USER MOD reduce.3.24.130724 H: found=0, std=0, add=758, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 752 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 95 HIS : no HD1:sc= -3 K(o=-4.4,f=-2.8) USER MOD Set 1.2: A 96 HIS : no HD1:sc= -1.41 K(o=-4.4,f=-2.8) USER MOD Set 2.1: A 61 TYR OH : rot -78:sc= 0.0027 USER MOD Set 2.2: A 65 ASN : amide:sc= -1.86 K(o=-1.9,f=-1.2) USER MOD Set 3.1: A 31 SER OG : rot -98:sc= 0.737 USER MOD Set 3.2: A 68 HIS : no HE2:sc= -8.03! C(o=-7.3!,f=-15!) USER MOD Set 4.1: A 13 SER OG : rot 180:sc= 0 USER MOD Set 4.2: A 17 ASN : amide:sc= 0.477 K(o=0.48,f=-0.14) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 6 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 8 ASN : amide:sc= -2.41! C(o=-2.4!,f=-3.1!) USER MOD Single : A 9 ASN : amide:sc= -1.53 K(o=-1.5,f=-0.41) USER MOD Single : A 12 GLN : amide:sc= -1.45! C(o=-1.4!,f=-1.4!) USER MOD Single : A 16 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 20 SER OG : rot 180:sc= 0.00474 USER MOD Single : A 22 GLN : amide:sc= -0.19 X(o=-0.19,f=-0.047) USER MOD Single : A 25 HIS : no HD1:sc= -6.43! C(o=-6.4!,f=-11!) USER MOD Single : A 27 SER OG : rot 126:sc= 0.141 USER MOD Single : A 32 HIS : no HD1:sc= -0.661 K(o=-0.66,f=-1.5) USER MOD Single : A 34 GLN : amide:sc= -10.4! C(o=-10!,f=-17!) USER MOD Single : A 45 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 49 LYS NZ :NH3+ 169:sc= 0 (180deg=-0.117) USER MOD Single : A 50 LYS NZ :NH3+ -171:sc= 0.0311 (180deg=0.0263) USER MOD Single : A 51 GLN : amide:sc= -2.58 K(o=-2.6,f=-0.92) USER MOD Single : A 52 GLN : amide:sc= -0.107 K(o=-0.11,f=-1.2) USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 55 TYR OH : rot 180:sc= -2.31! USER MOD Single : A 59 MET CE :methyl 173:sc= 0 (180deg=-0.121) USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 TYR OH : rot 180:sc= 0 USER MOD Single : A 76 THR OG1 : rot 180:sc= 0.502 USER MOD Single : A 85 LYS NZ :NH3+ -124:sc= -0.113 (180deg=-0.686) USER MOD Single : A 87 ASN : amide:sc=-0.00182 X(o=-0.0018,f=-0.28) USER MOD Single : A 92 HIS : no HD1:sc= -0.832 K(o=-0.83,f=0.022) USER MOD Single : A 93 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 94 HIS : no HD1:sc= -1.7 K(o=-1.7,f=-1.2) USER MOD Single : A 97 HIS : no HD1:sc= 0 X(o=0,f=-0.013) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.325 0.000 0.000 1.00 0.00 N ATOM 2 CA MET A 1 2.073 0.000 -1.245 1.00 0.00 C ATOM 3 C MET A 1 2.681 1.377 -1.520 1.00 0.00 C ATOM 4 O MET A 1 1.968 2.316 -1.869 1.00 0.00 O ATOM 5 CB MET A 1 1.146 -0.388 -2.399 1.00 0.00 C ATOM 6 CG MET A 1 0.922 -1.901 -2.437 1.00 0.00 C ATOM 7 SD MET A 1 1.117 -2.505 -4.105 1.00 0.00 S ATOM 8 CE MET A 1 2.774 -3.161 -4.005 1.00 0.00 C ATOM 0 H1 MET A 1 0.923 -0.945 0.163 1.00 0.00 H new ATOM 0 H2 MET A 1 1.959 0.247 0.786 1.00 0.00 H new ATOM 0 H3 MET A 1 0.556 0.698 -0.057 1.00 0.00 H new ATOM 0 HA MET A 1 2.883 -0.724 -1.159 1.00 0.00 H new ATOM 0 HB2 MET A 1 0.189 0.122 -2.289 1.00 0.00 H new ATOM 0 HB3 MET A 1 1.577 -0.057 -3.344 1.00 0.00 H new ATOM 0 HG2 MET A 1 1.632 -2.399 -1.776 1.00 0.00 H new ATOM 0 HG3 MET A 1 -0.076 -2.138 -2.070 1.00 0.00 H new ATOM 0 HE1 MET A 1 3.058 -3.581 -4.970 1.00 0.00 H new ATOM 0 HE2 MET A 1 3.466 -2.362 -3.740 1.00 0.00 H new ATOM 0 HE3 MET A 1 2.811 -3.941 -3.244 1.00 0.00 H new ATOM 18 N ILE A 2 3.993 1.454 -1.351 1.00 0.00 N ATOM 19 CA ILE A 2 4.705 2.700 -1.576 1.00 0.00 C ATOM 20 C ILE A 2 6.206 2.465 -1.393 1.00 0.00 C ATOM 21 O ILE A 2 6.663 1.323 -1.388 1.00 0.00 O ATOM 22 CB ILE A 2 4.142 3.807 -0.683 1.00 0.00 C ATOM 23 CG1 ILE A 2 4.139 5.152 -1.413 1.00 0.00 C ATOM 24 CG2 ILE A 2 4.899 3.878 0.645 1.00 0.00 C ATOM 25 CD1 ILE A 2 2.713 5.580 -1.767 1.00 0.00 C ATOM 0 H ILE A 2 4.582 0.673 -1.061 1.00 0.00 H new ATOM 0 HA ILE A 2 4.559 3.043 -2.600 1.00 0.00 H new ATOM 0 HB ILE A 2 3.105 3.564 -0.451 1.00 0.00 H new ATOM 0 HG12 ILE A 2 4.605 5.912 -0.786 1.00 0.00 H new ATOM 0 HG13 ILE A 2 4.737 5.078 -2.322 1.00 0.00 H new ATOM 0 HG21 ILE A 2 4.479 4.673 1.261 1.00 0.00 H new ATOM 0 HG22 ILE A 2 4.806 2.926 1.168 1.00 0.00 H new ATOM 0 HG23 ILE A 2 5.952 4.085 0.453 1.00 0.00 H new ATOM 0 HD11 ILE A 2 2.739 6.539 -2.285 1.00 0.00 H new ATOM 0 HD12 ILE A 2 2.258 4.830 -2.414 1.00 0.00 H new ATOM 0 HD13 ILE A 2 2.125 5.676 -0.854 1.00 0.00 H new ATOM 37 N GLU A 3 6.931 3.565 -1.247 1.00 0.00 N ATOM 38 CA GLU A 3 8.371 3.493 -1.064 1.00 0.00 C ATOM 39 C GLU A 3 8.833 4.559 -0.070 1.00 0.00 C ATOM 40 O GLU A 3 8.087 4.937 0.833 1.00 0.00 O ATOM 41 CB GLU A 3 9.101 3.636 -2.401 1.00 0.00 C ATOM 42 CG GLU A 3 10.273 2.657 -2.493 1.00 0.00 C ATOM 43 CD GLU A 3 11.307 3.134 -3.515 1.00 0.00 C ATOM 44 OE1 GLU A 3 11.512 4.347 -3.669 1.00 0.00 O ATOM 45 OE2 GLU A 3 11.909 2.194 -4.161 1.00 0.00 O ATOM 0 H GLU A 3 6.548 4.510 -1.252 1.00 0.00 H new ATOM 0 HA GLU A 3 8.618 2.513 -0.656 1.00 0.00 H new ATOM 0 HB2 GLU A 3 8.406 3.454 -3.220 1.00 0.00 H new ATOM 0 HB3 GLU A 3 9.466 4.657 -2.513 1.00 0.00 H new ATOM 0 HG2 GLU A 3 10.743 2.554 -1.515 1.00 0.00 H new ATOM 0 HG3 GLU A 3 9.906 1.670 -2.775 1.00 0.00 H new ATOM 53 N ASP A 4 10.061 5.015 -0.268 1.00 0.00 N ATOM 54 CA ASP A 4 10.632 6.031 0.601 1.00 0.00 C ATOM 55 C ASP A 4 11.407 7.042 -0.246 1.00 0.00 C ATOM 56 O ASP A 4 12.634 7.106 -0.176 1.00 0.00 O ATOM 57 CB ASP A 4 11.605 5.412 1.606 1.00 0.00 C ATOM 58 CG ASP A 4 11.865 6.255 2.856 1.00 0.00 C ATOM 59 OD1 ASP A 4 10.934 6.812 3.457 1.00 0.00 O ATOM 60 OD2 ASP A 4 13.102 6.330 3.216 1.00 0.00 O ATOM 0 H ASP A 4 10.677 4.700 -1.017 1.00 0.00 H new ATOM 0 HA ASP A 4 9.816 6.513 1.139 1.00 0.00 H new ATOM 0 HB2 ASP A 4 11.217 4.441 1.915 1.00 0.00 H new ATOM 0 HB3 ASP A 4 12.555 5.230 1.104 1.00 0.00 H new ATOM 66 N PRO A 5 10.640 7.829 -1.048 1.00 0.00 N ATOM 67 CA PRO A 5 11.241 8.834 -1.907 1.00 0.00 C ATOM 68 C PRO A 5 11.697 10.048 -1.094 1.00 0.00 C ATOM 69 O PRO A 5 11.819 9.971 0.127 1.00 0.00 O ATOM 70 CB PRO A 5 10.168 9.172 -2.928 1.00 0.00 C ATOM 71 CG PRO A 5 8.856 8.693 -2.328 1.00 0.00 C ATOM 72 CD PRO A 5 9.185 7.781 -1.157 1.00 0.00 C ATOM 0 HA PRO A 5 12.145 8.478 -2.402 1.00 0.00 H new ATOM 0 HB2 PRO A 5 10.139 10.244 -3.124 1.00 0.00 H new ATOM 0 HB3 PRO A 5 10.365 8.679 -3.880 1.00 0.00 H new ATOM 0 HG2 PRO A 5 8.256 9.540 -1.995 1.00 0.00 H new ATOM 0 HG3 PRO A 5 8.267 8.159 -3.074 1.00 0.00 H new ATOM 0 HD2 PRO A 5 8.708 8.126 -0.240 1.00 0.00 H new ATOM 0 HD3 PRO A 5 8.835 6.765 -1.336 1.00 0.00 H new ATOM 80 N MET A 6 11.938 11.140 -1.806 1.00 0.00 N ATOM 81 CA MET A 6 12.378 12.368 -1.166 1.00 0.00 C ATOM 82 C MET A 6 11.666 13.583 -1.764 1.00 0.00 C ATOM 83 O MET A 6 10.967 14.307 -1.058 1.00 0.00 O ATOM 84 CB MET A 6 13.889 12.523 -1.343 1.00 0.00 C ATOM 85 CG MET A 6 14.565 12.865 -0.013 1.00 0.00 C ATOM 86 SD MET A 6 15.103 14.567 -0.023 1.00 0.00 S ATOM 87 CE MET A 6 16.618 14.418 0.908 1.00 0.00 C ATOM 0 H MET A 6 11.837 11.199 -2.819 1.00 0.00 H new ATOM 0 HA MET A 6 12.132 12.312 -0.106 1.00 0.00 H new ATOM 0 HB2 MET A 6 14.309 11.599 -1.741 1.00 0.00 H new ATOM 0 HB3 MET A 6 14.095 13.307 -2.072 1.00 0.00 H new ATOM 0 HG2 MET A 6 13.871 12.699 0.811 1.00 0.00 H new ATOM 0 HG3 MET A 6 15.418 12.206 0.151 1.00 0.00 H new ATOM 0 HE1 MET A 6 17.088 15.397 0.998 1.00 0.00 H new ATOM 0 HE2 MET A 6 16.397 14.029 1.902 1.00 0.00 H new ATOM 0 HE3 MET A 6 17.296 13.736 0.394 1.00 0.00 H new ATOM 97 N GLU A 7 11.870 13.769 -3.060 1.00 0.00 N ATOM 98 CA GLU A 7 11.257 14.884 -3.762 1.00 0.00 C ATOM 99 C GLU A 7 11.664 14.872 -5.237 1.00 0.00 C ATOM 100 O GLU A 7 11.875 15.926 -5.834 1.00 0.00 O ATOM 101 CB GLU A 7 11.623 16.215 -3.102 1.00 0.00 C ATOM 102 CG GLU A 7 13.090 16.225 -2.666 1.00 0.00 C ATOM 103 CD GLU A 7 13.826 17.434 -3.246 1.00 0.00 C ATOM 104 OE1 GLU A 7 13.527 17.861 -4.371 1.00 0.00 O ATOM 105 OE2 GLU A 7 14.738 17.935 -2.483 1.00 0.00 O ATOM 0 H GLU A 7 12.451 13.166 -3.642 1.00 0.00 H new ATOM 0 HA GLU A 7 10.174 14.773 -3.704 1.00 0.00 H new ATOM 0 HB2 GLU A 7 11.441 17.033 -3.799 1.00 0.00 H new ATOM 0 HB3 GLU A 7 10.982 16.385 -2.237 1.00 0.00 H new ATOM 0 HG2 GLU A 7 13.150 16.246 -1.578 1.00 0.00 H new ATOM 0 HG3 GLU A 7 13.577 15.307 -2.994 1.00 0.00 H new ATOM 113 N ASN A 8 11.763 13.668 -5.781 1.00 0.00 N ATOM 114 CA ASN A 8 12.141 13.505 -7.174 1.00 0.00 C ATOM 115 C ASN A 8 10.904 13.675 -8.057 1.00 0.00 C ATOM 116 O ASN A 8 10.971 13.482 -9.270 1.00 0.00 O ATOM 117 CB ASN A 8 12.716 12.110 -7.429 1.00 0.00 C ATOM 118 CG ASN A 8 11.827 11.029 -6.810 1.00 0.00 C ATOM 119 OD1 ASN A 8 10.714 10.781 -7.244 1.00 0.00 O ATOM 120 ND2 ASN A 8 12.378 10.403 -5.775 1.00 0.00 N ATOM 0 H ASN A 8 11.588 12.796 -5.282 1.00 0.00 H new ATOM 0 HA ASN A 8 12.897 14.255 -7.408 1.00 0.00 H new ATOM 0 HB2 ASN A 8 12.807 11.941 -8.502 1.00 0.00 H new ATOM 0 HB3 ASN A 8 13.720 12.044 -7.010 1.00 0.00 H new ATOM 0 HD21 ASN A 8 11.864 9.665 -5.293 1.00 0.00 H new ATOM 0 HD22 ASN A 8 13.314 10.660 -5.463 1.00 0.00 H new ATOM 127 N ASN A 9 9.802 14.035 -7.415 1.00 0.00 N ATOM 128 CA ASN A 9 8.552 14.234 -8.127 1.00 0.00 C ATOM 129 C ASN A 9 8.671 15.468 -9.024 1.00 0.00 C ATOM 130 O ASN A 9 7.949 15.594 -10.012 1.00 0.00 O ATOM 131 CB ASN A 9 7.395 14.467 -7.154 1.00 0.00 C ATOM 132 CG ASN A 9 6.080 14.680 -7.906 1.00 0.00 C ATOM 133 OD1 ASN A 9 5.288 13.771 -8.095 1.00 0.00 O ATOM 134 ND2 ASN A 9 5.892 15.929 -8.325 1.00 0.00 N ATOM 0 H ASN A 9 9.749 14.194 -6.409 1.00 0.00 H new ATOM 0 HA ASN A 9 8.354 13.338 -8.716 1.00 0.00 H new ATOM 0 HB2 ASN A 9 7.301 13.612 -6.484 1.00 0.00 H new ATOM 0 HB3 ASN A 9 7.608 15.337 -6.532 1.00 0.00 H new ATOM 0 HD21 ASN A 9 5.045 16.173 -8.838 1.00 0.00 H new ATOM 0 HD22 ASN A 9 6.595 16.643 -8.133 1.00 0.00 H new ATOM 141 N GLU A 10 9.588 16.348 -8.647 1.00 0.00 N ATOM 142 CA GLU A 10 9.811 17.567 -9.405 1.00 0.00 C ATOM 143 C GLU A 10 10.329 17.235 -10.806 1.00 0.00 C ATOM 144 O GLU A 10 9.754 17.669 -11.803 1.00 0.00 O ATOM 145 CB GLU A 10 10.776 18.500 -8.671 1.00 0.00 C ATOM 146 CG GLU A 10 10.230 19.929 -8.625 1.00 0.00 C ATOM 147 CD GLU A 10 11.357 20.939 -8.404 1.00 0.00 C ATOM 148 OE1 GLU A 10 12.526 20.637 -8.689 1.00 0.00 O ATOM 149 OE2 GLU A 10 10.984 22.075 -7.918 1.00 0.00 O ATOM 0 H GLU A 10 10.185 16.241 -7.827 1.00 0.00 H new ATOM 0 HA GLU A 10 8.859 18.088 -9.505 1.00 0.00 H new ATOM 0 HB2 GLU A 10 10.938 18.136 -7.656 1.00 0.00 H new ATOM 0 HB3 GLU A 10 11.745 18.493 -9.171 1.00 0.00 H new ATOM 0 HG2 GLU A 10 9.712 20.155 -9.557 1.00 0.00 H new ATOM 0 HG3 GLU A 10 9.496 20.016 -7.824 1.00 0.00 H new ATOM 157 N ILE A 11 11.408 16.467 -10.836 1.00 0.00 N ATOM 158 CA ILE A 11 12.010 16.071 -12.098 1.00 0.00 C ATOM 159 C ILE A 11 11.076 15.098 -12.820 1.00 0.00 C ATOM 160 O ILE A 11 11.151 14.950 -14.039 1.00 0.00 O ATOM 161 CB ILE A 11 13.417 15.517 -11.870 1.00 0.00 C ATOM 162 CG1 ILE A 11 14.075 16.173 -10.654 1.00 0.00 C ATOM 163 CG2 ILE A 11 14.274 15.659 -13.130 1.00 0.00 C ATOM 164 CD1 ILE A 11 13.969 15.272 -9.421 1.00 0.00 C ATOM 0 H ILE A 11 11.881 16.108 -10.007 1.00 0.00 H new ATOM 0 HA ILE A 11 12.135 16.937 -12.749 1.00 0.00 H new ATOM 0 HB ILE A 11 13.333 14.452 -11.656 1.00 0.00 H new ATOM 0 HG12 ILE A 11 15.123 16.378 -10.870 1.00 0.00 H new ATOM 0 HG13 ILE A 11 13.598 17.132 -10.451 1.00 0.00 H new ATOM 0 HG21 ILE A 11 15.269 15.257 -12.940 1.00 0.00 H new ATOM 0 HG22 ILE A 11 13.811 15.109 -13.949 1.00 0.00 H new ATOM 0 HG23 ILE A 11 14.353 16.712 -13.399 1.00 0.00 H new ATOM 0 HD11 ILE A 11 14.444 15.761 -8.571 1.00 0.00 H new ATOM 0 HD12 ILE A 11 12.919 15.089 -9.194 1.00 0.00 H new ATOM 0 HD13 ILE A 11 14.468 14.324 -9.619 1.00 0.00 H new ATOM 176 N GLN A 12 10.217 14.461 -12.038 1.00 0.00 N ATOM 177 CA GLN A 12 9.269 13.507 -12.588 1.00 0.00 C ATOM 178 C GLN A 12 8.123 14.241 -13.289 1.00 0.00 C ATOM 179 O GLN A 12 7.615 13.776 -14.307 1.00 0.00 O ATOM 180 CB GLN A 12 8.737 12.573 -11.500 1.00 0.00 C ATOM 181 CG GLN A 12 8.578 11.147 -12.031 1.00 0.00 C ATOM 182 CD GLN A 12 7.668 10.321 -11.120 1.00 0.00 C ATOM 183 OE1 GLN A 12 6.597 9.880 -11.503 1.00 0.00 O ATOM 184 NE2 GLN A 12 8.153 10.136 -9.895 1.00 0.00 N ATOM 0 H GLN A 12 10.158 14.587 -11.028 1.00 0.00 H new ATOM 0 HA GLN A 12 9.787 12.894 -13.325 1.00 0.00 H new ATOM 0 HB2 GLN A 12 9.419 12.574 -10.649 1.00 0.00 H new ATOM 0 HB3 GLN A 12 7.776 12.940 -11.139 1.00 0.00 H new ATOM 0 HG2 GLN A 12 8.162 11.174 -13.038 1.00 0.00 H new ATOM 0 HG3 GLN A 12 9.556 10.671 -12.103 1.00 0.00 H new ATOM 0 HE21 GLN A 12 9.057 10.533 -9.639 1.00 0.00 H new ATOM 0 HE22 GLN A 12 7.621 9.597 -9.212 1.00 0.00 H new ATOM 193 N SER A 13 7.750 15.375 -12.714 1.00 0.00 N ATOM 194 CA SER A 13 6.674 16.177 -13.271 1.00 0.00 C ATOM 195 C SER A 13 7.149 16.879 -14.544 1.00 0.00 C ATOM 196 O SER A 13 6.415 16.951 -15.529 1.00 0.00 O ATOM 197 CB SER A 13 6.171 17.205 -12.255 1.00 0.00 C ATOM 198 OG SER A 13 5.015 17.895 -12.721 1.00 0.00 O ATOM 0 H SER A 13 8.174 15.757 -11.868 1.00 0.00 H new ATOM 0 HA SER A 13 5.845 15.513 -13.517 1.00 0.00 H new ATOM 0 HB2 SER A 13 5.939 16.703 -11.316 1.00 0.00 H new ATOM 0 HB3 SER A 13 6.962 17.924 -12.045 1.00 0.00 H new ATOM 0 HG SER A 13 4.724 18.541 -12.044 1.00 0.00 H new ATOM 204 N VAL A 14 8.375 17.380 -14.484 1.00 0.00 N ATOM 205 CA VAL A 14 8.957 18.074 -15.620 1.00 0.00 C ATOM 206 C VAL A 14 9.335 17.053 -16.696 1.00 0.00 C ATOM 207 O VAL A 14 9.283 17.354 -17.888 1.00 0.00 O ATOM 208 CB VAL A 14 10.141 18.927 -15.162 1.00 0.00 C ATOM 209 CG1 VAL A 14 9.707 19.944 -14.105 1.00 0.00 C ATOM 210 CG2 VAL A 14 11.281 18.048 -14.643 1.00 0.00 C ATOM 0 H VAL A 14 8.981 17.319 -13.666 1.00 0.00 H new ATOM 0 HA VAL A 14 8.233 18.759 -16.062 1.00 0.00 H new ATOM 0 HB VAL A 14 10.511 19.479 -16.026 1.00 0.00 H new ATOM 0 HG11 VAL A 14 10.567 20.538 -13.796 1.00 0.00 H new ATOM 0 HG12 VAL A 14 8.944 20.601 -14.523 1.00 0.00 H new ATOM 0 HG13 VAL A 14 9.299 19.419 -13.241 1.00 0.00 H new ATOM 0 HG21 VAL A 14 12.110 18.679 -14.324 1.00 0.00 H new ATOM 0 HG22 VAL A 14 10.929 17.457 -13.798 1.00 0.00 H new ATOM 0 HG23 VAL A 14 11.617 17.381 -15.437 1.00 0.00 H new ATOM 220 N LEU A 15 9.708 15.868 -16.237 1.00 0.00 N ATOM 221 CA LEU A 15 10.095 14.802 -17.145 1.00 0.00 C ATOM 222 C LEU A 15 8.859 14.303 -17.895 1.00 0.00 C ATOM 223 O LEU A 15 8.925 14.025 -19.092 1.00 0.00 O ATOM 224 CB LEU A 15 10.842 13.700 -16.390 1.00 0.00 C ATOM 225 CG LEU A 15 11.146 12.429 -17.186 1.00 0.00 C ATOM 226 CD1 LEU A 15 12.387 12.614 -18.061 1.00 0.00 C ATOM 227 CD2 LEU A 15 11.274 11.219 -16.258 1.00 0.00 C ATOM 0 H LEU A 15 9.751 15.622 -15.248 1.00 0.00 H new ATOM 0 HA LEU A 15 10.794 15.175 -17.894 1.00 0.00 H new ATOM 0 HB2 LEU A 15 11.784 14.111 -16.026 1.00 0.00 H new ATOM 0 HB3 LEU A 15 10.254 13.425 -15.514 1.00 0.00 H new ATOM 0 HG LEU A 15 10.307 12.235 -17.854 1.00 0.00 H new ATOM 0 HD11 LEU A 15 12.581 11.696 -18.616 1.00 0.00 H new ATOM 0 HD12 LEU A 15 12.220 13.433 -18.761 1.00 0.00 H new ATOM 0 HD13 LEU A 15 13.246 12.845 -17.430 1.00 0.00 H new ATOM 0 HD21 LEU A 15 11.490 10.329 -16.849 1.00 0.00 H new ATOM 0 HD22 LEU A 15 12.084 11.389 -15.548 1.00 0.00 H new ATOM 0 HD23 LEU A 15 10.340 11.076 -15.715 1.00 0.00 H new ATOM 239 N MET A 16 7.760 14.204 -17.162 1.00 0.00 N ATOM 240 CA MET A 16 6.511 13.744 -17.744 1.00 0.00 C ATOM 241 C MET A 16 5.858 14.844 -18.583 1.00 0.00 C ATOM 242 O MET A 16 5.406 14.593 -19.699 1.00 0.00 O ATOM 243 CB MET A 16 5.554 13.318 -16.628 1.00 0.00 C ATOM 244 CG MET A 16 5.965 11.967 -16.040 1.00 0.00 C ATOM 245 SD MET A 16 4.604 10.817 -16.142 1.00 0.00 S ATOM 246 CE MET A 16 5.462 9.290 -15.799 1.00 0.00 C ATOM 0 H MET A 16 7.709 14.435 -16.170 1.00 0.00 H new ATOM 0 HA MET A 16 6.726 12.896 -18.395 1.00 0.00 H new ATOM 0 HB2 MET A 16 5.546 14.074 -15.842 1.00 0.00 H new ATOM 0 HB3 MET A 16 4.539 13.255 -17.019 1.00 0.00 H new ATOM 0 HG2 MET A 16 6.826 11.573 -16.580 1.00 0.00 H new ATOM 0 HG3 MET A 16 6.270 12.091 -15.001 1.00 0.00 H new ATOM 0 HE1 MET A 16 4.754 8.461 -15.824 1.00 0.00 H new ATOM 0 HE2 MET A 16 6.234 9.130 -16.551 1.00 0.00 H new ATOM 0 HE3 MET A 16 5.922 9.345 -14.812 1.00 0.00 H new ATOM 256 N ASN A 17 5.831 16.041 -18.014 1.00 0.00 N ATOM 257 CA ASN A 17 5.241 17.180 -18.696 1.00 0.00 C ATOM 258 C ASN A 17 6.068 17.508 -19.941 1.00 0.00 C ATOM 259 O ASN A 17 5.546 18.054 -20.912 1.00 0.00 O ATOM 260 CB ASN A 17 5.232 18.417 -17.795 1.00 0.00 C ATOM 261 CG ASN A 17 3.992 18.434 -16.899 1.00 0.00 C ATOM 262 OD1 ASN A 17 2.866 18.533 -17.357 1.00 0.00 O ATOM 263 ND2 ASN A 17 4.262 18.332 -15.601 1.00 0.00 N ATOM 0 H ASN A 17 6.208 16.246 -17.089 1.00 0.00 H new ATOM 0 HA ASN A 17 4.216 16.920 -18.962 1.00 0.00 H new ATOM 0 HB2 ASN A 17 6.131 18.429 -17.178 1.00 0.00 H new ATOM 0 HB3 ASN A 17 5.254 19.318 -18.408 1.00 0.00 H new ATOM 0 HD21 ASN A 17 3.502 18.334 -14.920 1.00 0.00 H new ATOM 0 HD22 ASN A 17 5.229 18.252 -15.286 1.00 0.00 H new ATOM 270 N ALA A 18 7.345 17.160 -19.872 1.00 0.00 N ATOM 271 CA ALA A 18 8.249 17.411 -20.982 1.00 0.00 C ATOM 272 C ALA A 18 8.162 16.252 -21.977 1.00 0.00 C ATOM 273 O ALA A 18 8.118 16.469 -23.186 1.00 0.00 O ATOM 274 CB ALA A 18 9.668 17.615 -20.448 1.00 0.00 C ATOM 0 H ALA A 18 7.775 16.707 -19.066 1.00 0.00 H new ATOM 0 HA ALA A 18 7.965 18.321 -21.510 1.00 0.00 H new ATOM 0 HB1 ALA A 18 10.346 17.803 -21.280 1.00 0.00 H new ATOM 0 HB2 ALA A 18 9.682 18.467 -19.768 1.00 0.00 H new ATOM 0 HB3 ALA A 18 9.988 16.720 -19.914 1.00 0.00 H new ATOM 280 N LEU A 19 8.140 15.045 -21.430 1.00 0.00 N ATOM 281 CA LEU A 19 8.058 13.851 -22.254 1.00 0.00 C ATOM 282 C LEU A 19 8.116 12.613 -21.358 1.00 0.00 C ATOM 283 O LEU A 19 9.161 12.303 -20.788 1.00 0.00 O ATOM 284 CB LEU A 19 9.136 13.876 -23.340 1.00 0.00 C ATOM 285 CG LEU A 19 8.649 14.154 -24.763 1.00 0.00 C ATOM 286 CD1 LEU A 19 9.724 14.874 -25.580 1.00 0.00 C ATOM 287 CD2 LEU A 19 8.178 12.867 -25.443 1.00 0.00 C ATOM 0 H LEU A 19 8.178 14.869 -20.426 1.00 0.00 H new ATOM 0 HA LEU A 19 7.105 13.817 -22.783 1.00 0.00 H new ATOM 0 HB2 LEU A 19 9.873 14.634 -23.075 1.00 0.00 H new ATOM 0 HB3 LEU A 19 9.651 12.915 -23.335 1.00 0.00 H new ATOM 0 HG LEU A 19 7.789 14.821 -24.705 1.00 0.00 H new ATOM 0 HD11 LEU A 19 9.352 15.060 -26.588 1.00 0.00 H new ATOM 0 HD12 LEU A 19 9.969 15.823 -25.103 1.00 0.00 H new ATOM 0 HD13 LEU A 19 10.618 14.253 -25.632 1.00 0.00 H new ATOM 0 HD21 LEU A 19 7.837 13.093 -26.453 1.00 0.00 H new ATOM 0 HD22 LEU A 19 9.004 12.157 -25.489 1.00 0.00 H new ATOM 0 HD23 LEU A 19 7.357 12.433 -24.872 1.00 0.00 H new ATOM 299 N SER A 20 6.980 11.938 -21.262 1.00 0.00 N ATOM 300 CA SER A 20 6.888 10.740 -20.445 1.00 0.00 C ATOM 301 C SER A 20 7.360 9.524 -21.244 1.00 0.00 C ATOM 302 O SER A 20 8.193 9.650 -22.140 1.00 0.00 O ATOM 303 CB SER A 20 5.459 10.524 -19.943 1.00 0.00 C ATOM 304 OG SER A 20 4.706 11.733 -19.939 1.00 0.00 O ATOM 0 H SER A 20 6.115 12.198 -21.737 1.00 0.00 H new ATOM 0 HA SER A 20 7.534 10.868 -19.576 1.00 0.00 H new ATOM 0 HB2 SER A 20 4.960 9.789 -20.574 1.00 0.00 H new ATOM 0 HB3 SER A 20 5.488 10.111 -18.935 1.00 0.00 H new ATOM 0 HG SER A 20 3.799 11.553 -19.614 1.00 0.00 H new ATOM 310 N LEU A 21 6.807 8.373 -20.891 1.00 0.00 N ATOM 311 CA LEU A 21 7.160 7.135 -21.564 1.00 0.00 C ATOM 312 C LEU A 21 6.474 5.962 -20.860 1.00 0.00 C ATOM 313 O LEU A 21 6.042 5.011 -21.509 1.00 0.00 O ATOM 314 CB LEU A 21 8.681 6.991 -21.658 1.00 0.00 C ATOM 315 CG LEU A 21 9.243 6.708 -23.053 1.00 0.00 C ATOM 316 CD1 LEU A 21 9.400 8.002 -23.854 1.00 0.00 C ATOM 317 CD2 LEU A 21 10.554 5.924 -22.967 1.00 0.00 C ATOM 0 H LEU A 21 6.117 8.272 -20.147 1.00 0.00 H new ATOM 0 HA LEU A 21 6.799 7.145 -22.592 1.00 0.00 H new ATOM 0 HB2 LEU A 21 9.137 7.908 -21.283 1.00 0.00 H new ATOM 0 HB3 LEU A 21 8.992 6.186 -20.993 1.00 0.00 H new ATOM 0 HG LEU A 21 8.529 6.083 -23.589 1.00 0.00 H new ATOM 0 HD11 LEU A 21 9.801 7.772 -24.841 1.00 0.00 H new ATOM 0 HD12 LEU A 21 8.428 8.484 -23.960 1.00 0.00 H new ATOM 0 HD13 LEU A 21 10.083 8.672 -23.332 1.00 0.00 H new ATOM 0 HD21 LEU A 21 10.932 5.736 -23.972 1.00 0.00 H new ATOM 0 HD22 LEU A 21 11.288 6.502 -22.406 1.00 0.00 H new ATOM 0 HD23 LEU A 21 10.377 4.974 -22.462 1.00 0.00 H new ATOM 329 N GLN A 22 6.396 6.069 -19.542 1.00 0.00 N ATOM 330 CA GLN A 22 5.770 5.029 -18.743 1.00 0.00 C ATOM 331 C GLN A 22 6.291 5.079 -17.305 1.00 0.00 C ATOM 332 O GLN A 22 5.543 5.396 -16.381 1.00 0.00 O ATOM 333 CB GLN A 22 6.000 3.649 -19.362 1.00 0.00 C ATOM 334 CG GLN A 22 4.760 3.177 -20.123 1.00 0.00 C ATOM 335 CD GLN A 22 5.135 2.166 -21.209 1.00 0.00 C ATOM 336 OE1 GLN A 22 4.715 2.258 -22.351 1.00 0.00 O ATOM 337 NE2 GLN A 22 5.947 1.200 -20.791 1.00 0.00 N ATOM 0 H GLN A 22 6.756 6.860 -19.007 1.00 0.00 H new ATOM 0 HA GLN A 22 4.695 5.208 -18.726 1.00 0.00 H new ATOM 0 HB2 GLN A 22 6.854 3.688 -20.039 1.00 0.00 H new ATOM 0 HB3 GLN A 22 6.246 2.932 -18.579 1.00 0.00 H new ATOM 0 HG2 GLN A 22 4.053 2.724 -19.428 1.00 0.00 H new ATOM 0 HG3 GLN A 22 4.259 4.033 -20.575 1.00 0.00 H new ATOM 0 HE21 GLN A 22 6.261 1.182 -19.821 1.00 0.00 H new ATOM 0 HE22 GLN A 22 6.256 0.477 -21.441 1.00 0.00 H new ATOM 346 N GLU A 23 7.569 4.762 -17.161 1.00 0.00 N ATOM 347 CA GLU A 23 8.198 4.767 -15.851 1.00 0.00 C ATOM 348 C GLU A 23 9.312 5.814 -15.802 1.00 0.00 C ATOM 349 O GLU A 23 9.685 6.379 -16.829 1.00 0.00 O ATOM 350 CB GLU A 23 8.734 3.378 -15.496 1.00 0.00 C ATOM 351 CG GLU A 23 7.743 2.617 -14.614 1.00 0.00 C ATOM 352 CD GLU A 23 6.880 1.670 -15.450 1.00 0.00 C ATOM 353 OE1 GLU A 23 7.417 0.848 -16.208 1.00 0.00 O ATOM 354 OE2 GLU A 23 5.607 1.809 -15.292 1.00 0.00 O ATOM 0 H GLU A 23 8.186 4.500 -17.930 1.00 0.00 H new ATOM 0 HA GLU A 23 7.445 5.031 -15.108 1.00 0.00 H new ATOM 0 HB2 GLU A 23 8.922 2.813 -16.409 1.00 0.00 H new ATOM 0 HB3 GLU A 23 9.688 3.474 -14.978 1.00 0.00 H new ATOM 0 HG2 GLU A 23 8.285 2.049 -13.858 1.00 0.00 H new ATOM 0 HG3 GLU A 23 7.105 3.324 -14.084 1.00 0.00 H new ATOM 362 N VAL A 24 9.813 6.042 -14.596 1.00 0.00 N ATOM 363 CA VAL A 24 10.877 7.012 -14.399 1.00 0.00 C ATOM 364 C VAL A 24 11.890 6.454 -13.398 1.00 0.00 C ATOM 365 O VAL A 24 11.597 5.501 -12.677 1.00 0.00 O ATOM 366 CB VAL A 24 10.287 8.355 -13.966 1.00 0.00 C ATOM 367 CG1 VAL A 24 9.173 8.797 -14.918 1.00 0.00 C ATOM 368 CG2 VAL A 24 9.782 8.293 -12.523 1.00 0.00 C ATOM 0 H VAL A 24 9.502 5.572 -13.746 1.00 0.00 H new ATOM 0 HA VAL A 24 11.408 7.192 -15.334 1.00 0.00 H new ATOM 0 HB VAL A 24 11.082 9.100 -14.011 1.00 0.00 H new ATOM 0 HG11 VAL A 24 8.771 9.755 -14.587 1.00 0.00 H new ATOM 0 HG12 VAL A 24 9.575 8.901 -15.926 1.00 0.00 H new ATOM 0 HG13 VAL A 24 8.379 8.051 -14.920 1.00 0.00 H new ATOM 0 HG21 VAL A 24 9.368 9.261 -12.241 1.00 0.00 H new ATOM 0 HG22 VAL A 24 9.009 7.529 -12.441 1.00 0.00 H new ATOM 0 HG23 VAL A 24 10.609 8.045 -11.858 1.00 0.00 H new ATOM 378 N HIS A 25 13.063 7.071 -13.385 1.00 0.00 N ATOM 379 CA HIS A 25 14.122 6.648 -12.484 1.00 0.00 C ATOM 380 C HIS A 25 14.959 7.860 -12.071 1.00 0.00 C ATOM 381 O HIS A 25 15.371 8.652 -12.918 1.00 0.00 O ATOM 382 CB HIS A 25 14.960 5.535 -13.116 1.00 0.00 C ATOM 383 CG HIS A 25 14.372 4.154 -12.952 1.00 0.00 C ATOM 384 ND1 HIS A 25 13.194 3.763 -13.563 1.00 0.00 N ATOM 385 CD2 HIS A 25 14.813 3.077 -12.241 1.00 0.00 C ATOM 386 CE1 HIS A 25 12.945 2.506 -13.227 1.00 0.00 C ATOM 387 NE2 HIS A 25 13.950 2.082 -12.407 1.00 0.00 N ATOM 0 H HIS A 25 13.303 7.861 -13.984 1.00 0.00 H new ATOM 0 HA HIS A 25 13.687 6.226 -11.578 1.00 0.00 H new ATOM 0 HB2 HIS A 25 15.080 5.744 -14.179 1.00 0.00 H new ATOM 0 HB3 HIS A 25 15.956 5.549 -12.674 1.00 0.00 H new ATOM 0 HD2 HIS A 25 15.712 3.040 -11.644 1.00 0.00 H new ATOM 0 HE1 HIS A 25 12.096 1.920 -13.546 1.00 0.00 H new ATOM 0 HE2 HIS A 25 14.026 1.154 -11.990 1.00 0.00 H new ATOM 395 N VAL A 26 15.185 7.967 -10.770 1.00 0.00 N ATOM 396 CA VAL A 26 15.966 9.069 -10.235 1.00 0.00 C ATOM 397 C VAL A 26 17.100 8.513 -9.371 1.00 0.00 C ATOM 398 O VAL A 26 16.928 8.312 -8.169 1.00 0.00 O ATOM 399 CB VAL A 26 15.055 10.035 -9.476 1.00 0.00 C ATOM 400 CG1 VAL A 26 14.156 10.812 -10.439 1.00 0.00 C ATOM 401 CG2 VAL A 26 14.224 9.295 -8.426 1.00 0.00 C ATOM 0 H VAL A 26 14.841 7.309 -10.071 1.00 0.00 H new ATOM 0 HA VAL A 26 16.423 9.641 -11.043 1.00 0.00 H new ATOM 0 HB VAL A 26 15.688 10.754 -8.956 1.00 0.00 H new ATOM 0 HG11 VAL A 26 13.518 11.492 -9.873 1.00 0.00 H new ATOM 0 HG12 VAL A 26 14.773 11.385 -11.131 1.00 0.00 H new ATOM 0 HG13 VAL A 26 13.535 10.114 -11.000 1.00 0.00 H new ATOM 0 HG21 VAL A 26 13.585 10.005 -7.901 1.00 0.00 H new ATOM 0 HG22 VAL A 26 13.605 8.543 -8.916 1.00 0.00 H new ATOM 0 HG23 VAL A 26 14.889 8.809 -7.712 1.00 0.00 H new ATOM 411 N SER A 27 18.233 8.279 -10.016 1.00 0.00 N ATOM 412 CA SER A 27 19.395 7.750 -9.322 1.00 0.00 C ATOM 413 C SER A 27 20.343 8.890 -8.945 1.00 0.00 C ATOM 414 O SER A 27 20.640 9.754 -9.768 1.00 0.00 O ATOM 415 CB SER A 27 20.125 6.714 -10.180 1.00 0.00 C ATOM 416 OG SER A 27 19.221 5.926 -10.949 1.00 0.00 O ATOM 0 H SER A 27 18.371 8.446 -11.013 1.00 0.00 H new ATOM 0 HA SER A 27 19.054 7.254 -8.413 1.00 0.00 H new ATOM 0 HB2 SER A 27 20.821 7.222 -10.847 1.00 0.00 H new ATOM 0 HB3 SER A 27 20.717 6.063 -9.537 1.00 0.00 H new ATOM 0 HG SER A 27 19.471 5.972 -11.896 1.00 0.00 H new ATOM 422 N GLY A 28 20.792 8.855 -7.698 1.00 0.00 N ATOM 423 CA GLY A 28 21.700 9.875 -7.202 1.00 0.00 C ATOM 424 C GLY A 28 21.573 10.031 -5.685 1.00 0.00 C ATOM 425 O GLY A 28 21.183 9.093 -4.991 1.00 0.00 O ATOM 0 H GLY A 28 20.544 8.137 -7.018 1.00 0.00 H new ATOM 0 HA2 GLY A 28 22.726 9.610 -7.459 1.00 0.00 H new ATOM 0 HA3 GLY A 28 21.485 10.826 -7.688 1.00 0.00 H new ATOM 429 N ASP A 29 21.909 11.223 -5.215 1.00 0.00 N ATOM 430 CA ASP A 29 21.837 11.514 -3.793 1.00 0.00 C ATOM 431 C ASP A 29 20.685 12.486 -3.533 1.00 0.00 C ATOM 432 O ASP A 29 19.738 12.156 -2.821 1.00 0.00 O ATOM 433 CB ASP A 29 23.129 12.168 -3.298 1.00 0.00 C ATOM 434 CG ASP A 29 23.777 13.144 -4.282 1.00 0.00 C ATOM 435 OD1 ASP A 29 24.321 12.738 -5.320 1.00 0.00 O ATOM 436 OD2 ASP A 29 23.707 14.387 -3.943 1.00 0.00 O ATOM 0 H ASP A 29 22.232 11.999 -5.793 1.00 0.00 H new ATOM 0 HA ASP A 29 21.684 10.573 -3.264 1.00 0.00 H new ATOM 0 HB2 ASP A 29 22.918 12.698 -2.369 1.00 0.00 H new ATOM 0 HB3 ASP A 29 23.848 11.384 -3.061 1.00 0.00 H new ATOM 442 N GLY A 30 20.804 13.666 -4.125 1.00 0.00 N ATOM 443 CA GLY A 30 19.784 14.688 -3.966 1.00 0.00 C ATOM 444 C GLY A 30 20.128 15.937 -4.781 1.00 0.00 C ATOM 445 O GLY A 30 19.242 16.579 -5.344 1.00 0.00 O ATOM 0 H GLY A 30 21.591 13.936 -4.715 1.00 0.00 H new ATOM 0 HA2 GLY A 30 18.818 14.296 -4.285 1.00 0.00 H new ATOM 0 HA3 GLY A 30 19.689 14.951 -2.913 1.00 0.00 H new ATOM 449 N SER A 31 21.416 16.244 -4.818 1.00 0.00 N ATOM 450 CA SER A 31 21.888 17.404 -5.554 1.00 0.00 C ATOM 451 C SER A 31 22.072 17.048 -7.031 1.00 0.00 C ATOM 452 O SER A 31 21.388 17.594 -7.895 1.00 0.00 O ATOM 453 CB SER A 31 23.200 17.932 -4.969 1.00 0.00 C ATOM 454 OG SER A 31 23.003 18.575 -3.712 1.00 0.00 O ATOM 0 H SER A 31 22.148 15.709 -4.350 1.00 0.00 H new ATOM 0 HA SER A 31 21.139 18.191 -5.467 1.00 0.00 H new ATOM 0 HB2 SER A 31 23.901 17.106 -4.848 1.00 0.00 H new ATOM 0 HB3 SER A 31 23.652 18.635 -5.669 1.00 0.00 H new ATOM 0 HG SER A 31 22.956 19.545 -3.844 1.00 0.00 H new ATOM 460 N HIS A 32 22.999 16.133 -7.275 1.00 0.00 N ATOM 461 CA HIS A 32 23.281 15.697 -8.632 1.00 0.00 C ATOM 462 C HIS A 32 22.822 14.249 -8.812 1.00 0.00 C ATOM 463 O HIS A 32 23.357 13.340 -8.178 1.00 0.00 O ATOM 464 CB HIS A 32 24.760 15.896 -8.970 1.00 0.00 C ATOM 465 CG HIS A 32 25.681 14.900 -8.306 1.00 0.00 C ATOM 466 ND1 HIS A 32 25.998 13.678 -8.872 1.00 0.00 N ATOM 467 CD2 HIS A 32 26.351 14.960 -7.119 1.00 0.00 C ATOM 468 CE1 HIS A 32 26.820 13.038 -8.054 1.00 0.00 C ATOM 469 NE2 HIS A 32 27.038 13.834 -6.968 1.00 0.00 N ATOM 0 H HIS A 32 23.564 15.682 -6.556 1.00 0.00 H new ATOM 0 HA HIS A 32 22.721 16.310 -9.338 1.00 0.00 H new ATOM 0 HB2 HIS A 32 24.887 15.829 -10.050 1.00 0.00 H new ATOM 0 HB3 HIS A 32 25.057 16.903 -8.676 1.00 0.00 H new ATOM 0 HD2 HIS A 32 26.327 15.784 -6.421 1.00 0.00 H new ATOM 0 HE1 HIS A 32 27.243 12.058 -8.218 1.00 0.00 H new ATOM 0 HE2 HIS A 32 27.631 13.602 -6.171 1.00 0.00 H new ATOM 477 N PHE A 33 21.835 14.078 -9.679 1.00 0.00 N ATOM 478 CA PHE A 33 21.297 12.756 -9.950 1.00 0.00 C ATOM 479 C PHE A 33 20.837 12.639 -11.405 1.00 0.00 C ATOM 480 O PHE A 33 20.591 13.647 -12.065 1.00 0.00 O ATOM 481 CB PHE A 33 20.090 12.567 -9.030 1.00 0.00 C ATOM 482 CG PHE A 33 19.064 13.699 -9.108 1.00 0.00 C ATOM 483 CD1 PHE A 33 19.261 14.845 -8.404 1.00 0.00 C ATOM 484 CD2 PHE A 33 17.954 13.559 -9.882 1.00 0.00 C ATOM 485 CE1 PHE A 33 18.309 15.896 -8.477 1.00 0.00 C ATOM 486 CE2 PHE A 33 17.002 14.609 -9.955 1.00 0.00 C ATOM 487 CZ PHE A 33 17.199 15.756 -9.251 1.00 0.00 C ATOM 0 H PHE A 33 21.394 14.834 -10.203 1.00 0.00 H new ATOM 0 HA PHE A 33 22.063 12.000 -9.777 1.00 0.00 H new ATOM 0 HB2 PHE A 33 19.598 11.627 -9.281 1.00 0.00 H new ATOM 0 HB3 PHE A 33 20.440 12.478 -8.002 1.00 0.00 H new ATOM 0 HD1 PHE A 33 20.142 14.956 -7.789 1.00 0.00 H new ATOM 0 HD2 PHE A 33 17.797 12.648 -10.441 1.00 0.00 H new ATOM 0 HE1 PHE A 33 18.466 16.807 -7.918 1.00 0.00 H new ATOM 0 HE2 PHE A 33 16.121 14.497 -10.570 1.00 0.00 H new ATOM 0 HZ PHE A 33 16.475 16.555 -9.306 1.00 0.00 H new ATOM 497 N GLN A 34 20.736 11.400 -11.862 1.00 0.00 N ATOM 498 CA GLN A 34 20.310 11.138 -13.227 1.00 0.00 C ATOM 499 C GLN A 34 18.832 10.743 -13.255 1.00 0.00 C ATOM 500 O GLN A 34 18.398 9.891 -12.481 1.00 0.00 O ATOM 501 CB GLN A 34 21.178 10.057 -13.874 1.00 0.00 C ATOM 502 CG GLN A 34 20.944 9.998 -15.385 1.00 0.00 C ATOM 503 CD GLN A 34 19.529 9.511 -15.702 1.00 0.00 C ATOM 504 OE1 GLN A 34 18.931 8.741 -14.968 1.00 0.00 O ATOM 505 NE2 GLN A 34 19.029 10.001 -16.833 1.00 0.00 N ATOM 0 H GLN A 34 20.942 10.566 -11.312 1.00 0.00 H new ATOM 0 HA GLN A 34 20.433 12.052 -13.807 1.00 0.00 H new ATOM 0 HB2 GLN A 34 22.230 10.261 -13.673 1.00 0.00 H new ATOM 0 HB3 GLN A 34 20.951 9.088 -13.429 1.00 0.00 H new ATOM 0 HG2 GLN A 34 21.098 10.986 -15.819 1.00 0.00 H new ATOM 0 HG3 GLN A 34 21.673 9.331 -15.844 1.00 0.00 H new ATOM 0 HE21 GLN A 34 19.584 10.642 -17.401 1.00 0.00 H new ATOM 0 HE22 GLN A 34 18.091 9.736 -17.133 1.00 0.00 H new ATOM 514 N VAL A 35 18.099 11.382 -14.155 1.00 0.00 N ATOM 515 CA VAL A 35 16.679 11.109 -14.294 1.00 0.00 C ATOM 516 C VAL A 35 16.430 10.389 -15.621 1.00 0.00 C ATOM 517 O VAL A 35 16.373 11.022 -16.674 1.00 0.00 O ATOM 518 CB VAL A 35 15.880 12.407 -14.159 1.00 0.00 C ATOM 519 CG1 VAL A 35 14.376 12.128 -14.161 1.00 0.00 C ATOM 520 CG2 VAL A 35 16.294 13.177 -12.904 1.00 0.00 C ATOM 0 H VAL A 35 18.462 12.088 -14.795 1.00 0.00 H new ATOM 0 HA VAL A 35 16.338 10.449 -13.497 1.00 0.00 H new ATOM 0 HB VAL A 35 16.105 13.031 -15.024 1.00 0.00 H new ATOM 0 HG11 VAL A 35 13.832 13.067 -14.064 1.00 0.00 H new ATOM 0 HG12 VAL A 35 14.097 11.642 -15.096 1.00 0.00 H new ATOM 0 HG13 VAL A 35 14.126 11.475 -13.324 1.00 0.00 H new ATOM 0 HG21 VAL A 35 15.711 14.095 -12.832 1.00 0.00 H new ATOM 0 HG22 VAL A 35 16.112 12.562 -12.023 1.00 0.00 H new ATOM 0 HG23 VAL A 35 17.354 13.424 -12.962 1.00 0.00 H new ATOM 530 N ILE A 36 16.289 9.075 -15.527 1.00 0.00 N ATOM 531 CA ILE A 36 16.048 8.262 -16.708 1.00 0.00 C ATOM 532 C ILE A 36 14.541 8.072 -16.891 1.00 0.00 C ATOM 533 O ILE A 36 13.818 7.842 -15.923 1.00 0.00 O ATOM 534 CB ILE A 36 16.827 6.948 -16.622 1.00 0.00 C ATOM 535 CG1 ILE A 36 17.992 6.936 -17.614 1.00 0.00 C ATOM 536 CG2 ILE A 36 15.899 5.747 -16.812 1.00 0.00 C ATOM 537 CD1 ILE A 36 18.923 5.750 -17.352 1.00 0.00 C ATOM 0 H ILE A 36 16.337 8.553 -14.652 1.00 0.00 H new ATOM 0 HA ILE A 36 16.418 8.767 -17.600 1.00 0.00 H new ATOM 0 HB ILE A 36 17.255 6.869 -15.623 1.00 0.00 H new ATOM 0 HG12 ILE A 36 17.607 6.883 -18.632 1.00 0.00 H new ATOM 0 HG13 ILE A 36 18.552 7.867 -17.534 1.00 0.00 H new ATOM 0 HG21 ILE A 36 16.478 4.826 -16.746 1.00 0.00 H new ATOM 0 HG22 ILE A 36 15.135 5.751 -16.035 1.00 0.00 H new ATOM 0 HG23 ILE A 36 15.422 5.807 -17.790 1.00 0.00 H new ATOM 0 HD11 ILE A 36 19.742 5.765 -18.071 1.00 0.00 H new ATOM 0 HD12 ILE A 36 19.325 5.820 -16.341 1.00 0.00 H new ATOM 0 HD13 ILE A 36 18.365 4.819 -17.457 1.00 0.00 H new ATOM 549 N ALA A 37 14.112 8.176 -18.141 1.00 0.00 N ATOM 550 CA ALA A 37 12.704 8.018 -18.464 1.00 0.00 C ATOM 551 C ALA A 37 12.459 6.598 -18.977 1.00 0.00 C ATOM 552 O ALA A 37 12.763 6.289 -20.128 1.00 0.00 O ATOM 553 CB ALA A 37 12.291 9.085 -19.480 1.00 0.00 C ATOM 0 H ALA A 37 14.715 8.368 -18.941 1.00 0.00 H new ATOM 0 HA ALA A 37 12.088 8.158 -17.576 1.00 0.00 H new ATOM 0 HB1 ALA A 37 11.235 8.967 -19.723 1.00 0.00 H new ATOM 0 HB2 ALA A 37 12.457 10.075 -19.056 1.00 0.00 H new ATOM 0 HB3 ALA A 37 12.886 8.974 -20.386 1.00 0.00 H new ATOM 559 N VAL A 38 11.911 5.772 -18.098 1.00 0.00 N ATOM 560 CA VAL A 38 11.621 4.391 -18.448 1.00 0.00 C ATOM 561 C VAL A 38 10.354 4.342 -19.304 1.00 0.00 C ATOM 562 O VAL A 38 9.456 5.166 -19.138 1.00 0.00 O ATOM 563 CB VAL A 38 11.520 3.540 -17.180 1.00 0.00 C ATOM 564 CG1 VAL A 38 11.041 2.125 -17.507 1.00 0.00 C ATOM 565 CG2 VAL A 38 12.855 3.509 -16.434 1.00 0.00 C ATOM 0 H VAL A 38 11.660 6.032 -17.144 1.00 0.00 H new ATOM 0 HA VAL A 38 12.431 3.969 -19.043 1.00 0.00 H new ATOM 0 HB VAL A 38 10.781 4.000 -16.525 1.00 0.00 H new ATOM 0 HG11 VAL A 38 10.978 1.541 -16.589 1.00 0.00 H new ATOM 0 HG12 VAL A 38 10.058 2.173 -17.975 1.00 0.00 H new ATOM 0 HG13 VAL A 38 11.746 1.651 -18.191 1.00 0.00 H new ATOM 0 HG21 VAL A 38 12.756 2.898 -15.537 1.00 0.00 H new ATOM 0 HG22 VAL A 38 13.623 3.084 -17.080 1.00 0.00 H new ATOM 0 HG23 VAL A 38 13.138 4.523 -16.153 1.00 0.00 H new ATOM 575 N GLY A 39 10.321 3.366 -20.200 1.00 0.00 N ATOM 576 CA GLY A 39 9.178 3.198 -21.082 1.00 0.00 C ATOM 577 C GLY A 39 9.545 2.344 -22.297 1.00 0.00 C ATOM 578 O GLY A 39 9.928 1.185 -22.153 1.00 0.00 O ATOM 0 H GLY A 39 11.067 2.684 -20.334 1.00 0.00 H new ATOM 0 HA2 GLY A 39 8.359 2.729 -20.537 1.00 0.00 H new ATOM 0 HA3 GLY A 39 8.823 4.174 -21.413 1.00 0.00 H new ATOM 582 N GLU A 40 9.414 2.951 -23.468 1.00 0.00 N ATOM 583 CA GLU A 40 9.727 2.261 -24.708 1.00 0.00 C ATOM 584 C GLU A 40 9.644 3.230 -25.889 1.00 0.00 C ATOM 585 O GLU A 40 10.407 3.112 -26.847 1.00 0.00 O ATOM 586 CB GLU A 40 8.801 1.061 -24.916 1.00 0.00 C ATOM 587 CG GLU A 40 9.604 -0.232 -25.066 1.00 0.00 C ATOM 588 CD GLU A 40 9.054 -1.089 -26.208 1.00 0.00 C ATOM 589 OE1 GLU A 40 8.155 -1.913 -25.987 1.00 0.00 O ATOM 590 OE2 GLU A 40 9.595 -0.875 -27.359 1.00 0.00 O ATOM 0 H GLU A 40 9.095 3.913 -23.584 1.00 0.00 H new ATOM 0 HA GLU A 40 10.747 1.883 -24.644 1.00 0.00 H new ATOM 0 HB2 GLU A 40 8.118 0.973 -24.071 1.00 0.00 H new ATOM 0 HB3 GLU A 40 8.190 1.219 -25.805 1.00 0.00 H new ATOM 0 HG2 GLU A 40 10.651 0.006 -25.256 1.00 0.00 H new ATOM 0 HG3 GLU A 40 9.570 -0.796 -24.134 1.00 0.00 H new ATOM 598 N LEU A 41 8.711 4.165 -25.783 1.00 0.00 N ATOM 599 CA LEU A 41 8.519 5.152 -26.831 1.00 0.00 C ATOM 600 C LEU A 41 9.881 5.570 -27.388 1.00 0.00 C ATOM 601 O LEU A 41 10.119 5.476 -28.592 1.00 0.00 O ATOM 602 CB LEU A 41 7.680 6.324 -26.316 1.00 0.00 C ATOM 603 CG LEU A 41 7.431 7.459 -27.311 1.00 0.00 C ATOM 604 CD1 LEU A 41 6.892 6.918 -28.636 1.00 0.00 C ATOM 605 CD2 LEU A 41 6.510 8.523 -26.709 1.00 0.00 C ATOM 0 H LEU A 41 8.080 4.260 -24.987 1.00 0.00 H new ATOM 0 HA LEU A 41 7.953 4.724 -27.658 1.00 0.00 H new ATOM 0 HB2 LEU A 41 6.715 5.938 -25.987 1.00 0.00 H new ATOM 0 HB3 LEU A 41 8.173 6.740 -25.437 1.00 0.00 H new ATOM 0 HG LEU A 41 8.385 7.942 -27.525 1.00 0.00 H new ATOM 0 HD11 LEU A 41 6.724 7.745 -29.325 1.00 0.00 H new ATOM 0 HD12 LEU A 41 7.616 6.227 -29.068 1.00 0.00 H new ATOM 0 HD13 LEU A 41 5.952 6.395 -28.460 1.00 0.00 H new ATOM 0 HD21 LEU A 41 6.349 9.319 -27.436 1.00 0.00 H new ATOM 0 HD22 LEU A 41 5.553 8.071 -26.448 1.00 0.00 H new ATOM 0 HD23 LEU A 41 6.971 8.939 -25.813 1.00 0.00 H new ATOM 617 N PHE A 42 10.740 6.023 -26.487 1.00 0.00 N ATOM 618 CA PHE A 42 12.072 6.455 -26.873 1.00 0.00 C ATOM 619 C PHE A 42 13.046 5.276 -26.896 1.00 0.00 C ATOM 620 O PHE A 42 14.203 5.414 -26.500 1.00 0.00 O ATOM 621 CB PHE A 42 12.537 7.465 -25.823 1.00 0.00 C ATOM 622 CG PHE A 42 11.934 8.861 -25.992 1.00 0.00 C ATOM 623 CD1 PHE A 42 11.774 9.387 -27.236 1.00 0.00 C ATOM 624 CD2 PHE A 42 11.556 9.576 -24.898 1.00 0.00 C ATOM 625 CE1 PHE A 42 11.214 10.683 -27.393 1.00 0.00 C ATOM 626 CE2 PHE A 42 10.996 10.872 -25.055 1.00 0.00 C ATOM 627 CZ PHE A 42 10.837 11.397 -26.299 1.00 0.00 C ATOM 0 H PHE A 42 10.539 6.100 -25.490 1.00 0.00 H new ATOM 0 HA PHE A 42 12.047 6.890 -27.872 1.00 0.00 H new ATOM 0 HB2 PHE A 42 12.282 7.088 -24.833 1.00 0.00 H new ATOM 0 HB3 PHE A 42 13.623 7.542 -25.864 1.00 0.00 H new ATOM 0 HD1 PHE A 42 12.073 8.819 -28.105 1.00 0.00 H new ATOM 0 HD2 PHE A 42 11.682 9.158 -23.910 1.00 0.00 H new ATOM 0 HE1 PHE A 42 11.088 11.101 -28.381 1.00 0.00 H new ATOM 0 HE2 PHE A 42 10.697 11.440 -24.187 1.00 0.00 H new ATOM 0 HZ PHE A 42 10.411 12.382 -26.418 1.00 0.00 H new ATOM 637 N ASP A 43 12.543 4.143 -27.364 1.00 0.00 N ATOM 638 CA ASP A 43 13.355 2.940 -27.443 1.00 0.00 C ATOM 639 C ASP A 43 13.762 2.700 -28.898 1.00 0.00 C ATOM 640 O ASP A 43 13.249 1.791 -29.548 1.00 0.00 O ATOM 641 CB ASP A 43 12.574 1.716 -26.963 1.00 0.00 C ATOM 642 CG ASP A 43 13.388 0.424 -26.871 1.00 0.00 C ATOM 643 OD1 ASP A 43 14.627 0.444 -26.928 1.00 0.00 O ATOM 644 OD2 ASP A 43 12.690 -0.652 -26.733 1.00 0.00 O ATOM 0 H ASP A 43 11.584 4.032 -27.692 1.00 0.00 H new ATOM 0 HA ASP A 43 14.230 3.081 -26.808 1.00 0.00 H new ATOM 0 HB2 ASP A 43 12.154 1.934 -25.981 1.00 0.00 H new ATOM 0 HB3 ASP A 43 11.735 1.551 -27.639 1.00 0.00 H new ATOM 650 N GLY A 44 14.681 3.532 -29.367 1.00 0.00 N ATOM 651 CA GLY A 44 15.163 3.422 -30.733 1.00 0.00 C ATOM 652 C GLY A 44 15.613 4.783 -31.268 1.00 0.00 C ATOM 653 O GLY A 44 16.369 4.855 -32.235 1.00 0.00 O ATOM 0 H GLY A 44 15.104 4.285 -28.825 1.00 0.00 H new ATOM 0 HA2 GLY A 44 15.995 2.719 -30.773 1.00 0.00 H new ATOM 0 HA3 GLY A 44 14.374 3.020 -31.369 1.00 0.00 H new ATOM 657 N MET A 45 15.130 5.829 -30.614 1.00 0.00 N ATOM 658 CA MET A 45 15.473 7.184 -31.011 1.00 0.00 C ATOM 659 C MET A 45 16.969 7.447 -30.826 1.00 0.00 C ATOM 660 O MET A 45 17.663 6.672 -30.169 1.00 0.00 O ATOM 661 CB MET A 45 14.672 8.180 -30.171 1.00 0.00 C ATOM 662 CG MET A 45 13.590 8.861 -31.013 1.00 0.00 C ATOM 663 SD MET A 45 12.063 7.944 -30.900 1.00 0.00 S ATOM 664 CE MET A 45 10.903 9.214 -31.377 1.00 0.00 C ATOM 0 H MET A 45 14.504 5.765 -29.811 1.00 0.00 H new ATOM 0 HA MET A 45 15.229 7.306 -32.066 1.00 0.00 H new ATOM 0 HB2 MET A 45 14.211 7.663 -29.329 1.00 0.00 H new ATOM 0 HB3 MET A 45 15.342 8.933 -29.755 1.00 0.00 H new ATOM 0 HG2 MET A 45 13.437 9.883 -30.666 1.00 0.00 H new ATOM 0 HG3 MET A 45 13.911 8.922 -32.053 1.00 0.00 H new ATOM 0 HE1 MET A 45 9.892 8.808 -31.360 1.00 0.00 H new ATOM 0 HE2 MET A 45 10.971 10.049 -30.680 1.00 0.00 H new ATOM 0 HE3 MET A 45 11.137 9.562 -32.383 1.00 0.00 H new ATOM 674 N SER A 46 17.422 8.543 -31.417 1.00 0.00 N ATOM 675 CA SER A 46 18.823 8.918 -31.325 1.00 0.00 C ATOM 676 C SER A 46 19.059 9.755 -30.067 1.00 0.00 C ATOM 677 O SER A 46 18.404 10.776 -29.864 1.00 0.00 O ATOM 678 CB SER A 46 19.268 9.690 -32.569 1.00 0.00 C ATOM 679 OG SER A 46 20.598 10.187 -32.440 1.00 0.00 O ATOM 0 H SER A 46 16.844 9.183 -31.961 1.00 0.00 H new ATOM 0 HA SER A 46 19.418 8.007 -31.263 1.00 0.00 H new ATOM 0 HB2 SER A 46 19.207 9.039 -33.441 1.00 0.00 H new ATOM 0 HB3 SER A 46 18.585 10.522 -32.744 1.00 0.00 H new ATOM 0 HG SER A 46 20.846 10.672 -33.254 1.00 0.00 H new ATOM 685 N ARG A 47 19.998 9.293 -29.255 1.00 0.00 N ATOM 686 CA ARG A 47 20.330 9.986 -28.022 1.00 0.00 C ATOM 687 C ARG A 47 20.308 11.500 -28.242 1.00 0.00 C ATOM 688 O ARG A 47 20.023 12.262 -27.320 1.00 0.00 O ATOM 689 CB ARG A 47 21.711 9.572 -27.510 1.00 0.00 C ATOM 690 CG ARG A 47 22.057 10.303 -26.212 1.00 0.00 C ATOM 691 CD ARG A 47 23.541 10.146 -25.873 1.00 0.00 C ATOM 692 NE ARG A 47 24.350 11.059 -26.711 1.00 0.00 N ATOM 693 CZ ARG A 47 24.443 12.390 -26.509 1.00 0.00 C ATOM 694 NH1 ARG A 47 23.776 12.977 -25.492 1.00 0.00 N ATOM 695 NH2 ARG A 47 25.196 13.110 -27.320 1.00 0.00 N ATOM 0 H ARG A 47 20.540 8.446 -29.427 1.00 0.00 H new ATOM 0 HA ARG A 47 19.583 9.712 -27.277 1.00 0.00 H new ATOM 0 HB2 ARG A 47 21.732 8.495 -27.342 1.00 0.00 H new ATOM 0 HB3 ARG A 47 22.464 9.791 -28.267 1.00 0.00 H new ATOM 0 HG2 ARG A 47 21.813 11.361 -26.310 1.00 0.00 H new ATOM 0 HG3 ARG A 47 21.450 9.910 -25.396 1.00 0.00 H new ATOM 0 HD2 ARG A 47 23.707 10.364 -24.818 1.00 0.00 H new ATOM 0 HD3 ARG A 47 23.853 9.115 -26.038 1.00 0.00 H new ATOM 0 HE ARG A 47 24.870 10.657 -27.491 1.00 0.00 H new ATOM 0 HH11 ARG A 47 23.197 12.414 -24.870 1.00 0.00 H new ATOM 0 HH12 ARG A 47 23.852 13.984 -25.346 1.00 0.00 H new ATOM 0 HH21 ARG A 47 25.697 12.659 -28.086 1.00 0.00 H new ATOM 0 HH22 ARG A 47 25.277 14.117 -27.181 1.00 0.00 H new ATOM 708 N VAL A 48 20.614 11.891 -29.471 1.00 0.00 N ATOM 709 CA VAL A 48 20.634 13.301 -29.824 1.00 0.00 C ATOM 710 C VAL A 48 19.198 13.793 -30.019 1.00 0.00 C ATOM 711 O VAL A 48 18.755 14.713 -29.333 1.00 0.00 O ATOM 712 CB VAL A 48 21.513 13.519 -31.057 1.00 0.00 C ATOM 713 CG1 VAL A 48 21.333 14.931 -31.616 1.00 0.00 C ATOM 714 CG2 VAL A 48 22.983 13.238 -30.739 1.00 0.00 C ATOM 0 H VAL A 48 20.850 11.257 -30.234 1.00 0.00 H new ATOM 0 HA VAL A 48 21.074 13.890 -29.020 1.00 0.00 H new ATOM 0 HB VAL A 48 21.195 12.813 -31.824 1.00 0.00 H new ATOM 0 HG11 VAL A 48 21.969 15.059 -32.492 1.00 0.00 H new ATOM 0 HG12 VAL A 48 20.291 15.080 -31.899 1.00 0.00 H new ATOM 0 HG13 VAL A 48 21.610 15.661 -30.856 1.00 0.00 H new ATOM 0 HG21 VAL A 48 23.586 13.400 -31.632 1.00 0.00 H new ATOM 0 HG22 VAL A 48 23.319 13.908 -29.948 1.00 0.00 H new ATOM 0 HG23 VAL A 48 23.093 12.205 -30.410 1.00 0.00 H new ATOM 724 N LYS A 49 18.511 13.159 -30.958 1.00 0.00 N ATOM 725 CA LYS A 49 17.135 13.521 -31.252 1.00 0.00 C ATOM 726 C LYS A 49 16.290 13.363 -29.987 1.00 0.00 C ATOM 727 O LYS A 49 15.316 14.088 -29.792 1.00 0.00 O ATOM 728 CB LYS A 49 16.613 12.719 -32.445 1.00 0.00 C ATOM 729 CG LYS A 49 15.986 13.640 -33.493 1.00 0.00 C ATOM 730 CD LYS A 49 14.463 13.493 -33.513 1.00 0.00 C ATOM 731 CE LYS A 49 13.828 14.481 -34.493 1.00 0.00 C ATOM 732 NZ LYS A 49 14.217 14.155 -35.883 1.00 0.00 N ATOM 0 H LYS A 49 18.882 12.397 -31.525 1.00 0.00 H new ATOM 0 HA LYS A 49 17.071 14.568 -31.550 1.00 0.00 H new ATOM 0 HB2 LYS A 49 17.430 12.155 -32.894 1.00 0.00 H new ATOM 0 HB3 LYS A 49 15.874 11.993 -32.105 1.00 0.00 H new ATOM 0 HG2 LYS A 49 16.252 14.675 -33.278 1.00 0.00 H new ATOM 0 HG3 LYS A 49 16.390 13.405 -34.477 1.00 0.00 H new ATOM 0 HD2 LYS A 49 14.196 12.474 -33.795 1.00 0.00 H new ATOM 0 HD3 LYS A 49 14.065 13.662 -32.512 1.00 0.00 H new ATOM 0 HE2 LYS A 49 12.743 14.451 -34.396 1.00 0.00 H new ATOM 0 HE3 LYS A 49 14.142 15.496 -34.250 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 13.638 14.710 -36.545 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 15.221 14.385 -36.025 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 14.066 13.141 -36.057 1.00 0.00 H new ATOM 745 N LYS A 50 16.693 12.409 -29.160 1.00 0.00 N ATOM 746 CA LYS A 50 15.984 12.146 -27.919 1.00 0.00 C ATOM 747 C LYS A 50 16.331 13.233 -26.898 1.00 0.00 C ATOM 748 O LYS A 50 15.451 13.742 -26.205 1.00 0.00 O ATOM 749 CB LYS A 50 16.273 10.727 -27.427 1.00 0.00 C ATOM 750 CG LYS A 50 15.738 10.518 -26.009 1.00 0.00 C ATOM 751 CD LYS A 50 16.388 9.298 -25.352 1.00 0.00 C ATOM 752 CE LYS A 50 16.114 8.029 -26.161 1.00 0.00 C ATOM 753 NZ LYS A 50 17.383 7.433 -26.636 1.00 0.00 N ATOM 0 H LYS A 50 17.501 11.809 -29.325 1.00 0.00 H new ATOM 0 HA LYS A 50 14.907 12.190 -28.079 1.00 0.00 H new ATOM 0 HB2 LYS A 50 15.815 10.004 -28.102 1.00 0.00 H new ATOM 0 HB3 LYS A 50 17.347 10.544 -27.445 1.00 0.00 H new ATOM 0 HG2 LYS A 50 15.933 11.406 -25.408 1.00 0.00 H new ATOM 0 HG3 LYS A 50 14.657 10.386 -26.040 1.00 0.00 H new ATOM 0 HD2 LYS A 50 17.463 9.455 -25.268 1.00 0.00 H new ATOM 0 HD3 LYS A 50 16.004 9.178 -24.339 1.00 0.00 H new ATOM 0 HE2 LYS A 50 15.574 7.308 -25.547 1.00 0.00 H new ATOM 0 HE3 LYS A 50 15.475 8.264 -27.012 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 17.176 6.665 -27.306 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 17.953 8.162 -27.110 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 17.912 7.052 -25.826 1.00 0.00 H new ATOM 766 N GLN A 51 17.614 13.556 -26.839 1.00 0.00 N ATOM 767 CA GLN A 51 18.088 14.572 -25.915 1.00 0.00 C ATOM 768 C GLN A 51 17.605 15.956 -26.355 1.00 0.00 C ATOM 769 O GLN A 51 17.577 16.891 -25.556 1.00 0.00 O ATOM 770 CB GLN A 51 19.613 14.536 -25.794 1.00 0.00 C ATOM 771 CG GLN A 51 20.062 13.411 -24.859 1.00 0.00 C ATOM 772 CD GLN A 51 20.607 13.975 -23.545 1.00 0.00 C ATOM 773 OE1 GLN A 51 21.659 14.590 -23.493 1.00 0.00 O ATOM 774 NE2 GLN A 51 19.834 13.732 -22.491 1.00 0.00 N ATOM 0 H GLN A 51 18.340 13.132 -27.416 1.00 0.00 H new ATOM 0 HA GLN A 51 17.674 14.360 -24.929 1.00 0.00 H new ATOM 0 HB2 GLN A 51 20.056 14.393 -26.779 1.00 0.00 H new ATOM 0 HB3 GLN A 51 19.974 15.493 -25.417 1.00 0.00 H new ATOM 0 HG2 GLN A 51 19.222 12.747 -24.653 1.00 0.00 H new ATOM 0 HG3 GLN A 51 20.830 12.812 -25.348 1.00 0.00 H new ATOM 0 HE21 GLN A 51 18.965 13.210 -22.605 1.00 0.00 H new ATOM 0 HE22 GLN A 51 20.110 14.067 -21.568 1.00 0.00 H new ATOM 783 N GLN A 52 17.238 16.043 -27.625 1.00 0.00 N ATOM 784 CA GLN A 52 16.758 17.297 -28.181 1.00 0.00 C ATOM 785 C GLN A 52 15.262 17.460 -27.908 1.00 0.00 C ATOM 786 O GLN A 52 14.805 18.550 -27.568 1.00 0.00 O ATOM 787 CB GLN A 52 17.055 17.381 -29.680 1.00 0.00 C ATOM 788 CG GLN A 52 15.786 17.155 -30.504 1.00 0.00 C ATOM 789 CD GLN A 52 16.091 17.192 -32.002 1.00 0.00 C ATOM 790 OE1 GLN A 52 17.210 16.979 -32.440 1.00 0.00 O ATOM 791 NE2 GLN A 52 15.036 17.474 -32.762 1.00 0.00 N ATOM 0 H GLN A 52 17.263 15.266 -28.285 1.00 0.00 H new ATOM 0 HA GLN A 52 17.287 18.115 -27.693 1.00 0.00 H new ATOM 0 HB2 GLN A 52 17.477 18.358 -29.916 1.00 0.00 H new ATOM 0 HB3 GLN A 52 17.804 16.636 -29.948 1.00 0.00 H new ATOM 0 HG2 GLN A 52 15.345 16.193 -30.243 1.00 0.00 H new ATOM 0 HG3 GLN A 52 15.049 17.920 -30.260 1.00 0.00 H new ATOM 0 HE21 GLN A 52 14.127 17.642 -32.331 1.00 0.00 H new ATOM 0 HE22 GLN A 52 15.136 17.522 -33.776 1.00 0.00 H new ATOM 800 N THR A 53 14.540 16.361 -28.069 1.00 0.00 N ATOM 801 CA THR A 53 13.105 16.368 -27.844 1.00 0.00 C ATOM 802 C THR A 53 12.798 16.236 -26.351 1.00 0.00 C ATOM 803 O THR A 53 11.729 16.640 -25.895 1.00 0.00 O ATOM 804 CB THR A 53 12.487 15.255 -28.692 1.00 0.00 C ATOM 805 OG1 THR A 53 11.114 15.621 -28.800 1.00 0.00 O ATOM 806 CG2 THR A 53 12.458 13.910 -27.962 1.00 0.00 C ATOM 0 H THR A 53 14.923 15.459 -28.353 1.00 0.00 H new ATOM 0 HA THR A 53 12.662 17.315 -28.152 1.00 0.00 H new ATOM 0 HB THR A 53 13.049 15.152 -29.620 1.00 0.00 H new ATOM 0 HG1 THR A 53 10.639 14.953 -29.337 1.00 0.00 H new ATOM 0 HG21 THR A 53 12.010 13.155 -28.608 1.00 0.00 H new ATOM 0 HG22 THR A 53 13.475 13.612 -27.707 1.00 0.00 H new ATOM 0 HG23 THR A 53 11.868 14.004 -27.050 1.00 0.00 H new ATOM 814 N VAL A 54 13.754 15.669 -25.631 1.00 0.00 N ATOM 815 CA VAL A 54 13.600 15.478 -24.199 1.00 0.00 C ATOM 816 C VAL A 54 14.047 16.746 -23.469 1.00 0.00 C ATOM 817 O VAL A 54 13.357 17.226 -22.570 1.00 0.00 O ATOM 818 CB VAL A 54 14.363 14.230 -23.751 1.00 0.00 C ATOM 819 CG1 VAL A 54 14.416 14.137 -22.225 1.00 0.00 C ATOM 820 CG2 VAL A 54 13.750 12.966 -24.357 1.00 0.00 C ATOM 0 H VAL A 54 14.639 15.335 -26.013 1.00 0.00 H new ATOM 0 HA VAL A 54 12.553 15.309 -23.947 1.00 0.00 H new ATOM 0 HB VAL A 54 15.387 14.314 -24.116 1.00 0.00 H new ATOM 0 HG11 VAL A 54 14.964 13.241 -21.934 1.00 0.00 H new ATOM 0 HG12 VAL A 54 14.920 15.017 -21.824 1.00 0.00 H new ATOM 0 HG13 VAL A 54 13.402 14.087 -21.828 1.00 0.00 H new ATOM 0 HG21 VAL A 54 14.311 12.093 -24.023 1.00 0.00 H new ATOM 0 HG22 VAL A 54 12.712 12.875 -24.036 1.00 0.00 H new ATOM 0 HG23 VAL A 54 13.789 13.028 -25.445 1.00 0.00 H new ATOM 830 N TYR A 55 15.200 17.253 -23.881 1.00 0.00 N ATOM 831 CA TYR A 55 15.747 18.456 -23.278 1.00 0.00 C ATOM 832 C TYR A 55 15.162 19.711 -23.928 1.00 0.00 C ATOM 833 O TYR A 55 15.218 20.796 -23.353 1.00 0.00 O ATOM 834 CB TYR A 55 17.253 18.413 -23.544 1.00 0.00 C ATOM 835 CG TYR A 55 18.086 19.214 -22.541 1.00 0.00 C ATOM 836 CD1 TYR A 55 18.324 18.705 -21.280 1.00 0.00 C ATOM 837 CD2 TYR A 55 18.598 20.445 -22.896 1.00 0.00 C ATOM 838 CE1 TYR A 55 19.107 19.459 -20.335 1.00 0.00 C ATOM 839 CE2 TYR A 55 19.381 21.199 -21.952 1.00 0.00 C ATOM 840 CZ TYR A 55 19.597 20.669 -20.718 1.00 0.00 C ATOM 841 OH TYR A 55 20.337 21.381 -19.826 1.00 0.00 O ATOM 0 H TYR A 55 15.770 16.852 -24.626 1.00 0.00 H new ATOM 0 HA TYR A 55 15.511 18.494 -22.215 1.00 0.00 H new ATOM 0 HB2 TYR A 55 17.585 17.375 -23.529 1.00 0.00 H new ATOM 0 HB3 TYR A 55 17.445 18.794 -24.547 1.00 0.00 H new ATOM 0 HD1 TYR A 55 17.923 17.741 -21.002 1.00 0.00 H new ATOM 0 HD2 TYR A 55 18.411 20.843 -23.882 1.00 0.00 H new ATOM 0 HE1 TYR A 55 19.301 19.073 -19.345 1.00 0.00 H new ATOM 0 HE2 TYR A 55 19.788 22.164 -22.218 1.00 0.00 H new ATOM 0 HH TYR A 55 20.622 22.224 -20.236 1.00 0.00 H new ATOM 851 N GLY A 56 14.614 19.521 -25.119 1.00 0.00 N ATOM 852 CA GLY A 56 14.019 20.624 -25.854 1.00 0.00 C ATOM 853 C GLY A 56 12.958 21.335 -25.011 1.00 0.00 C ATOM 854 O GLY A 56 13.009 22.553 -24.843 1.00 0.00 O ATOM 0 H GLY A 56 14.570 18.619 -25.594 1.00 0.00 H new ATOM 0 HA2 GLY A 56 14.794 21.333 -26.143 1.00 0.00 H new ATOM 0 HA3 GLY A 56 13.568 20.252 -26.774 1.00 0.00 H new ATOM 858 N PRO A 57 11.999 20.525 -24.491 1.00 0.00 N ATOM 859 CA PRO A 57 10.928 21.064 -23.670 1.00 0.00 C ATOM 860 C PRO A 57 11.436 21.419 -22.271 1.00 0.00 C ATOM 861 O PRO A 57 11.211 22.527 -21.787 1.00 0.00 O ATOM 862 CB PRO A 57 9.859 19.983 -23.657 1.00 0.00 C ATOM 863 CG PRO A 57 10.558 18.701 -24.081 1.00 0.00 C ATOM 864 CD PRO A 57 11.907 19.079 -24.670 1.00 0.00 C ATOM 0 HA PRO A 57 10.526 21.998 -24.063 1.00 0.00 H new ATOM 0 HB2 PRO A 57 9.421 19.879 -22.664 1.00 0.00 H new ATOM 0 HB3 PRO A 57 9.046 20.229 -24.340 1.00 0.00 H new ATOM 0 HG2 PRO A 57 10.687 18.036 -23.227 1.00 0.00 H new ATOM 0 HG3 PRO A 57 9.958 18.164 -24.815 1.00 0.00 H new ATOM 0 HD2 PRO A 57 12.720 18.564 -24.158 1.00 0.00 H new ATOM 0 HD3 PRO A 57 11.969 18.806 -25.723 1.00 0.00 H new ATOM 872 N LEU A 58 12.111 20.457 -21.660 1.00 0.00 N ATOM 873 CA LEU A 58 12.653 20.654 -20.326 1.00 0.00 C ATOM 874 C LEU A 58 14.048 21.273 -20.433 1.00 0.00 C ATOM 875 O LEU A 58 14.949 20.916 -19.675 1.00 0.00 O ATOM 876 CB LEU A 58 12.620 19.344 -19.535 1.00 0.00 C ATOM 877 CG LEU A 58 13.636 18.281 -19.957 1.00 0.00 C ATOM 878 CD1 LEU A 58 14.855 18.291 -19.033 1.00 0.00 C ATOM 879 CD2 LEU A 58 12.984 16.898 -20.030 1.00 0.00 C ATOM 0 H LEU A 58 12.295 19.539 -22.064 1.00 0.00 H new ATOM 0 HA LEU A 58 12.035 21.354 -19.764 1.00 0.00 H new ATOM 0 HB2 LEU A 58 12.781 19.574 -18.482 1.00 0.00 H new ATOM 0 HB3 LEU A 58 11.621 18.917 -19.619 1.00 0.00 H new ATOM 0 HG LEU A 58 13.989 18.524 -20.959 1.00 0.00 H new ATOM 0 HD11 LEU A 58 15.562 17.526 -19.355 1.00 0.00 H new ATOM 0 HD12 LEU A 58 15.335 19.269 -19.074 1.00 0.00 H new ATOM 0 HD13 LEU A 58 14.538 18.085 -18.011 1.00 0.00 H new ATOM 0 HD21 LEU A 58 13.728 16.161 -20.332 1.00 0.00 H new ATOM 0 HD22 LEU A 58 12.586 16.631 -19.051 1.00 0.00 H new ATOM 0 HD23 LEU A 58 12.174 16.916 -20.759 1.00 0.00 H new ATOM 891 N MET A 59 14.183 22.189 -21.380 1.00 0.00 N ATOM 892 CA MET A 59 15.453 22.861 -21.596 1.00 0.00 C ATOM 893 C MET A 59 15.608 24.057 -20.655 1.00 0.00 C ATOM 894 O MET A 59 16.683 24.280 -20.100 1.00 0.00 O ATOM 895 CB MET A 59 15.539 23.338 -23.047 1.00 0.00 C ATOM 896 CG MET A 59 16.887 22.967 -23.668 1.00 0.00 C ATOM 897 SD MET A 59 17.658 24.417 -24.365 1.00 0.00 S ATOM 898 CE MET A 59 18.339 25.148 -22.886 1.00 0.00 C ATOM 0 H MET A 59 13.434 22.482 -22.007 1.00 0.00 H new ATOM 0 HA MET A 59 16.256 22.154 -21.389 1.00 0.00 H new ATOM 0 HB2 MET A 59 14.732 22.892 -23.628 1.00 0.00 H new ATOM 0 HB3 MET A 59 15.401 24.419 -23.087 1.00 0.00 H new ATOM 0 HG2 MET A 59 17.537 22.528 -22.911 1.00 0.00 H new ATOM 0 HG3 MET A 59 16.745 22.213 -24.442 1.00 0.00 H new ATOM 0 HE1 MET A 59 18.963 26.000 -23.155 1.00 0.00 H new ATOM 0 HE2 MET A 59 17.528 25.482 -22.239 1.00 0.00 H new ATOM 0 HE3 MET A 59 18.943 24.409 -22.360 1.00 0.00 H new ATOM 908 N GLU A 60 14.518 24.795 -20.504 1.00 0.00 N ATOM 909 CA GLU A 60 14.519 25.963 -19.640 1.00 0.00 C ATOM 910 C GLU A 60 14.601 25.538 -18.172 1.00 0.00 C ATOM 911 O GLU A 60 15.588 25.819 -17.495 1.00 0.00 O ATOM 912 CB GLU A 60 13.285 26.832 -19.891 1.00 0.00 C ATOM 913 CG GLU A 60 13.679 28.187 -20.482 1.00 0.00 C ATOM 914 CD GLU A 60 13.748 29.261 -19.394 1.00 0.00 C ATOM 915 OE1 GLU A 60 14.835 29.535 -18.863 1.00 0.00 O ATOM 916 OE2 GLU A 60 12.622 29.819 -19.106 1.00 0.00 O ATOM 0 H GLU A 60 13.628 24.607 -20.966 1.00 0.00 H new ATOM 0 HA GLU A 60 15.399 26.563 -19.874 1.00 0.00 H new ATOM 0 HB2 GLU A 60 12.606 26.318 -20.572 1.00 0.00 H new ATOM 0 HB3 GLU A 60 12.745 26.982 -18.956 1.00 0.00 H new ATOM 0 HG2 GLU A 60 14.646 28.104 -20.978 1.00 0.00 H new ATOM 0 HG3 GLU A 60 12.955 28.480 -21.242 1.00 0.00 H new ATOM 924 N TYR A 61 13.550 24.867 -17.724 1.00 0.00 N ATOM 925 CA TYR A 61 13.490 24.400 -16.350 1.00 0.00 C ATOM 926 C TYR A 61 14.868 23.944 -15.866 1.00 0.00 C ATOM 927 O TYR A 61 15.282 24.278 -14.757 1.00 0.00 O ATOM 928 CB TYR A 61 12.540 23.201 -16.353 1.00 0.00 C ATOM 929 CG TYR A 61 12.800 22.199 -15.225 1.00 0.00 C ATOM 930 CD1 TYR A 61 12.480 22.528 -13.923 1.00 0.00 C ATOM 931 CD2 TYR A 61 13.353 20.968 -15.510 1.00 0.00 C ATOM 932 CE1 TYR A 61 12.724 21.585 -12.862 1.00 0.00 C ATOM 933 CE2 TYR A 61 13.597 20.025 -14.449 1.00 0.00 C ATOM 934 CZ TYR A 61 13.270 20.380 -13.178 1.00 0.00 C ATOM 935 OH TYR A 61 13.500 19.490 -12.176 1.00 0.00 O ATOM 0 H TYR A 61 12.733 24.636 -18.289 1.00 0.00 H new ATOM 0 HA TYR A 61 13.153 25.197 -15.688 1.00 0.00 H new ATOM 0 HB2 TYR A 61 11.515 23.562 -16.275 1.00 0.00 H new ATOM 0 HB3 TYR A 61 12.624 22.686 -17.310 1.00 0.00 H new ATOM 0 HD1 TYR A 61 12.047 23.492 -13.700 1.00 0.00 H new ATOM 0 HD2 TYR A 61 13.603 20.711 -16.529 1.00 0.00 H new ATOM 0 HE1 TYR A 61 12.479 21.829 -11.839 1.00 0.00 H new ATOM 0 HE2 TYR A 61 14.030 19.058 -14.658 1.00 0.00 H new ATOM 0 HH TYR A 61 14.315 19.743 -11.694 1.00 0.00 H new ATOM 945 N ILE A 62 15.540 23.187 -16.721 1.00 0.00 N ATOM 946 CA ILE A 62 16.862 22.681 -16.395 1.00 0.00 C ATOM 947 C ILE A 62 17.860 23.841 -16.389 1.00 0.00 C ATOM 948 O ILE A 62 18.636 23.992 -15.447 1.00 0.00 O ATOM 949 CB ILE A 62 17.249 21.543 -17.341 1.00 0.00 C ATOM 950 CG1 ILE A 62 16.806 20.190 -16.780 1.00 0.00 C ATOM 951 CG2 ILE A 62 18.746 21.572 -17.651 1.00 0.00 C ATOM 952 CD1 ILE A 62 17.292 19.042 -17.668 1.00 0.00 C ATOM 0 H ILE A 62 15.193 22.912 -17.640 1.00 0.00 H new ATOM 0 HA ILE A 62 16.868 22.249 -15.394 1.00 0.00 H new ATOM 0 HB ILE A 62 16.723 21.689 -18.284 1.00 0.00 H new ATOM 0 HG12 ILE A 62 17.198 20.065 -15.771 1.00 0.00 H new ATOM 0 HG13 ILE A 62 15.719 20.162 -16.705 1.00 0.00 H new ATOM 0 HG21 ILE A 62 18.994 20.752 -18.325 1.00 0.00 H new ATOM 0 HG22 ILE A 62 19.001 22.521 -18.123 1.00 0.00 H new ATOM 0 HG23 ILE A 62 19.311 21.464 -16.725 1.00 0.00 H new ATOM 0 HD11 ILE A 62 16.964 18.092 -17.247 1.00 0.00 H new ATOM 0 HD12 ILE A 62 16.878 19.157 -18.670 1.00 0.00 H new ATOM 0 HD13 ILE A 62 18.381 19.059 -17.721 1.00 0.00 H new ATOM 964 N ALA A 63 17.806 24.632 -17.451 1.00 0.00 N ATOM 965 CA ALA A 63 18.696 25.773 -17.580 1.00 0.00 C ATOM 966 C ALA A 63 18.821 26.472 -16.224 1.00 0.00 C ATOM 967 O ALA A 63 19.905 26.915 -15.848 1.00 0.00 O ATOM 968 CB ALA A 63 18.172 26.708 -18.672 1.00 0.00 C ATOM 0 H ALA A 63 17.160 24.505 -18.230 1.00 0.00 H new ATOM 0 HA ALA A 63 19.694 25.451 -17.878 1.00 0.00 H new ATOM 0 HB1 ALA A 63 18.840 27.564 -18.769 1.00 0.00 H new ATOM 0 HB2 ALA A 63 18.129 26.172 -19.620 1.00 0.00 H new ATOM 0 HB3 ALA A 63 17.174 27.055 -18.406 1.00 0.00 H new ATOM 974 N ASP A 64 17.696 26.550 -15.529 1.00 0.00 N ATOM 975 CA ASP A 64 17.666 27.188 -14.223 1.00 0.00 C ATOM 976 C ASP A 64 18.089 26.176 -13.156 1.00 0.00 C ATOM 977 O ASP A 64 18.787 26.526 -12.206 1.00 0.00 O ATOM 978 CB ASP A 64 16.257 27.675 -13.880 1.00 0.00 C ATOM 979 CG ASP A 64 15.871 29.022 -14.494 1.00 0.00 C ATOM 980 OD1 ASP A 64 14.819 29.153 -15.137 1.00 0.00 O ATOM 981 OD2 ASP A 64 16.714 29.976 -14.288 1.00 0.00 O ATOM 0 H ASP A 64 16.799 26.182 -15.845 1.00 0.00 H new ATOM 0 HA ASP A 64 18.346 28.040 -14.248 1.00 0.00 H new ATOM 0 HB2 ASP A 64 15.539 26.924 -14.209 1.00 0.00 H new ATOM 0 HB3 ASP A 64 16.168 27.748 -12.796 1.00 0.00 H new ATOM 987 N ASN A 65 17.648 24.941 -13.349 1.00 0.00 N ATOM 988 CA ASN A 65 17.972 23.877 -12.415 1.00 0.00 C ATOM 989 C ASN A 65 19.493 23.745 -12.307 1.00 0.00 C ATOM 990 O ASN A 65 20.001 23.137 -11.366 1.00 0.00 O ATOM 991 CB ASN A 65 17.415 22.535 -12.895 1.00 0.00 C ATOM 992 CG ASN A 65 17.266 21.555 -11.729 1.00 0.00 C ATOM 993 OD1 ASN A 65 16.175 21.164 -11.349 1.00 0.00 O ATOM 994 ND2 ASN A 65 18.421 21.182 -11.185 1.00 0.00 N ATOM 0 H ASN A 65 17.069 24.654 -14.138 1.00 0.00 H new ATOM 0 HA ASN A 65 17.530 24.128 -11.451 1.00 0.00 H new ATOM 0 HB2 ASN A 65 16.447 22.689 -13.372 1.00 0.00 H new ATOM 0 HB3 ASN A 65 18.078 22.111 -13.649 1.00 0.00 H new ATOM 0 HD21 ASN A 65 18.428 20.530 -10.401 1.00 0.00 H new ATOM 0 HD22 ASN A 65 19.299 21.548 -11.552 1.00 0.00 H new ATOM 1001 N ARG A 66 20.176 24.324 -13.282 1.00 0.00 N ATOM 1002 CA ARG A 66 21.628 24.279 -13.308 1.00 0.00 C ATOM 1003 C ARG A 66 22.184 24.253 -11.883 1.00 0.00 C ATOM 1004 O ARG A 66 23.173 23.575 -11.611 1.00 0.00 O ATOM 1005 CB ARG A 66 22.204 25.487 -14.050 1.00 0.00 C ATOM 1006 CG ARG A 66 23.729 25.523 -13.939 1.00 0.00 C ATOM 1007 CD ARG A 66 24.354 26.177 -15.173 1.00 0.00 C ATOM 1008 NE ARG A 66 25.547 25.413 -15.602 1.00 0.00 N ATOM 1009 CZ ARG A 66 26.125 25.531 -16.816 1.00 0.00 C ATOM 1010 NH1 ARG A 66 25.623 26.385 -17.734 1.00 0.00 N ATOM 1011 NH2 ARG A 66 27.188 24.799 -17.093 1.00 0.00 N ATOM 0 H ARG A 66 19.751 24.827 -14.061 1.00 0.00 H new ATOM 0 HA ARG A 66 21.922 23.370 -13.833 1.00 0.00 H new ATOM 0 HB2 ARG A 66 21.913 25.446 -15.100 1.00 0.00 H new ATOM 0 HB3 ARG A 66 21.784 26.405 -13.639 1.00 0.00 H new ATOM 0 HG2 ARG A 66 24.019 26.075 -13.045 1.00 0.00 H new ATOM 0 HG3 ARG A 66 24.113 24.509 -13.827 1.00 0.00 H new ATOM 0 HD2 ARG A 66 23.626 26.215 -15.983 1.00 0.00 H new ATOM 0 HD3 ARG A 66 24.633 27.206 -14.947 1.00 0.00 H new ATOM 0 HE ARG A 66 25.958 24.756 -14.939 1.00 0.00 H new ATOM 0 HH11 ARG A 66 24.801 26.947 -17.512 1.00 0.00 H new ATOM 0 HH12 ARG A 66 26.066 26.468 -18.649 1.00 0.00 H new ATOM 0 HH21 ARG A 66 27.561 24.156 -16.394 1.00 0.00 H new ATOM 0 HH22 ARG A 66 27.637 24.876 -18.006 1.00 0.00 H new ATOM 1024 N ILE A 67 21.523 25.000 -11.011 1.00 0.00 N ATOM 1025 CA ILE A 67 21.939 25.071 -9.620 1.00 0.00 C ATOM 1026 C ILE A 67 22.432 23.695 -9.169 1.00 0.00 C ATOM 1027 O ILE A 67 23.339 23.597 -8.343 1.00 0.00 O ATOM 1028 CB ILE A 67 20.812 25.636 -8.752 1.00 0.00 C ATOM 1029 CG1 ILE A 67 20.173 26.860 -9.411 1.00 0.00 C ATOM 1030 CG2 ILE A 67 21.309 25.940 -7.338 1.00 0.00 C ATOM 1031 CD1 ILE A 67 21.233 27.739 -10.079 1.00 0.00 C ATOM 0 H ILE A 67 20.703 25.561 -11.240 1.00 0.00 H new ATOM 0 HA ILE A 67 22.774 25.762 -9.507 1.00 0.00 H new ATOM 0 HB ILE A 67 20.035 24.876 -8.664 1.00 0.00 H new ATOM 0 HG12 ILE A 67 19.442 26.538 -10.153 1.00 0.00 H new ATOM 0 HG13 ILE A 67 19.633 27.440 -8.663 1.00 0.00 H new ATOM 0 HG21 ILE A 67 20.489 26.340 -6.742 1.00 0.00 H new ATOM 0 HG22 ILE A 67 21.679 25.024 -6.877 1.00 0.00 H new ATOM 0 HG23 ILE A 67 22.114 26.673 -7.385 1.00 0.00 H new ATOM 0 HD11 ILE A 67 20.752 28.602 -10.540 1.00 0.00 H new ATOM 0 HD12 ILE A 67 21.948 28.079 -9.330 1.00 0.00 H new ATOM 0 HD13 ILE A 67 21.754 27.163 -10.844 1.00 0.00 H new ATOM 1043 N HIS A 68 21.814 22.667 -9.730 1.00 0.00 N ATOM 1044 CA HIS A 68 22.179 21.301 -9.396 1.00 0.00 C ATOM 1045 C HIS A 68 22.507 20.529 -10.675 1.00 0.00 C ATOM 1046 O HIS A 68 22.715 21.128 -11.730 1.00 0.00 O ATOM 1047 CB HIS A 68 21.080 20.633 -8.566 1.00 0.00 C ATOM 1048 CG HIS A 68 21.381 20.569 -7.087 1.00 0.00 C ATOM 1049 ND1 HIS A 68 20.391 20.471 -6.125 1.00 0.00 N ATOM 1050 CD2 HIS A 68 22.569 20.588 -6.418 1.00 0.00 C ATOM 1051 CE1 HIS A 68 20.969 20.436 -4.933 1.00 0.00 C ATOM 1052 NE2 HIS A 68 22.319 20.509 -5.117 1.00 0.00 N ATOM 0 H HIS A 68 21.062 22.752 -10.414 1.00 0.00 H new ATOM 0 HA HIS A 68 23.074 21.302 -8.775 1.00 0.00 H new ATOM 0 HB2 HIS A 68 20.147 21.176 -8.713 1.00 0.00 H new ATOM 0 HB3 HIS A 68 20.922 19.621 -8.938 1.00 0.00 H new ATOM 0 HD1 HIS A 68 19.387 20.432 -6.303 1.00 0.00 H new ATOM 0 HD2 HIS A 68 23.547 20.656 -6.870 1.00 0.00 H new ATOM 0 HE1 HIS A 68 20.461 20.363 -3.983 1.00 0.00 H new ATOM 1060 N ALA A 69 22.544 19.212 -10.541 1.00 0.00 N ATOM 1061 CA ALA A 69 22.843 18.352 -11.673 1.00 0.00 C ATOM 1062 C ALA A 69 21.708 17.343 -11.857 1.00 0.00 C ATOM 1063 O ALA A 69 21.748 16.250 -11.296 1.00 0.00 O ATOM 1064 CB ALA A 69 24.197 17.673 -11.455 1.00 0.00 C ATOM 0 H ALA A 69 22.372 18.719 -9.665 1.00 0.00 H new ATOM 0 HA ALA A 69 22.915 18.937 -12.590 1.00 0.00 H new ATOM 0 HB1 ALA A 69 24.421 17.028 -12.304 1.00 0.00 H new ATOM 0 HB2 ALA A 69 24.974 18.432 -11.361 1.00 0.00 H new ATOM 0 HB3 ALA A 69 24.162 17.075 -10.544 1.00 0.00 H new ATOM 1070 N VAL A 70 20.722 17.747 -12.645 1.00 0.00 N ATOM 1071 CA VAL A 70 19.577 16.892 -12.909 1.00 0.00 C ATOM 1072 C VAL A 70 19.614 16.436 -14.369 1.00 0.00 C ATOM 1073 O VAL A 70 19.130 17.138 -15.255 1.00 0.00 O ATOM 1074 CB VAL A 70 18.283 17.622 -12.543 1.00 0.00 C ATOM 1075 CG1 VAL A 70 18.353 18.182 -11.121 1.00 0.00 C ATOM 1076 CG2 VAL A 70 17.973 18.728 -13.554 1.00 0.00 C ATOM 0 H VAL A 70 20.692 18.655 -13.109 1.00 0.00 H new ATOM 0 HA VAL A 70 19.616 15.998 -12.287 1.00 0.00 H new ATOM 0 HB VAL A 70 17.468 16.899 -12.578 1.00 0.00 H new ATOM 0 HG11 VAL A 70 17.421 18.696 -10.886 1.00 0.00 H new ATOM 0 HG12 VAL A 70 18.505 17.365 -10.415 1.00 0.00 H new ATOM 0 HG13 VAL A 70 19.183 18.884 -11.047 1.00 0.00 H new ATOM 0 HG21 VAL A 70 17.048 19.231 -13.271 1.00 0.00 H new ATOM 0 HG22 VAL A 70 18.790 19.450 -13.566 1.00 0.00 H new ATOM 0 HG23 VAL A 70 17.860 18.292 -14.547 1.00 0.00 H new ATOM 1086 N SER A 71 20.192 15.261 -14.574 1.00 0.00 N ATOM 1087 CA SER A 71 20.297 14.703 -15.911 1.00 0.00 C ATOM 1088 C SER A 71 18.951 14.119 -16.343 1.00 0.00 C ATOM 1089 O SER A 71 18.151 13.707 -15.503 1.00 0.00 O ATOM 1090 CB SER A 71 21.386 13.629 -15.975 1.00 0.00 C ATOM 1091 OG SER A 71 22.621 14.150 -16.460 1.00 0.00 O ATOM 0 H SER A 71 20.592 14.681 -13.837 1.00 0.00 H new ATOM 0 HA SER A 71 20.573 15.505 -16.595 1.00 0.00 H new ATOM 0 HB2 SER A 71 21.536 13.205 -14.982 1.00 0.00 H new ATOM 0 HB3 SER A 71 21.056 12.816 -16.622 1.00 0.00 H new ATOM 0 HG SER A 71 23.291 13.435 -16.485 1.00 0.00 H new ATOM 1097 N ILE A 72 18.740 14.102 -17.651 1.00 0.00 N ATOM 1098 CA ILE A 72 17.504 13.576 -18.204 1.00 0.00 C ATOM 1099 C ILE A 72 17.815 12.787 -19.477 1.00 0.00 C ATOM 1100 O ILE A 72 18.233 13.361 -20.481 1.00 0.00 O ATOM 1101 CB ILE A 72 16.488 14.701 -18.410 1.00 0.00 C ATOM 1102 CG1 ILE A 72 15.136 14.338 -17.793 1.00 0.00 C ATOM 1103 CG2 ILE A 72 16.363 15.062 -19.891 1.00 0.00 C ATOM 1104 CD1 ILE A 72 14.898 15.115 -16.496 1.00 0.00 C ATOM 0 H ILE A 72 19.405 14.445 -18.344 1.00 0.00 H new ATOM 0 HA ILE A 72 17.038 12.882 -17.504 1.00 0.00 H new ATOM 0 HB ILE A 72 16.851 15.588 -17.892 1.00 0.00 H new ATOM 0 HG12 ILE A 72 14.338 14.556 -18.503 1.00 0.00 H new ATOM 0 HG13 ILE A 72 15.100 13.267 -17.591 1.00 0.00 H new ATOM 0 HG21 ILE A 72 15.635 15.864 -20.010 1.00 0.00 H new ATOM 0 HG22 ILE A 72 17.331 15.392 -20.268 1.00 0.00 H new ATOM 0 HG23 ILE A 72 16.034 14.187 -20.452 1.00 0.00 H new ATOM 0 HD11 ILE A 72 13.930 14.838 -16.078 1.00 0.00 H new ATOM 0 HD12 ILE A 72 15.684 14.876 -15.779 1.00 0.00 H new ATOM 0 HD13 ILE A 72 14.910 16.185 -16.705 1.00 0.00 H new ATOM 1116 N LYS A 73 17.599 11.482 -19.394 1.00 0.00 N ATOM 1117 CA LYS A 73 17.851 10.609 -20.527 1.00 0.00 C ATOM 1118 C LYS A 73 16.739 9.562 -20.616 1.00 0.00 C ATOM 1119 O LYS A 73 16.541 8.781 -19.686 1.00 0.00 O ATOM 1120 CB LYS A 73 19.256 10.008 -20.439 1.00 0.00 C ATOM 1121 CG LYS A 73 20.149 10.533 -21.564 1.00 0.00 C ATOM 1122 CD LYS A 73 21.576 10.769 -21.067 1.00 0.00 C ATOM 1123 CE LYS A 73 22.527 11.036 -22.235 1.00 0.00 C ATOM 1124 NZ LYS A 73 23.888 10.549 -21.918 1.00 0.00 N ATOM 0 H LYS A 73 17.252 11.009 -18.560 1.00 0.00 H new ATOM 0 HA LYS A 73 17.830 11.177 -21.457 1.00 0.00 H new ATOM 0 HB2 LYS A 73 19.700 10.252 -19.474 1.00 0.00 H new ATOM 0 HB3 LYS A 73 19.195 8.921 -20.496 1.00 0.00 H new ATOM 0 HG2 LYS A 73 20.160 9.819 -22.387 1.00 0.00 H new ATOM 0 HG3 LYS A 73 19.738 11.464 -21.955 1.00 0.00 H new ATOM 0 HD2 LYS A 73 21.590 11.616 -20.381 1.00 0.00 H new ATOM 0 HD3 LYS A 73 21.918 9.899 -20.507 1.00 0.00 H new ATOM 0 HE2 LYS A 73 22.157 10.541 -23.133 1.00 0.00 H new ATOM 0 HE3 LYS A 73 22.558 12.104 -22.450 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 24.520 10.738 -22.722 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 24.245 11.040 -21.074 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 23.857 9.526 -21.736 1.00 0.00 H new ATOM 1137 N ALA A 74 16.043 9.579 -21.743 1.00 0.00 N ATOM 1138 CA ALA A 74 14.955 8.640 -21.965 1.00 0.00 C ATOM 1139 C ALA A 74 15.532 7.293 -22.403 1.00 0.00 C ATOM 1140 O ALA A 74 16.192 7.202 -23.437 1.00 0.00 O ATOM 1141 CB ALA A 74 13.983 9.220 -22.994 1.00 0.00 C ATOM 0 H ALA A 74 16.211 10.227 -22.512 1.00 0.00 H new ATOM 0 HA ALA A 74 14.395 8.475 -21.044 1.00 0.00 H new ATOM 0 HB1 ALA A 74 13.167 8.517 -23.161 1.00 0.00 H new ATOM 0 HB2 ALA A 74 13.580 10.162 -22.623 1.00 0.00 H new ATOM 0 HB3 ALA A 74 14.509 9.395 -23.933 1.00 0.00 H new ATOM 1147 N TYR A 75 15.262 6.279 -21.594 1.00 0.00 N ATOM 1148 CA TYR A 75 15.746 4.940 -21.885 1.00 0.00 C ATOM 1149 C TYR A 75 14.789 3.880 -21.336 1.00 0.00 C ATOM 1150 O TYR A 75 13.758 4.211 -20.753 1.00 0.00 O ATOM 1151 CB TYR A 75 17.092 4.813 -21.169 1.00 0.00 C ATOM 1152 CG TYR A 75 18.241 5.539 -21.871 1.00 0.00 C ATOM 1153 CD1 TYR A 75 18.394 5.429 -23.239 1.00 0.00 C ATOM 1154 CD2 TYR A 75 19.125 6.305 -21.138 1.00 0.00 C ATOM 1155 CE1 TYR A 75 19.476 6.112 -23.900 1.00 0.00 C ATOM 1156 CE2 TYR A 75 20.207 6.988 -21.799 1.00 0.00 C ATOM 1157 CZ TYR A 75 20.328 6.858 -23.148 1.00 0.00 C ATOM 1158 OH TYR A 75 21.350 7.503 -23.772 1.00 0.00 O ATOM 0 H TYR A 75 14.714 6.358 -20.737 1.00 0.00 H new ATOM 0 HA TYR A 75 15.828 4.787 -22.961 1.00 0.00 H new ATOM 0 HB2 TYR A 75 16.992 5.206 -20.157 1.00 0.00 H new ATOM 0 HB3 TYR A 75 17.345 3.757 -21.078 1.00 0.00 H new ATOM 0 HD1 TYR A 75 17.702 4.831 -23.813 1.00 0.00 H new ATOM 0 HD2 TYR A 75 19.005 6.392 -20.068 1.00 0.00 H new ATOM 0 HE1 TYR A 75 19.608 6.033 -24.969 1.00 0.00 H new ATOM 0 HE2 TYR A 75 20.906 7.589 -21.237 1.00 0.00 H new ATOM 0 HH TYR A 75 21.877 7.998 -23.110 1.00 0.00 H new ATOM 1168 N THR A 76 15.164 2.626 -21.544 1.00 0.00 N ATOM 1169 CA THR A 76 14.351 1.515 -21.077 1.00 0.00 C ATOM 1170 C THR A 76 14.746 1.128 -19.651 1.00 0.00 C ATOM 1171 O THR A 76 15.621 1.752 -19.054 1.00 0.00 O ATOM 1172 CB THR A 76 14.497 0.369 -22.080 1.00 0.00 C ATOM 1173 OG1 THR A 76 15.605 -0.382 -21.590 1.00 0.00 O ATOM 1174 CG2 THR A 76 14.955 0.851 -23.458 1.00 0.00 C ATOM 0 H THR A 76 16.019 2.355 -22.029 1.00 0.00 H new ATOM 0 HA THR A 76 13.297 1.790 -21.026 1.00 0.00 H new ATOM 0 HB THR A 76 13.545 -0.152 -22.176 1.00 0.00 H new ATOM 0 HG1 THR A 76 15.769 -1.147 -22.181 1.00 0.00 H new ATOM 0 HG21 THR A 76 15.043 -0.002 -24.131 1.00 0.00 H new ATOM 0 HG22 THR A 76 14.226 1.556 -23.858 1.00 0.00 H new ATOM 0 HG23 THR A 76 15.923 1.343 -23.368 1.00 0.00 H new ATOM 1182 N PRO A 77 14.063 0.073 -19.132 1.00 0.00 N ATOM 1183 CA PRO A 77 14.332 -0.405 -17.787 1.00 0.00 C ATOM 1184 C PRO A 77 15.647 -1.187 -17.736 1.00 0.00 C ATOM 1185 O PRO A 77 16.384 -1.105 -16.754 1.00 0.00 O ATOM 1186 CB PRO A 77 13.124 -1.251 -17.420 1.00 0.00 C ATOM 1187 CG PRO A 77 12.442 -1.596 -18.734 1.00 0.00 C ATOM 1188 CD PRO A 77 13.019 -0.691 -19.810 1.00 0.00 C ATOM 0 HA PRO A 77 14.465 0.406 -17.071 1.00 0.00 H new ATOM 0 HB2 PRO A 77 13.426 -2.153 -16.888 1.00 0.00 H new ATOM 0 HB3 PRO A 77 12.449 -0.704 -16.762 1.00 0.00 H new ATOM 0 HG2 PRO A 77 12.608 -2.643 -18.987 1.00 0.00 H new ATOM 0 HG3 PRO A 77 11.364 -1.454 -18.653 1.00 0.00 H new ATOM 0 HD2 PRO A 77 13.427 -1.271 -20.638 1.00 0.00 H new ATOM 0 HD3 PRO A 77 12.255 -0.034 -20.227 1.00 0.00 H new ATOM 1196 N ALA A 78 15.900 -1.926 -18.805 1.00 0.00 N ATOM 1197 CA ALA A 78 17.113 -2.722 -18.895 1.00 0.00 C ATOM 1198 C ALA A 78 18.258 -1.843 -19.403 1.00 0.00 C ATOM 1199 O ALA A 78 19.427 -2.138 -19.159 1.00 0.00 O ATOM 1200 CB ALA A 78 16.864 -3.933 -19.795 1.00 0.00 C ATOM 0 H ALA A 78 15.286 -1.991 -19.617 1.00 0.00 H new ATOM 0 HA ALA A 78 17.398 -3.100 -17.913 1.00 0.00 H new ATOM 0 HB1 ALA A 78 17.774 -4.530 -19.862 1.00 0.00 H new ATOM 0 HB2 ALA A 78 16.062 -4.540 -19.375 1.00 0.00 H new ATOM 0 HB3 ALA A 78 16.578 -3.594 -20.791 1.00 0.00 H new ATOM 1206 N GLU A 79 17.882 -0.781 -20.099 1.00 0.00 N ATOM 1207 CA GLU A 79 18.862 0.143 -20.644 1.00 0.00 C ATOM 1208 C GLU A 79 19.705 0.746 -19.518 1.00 0.00 C ATOM 1209 O GLU A 79 20.893 1.008 -19.700 1.00 0.00 O ATOM 1210 CB GLU A 79 18.185 1.239 -21.469 1.00 0.00 C ATOM 1211 CG GLU A 79 19.221 2.169 -22.101 1.00 0.00 C ATOM 1212 CD GLU A 79 19.808 1.553 -23.373 1.00 0.00 C ATOM 1213 OE1 GLU A 79 19.304 1.809 -24.476 1.00 0.00 O ATOM 1214 OE2 GLU A 79 20.826 0.783 -23.186 1.00 0.00 O ATOM 0 H GLU A 79 16.911 -0.539 -20.298 1.00 0.00 H new ATOM 0 HA GLU A 79 19.523 -0.411 -21.311 1.00 0.00 H new ATOM 0 HB2 GLU A 79 17.574 0.786 -22.250 1.00 0.00 H new ATOM 0 HB3 GLU A 79 17.514 1.816 -20.833 1.00 0.00 H new ATOM 0 HG2 GLU A 79 18.759 3.127 -22.337 1.00 0.00 H new ATOM 0 HG3 GLU A 79 20.020 2.368 -21.387 1.00 0.00 H new ATOM 1222 N TRP A 80 19.057 0.950 -18.381 1.00 0.00 N ATOM 1223 CA TRP A 80 19.733 1.517 -17.226 1.00 0.00 C ATOM 1224 C TRP A 80 20.955 0.650 -16.920 1.00 0.00 C ATOM 1225 O TRP A 80 22.089 1.065 -17.154 1.00 0.00 O ATOM 1226 CB TRP A 80 18.776 1.643 -16.039 1.00 0.00 C ATOM 1227 CG TRP A 80 18.739 3.039 -15.415 1.00 0.00 C ATOM 1228 CD1 TRP A 80 17.679 3.693 -14.918 1.00 0.00 C ATOM 1229 CD2 TRP A 80 19.858 3.933 -15.240 1.00 0.00 C ATOM 1230 NE1 TRP A 80 18.033 4.937 -14.438 1.00 0.00 N ATOM 1231 CE2 TRP A 80 19.400 5.088 -14.640 1.00 0.00 C ATOM 1232 CE3 TRP A 80 21.213 3.771 -15.577 1.00 0.00 C ATOM 1233 CZ2 TRP A 80 20.231 6.170 -14.325 1.00 0.00 C ATOM 1234 CZ3 TRP A 80 22.031 4.861 -15.256 1.00 0.00 C ATOM 1235 CH2 TRP A 80 21.585 6.031 -14.652 1.00 0.00 C ATOM 0 H TRP A 80 18.071 0.733 -18.234 1.00 0.00 H new ATOM 0 HA TRP A 80 20.071 2.532 -17.436 1.00 0.00 H new ATOM 0 HB2 TRP A 80 17.771 1.376 -16.366 1.00 0.00 H new ATOM 0 HB3 TRP A 80 19.065 0.922 -15.274 1.00 0.00 H new ATOM 0 HD1 TRP A 80 16.675 3.296 -14.896 1.00 0.00 H new ATOM 0 HE1 TRP A 80 17.407 5.621 -14.013 1.00 0.00 H new ATOM 0 HE3 TRP A 80 21.593 2.876 -16.047 1.00 0.00 H new ATOM 0 HZ2 TRP A 80 19.848 7.064 -13.855 1.00 0.00 H new ATOM 0 HZ3 TRP A 80 23.082 4.788 -15.494 1.00 0.00 H new ATOM 0 HH2 TRP A 80 22.280 6.829 -14.436 1.00 0.00 H new ATOM 1246 N ALA A 81 20.683 -0.539 -16.401 1.00 0.00 N ATOM 1247 CA ALA A 81 21.747 -1.468 -16.061 1.00 0.00 C ATOM 1248 C ALA A 81 22.747 -1.537 -17.216 1.00 0.00 C ATOM 1249 O ALA A 81 23.955 -1.598 -16.994 1.00 0.00 O ATOM 1250 CB ALA A 81 21.144 -2.834 -15.728 1.00 0.00 C ATOM 0 H ALA A 81 19.741 -0.880 -16.208 1.00 0.00 H new ATOM 0 HA ALA A 81 22.288 -1.126 -15.178 1.00 0.00 H new ATOM 0 HB1 ALA A 81 21.942 -3.531 -15.473 1.00 0.00 H new ATOM 0 HB2 ALA A 81 20.464 -2.735 -14.882 1.00 0.00 H new ATOM 0 HB3 ALA A 81 20.596 -3.210 -16.592 1.00 0.00 H new ATOM 1256 N ARG A 82 22.207 -1.526 -18.426 1.00 0.00 N ATOM 1257 CA ARG A 82 23.037 -1.587 -19.617 1.00 0.00 C ATOM 1258 C ARG A 82 23.995 -0.395 -19.658 1.00 0.00 C ATOM 1259 O ARG A 82 25.133 -0.523 -20.107 1.00 0.00 O ATOM 1260 CB ARG A 82 22.181 -1.588 -20.885 1.00 0.00 C ATOM 1261 CG ARG A 82 23.043 -1.815 -22.129 1.00 0.00 C ATOM 1262 CD ARG A 82 22.216 -2.414 -23.268 1.00 0.00 C ATOM 1263 NE ARG A 82 22.974 -3.504 -23.924 1.00 0.00 N ATOM 1264 CZ ARG A 82 24.088 -3.313 -24.662 1.00 0.00 C ATOM 1265 NH1 ARG A 82 24.585 -2.071 -24.844 1.00 0.00 N ATOM 1266 NH2 ARG A 82 24.684 -4.359 -25.202 1.00 0.00 N ATOM 0 H ARG A 82 21.204 -1.476 -18.607 1.00 0.00 H new ATOM 0 HA ARG A 82 23.608 -2.515 -19.576 1.00 0.00 H new ATOM 0 HB2 ARG A 82 21.423 -2.369 -20.816 1.00 0.00 H new ATOM 0 HB3 ARG A 82 21.653 -0.638 -20.972 1.00 0.00 H new ATOM 0 HG2 ARG A 82 23.480 -0.870 -22.450 1.00 0.00 H new ATOM 0 HG3 ARG A 82 23.870 -2.482 -21.886 1.00 0.00 H new ATOM 0 HD2 ARG A 82 21.272 -2.798 -22.881 1.00 0.00 H new ATOM 0 HD3 ARG A 82 21.971 -1.641 -23.996 1.00 0.00 H new ATOM 0 HE ARG A 82 22.633 -4.459 -23.811 1.00 0.00 H new ATOM 0 HH11 ARG A 82 24.118 -1.268 -24.422 1.00 0.00 H new ATOM 0 HH12 ARG A 82 25.427 -1.936 -25.403 1.00 0.00 H new ATOM 0 HH21 ARG A 82 24.302 -5.294 -25.059 1.00 0.00 H new ATOM 0 HH22 ARG A 82 25.527 -4.233 -25.763 1.00 0.00 H new ATOM 1279 N ASP A 83 23.499 0.738 -19.182 1.00 0.00 N ATOM 1280 CA ASP A 83 24.297 1.952 -19.159 1.00 0.00 C ATOM 1281 C ASP A 83 25.166 1.962 -17.899 1.00 0.00 C ATOM 1282 O ASP A 83 26.378 2.154 -17.978 1.00 0.00 O ATOM 1283 CB ASP A 83 23.407 3.196 -19.129 1.00 0.00 C ATOM 1284 CG ASP A 83 23.453 4.055 -20.394 1.00 0.00 C ATOM 1285 OD1 ASP A 83 24.422 4.792 -20.631 1.00 0.00 O ATOM 1286 OD2 ASP A 83 22.425 3.945 -21.165 1.00 0.00 O ATOM 0 H ASP A 83 22.555 0.841 -18.810 1.00 0.00 H new ATOM 0 HA ASP A 83 24.911 1.969 -20.060 1.00 0.00 H new ATOM 0 HB2 ASP A 83 22.377 2.883 -18.958 1.00 0.00 H new ATOM 0 HB3 ASP A 83 23.699 3.812 -18.279 1.00 0.00 H new ATOM 1292 N ARG A 84 24.512 1.753 -16.766 1.00 0.00 N ATOM 1293 CA ARG A 84 25.209 1.735 -15.492 1.00 0.00 C ATOM 1294 C ARG A 84 26.248 0.612 -15.471 1.00 0.00 C ATOM 1295 O ARG A 84 27.282 0.730 -14.815 1.00 0.00 O ATOM 1296 CB ARG A 84 24.231 1.538 -14.331 1.00 0.00 C ATOM 1297 CG ARG A 84 24.536 2.507 -13.187 1.00 0.00 C ATOM 1298 CD ARG A 84 23.254 3.158 -12.664 1.00 0.00 C ATOM 1299 NE ARG A 84 23.067 2.830 -11.233 1.00 0.00 N ATOM 1300 CZ ARG A 84 23.652 3.503 -10.220 1.00 0.00 C ATOM 1301 NH1 ARG A 84 24.467 4.548 -10.472 1.00 0.00 N ATOM 1302 NH2 ARG A 84 23.414 3.123 -8.978 1.00 0.00 N ATOM 0 H ARG A 84 23.506 1.595 -16.704 1.00 0.00 H new ATOM 0 HA ARG A 84 25.707 2.697 -15.373 1.00 0.00 H new ATOM 0 HB2 ARG A 84 23.210 1.692 -14.681 1.00 0.00 H new ATOM 0 HB3 ARG A 84 24.292 0.512 -13.969 1.00 0.00 H new ATOM 0 HG2 ARG A 84 25.034 1.974 -12.377 1.00 0.00 H new ATOM 0 HG3 ARG A 84 25.225 3.278 -13.532 1.00 0.00 H new ATOM 0 HD2 ARG A 84 23.306 4.239 -12.794 1.00 0.00 H new ATOM 0 HD3 ARG A 84 22.398 2.809 -13.241 1.00 0.00 H new ATOM 0 HE ARG A 84 22.458 2.046 -10.998 1.00 0.00 H new ATOM 0 HH11 ARG A 84 24.645 4.835 -11.434 1.00 0.00 H new ATOM 0 HH12 ARG A 84 24.905 5.051 -9.700 1.00 0.00 H new ATOM 0 HH21 ARG A 84 22.796 2.332 -8.796 1.00 0.00 H new ATOM 0 HH22 ARG A 84 23.848 3.620 -8.200 1.00 0.00 H new ATOM 1315 N LYS A 85 25.937 -0.452 -16.196 1.00 0.00 N ATOM 1316 CA LYS A 85 26.831 -1.596 -16.269 1.00 0.00 C ATOM 1317 C LYS A 85 27.851 -1.370 -17.387 1.00 0.00 C ATOM 1318 O LYS A 85 28.873 -2.052 -17.446 1.00 0.00 O ATOM 1319 CB LYS A 85 26.032 -2.892 -16.418 1.00 0.00 C ATOM 1320 CG LYS A 85 25.744 -3.192 -17.891 1.00 0.00 C ATOM 1321 CD LYS A 85 24.564 -4.155 -18.034 1.00 0.00 C ATOM 1322 CE LYS A 85 24.558 -5.187 -16.904 1.00 0.00 C ATOM 1323 NZ LYS A 85 25.788 -6.010 -16.948 1.00 0.00 N ATOM 0 H LYS A 85 25.078 -0.547 -16.738 1.00 0.00 H new ATOM 0 HA LYS A 85 27.393 -1.700 -15.341 1.00 0.00 H new ATOM 0 HB2 LYS A 85 26.588 -3.719 -15.977 1.00 0.00 H new ATOM 0 HB3 LYS A 85 25.094 -2.810 -15.870 1.00 0.00 H new ATOM 0 HG2 LYS A 85 25.526 -2.264 -18.419 1.00 0.00 H new ATOM 0 HG3 LYS A 85 26.629 -3.624 -18.358 1.00 0.00 H new ATOM 0 HD2 LYS A 85 23.629 -3.594 -18.024 1.00 0.00 H new ATOM 0 HD3 LYS A 85 24.620 -4.664 -18.996 1.00 0.00 H new ATOM 0 HE2 LYS A 85 24.486 -4.681 -15.941 1.00 0.00 H new ATOM 0 HE3 LYS A 85 23.681 -5.828 -16.993 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 25.531 -7.016 -17.008 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 26.352 -5.747 -17.781 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 26.346 -5.846 -16.086 1.00 0.00 H new ATOM 1336 N LEU A 86 27.538 -0.410 -18.245 1.00 0.00 N ATOM 1337 CA LEU A 86 28.414 -0.086 -19.357 1.00 0.00 C ATOM 1338 C LEU A 86 29.622 0.697 -18.838 1.00 0.00 C ATOM 1339 O LEU A 86 29.941 0.638 -17.652 1.00 0.00 O ATOM 1340 CB LEU A 86 27.637 0.640 -20.458 1.00 0.00 C ATOM 1341 CG LEU A 86 27.403 -0.151 -21.746 1.00 0.00 C ATOM 1342 CD1 LEU A 86 26.904 0.763 -22.867 1.00 0.00 C ATOM 1343 CD2 LEU A 86 28.660 -0.922 -22.153 1.00 0.00 C ATOM 0 H LEU A 86 26.690 0.154 -18.192 1.00 0.00 H new ATOM 0 HA LEU A 86 28.798 -0.997 -19.817 1.00 0.00 H new ATOM 0 HB2 LEU A 86 26.668 0.937 -20.056 1.00 0.00 H new ATOM 0 HB3 LEU A 86 28.172 1.556 -20.709 1.00 0.00 H new ATOM 0 HG LEU A 86 26.621 -0.887 -21.557 1.00 0.00 H new ATOM 0 HD11 LEU A 86 26.745 0.176 -23.772 1.00 0.00 H new ATOM 0 HD12 LEU A 86 25.965 1.228 -22.567 1.00 0.00 H new ATOM 0 HD13 LEU A 86 27.646 1.537 -23.062 1.00 0.00 H new ATOM 0 HD21 LEU A 86 28.466 -1.476 -23.072 1.00 0.00 H new ATOM 0 HD22 LEU A 86 29.479 -0.222 -22.317 1.00 0.00 H new ATOM 0 HD23 LEU A 86 28.932 -1.619 -21.360 1.00 0.00 H new ATOM 1355 N ASN A 87 30.260 1.413 -19.753 1.00 0.00 N ATOM 1356 CA ASN A 87 31.426 2.206 -19.402 1.00 0.00 C ATOM 1357 C ASN A 87 31.091 3.691 -19.554 1.00 0.00 C ATOM 1358 O ASN A 87 31.988 4.524 -19.675 1.00 0.00 O ATOM 1359 CB ASN A 87 32.605 1.891 -20.324 1.00 0.00 C ATOM 1360 CG ASN A 87 32.539 0.446 -20.824 1.00 0.00 C ATOM 1361 OD1 ASN A 87 31.962 0.144 -21.855 1.00 0.00 O ATOM 1362 ND2 ASN A 87 33.161 -0.427 -20.036 1.00 0.00 N ATOM 0 H ASN A 87 29.992 1.460 -20.736 1.00 0.00 H new ATOM 0 HA ASN A 87 31.699 1.967 -18.374 1.00 0.00 H new ATOM 0 HB2 ASN A 87 32.600 2.574 -21.173 1.00 0.00 H new ATOM 0 HB3 ASN A 87 33.542 2.053 -19.791 1.00 0.00 H new ATOM 0 HD21 ASN A 87 33.174 -1.417 -20.282 1.00 0.00 H new ATOM 0 HD22 ASN A 87 33.625 -0.106 -19.186 1.00 0.00 H new ATOM 1369 N GLY A 88 29.797 3.977 -19.543 1.00 0.00 N ATOM 1370 CA GLY A 88 29.333 5.347 -19.679 1.00 0.00 C ATOM 1371 C GLY A 88 28.851 5.898 -18.335 1.00 0.00 C ATOM 1372 O GLY A 88 29.002 7.087 -18.057 1.00 0.00 O ATOM 0 H GLY A 88 29.056 3.283 -19.442 1.00 0.00 H new ATOM 0 HA2 GLY A 88 30.139 5.971 -20.064 1.00 0.00 H new ATOM 0 HA3 GLY A 88 28.522 5.390 -20.406 1.00 0.00 H new ATOM 1376 N PHE A 89 28.280 5.008 -17.537 1.00 0.00 N ATOM 1377 CA PHE A 89 27.775 5.390 -16.230 1.00 0.00 C ATOM 1378 C PHE A 89 28.579 4.720 -15.114 1.00 0.00 C ATOM 1379 O PHE A 89 28.299 4.924 -13.934 1.00 0.00 O ATOM 1380 CB PHE A 89 26.323 4.912 -16.153 1.00 0.00 C ATOM 1381 CG PHE A 89 25.298 5.967 -16.577 1.00 0.00 C ATOM 1382 CD1 PHE A 89 24.838 6.870 -15.670 1.00 0.00 C ATOM 1383 CD2 PHE A 89 24.848 6.001 -17.859 1.00 0.00 C ATOM 1384 CE1 PHE A 89 23.886 7.848 -16.063 1.00 0.00 C ATOM 1385 CE2 PHE A 89 23.897 6.979 -18.252 1.00 0.00 C ATOM 1386 CZ PHE A 89 23.436 7.882 -17.346 1.00 0.00 C ATOM 0 H PHE A 89 28.156 4.023 -17.771 1.00 0.00 H new ATOM 0 HA PHE A 89 27.855 6.469 -16.102 1.00 0.00 H new ATOM 0 HB2 PHE A 89 26.207 4.032 -16.786 1.00 0.00 H new ATOM 0 HB3 PHE A 89 26.107 4.600 -15.131 1.00 0.00 H new ATOM 0 HD1 PHE A 89 25.196 6.843 -14.652 1.00 0.00 H new ATOM 0 HD2 PHE A 89 25.214 5.284 -18.579 1.00 0.00 H new ATOM 0 HE1 PHE A 89 23.519 8.565 -15.343 1.00 0.00 H new ATOM 0 HE2 PHE A 89 23.540 7.006 -19.271 1.00 0.00 H new ATOM 0 HZ PHE A 89 22.713 8.626 -17.645 1.00 0.00 H new ATOM 1396 N LEU A 90 29.562 3.934 -15.527 1.00 0.00 N ATOM 1397 CA LEU A 90 30.409 3.232 -14.577 1.00 0.00 C ATOM 1398 C LEU A 90 31.868 3.338 -15.026 1.00 0.00 C ATOM 1399 O LEU A 90 32.735 2.644 -14.498 1.00 0.00 O ATOM 1400 CB LEU A 90 29.926 1.792 -14.391 1.00 0.00 C ATOM 1401 CG LEU A 90 30.851 0.873 -13.591 1.00 0.00 C ATOM 1402 CD1 LEU A 90 30.063 0.071 -12.553 1.00 0.00 C ATOM 1403 CD2 LEU A 90 31.663 -0.032 -14.520 1.00 0.00 C ATOM 0 H LEU A 90 29.791 3.767 -16.507 1.00 0.00 H new ATOM 0 HA LEU A 90 30.343 3.696 -13.593 1.00 0.00 H new ATOM 0 HB2 LEU A 90 28.955 1.816 -13.897 1.00 0.00 H new ATOM 0 HB3 LEU A 90 29.772 1.351 -15.376 1.00 0.00 H new ATOM 0 HG LEU A 90 31.562 1.494 -13.046 1.00 0.00 H new ATOM 0 HD11 LEU A 90 30.744 -0.574 -11.998 1.00 0.00 H new ATOM 0 HD12 LEU A 90 29.569 0.755 -11.863 1.00 0.00 H new ATOM 0 HD13 LEU A 90 29.314 -0.540 -13.057 1.00 0.00 H new ATOM 0 HD21 LEU A 90 32.312 -0.675 -13.926 1.00 0.00 H new ATOM 0 HD22 LEU A 90 30.986 -0.648 -15.112 1.00 0.00 H new ATOM 0 HD23 LEU A 90 32.271 0.581 -15.186 1.00 0.00 H new ATOM 1415 N GLU A 91 32.093 4.213 -15.995 1.00 0.00 N ATOM 1416 CA GLU A 91 33.432 4.419 -16.521 1.00 0.00 C ATOM 1417 C GLU A 91 33.487 5.708 -17.344 1.00 0.00 C ATOM 1418 O GLU A 91 32.646 6.590 -17.178 1.00 0.00 O ATOM 1419 CB GLU A 91 33.886 3.218 -17.353 1.00 0.00 C ATOM 1420 CG GLU A 91 35.314 2.807 -16.989 1.00 0.00 C ATOM 1421 CD GLU A 91 36.247 2.941 -18.194 1.00 0.00 C ATOM 1422 OE1 GLU A 91 35.846 2.632 -19.326 1.00 0.00 O ATOM 1423 OE2 GLU A 91 37.427 3.385 -17.924 1.00 0.00 O ATOM 0 H GLU A 91 31.371 4.787 -16.430 1.00 0.00 H new ATOM 0 HA GLU A 91 34.119 4.518 -15.681 1.00 0.00 H new ATOM 0 HB2 GLU A 91 33.209 2.380 -17.188 1.00 0.00 H new ATOM 0 HB3 GLU A 91 33.834 3.465 -18.413 1.00 0.00 H new ATOM 0 HG2 GLU A 91 35.678 3.429 -16.172 1.00 0.00 H new ATOM 0 HG3 GLU A 91 35.320 1.777 -16.633 1.00 0.00 H new ATOM 1431 N HIS A 92 34.485 5.775 -18.213 1.00 0.00 N ATOM 1432 CA HIS A 92 34.660 6.941 -19.061 1.00 0.00 C ATOM 1433 C HIS A 92 35.472 8.002 -18.315 1.00 0.00 C ATOM 1434 O HIS A 92 35.844 7.805 -17.160 1.00 0.00 O ATOM 1435 CB HIS A 92 33.309 7.465 -19.551 1.00 0.00 C ATOM 1436 CG HIS A 92 33.339 8.025 -20.953 1.00 0.00 C ATOM 1437 ND1 HIS A 92 33.188 7.235 -22.079 1.00 0.00 N ATOM 1438 CD2 HIS A 92 33.502 9.304 -21.399 1.00 0.00 C ATOM 1439 CE1 HIS A 92 33.260 8.014 -23.149 1.00 0.00 C ATOM 1440 NE2 HIS A 92 33.455 9.295 -22.725 1.00 0.00 N ATOM 0 H HIS A 92 35.180 5.041 -18.348 1.00 0.00 H new ATOM 0 HA HIS A 92 35.222 6.664 -19.953 1.00 0.00 H new ATOM 0 HB2 HIS A 92 32.580 6.655 -19.510 1.00 0.00 H new ATOM 0 HB3 HIS A 92 32.963 8.241 -18.868 1.00 0.00 H new ATOM 0 HD2 HIS A 92 33.645 10.176 -20.778 1.00 0.00 H new ATOM 0 HE1 HIS A 92 33.179 7.691 -24.176 1.00 0.00 H new ATOM 0 HE2 HIS A 92 33.549 10.112 -23.328 1.00 0.00 H new ATOM 1448 N HIS A 93 35.723 9.104 -19.007 1.00 0.00 N ATOM 1449 CA HIS A 93 36.484 10.196 -18.424 1.00 0.00 C ATOM 1450 C HIS A 93 35.633 10.911 -17.372 1.00 0.00 C ATOM 1451 O HIS A 93 36.117 11.226 -16.286 1.00 0.00 O ATOM 1452 CB HIS A 93 36.998 11.141 -19.512 1.00 0.00 C ATOM 1453 CG HIS A 93 38.454 11.513 -19.364 1.00 0.00 C ATOM 1454 ND1 HIS A 93 38.869 12.716 -18.820 1.00 0.00 N ATOM 1455 CD2 HIS A 93 39.587 10.828 -19.694 1.00 0.00 C ATOM 1456 CE1 HIS A 93 40.194 12.744 -18.827 1.00 0.00 C ATOM 1457 NE2 HIS A 93 40.637 11.573 -19.370 1.00 0.00 N ATOM 0 H HIS A 93 35.413 9.264 -19.965 1.00 0.00 H new ATOM 0 HA HIS A 93 37.366 9.801 -17.920 1.00 0.00 H new ATOM 0 HB2 HIS A 93 36.850 10.673 -20.485 1.00 0.00 H new ATOM 0 HB3 HIS A 93 36.398 12.051 -19.502 1.00 0.00 H new ATOM 0 HD2 HIS A 93 39.623 9.846 -20.143 1.00 0.00 H new ATOM 0 HE1 HIS A 93 40.814 13.551 -18.466 1.00 0.00 H new ATOM 0 HE2 HIS A 93 41.614 11.313 -19.505 1.00 0.00 H new ATOM 1465 N HIS A 94 34.379 11.145 -17.731 1.00 0.00 N ATOM 1466 CA HIS A 94 33.457 11.816 -16.832 1.00 0.00 C ATOM 1467 C HIS A 94 32.207 12.244 -17.604 1.00 0.00 C ATOM 1468 O HIS A 94 31.141 11.652 -17.445 1.00 0.00 O ATOM 1469 CB HIS A 94 34.143 12.985 -16.121 1.00 0.00 C ATOM 1470 CG HIS A 94 34.445 12.726 -14.665 1.00 0.00 C ATOM 1471 ND1 HIS A 94 34.735 13.739 -13.767 1.00 0.00 N ATOM 1472 CD2 HIS A 94 34.498 11.559 -13.959 1.00 0.00 C ATOM 1473 CE1 HIS A 94 34.952 13.195 -12.579 1.00 0.00 C ATOM 1474 NE2 HIS A 94 34.805 11.845 -12.700 1.00 0.00 N ATOM 0 H HIS A 94 33.981 10.882 -18.632 1.00 0.00 H new ATOM 0 HA HIS A 94 33.141 11.126 -16.050 1.00 0.00 H new ATOM 0 HB2 HIS A 94 35.074 13.216 -16.639 1.00 0.00 H new ATOM 0 HB3 HIS A 94 33.508 13.867 -16.198 1.00 0.00 H new ATOM 0 HD2 HIS A 94 34.320 10.571 -14.357 1.00 0.00 H new ATOM 0 HE1 HIS A 94 35.202 13.728 -11.673 1.00 0.00 H new ATOM 0 HE2 HIS A 94 34.913 11.166 -11.946 1.00 0.00 H new ATOM 1482 N HIS A 95 32.380 13.270 -18.425 1.00 0.00 N ATOM 1483 CA HIS A 95 31.280 13.784 -19.223 1.00 0.00 C ATOM 1484 C HIS A 95 31.792 14.883 -20.156 1.00 0.00 C ATOM 1485 O HIS A 95 32.889 15.405 -19.963 1.00 0.00 O ATOM 1486 CB HIS A 95 30.132 14.254 -18.327 1.00 0.00 C ATOM 1487 CG HIS A 95 28.991 14.897 -19.077 1.00 0.00 C ATOM 1488 ND1 HIS A 95 27.929 14.173 -19.591 1.00 0.00 N ATOM 1489 CD2 HIS A 95 28.756 16.202 -19.395 1.00 0.00 C ATOM 1490 CE1 HIS A 95 27.099 15.014 -20.189 1.00 0.00 C ATOM 1491 NE2 HIS A 95 27.613 16.272 -20.067 1.00 0.00 N ATOM 0 H HIS A 95 33.266 13.759 -18.555 1.00 0.00 H new ATOM 0 HA HIS A 95 30.875 12.987 -19.846 1.00 0.00 H new ATOM 0 HB2 HIS A 95 29.750 13.401 -17.766 1.00 0.00 H new ATOM 0 HB3 HIS A 95 30.521 14.965 -17.599 1.00 0.00 H new ATOM 0 HD2 HIS A 95 29.392 17.038 -19.143 1.00 0.00 H new ATOM 0 HE1 HIS A 95 26.177 14.750 -20.686 1.00 0.00 H new ATOM 0 HE2 HIS A 95 27.189 17.125 -20.432 1.00 0.00 H new ATOM 1499 N HIS A 96 30.973 15.201 -21.148 1.00 0.00 N ATOM 1500 CA HIS A 96 31.330 16.229 -22.112 1.00 0.00 C ATOM 1501 C HIS A 96 30.954 17.604 -21.558 1.00 0.00 C ATOM 1502 O HIS A 96 29.785 17.867 -21.278 1.00 0.00 O ATOM 1503 CB HIS A 96 30.691 15.942 -23.472 1.00 0.00 C ATOM 1504 CG HIS A 96 29.194 15.749 -23.420 1.00 0.00 C ATOM 1505 ND1 HIS A 96 28.590 14.518 -23.612 1.00 0.00 N ATOM 1506 CD2 HIS A 96 28.188 16.641 -23.193 1.00 0.00 C ATOM 1507 CE1 HIS A 96 27.279 14.675 -23.506 1.00 0.00 C ATOM 1508 NE2 HIS A 96 27.032 15.991 -23.246 1.00 0.00 N ATOM 0 H HIS A 96 30.064 14.766 -21.305 1.00 0.00 H new ATOM 0 HA HIS A 96 32.408 16.224 -22.274 1.00 0.00 H new ATOM 0 HB2 HIS A 96 30.917 16.766 -24.149 1.00 0.00 H new ATOM 0 HB3 HIS A 96 31.148 15.047 -23.895 1.00 0.00 H new ATOM 0 HD2 HIS A 96 28.311 17.697 -23.002 1.00 0.00 H new ATOM 0 HE1 HIS A 96 26.536 13.898 -23.608 1.00 0.00 H new ATOM 0 HE2 HIS A 96 26.110 16.407 -23.114 1.00 0.00 H new ATOM 1516 N HIS A 97 31.967 18.447 -21.417 1.00 0.00 N ATOM 1517 CA HIS A 97 31.757 19.789 -20.902 1.00 0.00 C ATOM 1518 C HIS A 97 30.516 20.401 -21.554 1.00 0.00 C ATOM 1519 O HIS A 97 30.041 19.909 -22.577 1.00 0.00 O ATOM 1520 CB HIS A 97 33.011 20.646 -21.091 1.00 0.00 C ATOM 1521 CG HIS A 97 33.118 21.284 -22.456 1.00 0.00 C ATOM 1522 ND1 HIS A 97 33.206 22.653 -22.639 1.00 0.00 N ATOM 1523 CD2 HIS A 97 33.151 20.726 -23.700 1.00 0.00 C ATOM 1524 CE1 HIS A 97 33.287 22.897 -23.938 1.00 0.00 C ATOM 1525 NE2 HIS A 97 33.252 21.701 -24.595 1.00 0.00 N ATOM 0 H HIS A 97 32.935 18.226 -21.651 1.00 0.00 H new ATOM 0 HA HIS A 97 31.576 19.746 -19.828 1.00 0.00 H new ATOM 0 HB2 HIS A 97 33.021 21.429 -20.333 1.00 0.00 H new ATOM 0 HB3 HIS A 97 33.891 20.026 -20.921 1.00 0.00 H new ATOM 0 HD2 HIS A 97 33.103 19.670 -23.920 1.00 0.00 H new ATOM 0 HE1 HIS A 97 33.367 23.871 -24.397 1.00 0.00 H new ATOM 0 HE2 HIS A 97 33.296 21.577 -25.606 1.00 0.00 H new TER 1533 HIS A 97