USER MOD reduce.3.24.130724 H: found=0, std=0, add=796, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 793 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 9 GLN : amide:sc= 1.49 K(o=4.1,f=-4.1) USER MOD Set 1.2: A 45 ASN : amide:sc= 0.216 K(o=4.1,f=0.31!) USER MOD Set 1.3: A 47 GLN : amide:sc= 1.09 K(o=4.1,f=-6.9!) USER MOD Set 1.4: A 87 LYS NZ :NH3+ 178:sc= 1.28 (180deg=0) USER MOD Single : A 0 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 LYS NZ :NH3+ -166:sc= 1.21 (180deg=0.713) USER MOD Single : A 5 THR OG1 : rot -85:sc= 0.997 USER MOD Single : A 7 LYS NZ :NH3+ 171:sc= 0.941 (180deg=0.925) USER MOD Single : A -1 HIS : no HD1:sc= 0 X(o=0,f=-0.0039) USER MOD Single : A -1 HIS N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 22 SER OG : rot 180:sc= -0.191 USER MOD Single : A 23 THR OG1 : rot 150:sc= -0.0502 USER MOD Single : A 25 LYS NZ :NH3+ -165:sc= 1.26 (180deg=1.12) USER MOD Single : A 32 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 36 LYS NZ :NH3+ 162:sc= 1.2 (180deg=0.858) USER MOD Single : A 49 THR OG1 : rot 180:sc= 0 USER MOD Single : A 51 SER OG : rot 108:sc= 0.867 USER MOD Single : A 54 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 57 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 59 LYS NZ :NH3+ 141:sc= 1.1 (180deg=-0.53!) USER MOD Single : A 70 GLN : amide:sc= 0 X(o=0,f=-0.42) USER MOD Single : A 71 LYS NZ :NH3+ 157:sc= 0.928 (180deg=-0.572!) USER MOD Single : A 74 TYR OH : rot -136:sc= 0.018 USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 ASN : amide:sc= 0.883 K(o=0.88,f=-1.1) USER MOD Single : A 82 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 84 THR OG1 : rot 103:sc= 1.25 USER MOD ----------------------------------------------------------------- ATOM 1 N HIS A -1 2.822 16.208 0.596 1.00 0.00 N ATOM 2 CA HIS A -1 3.221 15.481 1.826 1.00 0.00 C ATOM 3 C HIS A -1 2.270 14.280 2.113 1.00 0.00 C ATOM 4 O HIS A -1 1.046 14.436 2.192 1.00 0.00 O ATOM 5 CB HIS A -1 3.262 16.450 3.045 1.00 0.00 C ATOM 6 CG HIS A -1 4.473 17.379 3.133 1.00 0.00 C ATOM 7 ND1 HIS A -1 4.383 18.764 3.112 1.00 0.00 N ATOM 8 CD2 HIS A -1 5.797 16.972 3.393 1.00 0.00 C ATOM 9 CE1 HIS A -1 5.700 19.074 3.343 1.00 0.00 C ATOM 10 NE2 HIS A -1 6.621 18.075 3.520 1.00 0.00 N ATOM 0 H1 HIS A -1 3.475 17.001 0.434 1.00 0.00 H new ATOM 0 H2 HIS A -1 2.856 15.560 -0.217 1.00 0.00 H new ATOM 0 H3 HIS A -1 1.855 16.574 0.707 1.00 0.00 H new ATOM 0 HA HIS A -1 4.222 15.080 1.665 1.00 0.00 H new ATOM 0 HB2 HIS A -1 2.361 17.063 3.024 1.00 0.00 H new ATOM 0 HB3 HIS A -1 3.221 15.854 3.957 1.00 0.00 H new ATOM 0 HD2 HIS A -1 6.121 15.946 3.481 1.00 0.00 H new ATOM 0 HE1 HIS A -1 6.011 20.107 3.385 1.00 0.00 H new ATOM 0 HE2 HIS A -1 7.624 18.129 3.695 1.00 0.00 H new ATOM 18 N MET A 0 2.844 13.091 2.396 1.00 0.00 N ATOM 19 CA MET A 0 2.080 11.951 2.985 1.00 0.00 C ATOM 20 C MET A 0 1.858 12.181 4.519 1.00 0.00 C ATOM 21 O MET A 0 2.658 11.761 5.359 1.00 0.00 O ATOM 22 CB MET A 0 2.798 10.603 2.687 1.00 0.00 C ATOM 23 CG MET A 0 2.638 10.046 1.256 1.00 0.00 C ATOM 24 SD MET A 0 3.530 11.047 0.043 1.00 0.00 S ATOM 25 CE MET A 0 5.154 10.265 0.067 1.00 0.00 C ATOM 0 H MET A 0 3.830 12.888 2.230 1.00 0.00 H new ATOM 0 HA MET A 0 1.096 11.899 2.520 1.00 0.00 H new ATOM 0 HB2 MET A 0 3.862 10.730 2.888 1.00 0.00 H new ATOM 0 HB3 MET A 0 2.428 9.856 3.389 1.00 0.00 H new ATOM 0 HG2 MET A 0 3.006 9.020 1.222 1.00 0.00 H new ATOM 0 HG3 MET A 0 1.580 10.014 0.994 1.00 0.00 H new ATOM 0 HE1 MET A 0 5.814 10.776 -0.634 1.00 0.00 H new ATOM 0 HE2 MET A 0 5.573 10.327 1.071 1.00 0.00 H new ATOM 0 HE3 MET A 0 5.058 9.218 -0.222 1.00 0.00 H new ATOM 35 N LYS A 1 0.769 12.889 4.866 1.00 0.00 N ATOM 36 CA LYS A 1 0.461 13.261 6.280 1.00 0.00 C ATOM 37 C LYS A 1 -0.160 12.099 7.119 1.00 0.00 C ATOM 38 O LYS A 1 0.336 11.781 8.202 1.00 0.00 O ATOM 39 CB LYS A 1 -0.423 14.539 6.303 1.00 0.00 C ATOM 40 CG LYS A 1 0.244 15.827 5.758 1.00 0.00 C ATOM 41 CD LYS A 1 -0.668 17.076 5.790 1.00 0.00 C ATOM 42 CE LYS A 1 -1.129 17.597 7.170 1.00 0.00 C ATOM 43 NZ LYS A 1 -0.012 18.258 7.892 1.00 0.00 N ATOM 0 H LYS A 1 0.079 13.221 4.193 1.00 0.00 H new ATOM 0 HA LYS A 1 1.410 13.474 6.772 1.00 0.00 H new ATOM 0 HB2 LYS A 1 -1.325 14.345 5.722 1.00 0.00 H new ATOM 0 HB3 LYS A 1 -0.738 14.722 7.330 1.00 0.00 H new ATOM 0 HG2 LYS A 1 1.142 16.032 6.341 1.00 0.00 H new ATOM 0 HG3 LYS A 1 0.564 15.651 4.731 1.00 0.00 H new ATOM 0 HD2 LYS A 1 -0.143 17.887 5.284 1.00 0.00 H new ATOM 0 HD3 LYS A 1 -1.558 16.856 5.201 1.00 0.00 H new ATOM 0 HE2 LYS A 1 -1.950 18.302 7.040 1.00 0.00 H new ATOM 0 HE3 LYS A 1 -1.512 16.768 7.766 1.00 0.00 H new ATOM 0 HZ1 LYS A 1 -0.271 18.385 8.891 1.00 0.00 H new ATOM 0 HZ2 LYS A 1 0.841 17.666 7.828 1.00 0.00 H new ATOM 0 HZ3 LYS A 1 0.178 19.186 7.463 1.00 0.00 H new ATOM 57 N VAL A 2 -1.239 11.478 6.615 1.00 0.00 N ATOM 58 CA VAL A 2 -1.768 10.192 7.149 1.00 0.00 C ATOM 59 C VAL A 2 -1.742 9.188 5.951 1.00 0.00 C ATOM 60 O VAL A 2 -2.735 9.071 5.226 1.00 0.00 O ATOM 61 CB VAL A 2 -3.178 10.423 7.813 1.00 0.00 C ATOM 62 CG1 VAL A 2 -3.936 9.128 8.197 1.00 0.00 C ATOM 63 CG2 VAL A 2 -3.097 11.292 9.092 1.00 0.00 C ATOM 0 H VAL A 2 -1.775 11.844 5.828 1.00 0.00 H new ATOM 0 HA VAL A 2 -1.168 9.770 7.956 1.00 0.00 H new ATOM 0 HB VAL A 2 -3.731 10.933 7.024 1.00 0.00 H new ATOM 0 HG11 VAL A 2 -4.895 9.387 8.646 1.00 0.00 H new ATOM 0 HG12 VAL A 2 -4.105 8.527 7.304 1.00 0.00 H new ATOM 0 HG13 VAL A 2 -3.343 8.557 8.912 1.00 0.00 H new ATOM 0 HG21 VAL A 2 -4.096 11.420 9.509 1.00 0.00 H new ATOM 0 HG22 VAL A 2 -2.458 10.801 9.826 1.00 0.00 H new ATOM 0 HG23 VAL A 2 -2.680 12.268 8.843 1.00 0.00 H new ATOM 73 N ASP A 3 -0.625 8.452 5.751 1.00 0.00 N ATOM 74 CA ASP A 3 -0.633 7.215 4.916 1.00 0.00 C ATOM 75 C ASP A 3 -0.924 6.004 5.847 1.00 0.00 C ATOM 76 O ASP A 3 -0.048 5.550 6.587 1.00 0.00 O ATOM 77 CB ASP A 3 0.656 7.058 4.068 1.00 0.00 C ATOM 78 CG ASP A 3 0.586 5.992 2.959 1.00 0.00 C ATOM 79 OD1 ASP A 3 0.188 4.831 3.223 1.00 0.00 O ATOM 80 OD2 ASP A 3 0.935 6.320 1.806 1.00 0.00 O ATOM 0 H ASP A 3 0.286 8.684 6.148 1.00 0.00 H new ATOM 0 HA ASP A 3 -1.425 7.277 4.170 1.00 0.00 H new ATOM 0 HB2 ASP A 3 0.890 8.019 3.611 1.00 0.00 H new ATOM 0 HB3 ASP A 3 1.482 6.812 4.735 1.00 0.00 H new ATOM 85 N ILE A 4 -2.174 5.516 5.809 1.00 0.00 N ATOM 86 CA ILE A 4 -2.582 4.271 6.514 1.00 0.00 C ATOM 87 C ILE A 4 -2.467 3.099 5.478 1.00 0.00 C ATOM 88 O ILE A 4 -3.209 3.022 4.494 1.00 0.00 O ATOM 89 CB ILE A 4 -3.954 4.518 7.244 1.00 0.00 C ATOM 90 CG1 ILE A 4 -4.167 3.671 8.524 1.00 0.00 C ATOM 91 CG2 ILE A 4 -5.202 4.484 6.341 1.00 0.00 C ATOM 92 CD1 ILE A 4 -4.516 2.191 8.330 1.00 0.00 C ATOM 0 H ILE A 4 -2.933 5.963 5.295 1.00 0.00 H new ATOM 0 HA ILE A 4 -1.937 3.968 7.339 1.00 0.00 H new ATOM 0 HB ILE A 4 -3.846 5.554 7.564 1.00 0.00 H new ATOM 0 HG12 ILE A 4 -3.258 3.729 9.123 1.00 0.00 H new ATOM 0 HG13 ILE A 4 -4.964 4.133 9.107 1.00 0.00 H new ATOM 0 HG21 ILE A 4 -6.092 4.665 6.943 1.00 0.00 H new ATOM 0 HG22 ILE A 4 -5.118 5.256 5.576 1.00 0.00 H new ATOM 0 HG23 ILE A 4 -5.280 3.507 5.864 1.00 0.00 H new ATOM 0 HD11 ILE A 4 -4.638 1.715 9.303 1.00 0.00 H new ATOM 0 HD12 ILE A 4 -5.445 2.107 7.766 1.00 0.00 H new ATOM 0 HD13 ILE A 4 -3.713 1.697 7.783 1.00 0.00 H new ATOM 104 N THR A 5 -1.450 2.248 5.656 1.00 0.00 N ATOM 105 CA THR A 5 -0.876 1.416 4.561 1.00 0.00 C ATOM 106 C THR A 5 -1.148 -0.086 4.908 1.00 0.00 C ATOM 107 O THR A 5 -0.533 -0.651 5.822 1.00 0.00 O ATOM 108 CB THR A 5 0.651 1.723 4.380 1.00 0.00 C ATOM 109 OG1 THR A 5 1.019 3.081 4.642 1.00 0.00 O ATOM 110 CG2 THR A 5 1.175 1.399 2.976 1.00 0.00 C ATOM 0 H THR A 5 -0.993 2.108 6.557 1.00 0.00 H new ATOM 0 HA THR A 5 -1.347 1.649 3.606 1.00 0.00 H new ATOM 0 HB THR A 5 1.104 1.069 5.125 1.00 0.00 H new ATOM 0 HG1 THR A 5 0.884 3.618 3.834 1.00 0.00 H new ATOM 0 HG21 THR A 5 2.238 1.635 2.921 1.00 0.00 H new ATOM 0 HG22 THR A 5 1.028 0.339 2.768 1.00 0.00 H new ATOM 0 HG23 THR A 5 0.633 1.992 2.239 1.00 0.00 H new ATOM 118 N ILE A 6 -2.111 -0.725 4.226 1.00 0.00 N ATOM 119 CA ILE A 6 -2.783 -1.961 4.733 1.00 0.00 C ATOM 120 C ILE A 6 -2.200 -3.206 4.000 1.00 0.00 C ATOM 121 O ILE A 6 -2.479 -3.417 2.818 1.00 0.00 O ATOM 122 CB ILE A 6 -4.356 -1.899 4.623 1.00 0.00 C ATOM 123 CG1 ILE A 6 -5.039 -0.575 5.092 1.00 0.00 C ATOM 124 CG2 ILE A 6 -5.011 -3.064 5.413 1.00 0.00 C ATOM 125 CD1 ILE A 6 -5.157 0.497 3.997 1.00 0.00 C ATOM 0 H ILE A 6 -2.452 -0.415 3.316 1.00 0.00 H new ATOM 0 HA ILE A 6 -2.573 -2.042 5.799 1.00 0.00 H new ATOM 0 HB ILE A 6 -4.524 -1.970 3.548 1.00 0.00 H new ATOM 0 HG12 ILE A 6 -6.036 -0.807 5.466 1.00 0.00 H new ATOM 0 HG13 ILE A 6 -4.473 -0.164 5.928 1.00 0.00 H new ATOM 0 HG21 ILE A 6 -6.095 -3.000 5.323 1.00 0.00 H new ATOM 0 HG22 ILE A 6 -4.668 -4.016 5.008 1.00 0.00 H new ATOM 0 HG23 ILE A 6 -4.730 -2.994 6.464 1.00 0.00 H new ATOM 0 HD11 ILE A 6 -5.642 1.383 4.406 1.00 0.00 H new ATOM 0 HD12 ILE A 6 -4.162 0.761 3.638 1.00 0.00 H new ATOM 0 HD13 ILE A 6 -5.750 0.108 3.169 1.00 0.00 H new ATOM 137 N LYS A 7 -1.439 -4.049 4.716 1.00 0.00 N ATOM 138 CA LYS A 7 -0.931 -5.338 4.169 1.00 0.00 C ATOM 139 C LYS A 7 -1.893 -6.499 4.573 1.00 0.00 C ATOM 140 O LYS A 7 -1.895 -6.959 5.721 1.00 0.00 O ATOM 141 CB LYS A 7 0.520 -5.565 4.663 1.00 0.00 C ATOM 142 CG LYS A 7 1.631 -4.733 3.982 1.00 0.00 C ATOM 143 CD LYS A 7 1.695 -3.244 4.393 1.00 0.00 C ATOM 144 CE LYS A 7 3.132 -2.701 4.498 1.00 0.00 C ATOM 145 NZ LYS A 7 3.114 -1.227 4.339 1.00 0.00 N ATOM 0 H LYS A 7 -1.156 -3.869 5.679 1.00 0.00 H new ATOM 0 HA LYS A 7 -0.907 -5.309 3.080 1.00 0.00 H new ATOM 0 HB2 LYS A 7 0.550 -5.359 5.733 1.00 0.00 H new ATOM 0 HB3 LYS A 7 0.760 -6.620 4.535 1.00 0.00 H new ATOM 0 HG2 LYS A 7 2.593 -5.194 4.203 1.00 0.00 H new ATOM 0 HG3 LYS A 7 1.492 -4.788 2.902 1.00 0.00 H new ATOM 0 HD2 LYS A 7 1.142 -2.650 3.666 1.00 0.00 H new ATOM 0 HD3 LYS A 7 1.196 -3.118 5.354 1.00 0.00 H new ATOM 0 HE2 LYS A 7 3.564 -2.969 5.462 1.00 0.00 H new ATOM 0 HE3 LYS A 7 3.760 -3.153 3.731 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 4.055 -0.842 4.560 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 2.863 -0.987 3.359 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 2.411 -0.817 4.987 1.00 0.00 H new ATOM 159 N ILE A 8 -2.739 -6.940 3.623 1.00 0.00 N ATOM 160 CA ILE A 8 -3.805 -7.951 3.883 1.00 0.00 C ATOM 161 C ILE A 8 -3.238 -9.375 3.551 1.00 0.00 C ATOM 162 O ILE A 8 -3.214 -9.801 2.388 1.00 0.00 O ATOM 163 CB ILE A 8 -5.129 -7.632 3.086 1.00 0.00 C ATOM 164 CG1 ILE A 8 -5.638 -6.161 3.206 1.00 0.00 C ATOM 165 CG2 ILE A 8 -6.269 -8.601 3.504 1.00 0.00 C ATOM 166 CD1 ILE A 8 -6.819 -5.773 2.295 1.00 0.00 C ATOM 0 H ILE A 8 -2.711 -6.614 2.657 1.00 0.00 H new ATOM 0 HA ILE A 8 -4.085 -7.918 4.936 1.00 0.00 H new ATOM 0 HB ILE A 8 -4.858 -7.775 2.040 1.00 0.00 H new ATOM 0 HG12 ILE A 8 -5.931 -5.983 4.241 1.00 0.00 H new ATOM 0 HG13 ILE A 8 -4.805 -5.492 2.991 1.00 0.00 H new ATOM 0 HG21 ILE A 8 -7.173 -8.363 2.943 1.00 0.00 H new ATOM 0 HG22 ILE A 8 -5.970 -9.628 3.293 1.00 0.00 H new ATOM 0 HG23 ILE A 8 -6.466 -8.493 4.571 1.00 0.00 H new ATOM 0 HD11 ILE A 8 -7.084 -4.730 2.467 1.00 0.00 H new ATOM 0 HD12 ILE A 8 -6.533 -5.908 1.252 1.00 0.00 H new ATOM 0 HD13 ILE A 8 -7.676 -6.407 2.521 1.00 0.00 H new ATOM 178 N GLN A 9 -2.835 -10.133 4.586 1.00 0.00 N ATOM 179 CA GLN A 9 -2.206 -11.467 4.402 1.00 0.00 C ATOM 180 C GLN A 9 -3.247 -12.602 4.627 1.00 0.00 C ATOM 181 O GLN A 9 -3.716 -12.847 5.746 1.00 0.00 O ATOM 182 CB GLN A 9 -0.989 -11.628 5.346 1.00 0.00 C ATOM 183 CG GLN A 9 0.204 -10.709 4.997 1.00 0.00 C ATOM 184 CD GLN A 9 1.424 -10.792 5.915 1.00 0.00 C ATOM 185 OE1 GLN A 9 1.479 -11.472 6.938 1.00 0.00 O ATOM 186 NE2 GLN A 9 2.451 -10.058 5.571 1.00 0.00 N ATOM 0 H GLN A 9 -2.931 -9.851 5.561 1.00 0.00 H new ATOM 0 HA GLN A 9 -1.848 -11.542 3.375 1.00 0.00 H new ATOM 0 HB2 GLN A 9 -1.306 -11.422 6.368 1.00 0.00 H new ATOM 0 HB3 GLN A 9 -0.655 -12.665 5.318 1.00 0.00 H new ATOM 0 HG2 GLN A 9 0.526 -10.939 3.981 1.00 0.00 H new ATOM 0 HG3 GLN A 9 -0.150 -9.678 4.993 1.00 0.00 H new ATOM 0 HE21 GLN A 9 2.412 -9.492 4.724 1.00 0.00 H new ATOM 0 HE22 GLN A 9 3.291 -10.052 6.150 1.00 0.00 H new ATOM 195 N ARG A 10 -3.559 -13.349 3.558 1.00 0.00 N ATOM 196 CA ARG A 10 -4.401 -14.581 3.645 1.00 0.00 C ATOM 197 C ARG A 10 -3.526 -15.847 3.979 1.00 0.00 C ATOM 198 O ARG A 10 -3.561 -16.857 3.273 1.00 0.00 O ATOM 199 CB ARG A 10 -5.216 -14.692 2.317 1.00 0.00 C ATOM 200 CG ARG A 10 -6.497 -13.832 2.139 1.00 0.00 C ATOM 201 CD ARG A 10 -6.383 -12.289 2.227 1.00 0.00 C ATOM 202 NE ARG A 10 -5.273 -11.670 1.442 1.00 0.00 N ATOM 203 CZ ARG A 10 -5.200 -11.552 0.125 1.00 0.00 C ATOM 204 NH1 ARG A 10 -6.143 -11.930 -0.696 1.00 0.00 N ATOM 205 NH2 ARG A 10 -4.120 -11.031 -0.366 1.00 0.00 N ATOM 0 H ARG A 10 -3.245 -13.131 2.612 1.00 0.00 H new ATOM 0 HA ARG A 10 -5.110 -14.521 4.471 1.00 0.00 H new ATOM 0 HB2 ARG A 10 -4.541 -14.448 1.497 1.00 0.00 H new ATOM 0 HB3 ARG A 10 -5.503 -15.736 2.194 1.00 0.00 H new ATOM 0 HG2 ARG A 10 -6.925 -14.076 1.166 1.00 0.00 H new ATOM 0 HG3 ARG A 10 -7.216 -14.153 2.893 1.00 0.00 H new ATOM 0 HD2 ARG A 10 -7.325 -11.855 1.892 1.00 0.00 H new ATOM 0 HD3 ARG A 10 -6.259 -12.012 3.274 1.00 0.00 H new ATOM 0 HE ARG A 10 -4.488 -11.299 1.977 1.00 0.00 H new ATOM 0 HH11 ARG A 10 -7.000 -12.345 -0.331 1.00 0.00 H new ATOM 0 HH12 ARG A 10 -6.022 -11.810 -1.702 1.00 0.00 H new ATOM 0 HH21 ARG A 10 -3.370 -10.731 0.257 1.00 0.00 H new ATOM 0 HH22 ARG A 10 -4.020 -10.921 -1.375 1.00 0.00 H new ATOM 219 N ASP A 11 -2.763 -15.795 5.094 1.00 0.00 N ATOM 220 CA ASP A 11 -1.648 -16.738 5.418 1.00 0.00 C ATOM 221 C ASP A 11 -0.544 -16.788 4.302 1.00 0.00 C ATOM 222 O ASP A 11 -0.611 -17.592 3.367 1.00 0.00 O ATOM 223 CB ASP A 11 -2.194 -18.105 5.912 1.00 0.00 C ATOM 224 CG ASP A 11 -1.249 -18.869 6.828 1.00 0.00 C ATOM 225 OD1 ASP A 11 -0.966 -18.364 7.935 1.00 0.00 O ATOM 226 OD2 ASP A 11 -0.807 -19.975 6.458 1.00 0.00 O ATOM 0 H ASP A 11 -2.901 -15.085 5.814 1.00 0.00 H new ATOM 0 HA ASP A 11 -1.096 -16.343 6.271 1.00 0.00 H new ATOM 0 HB2 ASP A 11 -3.134 -17.938 6.439 1.00 0.00 H new ATOM 0 HB3 ASP A 11 -2.421 -18.726 5.045 1.00 0.00 H new ATOM 231 N GLY A 12 0.411 -15.837 4.336 1.00 0.00 N ATOM 232 CA GLY A 12 1.369 -15.623 3.211 1.00 0.00 C ATOM 233 C GLY A 12 0.897 -14.713 2.052 1.00 0.00 C ATOM 234 O GLY A 12 1.605 -13.775 1.685 1.00 0.00 O ATOM 0 H GLY A 12 0.547 -15.203 5.123 1.00 0.00 H new ATOM 0 HA2 GLY A 12 2.286 -15.200 3.622 1.00 0.00 H new ATOM 0 HA3 GLY A 12 1.626 -16.597 2.794 1.00 0.00 H new ATOM 238 N GLN A 13 -0.268 -15.015 1.452 1.00 0.00 N ATOM 239 CA GLN A 13 -0.778 -14.315 0.237 1.00 0.00 C ATOM 240 C GLN A 13 -1.122 -12.804 0.483 1.00 0.00 C ATOM 241 O GLN A 13 -2.067 -12.480 1.209 1.00 0.00 O ATOM 242 CB GLN A 13 -1.984 -15.151 -0.284 1.00 0.00 C ATOM 243 CG GLN A 13 -2.625 -14.708 -1.626 1.00 0.00 C ATOM 244 CD GLN A 13 -1.680 -14.675 -2.832 1.00 0.00 C ATOM 245 OE1 GLN A 13 -1.116 -13.643 -3.176 1.00 0.00 O ATOM 246 NE2 GLN A 13 -1.456 -15.781 -3.498 1.00 0.00 N ATOM 0 H GLN A 13 -0.890 -15.750 1.788 1.00 0.00 H new ATOM 0 HA GLN A 13 0.001 -14.264 -0.524 1.00 0.00 H new ATOM 0 HB2 GLN A 13 -1.657 -16.185 -0.390 1.00 0.00 H new ATOM 0 HB3 GLN A 13 -2.760 -15.139 0.482 1.00 0.00 H new ATOM 0 HG2 GLN A 13 -3.451 -15.381 -1.853 1.00 0.00 H new ATOM 0 HG3 GLN A 13 -3.051 -13.714 -1.494 1.00 0.00 H new ATOM 0 HE21 GLN A 13 -1.920 -16.646 -3.221 1.00 0.00 H new ATOM 0 HE22 GLN A 13 -0.818 -15.777 -4.294 1.00 0.00 H new ATOM 255 N GLU A 14 -0.333 -11.898 -0.119 1.00 0.00 N ATOM 256 CA GLU A 14 -0.224 -10.478 0.320 1.00 0.00 C ATOM 257 C GLU A 14 -0.857 -9.459 -0.686 1.00 0.00 C ATOM 258 O GLU A 14 -0.696 -9.572 -1.905 1.00 0.00 O ATOM 259 CB GLU A 14 1.301 -10.231 0.546 1.00 0.00 C ATOM 260 CG GLU A 14 1.717 -8.836 1.087 1.00 0.00 C ATOM 261 CD GLU A 14 1.162 -8.481 2.453 1.00 0.00 C ATOM 262 OE1 GLU A 14 -0.051 -8.201 2.552 1.00 0.00 O ATOM 263 OE2 GLU A 14 1.940 -8.458 3.429 1.00 0.00 O ATOM 0 H GLU A 14 0.251 -12.120 -0.925 1.00 0.00 H new ATOM 0 HA GLU A 14 -0.798 -10.313 1.232 1.00 0.00 H new ATOM 0 HB2 GLU A 14 1.667 -10.987 1.241 1.00 0.00 H new ATOM 0 HB3 GLU A 14 1.815 -10.394 -0.402 1.00 0.00 H new ATOM 0 HG2 GLU A 14 2.805 -8.791 1.132 1.00 0.00 H new ATOM 0 HG3 GLU A 14 1.396 -8.077 0.374 1.00 0.00 H new ATOM 270 N ILE A 15 -1.547 -8.429 -0.160 1.00 0.00 N ATOM 271 CA ILE A 15 -1.879 -7.190 -0.935 1.00 0.00 C ATOM 272 C ILE A 15 -1.516 -5.977 -0.013 1.00 0.00 C ATOM 273 O ILE A 15 -2.170 -5.766 1.014 1.00 0.00 O ATOM 274 CB ILE A 15 -3.380 -7.131 -1.411 1.00 0.00 C ATOM 275 CG1 ILE A 15 -3.778 -8.227 -2.443 1.00 0.00 C ATOM 276 CG2 ILE A 15 -3.758 -5.757 -2.044 1.00 0.00 C ATOM 277 CD1 ILE A 15 -5.286 -8.548 -2.478 1.00 0.00 C ATOM 0 H ILE A 15 -1.892 -8.419 0.800 1.00 0.00 H new ATOM 0 HA ILE A 15 -1.304 -7.173 -1.861 1.00 0.00 H new ATOM 0 HB ILE A 15 -3.929 -7.300 -0.485 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -3.464 -7.906 -3.436 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -3.229 -9.141 -2.215 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -4.803 -5.774 -2.353 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -3.610 -4.965 -1.310 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -3.126 -5.570 -2.912 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -5.476 -9.321 -3.223 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -5.605 -8.902 -1.498 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -5.844 -7.648 -2.738 1.00 0.00 H new ATOM 289 N GLU A 16 -0.558 -5.133 -0.438 1.00 0.00 N ATOM 290 CA GLU A 16 -0.353 -3.781 0.152 1.00 0.00 C ATOM 291 C GLU A 16 -1.288 -2.705 -0.504 1.00 0.00 C ATOM 292 O GLU A 16 -1.337 -2.559 -1.729 1.00 0.00 O ATOM 293 CB GLU A 16 1.161 -3.449 0.058 1.00 0.00 C ATOM 294 CG GLU A 16 1.556 -2.054 0.623 1.00 0.00 C ATOM 295 CD GLU A 16 2.970 -1.868 1.149 1.00 0.00 C ATOM 296 OE1 GLU A 16 3.817 -2.781 1.081 1.00 0.00 O ATOM 297 OE2 GLU A 16 3.207 -0.803 1.760 1.00 0.00 O ATOM 0 H GLU A 16 0.093 -5.357 -1.191 1.00 0.00 H new ATOM 0 HA GLU A 16 -0.643 -3.771 1.203 1.00 0.00 H new ATOM 0 HB2 GLU A 16 1.721 -4.215 0.594 1.00 0.00 H new ATOM 0 HB3 GLU A 16 1.467 -3.503 -0.987 1.00 0.00 H new ATOM 0 HG2 GLU A 16 1.394 -1.318 -0.164 1.00 0.00 H new ATOM 0 HG3 GLU A 16 0.865 -1.814 1.431 1.00 0.00 H new ATOM 304 N ILE A 17 -2.016 -1.948 0.339 1.00 0.00 N ATOM 305 CA ILE A 17 -2.944 -0.860 -0.122 1.00 0.00 C ATOM 306 C ILE A 17 -2.502 0.490 0.543 1.00 0.00 C ATOM 307 O ILE A 17 -2.597 0.635 1.765 1.00 0.00 O ATOM 308 CB ILE A 17 -4.464 -1.171 0.167 1.00 0.00 C ATOM 309 CG1 ILE A 17 -4.943 -2.565 -0.337 1.00 0.00 C ATOM 310 CG2 ILE A 17 -5.385 -0.062 -0.419 1.00 0.00 C ATOM 311 CD1 ILE A 17 -6.396 -2.952 -0.002 1.00 0.00 C ATOM 0 H ILE A 17 -1.989 -2.060 1.352 1.00 0.00 H new ATOM 0 HA ILE A 17 -2.868 -0.788 -1.207 1.00 0.00 H new ATOM 0 HB ILE A 17 -4.543 -1.189 1.254 1.00 0.00 H new ATOM 0 HG12 ILE A 17 -4.822 -2.597 -1.420 1.00 0.00 H new ATOM 0 HG13 ILE A 17 -4.282 -3.325 0.080 1.00 0.00 H new ATOM 0 HG21 ILE A 17 -6.426 -0.303 -0.205 1.00 0.00 H new ATOM 0 HG22 ILE A 17 -5.134 0.897 0.034 1.00 0.00 H new ATOM 0 HG23 ILE A 17 -5.241 -0.002 -1.498 1.00 0.00 H new ATOM 0 HD11 ILE A 17 -6.611 -3.942 -0.405 1.00 0.00 H new ATOM 0 HD12 ILE A 17 -6.529 -2.964 1.080 1.00 0.00 H new ATOM 0 HD13 ILE A 17 -7.077 -2.225 -0.444 1.00 0.00 H new ATOM 323 N ASP A 18 -2.095 1.497 -0.252 1.00 0.00 N ATOM 324 CA ASP A 18 -1.676 2.835 0.262 1.00 0.00 C ATOM 325 C ASP A 18 -2.856 3.871 0.340 1.00 0.00 C ATOM 326 O ASP A 18 -3.280 4.436 -0.673 1.00 0.00 O ATOM 327 CB ASP A 18 -0.444 3.320 -0.561 1.00 0.00 C ATOM 328 CG ASP A 18 -0.598 3.541 -2.078 1.00 0.00 C ATOM 329 OD1 ASP A 18 -0.829 2.554 -2.807 1.00 0.00 O ATOM 330 OD2 ASP A 18 -0.455 4.693 -2.550 1.00 0.00 O ATOM 0 H ASP A 18 -2.044 1.417 -1.268 1.00 0.00 H new ATOM 0 HA ASP A 18 -1.371 2.741 1.304 1.00 0.00 H new ATOM 0 HB2 ASP A 18 -0.106 4.260 -0.124 1.00 0.00 H new ATOM 0 HB3 ASP A 18 0.356 2.594 -0.414 1.00 0.00 H new ATOM 335 N ILE A 19 -3.392 4.137 1.551 1.00 0.00 N ATOM 336 CA ILE A 19 -4.485 5.145 1.753 1.00 0.00 C ATOM 337 C ILE A 19 -3.861 6.452 2.355 1.00 0.00 C ATOM 338 O ILE A 19 -3.756 6.616 3.574 1.00 0.00 O ATOM 339 CB ILE A 19 -5.687 4.517 2.547 1.00 0.00 C ATOM 340 CG1 ILE A 19 -6.374 3.309 1.839 1.00 0.00 C ATOM 341 CG2 ILE A 19 -6.769 5.535 2.996 1.00 0.00 C ATOM 342 CD1 ILE A 19 -7.045 3.556 0.472 1.00 0.00 C ATOM 0 H ILE A 19 -3.094 3.674 2.410 1.00 0.00 H new ATOM 0 HA ILE A 19 -4.938 5.443 0.808 1.00 0.00 H new ATOM 0 HB ILE A 19 -5.189 4.142 3.441 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -5.624 2.529 1.707 1.00 0.00 H new ATOM 0 HG13 ILE A 19 -7.131 2.912 2.515 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -7.559 5.012 3.536 1.00 0.00 H new ATOM 0 HG22 ILE A 19 -6.317 6.283 3.648 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -7.192 6.026 2.120 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -7.478 2.625 0.106 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -7.831 4.303 0.582 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -6.301 3.914 -0.239 1.00 0.00 H new ATOM 354 N ARG A 20 -3.474 7.383 1.464 1.00 0.00 N ATOM 355 CA ARG A 20 -2.770 8.651 1.819 1.00 0.00 C ATOM 356 C ARG A 20 -3.720 9.890 1.786 1.00 0.00 C ATOM 357 O ARG A 20 -4.222 10.294 0.733 1.00 0.00 O ATOM 358 CB ARG A 20 -1.449 8.801 1.010 1.00 0.00 C ATOM 359 CG ARG A 20 -1.464 8.548 -0.517 1.00 0.00 C ATOM 360 CD ARG A 20 -0.049 8.295 -1.085 1.00 0.00 C ATOM 361 NE ARG A 20 -0.114 7.361 -2.242 1.00 0.00 N ATOM 362 CZ ARG A 20 -0.029 7.681 -3.524 1.00 0.00 C ATOM 363 NH1 ARG A 20 0.124 8.905 -3.962 1.00 0.00 N ATOM 364 NH2 ARG A 20 -0.106 6.706 -4.379 1.00 0.00 N ATOM 0 H ARG A 20 -3.639 7.284 0.462 1.00 0.00 H new ATOM 0 HA ARG A 20 -2.460 8.597 2.863 1.00 0.00 H new ATOM 0 HB2 ARG A 20 -1.079 9.814 1.171 1.00 0.00 H new ATOM 0 HB3 ARG A 20 -0.718 8.122 1.448 1.00 0.00 H new ATOM 0 HG2 ARG A 20 -2.099 7.689 -0.734 1.00 0.00 H new ATOM 0 HG3 ARG A 20 -1.907 9.407 -1.021 1.00 0.00 H new ATOM 0 HD2 ARG A 20 0.399 9.239 -1.396 1.00 0.00 H new ATOM 0 HD3 ARG A 20 0.592 7.878 -0.308 1.00 0.00 H new ATOM 0 HE ARG A 20 -0.237 6.372 -2.025 1.00 0.00 H new ATOM 0 HH11 ARG A 20 0.185 9.679 -3.301 1.00 0.00 H new ATOM 0 HH12 ARG A 20 0.183 9.084 -4.964 1.00 0.00 H new ATOM 0 HH21 ARG A 20 -0.226 5.748 -4.050 1.00 0.00 H new ATOM 0 HH22 ARG A 20 -0.046 6.899 -5.379 1.00 0.00 H new ATOM 378 N VAL A 21 -3.983 10.452 2.980 1.00 0.00 N ATOM 379 CA VAL A 21 -5.126 11.387 3.228 1.00 0.00 C ATOM 380 C VAL A 21 -4.619 12.681 3.973 1.00 0.00 C ATOM 381 O VAL A 21 -3.809 12.620 4.905 1.00 0.00 O ATOM 382 CB VAL A 21 -6.259 10.623 4.021 1.00 0.00 C ATOM 383 CG1 VAL A 21 -7.465 11.504 4.416 1.00 0.00 C ATOM 384 CG2 VAL A 21 -6.863 9.412 3.270 1.00 0.00 C ATOM 0 H VAL A 21 -3.415 10.278 3.810 1.00 0.00 H new ATOM 0 HA VAL A 21 -5.555 11.722 2.284 1.00 0.00 H new ATOM 0 HB VAL A 21 -5.711 10.295 4.904 1.00 0.00 H new ATOM 0 HG11 VAL A 21 -8.195 10.901 4.956 1.00 0.00 H new ATOM 0 HG12 VAL A 21 -7.126 12.320 5.054 1.00 0.00 H new ATOM 0 HG13 VAL A 21 -7.927 11.913 3.517 1.00 0.00 H new ATOM 0 HG21 VAL A 21 -7.632 8.948 3.887 1.00 0.00 H new ATOM 0 HG22 VAL A 21 -7.305 9.749 2.332 1.00 0.00 H new ATOM 0 HG23 VAL A 21 -6.078 8.685 3.061 1.00 0.00 H new ATOM 394 N SER A 22 -5.164 13.856 3.594 1.00 0.00 N ATOM 395 CA SER A 22 -5.003 15.129 4.360 1.00 0.00 C ATOM 396 C SER A 22 -6.377 15.865 4.451 1.00 0.00 C ATOM 397 O SER A 22 -6.856 16.427 3.462 1.00 0.00 O ATOM 398 CB SER A 22 -3.916 15.996 3.681 1.00 0.00 C ATOM 399 OG SER A 22 -3.786 17.261 4.333 1.00 0.00 O ATOM 0 H SER A 22 -5.729 13.958 2.751 1.00 0.00 H new ATOM 0 HA SER A 22 -4.677 14.924 5.380 1.00 0.00 H new ATOM 0 HB2 SER A 22 -2.961 15.471 3.704 1.00 0.00 H new ATOM 0 HB3 SER A 22 -4.170 16.148 2.632 1.00 0.00 H new ATOM 0 HG SER A 22 -3.092 17.789 3.886 1.00 0.00 H new ATOM 405 N THR A 23 -7.028 15.841 5.630 1.00 0.00 N ATOM 406 CA THR A 23 -8.456 16.275 5.785 1.00 0.00 C ATOM 407 C THR A 23 -8.793 16.750 7.249 1.00 0.00 C ATOM 408 O THR A 23 -7.930 16.810 8.132 1.00 0.00 O ATOM 409 CB THR A 23 -9.384 15.131 5.238 1.00 0.00 C ATOM 410 OG1 THR A 23 -10.723 15.599 5.099 1.00 0.00 O ATOM 411 CG2 THR A 23 -9.430 13.864 6.108 1.00 0.00 C ATOM 0 H THR A 23 -6.598 15.527 6.500 1.00 0.00 H new ATOM 0 HA THR A 23 -8.640 17.169 5.189 1.00 0.00 H new ATOM 0 HB THR A 23 -8.940 14.858 4.281 1.00 0.00 H new ATOM 0 HG1 THR A 23 -11.162 15.121 4.365 1.00 0.00 H new ATOM 0 HG21 THR A 23 -10.096 13.132 5.650 1.00 0.00 H new ATOM 0 HG22 THR A 23 -8.428 13.442 6.190 1.00 0.00 H new ATOM 0 HG23 THR A 23 -9.799 14.118 7.102 1.00 0.00 H new ATOM 419 N GLY A 24 -10.081 17.048 7.509 1.00 0.00 N ATOM 420 CA GLY A 24 -10.632 17.069 8.893 1.00 0.00 C ATOM 421 C GLY A 24 -11.037 15.664 9.394 1.00 0.00 C ATOM 422 O GLY A 24 -10.188 14.926 9.899 1.00 0.00 O ATOM 0 H GLY A 24 -10.763 17.278 6.787 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -9.889 17.491 9.569 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -11.501 17.726 8.924 1.00 0.00 H new ATOM 426 N LYS A 25 -12.312 15.278 9.228 1.00 0.00 N ATOM 427 CA LYS A 25 -12.786 13.905 9.589 1.00 0.00 C ATOM 428 C LYS A 25 -12.553 12.773 8.531 1.00 0.00 C ATOM 429 O LYS A 25 -12.360 11.634 8.950 1.00 0.00 O ATOM 430 CB LYS A 25 -14.242 13.967 10.143 1.00 0.00 C ATOM 431 CG LYS A 25 -15.390 14.001 9.105 1.00 0.00 C ATOM 432 CD LYS A 25 -16.806 13.870 9.716 1.00 0.00 C ATOM 433 CE LYS A 25 -17.795 13.110 8.814 1.00 0.00 C ATOM 434 NZ LYS A 25 -18.140 13.891 7.593 1.00 0.00 N ATOM 0 H LYS A 25 -13.040 15.884 8.849 1.00 0.00 H new ATOM 0 HA LYS A 25 -12.121 13.572 10.386 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -14.395 13.103 10.789 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -14.328 14.854 10.771 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -15.333 14.936 8.548 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -15.240 13.193 8.388 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -16.733 13.357 10.675 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -17.201 14.866 9.916 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -17.361 12.153 8.523 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -18.704 12.891 9.374 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -18.982 13.479 7.144 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -18.336 14.878 7.856 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -17.343 13.862 6.926 1.00 0.00 H new ATOM 448 N GLU A 26 -12.591 13.041 7.208 1.00 0.00 N ATOM 449 CA GLU A 26 -12.876 12.009 6.155 1.00 0.00 C ATOM 450 C GLU A 26 -11.981 10.725 6.007 1.00 0.00 C ATOM 451 O GLU A 26 -12.394 9.771 5.339 1.00 0.00 O ATOM 452 CB GLU A 26 -13.038 12.726 4.782 1.00 0.00 C ATOM 453 CG GLU A 26 -14.096 13.863 4.664 1.00 0.00 C ATOM 454 CD GLU A 26 -15.520 13.483 5.045 1.00 0.00 C ATOM 455 OE1 GLU A 26 -16.061 12.522 4.463 1.00 0.00 O ATOM 456 OE2 GLU A 26 -16.117 14.137 5.925 1.00 0.00 O ATOM 0 H GLU A 26 -12.427 13.973 6.828 1.00 0.00 H new ATOM 0 HA GLU A 26 -13.787 11.549 6.537 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -12.069 13.144 4.508 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -13.280 11.968 4.037 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -13.781 14.694 5.294 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -14.099 14.226 3.636 1.00 0.00 H new ATOM 463 N LEU A 27 -10.837 10.632 6.714 1.00 0.00 N ATOM 464 CA LEU A 27 -10.257 9.323 7.143 1.00 0.00 C ATOM 465 C LEU A 27 -11.281 8.341 7.798 1.00 0.00 C ATOM 466 O LEU A 27 -11.380 7.213 7.330 1.00 0.00 O ATOM 467 CB LEU A 27 -9.046 9.636 8.070 1.00 0.00 C ATOM 468 CG LEU A 27 -8.196 8.469 8.643 1.00 0.00 C ATOM 469 CD1 LEU A 27 -8.823 7.709 9.824 1.00 0.00 C ATOM 470 CD2 LEU A 27 -7.660 7.507 7.569 1.00 0.00 C ATOM 0 H LEU A 27 -10.289 11.442 7.005 1.00 0.00 H new ATOM 0 HA LEU A 27 -9.934 8.777 6.257 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -8.372 10.289 7.516 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -9.423 10.211 8.916 1.00 0.00 H new ATOM 0 HG LEU A 27 -7.338 8.990 9.067 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -8.148 6.916 10.146 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -8.994 8.398 10.651 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -9.772 7.273 9.513 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -7.076 6.719 8.045 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -8.496 7.063 7.028 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -7.027 8.056 6.872 1.00 0.00 H new ATOM 482 N GLU A 28 -12.050 8.781 8.814 1.00 0.00 N ATOM 483 CA GLU A 28 -13.283 8.100 9.327 1.00 0.00 C ATOM 484 C GLU A 28 -14.123 7.262 8.302 1.00 0.00 C ATOM 485 O GLU A 28 -14.326 6.062 8.501 1.00 0.00 O ATOM 486 CB GLU A 28 -14.121 9.247 9.978 1.00 0.00 C ATOM 487 CG GLU A 28 -15.483 8.889 10.637 1.00 0.00 C ATOM 488 CD GLU A 28 -16.501 10.013 10.508 1.00 0.00 C ATOM 489 OE1 GLU A 28 -16.478 10.948 11.332 1.00 0.00 O ATOM 490 OE2 GLU A 28 -17.309 9.980 9.554 1.00 0.00 O ATOM 0 H GLU A 28 -11.836 9.640 9.321 1.00 0.00 H new ATOM 0 HA GLU A 28 -12.984 7.316 10.022 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -13.500 9.721 10.738 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -14.311 9.996 9.209 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -15.882 7.986 10.174 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -15.326 8.664 11.692 1.00 0.00 H new ATOM 497 N ARG A 29 -14.571 7.895 7.205 1.00 0.00 N ATOM 498 CA ARG A 29 -15.375 7.210 6.152 1.00 0.00 C ATOM 499 C ARG A 29 -14.574 6.231 5.222 1.00 0.00 C ATOM 500 O ARG A 29 -15.077 5.143 4.928 1.00 0.00 O ATOM 501 CB ARG A 29 -16.225 8.260 5.385 1.00 0.00 C ATOM 502 CG ARG A 29 -17.299 8.979 6.254 1.00 0.00 C ATOM 503 CD ARG A 29 -18.494 9.569 5.485 1.00 0.00 C ATOM 504 NE ARG A 29 -18.108 10.754 4.671 1.00 0.00 N ATOM 505 CZ ARG A 29 -18.807 11.262 3.658 1.00 0.00 C ATOM 506 NH1 ARG A 29 -19.961 10.798 3.254 1.00 0.00 N ATOM 507 NH2 ARG A 29 -18.296 12.284 3.043 1.00 0.00 N ATOM 0 H ARG A 29 -14.395 8.882 7.015 1.00 0.00 H new ATOM 0 HA ARG A 29 -16.050 6.523 6.663 1.00 0.00 H new ATOM 0 HB2 ARG A 29 -15.557 9.010 4.961 1.00 0.00 H new ATOM 0 HB3 ARG A 29 -16.722 7.767 4.550 1.00 0.00 H new ATOM 0 HG2 ARG A 29 -17.678 8.270 6.990 1.00 0.00 H new ATOM 0 HG3 ARG A 29 -16.814 9.783 6.807 1.00 0.00 H new ATOM 0 HD2 ARG A 29 -18.918 8.805 4.833 1.00 0.00 H new ATOM 0 HD3 ARG A 29 -19.274 9.854 6.191 1.00 0.00 H new ATOM 0 HE ARG A 29 -17.231 11.217 4.910 1.00 0.00 H new ATOM 0 HH11 ARG A 29 -20.381 9.996 3.724 1.00 0.00 H new ATOM 0 HH12 ARG A 29 -20.441 11.238 2.469 1.00 0.00 H new ATOM 0 HH21 ARG A 29 -17.397 12.662 3.342 1.00 0.00 H new ATOM 0 HH22 ARG A 29 -18.793 12.709 2.260 1.00 0.00 H new ATOM 521 N ALA A 30 -13.332 6.559 4.811 1.00 0.00 N ATOM 522 CA ALA A 30 -12.389 5.558 4.229 1.00 0.00 C ATOM 523 C ALA A 30 -11.952 4.380 5.172 1.00 0.00 C ATOM 524 O ALA A 30 -11.962 3.223 4.752 1.00 0.00 O ATOM 525 CB ALA A 30 -11.185 6.353 3.687 1.00 0.00 C ATOM 0 H ALA A 30 -12.951 7.504 4.867 1.00 0.00 H new ATOM 0 HA ALA A 30 -12.917 5.020 3.442 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -10.462 5.665 3.249 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -11.525 7.055 2.926 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -10.715 6.902 4.503 1.00 0.00 H new ATOM 531 N LEU A 31 -11.621 4.661 6.443 1.00 0.00 N ATOM 532 CA LEU A 31 -11.394 3.645 7.511 1.00 0.00 C ATOM 533 C LEU A 31 -12.615 2.703 7.836 1.00 0.00 C ATOM 534 O LEU A 31 -12.421 1.501 8.034 1.00 0.00 O ATOM 535 CB LEU A 31 -10.846 4.470 8.715 1.00 0.00 C ATOM 536 CG LEU A 31 -10.224 3.674 9.894 1.00 0.00 C ATOM 537 CD1 LEU A 31 -8.686 3.643 9.784 1.00 0.00 C ATOM 538 CD2 LEU A 31 -10.646 4.285 11.242 1.00 0.00 C ATOM 0 H LEU A 31 -11.499 5.618 6.775 1.00 0.00 H new ATOM 0 HA LEU A 31 -10.682 2.887 7.186 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -10.091 5.159 8.337 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -11.662 5.076 9.109 1.00 0.00 H new ATOM 0 HG LEU A 31 -10.595 2.650 9.842 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -8.273 3.080 10.621 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -8.398 3.165 8.848 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -8.299 4.662 9.806 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -10.200 3.713 12.056 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -10.305 5.319 11.295 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -11.732 4.256 11.331 1.00 0.00 H new ATOM 550 N GLN A 32 -13.862 3.211 7.816 1.00 0.00 N ATOM 551 CA GLN A 32 -15.106 2.384 7.781 1.00 0.00 C ATOM 552 C GLN A 32 -15.330 1.491 6.500 1.00 0.00 C ATOM 553 O GLN A 32 -15.891 0.398 6.611 1.00 0.00 O ATOM 554 CB GLN A 32 -16.251 3.408 8.014 1.00 0.00 C ATOM 555 CG GLN A 32 -17.655 2.825 8.293 1.00 0.00 C ATOM 556 CD GLN A 32 -18.715 3.911 8.508 1.00 0.00 C ATOM 557 OE1 GLN A 32 -19.261 4.486 7.572 1.00 0.00 O ATOM 558 NE2 GLN A 32 -19.026 4.255 9.734 1.00 0.00 N ATOM 0 H GLN A 32 -14.047 4.214 7.823 1.00 0.00 H new ATOM 0 HA GLN A 32 -15.050 1.610 8.546 1.00 0.00 H new ATOM 0 HB2 GLN A 32 -15.973 4.044 8.854 1.00 0.00 H new ATOM 0 HB3 GLN A 32 -16.317 4.051 7.136 1.00 0.00 H new ATOM 0 HG2 GLN A 32 -17.954 2.192 7.457 1.00 0.00 H new ATOM 0 HG3 GLN A 32 -17.610 2.187 9.176 1.00 0.00 H new ATOM 0 HE21 GLN A 32 -18.581 3.787 10.523 1.00 0.00 H new ATOM 0 HE22 GLN A 32 -19.713 4.991 9.899 1.00 0.00 H new ATOM 567 N GLU A 33 -14.877 1.898 5.297 1.00 0.00 N ATOM 568 CA GLU A 33 -14.671 0.944 4.161 1.00 0.00 C ATOM 569 C GLU A 33 -13.501 -0.091 4.373 1.00 0.00 C ATOM 570 O GLU A 33 -13.663 -1.260 4.016 1.00 0.00 O ATOM 571 CB GLU A 33 -14.585 1.737 2.828 1.00 0.00 C ATOM 572 CG GLU A 33 -14.626 0.889 1.524 1.00 0.00 C ATOM 573 CD GLU A 33 -15.885 0.062 1.271 1.00 0.00 C ATOM 574 OE1 GLU A 33 -16.993 0.634 1.175 1.00 0.00 O ATOM 575 OE2 GLU A 33 -15.787 -1.176 1.161 1.00 0.00 O ATOM 0 H GLU A 33 -14.646 2.867 5.077 1.00 0.00 H new ATOM 0 HA GLU A 33 -15.545 0.294 4.115 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -15.408 2.451 2.799 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -13.661 2.316 2.832 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -14.488 1.562 0.678 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -13.772 0.211 1.534 1.00 0.00 H new ATOM 582 N LEU A 34 -12.362 0.284 4.993 1.00 0.00 N ATOM 583 CA LEU A 34 -11.310 -0.684 5.434 1.00 0.00 C ATOM 584 C LEU A 34 -11.773 -1.777 6.458 1.00 0.00 C ATOM 585 O LEU A 34 -11.447 -2.946 6.243 1.00 0.00 O ATOM 586 CB LEU A 34 -10.042 0.062 5.941 1.00 0.00 C ATOM 587 CG LEU A 34 -9.291 0.979 4.936 1.00 0.00 C ATOM 588 CD1 LEU A 34 -8.175 1.759 5.651 1.00 0.00 C ATOM 589 CD2 LEU A 34 -8.706 0.193 3.748 1.00 0.00 C ATOM 0 H LEU A 34 -12.138 1.256 5.205 1.00 0.00 H new ATOM 0 HA LEU A 34 -11.068 -1.249 4.534 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -10.331 0.670 6.798 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -9.337 -0.685 6.304 1.00 0.00 H new ATOM 0 HG LEU A 34 -10.025 1.678 4.535 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -7.659 2.396 4.933 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -8.609 2.376 6.438 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -7.465 1.058 6.090 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -8.192 0.879 3.075 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -8.000 -0.551 4.116 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -9.512 -0.306 3.210 1.00 0.00 H new ATOM 601 N GLU A 35 -12.546 -1.452 7.518 1.00 0.00 N ATOM 602 CA GLU A 35 -13.191 -2.485 8.397 1.00 0.00 C ATOM 603 C GLU A 35 -14.128 -3.512 7.661 1.00 0.00 C ATOM 604 O GLU A 35 -13.970 -4.729 7.795 1.00 0.00 O ATOM 605 CB GLU A 35 -13.826 -1.798 9.644 1.00 0.00 C ATOM 606 CG GLU A 35 -15.245 -1.187 9.523 1.00 0.00 C ATOM 607 CD GLU A 35 -15.775 -0.387 10.701 1.00 0.00 C ATOM 608 OE1 GLU A 35 -15.111 -0.273 11.756 1.00 0.00 O ATOM 609 OE2 GLU A 35 -16.928 0.078 10.623 1.00 0.00 O ATOM 0 H GLU A 35 -12.745 -0.491 7.795 1.00 0.00 H new ATOM 0 HA GLU A 35 -12.397 -3.144 8.748 1.00 0.00 H new ATOM 0 HB2 GLU A 35 -13.852 -2.534 10.448 1.00 0.00 H new ATOM 0 HB3 GLU A 35 -13.151 -1.003 9.961 1.00 0.00 H new ATOM 0 HG2 GLU A 35 -15.257 -0.540 8.646 1.00 0.00 H new ATOM 0 HG3 GLU A 35 -15.944 -2.000 9.329 1.00 0.00 H new ATOM 616 N LYS A 36 -15.040 -2.996 6.817 1.00 0.00 N ATOM 617 CA LYS A 36 -15.779 -3.782 5.793 1.00 0.00 C ATOM 618 C LYS A 36 -14.883 -4.654 4.844 1.00 0.00 C ATOM 619 O LYS A 36 -15.105 -5.864 4.784 1.00 0.00 O ATOM 620 CB LYS A 36 -16.672 -2.728 5.082 1.00 0.00 C ATOM 621 CG LYS A 36 -17.547 -3.213 3.904 1.00 0.00 C ATOM 622 CD LYS A 36 -18.271 -2.022 3.239 1.00 0.00 C ATOM 623 CE LYS A 36 -18.712 -2.307 1.791 1.00 0.00 C ATOM 624 NZ LYS A 36 -19.031 -1.009 1.135 1.00 0.00 N ATOM 0 H LYS A 36 -15.293 -2.008 6.821 1.00 0.00 H new ATOM 0 HA LYS A 36 -16.377 -4.572 6.247 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -17.330 -2.285 5.830 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -16.025 -1.931 4.715 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -16.926 -3.724 3.169 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -18.279 -3.937 4.262 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -19.147 -1.761 3.833 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -17.611 -1.155 3.246 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -17.920 -2.823 1.248 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -19.584 -2.962 1.781 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -19.033 -1.133 0.102 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -19.968 -0.684 1.446 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -18.315 -0.302 1.397 1.00 0.00 H new ATOM 638 N ALA A 37 -13.878 -4.088 4.146 1.00 0.00 N ATOM 639 CA ALA A 37 -12.901 -4.868 3.336 1.00 0.00 C ATOM 640 C ALA A 37 -12.031 -5.935 4.084 1.00 0.00 C ATOM 641 O ALA A 37 -11.835 -7.023 3.542 1.00 0.00 O ATOM 642 CB ALA A 37 -12.030 -3.850 2.575 1.00 0.00 C ATOM 0 H ALA A 37 -13.715 -3.081 4.123 1.00 0.00 H new ATOM 0 HA ALA A 37 -13.487 -5.503 2.671 1.00 0.00 H new ATOM 0 HB1 ALA A 37 -11.298 -4.381 1.967 1.00 0.00 H new ATOM 0 HB2 ALA A 37 -12.663 -3.239 1.931 1.00 0.00 H new ATOM 0 HB3 ALA A 37 -11.513 -3.209 3.288 1.00 0.00 H new ATOM 648 N LEU A 38 -11.539 -5.667 5.311 1.00 0.00 N ATOM 649 CA LEU A 38 -10.869 -6.694 6.167 1.00 0.00 C ATOM 650 C LEU A 38 -11.772 -7.900 6.600 1.00 0.00 C ATOM 651 O LEU A 38 -11.348 -9.053 6.458 1.00 0.00 O ATOM 652 CB LEU A 38 -10.202 -6.000 7.393 1.00 0.00 C ATOM 653 CG LEU A 38 -8.995 -5.059 7.117 1.00 0.00 C ATOM 654 CD1 LEU A 38 -8.558 -4.358 8.415 1.00 0.00 C ATOM 655 CD2 LEU A 38 -7.799 -5.808 6.504 1.00 0.00 C ATOM 0 H LEU A 38 -11.589 -4.744 5.742 1.00 0.00 H new ATOM 0 HA LEU A 38 -10.107 -7.157 5.540 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -10.968 -5.422 7.910 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -9.871 -6.778 8.081 1.00 0.00 H new ATOM 0 HG LEU A 38 -9.328 -4.317 6.391 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -7.712 -3.702 8.207 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -9.387 -3.768 8.807 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -8.265 -5.106 9.152 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -6.982 -5.108 6.330 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -7.468 -6.588 7.189 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -8.098 -6.259 5.558 1.00 0.00 H new ATOM 667 N ALA A 39 -13.007 -7.657 7.087 1.00 0.00 N ATOM 668 CA ALA A 39 -14.017 -8.730 7.295 1.00 0.00 C ATOM 669 C ALA A 39 -14.538 -9.445 6.002 1.00 0.00 C ATOM 670 O ALA A 39 -14.552 -10.679 5.954 1.00 0.00 O ATOM 671 CB ALA A 39 -15.159 -8.106 8.119 1.00 0.00 C ATOM 0 H ALA A 39 -13.335 -6.726 7.346 1.00 0.00 H new ATOM 0 HA ALA A 39 -13.532 -9.551 7.823 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -15.929 -8.856 8.300 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -14.768 -7.751 9.072 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -15.589 -7.269 7.569 1.00 0.00 H new ATOM 677 N ARG A 40 -14.920 -8.703 4.945 1.00 0.00 N ATOM 678 CA ARG A 40 -15.341 -9.280 3.633 1.00 0.00 C ATOM 679 C ARG A 40 -14.127 -9.711 2.723 1.00 0.00 C ATOM 680 O ARG A 40 -13.951 -9.232 1.597 1.00 0.00 O ATOM 681 CB ARG A 40 -16.268 -8.189 3.021 1.00 0.00 C ATOM 682 CG ARG A 40 -17.091 -8.606 1.785 1.00 0.00 C ATOM 683 CD ARG A 40 -17.874 -7.409 1.207 1.00 0.00 C ATOM 684 NE ARG A 40 -18.552 -7.770 -0.068 1.00 0.00 N ATOM 685 CZ ARG A 40 -17.991 -7.746 -1.280 1.00 0.00 C ATOM 686 NH1 ARG A 40 -16.742 -7.410 -1.497 1.00 0.00 N ATOM 687 NH2 ARG A 40 -18.720 -8.084 -2.304 1.00 0.00 N ATOM 0 H ARG A 40 -14.949 -7.684 4.967 1.00 0.00 H new ATOM 0 HA ARG A 40 -15.871 -10.226 3.740 1.00 0.00 H new ATOM 0 HB2 ARG A 40 -16.959 -7.854 3.795 1.00 0.00 H new ATOM 0 HB3 ARG A 40 -15.653 -7.331 2.749 1.00 0.00 H new ATOM 0 HG2 ARG A 40 -16.426 -9.012 1.022 1.00 0.00 H new ATOM 0 HG3 ARG A 40 -17.785 -9.401 2.058 1.00 0.00 H new ATOM 0 HD2 ARG A 40 -18.615 -7.072 1.932 1.00 0.00 H new ATOM 0 HD3 ARG A 40 -17.193 -6.575 1.036 1.00 0.00 H new ATOM 0 HE ARG A 40 -19.528 -8.060 -0.011 1.00 0.00 H new ATOM 0 HH11 ARG A 40 -16.141 -7.148 -0.716 1.00 0.00 H new ATOM 0 HH12 ARG A 40 -16.371 -7.411 -2.447 1.00 0.00 H new ATOM 0 HH21 ARG A 40 -19.693 -8.358 -2.169 1.00 0.00 H new ATOM 0 HH22 ARG A 40 -18.318 -8.075 -3.241 1.00 0.00 H new ATOM 701 N ALA A 41 -13.298 -10.640 3.234 1.00 0.00 N ATOM 702 CA ALA A 41 -12.018 -11.069 2.600 1.00 0.00 C ATOM 703 C ALA A 41 -11.437 -12.371 3.239 1.00 0.00 C ATOM 704 O ALA A 41 -11.140 -13.318 2.506 1.00 0.00 O ATOM 705 CB ALA A 41 -10.973 -9.926 2.621 1.00 0.00 C ATOM 0 H ALA A 41 -13.492 -11.125 4.110 1.00 0.00 H new ATOM 0 HA ALA A 41 -12.249 -11.305 1.561 1.00 0.00 H new ATOM 0 HB1 ALA A 41 -10.050 -10.268 2.152 1.00 0.00 H new ATOM 0 HB2 ALA A 41 -11.362 -9.067 2.073 1.00 0.00 H new ATOM 0 HB3 ALA A 41 -10.771 -9.637 3.652 1.00 0.00 H new ATOM 711 N GLY A 42 -11.237 -12.416 4.574 1.00 0.00 N ATOM 712 CA GLY A 42 -10.642 -13.597 5.264 1.00 0.00 C ATOM 713 C GLY A 42 -9.113 -13.564 5.477 1.00 0.00 C ATOM 714 O GLY A 42 -8.411 -14.490 5.064 1.00 0.00 O ATOM 0 H GLY A 42 -11.477 -11.649 5.203 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -11.121 -13.702 6.237 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -10.889 -14.490 4.689 1.00 0.00 H new ATOM 718 N ALA A 43 -8.603 -12.524 6.156 1.00 0.00 N ATOM 719 CA ALA A 43 -7.159 -12.397 6.465 1.00 0.00 C ATOM 720 C ALA A 43 -6.759 -13.104 7.796 1.00 0.00 C ATOM 721 O ALA A 43 -7.455 -13.027 8.812 1.00 0.00 O ATOM 722 CB ALA A 43 -6.835 -10.894 6.490 1.00 0.00 C ATOM 0 H ALA A 43 -9.169 -11.751 6.506 1.00 0.00 H new ATOM 0 HA ALA A 43 -6.572 -12.904 5.699 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -5.778 -10.753 6.715 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -7.060 -10.457 5.517 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -7.437 -10.405 7.256 1.00 0.00 H new ATOM 728 N ARG A 44 -5.610 -13.793 7.768 1.00 0.00 N ATOM 729 CA ARG A 44 -5.021 -14.437 8.979 1.00 0.00 C ATOM 730 C ARG A 44 -4.065 -13.458 9.746 1.00 0.00 C ATOM 731 O ARG A 44 -4.243 -13.270 10.955 1.00 0.00 O ATOM 732 CB ARG A 44 -4.358 -15.794 8.598 1.00 0.00 C ATOM 733 CG ARG A 44 -5.299 -16.979 8.233 1.00 0.00 C ATOM 734 CD ARG A 44 -5.960 -16.898 6.838 1.00 0.00 C ATOM 735 NE ARG A 44 -6.659 -18.169 6.497 1.00 0.00 N ATOM 736 CZ ARG A 44 -6.295 -19.052 5.563 1.00 0.00 C ATOM 737 NH1 ARG A 44 -5.269 -18.910 4.764 1.00 0.00 N ATOM 738 NH2 ARG A 44 -7.009 -20.132 5.437 1.00 0.00 N ATOM 0 H ARG A 44 -5.058 -13.926 6.921 1.00 0.00 H new ATOM 0 HA ARG A 44 -5.819 -14.667 9.685 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -3.696 -15.618 7.751 1.00 0.00 H new ATOM 0 HB3 ARG A 44 -3.731 -16.108 9.433 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -4.728 -17.905 8.292 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -6.085 -17.041 8.985 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -6.671 -16.072 6.817 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -5.201 -16.684 6.085 1.00 0.00 H new ATOM 0 HE ARG A 44 -7.500 -18.387 7.031 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -4.682 -18.078 4.830 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -5.056 -19.631 4.075 1.00 0.00 H new ATOM 0 HH21 ARG A 44 -7.817 -20.282 6.041 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -6.761 -20.828 4.734 1.00 0.00 H new ATOM 752 N ASN A 45 -3.100 -12.817 9.050 1.00 0.00 N ATOM 753 CA ASN A 45 -2.380 -11.622 9.574 1.00 0.00 C ATOM 754 C ASN A 45 -2.872 -10.333 8.831 1.00 0.00 C ATOM 755 O ASN A 45 -3.163 -10.348 7.630 1.00 0.00 O ATOM 756 CB ASN A 45 -0.833 -11.745 9.428 1.00 0.00 C ATOM 757 CG ASN A 45 -0.138 -13.045 9.863 1.00 0.00 C ATOM 758 OD1 ASN A 45 -0.418 -13.637 10.897 1.00 0.00 O ATOM 759 ND2 ASN A 45 0.813 -13.520 9.094 1.00 0.00 N ATOM 0 H ASN A 45 -2.797 -13.104 8.120 1.00 0.00 H new ATOM 0 HA ASN A 45 -2.606 -11.555 10.638 1.00 0.00 H new ATOM 0 HB2 ASN A 45 -0.589 -11.578 8.379 1.00 0.00 H new ATOM 0 HB3 ASN A 45 -0.384 -10.928 9.994 1.00 0.00 H new ATOM 0 HD21 ASN A 45 1.307 -14.371 9.361 1.00 0.00 H new ATOM 0 HD22 ASN A 45 1.058 -13.038 8.229 1.00 0.00 H new ATOM 766 N VAL A 46 -2.906 -9.193 9.536 1.00 0.00 N ATOM 767 CA VAL A 46 -3.110 -7.854 8.902 1.00 0.00 C ATOM 768 C VAL A 46 -1.938 -6.963 9.415 1.00 0.00 C ATOM 769 O VAL A 46 -1.929 -6.530 10.574 1.00 0.00 O ATOM 770 CB VAL A 46 -4.542 -7.285 9.179 1.00 0.00 C ATOM 771 CG1 VAL A 46 -4.762 -5.865 8.611 1.00 0.00 C ATOM 772 CG2 VAL A 46 -5.672 -8.178 8.620 1.00 0.00 C ATOM 0 H VAL A 46 -2.796 -9.157 10.549 1.00 0.00 H new ATOM 0 HA VAL A 46 -3.079 -7.900 7.813 1.00 0.00 H new ATOM 0 HB VAL A 46 -4.591 -7.258 10.268 1.00 0.00 H new ATOM 0 HG11 VAL A 46 -5.775 -5.534 8.840 1.00 0.00 H new ATOM 0 HG12 VAL A 46 -4.046 -5.178 9.061 1.00 0.00 H new ATOM 0 HG13 VAL A 46 -4.621 -5.879 7.530 1.00 0.00 H new ATOM 0 HG21 VAL A 46 -6.638 -7.727 8.846 1.00 0.00 H new ATOM 0 HG22 VAL A 46 -5.560 -8.273 7.540 1.00 0.00 H new ATOM 0 HG23 VAL A 46 -5.616 -9.165 9.079 1.00 0.00 H new ATOM 782 N GLN A 47 -0.930 -6.705 8.561 1.00 0.00 N ATOM 783 CA GLN A 47 0.282 -5.933 8.974 1.00 0.00 C ATOM 784 C GLN A 47 0.144 -4.427 8.576 1.00 0.00 C ATOM 785 O GLN A 47 0.747 -3.934 7.620 1.00 0.00 O ATOM 786 CB GLN A 47 1.561 -6.641 8.449 1.00 0.00 C ATOM 787 CG GLN A 47 1.847 -8.038 9.072 1.00 0.00 C ATOM 788 CD GLN A 47 3.278 -8.564 8.889 1.00 0.00 C ATOM 789 OE1 GLN A 47 4.261 -7.828 8.876 1.00 0.00 O ATOM 790 NE2 GLN A 47 3.461 -9.857 8.794 1.00 0.00 N ATOM 0 H GLN A 47 -0.919 -7.011 7.588 1.00 0.00 H new ATOM 0 HA GLN A 47 0.376 -5.922 10.060 1.00 0.00 H new ATOM 0 HB2 GLN A 47 1.477 -6.753 7.368 1.00 0.00 H new ATOM 0 HB3 GLN A 47 2.418 -5.994 8.637 1.00 0.00 H new ATOM 0 HG2 GLN A 47 1.629 -7.992 10.139 1.00 0.00 H new ATOM 0 HG3 GLN A 47 1.155 -8.759 8.636 1.00 0.00 H new ATOM 0 HE21 GLN A 47 2.659 -10.488 8.803 1.00 0.00 H new ATOM 0 HE22 GLN A 47 4.405 -10.234 8.711 1.00 0.00 H new ATOM 799 N ILE A 48 -0.683 -3.694 9.330 1.00 0.00 N ATOM 800 CA ILE A 48 -1.165 -2.332 8.960 1.00 0.00 C ATOM 801 C ILE A 48 -0.179 -1.232 9.463 1.00 0.00 C ATOM 802 O ILE A 48 0.288 -1.293 10.604 1.00 0.00 O ATOM 803 CB ILE A 48 -2.634 -2.203 9.495 1.00 0.00 C ATOM 804 CG1 ILE A 48 -3.430 -1.071 8.802 1.00 0.00 C ATOM 805 CG2 ILE A 48 -2.721 -2.058 11.033 1.00 0.00 C ATOM 806 CD1 ILE A 48 -4.960 -1.180 8.970 1.00 0.00 C ATOM 0 H ILE A 48 -1.048 -4.021 10.225 1.00 0.00 H new ATOM 0 HA ILE A 48 -1.187 -2.183 7.881 1.00 0.00 H new ATOM 0 HB ILE A 48 -3.101 -3.152 9.233 1.00 0.00 H new ATOM 0 HG12 ILE A 48 -3.099 -0.112 9.201 1.00 0.00 H new ATOM 0 HG13 ILE A 48 -3.191 -1.073 7.738 1.00 0.00 H new ATOM 0 HG21 ILE A 48 -3.766 -1.974 11.332 1.00 0.00 H new ATOM 0 HG22 ILE A 48 -2.278 -2.934 11.507 1.00 0.00 H new ATOM 0 HG23 ILE A 48 -2.181 -1.164 11.345 1.00 0.00 H new ATOM 0 HD11 ILE A 48 -5.443 -0.349 8.455 1.00 0.00 H new ATOM 0 HD12 ILE A 48 -5.307 -2.122 8.544 1.00 0.00 H new ATOM 0 HD13 ILE A 48 -5.213 -1.146 10.030 1.00 0.00 H new ATOM 818 N THR A 49 0.178 -0.246 8.623 1.00 0.00 N ATOM 819 CA THR A 49 1.256 0.727 8.973 1.00 0.00 C ATOM 820 C THR A 49 0.773 2.182 8.760 1.00 0.00 C ATOM 821 O THR A 49 0.395 2.555 7.651 1.00 0.00 O ATOM 822 CB THR A 49 2.558 0.395 8.177 1.00 0.00 C ATOM 823 OG1 THR A 49 2.921 -0.970 8.367 1.00 0.00 O ATOM 824 CG2 THR A 49 3.781 1.237 8.580 1.00 0.00 C ATOM 0 H THR A 49 -0.249 -0.093 7.709 1.00 0.00 H new ATOM 0 HA THR A 49 1.496 0.636 10.032 1.00 0.00 H new ATOM 0 HB THR A 49 2.311 0.622 7.140 1.00 0.00 H new ATOM 0 HG1 THR A 49 3.738 -1.165 7.861 1.00 0.00 H new ATOM 0 HG21 THR A 49 4.640 0.941 7.978 1.00 0.00 H new ATOM 0 HG22 THR A 49 3.567 2.293 8.413 1.00 0.00 H new ATOM 0 HG23 THR A 49 4.003 1.074 9.635 1.00 0.00 H new ATOM 832 N ILE A 50 0.814 3.015 9.809 1.00 0.00 N ATOM 833 CA ILE A 50 0.470 4.460 9.698 1.00 0.00 C ATOM 834 C ILE A 50 1.776 5.315 9.682 1.00 0.00 C ATOM 835 O ILE A 50 2.478 5.420 10.694 1.00 0.00 O ATOM 836 CB ILE A 50 -0.614 4.854 10.756 1.00 0.00 C ATOM 837 CG1 ILE A 50 -1.488 6.078 10.352 1.00 0.00 C ATOM 838 CG2 ILE A 50 -0.131 4.933 12.225 1.00 0.00 C ATOM 839 CD1 ILE A 50 -0.751 7.401 10.081 1.00 0.00 C ATOM 0 H ILE A 50 1.081 2.723 10.749 1.00 0.00 H new ATOM 0 HA ILE A 50 -0.012 4.680 8.746 1.00 0.00 H new ATOM 0 HB ILE A 50 -1.272 3.985 10.736 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -2.049 5.813 9.456 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -2.216 6.251 11.145 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -0.965 5.214 12.868 1.00 0.00 H new ATOM 0 HG22 ILE A 50 0.254 3.961 12.534 1.00 0.00 H new ATOM 0 HG23 ILE A 50 0.659 5.680 12.309 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -1.473 8.171 9.810 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -0.213 7.708 10.978 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -0.044 7.263 9.263 1.00 0.00 H new ATOM 851 N SER A 51 2.082 5.963 8.542 1.00 0.00 N ATOM 852 CA SER A 51 3.166 6.980 8.470 1.00 0.00 C ATOM 853 C SER A 51 2.712 8.331 9.119 1.00 0.00 C ATOM 854 O SER A 51 1.924 9.086 8.539 1.00 0.00 O ATOM 855 CB SER A 51 3.595 7.131 6.996 1.00 0.00 C ATOM 856 OG SER A 51 4.783 7.918 6.889 1.00 0.00 O ATOM 0 H SER A 51 1.600 5.806 7.657 1.00 0.00 H new ATOM 0 HA SER A 51 4.032 6.656 9.047 1.00 0.00 H new ATOM 0 HB2 SER A 51 3.766 6.147 6.560 1.00 0.00 H new ATOM 0 HB3 SER A 51 2.792 7.598 6.425 1.00 0.00 H new ATOM 0 HG SER A 51 5.537 7.341 6.646 1.00 0.00 H new ATOM 862 N ALA A 52 3.159 8.576 10.363 1.00 0.00 N ATOM 863 CA ALA A 52 2.689 9.717 11.187 1.00 0.00 C ATOM 864 C ALA A 52 3.689 10.912 11.226 1.00 0.00 C ATOM 865 O ALA A 52 4.914 10.746 11.237 1.00 0.00 O ATOM 866 CB ALA A 52 2.446 9.171 12.607 1.00 0.00 C ATOM 0 H ALA A 52 3.854 7.994 10.830 1.00 0.00 H new ATOM 0 HA ALA A 52 1.780 10.122 10.743 1.00 0.00 H new ATOM 0 HB1 ALA A 52 2.098 9.977 13.252 1.00 0.00 H new ATOM 0 HB2 ALA A 52 1.692 8.384 12.570 1.00 0.00 H new ATOM 0 HB3 ALA A 52 3.376 8.764 13.005 1.00 0.00 H new ATOM 872 N GLU A 53 3.134 12.129 11.323 1.00 0.00 N ATOM 873 CA GLU A 53 3.931 13.391 11.345 1.00 0.00 C ATOM 874 C GLU A 53 4.716 13.689 12.673 1.00 0.00 C ATOM 875 O GLU A 53 5.856 14.156 12.614 1.00 0.00 O ATOM 876 CB GLU A 53 2.978 14.569 10.990 1.00 0.00 C ATOM 877 CG GLU A 53 2.362 14.550 9.567 1.00 0.00 C ATOM 878 CD GLU A 53 1.448 15.724 9.282 1.00 0.00 C ATOM 879 OE1 GLU A 53 0.249 15.675 9.624 1.00 0.00 O ATOM 880 OE2 GLU A 53 1.913 16.710 8.676 1.00 0.00 O ATOM 0 H GLU A 53 2.127 12.279 11.389 1.00 0.00 H new ATOM 0 HA GLU A 53 4.723 13.267 10.607 1.00 0.00 H new ATOM 0 HB2 GLU A 53 2.164 14.581 11.715 1.00 0.00 H new ATOM 0 HB3 GLU A 53 3.528 15.502 11.112 1.00 0.00 H new ATOM 0 HG2 GLU A 53 3.167 14.542 8.832 1.00 0.00 H new ATOM 0 HG3 GLU A 53 1.801 13.625 9.436 1.00 0.00 H new ATOM 887 N ASN A 54 4.099 13.483 13.853 1.00 0.00 N ATOM 888 CA ASN A 54 4.693 13.834 15.181 1.00 0.00 C ATOM 889 C ASN A 54 4.443 12.710 16.247 1.00 0.00 C ATOM 890 O ASN A 54 3.652 11.786 16.036 1.00 0.00 O ATOM 891 CB ASN A 54 4.112 15.206 15.646 1.00 0.00 C ATOM 892 CG ASN A 54 4.677 16.435 14.926 1.00 0.00 C ATOM 893 OD1 ASN A 54 5.749 16.937 15.243 1.00 0.00 O ATOM 894 ND2 ASN A 54 3.986 16.965 13.947 1.00 0.00 N ATOM 0 H ASN A 54 3.170 13.067 13.924 1.00 0.00 H new ATOM 0 HA ASN A 54 5.775 13.918 15.076 1.00 0.00 H new ATOM 0 HB2 ASN A 54 3.031 15.190 15.508 1.00 0.00 H new ATOM 0 HB3 ASN A 54 4.295 15.316 16.715 1.00 0.00 H new ATOM 0 HD21 ASN A 54 4.342 17.786 13.458 1.00 0.00 H new ATOM 0 HD22 ASN A 54 3.092 16.556 13.674 1.00 0.00 H new ATOM 901 N ASP A 55 5.101 12.806 17.417 1.00 0.00 N ATOM 902 CA ASP A 55 4.885 11.888 18.580 1.00 0.00 C ATOM 903 C ASP A 55 3.425 11.788 19.158 1.00 0.00 C ATOM 904 O ASP A 55 2.870 10.686 19.205 1.00 0.00 O ATOM 905 CB ASP A 55 5.975 12.182 19.653 1.00 0.00 C ATOM 906 CG ASP A 55 6.076 13.587 20.269 1.00 0.00 C ATOM 907 OD1 ASP A 55 5.213 14.451 19.997 1.00 0.00 O ATOM 908 OD2 ASP A 55 7.035 13.820 21.033 1.00 0.00 O ATOM 0 H ASP A 55 5.804 13.523 17.596 1.00 0.00 H new ATOM 0 HA ASP A 55 5.000 10.874 18.196 1.00 0.00 H new ATOM 0 HB2 ASP A 55 5.825 11.477 20.471 1.00 0.00 H new ATOM 0 HB3 ASP A 55 6.942 11.951 19.207 1.00 0.00 H new ATOM 913 N GLU A 56 2.779 12.908 19.541 1.00 0.00 N ATOM 914 CA GLU A 56 1.331 12.911 19.941 1.00 0.00 C ATOM 915 C GLU A 56 0.312 12.509 18.810 1.00 0.00 C ATOM 916 O GLU A 56 -0.645 11.777 19.085 1.00 0.00 O ATOM 917 CB GLU A 56 0.942 14.253 20.618 1.00 0.00 C ATOM 918 CG GLU A 56 1.610 14.528 21.993 1.00 0.00 C ATOM 919 CD GLU A 56 0.982 15.670 22.780 1.00 0.00 C ATOM 920 OE1 GLU A 56 1.265 16.846 22.471 1.00 0.00 O ATOM 921 OE2 GLU A 56 0.208 15.389 23.720 1.00 0.00 O ATOM 0 H GLU A 56 3.223 13.825 19.586 1.00 0.00 H new ATOM 0 HA GLU A 56 1.243 12.105 20.669 1.00 0.00 H new ATOM 0 HB2 GLU A 56 1.196 15.068 19.941 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -0.140 14.273 20.749 1.00 0.00 H new ATOM 0 HG2 GLU A 56 1.563 13.620 22.594 1.00 0.00 H new ATOM 0 HG3 GLU A 56 2.665 14.750 21.833 1.00 0.00 H new ATOM 928 N GLN A 57 0.553 12.906 17.540 1.00 0.00 N ATOM 929 CA GLN A 57 -0.088 12.272 16.345 1.00 0.00 C ATOM 930 C GLN A 57 0.090 10.715 16.264 1.00 0.00 C ATOM 931 O GLN A 57 -0.912 9.997 16.202 1.00 0.00 O ATOM 932 CB GLN A 57 0.434 12.958 15.044 1.00 0.00 C ATOM 933 CG GLN A 57 -0.105 14.376 14.723 1.00 0.00 C ATOM 934 CD GLN A 57 -1.519 14.397 14.131 1.00 0.00 C ATOM 935 OE1 GLN A 57 -2.519 14.358 14.837 1.00 0.00 O ATOM 936 NE2 GLN A 57 -1.657 14.459 12.826 1.00 0.00 N ATOM 0 H GLN A 57 1.190 13.667 17.306 1.00 0.00 H new ATOM 0 HA GLN A 57 -1.161 12.430 16.452 1.00 0.00 H new ATOM 0 HB2 GLN A 57 1.521 13.016 15.106 1.00 0.00 H new ATOM 0 HB3 GLN A 57 0.197 12.308 14.202 1.00 0.00 H new ATOM 0 HG2 GLN A 57 -0.098 14.970 15.637 1.00 0.00 H new ATOM 0 HG3 GLN A 57 0.576 14.860 14.023 1.00 0.00 H new ATOM 0 HE21 GLN A 57 -0.832 14.492 12.227 1.00 0.00 H new ATOM 0 HE22 GLN A 57 -2.589 14.474 12.412 1.00 0.00 H new ATOM 945 N ALA A 58 1.333 10.193 16.297 1.00 0.00 N ATOM 946 CA ALA A 58 1.619 8.735 16.376 1.00 0.00 C ATOM 947 C ALA A 58 0.956 7.923 17.537 1.00 0.00 C ATOM 948 O ALA A 58 0.571 6.778 17.293 1.00 0.00 O ATOM 949 CB ALA A 58 3.153 8.591 16.392 1.00 0.00 C ATOM 0 H ALA A 58 2.175 10.769 16.270 1.00 0.00 H new ATOM 0 HA ALA A 58 1.147 8.278 15.506 1.00 0.00 H new ATOM 0 HB1 ALA A 58 3.419 7.535 16.450 1.00 0.00 H new ATOM 0 HB2 ALA A 58 3.568 9.021 15.480 1.00 0.00 H new ATOM 0 HB3 ALA A 58 3.559 9.115 17.257 1.00 0.00 H new ATOM 955 N LYS A 59 0.760 8.495 18.746 1.00 0.00 N ATOM 956 CA LYS A 59 -0.120 7.897 19.793 1.00 0.00 C ATOM 957 C LYS A 59 -1.598 7.691 19.324 1.00 0.00 C ATOM 958 O LYS A 59 -2.027 6.541 19.236 1.00 0.00 O ATOM 959 CB LYS A 59 0.026 8.706 21.117 1.00 0.00 C ATOM 960 CG LYS A 59 -0.926 8.236 22.248 1.00 0.00 C ATOM 961 CD LYS A 59 -0.678 8.884 23.627 1.00 0.00 C ATOM 962 CE LYS A 59 -1.887 8.858 24.592 1.00 0.00 C ATOM 963 NZ LYS A 59 -2.406 7.485 24.856 1.00 0.00 N ATOM 0 H LYS A 59 1.198 9.372 19.028 1.00 0.00 H new ATOM 0 HA LYS A 59 0.218 6.879 19.989 1.00 0.00 H new ATOM 0 HB2 LYS A 59 1.056 8.629 21.467 1.00 0.00 H new ATOM 0 HB3 LYS A 59 -0.163 9.759 20.911 1.00 0.00 H new ATOM 0 HG2 LYS A 59 -1.953 8.443 21.946 1.00 0.00 H new ATOM 0 HG3 LYS A 59 -0.836 7.155 22.351 1.00 0.00 H new ATOM 0 HD2 LYS A 59 0.159 8.375 24.105 1.00 0.00 H new ATOM 0 HD3 LYS A 59 -0.377 9.920 23.475 1.00 0.00 H new ATOM 0 HE2 LYS A 59 -1.597 9.317 25.537 1.00 0.00 H new ATOM 0 HE3 LYS A 59 -2.689 9.467 24.174 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 -2.677 7.403 25.857 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 -3.237 7.307 24.257 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 -1.667 6.787 24.639 1.00 0.00 H new ATOM 977 N GLU A 60 -2.367 8.755 19.022 1.00 0.00 N ATOM 978 CA GLU A 60 -3.757 8.594 18.507 1.00 0.00 C ATOM 979 C GLU A 60 -3.925 7.849 17.145 1.00 0.00 C ATOM 980 O GLU A 60 -4.889 7.100 16.999 1.00 0.00 O ATOM 981 CB GLU A 60 -4.498 9.960 18.560 1.00 0.00 C ATOM 982 CG GLU A 60 -5.298 10.193 19.867 1.00 0.00 C ATOM 983 CD GLU A 60 -6.506 9.274 20.061 1.00 0.00 C ATOM 984 OE1 GLU A 60 -7.470 9.332 19.271 1.00 0.00 O ATOM 985 OE2 GLU A 60 -6.489 8.446 20.992 1.00 0.00 O ATOM 0 H GLU A 60 -2.063 9.724 19.121 1.00 0.00 H new ATOM 0 HA GLU A 60 -4.238 7.891 19.187 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -3.769 10.762 18.445 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -5.180 10.025 17.712 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -4.624 10.066 20.715 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -5.641 11.227 19.885 1.00 0.00 H new ATOM 992 N LEU A 61 -2.998 7.972 16.184 1.00 0.00 N ATOM 993 CA LEU A 61 -2.965 7.121 14.958 1.00 0.00 C ATOM 994 C LEU A 61 -2.667 5.595 15.211 1.00 0.00 C ATOM 995 O LEU A 61 -3.360 4.749 14.639 1.00 0.00 O ATOM 996 CB LEU A 61 -2.002 7.814 13.949 1.00 0.00 C ATOM 997 CG LEU A 61 -2.458 9.199 13.394 1.00 0.00 C ATOM 998 CD1 LEU A 61 -1.276 9.977 12.791 1.00 0.00 C ATOM 999 CD2 LEU A 61 -3.592 9.079 12.360 1.00 0.00 C ATOM 0 H LEU A 61 -2.246 8.660 16.223 1.00 0.00 H new ATOM 0 HA LEU A 61 -3.967 7.062 14.532 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -1.034 7.942 14.434 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -1.850 7.141 13.105 1.00 0.00 H new ATOM 0 HG LEU A 61 -2.849 9.753 14.247 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -1.627 10.937 12.413 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -0.520 10.143 13.559 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -0.842 9.402 11.973 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -3.870 10.072 12.008 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -3.254 8.476 11.517 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -4.457 8.603 12.822 1.00 0.00 H new ATOM 1011 N LEU A 62 -1.729 5.224 16.112 1.00 0.00 N ATOM 1012 CA LEU A 62 -1.715 3.883 16.783 1.00 0.00 C ATOM 1013 C LEU A 62 -3.057 3.462 17.472 1.00 0.00 C ATOM 1014 O LEU A 62 -3.612 2.408 17.148 1.00 0.00 O ATOM 1015 CB LEU A 62 -0.502 3.872 17.772 1.00 0.00 C ATOM 1016 CG LEU A 62 -0.358 2.728 18.817 1.00 0.00 C ATOM 1017 CD1 LEU A 62 -0.340 1.324 18.199 1.00 0.00 C ATOM 1018 CD2 LEU A 62 0.894 2.946 19.684 1.00 0.00 C ATOM 0 H LEU A 62 -0.962 5.832 16.400 1.00 0.00 H new ATOM 0 HA LEU A 62 -1.603 3.120 16.013 1.00 0.00 H new ATOM 0 HB2 LEU A 62 0.407 3.877 17.170 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -0.525 4.812 18.323 1.00 0.00 H new ATOM 0 HG LEU A 62 -1.251 2.775 19.440 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -0.237 0.580 18.989 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -1.271 1.153 17.658 1.00 0.00 H new ATOM 0 HD13 LEU A 62 0.501 1.240 17.510 1.00 0.00 H new ATOM 0 HD21 LEU A 62 0.980 2.137 20.409 1.00 0.00 H new ATOM 0 HD22 LEU A 62 1.779 2.958 19.048 1.00 0.00 H new ATOM 0 HD23 LEU A 62 0.811 3.897 20.210 1.00 0.00 H new ATOM 1030 N GLU A 63 -3.550 4.258 18.434 1.00 0.00 N ATOM 1031 CA GLU A 63 -4.730 3.897 19.267 1.00 0.00 C ATOM 1032 C GLU A 63 -6.095 3.877 18.495 1.00 0.00 C ATOM 1033 O GLU A 63 -6.883 2.954 18.706 1.00 0.00 O ATOM 1034 CB GLU A 63 -4.707 4.756 20.563 1.00 0.00 C ATOM 1035 CG GLU A 63 -3.494 4.476 21.502 1.00 0.00 C ATOM 1036 CD GLU A 63 -3.320 5.315 22.758 1.00 0.00 C ATOM 1037 OE1 GLU A 63 -3.911 6.405 22.911 1.00 0.00 O ATOM 1038 OE2 GLU A 63 -2.498 4.918 23.608 1.00 0.00 O ATOM 0 H GLU A 63 -3.151 5.168 18.663 1.00 0.00 H new ATOM 0 HA GLU A 63 -4.646 2.850 19.559 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -4.700 5.810 20.285 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -5.628 4.579 21.118 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -3.552 3.432 21.810 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -2.587 4.583 20.907 1.00 0.00 H new ATOM 1045 N LEU A 64 -6.352 4.791 17.538 1.00 0.00 N ATOM 1046 CA LEU A 64 -7.385 4.619 16.471 1.00 0.00 C ATOM 1047 C LEU A 64 -7.324 3.274 15.663 1.00 0.00 C ATOM 1048 O LEU A 64 -8.365 2.630 15.503 1.00 0.00 O ATOM 1049 CB LEU A 64 -7.342 5.913 15.610 1.00 0.00 C ATOM 1050 CG LEU A 64 -8.323 6.023 14.412 1.00 0.00 C ATOM 1051 CD1 LEU A 64 -8.847 7.460 14.237 1.00 0.00 C ATOM 1052 CD2 LEU A 64 -7.655 5.560 13.101 1.00 0.00 C ATOM 0 H LEU A 64 -5.852 5.677 17.474 1.00 0.00 H new ATOM 0 HA LEU A 64 -8.366 4.501 16.930 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -7.525 6.760 16.271 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -6.329 6.024 15.223 1.00 0.00 H new ATOM 0 HG LEU A 64 -9.166 5.369 14.635 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -9.531 7.497 13.389 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -9.373 7.768 15.141 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -8.009 8.134 14.057 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -8.366 5.648 12.279 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -6.785 6.183 12.896 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -7.342 4.521 13.200 1.00 0.00 H new ATOM 1064 N ILE A 65 -6.136 2.815 15.212 1.00 0.00 N ATOM 1065 CA ILE A 65 -5.952 1.421 14.687 1.00 0.00 C ATOM 1066 C ILE A 65 -6.269 0.304 15.751 1.00 0.00 C ATOM 1067 O ILE A 65 -6.983 -0.642 15.412 1.00 0.00 O ATOM 1068 CB ILE A 65 -4.556 1.255 13.980 1.00 0.00 C ATOM 1069 CG1 ILE A 65 -4.445 2.132 12.696 1.00 0.00 C ATOM 1070 CG2 ILE A 65 -4.239 -0.214 13.594 1.00 0.00 C ATOM 1071 CD1 ILE A 65 -3.056 2.184 12.039 1.00 0.00 C ATOM 0 H ILE A 65 -5.286 3.378 15.196 1.00 0.00 H new ATOM 0 HA ILE A 65 -6.706 1.268 13.915 1.00 0.00 H new ATOM 0 HB ILE A 65 -3.829 1.586 14.721 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -5.160 1.760 11.962 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -4.746 3.149 12.947 1.00 0.00 H new ATOM 0 HG21 ILE A 65 -3.263 -0.261 13.111 1.00 0.00 H new ATOM 0 HG22 ILE A 65 -4.229 -0.832 14.492 1.00 0.00 H new ATOM 0 HG23 ILE A 65 -5.002 -0.583 12.908 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -3.095 2.822 11.156 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -2.333 2.589 12.747 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -2.754 1.178 11.747 1.00 0.00 H new ATOM 1083 N ALA A 66 -5.767 0.383 17.001 1.00 0.00 N ATOM 1084 CA ALA A 66 -6.180 -0.550 18.088 1.00 0.00 C ATOM 1085 C ALA A 66 -7.715 -0.593 18.402 1.00 0.00 C ATOM 1086 O ALA A 66 -8.286 -1.684 18.384 1.00 0.00 O ATOM 1087 CB ALA A 66 -5.333 -0.245 19.336 1.00 0.00 C ATOM 0 H ALA A 66 -5.078 1.078 17.289 1.00 0.00 H new ATOM 0 HA ALA A 66 -5.987 -1.561 17.730 1.00 0.00 H new ATOM 0 HB1 ALA A 66 -5.620 -0.918 20.144 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -4.278 -0.387 19.103 1.00 0.00 H new ATOM 0 HB3 ALA A 66 -5.500 0.786 19.646 1.00 0.00 H new ATOM 1093 N ARG A 67 -8.400 0.561 18.573 1.00 0.00 N ATOM 1094 CA ARG A 67 -9.893 0.647 18.501 1.00 0.00 C ATOM 1095 C ARG A 67 -10.556 -0.033 17.243 1.00 0.00 C ATOM 1096 O ARG A 67 -11.515 -0.790 17.413 1.00 0.00 O ATOM 1097 CB ARG A 67 -10.347 2.136 18.653 1.00 0.00 C ATOM 1098 CG ARG A 67 -10.502 2.719 20.093 1.00 0.00 C ATOM 1099 CD ARG A 67 -9.457 3.758 20.561 1.00 0.00 C ATOM 1100 NE ARG A 67 -9.564 5.032 19.789 1.00 0.00 N ATOM 1101 CZ ARG A 67 -8.792 6.110 19.949 1.00 0.00 C ATOM 1102 NH1 ARG A 67 -7.902 6.232 20.899 1.00 0.00 N ATOM 1103 NH2 ARG A 67 -8.932 7.098 19.116 1.00 0.00 N ATOM 0 H ARG A 67 -7.947 1.455 18.763 1.00 0.00 H new ATOM 0 HA ARG A 67 -10.260 0.053 19.338 1.00 0.00 H new ATOM 0 HB2 ARG A 67 -9.630 2.758 18.118 1.00 0.00 H new ATOM 0 HB3 ARG A 67 -11.305 2.245 18.145 1.00 0.00 H new ATOM 0 HG2 ARG A 67 -11.488 3.178 20.165 1.00 0.00 H new ATOM 0 HG3 ARG A 67 -10.486 1.886 20.796 1.00 0.00 H new ATOM 0 HD2 ARG A 67 -9.597 3.962 21.623 1.00 0.00 H new ATOM 0 HD3 ARG A 67 -8.455 3.345 20.445 1.00 0.00 H new ATOM 0 HE ARG A 67 -10.292 5.083 19.076 1.00 0.00 H new ATOM 0 HH11 ARG A 67 -7.767 5.477 21.571 1.00 0.00 H new ATOM 0 HH12 ARG A 67 -7.343 7.082 20.968 1.00 0.00 H new ATOM 0 HH21 ARG A 67 -9.618 7.038 18.364 1.00 0.00 H new ATOM 0 HH22 ARG A 67 -8.356 7.934 19.215 1.00 0.00 H new ATOM 1117 N LEU A 68 -10.042 0.182 16.012 1.00 0.00 N ATOM 1118 CA LEU A 68 -10.482 -0.556 14.794 1.00 0.00 C ATOM 1119 C LEU A 68 -10.274 -2.112 14.855 1.00 0.00 C ATOM 1120 O LEU A 68 -11.248 -2.858 14.744 1.00 0.00 O ATOM 1121 CB LEU A 68 -9.765 0.116 13.585 1.00 0.00 C ATOM 1122 CG LEU A 68 -10.350 -0.209 12.184 1.00 0.00 C ATOM 1123 CD1 LEU A 68 -11.616 0.625 11.905 1.00 0.00 C ATOM 1124 CD2 LEU A 68 -9.308 0.059 11.088 1.00 0.00 C ATOM 0 H LEU A 68 -9.311 0.870 15.829 1.00 0.00 H new ATOM 0 HA LEU A 68 -11.565 -0.478 14.696 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -9.791 1.196 13.727 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -8.717 -0.182 13.598 1.00 0.00 H new ATOM 0 HG LEU A 68 -10.617 -1.266 12.175 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -12.005 0.377 10.917 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -12.372 0.403 12.658 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -11.368 1.686 11.942 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -9.737 -0.175 10.113 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -9.015 1.109 11.113 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -8.432 -0.566 11.258 1.00 0.00 H new ATOM 1136 N LEU A 69 -9.040 -2.612 15.051 1.00 0.00 N ATOM 1137 CA LEU A 69 -8.742 -4.078 15.090 1.00 0.00 C ATOM 1138 C LEU A 69 -9.261 -4.868 16.344 1.00 0.00 C ATOM 1139 O LEU A 69 -9.591 -6.051 16.209 1.00 0.00 O ATOM 1140 CB LEU A 69 -7.229 -4.293 14.793 1.00 0.00 C ATOM 1141 CG LEU A 69 -6.750 -4.239 13.311 1.00 0.00 C ATOM 1142 CD1 LEU A 69 -7.428 -5.280 12.405 1.00 0.00 C ATOM 1143 CD2 LEU A 69 -6.883 -2.870 12.642 1.00 0.00 C ATOM 0 H LEU A 69 -8.217 -2.025 15.187 1.00 0.00 H new ATOM 0 HA LEU A 69 -9.341 -4.536 14.303 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -6.671 -3.540 15.350 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -6.946 -5.264 15.198 1.00 0.00 H new ATOM 0 HG LEU A 69 -5.689 -4.472 13.407 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -7.045 -5.183 11.389 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -7.215 -6.281 12.779 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -8.505 -5.115 12.404 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -6.525 -2.931 11.614 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -7.929 -2.564 12.644 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -6.290 -2.138 13.190 1.00 0.00 H new ATOM 1155 N GLN A 70 -9.418 -4.237 17.525 1.00 0.00 N ATOM 1156 CA GLN A 70 -10.298 -4.758 18.618 1.00 0.00 C ATOM 1157 C GLN A 70 -11.827 -4.836 18.256 1.00 0.00 C ATOM 1158 O GLN A 70 -12.462 -5.842 18.576 1.00 0.00 O ATOM 1159 CB GLN A 70 -10.069 -3.922 19.908 1.00 0.00 C ATOM 1160 CG GLN A 70 -8.672 -4.077 20.567 1.00 0.00 C ATOM 1161 CD GLN A 70 -8.417 -3.109 21.724 1.00 0.00 C ATOM 1162 OE1 GLN A 70 -7.909 -2.006 21.557 1.00 0.00 O ATOM 1163 NE2 GLN A 70 -8.748 -3.482 22.935 1.00 0.00 N ATOM 0 H GLN A 70 -8.949 -3.361 17.757 1.00 0.00 H new ATOM 0 HA GLN A 70 -10.005 -5.795 18.780 1.00 0.00 H new ATOM 0 HB2 GLN A 70 -10.224 -2.870 19.670 1.00 0.00 H new ATOM 0 HB3 GLN A 70 -10.829 -4.199 20.639 1.00 0.00 H new ATOM 0 HG2 GLN A 70 -8.565 -5.099 20.932 1.00 0.00 H new ATOM 0 HG3 GLN A 70 -7.905 -3.928 19.807 1.00 0.00 H new ATOM 0 HE21 GLN A 70 -9.172 -4.397 23.089 1.00 0.00 H new ATOM 0 HE22 GLN A 70 -8.582 -2.857 23.724 1.00 0.00 H new ATOM 1172 N LYS A 71 -12.405 -3.827 17.565 1.00 0.00 N ATOM 1173 CA LYS A 71 -13.761 -3.926 16.935 1.00 0.00 C ATOM 1174 C LYS A 71 -13.932 -5.064 15.865 1.00 0.00 C ATOM 1175 O LYS A 71 -14.972 -5.726 15.873 1.00 0.00 O ATOM 1176 CB LYS A 71 -14.136 -2.496 16.441 1.00 0.00 C ATOM 1177 CG LYS A 71 -15.566 -2.248 15.893 1.00 0.00 C ATOM 1178 CD LYS A 71 -15.741 -2.587 14.391 1.00 0.00 C ATOM 1179 CE LYS A 71 -17.082 -2.143 13.771 1.00 0.00 C ATOM 1180 NZ LYS A 71 -17.072 -0.685 13.480 1.00 0.00 N ATOM 0 H LYS A 71 -11.956 -2.922 17.423 1.00 0.00 H new ATOM 0 HA LYS A 71 -14.480 -4.262 17.682 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -13.976 -1.807 17.271 1.00 0.00 H new ATOM 0 HB3 LYS A 71 -13.430 -2.221 15.658 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -16.273 -2.842 16.472 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -15.826 -1.201 16.050 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -14.929 -2.122 13.833 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -15.639 -3.665 14.264 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -17.265 -2.700 12.852 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -17.899 -2.377 14.454 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -17.773 -0.474 12.741 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -17.310 -0.157 14.344 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -16.126 -0.403 13.151 1.00 0.00 H new ATOM 1194 N LEU A 72 -12.945 -5.329 14.982 1.00 0.00 N ATOM 1195 CA LEU A 72 -12.908 -6.586 14.170 1.00 0.00 C ATOM 1196 C LEU A 72 -12.742 -7.924 14.983 1.00 0.00 C ATOM 1197 O LEU A 72 -13.378 -8.919 14.631 1.00 0.00 O ATOM 1198 CB LEU A 72 -11.797 -6.504 13.074 1.00 0.00 C ATOM 1199 CG LEU A 72 -11.991 -5.661 11.785 1.00 0.00 C ATOM 1200 CD1 LEU A 72 -13.325 -5.940 11.075 1.00 0.00 C ATOM 1201 CD2 LEU A 72 -11.794 -4.155 11.990 1.00 0.00 C ATOM 0 H LEU A 72 -12.162 -4.699 14.807 1.00 0.00 H new ATOM 0 HA LEU A 72 -13.900 -6.639 13.722 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -10.896 -6.133 13.563 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -11.589 -7.526 12.756 1.00 0.00 H new ATOM 0 HG LEU A 72 -11.188 -5.998 11.129 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -13.399 -5.319 10.182 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -13.373 -6.991 10.791 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -14.151 -5.708 11.748 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -11.947 -3.636 11.044 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -12.513 -3.791 12.724 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -10.782 -3.966 12.349 1.00 0.00 H new ATOM 1213 N GLY A 73 -11.868 -7.965 16.004 1.00 0.00 N ATOM 1214 CA GLY A 73 -11.564 -9.201 16.781 1.00 0.00 C ATOM 1215 C GLY A 73 -10.189 -9.862 16.512 1.00 0.00 C ATOM 1216 O GLY A 73 -10.114 -11.083 16.353 1.00 0.00 O ATOM 0 H GLY A 73 -11.347 -7.147 16.321 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -11.626 -8.961 17.843 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -12.343 -9.935 16.574 1.00 0.00 H new ATOM 1220 N TYR A 74 -9.104 -9.072 16.512 1.00 0.00 N ATOM 1221 CA TYR A 74 -7.722 -9.570 16.265 1.00 0.00 C ATOM 1222 C TYR A 74 -6.942 -9.559 17.616 1.00 0.00 C ATOM 1223 O TYR A 74 -6.581 -8.498 18.134 1.00 0.00 O ATOM 1224 CB TYR A 74 -7.051 -8.688 15.173 1.00 0.00 C ATOM 1225 CG TYR A 74 -7.417 -9.032 13.713 1.00 0.00 C ATOM 1226 CD1 TYR A 74 -8.661 -8.693 13.174 1.00 0.00 C ATOM 1227 CD2 TYR A 74 -6.475 -9.674 12.899 1.00 0.00 C ATOM 1228 CE1 TYR A 74 -8.973 -9.015 11.853 1.00 0.00 C ATOM 1229 CE2 TYR A 74 -6.782 -9.989 11.579 1.00 0.00 C ATOM 1230 CZ TYR A 74 -8.030 -9.670 11.060 1.00 0.00 C ATOM 1231 OH TYR A 74 -8.334 -9.997 9.767 1.00 0.00 O ATOM 0 H TYR A 74 -9.149 -8.067 16.682 1.00 0.00 H new ATOM 0 HA TYR A 74 -7.726 -10.594 15.893 1.00 0.00 H new ATOM 0 HB2 TYR A 74 -7.317 -7.647 15.359 1.00 0.00 H new ATOM 0 HB3 TYR A 74 -5.969 -8.765 15.284 1.00 0.00 H new ATOM 0 HD1 TYR A 74 -9.387 -8.177 13.785 1.00 0.00 H new ATOM 0 HD2 TYR A 74 -5.504 -9.926 13.299 1.00 0.00 H new ATOM 0 HE1 TYR A 74 -9.940 -8.759 11.446 1.00 0.00 H new ATOM 0 HE2 TYR A 74 -6.049 -10.482 10.957 1.00 0.00 H new ATOM 0 HH TYR A 74 -8.033 -10.911 9.581 1.00 0.00 H new ATOM 1241 N LYS A 75 -6.719 -10.748 18.204 1.00 0.00 N ATOM 1242 CA LYS A 75 -6.193 -10.880 19.598 1.00 0.00 C ATOM 1243 C LYS A 75 -4.673 -10.578 19.832 1.00 0.00 C ATOM 1244 O LYS A 75 -4.346 -9.933 20.831 1.00 0.00 O ATOM 1245 CB LYS A 75 -6.659 -12.247 20.183 1.00 0.00 C ATOM 1246 CG LYS A 75 -5.963 -13.519 19.627 1.00 0.00 C ATOM 1247 CD LYS A 75 -6.486 -14.872 20.151 1.00 0.00 C ATOM 1248 CE LYS A 75 -7.921 -15.216 19.702 1.00 0.00 C ATOM 1249 NZ LYS A 75 -8.191 -16.662 19.928 1.00 0.00 N ATOM 0 H LYS A 75 -6.892 -11.641 17.743 1.00 0.00 H new ATOM 0 HA LYS A 75 -6.634 -10.057 20.160 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -6.511 -12.223 21.263 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -7.731 -12.343 20.010 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -6.058 -13.513 18.541 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -4.899 -13.453 19.854 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -5.814 -15.662 19.816 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -6.451 -14.864 21.240 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -8.639 -14.612 20.257 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -8.049 -14.974 18.647 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -9.160 -16.886 19.623 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -7.515 -17.231 19.380 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -8.087 -16.881 20.939 1.00 0.00 H new ATOM 1263 N ASP A 76 -3.758 -11.062 18.969 1.00 0.00 N ATOM 1264 CA ASP A 76 -2.293 -10.870 19.151 1.00 0.00 C ATOM 1265 C ASP A 76 -1.820 -9.627 18.328 1.00 0.00 C ATOM 1266 O ASP A 76 -1.985 -9.577 17.104 1.00 0.00 O ATOM 1267 CB ASP A 76 -1.600 -12.200 18.772 1.00 0.00 C ATOM 1268 CG ASP A 76 -0.102 -12.221 19.062 1.00 0.00 C ATOM 1269 OD1 ASP A 76 0.682 -11.743 18.213 1.00 0.00 O ATOM 1270 OD2 ASP A 76 0.300 -12.704 20.137 1.00 0.00 O ATOM 0 H ASP A 76 -4.003 -11.592 18.133 1.00 0.00 H new ATOM 0 HA ASP A 76 -2.023 -10.646 20.183 1.00 0.00 H new ATOM 0 HB2 ASP A 76 -2.077 -13.015 19.316 1.00 0.00 H new ATOM 0 HB3 ASP A 76 -1.757 -12.391 17.710 1.00 0.00 H new ATOM 1275 N ILE A 77 -1.288 -8.610 19.031 1.00 0.00 N ATOM 1276 CA ILE A 77 -1.050 -7.247 18.468 1.00 0.00 C ATOM 1277 C ILE A 77 0.431 -6.851 18.809 1.00 0.00 C ATOM 1278 O ILE A 77 0.729 -6.462 19.944 1.00 0.00 O ATOM 1279 CB ILE A 77 -2.129 -6.231 19.021 1.00 0.00 C ATOM 1280 CG1 ILE A 77 -3.605 -6.598 18.649 1.00 0.00 C ATOM 1281 CG2 ILE A 77 -1.839 -4.764 18.598 1.00 0.00 C ATOM 1282 CD1 ILE A 77 -4.713 -5.800 19.361 1.00 0.00 C ATOM 0 H ILE A 77 -1.007 -8.700 20.007 1.00 0.00 H new ATOM 0 HA ILE A 77 -1.167 -7.226 17.384 1.00 0.00 H new ATOM 0 HB ILE A 77 -2.036 -6.316 20.104 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -3.728 -6.468 17.574 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -3.757 -7.656 18.861 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -2.610 -4.109 19.004 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -0.865 -4.460 18.982 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -1.838 -4.692 17.510 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -5.688 -6.147 19.019 1.00 0.00 H new ATOM 0 HD12 ILE A 77 -4.633 -5.947 20.438 1.00 0.00 H new ATOM 0 HD13 ILE A 77 -4.603 -4.740 19.131 1.00 0.00 H new ATOM 1294 N ASN A 78 1.344 -6.898 17.822 1.00 0.00 N ATOM 1295 CA ASN A 78 2.742 -6.388 17.977 1.00 0.00 C ATOM 1296 C ASN A 78 2.841 -4.892 17.518 1.00 0.00 C ATOM 1297 O ASN A 78 2.394 -4.539 16.424 1.00 0.00 O ATOM 1298 CB ASN A 78 3.720 -7.304 17.171 1.00 0.00 C ATOM 1299 CG ASN A 78 4.772 -8.093 17.953 1.00 0.00 C ATOM 1300 OD1 ASN A 78 4.975 -7.960 19.153 1.00 0.00 O ATOM 1301 ND2 ASN A 78 5.511 -8.931 17.262 1.00 0.00 N ATOM 0 H ASN A 78 1.148 -7.284 16.898 1.00 0.00 H new ATOM 0 HA ASN A 78 3.026 -6.420 19.029 1.00 0.00 H new ATOM 0 HB2 ASN A 78 3.120 -8.017 16.605 1.00 0.00 H new ATOM 0 HB3 ASN A 78 4.242 -6.679 16.446 1.00 0.00 H new ATOM 0 HD21 ASN A 78 6.247 -9.464 17.726 1.00 0.00 H new ATOM 0 HD22 ASN A 78 5.349 -9.048 16.262 1.00 0.00 H new ATOM 1308 N VAL A 79 3.447 -4.013 18.333 1.00 0.00 N ATOM 1309 CA VAL A 79 3.516 -2.545 18.035 1.00 0.00 C ATOM 1310 C VAL A 79 5.005 -2.144 17.764 1.00 0.00 C ATOM 1311 O VAL A 79 5.820 -2.106 18.693 1.00 0.00 O ATOM 1312 CB VAL A 79 2.837 -1.715 19.185 1.00 0.00 C ATOM 1313 CG1 VAL A 79 2.944 -0.186 18.977 1.00 0.00 C ATOM 1314 CG2 VAL A 79 1.333 -2.038 19.374 1.00 0.00 C ATOM 0 H VAL A 79 3.901 -4.279 19.207 1.00 0.00 H new ATOM 0 HA VAL A 79 2.952 -2.312 17.132 1.00 0.00 H new ATOM 0 HB VAL A 79 3.396 -2.015 20.071 1.00 0.00 H new ATOM 0 HG11 VAL A 79 2.456 0.329 19.805 1.00 0.00 H new ATOM 0 HG12 VAL A 79 3.994 0.103 18.938 1.00 0.00 H new ATOM 0 HG13 VAL A 79 2.457 0.089 18.041 1.00 0.00 H new ATOM 0 HG21 VAL A 79 0.929 -1.430 20.183 1.00 0.00 H new ATOM 0 HG22 VAL A 79 0.795 -1.819 18.452 1.00 0.00 H new ATOM 0 HG23 VAL A 79 1.216 -3.093 19.620 1.00 0.00 H new ATOM 1324 N ARG A 80 5.347 -1.792 16.508 1.00 0.00 N ATOM 1325 CA ARG A 80 6.679 -1.219 16.163 1.00 0.00 C ATOM 1326 C ARG A 80 6.548 0.296 15.793 1.00 0.00 C ATOM 1327 O ARG A 80 6.034 0.639 14.725 1.00 0.00 O ATOM 1328 CB ARG A 80 7.312 -2.080 15.031 1.00 0.00 C ATOM 1329 CG ARG A 80 8.725 -1.608 14.602 1.00 0.00 C ATOM 1330 CD ARG A 80 9.404 -2.501 13.547 1.00 0.00 C ATOM 1331 NE ARG A 80 10.670 -1.864 13.075 1.00 0.00 N ATOM 1332 CZ ARG A 80 11.871 -1.984 13.646 1.00 0.00 C ATOM 1333 NH1 ARG A 80 12.109 -2.751 14.681 1.00 0.00 N ATOM 1334 NH2 ARG A 80 12.860 -1.296 13.151 1.00 0.00 N ATOM 0 H ARG A 80 4.722 -1.892 15.708 1.00 0.00 H new ATOM 0 HA ARG A 80 7.349 -1.255 17.022 1.00 0.00 H new ATOM 0 HB2 ARG A 80 7.371 -3.116 15.365 1.00 0.00 H new ATOM 0 HB3 ARG A 80 6.654 -2.062 14.162 1.00 0.00 H new ATOM 0 HG2 ARG A 80 8.652 -0.594 14.208 1.00 0.00 H new ATOM 0 HG3 ARG A 80 9.362 -1.562 15.485 1.00 0.00 H new ATOM 0 HD2 ARG A 80 9.617 -3.482 13.972 1.00 0.00 H new ATOM 0 HD3 ARG A 80 8.731 -2.658 12.704 1.00 0.00 H new ATOM 0 HE ARG A 80 10.612 -1.283 12.239 1.00 0.00 H new ATOM 0 HH11 ARG A 80 11.354 -3.298 15.094 1.00 0.00 H new ATOM 0 HH12 ARG A 80 13.049 -2.801 15.073 1.00 0.00 H new ATOM 0 HH21 ARG A 80 12.706 -0.686 12.348 1.00 0.00 H new ATOM 0 HH22 ARG A 80 13.789 -1.367 13.566 1.00 0.00 H new ATOM 1348 N VAL A 81 7.091 1.189 16.640 1.00 0.00 N ATOM 1349 CA VAL A 81 7.195 2.652 16.335 1.00 0.00 C ATOM 1350 C VAL A 81 8.584 2.920 15.655 1.00 0.00 C ATOM 1351 O VAL A 81 9.634 2.839 16.303 1.00 0.00 O ATOM 1352 CB VAL A 81 6.967 3.512 17.631 1.00 0.00 C ATOM 1353 CG1 VAL A 81 7.039 5.036 17.362 1.00 0.00 C ATOM 1354 CG2 VAL A 81 5.619 3.261 18.352 1.00 0.00 C ATOM 0 H VAL A 81 7.471 0.933 17.551 1.00 0.00 H new ATOM 0 HA VAL A 81 6.412 2.954 15.640 1.00 0.00 H new ATOM 0 HB VAL A 81 7.784 3.181 18.272 1.00 0.00 H new ATOM 0 HG11 VAL A 81 6.874 5.578 18.293 1.00 0.00 H new ATOM 0 HG12 VAL A 81 8.022 5.289 16.964 1.00 0.00 H new ATOM 0 HG13 VAL A 81 6.272 5.315 16.639 1.00 0.00 H new ATOM 0 HG21 VAL A 81 5.553 3.899 19.233 1.00 0.00 H new ATOM 0 HG22 VAL A 81 4.796 3.491 17.675 1.00 0.00 H new ATOM 0 HG23 VAL A 81 5.558 2.216 18.656 1.00 0.00 H new ATOM 1364 N ASN A 82 8.590 3.268 14.356 1.00 0.00 N ATOM 1365 CA ASN A 82 9.825 3.646 13.612 1.00 0.00 C ATOM 1366 C ASN A 82 10.065 5.196 13.686 1.00 0.00 C ATOM 1367 O ASN A 82 9.817 5.934 12.725 1.00 0.00 O ATOM 1368 CB ASN A 82 9.629 3.076 12.177 1.00 0.00 C ATOM 1369 CG ASN A 82 10.892 3.048 11.314 1.00 0.00 C ATOM 1370 OD1 ASN A 82 11.810 2.270 11.556 1.00 0.00 O ATOM 1371 ND2 ASN A 82 10.973 3.853 10.279 1.00 0.00 N ATOM 0 H ASN A 82 7.745 3.298 13.785 1.00 0.00 H new ATOM 0 HA ASN A 82 10.737 3.228 14.039 1.00 0.00 H new ATOM 0 HB2 ASN A 82 9.238 2.061 12.256 1.00 0.00 H new ATOM 0 HB3 ASN A 82 8.871 3.671 11.666 1.00 0.00 H new ATOM 0 HD21 ASN A 82 11.797 3.831 9.679 1.00 0.00 H new ATOM 0 HD22 ASN A 82 10.212 4.500 10.076 1.00 0.00 H new ATOM 1378 N GLY A 83 10.502 5.692 14.862 1.00 0.00 N ATOM 1379 CA GLY A 83 10.511 7.155 15.164 1.00 0.00 C ATOM 1380 C GLY A 83 9.113 7.759 15.431 1.00 0.00 C ATOM 1381 O GLY A 83 8.687 7.885 16.580 1.00 0.00 O ATOM 0 H GLY A 83 10.854 5.110 15.622 1.00 0.00 H new ATOM 0 HA2 GLY A 83 11.142 7.330 16.035 1.00 0.00 H new ATOM 0 HA3 GLY A 83 10.969 7.684 14.328 1.00 0.00 H new ATOM 1385 N THR A 84 8.417 8.098 14.342 1.00 0.00 N ATOM 1386 CA THR A 84 6.951 8.419 14.356 1.00 0.00 C ATOM 1387 C THR A 84 6.060 7.337 13.650 1.00 0.00 C ATOM 1388 O THR A 84 4.941 7.094 14.107 1.00 0.00 O ATOM 1389 CB THR A 84 6.642 9.833 13.772 1.00 0.00 C ATOM 1390 OG1 THR A 84 6.996 9.911 12.391 1.00 0.00 O ATOM 1391 CG2 THR A 84 7.321 11.006 14.493 1.00 0.00 C ATOM 0 H THR A 84 8.837 8.163 13.415 1.00 0.00 H new ATOM 0 HA THR A 84 6.683 8.416 15.413 1.00 0.00 H new ATOM 0 HB THR A 84 5.567 9.939 13.921 1.00 0.00 H new ATOM 0 HG1 THR A 84 6.187 9.849 11.842 1.00 0.00 H new ATOM 0 HG21 THR A 84 7.041 11.942 14.009 1.00 0.00 H new ATOM 0 HG22 THR A 84 7.002 11.027 15.535 1.00 0.00 H new ATOM 0 HG23 THR A 84 8.403 10.884 14.448 1.00 0.00 H new ATOM 1399 N GLU A 85 6.516 6.712 12.544 1.00 0.00 N ATOM 1400 CA GLU A 85 5.700 5.792 11.705 1.00 0.00 C ATOM 1401 C GLU A 85 5.408 4.441 12.432 1.00 0.00 C ATOM 1402 O GLU A 85 6.333 3.695 12.772 1.00 0.00 O ATOM 1403 CB GLU A 85 6.425 5.524 10.357 1.00 0.00 C ATOM 1404 CG GLU A 85 6.916 6.747 9.538 1.00 0.00 C ATOM 1405 CD GLU A 85 7.436 6.367 8.168 1.00 0.00 C ATOM 1406 OE1 GLU A 85 8.590 5.899 8.068 1.00 0.00 O ATOM 1407 OE2 GLU A 85 6.682 6.535 7.183 1.00 0.00 O ATOM 0 H GLU A 85 7.469 6.829 12.200 1.00 0.00 H new ATOM 0 HA GLU A 85 4.742 6.277 11.518 1.00 0.00 H new ATOM 0 HB2 GLU A 85 7.288 4.891 10.562 1.00 0.00 H new ATOM 0 HB3 GLU A 85 5.751 4.947 9.724 1.00 0.00 H new ATOM 0 HG2 GLU A 85 6.096 7.456 9.426 1.00 0.00 H new ATOM 0 HG3 GLU A 85 7.704 7.256 10.092 1.00 0.00 H new ATOM 1414 N VAL A 86 4.131 4.132 12.704 1.00 0.00 N ATOM 1415 CA VAL A 86 3.764 2.982 13.581 1.00 0.00 C ATOM 1416 C VAL A 86 3.279 1.796 12.692 1.00 0.00 C ATOM 1417 O VAL A 86 2.254 1.892 12.012 1.00 0.00 O ATOM 1418 CB VAL A 86 2.755 3.352 14.725 1.00 0.00 C ATOM 1419 CG1 VAL A 86 2.708 2.240 15.800 1.00 0.00 C ATOM 1420 CG2 VAL A 86 3.055 4.681 15.460 1.00 0.00 C ATOM 0 H VAL A 86 3.332 4.651 12.338 1.00 0.00 H new ATOM 0 HA VAL A 86 4.658 2.671 14.123 1.00 0.00 H new ATOM 0 HB VAL A 86 1.804 3.465 14.205 1.00 0.00 H new ATOM 0 HG11 VAL A 86 2.002 2.519 16.582 1.00 0.00 H new ATOM 0 HG12 VAL A 86 2.390 1.304 15.341 1.00 0.00 H new ATOM 0 HG13 VAL A 86 3.699 2.112 16.235 1.00 0.00 H new ATOM 0 HG21 VAL A 86 2.303 4.848 16.231 1.00 0.00 H new ATOM 0 HG22 VAL A 86 4.041 4.627 15.921 1.00 0.00 H new ATOM 0 HG23 VAL A 86 3.032 5.505 14.746 1.00 0.00 H new ATOM 1430 N LYS A 87 4.006 0.669 12.735 1.00 0.00 N ATOM 1431 CA LYS A 87 3.566 -0.617 12.134 1.00 0.00 C ATOM 1432 C LYS A 87 2.862 -1.489 13.223 1.00 0.00 C ATOM 1433 O LYS A 87 3.507 -1.968 14.164 1.00 0.00 O ATOM 1434 CB LYS A 87 4.811 -1.256 11.458 1.00 0.00 C ATOM 1435 CG LYS A 87 4.585 -2.608 10.732 1.00 0.00 C ATOM 1436 CD LYS A 87 5.064 -3.821 11.563 1.00 0.00 C ATOM 1437 CE LYS A 87 4.729 -5.204 10.978 1.00 0.00 C ATOM 1438 NZ LYS A 87 5.461 -5.528 9.727 1.00 0.00 N ATOM 0 H LYS A 87 4.919 0.615 13.187 1.00 0.00 H new ATOM 0 HA LYS A 87 2.812 -0.496 11.357 1.00 0.00 H new ATOM 0 HB2 LYS A 87 5.211 -0.544 10.736 1.00 0.00 H new ATOM 0 HB3 LYS A 87 5.576 -1.402 12.220 1.00 0.00 H new ATOM 0 HG2 LYS A 87 3.524 -2.722 10.508 1.00 0.00 H new ATOM 0 HG3 LYS A 87 5.112 -2.596 9.778 1.00 0.00 H new ATOM 0 HD2 LYS A 87 6.145 -3.751 11.685 1.00 0.00 H new ATOM 0 HD3 LYS A 87 4.626 -3.752 12.559 1.00 0.00 H new ATOM 0 HE2 LYS A 87 4.953 -5.966 11.725 1.00 0.00 H new ATOM 0 HE3 LYS A 87 3.658 -5.254 10.783 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 5.207 -6.487 9.415 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 5.204 -4.844 8.987 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 6.485 -5.481 9.902 1.00 0.00 H new ATOM 1452 N ILE A 88 1.536 -1.681 13.087 1.00 0.00 N ATOM 1453 CA ILE A 88 0.724 -2.496 14.032 1.00 0.00 C ATOM 1454 C ILE A 88 0.539 -3.901 13.357 1.00 0.00 C ATOM 1455 O ILE A 88 -0.132 -4.062 12.331 1.00 0.00 O ATOM 1456 CB ILE A 88 -0.631 -1.800 14.428 1.00 0.00 C ATOM 1457 CG1 ILE A 88 -0.566 -0.336 14.962 1.00 0.00 C ATOM 1458 CG2 ILE A 88 -1.348 -2.609 15.538 1.00 0.00 C ATOM 1459 CD1 ILE A 88 -0.309 0.759 13.918 1.00 0.00 C ATOM 0 H ILE A 88 0.992 -1.280 12.323 1.00 0.00 H new ATOM 0 HA ILE A 88 1.234 -2.607 14.989 1.00 0.00 H new ATOM 0 HB ILE A 88 -1.152 -1.770 13.471 1.00 0.00 H new ATOM 0 HG12 ILE A 88 -1.507 -0.114 15.466 1.00 0.00 H new ATOM 0 HG13 ILE A 88 0.220 -0.281 15.715 1.00 0.00 H new ATOM 0 HG21 ILE A 88 -2.283 -2.115 15.801 1.00 0.00 H new ATOM 0 HG22 ILE A 88 -1.558 -3.616 15.177 1.00 0.00 H new ATOM 0 HG23 ILE A 88 -0.707 -2.666 16.418 1.00 0.00 H new ATOM 0 HD11 ILE A 88 -0.286 1.732 14.409 1.00 0.00 H new ATOM 0 HD12 ILE A 88 0.647 0.577 13.428 1.00 0.00 H new ATOM 0 HD13 ILE A 88 -1.106 0.747 13.175 1.00 0.00 H new ATOM 1471 N GLU A 89 1.176 -4.916 13.943 1.00 0.00 N ATOM 1472 CA GLU A 89 1.275 -6.282 13.376 1.00 0.00 C ATOM 1473 C GLU A 89 0.236 -7.216 14.065 1.00 0.00 C ATOM 1474 O GLU A 89 0.503 -7.773 15.138 1.00 0.00 O ATOM 1475 CB GLU A 89 2.750 -6.675 13.640 1.00 0.00 C ATOM 1476 CG GLU A 89 3.220 -8.025 13.057 1.00 0.00 C ATOM 1477 CD GLU A 89 4.638 -8.389 13.481 1.00 0.00 C ATOM 1478 OE1 GLU A 89 4.808 -9.057 14.527 1.00 0.00 O ATOM 1479 OE2 GLU A 89 5.584 -8.021 12.758 1.00 0.00 O ATOM 0 H GLU A 89 1.649 -4.821 14.841 1.00 0.00 H new ATOM 0 HA GLU A 89 1.042 -6.355 12.314 1.00 0.00 H new ATOM 0 HB2 GLU A 89 3.389 -5.889 13.238 1.00 0.00 H new ATOM 0 HB3 GLU A 89 2.910 -6.695 14.718 1.00 0.00 H new ATOM 0 HG2 GLU A 89 2.537 -8.812 13.377 1.00 0.00 H new ATOM 0 HG3 GLU A 89 3.170 -7.983 11.969 1.00 0.00 H new ATOM 1486 N VAL A 90 -0.961 -7.355 13.469 1.00 0.00 N ATOM 1487 CA VAL A 90 -2.106 -8.043 14.140 1.00 0.00 C ATOM 1488 C VAL A 90 -2.398 -9.441 13.508 1.00 0.00 C ATOM 1489 O VAL A 90 -2.287 -9.631 12.291 1.00 0.00 O ATOM 1490 CB VAL A 90 -3.388 -7.153 14.283 1.00 0.00 C ATOM 1491 CG1 VAL A 90 -3.134 -5.761 14.889 1.00 0.00 C ATOM 1492 CG2 VAL A 90 -4.232 -6.953 13.012 1.00 0.00 C ATOM 0 H VAL A 90 -1.172 -7.008 12.533 1.00 0.00 H new ATOM 0 HA VAL A 90 -1.784 -8.222 15.166 1.00 0.00 H new ATOM 0 HB VAL A 90 -3.962 -7.769 14.975 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -4.075 -5.214 14.951 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -2.711 -5.871 15.888 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -2.436 -5.211 14.258 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -5.090 -6.320 13.241 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -3.624 -6.477 12.243 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -4.581 -7.920 12.651 1.00 0.00 H new ATOM 1502 N ARG A 91 -2.830 -10.408 14.333 1.00 0.00 N ATOM 1503 CA ARG A 91 -3.244 -11.759 13.853 1.00 0.00 C ATOM 1504 C ARG A 91 -4.369 -12.391 14.739 1.00 0.00 C ATOM 1505 O ARG A 91 -4.538 -12.078 15.923 1.00 0.00 O ATOM 1506 CB ARG A 91 -2.024 -12.698 13.595 1.00 0.00 C ATOM 1507 CG ARG A 91 -0.916 -12.794 14.678 1.00 0.00 C ATOM 1508 CD ARG A 91 0.325 -11.943 14.354 1.00 0.00 C ATOM 1509 NE ARG A 91 1.178 -11.829 15.566 1.00 0.00 N ATOM 1510 CZ ARG A 91 2.396 -11.311 15.603 1.00 0.00 C ATOM 1511 NH1 ARG A 91 3.144 -11.143 14.549 1.00 0.00 N ATOM 1512 NH2 ARG A 91 2.855 -10.966 16.766 1.00 0.00 N ATOM 0 H ARG A 91 -2.906 -10.289 15.343 1.00 0.00 H new ATOM 0 HA ARG A 91 -3.705 -11.624 12.875 1.00 0.00 H new ATOM 0 HB2 ARG A 91 -2.410 -13.703 13.427 1.00 0.00 H new ATOM 0 HB3 ARG A 91 -1.552 -12.379 12.666 1.00 0.00 H new ATOM 0 HG2 ARG A 91 -1.326 -12.477 15.637 1.00 0.00 H new ATOM 0 HG3 ARG A 91 -0.615 -13.836 14.789 1.00 0.00 H new ATOM 0 HD2 ARG A 91 0.889 -12.399 13.541 1.00 0.00 H new ATOM 0 HD3 ARG A 91 0.022 -10.952 14.015 1.00 0.00 H new ATOM 0 HE ARG A 91 0.793 -12.179 16.443 1.00 0.00 H new ATOM 0 HH11 ARG A 91 2.798 -11.417 13.629 1.00 0.00 H new ATOM 0 HH12 ARG A 91 4.075 -10.738 14.644 1.00 0.00 H new ATOM 0 HH21 ARG A 91 2.283 -11.098 17.600 1.00 0.00 H new ATOM 0 HH22 ARG A 91 3.788 -10.562 16.847 1.00 0.00 H new ATOM 1526 N VAL A 92 -5.164 -13.294 14.127 1.00 0.00 N ATOM 1527 CA VAL A 92 -6.382 -13.879 14.763 1.00 0.00 C ATOM 1528 C VAL A 92 -5.936 -15.065 15.649 1.00 0.00 C ATOM 1529 O VAL A 92 -6.515 -15.328 16.706 1.00 0.00 O ATOM 1530 CB VAL A 92 -7.449 -14.303 13.690 1.00 0.00 C ATOM 1531 CG1 VAL A 92 -8.770 -14.823 14.313 1.00 0.00 C ATOM 1532 CG2 VAL A 92 -7.856 -13.179 12.706 1.00 0.00 C ATOM 0 H VAL A 92 -4.989 -13.642 13.184 1.00 0.00 H new ATOM 0 HA VAL A 92 -6.875 -13.131 15.384 1.00 0.00 H new ATOM 0 HB VAL A 92 -6.927 -15.094 13.152 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -9.463 -15.099 13.518 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -8.562 -15.696 14.932 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -9.215 -14.041 14.928 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -8.595 -13.562 12.002 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -8.283 -12.345 13.263 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -6.977 -12.838 12.159 1.00 0.00 H new TER 1542 VAL A 92