USER MOD reduce.3.24.130724 H: found=0, std=0, add=358, rem=0, adj=11 USER MOD reduce.3.24.130724 removed 354 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 18 TYR OH : rot 25:sc= 1.26 USER MOD Set 1.2: A 43 TYR OH : rot 180:sc= -0.356 USER MOD Set 1.3: A 47 HIS : no HE2:sc= -0.301 K(o=0.61,f=-3.4!) USER MOD Single : A 1 SER N :NH3+ -135:sc= 0.118 (180deg=0) USER MOD Single : A 1 SER OG : rot 180:sc= 0 USER MOD Single : A 11 MET CE :methyl -170:sc= -1.77 (180deg=-2.04) USER MOD Single : A 12 THR OG1 : rot 180:sc= -0.385 USER MOD Single : A 13 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 14 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.0467) USER MOD Single : A 17 ASN : amide:sc= 0 X(o=0,f=-0.15) USER MOD Single : A 19 LYS NZ :NH3+ 145:sc= -0.581 (180deg=-2.26!) USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 21 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 24 ASN : amide:sc= 0 X(o=0,f=-0.014) USER MOD Single : A 29 GLN : amide:sc= 0 X(o=0,f=-0.001) USER MOD Single : A 40 ASN : amide:sc= -0.586 K(o=-0.59,f=-6.2!) USER MOD Single : A 44 THR OG1 : rot 80:sc= 1.23 USER MOD Single : A 50 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 2.777 2.262 -2.031 1.00 0.00 N ATOM 2 CA SER A 1 2.431 1.246 -3.018 1.00 0.00 C ATOM 3 C SER A 1 3.041 -0.102 -2.647 1.00 0.00 C ATOM 4 O SER A 1 3.697 -0.235 -1.614 1.00 0.00 O ATOM 5 CB SER A 1 2.911 1.670 -4.408 1.00 0.00 C ATOM 6 OG SER A 1 4.324 1.764 -4.453 1.00 0.00 O ATOM 0 H1 SER A 1 1.930 2.817 -1.793 1.00 0.00 H new ATOM 0 H2 SER A 1 3.142 1.802 -1.173 1.00 0.00 H new ATOM 0 H3 SER A 1 3.506 2.892 -2.422 1.00 0.00 H new ATOM 0 HA SER A 1 1.346 1.143 -3.032 1.00 0.00 H new ATOM 0 HB2 SER A 1 2.568 0.949 -5.150 1.00 0.00 H new ATOM 0 HB3 SER A 1 2.471 2.632 -4.670 1.00 0.00 H new ATOM 0 HG SER A 1 4.605 2.035 -5.352 1.00 0.00 H new ATOM 12 N GLU A 2 2.820 -1.100 -3.498 1.00 0.00 N ATOM 13 CA GLU A 2 3.347 -2.438 -3.258 1.00 0.00 C ATOM 14 C GLU A 2 3.323 -3.269 -4.538 1.00 0.00 C ATOM 15 O GLU A 2 2.565 -2.998 -5.470 1.00 0.00 O ATOM 16 CB GLU A 2 2.538 -3.141 -2.166 1.00 0.00 C ATOM 17 CG GLU A 2 1.039 -2.915 -2.278 1.00 0.00 C ATOM 18 CD GLU A 2 0.233 -4.000 -1.591 1.00 0.00 C ATOM 19 OE1 GLU A 2 0.034 -5.069 -2.206 1.00 0.00 O ATOM 20 OE2 GLU A 2 -0.199 -3.781 -0.441 1.00 0.00 O ATOM 0 H GLU A 2 2.280 -1.007 -4.358 1.00 0.00 H new ATOM 0 HA GLU A 2 4.381 -2.340 -2.927 1.00 0.00 H new ATOM 0 HB2 GLU A 2 2.740 -4.211 -2.208 1.00 0.00 H new ATOM 0 HB3 GLU A 2 2.878 -2.791 -1.191 1.00 0.00 H new ATOM 0 HG2 GLU A 2 0.787 -1.949 -1.841 1.00 0.00 H new ATOM 0 HG3 GLU A 2 0.760 -2.871 -3.331 1.00 0.00 H new ATOM 27 N PRO A 3 4.174 -4.305 -4.586 1.00 0.00 N ATOM 28 CA PRO A 3 4.270 -5.197 -5.745 1.00 0.00 C ATOM 29 C PRO A 3 3.035 -6.077 -5.904 1.00 0.00 C ATOM 30 O PRO A 3 2.241 -6.222 -4.974 1.00 0.00 O ATOM 31 CB PRO A 3 5.500 -6.053 -5.433 1.00 0.00 C ATOM 32 CG PRO A 3 5.606 -6.036 -3.947 1.00 0.00 C ATOM 33 CD PRO A 3 5.106 -4.686 -3.512 1.00 0.00 C ATOM 0 HA PRO A 3 4.346 -4.643 -6.680 1.00 0.00 H new ATOM 0 HB2 PRO A 3 5.381 -7.069 -5.810 1.00 0.00 H new ATOM 0 HB3 PRO A 3 6.396 -5.643 -5.899 1.00 0.00 H new ATOM 0 HG2 PRO A 3 5.010 -6.834 -3.504 1.00 0.00 H new ATOM 0 HG3 PRO A 3 6.636 -6.192 -3.627 1.00 0.00 H new ATOM 0 HD2 PRO A 3 4.606 -4.735 -2.545 1.00 0.00 H new ATOM 0 HD3 PRO A 3 5.921 -3.968 -3.413 1.00 0.00 H new ATOM 41 N ASP A 4 2.879 -6.663 -7.086 1.00 0.00 N ATOM 42 CA ASP A 4 1.740 -7.529 -7.366 1.00 0.00 C ATOM 43 C ASP A 4 2.202 -8.872 -7.923 1.00 0.00 C ATOM 44 O ASP A 4 1.456 -9.552 -8.626 1.00 0.00 O ATOM 45 CB ASP A 4 0.788 -6.853 -8.354 1.00 0.00 C ATOM 46 CG ASP A 4 1.387 -6.728 -9.741 1.00 0.00 C ATOM 47 OD1 ASP A 4 2.545 -6.273 -9.849 1.00 0.00 O ATOM 48 OD2 ASP A 4 0.698 -7.087 -10.719 1.00 0.00 O ATOM 0 H ASP A 4 3.527 -6.554 -7.866 1.00 0.00 H new ATOM 0 HA ASP A 4 1.212 -7.707 -6.429 1.00 0.00 H new ATOM 0 HB2 ASP A 4 -0.138 -7.425 -8.411 1.00 0.00 H new ATOM 0 HB3 ASP A 4 0.528 -5.862 -7.983 1.00 0.00 H new ATOM 53 N GLU A 5 3.438 -9.245 -7.605 1.00 0.00 N ATOM 54 CA GLU A 5 4.000 -10.506 -8.077 1.00 0.00 C ATOM 55 C GLU A 5 3.331 -11.691 -7.387 1.00 0.00 C ATOM 56 O GLU A 5 3.149 -12.750 -7.989 1.00 0.00 O ATOM 57 CB GLU A 5 5.509 -10.542 -7.827 1.00 0.00 C ATOM 58 CG GLU A 5 6.328 -9.959 -8.966 1.00 0.00 C ATOM 59 CD GLU A 5 6.601 -8.477 -8.790 1.00 0.00 C ATOM 60 OE1 GLU A 5 6.077 -7.890 -7.820 1.00 0.00 O ATOM 61 OE2 GLU A 5 7.336 -7.906 -9.621 1.00 0.00 O ATOM 0 H GLU A 5 4.069 -8.693 -7.023 1.00 0.00 H new ATOM 0 HA GLU A 5 3.814 -10.579 -9.149 1.00 0.00 H new ATOM 0 HB2 GLU A 5 5.731 -9.992 -6.913 1.00 0.00 H new ATOM 0 HB3 GLU A 5 5.817 -11.574 -7.660 1.00 0.00 H new ATOM 0 HG2 GLU A 5 7.275 -10.493 -9.038 1.00 0.00 H new ATOM 0 HG3 GLU A 5 5.800 -10.118 -9.906 1.00 0.00 H new ATOM 68 N ILE A 6 2.967 -11.505 -6.123 1.00 0.00 N ATOM 69 CA ILE A 6 2.317 -12.558 -5.352 1.00 0.00 C ATOM 70 C ILE A 6 1.018 -13.002 -6.015 1.00 0.00 C ATOM 71 O ILE A 6 0.676 -14.185 -6.006 1.00 0.00 O ATOM 72 CB ILE A 6 2.015 -12.098 -3.914 1.00 0.00 C ATOM 73 CG1 ILE A 6 3.298 -11.624 -3.227 1.00 0.00 C ATOM 74 CG2 ILE A 6 1.369 -13.225 -3.122 1.00 0.00 C ATOM 75 CD1 ILE A 6 4.362 -12.695 -3.130 1.00 0.00 C ATOM 0 H ILE A 6 3.111 -10.635 -5.611 1.00 0.00 H new ATOM 0 HA ILE A 6 3.011 -13.398 -5.318 1.00 0.00 H new ATOM 0 HB ILE A 6 1.317 -11.262 -3.955 1.00 0.00 H new ATOM 0 HG12 ILE A 6 3.700 -10.772 -3.775 1.00 0.00 H new ATOM 0 HG13 ILE A 6 3.055 -11.272 -2.224 1.00 0.00 H new ATOM 0 HG21 ILE A 6 1.162 -12.884 -2.108 1.00 0.00 H new ATOM 0 HG22 ILE A 6 0.437 -13.520 -3.603 1.00 0.00 H new ATOM 0 HG23 ILE A 6 2.045 -14.079 -3.087 1.00 0.00 H new ATOM 0 HD11 ILE A 6 5.243 -12.289 -2.632 1.00 0.00 H new ATOM 0 HD12 ILE A 6 3.978 -13.539 -2.557 1.00 0.00 H new ATOM 0 HD13 ILE A 6 4.633 -13.030 -4.131 1.00 0.00 H new ATOM 87 N CYS A 7 0.298 -12.047 -6.593 1.00 0.00 N ATOM 88 CA CYS A 7 -0.964 -12.338 -7.262 1.00 0.00 C ATOM 89 C CYS A 7 -0.751 -13.291 -8.434 1.00 0.00 C ATOM 90 O CYS A 7 -1.430 -14.311 -8.551 1.00 0.00 O ATOM 91 CB CYS A 7 -1.615 -11.044 -7.754 1.00 0.00 C ATOM 92 SG CYS A 7 -2.333 -10.021 -6.429 1.00 0.00 S ATOM 0 H CYS A 7 0.567 -11.063 -6.612 1.00 0.00 H new ATOM 0 HA CYS A 7 -1.626 -12.818 -6.542 1.00 0.00 H new ATOM 0 HB2 CYS A 7 -0.869 -10.456 -8.289 1.00 0.00 H new ATOM 0 HB3 CYS A 7 -2.398 -11.293 -8.470 1.00 0.00 H new ATOM 97 N ARG A 8 0.198 -12.951 -9.301 1.00 0.00 N ATOM 98 CA ARG A 8 0.501 -13.776 -10.464 1.00 0.00 C ATOM 99 C ARG A 8 1.046 -15.137 -10.040 1.00 0.00 C ATOM 100 O ARG A 8 0.824 -16.142 -10.713 1.00 0.00 O ATOM 101 CB ARG A 8 1.514 -13.069 -11.367 1.00 0.00 C ATOM 102 CG ARG A 8 1.985 -13.918 -12.536 1.00 0.00 C ATOM 103 CD ARG A 8 3.081 -13.220 -13.326 1.00 0.00 C ATOM 104 NE ARG A 8 4.359 -13.236 -12.621 1.00 0.00 N ATOM 105 CZ ARG A 8 5.407 -12.505 -12.982 1.00 0.00 C ATOM 106 NH1 ARG A 8 5.329 -11.703 -14.036 1.00 0.00 N ATOM 107 NH2 ARG A 8 6.537 -12.574 -12.290 1.00 0.00 N ATOM 0 H ARG A 8 0.770 -12.110 -9.220 1.00 0.00 H new ATOM 0 HA ARG A 8 -0.425 -13.931 -11.018 1.00 0.00 H new ATOM 0 HB2 ARG A 8 1.067 -12.152 -11.752 1.00 0.00 H new ATOM 0 HB3 ARG A 8 2.378 -12.777 -10.770 1.00 0.00 H new ATOM 0 HG2 ARG A 8 2.354 -14.875 -12.167 1.00 0.00 H new ATOM 0 HG3 ARG A 8 1.142 -14.134 -13.193 1.00 0.00 H new ATOM 0 HD2 ARG A 8 3.195 -13.706 -14.295 1.00 0.00 H new ATOM 0 HD3 ARG A 8 2.787 -12.188 -13.520 1.00 0.00 H new ATOM 0 HE ARG A 8 4.452 -13.842 -11.806 1.00 0.00 H new ATOM 0 HH11 ARG A 8 4.462 -11.647 -14.571 1.00 0.00 H new ATOM 0 HH12 ARG A 8 6.136 -11.143 -14.311 1.00 0.00 H new ATOM 0 HH21 ARG A 8 6.602 -13.189 -11.479 1.00 0.00 H new ATOM 0 HH22 ARG A 8 7.341 -12.012 -12.569 1.00 0.00 H new ATOM 121 N ALA A 9 1.760 -15.159 -8.919 1.00 0.00 N ATOM 122 CA ALA A 9 2.333 -16.396 -8.403 1.00 0.00 C ATOM 123 C ALA A 9 1.252 -17.305 -7.829 1.00 0.00 C ATOM 124 O ALA A 9 1.421 -18.523 -7.767 1.00 0.00 O ATOM 125 CB ALA A 9 3.385 -16.090 -7.347 1.00 0.00 C ATOM 0 H ALA A 9 1.955 -14.334 -8.351 1.00 0.00 H new ATOM 0 HA ALA A 9 2.808 -16.921 -9.232 1.00 0.00 H new ATOM 0 HB1 ALA A 9 3.805 -17.023 -6.970 1.00 0.00 H new ATOM 0 HB2 ALA A 9 4.179 -15.487 -7.788 1.00 0.00 H new ATOM 0 HB3 ALA A 9 2.926 -15.540 -6.525 1.00 0.00 H new ATOM 131 N ARG A 10 0.143 -16.705 -7.409 1.00 0.00 N ATOM 132 CA ARG A 10 -0.964 -17.461 -6.837 1.00 0.00 C ATOM 133 C ARG A 10 -1.691 -18.261 -7.914 1.00 0.00 C ATOM 134 O ARG A 10 -2.145 -19.379 -7.671 1.00 0.00 O ATOM 135 CB ARG A 10 -1.946 -16.519 -6.137 1.00 0.00 C ATOM 136 CG ARG A 10 -1.818 -16.522 -4.623 1.00 0.00 C ATOM 137 CD ARG A 10 -2.119 -15.152 -4.036 1.00 0.00 C ATOM 138 NE ARG A 10 -3.106 -15.221 -2.962 1.00 0.00 N ATOM 139 CZ ARG A 10 -4.392 -15.487 -3.163 1.00 0.00 C ATOM 140 NH1 ARG A 10 -4.843 -15.709 -4.389 1.00 0.00 N ATOM 141 NH2 ARG A 10 -5.230 -15.532 -2.134 1.00 0.00 N ATOM 0 H ARG A 10 -0.012 -15.698 -7.454 1.00 0.00 H new ATOM 0 HA ARG A 10 -0.555 -18.158 -6.105 1.00 0.00 H new ATOM 0 HB2 ARG A 10 -1.788 -15.505 -6.505 1.00 0.00 H new ATOM 0 HB3 ARG A 10 -2.963 -16.802 -6.408 1.00 0.00 H new ATOM 0 HG2 ARG A 10 -2.502 -17.258 -4.200 1.00 0.00 H new ATOM 0 HG3 ARG A 10 -0.809 -16.826 -4.343 1.00 0.00 H new ATOM 0 HD2 ARG A 10 -1.198 -14.711 -3.654 1.00 0.00 H new ATOM 0 HD3 ARG A 10 -2.485 -14.493 -4.823 1.00 0.00 H new ATOM 0 HE ARG A 10 -2.791 -15.056 -2.006 1.00 0.00 H new ATOM 0 HH11 ARG A 10 -4.202 -15.676 -5.182 1.00 0.00 H new ATOM 0 HH12 ARG A 10 -5.831 -15.913 -4.540 1.00 0.00 H new ATOM 0 HH21 ARG A 10 -4.886 -15.362 -1.189 1.00 0.00 H new ATOM 0 HH22 ARG A 10 -6.217 -15.736 -2.289 1.00 0.00 H new ATOM 155 N MET A 11 -1.797 -17.680 -9.105 1.00 0.00 N ATOM 156 CA MET A 11 -2.467 -18.340 -10.220 1.00 0.00 C ATOM 157 C MET A 11 -1.457 -19.047 -11.118 1.00 0.00 C ATOM 158 O MET A 11 -0.262 -18.754 -11.078 1.00 0.00 O ATOM 159 CB MET A 11 -3.268 -17.323 -11.035 1.00 0.00 C ATOM 160 CG MET A 11 -2.412 -16.232 -11.656 1.00 0.00 C ATOM 161 SD MET A 11 -3.215 -14.618 -11.627 1.00 0.00 S ATOM 162 CE MET A 11 -4.810 -15.020 -12.336 1.00 0.00 C ATOM 0 H MET A 11 -1.428 -16.754 -9.323 1.00 0.00 H new ATOM 0 HA MET A 11 -3.149 -19.086 -9.812 1.00 0.00 H new ATOM 0 HB2 MET A 11 -3.805 -17.846 -11.826 1.00 0.00 H new ATOM 0 HB3 MET A 11 -4.017 -16.863 -10.391 1.00 0.00 H new ATOM 0 HG2 MET A 11 -1.464 -16.171 -11.122 1.00 0.00 H new ATOM 0 HG3 MET A 11 -2.181 -16.500 -12.687 1.00 0.00 H new ATOM 0 HE1 MET A 11 -5.355 -14.101 -12.549 1.00 0.00 H new ATOM 0 HE2 MET A 11 -4.667 -15.580 -13.260 1.00 0.00 H new ATOM 0 HE3 MET A 11 -5.380 -15.625 -11.630 1.00 0.00 H new ATOM 172 N THR A 12 -1.945 -19.981 -11.929 1.00 0.00 N ATOM 173 CA THR A 12 -1.086 -20.730 -12.836 1.00 0.00 C ATOM 174 C THR A 12 -0.708 -19.893 -14.053 1.00 0.00 C ATOM 175 O THR A 12 -1.268 -18.820 -14.279 1.00 0.00 O ATOM 176 CB THR A 12 -1.767 -22.028 -13.312 1.00 0.00 C ATOM 177 OG1 THR A 12 -3.081 -21.740 -13.801 1.00 0.00 O ATOM 178 CG2 THR A 12 -1.851 -23.041 -12.180 1.00 0.00 C ATOM 0 H THR A 12 -2.931 -20.236 -11.976 1.00 0.00 H new ATOM 0 HA THR A 12 -0.184 -20.984 -12.279 1.00 0.00 H new ATOM 0 HB THR A 12 -1.167 -22.455 -14.116 1.00 0.00 H new ATOM 0 HG1 THR A 12 -3.507 -22.569 -14.103 1.00 0.00 H new ATOM 0 HG21 THR A 12 -2.335 -23.949 -12.539 1.00 0.00 H new ATOM 0 HG22 THR A 12 -0.847 -23.280 -11.830 1.00 0.00 H new ATOM 0 HG23 THR A 12 -2.431 -22.621 -11.358 1.00 0.00 H new ATOM 186 N HIS A 13 0.246 -20.390 -14.834 1.00 0.00 N ATOM 187 CA HIS A 13 0.699 -19.687 -16.029 1.00 0.00 C ATOM 188 C HIS A 13 -0.452 -19.487 -17.011 1.00 0.00 C ATOM 189 O HIS A 13 -0.628 -18.402 -17.566 1.00 0.00 O ATOM 190 CB HIS A 13 1.832 -20.461 -16.704 1.00 0.00 C ATOM 191 CG HIS A 13 3.129 -20.395 -15.958 1.00 0.00 C ATOM 192 ND1 HIS A 13 3.672 -21.475 -15.295 1.00 0.00 N ATOM 193 CD2 HIS A 13 3.993 -19.369 -15.774 1.00 0.00 C ATOM 194 CE1 HIS A 13 4.813 -21.117 -14.734 1.00 0.00 C ATOM 195 NE2 HIS A 13 5.031 -19.844 -15.010 1.00 0.00 N ATOM 0 H HIS A 13 0.720 -21.276 -14.661 1.00 0.00 H new ATOM 0 HA HIS A 13 1.069 -18.708 -15.726 1.00 0.00 H new ATOM 0 HB2 HIS A 13 1.536 -21.505 -16.810 1.00 0.00 H new ATOM 0 HB3 HIS A 13 1.980 -20.068 -17.710 1.00 0.00 H new ATOM 0 HD2 HIS A 13 3.886 -18.365 -16.156 1.00 0.00 H new ATOM 0 HE1 HIS A 13 5.458 -21.756 -14.149 1.00 0.00 H new ATOM 0 HE2 HIS A 13 5.839 -19.301 -14.705 1.00 0.00 H new ATOM 203 N LYS A 14 -1.232 -20.541 -17.222 1.00 0.00 N ATOM 204 CA LYS A 14 -2.367 -20.483 -18.136 1.00 0.00 C ATOM 205 C LYS A 14 -3.439 -19.533 -17.613 1.00 0.00 C ATOM 206 O LYS A 14 -4.059 -18.800 -18.382 1.00 0.00 O ATOM 207 CB LYS A 14 -2.960 -21.880 -18.335 1.00 0.00 C ATOM 208 CG LYS A 14 -4.115 -21.915 -19.320 1.00 0.00 C ATOM 209 CD LYS A 14 -5.018 -23.114 -19.079 1.00 0.00 C ATOM 210 CE LYS A 14 -5.983 -22.863 -17.930 1.00 0.00 C ATOM 211 NZ LYS A 14 -7.091 -21.950 -18.327 1.00 0.00 N ATOM 0 H LYS A 14 -1.099 -21.447 -16.772 1.00 0.00 H new ATOM 0 HA LYS A 14 -2.010 -20.107 -19.095 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -2.176 -22.552 -18.683 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -3.302 -22.261 -17.373 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -4.696 -20.997 -19.233 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -3.726 -21.950 -20.337 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -5.580 -23.335 -19.986 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -4.409 -23.991 -18.859 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -6.398 -23.812 -17.590 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -5.441 -22.432 -17.088 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -7.814 -21.937 -17.580 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -6.717 -20.989 -18.464 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -7.516 -22.286 -19.215 1.00 0.00 H new ATOM 225 N GLU A 15 -3.651 -19.552 -16.300 1.00 0.00 N ATOM 226 CA GLU A 15 -4.648 -18.690 -15.676 1.00 0.00 C ATOM 227 C GLU A 15 -4.324 -17.219 -15.918 1.00 0.00 C ATOM 228 O GLU A 15 -5.166 -16.456 -16.392 1.00 0.00 O ATOM 229 CB GLU A 15 -4.723 -18.967 -14.173 1.00 0.00 C ATOM 230 CG GLU A 15 -5.955 -18.377 -13.506 1.00 0.00 C ATOM 231 CD GLU A 15 -6.084 -18.787 -12.052 1.00 0.00 C ATOM 232 OE1 GLU A 15 -5.488 -19.817 -11.672 1.00 0.00 O ATOM 233 OE2 GLU A 15 -6.780 -18.080 -11.295 1.00 0.00 O ATOM 0 H GLU A 15 -3.146 -20.154 -15.649 1.00 0.00 H new ATOM 0 HA GLU A 15 -5.615 -18.909 -16.128 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -4.713 -20.045 -14.010 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -3.832 -18.563 -13.693 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -5.913 -17.290 -13.571 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -6.845 -18.694 -14.049 1.00 0.00 H new ATOM 240 N PHE A 16 -3.097 -16.827 -15.589 1.00 0.00 N ATOM 241 CA PHE A 16 -2.661 -15.448 -15.769 1.00 0.00 C ATOM 242 C PHE A 16 -2.822 -15.012 -17.223 1.00 0.00 C ATOM 243 O PHE A 16 -3.069 -13.841 -17.507 1.00 0.00 O ATOM 244 CB PHE A 16 -1.202 -15.291 -15.337 1.00 0.00 C ATOM 245 CG PHE A 16 -0.684 -13.887 -15.469 1.00 0.00 C ATOM 246 CD1 PHE A 16 -0.862 -12.970 -14.447 1.00 0.00 C ATOM 247 CD2 PHE A 16 -0.021 -13.485 -16.618 1.00 0.00 C ATOM 248 CE1 PHE A 16 -0.387 -11.677 -14.565 1.00 0.00 C ATOM 249 CE2 PHE A 16 0.456 -12.194 -16.742 1.00 0.00 C ATOM 250 CZ PHE A 16 0.272 -11.289 -15.715 1.00 0.00 C ATOM 0 H PHE A 16 -2.387 -17.446 -15.196 1.00 0.00 H new ATOM 0 HA PHE A 16 -3.288 -14.811 -15.145 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -1.103 -15.610 -14.300 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -0.581 -15.957 -15.936 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -1.378 -13.268 -13.547 1.00 0.00 H new ATOM 0 HD2 PHE A 16 0.124 -14.188 -17.425 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -0.531 -10.972 -13.760 1.00 0.00 H new ATOM 0 HE2 PHE A 16 0.972 -11.893 -17.641 1.00 0.00 H new ATOM 0 HZ PHE A 16 0.643 -10.279 -15.811 1.00 0.00 H new ATOM 260 N ASN A 17 -2.679 -15.964 -18.139 1.00 0.00 N ATOM 261 CA ASN A 17 -2.807 -15.679 -19.564 1.00 0.00 C ATOM 262 C ASN A 17 -4.252 -15.347 -19.924 1.00 0.00 C ATOM 263 O ASN A 17 -4.514 -14.431 -20.703 1.00 0.00 O ATOM 264 CB ASN A 17 -2.326 -16.874 -20.389 1.00 0.00 C ATOM 265 CG ASN A 17 -2.357 -16.597 -21.880 1.00 0.00 C ATOM 266 OD1 ASN A 17 -3.391 -16.753 -22.530 1.00 0.00 O ATOM 267 ND2 ASN A 17 -1.220 -16.185 -22.429 1.00 0.00 N ATOM 0 H ASN A 17 -2.475 -16.939 -17.920 1.00 0.00 H new ATOM 0 HA ASN A 17 -2.186 -14.813 -19.794 1.00 0.00 H new ATOM 0 HB2 ASN A 17 -1.310 -17.132 -20.091 1.00 0.00 H new ATOM 0 HB3 ASN A 17 -2.952 -17.739 -20.170 1.00 0.00 H new ATOM 0 HD21 ASN A 17 -1.180 -15.984 -23.428 1.00 0.00 H new ATOM 0 HD22 ASN A 17 -0.387 -16.070 -21.851 1.00 0.00 H new ATOM 274 N TYR A 18 -5.186 -16.099 -19.352 1.00 0.00 N ATOM 275 CA TYR A 18 -6.605 -15.886 -19.614 1.00 0.00 C ATOM 276 C TYR A 18 -7.054 -14.519 -19.108 1.00 0.00 C ATOM 277 O TYR A 18 -7.612 -13.718 -19.858 1.00 0.00 O ATOM 278 CB TYR A 18 -7.438 -16.986 -18.953 1.00 0.00 C ATOM 279 CG TYR A 18 -8.927 -16.727 -18.996 1.00 0.00 C ATOM 280 CD1 TYR A 18 -9.550 -15.979 -18.005 1.00 0.00 C ATOM 281 CD2 TYR A 18 -9.710 -17.229 -20.028 1.00 0.00 C ATOM 282 CE1 TYR A 18 -10.911 -15.741 -18.040 1.00 0.00 C ATOM 283 CE2 TYR A 18 -11.070 -16.994 -20.072 1.00 0.00 C ATOM 284 CZ TYR A 18 -11.666 -16.249 -19.075 1.00 0.00 C ATOM 285 OH TYR A 18 -13.021 -16.014 -19.115 1.00 0.00 O ATOM 0 H TYR A 18 -4.986 -16.861 -18.704 1.00 0.00 H new ATOM 0 HA TYR A 18 -6.758 -15.922 -20.693 1.00 0.00 H new ATOM 0 HB2 TYR A 18 -7.228 -17.935 -19.447 1.00 0.00 H new ATOM 0 HB3 TYR A 18 -7.126 -17.092 -17.914 1.00 0.00 H new ATOM 0 HD1 TYR A 18 -8.961 -15.577 -17.194 1.00 0.00 H new ATOM 0 HD2 TYR A 18 -9.247 -17.813 -20.809 1.00 0.00 H new ATOM 0 HE1 TYR A 18 -11.381 -15.160 -17.260 1.00 0.00 H new ATOM 0 HE2 TYR A 18 -11.664 -17.391 -20.882 1.00 0.00 H new ATOM 0 HH TYR A 18 -13.225 -15.192 -18.623 1.00 0.00 H new ATOM 295 N LYS A 19 -6.805 -14.258 -17.829 1.00 0.00 N ATOM 296 CA LYS A 19 -7.181 -12.988 -17.219 1.00 0.00 C ATOM 297 C LYS A 19 -6.614 -11.815 -18.013 1.00 0.00 C ATOM 298 O LYS A 19 -7.339 -10.886 -18.369 1.00 0.00 O ATOM 299 CB LYS A 19 -6.685 -12.926 -15.773 1.00 0.00 C ATOM 300 CG LYS A 19 -7.566 -13.684 -14.795 1.00 0.00 C ATOM 301 CD LYS A 19 -7.281 -15.176 -14.828 1.00 0.00 C ATOM 302 CE LYS A 19 -8.113 -15.925 -13.798 1.00 0.00 C ATOM 303 NZ LYS A 19 -8.746 -17.143 -14.376 1.00 0.00 N ATOM 0 H LYS A 19 -6.344 -14.910 -17.194 1.00 0.00 H new ATOM 0 HA LYS A 19 -8.269 -12.918 -17.226 1.00 0.00 H new ATOM 0 HB2 LYS A 19 -5.674 -13.330 -15.727 1.00 0.00 H new ATOM 0 HB3 LYS A 19 -6.626 -11.883 -15.462 1.00 0.00 H new ATOM 0 HG2 LYS A 19 -7.402 -13.304 -13.787 1.00 0.00 H new ATOM 0 HG3 LYS A 19 -8.614 -13.508 -15.036 1.00 0.00 H new ATOM 0 HD2 LYS A 19 -7.494 -15.566 -15.823 1.00 0.00 H new ATOM 0 HD3 LYS A 19 -6.222 -15.350 -14.638 1.00 0.00 H new ATOM 0 HE2 LYS A 19 -7.480 -16.209 -12.957 1.00 0.00 H new ATOM 0 HE3 LYS A 19 -8.887 -15.265 -13.406 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 -8.779 -17.892 -13.656 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 -9.713 -16.918 -14.686 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 -8.189 -17.470 -15.191 1.00 0.00 H new ATOM 317 N SER A 20 -5.315 -11.865 -18.287 1.00 0.00 N ATOM 318 CA SER A 20 -4.650 -10.805 -19.037 1.00 0.00 C ATOM 319 C SER A 20 -5.285 -10.634 -20.414 1.00 0.00 C ATOM 320 O SER A 20 -5.476 -9.515 -20.887 1.00 0.00 O ATOM 321 CB SER A 20 -3.159 -11.113 -19.185 1.00 0.00 C ATOM 322 OG SER A 20 -2.635 -10.540 -20.371 1.00 0.00 O ATOM 0 H SER A 20 -4.701 -12.628 -18.001 1.00 0.00 H new ATOM 0 HA SER A 20 -4.767 -9.874 -18.483 1.00 0.00 H new ATOM 0 HB2 SER A 20 -2.617 -10.728 -18.321 1.00 0.00 H new ATOM 0 HB3 SER A 20 -3.007 -12.192 -19.201 1.00 0.00 H new ATOM 0 HG SER A 20 -1.680 -10.750 -20.442 1.00 0.00 H new ATOM 328 N ASN A 21 -5.610 -11.754 -21.052 1.00 0.00 N ATOM 329 CA ASN A 21 -6.222 -11.730 -22.375 1.00 0.00 C ATOM 330 C ASN A 21 -7.492 -10.884 -22.372 1.00 0.00 C ATOM 331 O ASN A 21 -7.691 -10.041 -23.246 1.00 0.00 O ATOM 332 CB ASN A 21 -6.545 -13.153 -22.837 1.00 0.00 C ATOM 333 CG ASN A 21 -6.931 -13.211 -24.302 1.00 0.00 C ATOM 334 OD1 ASN A 21 -8.082 -13.487 -24.642 1.00 0.00 O ATOM 335 ND2 ASN A 21 -5.968 -12.952 -25.178 1.00 0.00 N ATOM 0 H ASN A 21 -5.460 -12.689 -20.674 1.00 0.00 H new ATOM 0 HA ASN A 21 -5.510 -11.283 -23.069 1.00 0.00 H new ATOM 0 HB2 ASN A 21 -5.679 -13.793 -22.667 1.00 0.00 H new ATOM 0 HB3 ASN A 21 -7.360 -13.552 -22.233 1.00 0.00 H new ATOM 0 HD21 ASN A 21 -6.168 -12.977 -26.178 1.00 0.00 H new ATOM 0 HD22 ASN A 21 -5.028 -12.728 -24.851 1.00 0.00 H new ATOM 342 N VAL A 22 -8.347 -11.115 -21.381 1.00 0.00 N ATOM 343 CA VAL A 22 -9.597 -10.373 -21.262 1.00 0.00 C ATOM 344 C VAL A 22 -9.341 -8.923 -20.869 1.00 0.00 C ATOM 345 O VAL A 22 -10.047 -8.015 -21.308 1.00 0.00 O ATOM 346 CB VAL A 22 -10.535 -11.017 -20.224 1.00 0.00 C ATOM 347 CG1 VAL A 22 -11.888 -10.323 -20.223 1.00 0.00 C ATOM 348 CG2 VAL A 22 -10.690 -12.506 -20.497 1.00 0.00 C ATOM 0 H VAL A 22 -8.197 -11.810 -20.649 1.00 0.00 H new ATOM 0 HA VAL A 22 -10.076 -10.401 -22.241 1.00 0.00 H new ATOM 0 HB VAL A 22 -10.092 -10.897 -19.236 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -12.537 -10.792 -19.483 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -11.757 -9.270 -19.975 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -12.342 -10.409 -21.210 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -11.356 -12.945 -19.754 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -11.110 -12.652 -21.492 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -9.715 -12.990 -20.441 1.00 0.00 H new ATOM 358 N CYS A 23 -8.325 -8.712 -20.039 1.00 0.00 N ATOM 359 CA CYS A 23 -7.972 -7.371 -19.587 1.00 0.00 C ATOM 360 C CYS A 23 -7.756 -6.436 -20.773 1.00 0.00 C ATOM 361 O CYS A 23 -8.262 -5.314 -20.792 1.00 0.00 O ATOM 362 CB CYS A 23 -6.711 -7.417 -18.723 1.00 0.00 C ATOM 363 SG CYS A 23 -7.011 -7.901 -16.992 1.00 0.00 S ATOM 0 H CYS A 23 -7.731 -9.453 -19.666 1.00 0.00 H new ATOM 0 HA CYS A 23 -8.799 -6.986 -18.990 1.00 0.00 H new ATOM 0 HB2 CYS A 23 -6.005 -8.118 -19.168 1.00 0.00 H new ATOM 0 HB3 CYS A 23 -6.238 -6.435 -18.738 1.00 0.00 H new ATOM 368 N ASN A 24 -7.002 -6.906 -21.761 1.00 0.00 N ATOM 369 CA ASN A 24 -6.719 -6.113 -22.951 1.00 0.00 C ATOM 370 C ASN A 24 -8.000 -5.818 -23.725 1.00 0.00 C ATOM 371 O ASN A 24 -8.031 -4.934 -24.580 1.00 0.00 O ATOM 372 CB ASN A 24 -5.722 -6.844 -23.852 1.00 0.00 C ATOM 373 CG ASN A 24 -5.107 -5.931 -24.895 1.00 0.00 C ATOM 374 OD1 ASN A 24 -4.489 -4.919 -24.563 1.00 0.00 O ATOM 375 ND2 ASN A 24 -5.274 -6.285 -26.164 1.00 0.00 N ATOM 0 H ASN A 24 -6.576 -7.833 -21.761 1.00 0.00 H new ATOM 0 HA ASN A 24 -6.283 -5.167 -22.631 1.00 0.00 H new ATOM 0 HB2 ASN A 24 -4.931 -7.275 -23.239 1.00 0.00 H new ATOM 0 HB3 ASN A 24 -6.226 -7.672 -24.350 1.00 0.00 H new ATOM 0 HD21 ASN A 24 -4.883 -5.710 -26.910 1.00 0.00 H new ATOM 0 HD22 ASN A 24 -5.794 -7.132 -26.393 1.00 0.00 H new ATOM 382 N GLY A 25 -9.056 -6.565 -23.419 1.00 0.00 N ATOM 383 CA GLY A 25 -10.326 -6.367 -24.093 1.00 0.00 C ATOM 384 C GLY A 25 -11.197 -5.339 -23.397 1.00 0.00 C ATOM 385 O GLY A 25 -11.955 -4.617 -24.045 1.00 0.00 O ATOM 0 H GLY A 25 -9.055 -7.304 -22.716 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -10.144 -6.049 -25.120 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -10.859 -7.316 -24.143 1.00 0.00 H new ATOM 389 N CYS A 26 -11.091 -5.274 -22.075 1.00 0.00 N ATOM 390 CA CYS A 26 -11.875 -4.328 -21.290 1.00 0.00 C ATOM 391 C CYS A 26 -11.778 -2.923 -21.876 1.00 0.00 C ATOM 392 O CYS A 26 -12.711 -2.128 -21.768 1.00 0.00 O ATOM 393 CB CYS A 26 -11.398 -4.320 -19.836 1.00 0.00 C ATOM 394 SG CYS A 26 -12.261 -3.115 -18.777 1.00 0.00 S ATOM 0 H CYS A 26 -10.469 -5.866 -21.524 1.00 0.00 H new ATOM 0 HA CYS A 26 -12.917 -4.645 -21.322 1.00 0.00 H new ATOM 0 HB2 CYS A 26 -11.530 -5.317 -19.416 1.00 0.00 H new ATOM 0 HB3 CYS A 26 -10.330 -4.105 -19.817 1.00 0.00 H new ATOM 399 N GLY A 27 -10.642 -2.624 -22.498 1.00 0.00 N ATOM 400 CA GLY A 27 -10.444 -1.315 -23.092 1.00 0.00 C ATOM 401 C GLY A 27 -9.106 -0.706 -22.721 1.00 0.00 C ATOM 402 O GLY A 27 -8.084 -1.393 -22.714 1.00 0.00 O ATOM 0 H GLY A 27 -9.855 -3.265 -22.601 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -10.514 -1.397 -24.177 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -11.245 -0.649 -22.771 1.00 0.00 H new ATOM 406 N ASP A 28 -9.111 0.586 -22.414 1.00 0.00 N ATOM 407 CA ASP A 28 -7.888 1.287 -22.039 1.00 0.00 C ATOM 408 C ASP A 28 -7.725 1.322 -20.522 1.00 0.00 C ATOM 409 O ASP A 28 -7.068 2.210 -19.980 1.00 0.00 O ATOM 410 CB ASP A 28 -7.901 2.712 -22.596 1.00 0.00 C ATOM 411 CG ASP A 28 -8.083 2.744 -24.100 1.00 0.00 C ATOM 412 OD1 ASP A 28 -9.178 2.373 -24.573 1.00 0.00 O ATOM 413 OD2 ASP A 28 -7.132 3.140 -24.805 1.00 0.00 O ATOM 0 H ASP A 28 -9.948 1.169 -22.417 1.00 0.00 H new ATOM 0 HA ASP A 28 -7.043 0.746 -22.465 1.00 0.00 H new ATOM 0 HB2 ASP A 28 -8.705 3.276 -22.124 1.00 0.00 H new ATOM 0 HB3 ASP A 28 -6.967 3.209 -22.335 1.00 0.00 H new ATOM 418 N GLN A 29 -8.329 0.351 -19.845 1.00 0.00 N ATOM 419 CA GLN A 29 -8.251 0.273 -18.391 1.00 0.00 C ATOM 420 C GLN A 29 -7.434 -0.939 -17.954 1.00 0.00 C ATOM 421 O GLN A 29 -7.626 -1.468 -16.859 1.00 0.00 O ATOM 422 CB GLN A 29 -9.655 0.200 -17.788 1.00 0.00 C ATOM 423 CG GLN A 29 -10.241 1.560 -17.445 1.00 0.00 C ATOM 424 CD GLN A 29 -10.734 2.308 -18.668 1.00 0.00 C ATOM 425 OE1 GLN A 29 -11.663 1.869 -19.346 1.00 0.00 O ATOM 426 NE2 GLN A 29 -10.113 3.445 -18.957 1.00 0.00 N ATOM 0 H GLN A 29 -8.877 -0.392 -20.279 1.00 0.00 H new ATOM 0 HA GLN A 29 -7.754 1.173 -18.030 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -10.318 -0.305 -18.491 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -9.623 -0.411 -16.886 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -11.067 1.430 -16.746 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -9.485 2.159 -16.937 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -9.347 3.772 -18.368 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -10.401 3.992 -19.768 1.00 0.00 H new ATOM 435 N VAL A 30 -6.522 -1.373 -18.818 1.00 0.00 N ATOM 436 CA VAL A 30 -5.674 -2.522 -18.520 1.00 0.00 C ATOM 437 C VAL A 30 -5.023 -2.384 -17.148 1.00 0.00 C ATOM 438 O VAL A 30 -5.071 -3.304 -16.332 1.00 0.00 O ATOM 439 CB VAL A 30 -4.573 -2.696 -19.583 1.00 0.00 C ATOM 440 CG1 VAL A 30 -3.658 -3.856 -19.219 1.00 0.00 C ATOM 441 CG2 VAL A 30 -5.188 -2.904 -20.959 1.00 0.00 C ATOM 0 H VAL A 30 -6.351 -0.947 -19.729 1.00 0.00 H new ATOM 0 HA VAL A 30 -6.318 -3.401 -18.526 1.00 0.00 H new ATOM 0 HB VAL A 30 -3.974 -1.786 -19.612 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -2.886 -3.964 -19.981 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -3.190 -3.661 -18.254 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -4.241 -4.775 -19.161 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -4.395 -3.025 -21.697 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -5.812 -3.797 -20.947 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -5.798 -2.039 -21.220 1.00 0.00 H new ATOM 451 N ALA A 31 -4.416 -1.228 -16.901 1.00 0.00 N ATOM 452 CA ALA A 31 -3.757 -0.969 -15.627 1.00 0.00 C ATOM 453 C ALA A 31 -4.696 -1.244 -14.457 1.00 0.00 C ATOM 454 O ALA A 31 -4.312 -1.880 -13.477 1.00 0.00 O ATOM 455 CB ALA A 31 -3.254 0.466 -15.575 1.00 0.00 C ATOM 0 H ALA A 31 -4.367 -0.456 -17.566 1.00 0.00 H new ATOM 0 HA ALA A 31 -2.906 -1.645 -15.543 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -2.764 0.645 -14.618 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -2.542 0.632 -16.384 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -4.095 1.151 -15.686 1.00 0.00 H new ATOM 461 N ALA A 32 -5.929 -0.760 -14.568 1.00 0.00 N ATOM 462 CA ALA A 32 -6.923 -0.954 -13.519 1.00 0.00 C ATOM 463 C ALA A 32 -7.324 -2.421 -13.408 1.00 0.00 C ATOM 464 O ALA A 32 -7.588 -2.922 -12.315 1.00 0.00 O ATOM 465 CB ALA A 32 -8.146 -0.089 -13.785 1.00 0.00 C ATOM 0 H ALA A 32 -6.263 -0.231 -15.373 1.00 0.00 H new ATOM 0 HA ALA A 32 -6.478 -0.653 -12.570 1.00 0.00 H new ATOM 0 HB1 ALA A 32 -8.880 -0.244 -12.994 1.00 0.00 H new ATOM 0 HB2 ALA A 32 -7.852 0.960 -13.807 1.00 0.00 H new ATOM 0 HB3 ALA A 32 -8.584 -0.363 -14.745 1.00 0.00 H new ATOM 471 N CYS A 33 -7.368 -3.105 -14.547 1.00 0.00 N ATOM 472 CA CYS A 33 -7.739 -4.515 -14.578 1.00 0.00 C ATOM 473 C CYS A 33 -6.803 -5.343 -13.702 1.00 0.00 C ATOM 474 O CYS A 33 -7.243 -6.234 -12.977 1.00 0.00 O ATOM 475 CB CYS A 33 -7.708 -5.040 -16.015 1.00 0.00 C ATOM 476 SG CYS A 33 -8.380 -6.722 -16.206 1.00 0.00 S ATOM 0 H CYS A 33 -7.151 -2.706 -15.460 1.00 0.00 H new ATOM 0 HA CYS A 33 -8.752 -4.608 -14.186 1.00 0.00 H new ATOM 0 HB2 CYS A 33 -8.274 -4.360 -16.651 1.00 0.00 H new ATOM 0 HB3 CYS A 33 -6.678 -5.029 -16.373 1.00 0.00 H new ATOM 481 N GLU A 34 -5.510 -5.041 -13.777 1.00 0.00 N ATOM 482 CA GLU A 34 -4.513 -5.758 -12.991 1.00 0.00 C ATOM 483 C GLU A 34 -4.234 -5.035 -11.676 1.00 0.00 C ATOM 484 O GLU A 34 -3.554 -5.565 -10.797 1.00 0.00 O ATOM 485 CB GLU A 34 -3.215 -5.908 -13.788 1.00 0.00 C ATOM 486 CG GLU A 34 -3.433 -6.332 -15.231 1.00 0.00 C ATOM 487 CD GLU A 34 -2.410 -7.348 -15.701 1.00 0.00 C ATOM 488 OE1 GLU A 34 -2.097 -8.277 -14.928 1.00 0.00 O ATOM 489 OE2 GLU A 34 -1.924 -7.214 -16.844 1.00 0.00 O ATOM 0 H GLU A 34 -5.129 -4.306 -14.373 1.00 0.00 H new ATOM 0 HA GLU A 34 -4.909 -6.748 -12.765 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -2.678 -4.960 -13.774 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -2.578 -6.642 -13.295 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -4.433 -6.754 -15.335 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -3.389 -5.453 -15.875 1.00 0.00 H new ATOM 496 N ALA A 35 -4.763 -3.823 -11.550 1.00 0.00 N ATOM 497 CA ALA A 35 -4.574 -3.029 -10.343 1.00 0.00 C ATOM 498 C ALA A 35 -4.917 -3.835 -9.095 1.00 0.00 C ATOM 499 O ALA A 35 -4.160 -3.847 -8.125 1.00 0.00 O ATOM 500 CB ALA A 35 -5.418 -1.764 -10.405 1.00 0.00 C ATOM 0 H ALA A 35 -5.326 -3.369 -12.269 1.00 0.00 H new ATOM 0 HA ALA A 35 -3.522 -2.749 -10.284 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -5.267 -1.181 -9.497 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -5.122 -1.171 -11.270 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -6.471 -2.033 -10.492 1.00 0.00 H new ATOM 506 N GLU A 36 -6.064 -4.508 -9.128 1.00 0.00 N ATOM 507 CA GLU A 36 -6.507 -5.316 -7.998 1.00 0.00 C ATOM 508 C GLU A 36 -6.382 -6.804 -8.311 1.00 0.00 C ATOM 509 O GLU A 36 -7.166 -7.620 -7.826 1.00 0.00 O ATOM 510 CB GLU A 36 -7.956 -4.979 -7.638 1.00 0.00 C ATOM 511 CG GLU A 36 -8.259 -3.491 -7.662 1.00 0.00 C ATOM 512 CD GLU A 36 -7.466 -2.717 -6.626 1.00 0.00 C ATOM 513 OE1 GLU A 36 -6.706 -3.353 -5.866 1.00 0.00 O ATOM 514 OE2 GLU A 36 -7.606 -1.478 -6.575 1.00 0.00 O ATOM 0 H GLU A 36 -6.702 -4.509 -9.924 1.00 0.00 H new ATOM 0 HA GLU A 36 -5.866 -5.086 -7.147 1.00 0.00 H new ATOM 0 HB2 GLU A 36 -8.622 -5.488 -8.334 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -8.175 -5.370 -6.644 1.00 0.00 H new ATOM 0 HG2 GLU A 36 -8.038 -3.095 -8.653 1.00 0.00 H new ATOM 0 HG3 GLU A 36 -9.324 -3.338 -7.488 1.00 0.00 H new ATOM 521 N CYS A 37 -5.390 -7.150 -9.125 1.00 0.00 N ATOM 522 CA CYS A 37 -5.160 -8.539 -9.505 1.00 0.00 C ATOM 523 C CYS A 37 -6.417 -9.149 -10.118 1.00 0.00 C ATOM 524 O CYS A 37 -6.863 -10.222 -9.709 1.00 0.00 O ATOM 525 CB CYS A 37 -4.725 -9.357 -8.287 1.00 0.00 C ATOM 526 SG CYS A 37 -3.405 -8.578 -7.302 1.00 0.00 S ATOM 0 H CYS A 37 -4.732 -6.487 -9.534 1.00 0.00 H new ATOM 0 HA CYS A 37 -4.366 -8.560 -10.251 1.00 0.00 H new ATOM 0 HB2 CYS A 37 -5.591 -9.524 -7.647 1.00 0.00 H new ATOM 0 HB3 CYS A 37 -4.383 -10.336 -8.623 1.00 0.00 H new ATOM 531 N PHE A 38 -6.983 -8.460 -11.103 1.00 0.00 N ATOM 532 CA PHE A 38 -8.190 -8.932 -11.772 1.00 0.00 C ATOM 533 C PHE A 38 -9.359 -9.007 -10.795 1.00 0.00 C ATOM 534 O PHE A 38 -10.320 -9.745 -11.016 1.00 0.00 O ATOM 535 CB PHE A 38 -7.945 -10.306 -12.399 1.00 0.00 C ATOM 536 CG PHE A 38 -6.640 -10.406 -13.135 1.00 0.00 C ATOM 537 CD1 PHE A 38 -6.258 -9.420 -14.031 1.00 0.00 C ATOM 538 CD2 PHE A 38 -5.795 -11.485 -12.932 1.00 0.00 C ATOM 539 CE1 PHE A 38 -5.057 -9.509 -14.710 1.00 0.00 C ATOM 540 CE2 PHE A 38 -4.593 -11.578 -13.607 1.00 0.00 C ATOM 541 CZ PHE A 38 -4.224 -10.590 -14.498 1.00 0.00 C ATOM 0 H PHE A 38 -6.625 -7.572 -11.456 1.00 0.00 H new ATOM 0 HA PHE A 38 -8.442 -8.221 -12.558 1.00 0.00 H new ATOM 0 HB2 PHE A 38 -7.970 -11.063 -11.616 1.00 0.00 H new ATOM 0 HB3 PHE A 38 -8.759 -10.533 -13.087 1.00 0.00 H new ATOM 0 HD1 PHE A 38 -6.906 -8.573 -14.201 1.00 0.00 H new ATOM 0 HD2 PHE A 38 -6.079 -12.262 -12.238 1.00 0.00 H new ATOM 0 HE1 PHE A 38 -4.771 -8.734 -15.405 1.00 0.00 H new ATOM 0 HE2 PHE A 38 -3.942 -12.423 -13.438 1.00 0.00 H new ATOM 0 HZ PHE A 38 -3.286 -10.662 -15.028 1.00 0.00 H new ATOM 551 N ARG A 39 -9.270 -8.239 -9.714 1.00 0.00 N ATOM 552 CA ARG A 39 -10.320 -8.219 -8.702 1.00 0.00 C ATOM 553 C ARG A 39 -10.857 -6.805 -8.504 1.00 0.00 C ATOM 554 O ARG A 39 -10.613 -6.176 -7.475 1.00 0.00 O ATOM 555 CB ARG A 39 -9.789 -8.765 -7.376 1.00 0.00 C ATOM 556 CG ARG A 39 -10.870 -9.347 -6.480 1.00 0.00 C ATOM 557 CD ARG A 39 -11.490 -8.280 -5.591 1.00 0.00 C ATOM 558 NE ARG A 39 -12.209 -8.860 -4.460 1.00 0.00 N ATOM 559 CZ ARG A 39 -13.383 -9.472 -4.571 1.00 0.00 C ATOM 560 NH1 ARG A 39 -13.966 -9.584 -5.756 1.00 0.00 N ATOM 561 NH2 ARG A 39 -13.975 -9.975 -3.495 1.00 0.00 N ATOM 0 H ARG A 39 -8.482 -7.622 -9.516 1.00 0.00 H new ATOM 0 HA ARG A 39 -11.136 -8.854 -9.048 1.00 0.00 H new ATOM 0 HB2 ARG A 39 -9.046 -9.535 -7.582 1.00 0.00 H new ATOM 0 HB3 ARG A 39 -9.278 -7.964 -6.841 1.00 0.00 H new ATOM 0 HG2 ARG A 39 -11.645 -9.806 -7.094 1.00 0.00 H new ATOM 0 HG3 ARG A 39 -10.445 -10.136 -5.860 1.00 0.00 H new ATOM 0 HD2 ARG A 39 -10.708 -7.617 -5.222 1.00 0.00 H new ATOM 0 HD3 ARG A 39 -12.174 -7.669 -6.181 1.00 0.00 H new ATOM 0 HE ARG A 39 -11.787 -8.792 -3.534 1.00 0.00 H new ATOM 0 HH11 ARG A 39 -13.513 -9.200 -6.585 1.00 0.00 H new ATOM 0 HH12 ARG A 39 -14.867 -10.054 -5.839 1.00 0.00 H new ATOM 0 HH21 ARG A 39 -13.529 -9.892 -2.582 1.00 0.00 H new ATOM 0 HH22 ARG A 39 -14.876 -10.445 -3.581 1.00 0.00 H new ATOM 575 N ASN A 40 -11.589 -6.311 -9.497 1.00 0.00 N ATOM 576 CA ASN A 40 -12.159 -4.970 -9.433 1.00 0.00 C ATOM 577 C ASN A 40 -13.409 -4.868 -10.302 1.00 0.00 C ATOM 578 O ASN A 40 -13.684 -5.749 -11.117 1.00 0.00 O ATOM 579 CB ASN A 40 -11.127 -3.932 -9.880 1.00 0.00 C ATOM 580 CG ASN A 40 -10.424 -4.332 -11.162 1.00 0.00 C ATOM 581 OD1 ASN A 40 -11.000 -4.261 -12.248 1.00 0.00 O ATOM 582 ND2 ASN A 40 -9.171 -4.754 -11.042 1.00 0.00 N ATOM 0 H ASN A 40 -11.802 -6.819 -10.356 1.00 0.00 H new ATOM 0 HA ASN A 40 -12.440 -4.771 -8.399 1.00 0.00 H new ATOM 0 HB2 ASN A 40 -11.621 -2.971 -10.024 1.00 0.00 H new ATOM 0 HB3 ASN A 40 -10.388 -3.795 -9.091 1.00 0.00 H new ATOM 0 HD21 ASN A 40 -8.646 -5.036 -11.870 1.00 0.00 H new ATOM 0 HD22 ASN A 40 -8.733 -4.797 -10.122 1.00 0.00 H new ATOM 589 N ASP A 41 -14.161 -3.788 -10.122 1.00 0.00 N ATOM 590 CA ASP A 41 -15.382 -3.570 -10.890 1.00 0.00 C ATOM 591 C ASP A 41 -15.065 -3.375 -12.369 1.00 0.00 C ATOM 592 O ASP A 41 -15.829 -3.794 -13.239 1.00 0.00 O ATOM 593 CB ASP A 41 -16.137 -2.353 -10.352 1.00 0.00 C ATOM 594 CG ASP A 41 -17.641 -2.527 -10.425 1.00 0.00 C ATOM 595 OD1 ASP A 41 -18.134 -3.604 -10.028 1.00 0.00 O ATOM 596 OD2 ASP A 41 -18.325 -1.586 -10.878 1.00 0.00 O ATOM 0 H ASP A 41 -13.947 -3.050 -9.451 1.00 0.00 H new ATOM 0 HA ASP A 41 -16.012 -4.454 -10.785 1.00 0.00 H new ATOM 0 HB2 ASP A 41 -15.844 -2.176 -9.317 1.00 0.00 H new ATOM 0 HB3 ASP A 41 -15.848 -1.469 -10.921 1.00 0.00 H new ATOM 601 N VAL A 42 -13.934 -2.734 -12.648 1.00 0.00 N ATOM 602 CA VAL A 42 -13.517 -2.483 -14.022 1.00 0.00 C ATOM 603 C VAL A 42 -13.459 -3.778 -14.825 1.00 0.00 C ATOM 604 O VAL A 42 -14.013 -3.867 -15.921 1.00 0.00 O ATOM 605 CB VAL A 42 -12.138 -1.798 -14.073 1.00 0.00 C ATOM 606 CG1 VAL A 42 -11.595 -1.797 -15.494 1.00 0.00 C ATOM 607 CG2 VAL A 42 -12.226 -0.382 -13.526 1.00 0.00 C ATOM 0 H VAL A 42 -13.291 -2.379 -11.940 1.00 0.00 H new ATOM 0 HA VAL A 42 -14.261 -1.820 -14.462 1.00 0.00 H new ATOM 0 HB VAL A 42 -11.448 -2.362 -13.446 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -10.620 -1.309 -15.511 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -11.493 -2.824 -15.845 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -12.282 -1.257 -16.146 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -11.243 0.087 -13.570 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -12.930 0.196 -14.124 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -12.568 -0.412 -12.491 1.00 0.00 H new ATOM 617 N TYR A 43 -12.786 -4.781 -14.271 1.00 0.00 N ATOM 618 CA TYR A 43 -12.654 -6.072 -14.936 1.00 0.00 C ATOM 619 C TYR A 43 -13.944 -6.878 -14.821 1.00 0.00 C ATOM 620 O TYR A 43 -14.403 -7.480 -15.792 1.00 0.00 O ATOM 621 CB TYR A 43 -11.490 -6.862 -14.336 1.00 0.00 C ATOM 622 CG TYR A 43 -11.354 -8.260 -14.896 1.00 0.00 C ATOM 623 CD1 TYR A 43 -11.265 -8.475 -16.266 1.00 0.00 C ATOM 624 CD2 TYR A 43 -11.314 -9.365 -14.055 1.00 0.00 C ATOM 625 CE1 TYR A 43 -11.141 -9.750 -16.782 1.00 0.00 C ATOM 626 CE2 TYR A 43 -11.190 -10.644 -14.562 1.00 0.00 C ATOM 627 CZ TYR A 43 -11.104 -10.831 -15.926 1.00 0.00 C ATOM 628 OH TYR A 43 -10.980 -12.103 -16.436 1.00 0.00 O ATOM 0 H TYR A 43 -12.324 -4.725 -13.364 1.00 0.00 H new ATOM 0 HA TYR A 43 -12.454 -5.890 -15.992 1.00 0.00 H new ATOM 0 HB2 TYR A 43 -10.563 -6.317 -14.513 1.00 0.00 H new ATOM 0 HB3 TYR A 43 -11.622 -6.924 -13.256 1.00 0.00 H new ATOM 0 HD1 TYR A 43 -11.293 -7.631 -16.939 1.00 0.00 H new ATOM 0 HD2 TYR A 43 -11.381 -9.222 -12.987 1.00 0.00 H new ATOM 0 HE1 TYR A 43 -11.073 -9.900 -17.849 1.00 0.00 H new ATOM 0 HE2 TYR A 43 -11.161 -11.492 -13.894 1.00 0.00 H new ATOM 0 HH TYR A 43 -10.969 -12.751 -15.701 1.00 0.00 H new ATOM 638 N THR A 44 -14.525 -6.885 -13.626 1.00 0.00 N ATOM 639 CA THR A 44 -15.762 -7.617 -13.381 1.00 0.00 C ATOM 640 C THR A 44 -16.865 -7.166 -14.331 1.00 0.00 C ATOM 641 O THR A 44 -17.716 -7.960 -14.731 1.00 0.00 O ATOM 642 CB THR A 44 -16.244 -7.435 -11.930 1.00 0.00 C ATOM 643 OG1 THR A 44 -15.243 -7.903 -11.019 1.00 0.00 O ATOM 644 CG2 THR A 44 -17.544 -8.189 -11.693 1.00 0.00 C ATOM 0 H THR A 44 -14.159 -6.392 -12.812 1.00 0.00 H new ATOM 0 HA THR A 44 -15.545 -8.671 -13.555 1.00 0.00 H new ATOM 0 HB THR A 44 -16.422 -6.373 -11.760 1.00 0.00 H new ATOM 0 HG1 THR A 44 -14.547 -7.220 -10.918 1.00 0.00 H new ATOM 0 HG21 THR A 44 -17.865 -8.046 -10.661 1.00 0.00 H new ATOM 0 HG22 THR A 44 -18.312 -7.811 -12.368 1.00 0.00 H new ATOM 0 HG23 THR A 44 -17.388 -9.251 -11.880 1.00 0.00 H new ATOM 652 N ALA A 45 -16.844 -5.886 -14.690 1.00 0.00 N ATOM 653 CA ALA A 45 -17.842 -5.330 -15.596 1.00 0.00 C ATOM 654 C ALA A 45 -17.539 -5.704 -17.043 1.00 0.00 C ATOM 655 O ALA A 45 -18.403 -6.211 -17.758 1.00 0.00 O ATOM 656 CB ALA A 45 -17.911 -3.818 -15.442 1.00 0.00 C ATOM 0 H ALA A 45 -16.147 -5.215 -14.367 1.00 0.00 H new ATOM 0 HA ALA A 45 -18.811 -5.755 -15.334 1.00 0.00 H new ATOM 0 HB1 ALA A 45 -18.660 -3.417 -16.124 1.00 0.00 H new ATOM 0 HB2 ALA A 45 -18.184 -3.569 -14.417 1.00 0.00 H new ATOM 0 HB3 ALA A 45 -16.939 -3.384 -15.675 1.00 0.00 H new ATOM 662 N CYS A 46 -16.306 -5.449 -17.469 1.00 0.00 N ATOM 663 CA CYS A 46 -15.889 -5.756 -18.831 1.00 0.00 C ATOM 664 C CYS A 46 -16.011 -7.251 -19.113 1.00 0.00 C ATOM 665 O CYS A 46 -16.652 -7.661 -20.082 1.00 0.00 O ATOM 666 CB CYS A 46 -14.447 -5.299 -19.060 1.00 0.00 C ATOM 667 SG CYS A 46 -14.218 -3.493 -18.984 1.00 0.00 S ATOM 0 H CYS A 46 -15.578 -5.030 -16.890 1.00 0.00 H new ATOM 0 HA CYS A 46 -16.546 -5.220 -19.516 1.00 0.00 H new ATOM 0 HB2 CYS A 46 -13.806 -5.767 -18.313 1.00 0.00 H new ATOM 0 HB3 CYS A 46 -14.115 -5.656 -20.035 1.00 0.00 H new ATOM 672 N HIS A 47 -15.392 -8.061 -18.261 1.00 0.00 N ATOM 673 CA HIS A 47 -15.432 -9.511 -18.417 1.00 0.00 C ATOM 674 C HIS A 47 -16.867 -10.000 -18.583 1.00 0.00 C ATOM 675 O HIS A 47 -17.179 -10.731 -19.522 1.00 0.00 O ATOM 676 CB HIS A 47 -14.784 -10.193 -17.212 1.00 0.00 C ATOM 677 CG HIS A 47 -14.628 -11.674 -17.374 1.00 0.00 C ATOM 678 ND1 HIS A 47 -15.641 -12.571 -17.107 1.00 0.00 N ATOM 679 CD2 HIS A 47 -13.570 -12.413 -17.780 1.00 0.00 C ATOM 680 CE1 HIS A 47 -15.212 -13.798 -17.340 1.00 0.00 C ATOM 681 NE2 HIS A 47 -13.958 -13.730 -17.750 1.00 0.00 N ATOM 0 H HIS A 47 -14.856 -7.738 -17.455 1.00 0.00 H new ATOM 0 HA HIS A 47 -14.872 -9.771 -19.316 1.00 0.00 H new ATOM 0 HB2 HIS A 47 -13.804 -9.750 -17.038 1.00 0.00 H new ATOM 0 HB3 HIS A 47 -15.386 -9.994 -16.325 1.00 0.00 H new ATOM 0 HD1 HIS A 47 -16.576 -12.325 -16.781 1.00 0.00 H new ATOM 0 HD2 HIS A 47 -12.601 -12.037 -18.073 1.00 0.00 H new ATOM 0 HE1 HIS A 47 -15.788 -14.703 -17.216 1.00 0.00 H new ATOM 689 N GLU A 48 -17.736 -9.591 -17.663 1.00 0.00 N ATOM 690 CA GLU A 48 -19.138 -9.990 -17.708 1.00 0.00 C ATOM 691 C GLU A 48 -19.813 -9.469 -18.973 1.00 0.00 C ATOM 692 O GLU A 48 -20.650 -10.147 -19.568 1.00 0.00 O ATOM 693 CB GLU A 48 -19.878 -9.474 -16.472 1.00 0.00 C ATOM 694 CG GLU A 48 -19.631 -10.304 -15.223 1.00 0.00 C ATOM 695 CD GLU A 48 -20.576 -9.950 -14.091 1.00 0.00 C ATOM 696 OE1 GLU A 48 -21.019 -8.784 -14.030 1.00 0.00 O ATOM 697 OE2 GLU A 48 -20.873 -10.840 -13.267 1.00 0.00 O ATOM 0 H GLU A 48 -17.494 -8.985 -16.879 1.00 0.00 H new ATOM 0 HA GLU A 48 -19.178 -11.079 -17.719 1.00 0.00 H new ATOM 0 HB2 GLU A 48 -19.574 -8.445 -16.280 1.00 0.00 H new ATOM 0 HB3 GLU A 48 -20.948 -9.456 -16.681 1.00 0.00 H new ATOM 0 HG2 GLU A 48 -19.741 -11.361 -15.466 1.00 0.00 H new ATOM 0 HG3 GLU A 48 -18.603 -10.158 -14.892 1.00 0.00 H new ATOM 704 N ALA A 49 -19.442 -8.258 -19.378 1.00 0.00 N ATOM 705 CA ALA A 49 -20.010 -7.645 -20.572 1.00 0.00 C ATOM 706 C ALA A 49 -19.721 -8.486 -21.811 1.00 0.00 C ATOM 707 O ALA A 49 -20.550 -8.578 -22.716 1.00 0.00 O ATOM 708 CB ALA A 49 -19.466 -6.235 -20.751 1.00 0.00 C ATOM 0 H ALA A 49 -18.751 -7.683 -18.896 1.00 0.00 H new ATOM 0 HA ALA A 49 -21.091 -7.592 -20.444 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -19.899 -5.789 -21.647 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -19.728 -5.631 -19.882 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -18.381 -6.274 -20.853 1.00 0.00 H new ATOM 714 N GLN A 50 -18.541 -9.097 -21.844 1.00 0.00 N ATOM 715 CA GLN A 50 -18.144 -9.930 -22.973 1.00 0.00 C ATOM 716 C GLN A 50 -18.652 -11.358 -22.802 1.00 0.00 C ATOM 717 O GLN A 50 -18.030 -12.172 -22.120 1.00 0.00 O ATOM 718 CB GLN A 50 -16.621 -9.932 -23.122 1.00 0.00 C ATOM 719 CG GLN A 50 -16.130 -10.704 -24.336 1.00 0.00 C ATOM 720 CD GLN A 50 -14.695 -10.371 -24.697 1.00 0.00 C ATOM 721 OE1 GLN A 50 -14.415 -9.896 -25.798 1.00 0.00 O ATOM 722 NE2 GLN A 50 -13.778 -10.620 -23.770 1.00 0.00 N ATOM 0 H GLN A 50 -17.844 -9.031 -21.102 1.00 0.00 H new ATOM 0 HA GLN A 50 -18.590 -9.511 -23.875 1.00 0.00 H new ATOM 0 HB2 GLN A 50 -16.269 -8.902 -23.190 1.00 0.00 H new ATOM 0 HB3 GLN A 50 -16.177 -10.362 -22.224 1.00 0.00 H new ATOM 0 HG2 GLN A 50 -16.213 -11.773 -24.140 1.00 0.00 H new ATOM 0 HG3 GLN A 50 -16.775 -10.485 -25.187 1.00 0.00 H new ATOM 0 HE21 GLN A 50 -14.055 -11.014 -22.871 1.00 0.00 H new ATOM 0 HE22 GLN A 50 -12.796 -10.417 -23.957 1.00 0.00 H new ATOM 731 N LYS A 51 -19.787 -11.655 -23.426 1.00 0.00 N ATOM 732 CA LYS A 51 -20.380 -12.985 -23.344 1.00 0.00 C ATOM 733 C LYS A 51 -20.544 -13.419 -21.891 1.00 0.00 C ATOM 734 O LYS A 51 -20.427 -14.601 -21.570 1.00 0.00 O ATOM 735 CB LYS A 51 -19.514 -13.999 -24.096 1.00 0.00 C ATOM 736 CG LYS A 51 -19.315 -13.659 -25.563 1.00 0.00 C ATOM 737 CD LYS A 51 -18.872 -14.874 -26.361 1.00 0.00 C ATOM 738 CE LYS A 51 -17.458 -15.296 -25.994 1.00 0.00 C ATOM 739 NZ LYS A 51 -16.845 -16.155 -27.046 1.00 0.00 N ATOM 0 H LYS A 51 -20.315 -10.992 -23.994 1.00 0.00 H new ATOM 0 HA LYS A 51 -21.366 -12.945 -23.806 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -18.540 -14.063 -23.611 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -19.973 -14.984 -24.019 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -20.245 -13.270 -25.977 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -18.570 -12.869 -25.657 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -19.559 -15.701 -26.178 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -18.921 -14.649 -27.426 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -16.842 -14.410 -25.844 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -17.474 -15.837 -25.048 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -15.882 -16.422 -26.759 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -17.419 -17.013 -27.171 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -16.806 -15.631 -27.943 1.00 0.00 H new TER 753 LYS A 51