 0.00 C ATOM 183 C GLU A 12 25.335 -3.624 -29.970 1.00 0.00 C ATOM 184 O GLU A 12 25.227 -4.656 -29.301 1.00 0.00 O ATOM 185 CB GLU A 12 27.816 -4.153 -30.312 1.00 0.00 C ATOM 186 CG GLU A 12 29.211 -3.648 -30.724 1.00 0.00 C ATOM 187 CD GLU A 12 30.293 -4.743 -30.704 1.00 0.00 C ATOM 188 OE1 GLU A 12 30.542 -5.371 -31.754 1.00 0.00 O ATOM 189 OE2 GLU A 12 30.901 -4.980 -29.639 1.00 0.00 O ATOM 0 H GLU A 12 27.496 -2.343 -28.496 1.00 0.00 H new ATOM 0 HA GLU A 12 26.667 -2.633 -31.319 1.00 0.00 H new ATOM 0 HB2 GLU A 12 27.878 -4.588 -29.315 1.00 0.00 H new ATOM 0 HB3 GLU A 12 27.515 -4.951 -30.990 1.00 0.00 H new ATOM 0 HG2 GLU A 12 29.153 -3.224 -31.727 1.00 0.00 H new ATOM 0 HG3 GLU A 12 29.509 -2.842 -30.054 1.00 0.00 H new ATOM 196 N ASN A 13 24.286 -2.875 -30.361 1.00 0.00 N ATOM 197 CA ASN A 13 22.882 -3.315 -30.259 1.00 0.00 C ATOM 198 C ASN A 13 22.013 -2.403 -31.143 1.00 0.00 C ATOM 199 O ASN A 13 21.343 -1.479 -30.654 1.00 0.00 O ATOM 200 CB ASN A 13 22.366 -3.323 -28.787 1.00 0.00 C ATOM 201 CG ASN A 13 20.971 -3.956 -28.632 1.00 0.00 C ATOM 202 OD1 ASN A 13 20.622 -4.902 -29.343 1.00 0.00 O ATOM 203 ND2 ASN A 13 20.167 -3.433 -27.719 1.00 0.00 N ATOM 0 H ASN A 13 24.390 -1.942 -30.759 1.00 0.00 H new ATOM 0 HA ASN A 13 22.816 -4.345 -30.608 1.00 0.00 H new ATOM 0 HB2 ASN A 13 23.075 -3.868 -28.164 1.00 0.00 H new ATOM 0 HB3 ASN A 13 22.336 -2.299 -28.415 1.00 0.00 H new ATOM 0 HD21 ASN A 13 19.229 -3.812 -27.588 1.00 0.00 H new ATOM 0 HD22 ASN A 13 20.485 -2.651 -27.147 1.00 0.00 H new ATOM 210 N LEU A 14 22.105 -2.632 -32.455 1.00 0.00 N ATOM 211 CA LEU A 14 21.351 -1.882 -33.481 1.00 0.00 C ATOM 212 C LEU A 14 21.466 -2.620 -34.821 1.00 0.00 C ATOM 213 O LEU A 14 22.427 -3.370 -35.045 1.00 0.00 O ATOM 214 CB LEU A 14 21.817 -0.379 -33.582 1.00 0.00 C ATOM 215 CG LEU A 14 23.205 -0.014 -34.231 1.00 0.00 C ATOM 216 CD1 LEU A 14 24.341 -0.934 -33.775 1.00 0.00 C ATOM 217 CD2 LEU A 14 23.125 0.083 -35.769 1.00 0.00 C ATOM 0 H LEU A 14 22.712 -3.352 -32.847 1.00 0.00 H new ATOM 0 HA LEU A 14 20.301 -1.840 -33.191 1.00 0.00 H new ATOM 0 HB2 LEU A 14 21.050 0.159 -34.139 1.00 0.00 H new ATOM 0 HB3 LEU A 14 21.819 0.026 -32.570 1.00 0.00 H new ATOM 0 HG LEU A 14 23.452 0.981 -33.860 1.00 0.00 H new ATOM 0 HD11 LEU A 14 25.270 -0.631 -34.257 1.00 0.00 H new ATOM 0 HD12 LEU A 14 24.454 -0.864 -32.693 1.00 0.00 H new ATOM 0 HD13 LEU A 14 24.108 -1.963 -34.050 1.00 0.00 H new ATOM 0 HD21 LEU A 14 24.107 0.337 -36.169 1.00 0.00 H new ATOM 0 HD22 LEU A 14 22.803 -0.875 -36.178 1.00 0.00 H new ATOM 0 HD23 LEU A 14 22.409 0.856 -36.048 1.00 0.00 H new ATOM 229 N TYR A 15 20.486 -2.411 -35.715 1.00 0.00 N ATOM 230 CA TYR A 15 20.448 -3.071 -37.033 1.00 0.00 C ATOM 231 C TYR A 15 20.087 -2.060 -38.118 1.00 0.00 C ATOM 232 O TYR A 15 20.894 -1.812 -39.027 1.00 0.00 O ATOM 233 CB TYR A 15 19.468 -4.284 -37.023 1.00 0.00 C ATOM 234 CG TYR A 15 20.019 -5.482 -36.236 1.00 0.00 C ATOM 235 CD1 TYR A 15 19.845 -5.583 -34.856 1.00 0.00 C ATOM 236 CD2 TYR A 15 20.781 -6.470 -36.867 1.00 0.00 C ATOM 237 CE1 TYR A 15 20.404 -6.619 -34.140 1.00 0.00 C ATOM 238 CE2 TYR A 15 21.330 -7.514 -36.153 1.00 0.00 C ATOM 239 CZ TYR A 15 21.141 -7.584 -34.791 1.00 0.00 C ATOM 240 OH TYR A 15 21.699 -8.615 -34.073 1.00 0.00 O ATOM 0 H TYR A 15 19.700 -1.783 -35.547 1.00 0.00 H new ATOM 0 HA TYR A 15 21.440 -3.464 -37.257 1.00 0.00 H new ATOM 0 HB2 TYR A 15 18.517 -3.975 -36.588 1.00 0.00 H new ATOM 0 HB3 TYR A 15 19.265 -4.591 -38.049 1.00 0.00 H new ATOM 0 HD1 TYR A 15 19.261 -4.836 -34.339 1.00 0.00 H new ATOM 0 HD2 TYR A 15 20.943 -6.414 -37.933 1.00 0.00 H new ATOM 0 HE1 TYR A 15 20.265 -6.675 -33.070 1.00 0.00 H new ATOM 0 HE2 TYR A 15 21.906 -8.274 -36.660 1.00 0.00 H new ATOM 0 HH TYR A 15 22.186 -9.211 -34.680 1.00 0.00 H new ATOM 250 N PHE A 16 18.856 -1.517 -38.030 1.00 0.00 N ATOM 251 CA PHE A 16 18.322 -0.532 -39.001 1.00 0.00 C ATOM 252 C PHE A 16 18.166 -1.168 -40.422 1.00 0.00 C ATOM 253 O PHE A 16 17.952 -0.471 -41.423 1.00 0.00 O ATOM 254 CB PHE A 16 19.213 0.763 -38.988 1.00 0.00 C ATOM 255 CG PHE A 16 18.700 1.933 -39.831 1.00 0.00 C ATOM 256 CD1 PHE A 16 19.392 2.371 -40.966 1.00 0.00 C ATOM 257 CD2 PHE A 16 17.520 2.598 -39.488 1.00 0.00 C ATOM 258 CE1 PHE A 16 18.918 3.424 -41.729 1.00 0.00 C ATOM 259 CE2 PHE A 16 17.049 3.655 -40.253 1.00 0.00 C ATOM 260 CZ PHE A 16 17.748 4.068 -41.370 1.00 0.00 C ATOM 0 H PHE A 16 18.200 -1.748 -37.283 1.00 0.00 H new ATOM 0 HA PHE A 16 17.317 -0.232 -38.703 1.00 0.00 H new ATOM 0 HB2 PHE A 16 19.315 1.100 -37.957 1.00 0.00 H new ATOM 0 HB3 PHE A 16 20.211 0.498 -39.337 1.00 0.00 H new ATOM 0 HD1 PHE A 16 20.310 1.879 -41.251 1.00 0.00 H new ATOM 0 HD2 PHE A 16 16.967 2.285 -38.615 1.00 0.00 H new ATOM 0 HE1 PHE A 16 19.462 3.743 -42.606 1.00 0.00 H new ATOM 0 HE2 PHE A 16 16.134 4.156 -39.974 1.00 0.00 H new ATOM 0 HZ PHE A 16 17.381 4.893 -41.963 1.00 0.00 H new ATOM 270 N GLN A 17 18.233 -2.520 -40.482 1.00 0.00 N ATOM 271 CA GLN A 17 18.178 -3.303 -41.732 1.00 0.00 C ATOM 272 C GLN A 17 17.112 -4.402 -41.612 1.00 0.00 C ATOM 273 O GLN A 17 16.279 -4.371 -40.703 1.00 0.00 O ATOM 274 CB GLN A 17 19.603 -3.874 -42.066 1.00 0.00 C ATOM 275 CG GLN A 17 20.338 -4.662 -40.939 1.00 0.00 C ATOM 276 CD GLN A 17 19.742 -6.026 -40.573 1.00 0.00 C ATOM 277 OE1 GLN A 17 18.900 -6.136 -39.684 1.00 0.00 O ATOM 278 NE2 GLN A 17 20.149 -7.062 -41.285 1.00 0.00 N ATOM 0 H GLN A 17 18.328 -3.102 -39.650 1.00 0.00 H new ATOM 0 HA GLN A 17 17.886 -2.662 -42.564 1.00 0.00 H new ATOM 0 HB2 GLN A 17 19.509 -4.530 -42.931 1.00 0.00 H new ATOM 0 HB3 GLN A 17 20.239 -3.041 -42.365 1.00 0.00 H new ATOM 0 HG2 GLN A 17 21.374 -4.811 -41.243 1.00 0.00 H new ATOM 0 HG3 GLN A 17 20.355 -4.043 -40.042 1.00 0.00 H new ATOM 0 HE21 GLN A 17 20.850 -6.935 -42.015 1.00 0.00 H new ATOM 0 HE22 GLN A 17 19.763 -7.989 -41.104 1.00 0.00 H new ATOM 287 N GLY A 18 17.139 -5.368 -42.551 1.00 0.00 N ATOM 288 CA GLY A 18 16.287 -6.560 -42.487 1.00 0.00 C ATOM 289 C GLY A 18 14.923 -6.375 -43.146 1.00 0.00 C ATOM 290 O GLY A 18 14.009 -7.176 -42.914 1.00 0.00 O ATOM 0 H GLY A 18 17.749 -5.340 -43.368 1.00 0.00 H new ATOM 0 HA2 GLY A 18 16.803 -7.391 -42.968 1.00 0.00 H new ATOM 0 HA3 GLY A 18 16.142 -6.836 -41.443 1.00 0.00 H new ATOM 294 N HIS A 19 14.776 -5.310 -43.958 1.00 0.00 N ATOM 295 CA HIS A 19 13.564 -5.081 -44.757 1.00 0.00 C ATOM 296 C HIS A 19 13.823 -5.504 -46.210 1.00 0.00 C ATOM 297 O HIS A 19 14.693 -4.938 -46.889 1.00 0.00 O ATOM 298 CB HIS A 19 13.125 -3.596 -44.701 1.00 0.00 C ATOM 299 CG HIS A 19 11.853 -3.323 -45.463 1.00 0.00 C ATOM 300 ND1 HIS A 19 11.835 -2.837 -46.756 1.00 0.00 N ATOM 301 CD2 HIS A 19 10.558 -3.495 -45.113 1.00 0.00 C ATOM 302 CE1 HIS A 19 10.586 -2.733 -47.167 1.00 0.00 C ATOM 303 NE2 HIS A 19 9.792 -3.124 -46.190 1.00 0.00 N ATOM 0 H HIS A 19 15.490 -4.591 -44.076 1.00 0.00 H new ATOM 0 HA HIS A 19 12.755 -5.681 -44.340 1.00 0.00 H new ATOM 0 HB2 HIS A 19 12.987 -3.304 -43.660 1.00 0.00 H new ATOM 0 HB3 HIS A 19 13.923 -2.973 -45.104 1.00 0.00 H new ATOM 0 HD2 HIS A 19 10.194 -3.857 -44.163 1.00 0.00 H new ATOM 0 HE1 HIS A 19 10.268 -2.386 -48.139 1.00 0.00 H new ATOM 0 HE2 HIS A 19 8.773 -3.147 -46.228 1.00 0.00 H new ATOM 312 N MET A 20 13.068 -6.508 -46.662 1.00 0.00 N ATOM 313 CA MET A 20 13.095 -7.005 -48.044 1.00 0.00 C ATOM 314 C MET A 20 11.742 -6.701 -48.708 1.00 0.00 C ATOM 315 O MET A 20 10.694 -7.019 -48.142 1.00 0.00 O ATOM 316 CB MET A 20 13.360 -8.545 -48.082 1.00 0.00 C ATOM 317 CG MET A 20 14.684 -9.011 -47.448 1.00 0.00 C ATOM 318 SD MET A 20 14.769 -8.740 -45.659 1.00 0.00 S ATOM 319 CE MET A 20 13.346 -9.665 -45.060 1.00 0.00 C ATOM 0 H MET A 20 12.407 -7.009 -46.068 1.00 0.00 H new ATOM 0 HA MET A 20 13.903 -6.507 -48.581 1.00 0.00 H new ATOM 0 HB2 MET A 20 12.538 -9.049 -47.574 1.00 0.00 H new ATOM 0 HB3 MET A 20 13.341 -8.873 -49.121 1.00 0.00 H new ATOM 0 HG2 MET A 20 14.821 -10.073 -47.653 1.00 0.00 H new ATOM 0 HG3 MET A 20 15.511 -8.485 -47.926 1.00 0.00 H new ATOM 0 HE1 MET A 20 13.456 -9.851 -43.992 1.00 0.00 H new ATOM 0 HE2 MET A 20 12.437 -9.089 -45.236 1.00 0.00 H new ATOM 0 HE3 MET A 20 13.281 -10.616 -45.589 1.00 0.00 H new ATOM 329 N ALA A 21 11.764 -6.063 -49.890 1.00 0.00 N ATOM 330 CA ALA A 21 10.559 -5.879 -50.714 1.00 0.00 C ATOM 331 C ALA A 21 10.223 -7.206 -51.420 1.00 0.00 C ATOM 332 O ALA A 21 10.613 -7.431 -52.569 1.00 0.00 O ATOM 333 CB ALA A 21 10.748 -4.719 -51.713 1.00 0.00 C ATOM 0 H ALA A 21 12.609 -5.664 -50.298 1.00 0.00 H new ATOM 0 HA ALA A 21 9.717 -5.606 -50.078 1.00 0.00 H new ATOM 0 HB1 ALA A 21 9.844 -4.603 -52.311 1.00 0.00 H new ATOM 0 HB2 ALA A 21 10.943 -3.796 -51.166 1.00 0.00 H new ATOM 0 HB3 ALA A 21 11.591 -4.937 -52.369 1.00 0.00 H new ATOM 339 N SER A 22 9.550 -8.112 -50.681 1.00 0.00 N ATOM 340 CA SER A 22 9.263 -9.490 -51.134 1.00 0.00 C ATOM 341 C SER A 22 7.911 -9.971 -50.573 1.00 0.00 C ATOM 342 O SER A 22 7.558 -9.649 -49.430 1.00 0.00 O ATOM 343 CB SER A 22 10.400 -10.442 -50.676 1.00 0.00 C ATOM 344 OG SER A 22 11.652 -10.045 -51.207 1.00 0.00 O ATOM 0 H SER A 22 9.189 -7.908 -49.749 1.00 0.00 H new ATOM 0 HA SER A 22 9.208 -9.497 -52.223 1.00 0.00 H new ATOM 0 HB2 SER A 22 10.452 -10.452 -49.587 1.00 0.00 H new ATOM 0 HB3 SER A 22 10.175 -11.460 -50.994 1.00 0.00 H new ATOM 0 HG SER A 22 12.348 -10.662 -50.900 1.00 0.00 H new ATOM 350 N GLY A 23 7.173 -10.745 -51.389 1.00 0.00 N ATOM 351 CA GLY A 23 5.884 -11.310 -50.999 1.00 0.00 C ATOM 352 C GLY A 23 5.399 -12.348 -52.007 1.00 0.00 C ATOM 353 O GLY A 23 4.209 -12.393 -52.343 1.00 0.00 O ATOM 0 H GLY A 23 7.460 -10.992 -52.336 1.00 0.00 H new ATOM 0 HA2 GLY A 23 5.970 -11.770 -50.015 1.00 0.00 H new ATOM 0 HA3 GLY A 23 5.147 -10.512 -50.914 1.00 0.00 H new ATOM 357 N SER A 24 6.343 -13.182 -52.492 1.00 0.00 N ATOM 358 CA SER A 24 6.071 -14.244 -53.476 1.00 0.00 C ATOM 359 C SER A 24 5.135 -15.309 -52.875 1.00 0.00 C ATOM 360 O SER A 24 5.365 -15.785 -51.752 1.00 0.00 O ATOM 361 CB SER A 24 7.403 -14.894 -53.915 1.00 0.00 C ATOM 362 OG SER A 24 8.317 -13.918 -54.395 1.00 0.00 O ATOM 0 H SER A 24 7.321 -13.135 -52.208 1.00 0.00 H new ATOM 0 HA SER A 24 5.579 -13.805 -54.344 1.00 0.00 H new ATOM 0 HB2 SER A 24 7.845 -15.427 -53.074 1.00 0.00 H new ATOM 0 HB3 SER A 24 7.211 -15.631 -54.695 1.00 0.00 H new ATOM 0 HG SER A 24 9.151 -14.356 -54.664 1.00 0.00 H new ATOM 368 N GLU A 25 4.083 -15.663 -53.621 1.00 0.00 N ATOM 369 CA GLU A 25 3.093 -16.665 -53.201 1.00 0.00 C ATOM 370 C GLU A 25 2.660 -17.466 -54.441 1.00 0.00 C ATOM 371 O GLU A 25 1.646 -17.161 -55.071 1.00 0.00 O ATOM 372 CB GLU A 25 1.887 -15.967 -52.502 1.00 0.00 C ATOM 373 CG GLU A 25 0.876 -16.922 -51.844 1.00 0.00 C ATOM 374 CD GLU A 25 -0.258 -16.178 -51.121 1.00 0.00 C ATOM 375 OE1 GLU A 25 -1.400 -16.154 -51.637 1.00 0.00 O ATOM 376 OE2 GLU A 25 -0.001 -15.568 -50.052 1.00 0.00 O ATOM 0 H GLU A 25 3.892 -15.261 -54.539 1.00 0.00 H new ATOM 0 HA GLU A 25 3.524 -17.353 -52.474 1.00 0.00 H new ATOM 0 HB2 GLU A 25 2.271 -15.288 -51.741 1.00 0.00 H new ATOM 0 HB3 GLU A 25 1.363 -15.358 -53.238 1.00 0.00 H new ATOM 0 HG2 GLU A 25 0.449 -17.574 -52.606 1.00 0.00 H new ATOM 0 HG3 GLU A 25 1.397 -17.562 -51.132 1.00 0.00 H new ATOM 383 N GLU A 26 3.502 -18.436 -54.831 1.00 0.00 N ATOM 384 CA GLU A 26 3.288 -19.294 -56.010 1.00 0.00 C ATOM 385 C GLU A 26 2.893 -20.705 -55.540 1.00 0.00 C ATOM 386 O GLU A 26 3.608 -21.316 -54.738 1.00 0.00 O ATOM 387 CB GLU A 26 4.575 -19.327 -56.878 1.00 0.00 C ATOM 388 CG GLU A 26 5.028 -17.938 -57.364 1.00 0.00 C ATOM 389 CD GLU A 26 6.251 -17.990 -58.298 1.00 0.00 C ATOM 390 OE1 GLU A 26 6.071 -18.133 -59.533 1.00 0.00 O ATOM 391 OE2 GLU A 26 7.397 -17.894 -57.812 1.00 0.00 O ATOM 0 H GLU A 26 4.364 -18.650 -54.329 1.00 0.00 H new ATOM 0 HA GLU A 26 2.481 -18.894 -56.624 1.00 0.00 H new ATOM 0 HB2 GLU A 26 5.381 -19.781 -56.301 1.00 0.00 H new ATOM 0 HB3 GLU A 26 4.403 -19.967 -57.743 1.00 0.00 H new ATOM 0 HG2 GLU A 26 4.201 -17.455 -57.885 1.00 0.00 H new ATOM 0 HG3 GLU A 26 5.265 -17.318 -56.500 1.00 0.00 H new ATOM 398 N GLU A 27 1.741 -21.202 -56.026 1.00 0.00 N ATOM 399 CA GLU A 27 1.156 -22.479 -55.590 1.00 0.00 C ATOM 400 C GLU A 27 1.885 -23.663 -56.262 1.00 0.00 C ATOM 401 O GLU A 27 1.562 -24.055 -57.389 1.00 0.00 O ATOM 402 CB GLU A 27 -0.373 -22.491 -55.895 1.00 0.00 C ATOM 403 CG GLU A 27 -1.142 -23.674 -55.284 1.00 0.00 C ATOM 404 CD GLU A 27 -0.953 -23.790 -53.759 1.00 0.00 C ATOM 405 OE1 GLU A 27 -1.491 -22.940 -53.008 1.00 0.00 O ATOM 406 OE2 GLU A 27 -0.253 -24.722 -53.303 1.00 0.00 O ATOM 0 H GLU A 27 1.188 -20.724 -56.737 1.00 0.00 H new ATOM 0 HA GLU A 27 1.285 -22.588 -54.513 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -0.810 -21.563 -55.527 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -0.514 -22.503 -56.976 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -2.203 -23.564 -55.506 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -0.812 -24.599 -55.757 1.00 0.00 H new ATOM 413 N VAL A 28 2.912 -24.181 -55.560 1.00 0.00 N ATOM 414 CA VAL A 28 3.776 -25.288 -56.026 1.00 0.00 C ATOM 415 C VAL A 28 3.862 -26.382 -54.937 1.00 0.00 C ATOM 416 O VAL A 28 3.795 -26.083 -53.738 1.00 0.00 O ATOM 417 CB VAL A 28 5.228 -24.773 -56.393 1.00 0.00 C ATOM 418 CG1 VAL A 28 5.202 -23.860 -57.649 1.00 0.00 C ATOM 419 CG2 VAL A 28 5.881 -24.040 -55.189 1.00 0.00 C ATOM 0 H VAL A 28 3.171 -23.836 -54.635 1.00 0.00 H new ATOM 0 HA VAL A 28 3.331 -25.707 -56.928 1.00 0.00 H new ATOM 0 HB VAL A 28 5.838 -25.645 -56.628 1.00 0.00 H new ATOM 0 HG11 VAL A 28 6.214 -23.523 -57.875 1.00 0.00 H new ATOM 0 HG12 VAL A 28 4.808 -24.420 -58.497 1.00 0.00 H new ATOM 0 HG13 VAL A 28 4.566 -22.996 -57.457 1.00 0.00 H new ATOM 0 HG21 VAL A 28 6.877 -23.697 -55.469 1.00 0.00 H new ATOM 0 HG22 VAL A 28 5.268 -23.184 -54.908 1.00 0.00 H new ATOM 0 HG23 VAL A 28 5.957 -24.724 -54.344 1.00 0.00 H new ATOM 429 N VAL A 29 3.995 -27.650 -55.363 1.00 0.00 N ATOM 430 CA VAL A 29 4.124 -28.795 -54.441 1.00 0.00 C ATOM 431 C VAL A 29 5.599 -28.983 -54.022 1.00 0.00 C ATOM 432 O VAL A 29 6.457 -29.327 -54.839 1.00 0.00 O ATOM 433 CB VAL A 29 3.510 -30.125 -55.057 1.00 0.00 C ATOM 434 CG1 VAL A 29 1.974 -29.995 -55.193 1.00 0.00 C ATOM 435 CG2 VAL A 29 4.147 -30.498 -56.426 1.00 0.00 C ATOM 0 H VAL A 29 4.016 -27.910 -56.349 1.00 0.00 H new ATOM 0 HA VAL A 29 3.543 -28.574 -53.546 1.00 0.00 H new ATOM 0 HB VAL A 29 3.744 -30.935 -54.366 1.00 0.00 H new ATOM 0 HG11 VAL A 29 1.567 -30.913 -55.616 1.00 0.00 H new ATOM 0 HG12 VAL A 29 1.535 -29.823 -54.210 1.00 0.00 H new ATOM 0 HG13 VAL A 29 1.736 -29.157 -55.848 1.00 0.00 H new ATOM 0 HG21 VAL A 29 3.691 -31.414 -56.802 1.00 0.00 H new ATOM 0 HG22 VAL A 29 3.978 -29.690 -57.138 1.00 0.00 H new ATOM 0 HG23 VAL A 29 5.219 -30.652 -56.299 1.00 0.00 H new ATOM 445 N SER A 30 5.893 -28.705 -52.739 1.00 0.00 N ATOM 446 CA SER A 30 7.230 -28.875 -52.150 1.00 0.00 C ATOM 447 C SER A 30 7.095 -29.436 -50.723 1.00 0.00 C ATOM 448 O SER A 30 6.386 -28.866 -49.881 1.00 0.00 O ATOM 449 CB SER A 30 7.991 -27.530 -52.140 1.00 0.00 C ATOM 450 OG SER A 30 7.254 -26.522 -51.463 1.00 0.00 O ATOM 0 H SER A 30 5.201 -28.353 -52.077 1.00 0.00 H new ATOM 0 HA SER A 30 7.802 -29.579 -52.754 1.00 0.00 H new ATOM 0 HB2 SER A 30 8.959 -27.662 -51.657 1.00 0.00 H new ATOM 0 HB3 SER A 30 8.187 -27.213 -53.164 1.00 0.00 H new ATOM 0 HG SER A 30 6.685 -26.935 -50.781 1.00 0.00 H new ATOM 456 N VAL A 31 7.754 -30.582 -50.480 1.00 0.00 N ATOM 457 CA VAL A 31 7.777 -31.264 -49.171 1.00 0.00 C ATOM 458 C VAL A 31 9.185 -31.163 -48.566 1.00 0.00 C ATOM 459 O VAL A 31 10.167 -31.550 -49.205 1.00 0.00 O ATOM 460 CB VAL A 31 7.359 -32.781 -49.291 1.00 0.00 C ATOM 461 CG1 VAL A 31 7.321 -33.472 -47.899 1.00 0.00 C ATOM 462 CG2 VAL A 31 6.006 -32.924 -50.029 1.00 0.00 C ATOM 0 H VAL A 31 8.294 -31.069 -51.196 1.00 0.00 H new ATOM 0 HA VAL A 31 7.052 -30.770 -48.523 1.00 0.00 H new ATOM 0 HB VAL A 31 8.119 -33.290 -49.884 1.00 0.00 H new ATOM 0 HG11 VAL A 31 7.030 -34.515 -48.019 1.00 0.00 H new ATOM 0 HG12 VAL A 31 8.309 -33.421 -47.441 1.00 0.00 H new ATOM 0 HG13 VAL A 31 6.598 -32.964 -47.260 1.00 0.00 H new ATOM 0 HG21 VAL A 31 5.739 -33.979 -50.099 1.00 0.00 H new ATOM 0 HG22 VAL A 31 5.232 -32.390 -49.477 1.00 0.00 H new ATOM 0 HG23 VAL A 31 6.092 -32.504 -51.031 1.00 0.00 H new ATOM 472 N GLU A 32 9.277 -30.625 -47.339 1.00 0.00 N ATOM 473 CA GLU A 32 10.546 -30.526 -46.604 1.00 0.00 C ATOM 474 C GLU A 32 10.879 -31.876 -45.931 1.00 0.00 C ATOM 475 O GLU A 32 10.259 -32.266 -44.935 1.00 0.00 O ATOM 476 CB GLU A 32 10.498 -29.367 -45.572 1.00 0.00 C ATOM 477 CG GLU A 32 10.295 -27.975 -46.207 1.00 0.00 C ATOM 478 CD GLU A 32 10.215 -26.825 -45.183 1.00 0.00 C ATOM 479 OE1 GLU A 32 9.259 -26.801 -44.378 1.00 0.00 O ATOM 480 OE2 GLU A 32 11.085 -25.926 -45.190 1.00 0.00 O ATOM 0 H GLU A 32 8.477 -30.248 -46.831 1.00 0.00 H new ATOM 0 HA GLU A 32 11.344 -30.297 -47.310 1.00 0.00 H new ATOM 0 HB2 GLU A 32 9.689 -29.555 -44.866 1.00 0.00 H new ATOM 0 HB3 GLU A 32 11.426 -29.363 -45.000 1.00 0.00 H new ATOM 0 HG2 GLU A 32 11.116 -27.778 -46.896 1.00 0.00 H new ATOM 0 HG3 GLU A 32 9.379 -27.986 -46.798 1.00 0.00 H new ATOM 487 N LEU A 33 11.836 -32.589 -46.543 1.00 0.00 N ATOM 488 CA LEU A 33 12.365 -33.889 -46.061 1.00 0.00 C ATOM 489 C LEU A 33 13.396 -33.664 -44.906 1.00 0.00 C ATOM 490 O LEU A 33 13.862 -32.527 -44.723 1.00 0.00 O ATOM 491 CB LEU A 33 12.981 -34.657 -47.288 1.00 0.00 C ATOM 492 CG LEU A 33 12.003 -35.506 -48.166 1.00 0.00 C ATOM 493 CD1 LEU A 33 11.543 -36.772 -47.429 1.00 0.00 C ATOM 494 CD2 LEU A 33 10.801 -34.682 -48.642 1.00 0.00 C ATOM 0 H LEU A 33 12.279 -32.277 -47.407 1.00 0.00 H new ATOM 0 HA LEU A 33 11.567 -34.500 -45.640 1.00 0.00 H new ATOM 0 HB2 LEU A 33 13.467 -33.926 -47.934 1.00 0.00 H new ATOM 0 HB3 LEU A 33 13.761 -35.320 -46.914 1.00 0.00 H new ATOM 0 HG LEU A 33 12.559 -35.816 -49.051 1.00 0.00 H new ATOM 0 HD11 LEU A 33 10.865 -37.338 -48.067 1.00 0.00 H new ATOM 0 HD12 LEU A 33 12.410 -37.386 -47.185 1.00 0.00 H new ATOM 0 HD13 LEU A 33 11.027 -36.491 -46.511 1.00 0.00 H new ATOM 0 HD21 LEU A 33 10.147 -35.309 -49.248 1.00 0.00 H new ATOM 0 HD22 LEU A 33 10.249 -34.311 -47.778 1.00 0.00 H new ATOM 0 HD23 LEU A 33 11.151 -33.839 -49.238 1.00 0.00 H new ATOM 506 N PRO A 34 13.750 -34.726 -44.081 1.00 0.00 N ATOM 507 CA PRO A 34 14.633 -34.562 -42.886 1.00 0.00 C ATOM 508 C PRO A 34 16.047 -34.015 -43.212 1.00 0.00 C ATOM 509 O PRO A 34 16.632 -34.346 -44.253 1.00 0.00 O ATOM 510 CB PRO A 34 14.696 -35.992 -42.266 1.00 0.00 C ATOM 511 CG PRO A 34 14.319 -36.907 -43.389 1.00 0.00 C ATOM 512 CD PRO A 34 13.296 -36.145 -44.198 1.00 0.00 C ATOM 0 HA PRO A 34 14.231 -33.812 -42.205 1.00 0.00 H new ATOM 0 HB2 PRO A 34 15.694 -36.217 -41.889 1.00 0.00 H new ATOM 0 HB3 PRO A 34 14.008 -36.091 -41.426 1.00 0.00 H new ATOM 0 HG2 PRO A 34 15.188 -37.164 -43.995 1.00 0.00 H new ATOM 0 HG3 PRO A 34 13.905 -37.842 -43.012 1.00 0.00 H new ATOM 0 HD2 PRO A 34 13.277 -36.476 -45.236 1.00 0.00 H new ATOM 0 HD3 PRO A 34 12.289 -36.279 -43.802 1.00 0.00 H new ATOM 520 N ALA A 35 16.583 -33.204 -42.277 1.00 0.00 N ATOM 521 CA ALA A 35 17.834 -32.449 -42.456 1.00 0.00 C ATOM 522 C ALA A 35 18.460 -32.093 -41.092 1.00 0.00 C ATOM 523 O ALA A 35 17.766 -32.156 -40.065 1.00 0.00 O ATOM 524 CB ALA A 35 17.542 -31.154 -43.233 1.00 0.00 C ATOM 0 H ALA A 35 16.151 -33.055 -41.365 1.00 0.00 H new ATOM 0 HA ALA A 35 18.537 -33.070 -43.011 1.00 0.00 H new ATOM 0 HB1 ALA A 35 18.467 -30.593 -43.367 1.00 0.00 H new ATOM 0 HB2 ALA A 35 17.124 -31.402 -44.209 1.00 0.00 H new ATOM 0 HB3 ALA A 35 16.828 -30.548 -42.675 1.00 0.00 H new ATOM 530 N PRO A 36 19.784 -31.710 -41.061 1.00 0.00 N ATOM 531 CA PRO A 36 20.403 -31.028 -39.893 1.00 0.00 C ATOM 532 C PRO A 36 19.604 -29.778 -39.458 1.00 0.00 C ATOM 533 O PRO A 36 19.031 -29.090 -40.304 1.00 0.00 O ATOM 534 CB PRO A 36 21.807 -30.625 -40.416 1.00 0.00 C ATOM 535 CG PRO A 36 22.111 -31.640 -41.470 1.00 0.00 C ATOM 536 CD PRO A 36 20.789 -31.947 -42.137 1.00 0.00 C ATOM 0 HA PRO A 36 20.432 -31.668 -39.011 1.00 0.00 H new ATOM 0 HB2 PRO A 36 21.805 -29.615 -40.825 1.00 0.00 H new ATOM 0 HB3 PRO A 36 22.550 -30.644 -39.618 1.00 0.00 H new ATOM 0 HG2 PRO A 36 22.832 -31.253 -42.190 1.00 0.00 H new ATOM 0 HG3 PRO A 36 22.547 -32.539 -41.034 1.00 0.00 H new ATOM 0 HD2 PRO A 36 20.615 -31.300 -42.997 1.00 0.00 H new ATOM 0 HD3 PRO A 36 20.753 -32.974 -42.499 1.00 0.00 H new ATOM 544 N SER A 37 19.611 -29.485 -38.147 1.00 0.00 N ATOM 545 CA SER A 37 18.842 -28.363 -37.554 1.00 0.00 C ATOM 546 C SER A 37 19.446 -26.985 -37.929 1.00 0.00 C ATOM 547 O SER A 37 18.800 -25.945 -37.748 1.00 0.00 O ATOM 548 CB SER A 37 18.764 -28.544 -36.015 1.00 0.00 C ATOM 549 OG SER A 37 20.056 -28.712 -35.443 1.00 0.00 O ATOM 0 H SER A 37 20.149 -30.016 -37.462 1.00 0.00 H new ATOM 0 HA SER A 37 17.833 -28.382 -37.966 1.00 0.00 H new ATOM 0 HB2 SER A 37 18.278 -27.676 -35.570 1.00 0.00 H new ATOM 0 HB3 SER A 37 18.146 -29.411 -35.780 1.00 0.00 H new ATOM 0 HG SER A 37 19.972 -28.822 -34.473 1.00 0.00 H new ATOM 555 N SER A 38 20.698 -26.992 -38.432 1.00 0.00 N ATOM 556 CA SER A 38 21.358 -25.798 -38.997 1.00 0.00 C ATOM 557 C SER A 38 20.797 -25.494 -40.401 1.00 0.00 C ATOM 558 O SER A 38 20.662 -24.329 -40.795 1.00 0.00 O ATOM 559 CB SER A 38 22.893 -26.029 -39.067 1.00 0.00 C ATOM 560 OG SER A 38 23.585 -24.897 -39.583 1.00 0.00 O ATOM 0 H SER A 38 21.281 -27.829 -38.457 1.00 0.00 H new ATOM 0 HA SER A 38 21.159 -24.942 -38.352 1.00 0.00 H new ATOM 0 HB2 SER A 38 23.270 -26.260 -38.070 1.00 0.00 H new ATOM 0 HB3 SER A 38 23.100 -26.896 -39.694 1.00 0.00 H new ATOM 0 HG SER A 38 24.546 -25.085 -39.608 1.00 0.00 H new ATOM 566 N TRP A 39 20.466 -26.562 -41.141 1.00 0.00 N ATOM 567 CA TRP A 39 20.003 -26.482 -42.543 1.00 0.00 C ATOM 568 C TRP A 39 18.511 -26.838 -42.648 1.00 0.00 C ATOM 569 O TRP A 39 17.797 -26.923 -41.640 1.00 0.00 O ATOM 570 CB TRP A 39 20.841 -27.448 -43.422 1.00 0.00 C ATOM 571 CG TRP A 39 22.225 -26.950 -43.740 1.00 0.00 C ATOM 572 CD1 TRP A 39 23.265 -26.766 -42.877 1.00 0.00 C ATOM 573 CD2 TRP A 39 22.708 -26.575 -45.032 1.00 0.00 C ATOM 574 NE1 TRP A 39 24.361 -26.299 -43.555 1.00 0.00 N ATOM 575 CE2 TRP A 39 24.042 -26.181 -44.878 1.00 0.00 C ATOM 576 CE3 TRP A 39 22.135 -26.538 -46.305 1.00 0.00 C ATOM 577 CZ2 TRP A 39 24.814 -25.761 -45.943 1.00 0.00 C ATOM 578 CZ3 TRP A 39 22.903 -26.117 -47.366 1.00 0.00 C ATOM 579 CH2 TRP A 39 24.234 -25.733 -47.182 1.00 0.00 C ATOM 0 H TRP A 39 20.511 -27.517 -40.784 1.00 0.00 H new ATOM 0 HA TRP A 39 20.135 -25.459 -42.896 1.00 0.00 H new ATOM 0 HB2 TRP A 39 20.921 -28.408 -42.912 1.00 0.00 H new ATOM 0 HB3 TRP A 39 20.308 -27.626 -44.356 1.00 0.00 H new ATOM 0 HD1 TRP A 39 23.230 -26.960 -41.815 1.00 0.00 H new ATOM 0 HE1 TRP A 39 25.266 -26.076 -43.140 1.00 0.00 H new ATOM 0 HE3 TRP A 39 21.107 -26.835 -46.454 1.00 0.00 H new ATOM 0 HZ2 TRP A 39 25.843 -25.464 -45.803 1.00 0.00 H new ATOM 0 HZ3 TRP A 39 22.471 -26.083 -48.355 1.00 0.00 H new ATOM 0 HH2 TRP A 39 24.815 -25.408 -48.033 1.00 0.00 H new ATOM 590 N LYS A 40 18.056 -26.998 -43.895 1.00 0.00 N ATOM 591 CA LYS A 40 16.768 -27.599 -44.218 1.00 0.00 C ATOM 592 C LYS A 40 16.899 -28.322 -45.564 1.00 0.00 C ATOM 593 O LYS A 40 17.640 -27.886 -46.442 1.00 0.00 O ATOM 594 CB LYS A 40 15.631 -26.538 -44.247 1.00 0.00 C ATOM 595 CG LYS A 40 14.185 -27.111 -44.245 1.00 0.00 C ATOM 596 CD LYS A 40 13.601 -27.370 -42.825 1.00 0.00 C ATOM 597 CE LYS A 40 14.351 -28.438 -42.014 1.00 0.00 C ATOM 598 NZ LYS A 40 13.781 -28.624 -40.661 1.00 0.00 N ATOM 0 H LYS A 40 18.584 -26.707 -44.718 1.00 0.00 H new ATOM 0 HA LYS A 40 16.494 -28.315 -43.443 1.00 0.00 H new ATOM 0 HB2 LYS A 40 15.746 -25.883 -43.383 1.00 0.00 H new ATOM 0 HB3 LYS A 40 15.757 -25.919 -45.135 1.00 0.00 H new ATOM 0 HG2 LYS A 40 13.531 -26.417 -44.773 1.00 0.00 H new ATOM 0 HG3 LYS A 40 14.176 -28.046 -44.805 1.00 0.00 H new ATOM 0 HD2 LYS A 40 13.610 -26.434 -42.266 1.00 0.00 H new ATOM 0 HD3 LYS A 40 12.558 -27.672 -42.924 1.00 0.00 H new ATOM 0 HE2 LYS A 40 14.321 -29.386 -42.551 1.00 0.00 H new ATOM 0 HE3 LYS A 40 15.400 -28.154 -41.927 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 14.321 -29.354 -40.154 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 13.833 -27.728 -40.136 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 12.788 -28.921 -40.741 1.00 0.00 H new ATOM 612 N LYS A 41 16.201 -29.446 -45.688 1.00 0.00 N ATOM 613 CA LYS A 41 16.143 -30.250 -46.907 1.00 0.00 C ATOM 614 C LYS A 41 14.728 -30.164 -47.448 1.00 0.00 C ATOM 615 O LYS A 41 13.777 -30.583 -46.802 1.00 0.00 O ATOM 616 CB LYS A 41 16.576 -31.707 -46.589 1.00 0.00 C ATOM 617 CG LYS A 41 16.180 -32.821 -47.587 1.00 0.00 C ATOM 618 CD LYS A 41 16.558 -32.537 -49.052 1.00 0.00 C ATOM 619 CE LYS A 41 16.306 -33.746 -49.964 1.00 0.00 C ATOM 620 NZ LYS A 41 14.961 -34.318 -49.798 1.00 0.00 N ATOM 0 H LYS A 41 15.646 -29.834 -44.926 1.00 0.00 H new ATOM 0 HA LYS A 41 16.829 -29.880 -47.669 1.00 0.00 H new ATOM 0 HB2 LYS A 41 17.662 -31.718 -46.491 1.00 0.00 H new ATOM 0 HB3 LYS A 41 16.165 -31.971 -45.615 1.00 0.00 H new ATOM 0 HG2 LYS A 41 16.654 -33.752 -47.278 1.00 0.00 H new ATOM 0 HG3 LYS A 41 15.103 -32.977 -47.528 1.00 0.00 H new ATOM 0 HD2 LYS A 41 15.983 -31.685 -49.415 1.00 0.00 H new ATOM 0 HD3 LYS A 41 17.610 -32.257 -49.106 1.00 0.00 H new ATOM 0 HE2 LYS A 41 16.442 -33.446 -51.003 1.00 0.00 H new ATOM 0 HE3 LYS A 41 17.050 -34.514 -49.754 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 14.650 -34.740 -50.696 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 14.984 -35.051 -49.060 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 14.297 -33.568 -49.520 1.00 0.00 H new ATOM 634 N LEU A 42 14.620 -29.573 -48.622 1.00 0.00 N ATOM 635 CA LEU A 42 13.387 -29.475 -49.384 1.00 0.00 C ATOM 636 C LEU A 42 13.525 -30.352 -50.638 1.00 0.00 C ATOM 637 O LEU A 42 14.588 -30.420 -51.266 1.00 0.00 O ATOM 638 CB LEU A 42 13.096 -27.975 -49.715 1.00 0.00 C ATOM 639 CG LEU A 42 11.871 -27.656 -50.654 1.00 0.00 C ATOM 640 CD1 LEU A 42 11.229 -26.285 -50.325 1.00 0.00 C ATOM 641 CD2 LEU A 42 12.278 -27.692 -52.138 1.00 0.00 C ATOM 0 H LEU A 42 15.413 -29.133 -49.088 1.00 0.00 H new ATOM 0 HA LEU A 42 12.533 -29.839 -48.813 1.00 0.00 H new ATOM 0 HB2 LEU A 42 12.943 -27.447 -48.774 1.00 0.00 H new ATOM 0 HB3 LEU A 42 13.990 -27.554 -50.175 1.00 0.00 H new ATOM 0 HG LEU A 42 11.130 -28.434 -50.470 1.00 0.00 H new ATOM 0 HD11 LEU A 42 10.389 -26.106 -50.996 1.00 0.00 H new ATOM 0 HD12 LEU A 42 10.876 -26.287 -49.294 1.00 0.00 H new ATOM 0 HD13 LEU A 42 11.970 -25.496 -50.453 1.00 0.00 H new ATOM 0 HD21 LEU A 42 11.411 -27.468 -52.759 1.00 0.00 H new ATOM 0 HD22 LEU A 42 13.056 -26.950 -52.320 1.00 0.00 H new ATOM 0 HD23 LEU A 42 12.656 -28.683 -52.388 1.00 0.00 H new ATOM 653 N PHE A 43 12.441 -31.041 -50.969 1.00 0.00 N ATOM 654 CA PHE A 43 12.298 -31.826 -52.193 1.00 0.00 C ATOM 655 C PHE A 43 11.030 -31.351 -52.912 1.00 0.00 C ATOM 656 O PHE A 43 10.009 -31.113 -52.270 1.00 0.00 O ATOM 657 CB PHE A 43 12.219 -33.334 -51.834 1.00 0.00 C ATOM 658 CG PHE A 43 11.857 -34.265 -52.993 1.00 0.00 C ATOM 659 CD1 PHE A 43 12.667 -34.362 -54.126 1.00 0.00 C ATOM 660 CD2 PHE A 43 10.696 -35.046 -52.948 1.00 0.00 C ATOM 661 CE1 PHE A 43 12.329 -35.204 -55.171 1.00 0.00 C ATOM 662 CE2 PHE A 43 10.363 -35.888 -53.993 1.00 0.00 C ATOM 663 CZ PHE A 43 11.176 -35.965 -55.105 1.00 0.00 C ATOM 0 H PHE A 43 11.611 -31.071 -50.377 1.00 0.00 H new ATOM 0 HA PHE A 43 13.155 -31.689 -52.852 1.00 0.00 H new ATOM 0 HB2 PHE A 43 13.182 -33.645 -51.428 1.00 0.00 H new ATOM 0 HB3 PHE A 43 11.482 -33.464 -51.042 1.00 0.00 H new ATOM 0 HD1 PHE A 43 13.569 -33.772 -54.188 1.00 0.00 H new ATOM 0 HD2 PHE A 43 10.051 -34.990 -52.084 1.00 0.00 H new ATOM 0 HE1 PHE A 43 12.967 -35.267 -56.040 1.00 0.00 H new ATOM 0 HE2 PHE A 43 9.465 -36.486 -53.939 1.00 0.00 H new ATOM 0 HZ PHE A 43 10.912 -36.619 -55.923 1.00 0.00 H new ATOM 673 N TYR A 44 11.125 -31.164 -54.232 1.00 0.00 N ATOM 674 CA TYR A 44 9.963 -30.860 -55.084 1.00 0.00 C ATOM 675 C TYR A 44 9.406 -32.175 -55.687 1.00 0.00 C ATOM 676 O TYR A 44 10.015 -32.735 -56.607 1.00 0.00 O ATOM 677 CB TYR A 44 10.351 -29.847 -56.206 1.00 0.00 C ATOM 678 CG TYR A 44 10.137 -28.366 -55.852 1.00 0.00 C ATOM 679 CD1 TYR A 44 11.174 -27.571 -55.370 1.00 0.00 C ATOM 680 CD2 TYR A 44 8.878 -27.775 -55.983 1.00 0.00 C ATOM 681 CE1 TYR A 44 10.961 -26.247 -55.024 1.00 0.00 C ATOM 682 CE2 TYR A 44 8.666 -26.455 -55.646 1.00 0.00 C ATOM 683 CZ TYR A 44 9.705 -25.697 -55.162 1.00 0.00 C ATOM 684 OH TYR A 44 9.487 -24.382 -54.805 1.00 0.00 O ATOM 0 H TYR A 44 12.006 -31.218 -54.743 1.00 0.00 H new ATOM 0 HA TYR A 44 9.186 -30.395 -54.477 1.00 0.00 H new ATOM 0 HB2 TYR A 44 11.400 -29.995 -56.461 1.00 0.00 H new ATOM 0 HB3 TYR A 44 9.771 -30.078 -57.099 1.00 0.00 H new ATOM 0 HD1 TYR A 44 12.162 -27.995 -55.264 1.00 0.00 H new ATOM 0 HD2 TYR A 44 8.053 -28.364 -56.356 1.00 0.00 H new ATOM 0 HE1 TYR A 44 11.777 -25.648 -54.647 1.00 0.00 H new ATOM 0 HE2 TYR A 44 7.685 -26.018 -55.762 1.00 0.00 H new ATOM 0 HH TYR A 44 10.310 -23.866 -54.937 1.00 0.00 H new ATOM 694 N PRO A 45 8.265 -32.722 -55.151 1.00 0.00 N ATOM 695 CA PRO A 45 7.569 -33.884 -55.752 1.00 0.00 C ATOM 696 C PRO A 45 6.647 -33.461 -56.914 1.00 0.00 C ATOM 697 O PRO A 45 6.781 -32.359 -57.465 1.00 0.00 O ATOM 698 CB PRO A 45 6.776 -34.445 -54.546 1.00 0.00 C ATOM 699 CG PRO A 45 6.385 -33.221 -53.785 1.00 0.00 C ATOM 700 CD PRO A 45 7.575 -32.283 -53.907 1.00 0.00 C ATOM 0 HA PRO A 45 8.240 -34.614 -56.204 1.00 0.00 H new ATOM 0 HB2 PRO A 45 5.903 -35.013 -54.869 1.00 0.00 H new ATOM 0 HB3 PRO A 45 7.387 -35.116 -53.941 1.00 0.00 H new ATOM 0 HG2 PRO A 45 5.483 -32.770 -54.200 1.00 0.00 H new ATOM 0 HG3 PRO A 45 6.173 -33.456 -52.742 1.00 0.00 H new ATOM 0 HD2 PRO A 45 7.256 -31.243 -53.975 1.00 0.00 H new ATOM 0 HD3 PRO A 45 8.232 -32.359 -53.040 1.00 0.00 H new ATOM 708 N ASN A 46 5.731 -34.364 -57.287 1.00 0.00 N ATOM 709 CA ASN A 46 4.753 -34.143 -58.367 1.00 0.00 C ATOM 710 C ASN A 46 3.653 -35.226 -58.316 1.00 0.00 C ATOM 711 O ASN A 46 3.717 -36.150 -57.492 1.00 0.00 O ATOM 712 CB ASN A 46 5.451 -34.116 -59.758 1.00 0.00 C ATOM 713 CG ASN A 46 6.299 -35.356 -60.038 1.00 0.00 C ATOM 714 OD1 ASN A 46 5.807 -36.358 -60.551 1.00 0.00 O ATOM 715 ND2 ASN A 46 7.583 -35.285 -59.709 1.00 0.00 N ATOM 0 H ASN A 46 5.645 -35.279 -56.845 1.00 0.00 H new ATOM 0 HA ASN A 46 4.286 -33.169 -58.218 1.00 0.00 H new ATOM 0 HB2 ASN A 46 4.692 -34.021 -60.535 1.00 0.00 H new ATOM 0 HB3 ASN A 46 6.084 -33.231 -59.821 1.00 0.00 H new ATOM 0 HD21 ASN A 46 8.198 -36.080 -59.881 1.00 0.00 H new ATOM 0 HD22 ASN A 46 7.954 -34.435 -59.285 1.00 0.00 H new ATOM 722 N LYS A 47 2.657 -35.110 -59.215 1.00 0.00 N ATOM 723 CA LYS A 47 1.455 -35.973 -59.216 1.00 0.00 C ATOM 724 C LYS A 47 1.727 -37.355 -59.840 1.00 0.00 C ATOM 725 O LYS A 47 1.407 -38.387 -59.236 1.00 0.00 O ATOM 726 CB LYS A 47 0.299 -35.274 -59.970 1.00 0.00 C ATOM 727 CG LYS A 47 -0.155 -33.940 -59.345 1.00 0.00 C ATOM 728 CD LYS A 47 -1.394 -33.351 -60.051 1.00 0.00 C ATOM 729 CE LYS A 47 -2.613 -34.301 -60.009 1.00 0.00 C ATOM 730 NZ LYS A 47 -3.795 -33.720 -60.691 1.00 0.00 N ATOM 0 H LYS A 47 2.661 -34.416 -59.962 1.00 0.00 H new ATOM 0 HA LYS A 47 1.173 -36.134 -58.175 1.00 0.00 H new ATOM 0 HB2 LYS A 47 0.610 -35.092 -60.999 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -0.554 -35.951 -60.010 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -0.381 -34.094 -58.290 1.00 0.00 H new ATOM 0 HG3 LYS A 47 0.663 -33.222 -59.394 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -1.660 -32.405 -59.580 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -1.145 -33.131 -61.089 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -2.351 -35.248 -60.481 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -2.865 -34.521 -58.972 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -4.589 -34.389 -60.639 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -4.062 -32.829 -60.225 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -3.564 -33.533 -61.688 1.00 0.00 H new ATOM 744 N VAL A 48 2.316 -37.356 -61.053 1.00 0.00 N ATOM 745 CA VAL A 48 2.559 -38.593 -61.835 1.00 0.00 C ATOM 746 C VAL A 48 3.535 -39.540 -61.096 1.00 0.00 C ATOM 747 O VAL A 48 3.358 -40.767 -61.096 1.00 0.00 O ATOM 748 CB VAL A 48 3.113 -38.254 -63.268 1.00 0.00 C ATOM 749 CG1 VAL A 48 3.424 -39.529 -64.098 1.00 0.00 C ATOM 750 CG2 VAL A 48 2.137 -37.318 -64.025 1.00 0.00 C ATOM 0 H VAL A 48 2.636 -36.507 -61.519 1.00 0.00 H new ATOM 0 HA VAL A 48 1.602 -39.104 -61.945 1.00 0.00 H new ATOM 0 HB VAL A 48 4.059 -37.730 -63.132 1.00 0.00 H new ATOM 0 HG11 VAL A 48 3.803 -39.241 -65.078 1.00 0.00 H new ATOM 0 HG12 VAL A 48 4.174 -40.127 -63.580 1.00 0.00 H new ATOM 0 HG13 VAL A 48 2.513 -40.115 -64.219 1.00 0.00 H new ATOM 0 HG21 VAL A 48 2.539 -37.096 -65.014 1.00 0.00 H new ATOM 0 HG22 VAL A 48 1.169 -37.809 -64.129 1.00 0.00 H new ATOM 0 HG23 VAL A 48 2.015 -36.390 -63.466 1.00 0.00 H new ATOM 760 N GLY A 49 4.561 -38.945 -60.466 1.00 0.00 N ATOM 761 CA GLY A 49 5.575 -39.694 -59.714 1.00 0.00 C ATOM 762 C GLY A 49 6.770 -40.083 -60.578 1.00 0.00 C ATOM 763 O GLY A 49 7.923 -39.849 -60.201 1.00 0.00 O ATOM 0 H GLY A 49 4.709 -37.936 -60.465 1.00 0.00 H new ATOM 0 HA2 GLY A 49 5.919 -39.091 -58.873 1.00 0.00 H new ATOM 0 HA3 GLY A 49 5.123 -40.594 -59.297 1.00 0.00 H new ATOM 767 N SER A 50 6.476 -40.694 -61.742 1.00 0.00 N ATOM 768 CA SER A 50 7.501 -41.157 -62.701 1.00 0.00 C ATOM 769 C SER A 50 8.250 -39.980 -63.356 1.00 0.00 C ATOM 770 O SER A 50 9.442 -40.094 -63.673 1.00 0.00 O ATOM 771 CB SER A 50 6.851 -42.054 -63.776 1.00 0.00 C ATOM 772 OG SER A 50 6.155 -43.146 -63.179 1.00 0.00 O ATOM 0 H SER A 50 5.520 -40.881 -62.045 1.00 0.00 H new ATOM 0 HA SER A 50 8.238 -41.738 -62.147 1.00 0.00 H new ATOM 0 HB2 SER A 50 6.160 -41.464 -64.378 1.00 0.00 H new ATOM 0 HB3 SER A 50 7.618 -42.433 -64.451 1.00 0.00 H new ATOM 0 HG SER A 50 5.751 -43.699 -63.880 1.00 0.00 H new ATOM 778 N VAL A 51 7.545 -38.849 -63.559 1.00 0.00 N ATOM 779 CA VAL A 51 8.164 -37.623 -64.080 1.00 0.00 C ATOM 780 C VAL A 51 8.946 -36.920 -62.956 1.00 0.00 C ATOM 781 O VAL A 51 8.552 -36.972 -61.782 1.00 0.00 O ATOM 782 CB VAL A 51 7.112 -36.641 -64.733 1.00 0.00 C ATOM 783 CG1 VAL A 51 6.341 -37.339 -65.880 1.00 0.00 C ATOM 784 CG2 VAL A 51 6.133 -36.036 -63.699 1.00 0.00 C ATOM 0 H VAL A 51 6.547 -38.764 -63.369 1.00 0.00 H new ATOM 0 HA VAL A 51 8.850 -37.912 -64.876 1.00 0.00 H new ATOM 0 HB VAL A 51 7.680 -35.809 -65.149 1.00 0.00 H new ATOM 0 HG11 VAL A 51 5.623 -36.642 -66.313 1.00 0.00 H new ATOM 0 HG12 VAL A 51 7.044 -37.660 -66.649 1.00 0.00 H new ATOM 0 HG13 VAL A 51 5.812 -38.207 -65.487 1.00 0.00 H new ATOM 0 HG21 VAL A 51 5.434 -35.370 -64.206 1.00 0.00 H new ATOM 0 HG22 VAL A 51 5.580 -36.838 -63.209 1.00 0.00 H new ATOM 0 HG23 VAL A 51 6.694 -35.474 -62.953 1.00 0.00 H new ATOM 794 N LYS A 52 10.079 -36.312 -63.315 1.00 0.00 N ATOM 795 CA LYS A 52 10.929 -35.559 -62.380 1.00 0.00 C ATOM 796 C LYS A 52 10.813 -34.069 -62.742 1.00 0.00 C ATOM 797 O LYS A 52 11.563 -33.563 -63.580 1.00 0.00 O ATOM 798 CB LYS A 52 12.395 -36.080 -62.468 1.00 0.00 C ATOM 799 CG LYS A 52 13.370 -35.475 -61.433 1.00 0.00 C ATOM 800 CD LYS A 52 14.793 -36.057 -61.567 1.00 0.00 C ATOM 801 CE LYS A 52 15.799 -35.453 -60.577 1.00 0.00 C ATOM 802 NZ LYS A 52 17.150 -36.049 -60.750 1.00 0.00 N ATOM 0 H LYS A 52 10.438 -36.327 -64.270 1.00 0.00 H new ATOM 0 HA LYS A 52 10.609 -35.696 -61.347 1.00 0.00 H new ATOM 0 HB2 LYS A 52 12.387 -37.163 -62.346 1.00 0.00 H new ATOM 0 HB3 LYS A 52 12.778 -35.874 -63.468 1.00 0.00 H new ATOM 0 HG2 LYS A 52 13.408 -34.393 -61.560 1.00 0.00 H new ATOM 0 HG3 LYS A 52 12.994 -35.665 -60.428 1.00 0.00 H new ATOM 0 HD2 LYS A 52 14.751 -37.136 -61.417 1.00 0.00 H new ATOM 0 HD3 LYS A 52 15.151 -35.890 -62.583 1.00 0.00 H new ATOM 0 HE2 LYS A 52 15.853 -34.374 -60.723 1.00 0.00 H new ATOM 0 HE3 LYS A 52 15.453 -35.620 -59.557 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 17.808 -35.621 -60.068 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 17.100 -37.075 -60.587 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 17.488 -35.868 -61.717 1.00 0.00 H new ATOM 816 N LYS A 53 9.814 -33.392 -62.138 1.00 0.00 N ATOM 817 CA LYS A 53 9.435 -32.006 -62.495 1.00 0.00 C ATOM 818 C LYS A 53 10.574 -31.026 -62.100 1.00 0.00 C ATOM 819 O LYS A 53 11.245 -30.450 -62.968 1.00 0.00 O ATOM 820 CB LYS A 53 8.062 -31.651 -61.811 1.00 0.00 C ATOM 821 CG LYS A 53 7.237 -30.500 -62.460 1.00 0.00 C ATOM 822 CD LYS A 53 7.883 -29.099 -62.314 1.00 0.00 C ATOM 823 CE LYS A 53 7.053 -27.973 -62.952 1.00 0.00 C ATOM 824 NZ LYS A 53 7.730 -26.651 -62.844 1.00 0.00 N ATOM 0 H LYS A 53 9.247 -33.789 -61.389 1.00 0.00 H new ATOM 0 HA LYS A 53 9.299 -31.913 -63.573 1.00 0.00 H new ATOM 0 HB2 LYS A 53 7.444 -32.549 -61.800 1.00 0.00 H new ATOM 0 HB3 LYS A 53 8.257 -31.386 -60.772 1.00 0.00 H new ATOM 0 HG2 LYS A 53 7.101 -30.717 -63.519 1.00 0.00 H new ATOM 0 HG3 LYS A 53 6.245 -30.480 -62.009 1.00 0.00 H new ATOM 0 HD2 LYS A 53 8.024 -28.881 -61.255 1.00 0.00 H new ATOM 0 HD3 LYS A 53 8.873 -29.114 -62.771 1.00 0.00 H new ATOM 0 HE2 LYS A 53 6.875 -28.204 -64.002 1.00 0.00 H new ATOM 0 HE3 LYS A 53 6.078 -27.922 -62.467 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 7.137 -25.920 -63.286 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 7.877 -26.417 -61.841 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 8.649 -26.691 -63.329 1.00 0.00 H new ATOM 838 N THR A 54 10.789 -30.872 -60.785 1.00 0.00 N ATOM 839 CA THR A 54 11.820 -29.981 -60.224 1.00 0.00 C ATOM 840 C THR A 54 12.665 -30.778 -59.205 1.00 0.00 C ATOM 841 O THR A 54 12.161 -31.715 -58.570 1.00 0.00 O ATOM 842 CB THR A 54 11.160 -28.715 -59.575 1.00 0.00 C ATOM 843 OG1 THR A 54 10.367 -28.036 -60.559 1.00 0.00 O ATOM 844 CG2 THR A 54 12.187 -27.722 -59.000 1.00 0.00 C ATOM 0 H THR A 54 10.249 -31.365 -60.074 1.00 0.00 H new ATOM 0 HA THR A 54 12.477 -29.623 -61.017 1.00 0.00 H new ATOM 0 HB THR A 54 10.549 -29.070 -58.745 1.00 0.00 H new ATOM 0 HG1 THR A 54 9.952 -27.245 -60.156 1.00 0.00 H new ATOM 0 HG21 THR A 54 11.665 -26.869 -58.566 1.00 0.00 H new ATOM 0 HG22 THR A 54 12.779 -28.216 -58.229 1.00 0.00 H new ATOM 0 HG23 THR A 54 12.845 -27.377 -59.797 1.00 0.00 H new ATOM 852 N GLU A 55 13.950 -30.404 -59.079 1.00 0.00 N ATOM 853 CA GLU A 55 14.946 -31.143 -58.281 1.00 0.00 C ATOM 854 C GLU A 55 14.907 -30.741 -56.780 1.00 0.00 C ATOM 855 O GLU A 55 13.993 -30.046 -56.317 1.00 0.00 O ATOM 856 CB GLU A 55 16.380 -30.929 -58.881 1.00 0.00 C ATOM 857 CG GLU A 55 16.901 -29.464 -58.893 1.00 0.00 C ATOM 858 CD GLU A 55 16.479 -28.649 -60.129 1.00 0.00 C ATOM 859 OE1 GLU A 55 17.178 -28.722 -61.161 1.00 0.00 O ATOM 860 OE2 GLU A 55 15.456 -27.930 -60.074 1.00 0.00 O ATOM 0 H GLU A 55 14.331 -29.573 -59.532 1.00 0.00 H new ATOM 0 HA GLU A 55 14.694 -32.202 -58.331 1.00 0.00 H new ATOM 0 HB2 GLU A 55 17.084 -31.540 -58.315 1.00 0.00 H new ATOM 0 HB3 GLU A 55 16.384 -31.304 -59.905 1.00 0.00 H new ATOM 0 HG2 GLU A 55 16.542 -28.956 -57.998 1.00 0.00 H new ATOM 0 HG3 GLU A 55 17.989 -29.478 -58.836 1.00 0.00 H new ATOM 867 N VAL A 56 15.936 -31.202 -56.044 1.00 0.00 N ATOM 868 CA VAL A 56 16.110 -30.970 -54.602 1.00 0.00 C ATOM 869 C VAL A 56 16.751 -29.594 -54.349 1.00 0.00 C ATOM 870 O VAL A 56 17.660 -29.183 -55.074 1.00 0.00 O ATOM 871 CB VAL A 56 17.031 -32.096 -53.991 1.00 0.00 C ATOM 872 CG1 VAL A 56 17.489 -31.756 -52.554 1.00 0.00 C ATOM 873 CG2 VAL A 56 16.330 -33.480 -54.046 1.00 0.00 C ATOM 0 H VAL A 56 16.688 -31.760 -56.449 1.00 0.00 H new ATOM 0 HA VAL A 56 15.130 -30.995 -54.126 1.00 0.00 H new ATOM 0 HB VAL A 56 17.929 -32.147 -54.607 1.00 0.00 H new ATOM 0 HG11 VAL A 56 18.121 -32.559 -52.174 1.00 0.00 H new ATOM 0 HG12 VAL A 56 18.054 -30.824 -52.563 1.00 0.00 H new ATOM 0 HG13 VAL A 56 16.616 -31.645 -51.911 1.00 0.00 H new ATOM 0 HG21 VAL A 56 16.987 -34.238 -53.619 1.00 0.00 H new ATOM 0 HG22 VAL A 56 15.402 -33.441 -53.476 1.00 0.00 H new ATOM 0 HG23 VAL A 56 16.108 -33.735 -55.082 1.00 0.00 H new ATOM 883 N VAL A 57 16.261 -28.903 -53.304 1.00 0.00 N ATOM 884 CA VAL A 57 16.834 -27.641 -52.808 1.00 0.00 C ATOM 885 C VAL A 57 17.177 -27.797 -51.312 1.00 0.00 C ATOM 886 O VAL A 57 16.354 -28.277 -50.540 1.00 0.00 O ATOM 887 CB VAL A 57 15.827 -26.437 -52.991 1.00 0.00 C ATOM 888 CG1 VAL A 57 16.414 -25.108 -52.450 1.00 0.00 C ATOM 889 CG2 VAL A 57 15.377 -26.293 -54.470 1.00 0.00 C ATOM 0 H VAL A 57 15.445 -29.210 -52.774 1.00 0.00 H new ATOM 0 HA VAL A 57 17.732 -27.422 -53.385 1.00 0.00 H new ATOM 0 HB VAL A 57 14.942 -26.666 -52.397 1.00 0.00 H new ATOM 0 HG11 VAL A 57 15.691 -24.305 -52.595 1.00 0.00 H new ATOM 0 HG12 VAL A 57 16.632 -25.213 -51.387 1.00 0.00 H new ATOM 0 HG13 VAL A 57 17.332 -24.870 -52.987 1.00 0.00 H new ATOM 0 HG21 VAL A 57 14.685 -25.456 -54.560 1.00 0.00 H new ATOM 0 HG22 VAL A 57 16.248 -26.113 -55.100 1.00 0.00 H new ATOM 0 HG23 VAL A 57 14.881 -27.209 -54.790 1.00 0.00 H new ATOM 899 N PHE A 58 18.399 -27.418 -50.916 1.00 0.00 N ATOM 900 CA PHE A 58 18.799 -27.334 -49.498 1.00 0.00 C ATOM 901 C PHE A 58 18.782 -25.871 -49.048 1.00 0.00 C ATOM 902 O PHE A 58 19.470 -25.044 -49.623 1.00 0.00 O ATOM 903 CB PHE A 58 20.208 -27.952 -49.275 1.00 0.00 C ATOM 904 CG PHE A 58 20.191 -29.446 -48.988 1.00 0.00 C ATOM 905 CD1 PHE A 58 20.215 -30.377 -50.017 1.00 0.00 C ATOM 906 CD2 PHE A 58 20.141 -29.913 -47.673 1.00 0.00 C ATOM 907 CE1 PHE A 58 20.194 -31.728 -49.744 1.00 0.00 C ATOM 908 CE2 PHE A 58 20.118 -31.265 -47.402 1.00 0.00 C ATOM 909 CZ PHE A 58 20.145 -32.171 -48.438 1.00 0.00 C ATOM 0 H PHE A 58 19.141 -27.160 -51.567 1.00 0.00 H new ATOM 0 HA PHE A 58 18.088 -27.905 -48.901 1.00 0.00 H new ATOM 0 HB2 PHE A 58 20.818 -27.770 -50.160 1.00 0.00 H new ATOM 0 HB3 PHE A 58 20.691 -27.438 -48.444 1.00 0.00 H new ATOM 0 HD1 PHE A 58 20.250 -30.039 -51.042 1.00 0.00 H new ATOM 0 HD2 PHE A 58 20.120 -29.206 -46.857 1.00 0.00 H new ATOM 0 HE1 PHE A 58 20.216 -32.442 -50.554 1.00 0.00 H new ATOM 0 HE2 PHE A 58 20.079 -31.612 -46.380 1.00 0.00 H new ATOM 0 HZ PHE A 58 20.128 -33.230 -48.228 1.00 0.00 H new ATOM 919 N VAL A 59 17.995 -25.565 -48.009 1.00 0.00 N ATOM 920 CA VAL A 59 17.992 -24.234 -47.378 1.00 0.00 C ATOM 921 C VAL A 59 19.171 -24.127 -46.401 1.00 0.00 C ATOM 922 O VAL A 59 19.388 -25.014 -45.570 1.00 0.00 O ATOM 923 CB VAL A 59 16.613 -23.936 -46.672 1.00 0.00 C ATOM 924 CG1 VAL A 59 16.716 -22.852 -45.562 1.00 0.00 C ATOM 925 CG2 VAL A 59 15.548 -23.542 -47.722 1.00 0.00 C ATOM 0 H VAL A 59 17.346 -26.226 -47.583 1.00 0.00 H new ATOM 0 HA VAL A 59 18.114 -23.474 -48.150 1.00 0.00 H new ATOM 0 HB VAL A 59 16.309 -24.857 -46.174 1.00 0.00 H new ATOM 0 HG11 VAL A 59 15.734 -22.694 -45.116 1.00 0.00 H new ATOM 0 HG12 VAL A 59 17.415 -23.183 -44.794 1.00 0.00 H new ATOM 0 HG13 VAL A 59 17.072 -21.918 -45.997 1.00 0.00 H new ATOM 0 HG21 VAL A 59 14.601 -23.339 -47.221 1.00 0.00 H new ATOM 0 HG22 VAL A 59 15.875 -22.649 -48.255 1.00 0.00 H new ATOM 0 HG23 VAL A 59 15.416 -24.360 -48.431 1.00 0.00 H new ATOM 935 N ALA A 60 19.924 -23.029 -46.538 1.00 0.00 N ATOM 936 CA ALA A 60 21.149 -22.763 -45.762 1.00 0.00 C ATOM 937 C ALA A 60 20.835 -21.889 -44.524 1.00 0.00 C ATOM 938 O ALA A 60 19.865 -21.120 -44.549 1.00 0.00 O ATOM 939 CB ALA A 60 22.190 -22.093 -46.676 1.00 0.00 C ATOM 0 H ALA A 60 19.699 -22.287 -47.200 1.00 0.00 H new ATOM 0 HA ALA A 60 21.559 -23.704 -45.394 1.00 0.00 H new ATOM 0 HB1 ALA A 60 23.099 -21.894 -46.108 1.00 0.00 H new ATOM 0 HB2 ALA A 60 22.422 -22.755 -47.510 1.00 0.00 H new ATOM 0 HB3 ALA A 60 21.788 -21.155 -47.059 1.00 0.00 H new ATOM 945 N PRO A 61 21.685 -21.951 -43.438 1.00 0.00 N ATOM 946 CA PRO A 61 21.444 -21.194 -42.166 1.00 0.00 C ATOM 947 C PRO A 61 21.530 -19.655 -42.317 1.00 0.00 C ATOM 948 O PRO A 61 21.208 -18.909 -41.380 1.00 0.00 O ATOM 949 CB PRO A 61 22.568 -21.727 -41.230 1.00 0.00 C ATOM 950 CG PRO A 61 23.654 -22.167 -42.164 1.00 0.00 C ATOM 951 CD PRO A 61 22.932 -22.775 -43.342 1.00 0.00 C ATOM 0 HA PRO A 61 20.432 -21.352 -41.794 1.00 0.00 H new ATOM 0 HB2 PRO A 61 22.919 -20.951 -40.550 1.00 0.00 H new ATOM 0 HB3 PRO A 61 22.214 -22.554 -40.615 1.00 0.00 H new ATOM 0 HG2 PRO A 61 24.274 -21.326 -42.473 1.00 0.00 H new ATOM 0 HG3 PRO A 61 24.314 -22.892 -41.688 1.00 0.00 H new ATOM 0 HD2 PRO A 61 23.526 -22.715 -44.254 1.00 0.00 H new ATOM 0 HD3 PRO A 61 22.707 -23.829 -43.177 1.00 0.00 H new ATOM 959 N THR A 62 21.969 -19.197 -43.496 1.00 0.00 N ATOM 960 CA THR A 62 22.212 -17.762 -43.780 1.00 0.00 C ATOM 961 C THR A 62 21.348 -17.266 -44.967 1.00 0.00 C ATOM 962 O THR A 62 21.588 -16.182 -45.506 1.00 0.00 O ATOM 963 CB THR A 62 23.742 -17.542 -44.064 1.00 0.00 C ATOM 964 OG1 THR A 62 24.055 -16.160 -44.304 1.00 0.00 O ATOM 965 CG2 THR A 62 24.217 -18.368 -45.262 1.00 0.00 C ATOM 0 H THR A 62 22.169 -19.807 -44.288 1.00 0.00 H new ATOM 0 HA THR A 62 21.921 -17.176 -42.908 1.00 0.00 H new ATOM 0 HB THR A 62 24.263 -17.872 -43.165 1.00 0.00 H new ATOM 0 HG1 THR A 62 23.353 -15.757 -44.857 1.00 0.00 H new ATOM 0 HG21 THR A 62 25.279 -18.190 -45.428 1.00 0.00 H new ATOM 0 HG22 THR A 62 24.053 -19.427 -45.062 1.00 0.00 H new ATOM 0 HG23 THR A 62 23.657 -18.076 -46.150 1.00 0.00 H new ATOM 973 N GLY A 63 20.349 -18.080 -45.379 1.00 0.00 N ATOM 974 CA GLY A 63 19.437 -17.732 -46.488 1.00 0.00 C ATOM 975 C GLY A 63 20.007 -17.994 -47.887 1.00 0.00 C ATOM 976 O GLY A 63 19.247 -18.142 -48.853 1.00 0.00 O ATOM 0 H GLY A 63 20.155 -18.987 -44.956 1.00 0.00 H new ATOM 0 HA2 GLY A 63 18.514 -18.300 -46.374 1.00 0.00 H new ATOM 0 HA3 GLY A 63 19.175 -16.677 -46.408 1.00 0.00 H new ATOM 980 N GLU A 64 21.347 -18.038 -47.991 1.00 0.00 N ATOM 981 CA GLU A 64 22.078 -18.326 -49.234 1.00 0.00 C ATOM 982 C GLU A 64 21.940 -19.830 -49.578 1.00 0.00 C ATOM 983 O GLU A 64 22.862 -20.629 -49.365 1.00 0.00 O ATOM 984 CB GLU A 64 23.559 -17.891 -49.035 1.00 0.00 C ATOM 985 CG GLU A 64 24.509 -18.100 -50.233 1.00 0.00 C ATOM 986 CD GLU A 64 25.960 -17.671 -49.930 1.00 0.00 C ATOM 987 OE1 GLU A 64 26.594 -17.005 -50.777 1.00 0.00 O ATOM 988 OE2 GLU A 64 26.464 -17.989 -48.833 1.00 0.00 O ATOM 0 H GLU A 64 21.963 -17.871 -47.196 1.00 0.00 H new ATOM 0 HA GLU A 64 21.668 -17.770 -50.077 1.00 0.00 H new ATOM 0 HB2 GLU A 64 23.571 -16.833 -48.772 1.00 0.00 H new ATOM 0 HB3 GLU A 64 23.962 -18.436 -48.182 1.00 0.00 H new ATOM 0 HG2 GLU A 64 24.499 -19.152 -50.519 1.00 0.00 H new ATOM 0 HG3 GLU A 64 24.139 -17.533 -51.087 1.00 0.00 H new ATOM 995 N GLU A 65 20.745 -20.199 -50.071 1.00 0.00 N ATOM 996 CA GLU A 65 20.331 -21.606 -50.235 1.00 0.00 C ATOM 997 C GLU A 65 20.907 -22.221 -51.516 1.00 0.00 C ATOM 998 O GLU A 65 21.268 -21.516 -52.464 1.00 0.00 O ATOM 999 CB GLU A 65 18.787 -21.713 -50.209 1.00 0.00 C ATOM 1000 CG GLU A 65 18.058 -21.005 -51.369 1.00 0.00 C ATOM 1001 CD GLU A 65 16.526 -21.066 -51.237 1.00 0.00 C ATOM 1002 OE1 GLU A 65 15.876 -21.882 -51.922 1.00 0.00 O ATOM 1003 OE2 GLU A 65 15.959 -20.279 -50.448 1.00 0.00 O ATOM 0 H GLU A 65 20.036 -19.529 -50.368 1.00 0.00 H new ATOM 0 HA GLU A 65 20.734 -22.177 -49.399 1.00 0.00 H new ATOM 0 HB2 GLU A 65 18.512 -22.768 -50.219 1.00 0.00 H new ATOM 0 HB3 GLU A 65 18.426 -21.298 -49.268 1.00 0.00 H new ATOM 0 HG2 GLU A 65 18.373 -19.962 -51.408 1.00 0.00 H new ATOM 0 HG3 GLU A 65 18.355 -21.463 -52.312 1.00 0.00 H new ATOM 1010 N ILE A 66 20.977 -23.547 -51.513 1.00 0.00 N ATOM 1011 CA ILE A 66 21.612 -24.353 -52.553 1.00 0.00 C ATOM 1012 C ILE A 66 20.543 -25.085 -53.394 1.00 0.00 C ATOM 1013 O ILE A 66 19.576 -25.597 -52.838 1.00 0.00 O ATOM 1014 CB ILE A 66 22.558 -25.401 -51.878 1.00 0.00 C ATOM 1015 CG1 ILE A 66 23.571 -24.719 -50.894 1.00 0.00 C ATOM 1016 CG2 ILE A 66 23.273 -26.254 -52.928 1.00 0.00 C ATOM 1017 CD1 ILE A 66 24.445 -23.633 -51.498 1.00 0.00 C ATOM 0 H ILE A 66 20.580 -24.111 -50.762 1.00 0.00 H new ATOM 0 HA ILE A 66 22.187 -23.702 -53.212 1.00 0.00 H new ATOM 0 HB ILE A 66 21.937 -26.068 -51.280 1.00 0.00 H new ATOM 0 HG12 ILE A 66 23.010 -24.289 -50.064 1.00 0.00 H new ATOM 0 HG13 ILE A 66 24.218 -25.490 -50.476 1.00 0.00 H new ATOM 0 HG21 ILE A 66 23.924 -26.973 -52.431 1.00 0.00 H new ATOM 0 HG22 ILE A 66 22.535 -26.786 -53.528 1.00 0.00 H new ATOM 0 HG23 ILE A 66 23.870 -25.611 -53.574 1.00 0.00 H new ATOM 0 HD11 ILE A 66 25.107 -23.230 -50.731 1.00 0.00 H new ATOM 0 HD12 ILE A 66 25.042 -24.054 -52.307 1.00 0.00 H new ATOM 0 HD13 ILE A 66 23.815 -22.835 -51.890 1.00 0.00 H new ATOM 1029 N SER A 67 20.745 -25.154 -54.723 1.00 0.00 N ATOM 1030 CA SER A 67 19.808 -25.821 -55.663 1.00 0.00 C ATOM 1031 C SER A 67 20.369 -27.149 -56.221 1.00 0.00 C ATOM 1032 O SER A 67 19.637 -27.904 -56.873 1.00 0.00 O ATOM 1033 CB SER A 67 19.499 -24.850 -56.828 1.00 0.00 C ATOM 1034 OG SER A 67 20.685 -24.293 -57.385 1.00 0.00 O ATOM 0 H SER A 67 21.562 -24.750 -55.182 1.00 0.00 H new ATOM 0 HA SER A 67 18.900 -26.069 -55.113 1.00 0.00 H new ATOM 0 HB2 SER A 67 18.947 -25.379 -57.605 1.00 0.00 H new ATOM 0 HB3 SER A 67 18.855 -24.047 -56.470 1.00 0.00 H new ATOM 0 HG SER A 67 21.416 -24.942 -57.315 1.00 0.00 H new ATOM 1040 N ASN A 68 21.664 -27.428 -55.969 1.00 0.00 N ATOM 1041 CA ASN A 68 22.390 -28.531 -56.650 1.00 0.00 C ATOM 1042 C ASN A 68 23.662 -28.957 -55.885 1.00 0.00 C ATOM 1043 O ASN A 68 24.190 -28.201 -55.070 1.00 0.00 O ATOM 1044 CB ASN A 68 22.746 -28.126 -58.106 1.00 0.00 C ATOM 1045 CG ASN A 68 23.487 -26.792 -58.198 1.00 0.00 C ATOM 1046 OD1 ASN A 68 23.186 -25.842 -57.479 1.00 0.00 O ATOM 1047 ND2 ASN A 68 24.475 -26.718 -59.052 1.00 0.00 N ATOM 0 H ASN A 68 22.232 -26.908 -55.300 1.00 0.00 H new ATOM 0 HA ASN A 68 21.722 -29.392 -56.669 1.00 0.00 H new ATOM 0 HB2 ASN A 68 23.361 -28.907 -58.553 1.00 0.00 H new ATOM 0 HB3 ASN A 68 21.830 -28.066 -58.694 1.00 0.00 H new ATOM 0 HD21 ASN A 68 25.016 -25.857 -59.133 1.00 0.00 H new ATOM 0 HD22 ASN A 68 24.704 -27.521 -59.637 1.00 0.00 H new ATOM 1054 N ARG A 69 24.172 -30.166 -56.221 1.00 0.00 N ATOM 1055 CA ARG A 69 25.266 -30.857 -55.484 1.00 0.00 C ATOM 1056 C ARG A 69 26.566 -30.026 -55.458 1.00 0.00 C ATOM 1057 O ARG A 69 27.243 -29.942 -54.428 1.00 0.00 O ATOM 1058 CB ARG A 69 25.561 -32.233 -56.141 1.00 0.00 C ATOM 1059 CG ARG A 69 26.459 -33.183 -55.301 1.00 0.00 C ATOM 1060 CD ARG A 69 27.299 -34.165 -56.149 1.00 0.00 C ATOM 1061 NE ARG A 69 26.512 -34.846 -57.198 1.00 0.00 N ATOM 1062 CZ ARG A 69 26.455 -36.168 -57.403 1.00 0.00 C ATOM 1063 NH1 ARG A 69 26.997 -37.023 -56.535 1.00 0.00 N ATOM 1064 NH2 ARG A 69 25.820 -36.630 -58.471 1.00 0.00 N ATOM 0 H ARG A 69 23.833 -30.699 -57.022 1.00 0.00 H new ATOM 0 HA ARG A 69 24.927 -30.990 -54.457 1.00 0.00 H new ATOM 0 HB2 ARG A 69 24.614 -32.734 -56.340 1.00 0.00 H new ATOM 0 HB3 ARG A 69 26.040 -32.063 -57.105 1.00 0.00 H new ATOM 0 HG2 ARG A 69 27.130 -32.583 -54.687 1.00 0.00 H new ATOM 0 HG3 ARG A 69 25.829 -33.754 -54.620 1.00 0.00 H new ATOM 0 HD2 ARG A 69 28.121 -33.622 -56.615 1.00 0.00 H new ATOM 0 HD3 ARG A 69 27.743 -34.914 -55.493 1.00 0.00 H new ATOM 0 HE ARG A 69 25.962 -34.256 -57.822 1.00 0.00 H new ATOM 0 HH11 ARG A 69 27.464 -36.673 -55.699 1.00 0.00 H new ATOM 0 HH12 ARG A 69 26.944 -38.027 -56.707 1.00 0.00 H new ATOM 0 HH21 ARG A 69 25.382 -35.981 -59.125 1.00 0.00 H new ATOM 0 HH22 ARG A 69 25.769 -37.635 -58.639 1.00 0.00 H new ATOM 1078 N LYS A 70 26.874 -29.411 -56.613 1.00 0.00 N ATOM 1079 CA LYS A 70 28.110 -28.628 -56.819 1.00 0.00 C ATOM 1080 C LYS A 70 28.142 -27.453 -55.834 1.00 0.00 C ATOM 1081 O LYS A 70 29.101 -27.302 -55.067 1.00 0.00 O ATOM 1082 CB LYS A 70 28.191 -28.123 -58.297 1.00 0.00 C ATOM 1083 CG LYS A 70 29.586 -27.621 -58.792 1.00 0.00 C ATOM 1084 CD LYS A 70 29.989 -26.218 -58.263 1.00 0.00 C ATOM 1085 CE LYS A 70 31.367 -25.762 -58.770 1.00 0.00 C ATOM 1086 NZ LYS A 70 32.449 -26.709 -58.383 1.00 0.00 N ATOM 0 H LYS A 70 26.271 -29.442 -57.435 1.00 0.00 H new ATOM 0 HA LYS A 70 28.977 -29.262 -56.634 1.00 0.00 H new ATOM 0 HB2 LYS A 70 27.869 -28.933 -58.951 1.00 0.00 H new ATOM 0 HB3 LYS A 70 27.474 -27.311 -58.419 1.00 0.00 H new ATOM 0 HG2 LYS A 70 30.346 -28.342 -58.490 1.00 0.00 H new ATOM 0 HG3 LYS A 70 29.584 -27.598 -59.882 1.00 0.00 H new ATOM 0 HD2 LYS A 70 29.236 -25.490 -58.567 1.00 0.00 H new ATOM 0 HD3 LYS A 70 29.995 -26.234 -57.173 1.00 0.00 H new ATOM 0 HE2 LYS A 70 31.340 -25.667 -59.856 1.00 0.00 H new ATOM 0 HE3 LYS A 70 31.591 -24.773 -58.369 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 33.374 -26.291 -58.610 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 32.396 -26.898 -57.362 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 32.334 -27.600 -58.907 1.00 0.00 H new ATOM 1100 N GLN A 71 27.060 -26.647 -55.858 1.00 0.00 N ATOM 1101 CA GLN A 71 26.950 -25.430 -55.032 1.00 0.00 C ATOM 1102 C GLN A 71 26.937 -25.768 -53.531 1.00 0.00 C ATOM 1103 O GLN A 71 27.331 -24.941 -52.719 1.00 0.00 O ATOM 1104 CB GLN A 71 25.702 -24.601 -55.428 1.00 0.00 C ATOM 1105 CG GLN A 71 25.724 -24.090 -56.886 1.00 0.00 C ATOM 1106 CD GLN A 71 26.900 -23.168 -57.217 1.00 0.00 C ATOM 1107 OE1 GLN A 71 27.385 -22.423 -56.372 1.00 0.00 O ATOM 1108 NE2 GLN A 71 27.358 -23.209 -58.455 1.00 0.00 N ATOM 0 H GLN A 71 26.245 -26.821 -56.446 1.00 0.00 H new ATOM 0 HA GLN A 71 27.833 -24.821 -55.223 1.00 0.00 H new ATOM 0 HB2 GLN A 71 24.811 -25.212 -55.281 1.00 0.00 H new ATOM 0 HB3 GLN A 71 25.617 -23.747 -54.756 1.00 0.00 H new ATOM 0 HG2 GLN A 71 25.751 -24.948 -57.558 1.00 0.00 H new ATOM 0 HG3 GLN A 71 24.794 -23.558 -57.085 1.00 0.00 H new ATOM 0 HE21 GLN A 71 26.933 -23.839 -59.135 1.00 0.00 H new ATOM 0 HE22 GLN A 71 28.136 -22.610 -58.731 1.00 0.00 H new ATOM 1117 N LEU A 72 26.506 -26.995 -53.195 1.00 0.00 N ATOM 1118 CA LEU A 72 26.514 -27.508 -51.810 1.00 0.00 C ATOM 1119 C LEU A 72 27.974 -27.666 -51.335 1.00 0.00 C ATOM 1120 O LEU A 72 28.352 -27.147 -50.287 1.00 0.00 O ATOM 1121 CB LEU A 72 25.739 -28.871 -51.751 1.00 0.00 C ATOM 1122 CG LEU A 72 25.135 -29.330 -50.374 1.00 0.00 C ATOM 1123 CD1 LEU A 72 26.186 -29.494 -49.276 1.00 0.00 C ATOM 1124 CD2 LEU A 72 23.999 -28.397 -49.927 1.00 0.00 C ATOM 0 H LEU A 72 26.141 -27.662 -53.875 1.00 0.00 H new ATOM 0 HA LEU A 72 26.012 -26.807 -51.144 1.00 0.00 H new ATOM 0 HB2 LEU A 72 24.922 -28.820 -52.471 1.00 0.00 H new ATOM 0 HB3 LEU A 72 26.417 -29.653 -52.093 1.00 0.00 H new ATOM 0 HG LEU A 72 24.718 -30.323 -50.541 1.00 0.00 H new ATOM 0 HD11 LEU A 72 25.701 -29.812 -48.353 1.00 0.00 H new ATOM 0 HD12 LEU A 72 26.916 -30.244 -49.580 1.00 0.00 H new ATOM 0 HD13 LEU A 72 26.691 -28.542 -49.111 1.00 0.00 H new ATOM 0 HD21 LEU A 72 23.601 -28.740 -48.972 1.00 0.00 H new ATOM 0 HD22 LEU A 72 24.383 -27.383 -49.817 1.00 0.00 H new ATOM 0 HD23 LEU A 72 23.206 -28.406 -50.674 1.00 0.00 H new ATOM 1136 N GLU A 73 28.772 -28.383 -52.139 1.00 0.00 N ATOM 1137 CA GLU A 73 30.171 -28.723 -51.811 1.00 0.00 C ATOM 1138 C GLU A 73 31.047 -27.461 -51.715 1.00 0.00 C ATOM 1139 O GLU A 73 31.750 -27.257 -50.710 1.00 0.00 O ATOM 1140 CB GLU A 73 30.725 -29.705 -52.876 1.00 0.00 C ATOM 1141 CG GLU A 73 29.972 -31.043 -52.939 1.00 0.00 C ATOM 1142 CD GLU A 73 30.435 -31.948 -54.085 1.00 0.00 C ATOM 1143 OE1 GLU A 73 29.772 -31.984 -55.139 1.00 0.00 O ATOM 1144 OE2 GLU A 73 31.482 -32.618 -53.944 1.00 0.00 O ATOM 0 H GLU A 73 28.467 -28.747 -53.041 1.00 0.00 H new ATOM 0 HA GLU A 73 30.195 -29.205 -50.833 1.00 0.00 H new ATOM 0 HB2 GLU A 73 30.680 -29.227 -53.855 1.00 0.00 H new ATOM 0 HB3 GLU A 73 31.776 -29.900 -52.664 1.00 0.00 H new ATOM 0 HG2 GLU A 73 30.103 -31.570 -51.994 1.00 0.00 H new ATOM 0 HG3 GLU A 73 28.906 -30.846 -53.049 1.00 0.00 H new ATOM 1151 N GLN A 74 30.973 -26.604 -52.751 1.00 0.00 N ATOM 1152 CA GLN A 74 31.743 -25.351 -52.800 1.00 0.00 C ATOM 1153 C GLN A 74 31.279 -24.361 -51.705 1.00 0.00 C ATOM 1154 O GLN A 74 32.059 -23.505 -51.274 1.00 0.00 O ATOM 1155 CB GLN A 74 31.735 -24.733 -54.241 1.00 0.00 C ATOM 1156 CG GLN A 74 30.382 -24.256 -54.822 1.00 0.00 C ATOM 1157 CD GLN A 74 29.941 -22.849 -54.386 1.00 0.00 C ATOM 1158 OE1 GLN A 74 29.220 -22.681 -53.411 1.00 0.00 O ATOM 1159 NE2 GLN A 74 30.406 -21.833 -55.102 1.00 0.00 N ATOM 0 H GLN A 74 30.384 -26.760 -53.569 1.00 0.00 H new ATOM 0 HA GLN A 74 32.785 -25.580 -52.576 1.00 0.00 H new ATOM 0 HB2 GLN A 74 32.417 -23.883 -54.243 1.00 0.00 H new ATOM 0 HB3 GLN A 74 32.148 -25.475 -54.924 1.00 0.00 H new ATOM 0 HG2 GLN A 74 30.444 -24.279 -55.910 1.00 0.00 H new ATOM 0 HG3 GLN A 74 29.609 -24.968 -54.532 1.00 0.00 H new ATOM 0 HE21 GLN A 74 31.005 -22.009 -55.909 1.00 0.00 H new ATOM 0 HE22 GLN A 74 30.165 -20.876 -54.846 1.00 0.00 H new ATOM 1168 N TYR A 75 30.016 -24.514 -51.237 1.00 0.00 N ATOM 1169 CA TYR A 75 29.495 -23.767 -50.076 1.00 0.00 C ATOM 1170 C TYR A 75 30.228 -24.209 -48.805 1.00 0.00 C ATOM 1171 O TYR A 75 30.741 -23.375 -48.090 1.00 0.00 O ATOM 1172 CB TYR A 75 27.960 -23.974 -49.917 1.00 0.00 C ATOM 1173 CG TYR A 75 27.289 -23.209 -48.758 1.00 0.00 C ATOM 1174 CD1 TYR A 75 26.622 -21.997 -48.967 1.00 0.00 C ATOM 1175 CD2 TYR A 75 27.313 -23.713 -47.455 1.00 0.00 C ATOM 1176 CE1 TYR A 75 26.009 -21.329 -47.922 1.00 0.00 C ATOM 1177 CE2 TYR A 75 26.710 -23.043 -46.417 1.00 0.00 C ATOM 1178 CZ TYR A 75 26.061 -21.861 -46.651 1.00 0.00 C ATOM 1179 OH TYR A 75 25.455 -21.211 -45.606 1.00 0.00 O ATOM 0 H TYR A 75 29.339 -25.154 -51.652 1.00 0.00 H new ATOM 0 HA TYR A 75 29.672 -22.704 -50.242 1.00 0.00 H new ATOM 0 HB2 TYR A 75 27.476 -23.680 -50.848 1.00 0.00 H new ATOM 0 HB3 TYR A 75 27.770 -25.039 -49.781 1.00 0.00 H new ATOM 0 HD1 TYR A 75 26.585 -21.576 -49.961 1.00 0.00 H new ATOM 0 HD2 TYR A 75 27.816 -24.649 -47.259 1.00 0.00 H new ATOM 0 HE1 TYR A 75 25.493 -20.397 -48.101 1.00 0.00 H new ATOM 0 HE2 TYR A 75 26.748 -23.449 -45.417 1.00 0.00 H new ATOM 0 HH TYR A 75 25.587 -21.723 -44.781 1.00 0.00 H new ATOM 1189 N LEU A 76 30.281 -25.527 -48.553 1.00 0.00 N ATOM 1190 CA LEU A 76 30.804 -26.092 -47.284 1.00 0.00 C ATOM 1191 C LEU A 76 32.296 -25.757 -47.058 1.00 0.00 C ATOM 1192 O LEU A 76 32.718 -25.504 -45.927 1.00 0.00 O ATOM 1193 CB LEU A 76 30.593 -27.623 -47.236 1.00 0.00 C ATOM 1194 CG LEU A 76 29.121 -28.130 -47.313 1.00 0.00 C ATOM 1195 CD1 LEU A 76 29.069 -29.664 -47.220 1.00 0.00 C ATOM 1196 CD2 LEU A 76 28.218 -27.463 -46.252 1.00 0.00 C ATOM 0 H LEU A 76 29.965 -26.234 -49.216 1.00 0.00 H new ATOM 0 HA LEU A 76 30.238 -25.625 -46.478 1.00 0.00 H new ATOM 0 HB2 LEU A 76 31.150 -28.069 -48.060 1.00 0.00 H new ATOM 0 HB3 LEU A 76 31.034 -27.998 -46.313 1.00 0.00 H new ATOM 0 HG LEU A 76 28.724 -27.837 -48.285 1.00 0.00 H new ATOM 0 HD11 LEU A 76 28.033 -29.997 -47.276 1.00 0.00 H new ATOM 0 HD12 LEU A 76 29.634 -30.098 -48.045 1.00 0.00 H new ATOM 0 HD13 LEU A 76 29.503 -29.986 -46.273 1.00 0.00 H new ATOM 0 HD21 LEU A 76 27.202 -27.848 -46.345 1.00 0.00 H new ATOM 0 HD22 LEU A 76 28.601 -27.686 -45.256 1.00 0.00 H new ATOM 0 HD23 LEU A 76 28.213 -26.384 -46.405 1.00 0.00 H new ATOM 1208 N LYS A 77 33.088 -25.766 -48.144 1.00 0.00 N ATOM 1209 CA LYS A 77 34.526 -25.422 -48.076 1.00 0.00 C ATOM 1210 C LYS A 77 34.724 -23.888 -47.938 1.00 0.00 C ATOM 1211 O LYS A 77 35.733 -23.426 -47.394 1.00 0.00 O ATOM 1212 CB LYS A 77 35.286 -26.035 -49.298 1.00 0.00 C ATOM 1213 CG LYS A 77 34.859 -25.531 -50.707 1.00 0.00 C ATOM 1214 CD LYS A 77 35.632 -24.269 -51.165 1.00 0.00 C ATOM 1215 CE LYS A 77 35.219 -23.792 -52.564 1.00 0.00 C ATOM 1216 NZ LYS A 77 35.972 -22.586 -52.979 1.00 0.00 N ATOM 0 H LYS A 77 32.761 -26.007 -49.080 1.00 0.00 H new ATOM 0 HA LYS A 77 34.961 -25.864 -47.179 1.00 0.00 H new ATOM 0 HB2 LYS A 77 36.350 -25.835 -49.173 1.00 0.00 H new ATOM 0 HB3 LYS A 77 35.159 -27.117 -49.270 1.00 0.00 H new ATOM 0 HG2 LYS A 77 35.015 -26.328 -51.434 1.00 0.00 H new ATOM 0 HG3 LYS A 77 33.791 -25.312 -50.699 1.00 0.00 H new ATOM 0 HD2 LYS A 77 35.463 -23.465 -50.448 1.00 0.00 H new ATOM 0 HD3 LYS A 77 36.701 -24.482 -51.160 1.00 0.00 H new ATOM 0 HE2 LYS A 77 35.388 -24.592 -53.285 1.00 0.00 H new ATOM 0 HE3 LYS A 77 34.151 -23.575 -52.573 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 35.665 -22.295 -53.929 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 35.791 -21.815 -52.305 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 36.990 -22.800 -52.995 1.00 0.00 H new ATOM 1230 N SER A 78 33.744 -23.105 -48.439 1.00 0.00 N ATOM 1231 CA SER A 78 33.738 -21.627 -48.308 1.00 0.00 C ATOM 1232 C SER A 78 33.163 -21.193 -46.939 1.00 0.00 C ATOM 1233 O SER A 78 33.510 -20.131 -46.409 1.00 0.00 O ATOM 1234 CB SER A 78 32.916 -21.003 -49.462 1.00 0.00 C ATOM 1235 OG SER A 78 32.901 -19.587 -49.401 1.00 0.00 O ATOM 0 H SER A 78 32.938 -23.475 -48.943 1.00 0.00 H new ATOM 0 HA SER A 78 34.766 -21.270 -48.367 1.00 0.00 H new ATOM 0 HB2 SER A 78 33.335 -21.320 -50.417 1.00 0.00 H new ATOM 0 HB3 SER A 78 31.893 -21.378 -49.422 1.00 0.00 H new ATOM 0 HG SER A 78 32.373 -19.233 -50.147 1.00 0.00 H new ATOM 1241 N HIS A 79 32.298 -22.046 -46.369 1.00 0.00 N ATOM 1242 CA HIS A 79 31.537 -21.762 -45.143 1.00 0.00 C ATOM 1243 C HIS A 79 31.798 -22.891 -44.131 1.00 0.00 C ATOM 1244 O HIS A 79 31.079 -23.902 -44.142 1.00 0.00 O ATOM 1245 CB HIS A 79 30.008 -21.657 -45.439 1.00 0.00 C ATOM 1246 CG HIS A 79 29.617 -20.585 -46.412 1.00 0.00 C ATOM 1247 ND1 HIS A 79 29.877 -20.668 -47.761 1.00 0.00 N ATOM 1248 CD2 HIS A 79 28.956 -19.421 -46.235 1.00 0.00 C ATOM 1249 CE1 HIS A 79 29.401 -19.603 -48.366 1.00 0.00 C ATOM 1250 NE2 HIS A 79 28.839 -18.830 -47.464 1.00 0.00 N ATOM 0 H HIS A 79 32.104 -22.970 -46.755 1.00 0.00 H new ATOM 0 HA HIS A 79 31.863 -20.805 -44.736 1.00 0.00 H new ATOM 0 HB2 HIS A 79 29.662 -22.617 -45.822 1.00 0.00 H new ATOM 0 HB3 HIS A 79 29.484 -21.481 -44.500 1.00 0.00 H new ATOM 0 HD1 HIS A 79 30.364 -21.438 -48.220 1.00 0.00 H new ATOM 0 HD2 HIS A 79 28.588 -19.029 -45.298 1.00 0.00 H new ATOM 0 HE1 HIS A 79 29.461 -19.398 -49.425 1.00 0.00 H new ATOM 0 HE2 HIS A 79 28.388 -17.934 -47.650 1.00 0.00 H new ATOM 1259 N PRO A 80 32.852 -22.764 -43.267 1.00 0.00 N ATOM 1260 CA PRO A 80 33.129 -23.759 -42.203 1.00 0.00 C ATOM 1261 C PRO A 80 32.046 -23.733 -41.102 1.00 0.00 C ATOM 1262 O PRO A 80 31.237 -22.792 -41.030 1.00 0.00 O ATOM 1263 CB PRO A 80 34.518 -23.332 -41.673 1.00 0.00 C ATOM 1264 CG PRO A 80 34.601 -21.862 -41.959 1.00 0.00 C ATOM 1265 CD PRO A 80 33.851 -21.653 -43.254 1.00 0.00 C ATOM 0 HA PRO A 80 33.118 -24.788 -42.564 1.00 0.00 H new ATOM 0 HB2 PRO A 80 34.613 -23.534 -40.606 1.00 0.00 H new ATOM 0 HB3 PRO A 80 35.318 -23.878 -42.173 1.00 0.00 H new ATOM 0 HG2 PRO A 80 34.157 -21.281 -41.151 1.00 0.00 H new ATOM 0 HG3 PRO A 80 35.638 -21.539 -42.051 1.00 0.00 H new ATOM 0 HD2 PRO A 80 33.366 -20.677 -43.283 1.00 0.00 H new ATOM 0 HD3 PRO A 80 34.517 -21.703 -44.115 1.00 0.00 H new ATOM 1273 N GLY A 81 32.017 -24.786 -40.264 1.00 0.00 N ATOM 1274 CA GLY A 81 30.992 -24.940 -39.224 1.00 0.00 C ATOM 1275 C GLY A 81 29.758 -25.701 -39.719 1.00 0.00 C ATOM 1276 O GLY A 81 29.087 -26.385 -38.935 1.00 0.00 O ATOM 0 H GLY A 81 32.698 -25.545 -40.291 1.00 0.00 H new ATOM 0 HA2 GLY A 81 31.421 -25.467 -38.372 1.00 0.00 H new ATOM 0 HA3 GLY A 81 30.689 -23.955 -38.870 1.00 0.00 H new ATOM 1280 N ASN A 82 29.470 -25.584 -41.030 1.00 0.00 N ATOM 1281 CA ASN A 82 28.339 -26.263 -41.686 1.00 0.00 C ATOM 1282 C ASN A 82 28.607 -27.784 -41.808 1.00 0.00 C ATOM 1283 O ASN A 82 29.749 -28.185 -42.054 1.00 0.00 O ATOM 1284 CB ASN A 82 28.081 -25.637 -43.085 1.00 0.00 C ATOM 1285 CG ASN A 82 27.521 -24.216 -43.006 1.00 0.00 C ATOM 1286 OD1 ASN A 82 26.308 -24.015 -43.003 1.00 0.00 O ATOM 1287 ND2 ASN A 82 28.398 -23.221 -42.930 1.00 0.00 N ATOM 0 H ASN A 82 30.022 -25.010 -41.668 1.00 0.00 H new ATOM 0 HA ASN A 82 27.448 -26.127 -41.072 1.00 0.00 H new ATOM 0 HB2 ASN A 82 29.013 -25.624 -43.649 1.00 0.00 H new ATOM 0 HB3 ASN A 82 27.383 -26.267 -43.637 1.00 0.00 H new ATOM 0 HD21 ASN A 82 28.071 -22.257 -42.867 1.00 0.00 H new ATOM 0 HD22 ASN A 82 29.398 -23.421 -42.935 1.00 0.00 H new ATOM 1294 N PRO A 83 27.562 -28.652 -41.602 1.00 0.00 N ATOM 1295 CA PRO A 83 27.703 -30.130 -41.694 1.00 0.00 C ATOM 1296 C PRO A 83 28.006 -30.618 -43.135 1.00 0.00 C ATOM 1297 O PRO A 83 27.796 -29.883 -44.107 1.00 0.00 O ATOM 1298 CB PRO A 83 26.338 -30.643 -41.167 1.00 0.00 C ATOM 1299 CG PRO A 83 25.379 -29.529 -41.430 1.00 0.00 C ATOM 1300 CD PRO A 83 26.168 -28.257 -41.253 1.00 0.00 C ATOM 0 HA PRO A 83 28.550 -30.508 -41.121 1.00 0.00 H new ATOM 0 HB2 PRO A 83 26.034 -31.555 -41.681 1.00 0.00 H new ATOM 0 HB3 PRO A 83 26.388 -30.878 -40.104 1.00 0.00 H new ATOM 0 HG2 PRO A 83 24.968 -29.597 -42.437 1.00 0.00 H new ATOM 0 HG3 PRO A 83 24.537 -29.566 -40.739 1.00 0.00 H new ATOM 0 HD2 PRO A 83 25.801 -27.465 -41.906 1.00 0.00 H new ATOM 0 HD3 PRO A 83 26.102 -27.884 -40.231 1.00 0.00 H new ATOM 1308 N ALA A 84 28.493 -31.874 -43.241 1.00 0.00 N ATOM 1309 CA ALA A 84 29.038 -32.452 -44.499 1.00 0.00 C ATOM 1310 C ALA A 84 27.926 -32.814 -45.506 1.00 0.00 C ATOM 1311 O ALA A 84 26.775 -32.964 -45.127 1.00 0.00 O ATOM 1312 CB ALA A 84 29.896 -33.690 -44.172 1.00 0.00 C ATOM 0 H ALA A 84 28.521 -32.523 -42.454 1.00 0.00 H new ATOM 0 HA ALA A 84 29.659 -31.692 -44.973 1.00 0.00 H new ATOM 0 HB1 ALA A 84 30.294 -34.111 -45.095 1.00 0.00 H new ATOM 0 HB2 ALA A 84 30.720 -33.400 -43.521 1.00 0.00 H new ATOM 0 HB3 ALA A 84 29.281 -34.436 -43.668 1.00 0.00 H new ATOM 1318 N ILE A 85 28.289 -32.969 -46.799 1.00 0.00 N ATOM 1319 CA ILE A 85 27.318 -33.332 -47.861 1.00 0.00 C ATOM 1320 C ILE A 85 26.999 -34.850 -47.833 1.00 0.00 C ATOM 1321 O ILE A 85 25.953 -35.289 -48.336 1.00 0.00 O ATOM 1322 CB ILE A 85 27.815 -32.886 -49.298 1.00 0.00 C ATOM 1323 CG1 ILE A 85 26.695 -33.120 -50.371 1.00 0.00 C ATOM 1324 CG2 ILE A 85 29.144 -33.575 -49.697 1.00 0.00 C ATOM 1325 CD1 ILE A 85 27.019 -32.638 -51.767 1.00 0.00 C ATOM 0 H ILE A 85 29.245 -32.849 -47.134 1.00 0.00 H new ATOM 0 HA ILE A 85 26.398 -32.786 -47.652 1.00 0.00 H new ATOM 0 HB ILE A 85 28.022 -31.817 -49.256 1.00 0.00 H new ATOM 0 HG12 ILE A 85 26.476 -34.187 -50.416 1.00 0.00 H new ATOM 0 HG13 ILE A 85 25.785 -32.622 -50.036 1.00 0.00 H new ATOM 0 HG21 ILE A 85 29.445 -33.238 -50.689 1.00 0.00 H new ATOM 0 HG22 ILE A 85 29.919 -33.316 -48.975 1.00 0.00 H new ATOM 0 HG23 ILE A 85 29.005 -34.656 -49.708 1.00 0.00 H new ATOM 0 HD11 ILE A 85 26.179 -32.848 -52.429 1.00 0.00 H new ATOM 0 HD12 ILE A 85 27.205 -31.564 -51.747 1.00 0.00 H new ATOM 0 HD13 ILE A 85 27.907 -33.154 -52.133 1.00 0.00 H new ATOM 1337 N ALA A 86 27.892 -35.639 -47.204 1.00 0.00 N ATOM 1338 CA ALA A 86 27.719 -37.099 -47.049 1.00 0.00 C ATOM 1339 C ALA A 86 26.460 -37.442 -46.226 1.00 0.00 C ATOM 1340 O ALA A 86 25.747 -38.404 -46.529 1.00 0.00 O ATOM 1341 CB ALA A 86 28.971 -37.707 -46.403 1.00 0.00 C ATOM 0 H ALA A 86 28.753 -35.284 -46.789 1.00 0.00 H new ATOM 0 HA ALA A 86 27.583 -37.530 -48.041 1.00 0.00 H new ATOM 0 HB1 ALA A 86 28.837 -38.783 -46.292 1.00 0.00 H new ATOM 0 HB2 ALA A 86 29.837 -37.513 -47.035 1.00 0.00 H new ATOM 0 HB3 ALA A 86 29.129 -37.258 -45.423 1.00 0.00 H new ATOM 1347 N GLU A 87 26.191 -36.629 -45.187 1.00 0.00 N ATOM 1348 CA GLU A 87 25.017 -36.803 -44.302 1.00 0.00 C ATOM 1349 C GLU A 87 23.751 -36.149 -44.904 1.00 0.00 C ATOM 1350 O GLU A 87 22.645 -36.334 -44.383 1.00 0.00 O ATOM 1351 CB GLU A 87 25.323 -36.212 -42.908 1.00 0.00 C ATOM 1352 CG GLU A 87 25.622 -34.712 -42.916 1.00 0.00 C ATOM 1353 CD GLU A 87 26.020 -34.178 -41.547 1.00 0.00 C ATOM 1354 OE1 GLU A 87 27.233 -34.009 -41.290 1.00 0.00 O ATOM 1355 OE2 GLU A 87 25.126 -33.942 -40.702 1.00 0.00 O ATOM 0 H GLU A 87 26.778 -35.834 -44.935 1.00 0.00 H new ATOM 0 HA GLU A 87 24.817 -37.870 -44.204 1.00 0.00 H new ATOM 0 HB2 GLU A 87 24.473 -36.398 -42.252 1.00 0.00 H new ATOM 0 HB3 GLU A 87 26.176 -36.739 -42.481 1.00 0.00 H new ATOM 0 HG2 GLU A 87 26.424 -34.511 -43.626 1.00 0.00 H new ATOM 0 HG3 GLU A 87 24.742 -34.174 -43.268 1.00 0.00 H new ATOM 1362 N PHE A 88 23.935 -35.374 -45.986 1.00 0.00 N ATOM 1363 CA PHE A 88 22.832 -34.716 -46.710 1.00 0.00 C ATOM 1364 C PHE A 88 22.183 -35.701 -47.696 1.00 0.00 C ATOM 1365 O PHE A 88 22.877 -36.369 -48.478 1.00 0.00 O ATOM 1366 CB PHE A 88 23.338 -33.447 -47.462 1.00 0.00 C ATOM 1367 CG PHE A 88 23.631 -32.224 -46.586 1.00 0.00 C ATOM 1368 CD1 PHE A 88 23.718 -30.959 -47.154 1.00 0.00 C ATOM 1369 CD2 PHE A 88 23.811 -32.329 -45.210 1.00 0.00 C ATOM 1370 CE1 PHE A 88 23.977 -29.844 -46.377 1.00 0.00 C ATOM 1371 CE2 PHE A 88 24.071 -31.219 -44.441 1.00 0.00 C ATOM 1372 CZ PHE A 88 24.154 -29.976 -45.023 1.00 0.00 C ATOM 0 H PHE A 88 24.855 -35.185 -46.385 1.00 0.00 H new ATOM 0 HA PHE A 88 22.084 -34.402 -45.982 1.00 0.00 H new ATOM 0 HB2 PHE A 88 24.247 -33.708 -48.004 1.00 0.00 H new ATOM 0 HB3 PHE A 88 22.592 -33.167 -48.206 1.00 0.00 H new ATOM 0 HD1 PHE A 88 23.581 -30.844 -48.219 1.00 0.00 H new ATOM 0 HD2 PHE A 88 23.745 -33.298 -44.738 1.00 0.00 H new ATOM 0 HE1 PHE A 88 24.040 -28.869 -46.837 1.00 0.00 H new ATOM 0 HE2 PHE A 88 24.211 -31.324 -43.375 1.00 0.00 H new ATOM 0 HZ PHE A 88 24.358 -29.106 -44.416 1.00 0.00 H new ATOM 1382 N ASP A 89 20.847 -35.791 -47.625 1.00 0.00 N ATOM 1383 CA ASP A 89 20.034 -36.634 -48.513 1.00 0.00 C ATOM 1384 C ASP A 89 19.729 -35.890 -49.824 1.00 0.00 C ATOM 1385 O ASP A 89 19.231 -34.772 -49.802 1.00 0.00 O ATOM 1386 CB ASP A 89 18.707 -37.064 -47.803 1.00 0.00 C ATOM 1387 CG ASP A 89 17.624 -37.537 -48.783 1.00 0.00 C ATOM 1388 OD1 ASP A 89 16.621 -36.808 -48.976 1.00 0.00 O ATOM 1389 OD2 ASP A 89 17.787 -38.628 -49.372 1.00 0.00 O ATOM 0 H ASP A 89 20.294 -35.274 -46.941 1.00 0.00 H new ATOM 0 HA ASP A 89 20.601 -37.534 -48.749 1.00 0.00 H new ATOM 0 HB2 ASP A 89 18.924 -37.865 -47.096 1.00 0.00 H new ATOM 0 HB3 ASP A 89 18.323 -36.224 -47.225 1.00 0.00 H new ATOM 1394 N TRP A 90 20.060 -36.524 -50.951 1.00 0.00 N ATOM 1395 CA TRP A 90 19.626 -36.095 -52.299 1.00 0.00 C ATOM 1396 C TRP A 90 18.774 -37.209 -52.943 1.00 0.00 C ATOM 1397 O TRP A 90 18.090 -36.978 -53.942 1.00 0.00 O ATOM 1398 CB TRP A 90 20.860 -35.785 -53.195 1.00 0.00 C ATOM 1399 CG TRP A 90 21.737 -34.659 -52.686 1.00 0.00 C ATOM 1400 CD1 TRP A 90 22.781 -34.755 -51.805 1.00 0.00 C ATOM 1401 CD2 TRP A 90 21.629 -33.263 -53.023 1.00 0.00 C ATOM 1402 NE1 TRP A 90 23.328 -33.519 -51.587 1.00 0.00 N ATOM 1403 CE2 TRP A 90 22.640 -32.590 -52.324 1.00 0.00 C ATOM 1404 CE3 TRP A 90 20.782 -32.517 -53.855 1.00 0.00 C ATOM 1405 CZ2 TRP A 90 22.825 -31.217 -52.423 1.00 0.00 C ATOM 1406 CZ3 TRP A 90 20.970 -31.151 -53.948 1.00 0.00 C ATOM 1407 CH2 TRP A 90 21.986 -30.514 -53.239 1.00 0.00 C ATOM 0 H TRP A 90 20.644 -37.360 -50.962 1.00 0.00 H new ATOM 0 HA TRP A 90 19.029 -35.187 -52.207 1.00 0.00 H new ATOM 0 HB2 TRP A 90 21.464 -36.688 -53.285 1.00 0.00 H new ATOM 0 HB3 TRP A 90 20.512 -35.534 -54.197 1.00 0.00 H new ATOM 0 HD1 TRP A 90 23.123 -35.672 -51.349 1.00 0.00 H new ATOM 0 HE1 TRP A 90 24.120 -33.321 -50.975 1.00 0.00 H new ATOM 0 HE3 TRP A 90 19.995 -33.002 -54.414 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 23.609 -30.720 -51.871 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 20.318 -30.567 -54.581 1.00 0.00 H new ATOM 0 HH2 TRP A 90 22.112 -29.446 -53.337 1.00 0.00 H new ATOM 1418 N THR A 91 18.788 -38.402 -52.310 1.00 0.00 N ATOM 1419 CA THR A 91 18.341 -39.673 -52.916 1.00 0.00 C ATOM 1420 C THR A 91 16.933 -40.108 -52.420 1.00 0.00 C ATOM 1421 O THR A 91 16.507 -41.244 -52.680 1.00 0.00 O ATOM 1422 CB THR A 91 19.419 -40.791 -52.631 1.00 0.00 C ATOM 1423 OG1 THR A 91 19.102 -42.011 -53.332 1.00 0.00 O ATOM 1424 CG2 THR A 91 19.564 -41.087 -51.130 1.00 0.00 C ATOM 0 H THR A 91 19.115 -38.510 -51.350 1.00 0.00 H new ATOM 0 HA THR A 91 18.247 -39.522 -53.991 1.00 0.00 H new ATOM 0 HB THR A 91 20.370 -40.402 -52.996 1.00 0.00 H new ATOM 0 HG1 THR A 91 18.137 -42.177 -53.281 1.00 0.00 H new ATOM 0 HG21 THR A 91 20.316 -41.862 -50.983 1.00 0.00 H new ATOM 0 HG22 THR A 91 19.870 -40.180 -50.608 1.00 0.00 H new ATOM 0 HG23 THR A 91 18.608 -41.429 -50.733 1.00 0.00 H new ATOM 1432 N THR A 92 16.186 -39.187 -51.755 1.00 0.00 N ATOM 1433 CA THR A 92 14.827 -39.484 -51.222 1.00 0.00 C ATOM 1434 C THR A 92 13.828 -39.841 -52.351 1.00 0.00 C ATOM 1435 O THR A 92 12.803 -40.487 -52.107 1.00 0.00 O ATOM 1436 CB THR A 92 14.239 -38.302 -50.388 1.00 0.00 C ATOM 1437 OG1 THR A 92 13.035 -38.718 -49.721 1.00 0.00 O ATOM 1438 CG2 THR A 92 13.951 -37.052 -51.242 1.00 0.00 C ATOM 0 H THR A 92 16.501 -38.234 -51.575 1.00 0.00 H new ATOM 0 HA THR A 92 14.956 -40.345 -50.567 1.00 0.00 H new ATOM 0 HB THR A 92 14.998 -38.026 -49.656 1.00 0.00 H new ATOM 0 HG1 THR A 92 12.375 -37.994 -49.755 1.00 0.00 H new ATOM 0 HG21 THR A 92 13.544 -36.264 -50.608 1.00 0.00 H new ATOM 0 HG22 THR A 92 14.876 -36.705 -51.703 1.00 0.00 H new ATOM 0 HG23 THR A 92 13.229 -37.301 -52.020 1.00 0.00 H new ATOM 1446 N SER A 93 14.167 -39.414 -53.585 1.00 0.00 N ATOM 1447 CA SER A 93 13.365 -39.645 -54.801 1.00 0.00 C ATOM 1448 C SER A 93 13.180 -41.153 -55.106 1.00 0.00 C ATOM 1449 O SER A 93 12.287 -41.532 -55.883 1.00 0.00 O ATOM 1450 CB SER A 93 14.057 -38.946 -55.993 1.00 0.00 C ATOM 1451 OG SER A 93 14.357 -37.593 -55.683 1.00 0.00 O ATOM 0 H SER A 93 15.023 -38.889 -53.766 1.00 0.00 H new ATOM 0 HA SER A 93 12.371 -39.230 -54.637 1.00 0.00 H new ATOM 0 HB2 SER A 93 14.974 -39.477 -56.248 1.00 0.00 H new ATOM 0 HB3 SER A 93 13.410 -38.988 -56.869 1.00 0.00 H new ATOM 0 HG SER A 93 13.523 -37.088 -55.581 1.00 0.00 H new ATOM 1457 N GLY A 94 14.039 -41.998 -54.493 1.00 0.00 N ATOM 1458 CA GLY A 94 14.017 -43.444 -54.703 1.00 0.00 C ATOM 1459 C GLY A 94 14.813 -43.813 -55.946 1.00 0.00 C ATOM 1460 O GLY A 94 15.877 -44.428 -55.861 1.00 0.00 O ATOM 0 H GLY A 94 14.761 -41.688 -53.843 1.00 0.00 H new ATOM 0 HA2 GLY A 94 14.435 -43.950 -53.833 1.00 0.00 H new ATOM 0 HA3 GLY A 94 12.988 -43.787 -54.808 1.00 0.00 H new ATOM 1464 N THR A 95 14.279 -43.396 -57.105 1.00 0.00 N ATOM 1465 CA THR A 95 14.926 -43.532 -58.409 1.00 0.00 C ATOM 1466 C THR A 95 15.721 -42.233 -58.732 1.00 0.00 C ATOM 1467 O THR A 95 16.976 -42.264 -58.696 1.00 0.00 O ATOM 1468 CB THR A 95 13.854 -43.852 -59.513 1.00 0.00 C ATOM 1469 OG1 THR A 95 12.776 -42.897 -59.442 1.00 0.00 O ATOM 1470 CG2 THR A 95 13.289 -45.284 -59.361 1.00 0.00 C ATOM 1471 OXT THR A 95 15.092 -41.176 -58.950 1.00 0.00 O ATOM 0 H THR A 95 13.365 -42.946 -57.157 1.00 0.00 H new ATOM 0 HA THR A 95 15.631 -44.363 -58.388 1.00 0.00 H new ATOM 0 HB THR A 95 14.346 -43.784 -60.483 1.00 0.00 H new ATOM 0 HG1 THR A 95 13.140 -42.006 -59.257 1.00 0.00 H new ATOM 0 HG21 THR A 95 12.551 -45.469 -60.142 1.00 0.00 H new ATOM 0 HG22 THR A 95 14.100 -46.007 -59.450 1.00 0.00 H new ATOM 0 HG23 THR A 95 12.817 -45.387 -58.384 1.00 0.00 H new TER 1479 THR A 95