USER MOD reduce.3.24.130724 H: found=0, std=0, add=1751, rem=0, adj=77 USER MOD reduce.3.24.130724 removed 1751 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 173 THR OG1 : rot 100:sc= -0.171 USER MOD Set 1.2: A 188 MET CE :methyl -115:sc= -5.26! (180deg=-7.88!) USER MOD Set 2.1: A 17 TYR OH : rot 130:sc= 0.0991 USER MOD Set 2.2: A 172 GLN : amide:sc= -5.19! C(o=-5.1!,f=-9.4!) USER MOD Set 3.1: A 158 MET CE :methyl 160:sc= 0 (180deg=-0.288) USER MOD Set 3.2: A 166 LYS NZ :NH3+ -153:sc= 0.706 (180deg=0.212) USER MOD Set 4.1: A 18 ASN :FLIP amide:sc= -0.859 F(o=-3.1,f=-1.7) USER MOD Set 4.2: A 156 SER OG : rot 175:sc= -0.816 USER MOD Set 5.1: A 95 HIS :FLIP no HD1:sc= -2.01 F(o=-2.5!,f=-1.1) USER MOD Set 5.2: A 137 TYR OH : rot 157:sc= 0.89 USER MOD Set 6.1: A 118 LYS NZ :NH3+ -172:sc= 0.949 (180deg=0.0147) USER MOD Set 6.2: A 120 TYR OH : rot 180:sc= 0.739 USER MOD Set 7.1: A 67 GLN : amide:sc= 0.683 X(o=0.13,f=0.53) USER MOD Set 7.2: A 83 MET CE :methyl -148:sc= -0.553 (180deg=-0.864) USER MOD Set 8.1: A 81 TYR OH : rot 130:sc= -1.54! USER MOD Set 8.2: A 94 CYS SG : rot -72:sc= -2.85! USER MOD Set 9.1: A 77 SER OG : rot -119:sc= 0.159 USER MOD Set 9.2: A 194 ASN : amide:sc= -0.491 K(o=-0.33,f=-2.9!) USER MOD Set10.1: A 37 SER OG : rot 102:sc= 0.959 USER MOD Set10.2: A 48 TYR OH : rot 180:sc= 0 USER MOD Set11.1: A 22 SER OG : rot -160:sc= 0.975 USER MOD Set11.2: A 38 LYS NZ :NH3+ -133:sc= 1.17 (180deg=0) USER MOD Set12.1: A 4 LYS NZ :NH3+ 177:sc= 1.23 (180deg=0) USER MOD Set12.2: A 8 GLN : amide:sc= -0.569! C(o=1.5!,f=-6.4!) USER MOD Set12.3: A 116 TYR OH : rot 71:sc= 0.862 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -118:sc= 0.14 (180deg=0) USER MOD Single : A 9 GLN : amide:sc= -0.334 K(o=-0.33,f=-1.1) USER MOD Single : A 10 THR OG1 : rot 26:sc= -1.45! USER MOD Single : A 12 GLN :FLIP amide:sc= -0.015 F(o=-1.1,f=-0.015) USER MOD Single : A 21 THR OG1 : rot 39:sc= 0.121 USER MOD Single : A 25 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.041) USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 THR OG1 : rot 180:sc= 0 USER MOD Single : A 30 SER OG : rot -131:sc= 0.301 USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 THR OG1 : rot 180:sc= -0.0058 USER MOD Single : A 36 SER OG : rot 71:sc= 0.715 USER MOD Single : A 40 SER OG : rot -98:sc= 0.881 USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 HIS : no HE2:sc= 1.19 K(o=1.2,f=-4.7!) USER MOD Single : A 46 ASN : amide:sc= 0.284 X(o=0.28,f=0) USER MOD Single : A 57 SER OG : rot -71:sc= 0.613 USER MOD Single : A 60 LYS NZ :NH3+ -179:sc= 0.625 (180deg=0.597) USER MOD Single : A 62 SER OG : rot 14:sc= 1.05 USER MOD Single : A 66 TYR OH : rot 180:sc= 0 USER MOD Single : A 68 THR OG1 : rot -51:sc= 0.259 USER MOD Single : A 73 THR OG1 : rot -69:sc= 0.0629 USER MOD Single : A 76 LYS NZ :NH3+ -174:sc= 1.26 (180deg=1.11) USER MOD Single : A 79 GLN : amide:sc= -1.76 X(o=-1.8,f=-1.8!) USER MOD Single : A 82 ASN :FLIP amide:sc= -0.0843 F(o=-1.7!,f=-0.084) USER MOD Single : A 85 HIS : no HE2:sc= 1.27 K(o=1.3,f=-4.6!) USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 91 THR OG1 : rot 135:sc= 0.898 USER MOD Single : A 96 THR OG1 : rot 180:sc= -0.689 USER MOD Single : A 98 THR OG1 : rot -110:sc= 0.855 USER MOD Single : A 99 GLN : amide:sc= 1.14 K(o=1.1,f=-0.036) USER MOD Single : A 100 SER OG : rot 160:sc= -0.692 USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 123 ASN :FLIP amide:sc= 0 F(o=-2.2!,f=0) USER MOD Single : A 124 MET CE :methyl -134:sc= -3.36! (180deg=-3.78!) USER MOD Single : A 125 ASN : amide:sc= 0.376 K(o=0.38,f=-0.32) USER MOD Single : A 128 SER OG : rot -90:sc= -0.789 USER MOD Single : A 129 SER OG : rot 180:sc= -0.274 USER MOD Single : A 130 LYS NZ :NH3+ -135:sc= -0.363 (180deg=-1.9!) USER MOD Single : A 131 SER OG : rot 41:sc= -0.2 USER MOD Single : A 140 SER OG : rot 180:sc= 0.431 USER MOD Single : A 141 SER OG : rot 180:sc= 0 USER MOD Single : A 142 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 143 TYR OH : rot 180:sc= 0 USER MOD Single : A 147 TYR OH : rot 180:sc= 0 USER MOD Single : A 148 ASN : amide:sc= 0.81 K(o=0.81,f=-3!) USER MOD Single : A 149 HIS : no HD1:sc= -0.728 K(o=-0.73,f=-7!) USER MOD Single : A 151 CYS SG : rot -9:sc= -2.62! USER MOD Single : A 155 CYS SG : rot 160:sc= -0.532 USER MOD Single : A 161 ASN :FLIP amide:sc= -4.58! C(o=-6.8!,f=-4.6!) USER MOD Single : A 164 TYR OH : rot 180:sc= 0 USER MOD Single : A 165 SER OG : rot -78:sc= -1.7 USER MOD Single : A 169 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 175 MET CE :methyl 180:sc= -0.892 (180deg=-0.892) USER MOD Single : A 178 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 180 SER OG : rot 180:sc= 0 USER MOD Single : A 182 SER OG : rot 45:sc= 0.151 USER MOD Single : A 186 LYS NZ :NH3+ -119:sc= -0.86! (180deg=-3.6!) USER MOD Single : A 187 THR OG1 : rot 180:sc= -0.184 USER MOD Single : A 190 SER OG : rot 180:sc= 0 USER MOD Single : A 191 ASN :FLIP amide:sc= -0.353 F(o=-0.9!,f=-0.35) USER MOD Single : A 198 ASN : amide:sc= -4.87! C(o=-4.9!,f=-9.2!) USER MOD Single : A 200 LYS NZ :NH3+ 150:sc= -0.268 (180deg=-1.06!) USER MOD Single : A 204 LYS NZ :NH3+ -126:sc= 0.293 (180deg=0.186) USER MOD Single : A 206 HIS : no HE2:sc= -1.28! C(o=-1.3!,f=-5.8!) USER MOD Single : A 208 THR OG1 : rot 180:sc= 0 USER MOD Single : A 210 SER OG : rot 180:sc= 0 USER MOD Single : A 215 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 216 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 217 ASN : amide:sc= -2.34! C(o=-2.3!,f=-4.6!) USER MOD Single : A 218 SER OG : rot 180:sc= -0.037 USER MOD Single : A 219 HIS : no HE2:sc= 0.374 K(o=0.37,f=-2.9!) USER MOD Single : A 220 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -4.871 -6.089 -21.407 1.00 1.81 N ATOM 2 CA MET A 1 -6.227 -6.509 -20.990 1.00 1.25 C ATOM 3 C MET A 1 -6.919 -5.364 -20.245 1.00 1.04 C ATOM 4 O MET A 1 -6.286 -4.348 -19.963 1.00 1.62 O ATOM 5 CB MET A 1 -6.129 -7.775 -20.126 1.00 1.61 C ATOM 6 CG MET A 1 -7.468 -8.386 -19.734 1.00 2.19 C ATOM 7 SD MET A 1 -8.482 -8.831 -21.156 1.00 2.82 S ATOM 8 CE MET A 1 -9.945 -9.474 -20.343 1.00 3.86 C ATOM 0 H1 MET A 1 -4.805 -6.110 -22.445 1.00 1.81 H new ATOM 0 H2 MET A 1 -4.687 -5.123 -21.068 1.00 1.81 H new ATOM 0 H3 MET A 1 -4.167 -6.738 -21.002 1.00 1.81 H new ATOM 0 HA MET A 1 -6.831 -6.746 -21.866 1.00 1.25 H new ATOM 0 HB2 MET A 1 -5.549 -8.523 -20.667 1.00 1.61 H new ATOM 0 HB3 MET A 1 -5.575 -7.536 -19.218 1.00 1.61 H new ATOM 0 HG2 MET A 1 -7.292 -9.275 -19.128 1.00 2.19 H new ATOM 0 HG3 MET A 1 -8.016 -7.679 -19.111 1.00 2.19 H new ATOM 0 HE1 MET A 1 -10.669 -9.792 -21.094 1.00 3.86 H new ATOM 0 HE2 MET A 1 -9.671 -10.326 -19.720 1.00 3.86 H new ATOM 0 HE3 MET A 1 -10.386 -8.696 -19.720 1.00 3.86 H new ATOM 20 N ASP A 2 -8.206 -5.535 -19.921 1.00 0.84 N ATOM 21 CA ASP A 2 -9.046 -4.473 -19.373 1.00 0.67 C ATOM 22 C ASP A 2 -8.401 -3.771 -18.199 1.00 0.52 C ATOM 23 O ASP A 2 -8.401 -2.551 -18.132 1.00 0.53 O ATOM 24 CB ASP A 2 -10.399 -5.039 -18.929 1.00 0.98 C ATOM 25 CG ASP A 2 -11.274 -5.486 -20.084 1.00 1.50 C ATOM 26 OD1 ASP A 2 -10.760 -6.169 -20.995 1.00 2.25 O ATOM 27 OD2 ASP A 2 -12.471 -5.135 -20.102 1.00 1.72 O ATOM 0 H ASP A 2 -8.694 -6.423 -20.034 1.00 0.84 H new ATOM 0 HA ASP A 2 -9.183 -3.743 -20.171 1.00 0.67 H new ATOM 0 HB2 ASP A 2 -10.229 -5.885 -18.263 1.00 0.98 H new ATOM 0 HB3 ASP A 2 -10.930 -4.281 -18.353 1.00 0.98 H new ATOM 32 N PHE A 3 -7.812 -4.531 -17.296 1.00 0.43 N ATOM 33 CA PHE A 3 -7.314 -3.976 -16.059 1.00 0.34 C ATOM 34 C PHE A 3 -6.125 -3.077 -16.340 1.00 0.37 C ATOM 35 O PHE A 3 -5.890 -2.105 -15.639 1.00 0.40 O ATOM 36 CB PHE A 3 -6.940 -5.088 -15.091 1.00 0.30 C ATOM 37 CG PHE A 3 -8.111 -5.912 -14.620 1.00 0.29 C ATOM 38 CD1 PHE A 3 -8.836 -5.523 -13.509 1.00 0.28 C ATOM 39 CD2 PHE A 3 -8.467 -7.083 -15.269 1.00 0.30 C ATOM 40 CE1 PHE A 3 -9.891 -6.280 -13.047 1.00 0.29 C ATOM 41 CE2 PHE A 3 -9.524 -7.846 -14.815 1.00 0.31 C ATOM 42 CZ PHE A 3 -10.235 -7.445 -13.702 1.00 0.29 C ATOM 0 H PHE A 3 -7.668 -5.536 -17.399 1.00 0.43 H new ATOM 0 HA PHE A 3 -8.098 -3.378 -15.595 1.00 0.34 H new ATOM 0 HB2 PHE A 3 -6.216 -5.746 -15.572 1.00 0.30 H new ATOM 0 HB3 PHE A 3 -6.445 -4.650 -14.224 1.00 0.30 H new ATOM 0 HD1 PHE A 3 -8.571 -4.611 -12.995 1.00 0.28 H new ATOM 0 HD2 PHE A 3 -7.912 -7.402 -16.139 1.00 0.30 H new ATOM 0 HE1 PHE A 3 -10.446 -5.963 -12.176 1.00 0.29 H new ATOM 0 HE2 PHE A 3 -9.794 -8.756 -15.330 1.00 0.31 H new ATOM 0 HZ PHE A 3 -11.060 -8.043 -13.344 1.00 0.29 H new ATOM 52 N LYS A 4 -5.423 -3.381 -17.416 1.00 0.40 N ATOM 53 CA LYS A 4 -4.301 -2.591 -17.858 1.00 0.47 C ATOM 54 C LYS A 4 -4.800 -1.324 -18.529 1.00 0.54 C ATOM 55 O LYS A 4 -4.029 -0.519 -19.020 1.00 0.95 O ATOM 56 CB LYS A 4 -3.443 -3.370 -18.848 1.00 0.54 C ATOM 57 CG LYS A 4 -1.949 -3.148 -18.661 1.00 0.68 C ATOM 58 CD LYS A 4 -1.126 -4.090 -19.524 1.00 0.83 C ATOM 59 CE LYS A 4 0.371 -3.889 -19.331 1.00 1.10 C ATOM 60 NZ LYS A 4 0.885 -2.710 -20.078 1.00 1.51 N ATOM 0 H LYS A 4 -5.620 -4.188 -18.007 1.00 0.40 H new ATOM 0 HA LYS A 4 -3.697 -2.342 -16.986 1.00 0.47 H new ATOM 0 HB2 LYS A 4 -3.660 -4.433 -18.747 1.00 0.54 H new ATOM 0 HB3 LYS A 4 -3.721 -3.083 -19.862 1.00 0.54 H new ATOM 0 HG2 LYS A 4 -1.701 -2.116 -18.910 1.00 0.68 H new ATOM 0 HG3 LYS A 4 -1.688 -3.294 -17.613 1.00 0.68 H new ATOM 0 HD2 LYS A 4 -1.386 -5.121 -19.283 1.00 0.83 H new ATOM 0 HD3 LYS A 4 -1.379 -3.934 -20.573 1.00 0.83 H new ATOM 0 HE2 LYS A 4 0.584 -3.764 -18.269 1.00 1.10 H new ATOM 0 HE3 LYS A 4 0.900 -4.783 -19.660 1.00 1.10 H new ATOM 0 HZ1 LYS A 4 1.897 -2.585 -19.875 1.00 1.51 H new ATOM 0 HZ2 LYS A 4 0.753 -2.861 -21.098 1.00 1.51 H new ATOM 0 HZ3 LYS A 4 0.365 -1.859 -19.784 1.00 1.51 H new ATOM 74 N ALA A 5 -6.097 -1.200 -18.631 1.00 0.45 N ATOM 75 CA ALA A 5 -6.699 0.036 -19.062 1.00 0.47 C ATOM 76 C ALA A 5 -7.048 0.894 -17.853 1.00 0.42 C ATOM 77 O ALA A 5 -6.755 2.083 -17.808 1.00 0.42 O ATOM 78 CB ALA A 5 -7.917 -0.253 -19.913 1.00 0.54 C ATOM 0 H ALA A 5 -6.761 -1.945 -18.420 1.00 0.45 H new ATOM 0 HA ALA A 5 -5.990 0.595 -19.673 1.00 0.47 H new ATOM 0 HB1 ALA A 5 -8.367 0.686 -20.235 1.00 0.54 H new ATOM 0 HB2 ALA A 5 -7.621 -0.832 -20.788 1.00 0.54 H new ATOM 0 HB3 ALA A 5 -8.642 -0.821 -19.330 1.00 0.54 H new ATOM 84 N ILE A 6 -7.609 0.254 -16.836 1.00 0.42 N ATOM 85 CA ILE A 6 -8.162 0.975 -15.696 1.00 0.43 C ATOM 86 C ILE A 6 -7.043 1.340 -14.740 1.00 0.37 C ATOM 87 O ILE A 6 -6.965 2.453 -14.222 1.00 0.38 O ATOM 88 CB ILE A 6 -9.210 0.137 -14.926 1.00 0.53 C ATOM 89 CG1 ILE A 6 -10.151 -0.601 -15.881 1.00 0.91 C ATOM 90 CG2 ILE A 6 -10.012 1.032 -13.998 1.00 1.07 C ATOM 91 CD1 ILE A 6 -10.038 -2.110 -15.787 1.00 0.65 C ATOM 0 H ILE A 6 -7.693 -0.761 -16.776 1.00 0.42 H new ATOM 0 HA ILE A 6 -8.655 1.866 -16.084 1.00 0.43 H new ATOM 0 HB ILE A 6 -8.675 -0.609 -14.339 1.00 0.53 H new ATOM 0 HG12 ILE A 6 -11.178 -0.307 -15.667 1.00 0.91 H new ATOM 0 HG13 ILE A 6 -9.936 -0.290 -16.904 1.00 0.91 H new ATOM 0 HG21 ILE A 6 -10.747 0.433 -13.460 1.00 1.07 H new ATOM 0 HG22 ILE A 6 -9.341 1.510 -13.284 1.00 1.07 H new ATOM 0 HG23 ILE A 6 -10.524 1.796 -14.582 1.00 1.07 H new ATOM 0 HD11 ILE A 6 -10.732 -2.571 -16.490 1.00 0.65 H new ATOM 0 HD12 ILE A 6 -9.020 -2.414 -16.029 1.00 0.65 H new ATOM 0 HD13 ILE A 6 -10.281 -2.431 -14.774 1.00 0.65 H new ATOM 103 N ALA A 7 -6.172 0.374 -14.538 1.00 0.33 N ATOM 104 CA ALA A 7 -5.065 0.486 -13.614 1.00 0.31 C ATOM 105 C ALA A 7 -3.955 1.340 -14.178 1.00 0.30 C ATOM 106 O ALA A 7 -3.292 2.067 -13.461 1.00 0.32 O ATOM 107 CB ALA A 7 -4.524 -0.879 -13.362 1.00 0.34 C ATOM 0 H ALA A 7 -6.214 -0.525 -15.019 1.00 0.33 H new ATOM 0 HA ALA A 7 -5.427 0.951 -12.697 1.00 0.31 H new ATOM 0 HB1 ALA A 7 -3.687 -0.816 -12.667 1.00 0.34 H new ATOM 0 HB2 ALA A 7 -5.305 -1.507 -12.934 1.00 0.34 H new ATOM 0 HB3 ALA A 7 -4.183 -1.314 -14.301 1.00 0.34 H new ATOM 113 N GLN A 8 -3.740 1.208 -15.467 1.00 0.31 N ATOM 114 CA GLN A 8 -2.717 1.973 -16.153 1.00 0.34 C ATOM 115 C GLN A 8 -3.071 3.434 -16.138 1.00 0.35 C ATOM 116 O GLN A 8 -2.200 4.302 -16.121 1.00 0.39 O ATOM 117 CB GLN A 8 -2.550 1.483 -17.580 1.00 0.38 C ATOM 118 CG GLN A 8 -1.627 0.300 -17.681 1.00 0.96 C ATOM 119 CD GLN A 8 -0.973 0.190 -19.044 1.00 1.04 C ATOM 120 OE1 GLN A 8 0.142 -0.308 -19.168 1.00 1.59 O ATOM 121 NE2 GLN A 8 -1.662 0.651 -20.075 1.00 1.50 N ATOM 0 H GLN A 8 -4.264 0.572 -16.069 1.00 0.31 H new ATOM 0 HA GLN A 8 -1.770 1.835 -15.632 1.00 0.34 H new ATOM 0 HB2 GLN A 8 -3.526 1.213 -17.984 1.00 0.38 H new ATOM 0 HB3 GLN A 8 -2.163 2.295 -18.196 1.00 0.38 H new ATOM 0 HG2 GLN A 8 -0.855 0.379 -16.916 1.00 0.96 H new ATOM 0 HG3 GLN A 8 -2.187 -0.612 -17.475 1.00 0.96 H new ATOM 0 HE21 GLN A 8 -2.586 1.058 -19.930 1.00 1.50 H new ATOM 0 HE22 GLN A 8 -1.269 0.600 -21.015 1.00 1.50 H new ATOM 130 N GLN A 9 -4.359 3.694 -16.117 1.00 0.36 N ATOM 131 CA GLN A 9 -4.832 5.062 -15.972 1.00 0.40 C ATOM 132 C GLN A 9 -4.706 5.463 -14.514 1.00 0.38 C ATOM 133 O GLN A 9 -4.308 6.579 -14.189 1.00 0.45 O ATOM 134 CB GLN A 9 -6.278 5.220 -16.445 1.00 0.48 C ATOM 135 CG GLN A 9 -6.468 4.982 -17.934 1.00 0.74 C ATOM 136 CD GLN A 9 -5.596 5.874 -18.796 1.00 1.65 C ATOM 137 OE1 GLN A 9 -5.246 6.991 -18.411 1.00 2.47 O ATOM 138 NE2 GLN A 9 -5.257 5.396 -19.982 1.00 2.31 N ATOM 0 H GLN A 9 -5.093 2.990 -16.197 1.00 0.36 H new ATOM 0 HA GLN A 9 -4.222 5.712 -16.599 1.00 0.40 H new ATOM 0 HB2 GLN A 9 -6.909 4.524 -15.892 1.00 0.48 H new ATOM 0 HB3 GLN A 9 -6.622 6.225 -16.201 1.00 0.48 H new ATOM 0 HG2 GLN A 9 -6.246 3.939 -18.160 1.00 0.74 H new ATOM 0 HG3 GLN A 9 -7.514 5.148 -18.192 1.00 0.74 H new ATOM 0 HE21 GLN A 9 -5.567 4.466 -20.265 1.00 2.31 H new ATOM 0 HE22 GLN A 9 -4.686 5.957 -20.614 1.00 2.31 H new ATOM 147 N THR A 10 -5.011 4.504 -13.651 1.00 0.34 N ATOM 148 CA THR A 10 -4.959 4.693 -12.215 1.00 0.34 C ATOM 149 C THR A 10 -3.531 4.936 -11.721 1.00 0.30 C ATOM 150 O THR A 10 -3.325 5.704 -10.780 1.00 0.30 O ATOM 151 CB THR A 10 -5.598 3.487 -11.497 1.00 0.37 C ATOM 152 OG1 THR A 10 -6.758 3.916 -10.779 1.00 0.48 O ATOM 153 CG2 THR A 10 -4.621 2.784 -10.557 1.00 0.34 C ATOM 0 H THR A 10 -5.303 3.568 -13.933 1.00 0.34 H new ATOM 0 HA THR A 10 -5.533 5.588 -11.975 1.00 0.34 H new ATOM 0 HB THR A 10 -5.882 2.761 -12.259 1.00 0.37 H new ATOM 0 HG1 THR A 10 -7.130 4.716 -11.206 1.00 0.48 H new ATOM 0 HG21 THR A 10 -5.120 1.942 -10.077 1.00 0.34 H new ATOM 0 HG22 THR A 10 -3.765 2.421 -11.126 1.00 0.34 H new ATOM 0 HG23 THR A 10 -4.279 3.486 -9.796 1.00 0.34 H new ATOM 161 N ALA A 11 -2.552 4.263 -12.332 1.00 0.29 N ATOM 162 CA ALA A 11 -1.147 4.551 -12.045 1.00 0.28 C ATOM 163 C ALA A 11 -0.880 6.048 -12.057 1.00 0.30 C ATOM 164 O ALA A 11 -0.447 6.625 -11.063 1.00 0.31 O ATOM 165 CB ALA A 11 -0.245 3.870 -13.053 1.00 0.31 C ATOM 0 H ALA A 11 -2.704 3.525 -13.019 1.00 0.29 H new ATOM 0 HA ALA A 11 -0.930 4.164 -11.049 1.00 0.28 H new ATOM 0 HB1 ALA A 11 0.796 4.097 -12.822 1.00 0.31 H new ATOM 0 HB2 ALA A 11 -0.400 2.792 -13.010 1.00 0.31 H new ATOM 0 HB3 ALA A 11 -0.481 4.230 -14.054 1.00 0.31 H new ATOM 171 N GLN A 12 -1.148 6.664 -13.194 1.00 0.35 N ATOM 172 CA GLN A 12 -0.960 8.084 -13.372 1.00 0.40 C ATOM 173 C GLN A 12 -1.920 8.902 -12.510 1.00 0.40 C ATOM 174 O GLN A 12 -1.713 10.096 -12.315 1.00 0.45 O ATOM 175 CB GLN A 12 -1.159 8.437 -14.836 1.00 0.48 C ATOM 176 CG GLN A 12 -0.455 9.709 -15.219 1.00 0.98 C ATOM 177 CD GLN A 12 -0.704 10.119 -16.655 1.00 0.97 C ATOM 178 OE1 GLN A 12 -1.871 9.780 -17.179 1.00 1.30 O flip ATOM 179 NE2 GLN A 12 0.145 10.737 -17.289 1.00 1.64 N flip ATOM 0 H GLN A 12 -1.504 6.186 -14.022 1.00 0.35 H new ATOM 0 HA GLN A 12 0.054 8.330 -13.057 1.00 0.40 H new ATOM 0 HB2 GLN A 12 -0.791 7.620 -15.457 1.00 0.48 H new ATOM 0 HB3 GLN A 12 -2.225 8.539 -15.041 1.00 0.48 H new ATOM 0 HG2 GLN A 12 -0.782 10.511 -14.557 1.00 0.98 H new ATOM 0 HG3 GLN A 12 0.617 9.584 -15.064 1.00 0.98 H new ATOM 0 HE21 GLN A 12 1.033 10.980 -16.850 1.00 1.64 H new ATOM 0 HE22 GLN A 12 -0.037 11.008 -18.255 1.00 1.64 H new ATOM 188 N GLU A 13 -2.972 8.272 -12.011 1.00 0.38 N ATOM 189 CA GLU A 13 -3.890 8.952 -11.099 1.00 0.39 C ATOM 190 C GLU A 13 -3.235 9.121 -9.736 1.00 0.37 C ATOM 191 O GLU A 13 -3.155 10.228 -9.204 1.00 0.42 O ATOM 192 CB GLU A 13 -5.212 8.190 -10.939 1.00 0.43 C ATOM 193 CG GLU A 13 -6.032 8.100 -12.213 1.00 1.10 C ATOM 194 CD GLU A 13 -7.411 7.513 -11.983 1.00 1.65 C ATOM 195 OE1 GLU A 13 -7.553 6.272 -12.022 1.00 2.54 O ATOM 196 OE2 GLU A 13 -8.364 8.299 -11.778 1.00 1.64 O ATOM 0 H GLU A 13 -3.213 7.302 -12.216 1.00 0.38 H new ATOM 0 HA GLU A 13 -4.116 9.927 -11.530 1.00 0.39 H new ATOM 0 HB2 GLU A 13 -4.997 7.181 -10.585 1.00 0.43 H new ATOM 0 HB3 GLU A 13 -5.809 8.678 -10.169 1.00 0.43 H new ATOM 0 HG2 GLU A 13 -6.133 9.095 -12.646 1.00 1.10 H new ATOM 0 HG3 GLU A 13 -5.498 7.489 -12.941 1.00 1.10 H new ATOM 203 N VAL A 14 -2.735 8.018 -9.194 1.00 0.34 N ATOM 204 CA VAL A 14 -2.136 8.025 -7.867 1.00 0.33 C ATOM 205 C VAL A 14 -0.778 8.712 -7.900 1.00 0.33 C ATOM 206 O VAL A 14 -0.423 9.486 -7.009 1.00 0.36 O ATOM 207 CB VAL A 14 -1.997 6.599 -7.301 1.00 0.32 C ATOM 208 CG1 VAL A 14 -1.010 5.765 -8.085 1.00 0.53 C ATOM 209 CG2 VAL A 14 -1.629 6.647 -5.837 1.00 0.49 C ATOM 0 H VAL A 14 -2.733 7.107 -9.653 1.00 0.34 H new ATOM 0 HA VAL A 14 -2.801 8.583 -7.208 1.00 0.33 H new ATOM 0 HB VAL A 14 -2.967 6.111 -7.401 1.00 0.32 H new ATOM 0 HG11 VAL A 14 -0.947 4.769 -7.647 1.00 0.53 H new ATOM 0 HG12 VAL A 14 -1.342 5.686 -9.120 1.00 0.53 H new ATOM 0 HG13 VAL A 14 -0.028 6.238 -8.053 1.00 0.53 H new ATOM 0 HG21 VAL A 14 -1.535 5.632 -5.452 1.00 0.49 H new ATOM 0 HG22 VAL A 14 -0.680 7.170 -5.717 1.00 0.49 H new ATOM 0 HG23 VAL A 14 -2.406 7.174 -5.284 1.00 0.49 H new ATOM 219 N LEU A 15 -0.035 8.441 -8.953 1.00 0.32 N ATOM 220 CA LEU A 15 1.208 9.111 -9.200 1.00 0.33 C ATOM 221 C LEU A 15 0.927 10.559 -9.508 1.00 0.39 C ATOM 222 O LEU A 15 1.773 11.434 -9.343 1.00 0.43 O ATOM 223 CB LEU A 15 1.853 8.496 -10.402 1.00 0.34 C ATOM 224 CG LEU A 15 3.308 8.811 -10.558 1.00 0.43 C ATOM 225 CD1 LEU A 15 4.096 7.529 -10.453 1.00 0.56 C ATOM 226 CD2 LEU A 15 3.566 9.506 -11.884 1.00 0.60 C ATOM 0 H LEU A 15 -0.284 7.747 -9.658 1.00 0.32 H new ATOM 0 HA LEU A 15 1.857 9.025 -8.329 1.00 0.33 H new ATOM 0 HB2 LEU A 15 1.733 7.414 -10.349 1.00 0.34 H new ATOM 0 HB3 LEU A 15 1.324 8.832 -11.294 1.00 0.34 H new ATOM 0 HG LEU A 15 3.624 9.492 -9.768 1.00 0.43 H new ATOM 0 HD11 LEU A 15 5.159 7.745 -10.565 1.00 0.56 H new ATOM 0 HD12 LEU A 15 3.919 7.072 -9.479 1.00 0.56 H new ATOM 0 HD13 LEU A 15 3.780 6.843 -11.239 1.00 0.56 H new ATOM 0 HD21 LEU A 15 4.629 9.727 -11.978 1.00 0.60 H new ATOM 0 HD22 LEU A 15 3.256 8.856 -12.702 1.00 0.60 H new ATOM 0 HD23 LEU A 15 2.998 10.435 -11.924 1.00 0.60 H new ATOM 238 N GLY A 16 -0.287 10.783 -9.966 1.00 0.43 N ATOM 239 CA GLY A 16 -0.738 12.123 -10.253 1.00 0.50 C ATOM 240 C GLY A 16 -0.826 12.928 -8.987 1.00 0.50 C ATOM 241 O GLY A 16 -0.844 14.154 -9.008 1.00 0.57 O ATOM 0 H GLY A 16 -0.976 10.053 -10.146 1.00 0.43 H new ATOM 0 HA2 GLY A 16 -0.051 12.603 -10.950 1.00 0.50 H new ATOM 0 HA3 GLY A 16 -1.713 12.089 -10.739 1.00 0.50 H new ATOM 245 N TYR A 17 -0.856 12.220 -7.870 1.00 0.45 N ATOM 246 CA TYR A 17 -0.872 12.862 -6.575 1.00 0.48 C ATOM 247 C TYR A 17 0.553 13.038 -6.092 1.00 0.50 C ATOM 248 O TYR A 17 0.830 13.883 -5.245 1.00 0.64 O ATOM 249 CB TYR A 17 -1.672 12.048 -5.561 1.00 0.49 C ATOM 250 CG TYR A 17 -3.065 11.700 -6.019 1.00 0.96 C ATOM 251 CD1 TYR A 17 -3.926 12.689 -6.462 1.00 1.59 C ATOM 252 CD2 TYR A 17 -3.519 10.388 -6.003 1.00 1.41 C ATOM 253 CE1 TYR A 17 -5.207 12.387 -6.881 1.00 2.29 C ATOM 254 CE2 TYR A 17 -4.800 10.073 -6.420 1.00 2.13 C ATOM 255 CZ TYR A 17 -5.628 11.037 -6.866 1.00 2.49 C ATOM 256 OH TYR A 17 -6.918 10.774 -7.276 1.00 3.27 O ATOM 0 H TYR A 17 -0.870 11.201 -7.839 1.00 0.45 H new ATOM 0 HA TYR A 17 -1.355 13.834 -6.673 1.00 0.48 H new ATOM 0 HB2 TYR A 17 -1.132 11.127 -5.342 1.00 0.49 H new ATOM 0 HB3 TYR A 17 -1.736 12.609 -4.629 1.00 0.49 H new ATOM 0 HD1 TYR A 17 -3.590 13.715 -6.480 1.00 1.59 H new ATOM 0 HD2 TYR A 17 -2.863 9.602 -5.660 1.00 1.41 H new ATOM 0 HE1 TYR A 17 -5.875 13.168 -7.214 1.00 2.29 H new ATOM 0 HE2 TYR A 17 -5.138 9.048 -6.388 1.00 2.13 H new ATOM 0 HH TYR A 17 -6.909 10.055 -7.942 1.00 3.27 H new ATOM 266 N ASN A 18 1.462 12.235 -6.648 1.00 0.43 N ATOM 267 CA ASN A 18 2.876 12.331 -6.299 1.00 0.51 C ATOM 268 C ASN A 18 3.477 13.596 -6.902 1.00 0.62 C ATOM 269 O ASN A 18 4.562 14.037 -6.521 1.00 0.77 O ATOM 270 CB ASN A 18 3.631 11.102 -6.811 1.00 0.60 C ATOM 271 CG ASN A 18 5.073 11.044 -6.326 1.00 1.20 C ATOM 272 OD1 ASN A 18 5.318 11.498 -5.102 1.00 2.03 O flip ATOM 273 ND2 ASN A 18 5.959 10.577 -7.040 1.00 1.65 N flip ATOM 0 H ASN A 18 1.244 11.516 -7.338 1.00 0.43 H new ATOM 0 HA ASN A 18 2.967 12.375 -5.214 1.00 0.51 H new ATOM 0 HB2 ASN A 18 3.109 10.201 -6.488 1.00 0.60 H new ATOM 0 HB3 ASN A 18 3.620 11.104 -7.901 1.00 0.60 H new ATOM 0 HD21 ASN A 18 5.734 10.237 -7.975 1.00 1.65 H new ATOM 0 HD22 ASN A 18 6.918 10.529 -6.697 1.00 1.65 H new ATOM 280 N ARG A 19 2.748 14.182 -7.842 1.00 0.61 N ATOM 281 CA ARG A 19 3.232 15.345 -8.570 1.00 0.80 C ATOM 282 C ARG A 19 2.365 16.565 -8.281 1.00 0.90 C ATOM 283 O ARG A 19 2.792 17.703 -8.483 1.00 1.10 O ATOM 284 CB ARG A 19 3.231 15.038 -10.062 1.00 0.83 C ATOM 285 CG ARG A 19 3.904 13.719 -10.389 1.00 1.26 C ATOM 286 CD ARG A 19 3.382 13.134 -11.683 1.00 1.01 C ATOM 287 NE ARG A 19 3.906 13.826 -12.861 1.00 1.65 N ATOM 288 CZ ARG A 19 3.162 14.201 -13.900 1.00 1.85 C ATOM 289 NH1 ARG A 19 1.842 14.088 -13.846 1.00 1.70 N ATOM 290 NH2 ARG A 19 3.735 14.720 -14.978 1.00 2.72 N ATOM 0 H ARG A 19 1.817 13.869 -8.118 1.00 0.61 H new ATOM 0 HA ARG A 19 4.247 15.571 -8.244 1.00 0.80 H new ATOM 0 HB2 ARG A 19 2.203 15.016 -10.423 1.00 0.83 H new ATOM 0 HB3 ARG A 19 3.739 15.842 -10.594 1.00 0.83 H new ATOM 0 HG2 ARG A 19 4.981 13.868 -10.465 1.00 1.26 H new ATOM 0 HG3 ARG A 19 3.736 13.013 -9.576 1.00 1.26 H new ATOM 0 HD2 ARG A 19 3.651 12.079 -11.736 1.00 1.01 H new ATOM 0 HD3 ARG A 19 2.293 13.186 -11.689 1.00 1.01 H new ATOM 0 HE ARG A 19 4.904 14.034 -12.888 1.00 1.65 H new ATOM 0 HH11 ARG A 19 1.396 13.714 -13.008 1.00 1.70 H new ATOM 0 HH12 ARG A 19 1.273 14.375 -14.642 1.00 1.70 H new ATOM 0 HH21 ARG A 19 4.748 14.833 -15.013 1.00 2.72 H new ATOM 0 HH22 ARG A 19 3.162 15.006 -15.772 1.00 2.72 H new ATOM 304 N ASP A 20 1.148 16.330 -7.812 1.00 0.87 N ATOM 305 CA ASP A 20 0.236 17.418 -7.482 1.00 1.08 C ATOM 306 C ASP A 20 0.270 17.738 -6.004 1.00 0.94 C ATOM 307 O ASP A 20 0.165 16.849 -5.159 1.00 1.32 O ATOM 308 CB ASP A 20 -1.199 17.083 -7.855 1.00 1.59 C ATOM 309 CG ASP A 20 -1.567 17.514 -9.262 1.00 1.74 C ATOM 310 OD1 ASP A 20 -1.655 18.735 -9.512 1.00 1.91 O ATOM 311 OD2 ASP A 20 -1.789 16.639 -10.124 1.00 2.16 O ATOM 0 H ASP A 20 0.769 15.397 -7.651 1.00 0.87 H new ATOM 0 HA ASP A 20 0.573 18.279 -8.058 1.00 1.08 H new ATOM 0 HB2 ASP A 20 -1.351 16.008 -7.760 1.00 1.59 H new ATOM 0 HB3 ASP A 20 -1.873 17.564 -7.147 1.00 1.59 H new ATOM 316 N THR A 21 0.372 19.014 -5.695 1.00 0.91 N ATOM 317 CA THR A 21 0.410 19.460 -4.322 1.00 1.05 C ATOM 318 C THR A 21 -0.524 20.644 -4.144 1.00 1.13 C ATOM 319 O THR A 21 -0.371 21.677 -4.792 1.00 1.46 O ATOM 320 CB THR A 21 1.849 19.801 -3.898 1.00 1.45 C ATOM 321 OG1 THR A 21 2.429 20.757 -4.798 1.00 1.82 O ATOM 322 CG2 THR A 21 2.680 18.530 -3.896 1.00 1.70 C ATOM 0 H THR A 21 0.430 19.764 -6.384 1.00 0.91 H new ATOM 0 HA THR A 21 0.068 18.654 -3.673 1.00 1.05 H new ATOM 0 HB THR A 21 1.831 20.236 -2.899 1.00 1.45 H new ATOM 0 HG1 THR A 21 1.751 21.416 -5.057 1.00 1.82 H new ATOM 0 HG21 THR A 21 3.702 18.764 -3.596 1.00 1.70 H new ATOM 0 HG22 THR A 21 2.250 17.815 -3.194 1.00 1.70 H new ATOM 0 HG23 THR A 21 2.685 18.097 -4.896 1.00 1.70 H new ATOM 330 N SER A 22 -1.511 20.475 -3.282 1.00 1.05 N ATOM 331 CA SER A 22 -2.600 21.431 -3.192 1.00 1.30 C ATOM 332 C SER A 22 -2.915 21.740 -1.732 1.00 1.31 C ATOM 333 O SER A 22 -2.005 21.791 -0.898 1.00 2.15 O ATOM 334 CB SER A 22 -3.835 20.859 -3.899 1.00 1.67 C ATOM 335 OG SER A 22 -3.467 20.022 -4.990 1.00 2.19 O ATOM 0 H SER A 22 -1.581 19.688 -2.637 1.00 1.05 H new ATOM 0 HA SER A 22 -2.306 22.361 -3.679 1.00 1.30 H new ATOM 0 HB2 SER A 22 -4.433 20.290 -3.187 1.00 1.67 H new ATOM 0 HB3 SER A 22 -4.461 21.675 -4.260 1.00 1.67 H new ATOM 0 HG SER A 22 -4.226 19.930 -5.603 1.00 2.19 H new ATOM 341 N GLY A 23 -4.195 21.936 -1.426 1.00 0.96 N ATOM 342 CA GLY A 23 -4.613 22.202 -0.062 1.00 1.10 C ATOM 343 C GLY A 23 -4.553 20.970 0.820 1.00 0.89 C ATOM 344 O GLY A 23 -5.577 20.476 1.292 1.00 1.01 O ATOM 0 H GLY A 23 -4.955 21.915 -2.106 1.00 0.96 H new ATOM 0 HA2 GLY A 23 -3.978 22.979 0.363 1.00 1.10 H new ATOM 0 HA3 GLY A 23 -5.631 22.590 -0.068 1.00 1.10 H new ATOM 348 N TRP A 24 -3.353 20.451 1.002 1.00 0.79 N ATOM 349 CA TRP A 24 -3.100 19.393 1.954 1.00 0.66 C ATOM 350 C TRP A 24 -2.094 19.897 2.961 1.00 0.67 C ATOM 351 O TRP A 24 -1.675 21.053 2.897 1.00 0.83 O ATOM 352 CB TRP A 24 -2.639 18.100 1.246 1.00 0.71 C ATOM 353 CG TRP A 24 -1.201 18.017 0.810 1.00 0.81 C ATOM 354 CD1 TRP A 24 -0.165 18.814 1.181 1.00 1.34 C ATOM 355 CD2 TRP A 24 -0.647 17.029 -0.063 1.00 0.87 C ATOM 356 NE1 TRP A 24 0.991 18.382 0.613 1.00 1.41 N ATOM 357 CE2 TRP A 24 0.727 17.294 -0.168 1.00 0.99 C ATOM 358 CE3 TRP A 24 -1.181 15.947 -0.766 1.00 1.36 C ATOM 359 CZ2 TRP A 24 1.579 16.514 -0.941 1.00 1.09 C ATOM 360 CZ3 TRP A 24 -0.337 15.175 -1.536 1.00 1.67 C ATOM 361 CH2 TRP A 24 1.030 15.463 -1.618 1.00 1.37 C ATOM 0 H TRP A 24 -2.525 20.755 0.490 1.00 0.79 H new ATOM 0 HA TRP A 24 -4.018 19.127 2.477 1.00 0.66 H new ATOM 0 HB2 TRP A 24 -2.836 17.263 1.915 1.00 0.71 H new ATOM 0 HB3 TRP A 24 -3.265 17.958 0.365 1.00 0.71 H new ATOM 0 HD1 TRP A 24 -0.249 19.670 1.835 1.00 1.34 H new ATOM 0 HE1 TRP A 24 1.910 18.804 0.749 1.00 1.41 H new ATOM 0 HE3 TRP A 24 -2.235 15.719 -0.708 1.00 1.36 H new ATOM 0 HZ2 TRP A 24 2.635 16.731 -1.004 1.00 1.09 H new ATOM 0 HZ3 TRP A 24 -0.737 14.335 -2.084 1.00 1.67 H new ATOM 0 HH2 TRP A 24 1.665 14.840 -2.230 1.00 1.37 H new ATOM 372 N LYS A 25 -1.691 19.026 3.846 1.00 0.60 N ATOM 373 CA LYS A 25 -0.788 19.363 4.909 1.00 0.70 C ATOM 374 C LYS A 25 -0.371 18.098 5.607 1.00 0.61 C ATOM 375 O LYS A 25 -1.206 17.237 5.890 1.00 0.59 O ATOM 376 CB LYS A 25 -1.451 20.292 5.921 1.00 0.89 C ATOM 377 CG LYS A 25 -1.124 21.762 5.731 1.00 1.29 C ATOM 378 CD LYS A 25 -1.513 22.551 6.962 1.00 1.62 C ATOM 379 CE LYS A 25 -0.843 21.966 8.192 1.00 2.23 C ATOM 380 NZ LYS A 25 0.634 22.145 8.157 1.00 2.95 N ATOM 0 H LYS A 25 -1.986 18.049 3.848 1.00 0.60 H new ATOM 0 HA LYS A 25 0.075 19.876 4.485 1.00 0.70 H new ATOM 0 HB2 LYS A 25 -2.532 20.162 5.862 1.00 0.89 H new ATOM 0 HB3 LYS A 25 -1.148 19.992 6.924 1.00 0.89 H new ATOM 0 HG2 LYS A 25 -0.058 21.882 5.536 1.00 1.29 H new ATOM 0 HG3 LYS A 25 -1.653 22.149 4.860 1.00 1.29 H new ATOM 0 HD2 LYS A 25 -1.221 23.594 6.841 1.00 1.62 H new ATOM 0 HD3 LYS A 25 -2.596 22.535 7.086 1.00 1.62 H new ATOM 0 HE2 LYS A 25 -1.245 22.443 9.086 1.00 2.23 H new ATOM 0 HE3 LYS A 25 -1.078 20.904 8.263 1.00 2.23 H new ATOM 0 HZ1 LYS A 25 1.044 21.825 9.058 1.00 2.95 H new ATOM 0 HZ2 LYS A 25 1.033 21.585 7.376 1.00 2.95 H new ATOM 0 HZ3 LYS A 25 0.859 23.150 8.013 1.00 2.95 H new ATOM 394 N VAL A 26 0.911 17.955 5.842 1.00 0.63 N ATOM 395 CA VAL A 26 1.379 16.877 6.676 1.00 0.58 C ATOM 396 C VAL A 26 0.770 17.000 8.059 1.00 0.66 C ATOM 397 O VAL A 26 0.993 17.974 8.781 1.00 0.80 O ATOM 398 CB VAL A 26 2.902 16.821 6.776 1.00 0.64 C ATOM 399 CG1 VAL A 26 3.462 18.209 6.981 1.00 1.22 C ATOM 400 CG2 VAL A 26 3.314 15.894 7.899 1.00 1.56 C ATOM 0 H VAL A 26 1.641 18.564 5.472 1.00 0.63 H new ATOM 0 HA VAL A 26 1.061 15.946 6.207 1.00 0.58 H new ATOM 0 HB VAL A 26 3.308 16.428 5.844 1.00 0.64 H new ATOM 0 HG11 VAL A 26 4.548 18.156 7.051 1.00 1.22 H new ATOM 0 HG12 VAL A 26 3.183 18.842 6.139 1.00 1.22 H new ATOM 0 HG13 VAL A 26 3.059 18.632 7.902 1.00 1.22 H new ATOM 0 HG21 VAL A 26 4.402 15.860 7.963 1.00 1.56 H new ATOM 0 HG22 VAL A 26 2.907 16.260 8.841 1.00 1.56 H new ATOM 0 HG23 VAL A 26 2.931 14.892 7.703 1.00 1.56 H new ATOM 410 N VAL A 27 -0.009 16.010 8.402 1.00 0.62 N ATOM 411 CA VAL A 27 -0.711 16.003 9.657 1.00 0.73 C ATOM 412 C VAL A 27 0.136 15.296 10.694 1.00 0.76 C ATOM 413 O VAL A 27 0.005 15.534 11.895 1.00 0.90 O ATOM 414 CB VAL A 27 -2.093 15.319 9.531 1.00 0.75 C ATOM 415 CG1 VAL A 27 -1.946 13.842 9.184 1.00 1.21 C ATOM 416 CG2 VAL A 27 -2.906 15.501 10.806 1.00 1.22 C ATOM 0 H VAL A 27 -0.175 15.188 7.821 1.00 0.62 H new ATOM 0 HA VAL A 27 -0.887 17.034 9.964 1.00 0.73 H new ATOM 0 HB VAL A 27 -2.632 15.800 8.715 1.00 0.75 H new ATOM 0 HG11 VAL A 27 -2.933 13.388 9.102 1.00 1.21 H new ATOM 0 HG12 VAL A 27 -1.420 13.742 8.234 1.00 1.21 H new ATOM 0 HG13 VAL A 27 -1.379 13.339 9.967 1.00 1.21 H new ATOM 0 HG21 VAL A 27 -3.873 15.012 10.694 1.00 1.22 H new ATOM 0 HG22 VAL A 27 -2.370 15.058 11.645 1.00 1.22 H new ATOM 0 HG23 VAL A 27 -3.057 16.564 10.993 1.00 1.22 H new ATOM 426 N LYS A 28 1.032 14.436 10.221 1.00 0.65 N ATOM 427 CA LYS A 28 1.795 13.611 11.124 1.00 0.68 C ATOM 428 C LYS A 28 3.133 13.222 10.525 1.00 0.58 C ATOM 429 O LYS A 28 3.229 12.927 9.337 1.00 0.55 O ATOM 430 CB LYS A 28 1.007 12.352 11.490 1.00 0.77 C ATOM 431 CG LYS A 28 1.168 11.958 12.945 1.00 0.87 C ATOM 432 CD LYS A 28 0.645 13.054 13.855 1.00 1.45 C ATOM 433 CE LYS A 28 -0.871 13.163 13.781 1.00 2.02 C ATOM 434 NZ LYS A 28 -1.391 14.298 14.583 1.00 2.41 N ATOM 0 H LYS A 28 1.239 14.300 9.232 1.00 0.65 H new ATOM 0 HA LYS A 28 1.982 14.195 12.025 1.00 0.68 H new ATOM 0 HB2 LYS A 28 -0.049 12.516 11.278 1.00 0.77 H new ATOM 0 HB3 LYS A 28 1.335 11.527 10.857 1.00 0.77 H new ATOM 0 HG2 LYS A 28 0.630 11.030 13.138 1.00 0.87 H new ATOM 0 HG3 LYS A 28 2.219 11.768 13.162 1.00 0.87 H new ATOM 0 HD2 LYS A 28 0.947 12.850 14.882 1.00 1.45 H new ATOM 0 HD3 LYS A 28 1.094 14.007 13.574 1.00 1.45 H new ATOM 0 HE2 LYS A 28 -1.174 13.286 12.741 1.00 2.02 H new ATOM 0 HE3 LYS A 28 -1.318 12.234 14.136 1.00 2.02 H new ATOM 0 HZ1 LYS A 28 -2.427 14.334 14.503 1.00 2.41 H new ATOM 0 HZ2 LYS A 28 -1.125 14.169 15.580 1.00 2.41 H new ATOM 0 HZ3 LYS A 28 -0.986 15.188 14.229 1.00 2.41 H new ATOM 448 N THR A 29 4.164 13.238 11.351 1.00 0.61 N ATOM 449 CA THR A 29 5.484 12.796 10.941 1.00 0.59 C ATOM 450 C THR A 29 6.127 11.963 12.037 1.00 0.72 C ATOM 451 O THR A 29 5.947 12.237 13.224 1.00 0.88 O ATOM 452 CB THR A 29 6.419 13.985 10.636 1.00 0.75 C ATOM 453 OG1 THR A 29 6.414 14.910 11.732 1.00 1.38 O ATOM 454 CG2 THR A 29 6.015 14.698 9.358 1.00 0.82 C ATOM 0 H THR A 29 4.110 13.556 12.319 1.00 0.61 H new ATOM 0 HA THR A 29 5.350 12.204 10.036 1.00 0.59 H new ATOM 0 HB THR A 29 7.425 13.590 10.498 1.00 0.75 H new ATOM 0 HG1 THR A 29 7.011 15.660 11.530 1.00 1.38 H new ATOM 0 HG21 THR A 29 6.695 15.530 9.175 1.00 0.82 H new ATOM 0 HG22 THR A 29 6.061 14.000 8.522 1.00 0.82 H new ATOM 0 HG23 THR A 29 4.998 15.077 9.459 1.00 0.82 H new ATOM 462 N SER A 30 6.856 10.939 11.634 1.00 0.80 N ATOM 463 CA SER A 30 7.720 10.223 12.550 1.00 1.04 C ATOM 464 C SER A 30 9.089 10.901 12.520 1.00 1.45 C ATOM 465 O SER A 30 9.170 12.119 12.362 1.00 2.37 O ATOM 466 CB SER A 30 7.811 8.741 12.156 1.00 1.24 C ATOM 467 OG SER A 30 8.601 7.994 13.068 1.00 1.93 O ATOM 0 H SER A 30 6.866 10.585 10.677 1.00 0.80 H new ATOM 0 HA SER A 30 7.320 10.253 13.563 1.00 1.04 H new ATOM 0 HB2 SER A 30 6.808 8.316 12.113 1.00 1.24 H new ATOM 0 HB3 SER A 30 8.236 8.658 11.156 1.00 1.24 H new ATOM 0 HG SER A 30 9.252 7.455 12.572 1.00 1.93 H new ATOM 473 N LYS A 31 10.157 10.140 12.630 1.00 1.32 N ATOM 474 CA LYS A 31 11.482 10.726 12.625 1.00 1.71 C ATOM 475 C LYS A 31 12.142 10.515 11.267 1.00 1.47 C ATOM 476 O LYS A 31 13.362 10.628 11.131 1.00 2.02 O ATOM 477 CB LYS A 31 12.324 10.118 13.749 1.00 2.29 C ATOM 478 CG LYS A 31 13.464 11.015 14.213 1.00 2.73 C ATOM 479 CD LYS A 31 14.150 10.457 15.450 1.00 3.59 C ATOM 480 CE LYS A 31 13.158 10.213 16.574 1.00 4.18 C ATOM 481 NZ LYS A 31 13.834 9.858 17.848 1.00 4.55 N ATOM 0 H LYS A 31 10.136 9.124 12.723 1.00 1.32 H new ATOM 0 HA LYS A 31 11.404 11.799 12.799 1.00 1.71 H new ATOM 0 HB2 LYS A 31 11.677 9.899 14.598 1.00 2.29 H new ATOM 0 HB3 LYS A 31 12.736 9.168 13.409 1.00 2.29 H new ATOM 0 HG2 LYS A 31 14.193 11.122 13.410 1.00 2.73 H new ATOM 0 HG3 LYS A 31 13.078 12.011 14.429 1.00 2.73 H new ATOM 0 HD2 LYS A 31 14.653 9.523 15.198 1.00 3.59 H new ATOM 0 HD3 LYS A 31 14.919 11.153 15.786 1.00 3.59 H new ATOM 0 HE2 LYS A 31 12.552 11.107 16.722 1.00 4.18 H new ATOM 0 HE3 LYS A 31 12.478 9.410 16.289 1.00 4.18 H new ATOM 0 HZ1 LYS A 31 13.120 9.700 18.588 1.00 4.55 H new ATOM 0 HZ2 LYS A 31 14.392 8.991 17.715 1.00 4.55 H new ATOM 0 HZ3 LYS A 31 14.464 10.634 18.135 1.00 4.55 H new ATOM 495 N LYS A 32 11.325 10.224 10.253 1.00 0.87 N ATOM 496 CA LYS A 32 11.843 10.028 8.904 1.00 0.69 C ATOM 497 C LYS A 32 10.724 9.973 7.856 1.00 0.51 C ATOM 498 O LYS A 32 10.986 9.744 6.673 1.00 0.59 O ATOM 499 CB LYS A 32 12.654 8.732 8.839 1.00 0.80 C ATOM 500 CG LYS A 32 13.730 8.739 7.763 1.00 1.00 C ATOM 501 CD LYS A 32 14.706 9.884 7.980 1.00 0.93 C ATOM 502 CE LYS A 32 15.829 9.883 6.954 1.00 1.14 C ATOM 503 NZ LYS A 32 16.735 11.046 7.141 1.00 1.42 N ATOM 0 H LYS A 32 10.314 10.120 10.341 1.00 0.87 H new ATOM 0 HA LYS A 32 12.478 10.884 8.676 1.00 0.69 H new ATOM 0 HB2 LYS A 32 13.122 8.557 9.808 1.00 0.80 H new ATOM 0 HB3 LYS A 32 11.976 7.898 8.658 1.00 0.80 H new ATOM 0 HG2 LYS A 32 14.267 7.791 7.774 1.00 1.00 H new ATOM 0 HG3 LYS A 32 13.267 8.832 6.781 1.00 1.00 H new ATOM 0 HD2 LYS A 32 14.169 10.831 7.928 1.00 0.93 H new ATOM 0 HD3 LYS A 32 15.131 9.813 8.981 1.00 0.93 H new ATOM 0 HE2 LYS A 32 16.400 8.958 7.038 1.00 1.14 H new ATOM 0 HE3 LYS A 32 15.406 9.907 5.950 1.00 1.14 H new ATOM 0 HZ1 LYS A 32 17.490 11.016 6.426 1.00 1.42 H new ATOM 0 HZ2 LYS A 32 16.194 11.928 7.037 1.00 1.42 H new ATOM 0 HZ3 LYS A 32 17.156 11.009 8.091 1.00 1.42 H new ATOM 517 N ILE A 33 9.481 10.182 8.280 1.00 0.37 N ATOM 518 CA ILE A 33 8.343 10.030 7.375 1.00 0.33 C ATOM 519 C ILE A 33 7.313 11.130 7.576 1.00 0.36 C ATOM 520 O ILE A 33 7.351 11.858 8.567 1.00 0.46 O ATOM 521 CB ILE A 33 7.653 8.657 7.528 1.00 0.41 C ATOM 522 CG1 ILE A 33 7.201 8.440 8.968 1.00 0.58 C ATOM 523 CG2 ILE A 33 8.586 7.537 7.097 1.00 0.76 C ATOM 524 CD1 ILE A 33 6.368 7.190 9.159 1.00 0.75 C ATOM 0 H ILE A 33 9.236 10.454 9.232 1.00 0.37 H new ATOM 0 HA ILE A 33 8.753 10.103 6.368 1.00 0.33 H new ATOM 0 HB ILE A 33 6.775 8.646 6.882 1.00 0.41 H new ATOM 0 HG12 ILE A 33 8.079 8.383 9.611 1.00 0.58 H new ATOM 0 HG13 ILE A 33 6.623 9.305 9.293 1.00 0.58 H new ATOM 0 HG21 ILE A 33 8.081 6.578 7.212 1.00 0.76 H new ATOM 0 HG22 ILE A 33 8.864 7.677 6.052 1.00 0.76 H new ATOM 0 HG23 ILE A 33 9.483 7.552 7.717 1.00 0.76 H new ATOM 0 HD11 ILE A 33 6.082 7.100 10.207 1.00 0.75 H new ATOM 0 HD12 ILE A 33 5.471 7.252 8.542 1.00 0.75 H new ATOM 0 HD13 ILE A 33 6.950 6.316 8.865 1.00 0.75 H new ATOM 536 N THR A 34 6.377 11.203 6.644 1.00 0.33 N ATOM 537 CA THR A 34 5.484 12.339 6.513 1.00 0.36 C ATOM 538 C THR A 34 4.108 11.889 6.020 1.00 0.36 C ATOM 539 O THR A 34 3.992 11.313 4.943 1.00 0.39 O ATOM 540 CB THR A 34 6.094 13.322 5.493 1.00 0.39 C ATOM 541 OG1 THR A 34 7.406 13.721 5.914 1.00 0.58 O ATOM 542 CG2 THR A 34 5.226 14.544 5.300 1.00 0.56 C ATOM 0 H THR A 34 6.216 10.470 5.953 1.00 0.33 H new ATOM 0 HA THR A 34 5.363 12.817 7.485 1.00 0.36 H new ATOM 0 HB THR A 34 6.158 12.803 4.537 1.00 0.39 H new ATOM 0 HG1 THR A 34 7.785 14.344 5.259 1.00 0.58 H new ATOM 0 HG21 THR A 34 5.692 15.210 4.574 1.00 0.56 H new ATOM 0 HG22 THR A 34 4.245 14.240 4.936 1.00 0.56 H new ATOM 0 HG23 THR A 34 5.114 15.065 6.251 1.00 0.56 H new ATOM 550 N VAL A 35 3.074 12.135 6.812 1.00 0.39 N ATOM 551 CA VAL A 35 1.716 11.769 6.432 1.00 0.40 C ATOM 552 C VAL A 35 0.899 13.032 6.171 1.00 0.40 C ATOM 553 O VAL A 35 0.478 13.714 7.101 1.00 0.44 O ATOM 554 CB VAL A 35 1.030 10.920 7.532 1.00 0.48 C ATOM 555 CG1 VAL A 35 -0.243 10.268 7.009 1.00 0.82 C ATOM 556 CG2 VAL A 35 1.988 9.869 8.074 1.00 0.86 C ATOM 0 H VAL A 35 3.149 12.587 7.723 1.00 0.39 H new ATOM 0 HA VAL A 35 1.768 11.167 5.525 1.00 0.40 H new ATOM 0 HB VAL A 35 0.754 11.588 8.348 1.00 0.48 H new ATOM 0 HG11 VAL A 35 -0.703 9.679 7.803 1.00 0.82 H new ATOM 0 HG12 VAL A 35 -0.939 11.040 6.681 1.00 0.82 H new ATOM 0 HG13 VAL A 35 0.000 9.618 6.169 1.00 0.82 H new ATOM 0 HG21 VAL A 35 1.487 9.283 8.845 1.00 0.86 H new ATOM 0 HG22 VAL A 35 2.301 9.210 7.264 1.00 0.86 H new ATOM 0 HG23 VAL A 35 2.862 10.360 8.501 1.00 0.86 H new ATOM 566 N SER A 36 0.709 13.351 4.901 1.00 0.42 N ATOM 567 CA SER A 36 0.002 14.559 4.497 1.00 0.42 C ATOM 568 C SER A 36 -1.434 14.260 4.133 1.00 0.43 C ATOM 569 O SER A 36 -1.724 13.394 3.310 1.00 0.47 O ATOM 570 CB SER A 36 0.736 15.218 3.341 1.00 0.45 C ATOM 571 OG SER A 36 2.094 15.416 3.680 1.00 1.10 O ATOM 0 H SER A 36 1.039 12.782 4.121 1.00 0.42 H new ATOM 0 HA SER A 36 -0.019 15.250 5.340 1.00 0.42 H new ATOM 0 HB2 SER A 36 0.662 14.594 2.450 1.00 0.45 H new ATOM 0 HB3 SER A 36 0.270 16.173 3.101 1.00 0.45 H new ATOM 0 HG SER A 36 2.554 14.551 3.706 1.00 1.10 H new ATOM 577 N SER A 37 -2.318 14.995 4.764 1.00 0.45 N ATOM 578 CA SER A 37 -3.742 14.810 4.592 1.00 0.48 C ATOM 579 C SER A 37 -4.272 15.815 3.587 1.00 0.53 C ATOM 580 O SER A 37 -4.083 17.021 3.738 1.00 0.59 O ATOM 581 CB SER A 37 -4.467 14.965 5.935 1.00 0.59 C ATOM 582 OG SER A 37 -5.836 14.614 5.825 1.00 1.27 O ATOM 0 H SER A 37 -2.071 15.741 5.414 1.00 0.45 H new ATOM 0 HA SER A 37 -3.926 13.803 4.217 1.00 0.48 H new ATOM 0 HB2 SER A 37 -3.987 14.336 6.684 1.00 0.59 H new ATOM 0 HB3 SER A 37 -4.380 15.995 6.281 1.00 0.59 H new ATOM 0 HG SER A 37 -5.975 13.718 6.198 1.00 1.27 H new ATOM 588 N LYS A 38 -4.912 15.305 2.555 1.00 0.59 N ATOM 589 CA LYS A 38 -5.474 16.144 1.514 1.00 0.76 C ATOM 590 C LYS A 38 -6.981 15.912 1.407 1.00 0.90 C ATOM 591 O LYS A 38 -7.744 16.393 2.243 1.00 1.69 O ATOM 592 CB LYS A 38 -4.771 15.867 0.172 1.00 0.99 C ATOM 593 CG LYS A 38 -5.170 16.802 -0.962 1.00 1.06 C ATOM 594 CD LYS A 38 -4.387 16.496 -2.232 1.00 1.11 C ATOM 595 CE LYS A 38 -4.778 17.428 -3.368 1.00 1.44 C ATOM 596 NZ LYS A 38 -3.882 17.284 -4.549 1.00 1.91 N ATOM 0 H LYS A 38 -5.057 14.305 2.413 1.00 0.59 H new ATOM 0 HA LYS A 38 -5.311 17.191 1.771 1.00 0.76 H new ATOM 0 HB2 LYS A 38 -3.694 15.938 0.321 1.00 0.99 H new ATOM 0 HB3 LYS A 38 -4.984 14.841 -0.129 1.00 0.99 H new ATOM 0 HG2 LYS A 38 -6.238 16.705 -1.158 1.00 1.06 H new ATOM 0 HG3 LYS A 38 -4.994 17.835 -0.663 1.00 1.06 H new ATOM 0 HD2 LYS A 38 -3.319 16.591 -2.034 1.00 1.11 H new ATOM 0 HD3 LYS A 38 -4.565 15.463 -2.530 1.00 1.11 H new ATOM 0 HE2 LYS A 38 -5.806 17.222 -3.667 1.00 1.44 H new ATOM 0 HE3 LYS A 38 -4.749 18.459 -3.016 1.00 1.44 H new ATOM 0 HZ1 LYS A 38 -3.591 18.226 -4.881 1.00 1.91 H new ATOM 0 HZ2 LYS A 38 -3.040 16.736 -4.281 1.00 1.91 H new ATOM 0 HZ3 LYS A 38 -4.389 16.790 -5.311 1.00 1.91 H new ATOM 610 N ALA A 39 -7.391 15.122 0.422 1.00 1.16 N ATOM 611 CA ALA A 39 -8.802 14.886 0.142 1.00 1.25 C ATOM 612 C ALA A 39 -8.940 13.948 -1.044 1.00 1.19 C ATOM 613 O ALA A 39 -8.132 13.993 -1.971 1.00 1.50 O ATOM 614 CB ALA A 39 -9.523 16.194 -0.152 1.00 1.68 C ATOM 0 H ALA A 39 -6.756 14.628 -0.204 1.00 1.16 H new ATOM 0 HA ALA A 39 -9.256 14.432 1.023 1.00 1.25 H new ATOM 0 HB1 ALA A 39 -10.574 15.992 -0.358 1.00 1.68 H new ATOM 0 HB2 ALA A 39 -9.443 16.855 0.711 1.00 1.68 H new ATOM 0 HB3 ALA A 39 -9.069 16.673 -1.020 1.00 1.68 H new ATOM 620 N SER A 40 -9.939 13.083 -1.000 1.00 1.11 N ATOM 621 CA SER A 40 -10.203 12.180 -2.095 1.00 1.35 C ATOM 622 C SER A 40 -11.440 12.638 -2.844 1.00 1.53 C ATOM 623 O SER A 40 -11.475 12.654 -4.074 1.00 2.09 O ATOM 624 CB SER A 40 -10.381 10.752 -1.571 1.00 1.66 C ATOM 625 OG SER A 40 -11.216 10.727 -0.424 1.00 2.06 O ATOM 0 H SER A 40 -10.580 12.991 -0.212 1.00 1.11 H new ATOM 0 HA SER A 40 -9.356 12.186 -2.781 1.00 1.35 H new ATOM 0 HB2 SER A 40 -10.813 10.126 -2.352 1.00 1.66 H new ATOM 0 HB3 SER A 40 -9.407 10.328 -1.325 1.00 1.66 H new ATOM 0 HG SER A 40 -10.662 10.704 0.384 1.00 2.06 H new ATOM 631 N ARG A 41 -12.455 13.013 -2.061 1.00 1.87 N ATOM 632 CA ARG A 41 -13.721 13.542 -2.569 1.00 2.15 C ATOM 633 C ARG A 41 -14.417 12.583 -3.523 1.00 1.92 C ATOM 634 O ARG A 41 -15.418 12.941 -4.144 1.00 2.12 O ATOM 635 CB ARG A 41 -13.523 14.884 -3.257 1.00 3.07 C ATOM 636 CG ARG A 41 -13.125 16.007 -2.311 1.00 3.62 C ATOM 637 CD ARG A 41 -12.813 17.291 -3.062 1.00 4.44 C ATOM 638 NE ARG A 41 -13.963 17.796 -3.816 1.00 4.95 N ATOM 639 CZ ARG A 41 -13.879 18.773 -4.721 1.00 5.91 C ATOM 640 NH1 ARG A 41 -12.709 19.356 -4.955 1.00 6.46 N ATOM 641 NH2 ARG A 41 -14.960 19.178 -5.376 1.00 6.61 N ATOM 0 H ARG A 41 -12.419 12.956 -1.043 1.00 1.87 H new ATOM 0 HA ARG A 41 -14.362 13.673 -1.697 1.00 2.15 H new ATOM 0 HB2 ARG A 41 -12.756 14.779 -4.024 1.00 3.07 H new ATOM 0 HB3 ARG A 41 -14.446 15.160 -3.766 1.00 3.07 H new ATOM 0 HG2 ARG A 41 -13.932 16.188 -1.601 1.00 3.62 H new ATOM 0 HG3 ARG A 41 -12.253 15.703 -1.732 1.00 3.62 H new ATOM 0 HD2 ARG A 41 -12.485 18.052 -2.353 1.00 4.44 H new ATOM 0 HD3 ARG A 41 -11.983 17.115 -3.747 1.00 4.44 H new ATOM 0 HE ARG A 41 -14.877 17.378 -3.640 1.00 4.95 H new ATOM 0 HH11 ARG A 41 -11.879 19.057 -4.444 1.00 6.46 H new ATOM 0 HH12 ARG A 41 -12.641 20.103 -5.646 1.00 6.46 H new ATOM 0 HH21 ARG A 41 -15.863 18.742 -5.189 1.00 6.61 H new ATOM 0 HH22 ARG A 41 -14.888 19.925 -6.066 1.00 6.61 H new ATOM 655 N LYS A 42 -13.892 11.369 -3.632 1.00 1.99 N ATOM 656 CA LYS A 42 -14.519 10.343 -4.440 1.00 2.62 C ATOM 657 C LYS A 42 -15.847 9.973 -3.807 1.00 2.59 C ATOM 658 O LYS A 42 -16.766 9.521 -4.488 1.00 3.13 O ATOM 659 CB LYS A 42 -13.618 9.107 -4.542 1.00 3.24 C ATOM 660 CG LYS A 42 -12.227 9.380 -5.106 1.00 3.85 C ATOM 661 CD LYS A 42 -12.253 9.711 -6.595 1.00 4.70 C ATOM 662 CE LYS A 42 -10.840 9.871 -7.145 1.00 5.56 C ATOM 663 NZ LYS A 42 -10.821 10.080 -8.621 1.00 6.46 N ATOM 0 H LYS A 42 -13.032 11.075 -3.168 1.00 1.99 H new ATOM 0 HA LYS A 42 -14.680 10.723 -5.449 1.00 2.62 H new ATOM 0 HB2 LYS A 42 -13.514 8.667 -3.550 1.00 3.24 H new ATOM 0 HB3 LYS A 42 -14.111 8.365 -5.170 1.00 3.24 H new ATOM 0 HG2 LYS A 42 -11.774 10.208 -4.561 1.00 3.85 H new ATOM 0 HG3 LYS A 42 -11.595 8.507 -4.942 1.00 3.85 H new ATOM 0 HD2 LYS A 42 -12.771 8.920 -7.138 1.00 4.70 H new ATOM 0 HD3 LYS A 42 -12.816 10.630 -6.757 1.00 4.70 H new ATOM 0 HE2 LYS A 42 -10.357 10.717 -6.656 1.00 5.56 H new ATOM 0 HE3 LYS A 42 -10.256 8.984 -6.900 1.00 5.56 H new ATOM 0 HZ1 LYS A 42 -9.838 10.183 -8.944 1.00 6.46 H new ATOM 0 HZ2 LYS A 42 -11.257 9.262 -9.093 1.00 6.46 H new ATOM 0 HZ3 LYS A 42 -11.355 10.941 -8.857 1.00 6.46 H new ATOM 677 N PHE A 43 -15.932 10.207 -2.494 1.00 2.24 N ATOM 678 CA PHE A 43 -17.124 9.913 -1.717 1.00 2.56 C ATOM 679 C PHE A 43 -16.831 10.132 -0.249 1.00 2.44 C ATOM 680 O PHE A 43 -17.512 10.899 0.429 1.00 3.00 O ATOM 681 CB PHE A 43 -17.576 8.462 -1.912 1.00 3.06 C ATOM 682 CG PHE A 43 -18.778 8.095 -1.086 1.00 3.83 C ATOM 683 CD1 PHE A 43 -20.030 8.599 -1.401 1.00 4.52 C ATOM 684 CD2 PHE A 43 -18.656 7.247 0.002 1.00 4.19 C ATOM 685 CE1 PHE A 43 -21.137 8.263 -0.649 1.00 5.45 C ATOM 686 CE2 PHE A 43 -19.762 6.907 0.759 1.00 5.06 C ATOM 687 CZ PHE A 43 -20.996 7.419 0.445 1.00 5.65 C ATOM 0 H PHE A 43 -15.171 10.607 -1.945 1.00 2.24 H new ATOM 0 HA PHE A 43 -17.919 10.576 -2.058 1.00 2.56 H new ATOM 0 HB2 PHE A 43 -17.805 8.299 -2.965 1.00 3.06 H new ATOM 0 HB3 PHE A 43 -16.752 7.795 -1.658 1.00 3.06 H new ATOM 0 HD1 PHE A 43 -20.141 9.263 -2.246 1.00 4.52 H new ATOM 0 HD2 PHE A 43 -17.687 6.847 0.262 1.00 4.19 H new ATOM 0 HE1 PHE A 43 -22.109 8.655 -0.910 1.00 5.45 H new ATOM 0 HE2 PHE A 43 -19.655 6.237 1.599 1.00 5.06 H new ATOM 0 HZ PHE A 43 -21.856 7.166 1.048 1.00 5.65 H new ATOM 697 N HIS A 44 -15.793 9.454 0.223 1.00 2.18 N ATOM 698 CA HIS A 44 -15.509 9.393 1.641 1.00 2.43 C ATOM 699 C HIS A 44 -15.133 10.750 2.216 1.00 1.88 C ATOM 700 O HIS A 44 -15.895 11.341 2.978 1.00 2.06 O ATOM 701 CB HIS A 44 -14.397 8.386 1.931 1.00 3.27 C ATOM 702 CG HIS A 44 -14.321 7.998 3.376 1.00 4.01 C ATOM 703 ND1 HIS A 44 -15.029 6.944 3.898 1.00 4.55 N ATOM 704 CD2 HIS A 44 -13.639 8.541 4.411 1.00 4.75 C ATOM 705 CE1 HIS A 44 -14.793 6.852 5.193 1.00 5.43 C ATOM 706 NE2 HIS A 44 -13.949 7.811 5.534 1.00 5.56 N ATOM 0 H HIS A 44 -15.135 8.939 -0.362 1.00 2.18 H new ATOM 0 HA HIS A 44 -16.429 9.068 2.127 1.00 2.43 H new ATOM 0 HB2 HIS A 44 -14.558 7.492 1.328 1.00 3.27 H new ATOM 0 HB3 HIS A 44 -13.441 8.810 1.624 1.00 3.27 H new ATOM 0 HD1 HIS A 44 -15.643 6.327 3.367 1.00 4.55 H new ATOM 0 HD2 HIS A 44 -12.974 9.391 4.364 1.00 4.75 H new ATOM 0 HE1 HIS A 44 -15.217 6.118 5.861 1.00 5.43 H new ATOM 715 N GLY A 45 -13.958 11.237 1.861 1.00 1.56 N ATOM 716 CA GLY A 45 -13.493 12.484 2.422 1.00 1.46 C ATOM 717 C GLY A 45 -12.055 12.780 2.080 1.00 1.27 C ATOM 718 O GLY A 45 -11.764 13.290 0.996 1.00 1.42 O ATOM 0 H GLY A 45 -13.321 10.795 1.199 1.00 1.56 H new ATOM 0 HA2 GLY A 45 -14.122 13.297 2.060 1.00 1.46 H new ATOM 0 HA3 GLY A 45 -13.605 12.453 3.506 1.00 1.46 H new ATOM 722 N ASN A 46 -11.145 12.441 2.984 1.00 1.06 N ATOM 723 CA ASN A 46 -9.752 12.826 2.817 1.00 0.90 C ATOM 724 C ASN A 46 -8.951 11.767 2.070 1.00 0.81 C ATOM 725 O ASN A 46 -9.431 10.665 1.807 1.00 0.95 O ATOM 726 CB ASN A 46 -9.094 13.103 4.171 1.00 0.91 C ATOM 727 CG ASN A 46 -9.738 14.256 4.916 1.00 1.32 C ATOM 728 OD1 ASN A 46 -10.678 14.064 5.690 1.00 2.05 O ATOM 729 ND2 ASN A 46 -9.235 15.462 4.698 1.00 1.87 N ATOM 0 H ASN A 46 -11.344 11.907 3.830 1.00 1.06 H new ATOM 0 HA ASN A 46 -9.750 13.738 2.221 1.00 0.90 H new ATOM 0 HB2 ASN A 46 -9.148 12.205 4.786 1.00 0.91 H new ATOM 0 HB3 ASN A 46 -8.037 13.321 4.018 1.00 0.91 H new ATOM 0 HD21 ASN A 46 -9.626 16.272 5.178 1.00 1.87 H new ATOM 0 HD22 ASN A 46 -8.456 15.580 4.050 1.00 1.87 H new ATOM 736 N LEU A 47 -7.736 12.148 1.711 1.00 0.70 N ATOM 737 CA LEU A 47 -6.770 11.263 1.081 1.00 0.62 C ATOM 738 C LEU A 47 -5.437 11.535 1.752 1.00 0.54 C ATOM 739 O LEU A 47 -5.098 12.694 1.989 1.00 0.58 O ATOM 740 CB LEU A 47 -6.686 11.550 -0.428 1.00 0.66 C ATOM 741 CG LEU A 47 -6.120 10.436 -1.320 1.00 0.70 C ATOM 742 CD1 LEU A 47 -6.281 10.814 -2.779 1.00 0.77 C ATOM 743 CD2 LEU A 47 -4.655 10.158 -1.023 1.00 0.87 C ATOM 0 H LEU A 47 -7.388 13.096 1.851 1.00 0.70 H new ATOM 0 HA LEU A 47 -7.058 10.218 1.194 1.00 0.62 H new ATOM 0 HB2 LEU A 47 -7.688 11.792 -0.783 1.00 0.66 H new ATOM 0 HB3 LEU A 47 -6.074 12.441 -0.570 1.00 0.66 H new ATOM 0 HG LEU A 47 -6.681 9.526 -1.106 1.00 0.70 H new ATOM 0 HD11 LEU A 47 -5.878 10.020 -3.407 1.00 0.77 H new ATOM 0 HD12 LEU A 47 -7.338 10.953 -3.004 1.00 0.77 H new ATOM 0 HD13 LEU A 47 -5.743 11.741 -2.976 1.00 0.77 H new ATOM 0 HD21 LEU A 47 -4.296 9.363 -1.677 1.00 0.87 H new ATOM 0 HD22 LEU A 47 -4.071 11.062 -1.196 1.00 0.87 H new ATOM 0 HD23 LEU A 47 -4.547 9.849 0.017 1.00 0.87 H new ATOM 755 N TYR A 48 -4.687 10.501 2.065 1.00 0.48 N ATOM 756 CA TYR A 48 -3.479 10.677 2.843 1.00 0.45 C ATOM 757 C TYR A 48 -2.261 10.234 2.061 1.00 0.46 C ATOM 758 O TYR A 48 -2.226 9.130 1.513 1.00 0.54 O ATOM 759 CB TYR A 48 -3.569 9.902 4.156 1.00 0.48 C ATOM 760 CG TYR A 48 -4.518 10.504 5.166 1.00 0.53 C ATOM 761 CD1 TYR A 48 -5.893 10.402 5.009 1.00 0.63 C ATOM 762 CD2 TYR A 48 -4.033 11.180 6.278 1.00 0.64 C ATOM 763 CE1 TYR A 48 -6.759 10.955 5.931 1.00 0.76 C ATOM 764 CE2 TYR A 48 -4.892 11.737 7.205 1.00 0.78 C ATOM 765 CZ TYR A 48 -6.253 11.621 7.027 1.00 0.82 C ATOM 766 OH TYR A 48 -7.111 12.183 7.945 1.00 0.99 O ATOM 0 H TYR A 48 -4.889 9.538 1.796 1.00 0.48 H new ATOM 0 HA TYR A 48 -3.377 11.739 3.067 1.00 0.45 H new ATOM 0 HB2 TYR A 48 -3.884 8.881 3.941 1.00 0.48 H new ATOM 0 HB3 TYR A 48 -2.575 9.842 4.599 1.00 0.48 H new ATOM 0 HD1 TYR A 48 -6.292 9.881 4.151 1.00 0.63 H new ATOM 0 HD2 TYR A 48 -2.966 11.272 6.420 1.00 0.64 H new ATOM 0 HE1 TYR A 48 -7.827 10.866 5.795 1.00 0.76 H new ATOM 0 HE2 TYR A 48 -4.499 12.260 8.064 1.00 0.78 H new ATOM 0 HH TYR A 48 -6.593 12.613 8.657 1.00 0.99 H new ATOM 776 N ARG A 49 -1.278 11.110 1.996 1.00 0.45 N ATOM 777 CA ARG A 49 -0.004 10.768 1.397 1.00 0.48 C ATOM 778 C ARG A 49 0.979 10.427 2.496 1.00 0.40 C ATOM 779 O ARG A 49 1.302 11.278 3.320 1.00 0.48 O ATOM 780 CB ARG A 49 0.570 11.927 0.572 1.00 0.59 C ATOM 781 CG ARG A 49 1.965 11.634 0.015 1.00 0.71 C ATOM 782 CD ARG A 49 2.708 12.897 -0.390 1.00 1.32 C ATOM 783 NE ARG A 49 2.903 13.817 0.734 1.00 1.69 N ATOM 784 CZ ARG A 49 3.928 14.671 0.837 1.00 2.18 C ATOM 785 NH1 ARG A 49 4.895 14.673 -0.068 1.00 2.54 N ATOM 786 NH2 ARG A 49 3.993 15.506 1.865 1.00 2.92 N ATOM 0 H ARG A 49 -1.337 12.064 2.351 1.00 0.45 H new ATOM 0 HA ARG A 49 -0.164 9.920 0.731 1.00 0.48 H new ATOM 0 HB2 ARG A 49 -0.106 12.147 -0.254 1.00 0.59 H new ATOM 0 HB3 ARG A 49 0.614 12.821 1.194 1.00 0.59 H new ATOM 0 HG2 ARG A 49 2.547 11.099 0.765 1.00 0.71 H new ATOM 0 HG3 ARG A 49 1.877 10.976 -0.849 1.00 0.71 H new ATOM 0 HD2 ARG A 49 3.678 12.626 -0.807 1.00 1.32 H new ATOM 0 HD3 ARG A 49 2.153 13.404 -1.179 1.00 1.32 H new ATOM 0 HE ARG A 49 2.214 13.806 1.486 1.00 1.69 H new ATOM 0 HH11 ARG A 49 4.862 14.020 -0.851 1.00 2.54 H new ATOM 0 HH12 ARG A 49 5.673 15.327 0.018 1.00 2.54 H new ATOM 0 HH21 ARG A 49 3.262 15.497 2.576 1.00 2.92 H new ATOM 0 HH22 ARG A 49 4.774 16.157 1.944 1.00 2.92 H new ATOM 800 N VAL A 50 1.456 9.205 2.516 1.00 0.37 N ATOM 801 CA VAL A 50 2.471 8.842 3.469 1.00 0.42 C ATOM 802 C VAL A 50 3.790 8.703 2.734 1.00 0.46 C ATOM 803 O VAL A 50 3.925 7.930 1.786 1.00 0.62 O ATOM 804 CB VAL A 50 2.117 7.572 4.275 1.00 0.63 C ATOM 805 CG1 VAL A 50 2.136 6.316 3.422 1.00 1.29 C ATOM 806 CG2 VAL A 50 3.040 7.435 5.473 1.00 1.33 C ATOM 0 H VAL A 50 1.161 8.455 1.891 1.00 0.37 H new ATOM 0 HA VAL A 50 2.548 9.632 4.216 1.00 0.42 H new ATOM 0 HB VAL A 50 1.093 7.687 4.630 1.00 0.63 H new ATOM 0 HG11 VAL A 50 1.880 5.454 4.038 1.00 1.29 H new ATOM 0 HG12 VAL A 50 1.410 6.413 2.615 1.00 1.29 H new ATOM 0 HG13 VAL A 50 3.131 6.178 3.000 1.00 1.29 H new ATOM 0 HG21 VAL A 50 2.780 6.536 6.032 1.00 1.33 H new ATOM 0 HG22 VAL A 50 4.072 7.363 5.131 1.00 1.33 H new ATOM 0 HG23 VAL A 50 2.932 8.307 6.118 1.00 1.33 H new ATOM 816 N GLU A 51 4.744 9.497 3.146 1.00 0.37 N ATOM 817 CA GLU A 51 5.957 9.674 2.394 1.00 0.37 C ATOM 818 C GLU A 51 7.152 9.738 3.325 1.00 0.38 C ATOM 819 O GLU A 51 7.225 10.594 4.200 1.00 0.56 O ATOM 820 CB GLU A 51 5.866 10.952 1.561 1.00 0.40 C ATOM 821 CG GLU A 51 7.113 11.205 0.750 1.00 0.47 C ATOM 822 CD GLU A 51 7.080 12.494 -0.035 1.00 0.52 C ATOM 823 OE1 GLU A 51 6.295 12.567 -1.002 1.00 1.07 O ATOM 824 OE2 GLU A 51 7.805 13.446 0.323 1.00 1.02 O ATOM 0 H GLU A 51 4.701 10.037 4.010 1.00 0.37 H new ATOM 0 HA GLU A 51 6.087 8.822 1.727 1.00 0.37 H new ATOM 0 HB2 GLU A 51 5.009 10.885 0.891 1.00 0.40 H new ATOM 0 HB3 GLU A 51 5.688 11.800 2.222 1.00 0.40 H new ATOM 0 HG2 GLU A 51 7.973 11.220 1.419 1.00 0.47 H new ATOM 0 HG3 GLU A 51 7.261 10.374 0.060 1.00 0.47 H new ATOM 831 N GLY A 52 8.079 8.830 3.133 1.00 0.27 N ATOM 832 CA GLY A 52 9.268 8.804 3.948 1.00 0.29 C ATOM 833 C GLY A 52 10.444 8.294 3.168 1.00 0.25 C ATOM 834 O GLY A 52 10.273 7.689 2.112 1.00 0.29 O ATOM 0 H GLY A 52 8.032 8.101 2.421 1.00 0.27 H new ATOM 0 HA2 GLY A 52 9.481 9.807 4.319 1.00 0.29 H new ATOM 0 HA3 GLY A 52 9.102 8.170 4.819 1.00 0.29 H new ATOM 838 N ILE A 53 11.640 8.542 3.652 1.00 0.24 N ATOM 839 CA ILE A 53 12.815 8.062 2.965 1.00 0.23 C ATOM 840 C ILE A 53 13.313 6.768 3.579 1.00 0.23 C ATOM 841 O ILE A 53 13.656 6.717 4.760 1.00 0.30 O ATOM 842 CB ILE A 53 13.950 9.094 2.975 1.00 0.29 C ATOM 843 CG1 ILE A 53 13.445 10.432 2.428 1.00 0.37 C ATOM 844 CG2 ILE A 53 15.112 8.574 2.144 1.00 0.27 C ATOM 845 CD1 ILE A 53 14.436 11.562 2.574 1.00 0.58 C ATOM 0 H ILE A 53 11.823 9.066 4.508 1.00 0.24 H new ATOM 0 HA ILE A 53 12.519 7.885 1.931 1.00 0.23 H new ATOM 0 HB ILE A 53 14.293 9.252 3.997 1.00 0.29 H new ATOM 0 HG12 ILE A 53 13.197 10.313 1.373 1.00 0.37 H new ATOM 0 HG13 ILE A 53 12.523 10.700 2.944 1.00 0.37 H new ATOM 0 HG21 ILE A 53 15.920 9.306 2.150 1.00 0.27 H new ATOM 0 HG22 ILE A 53 15.470 7.635 2.566 1.00 0.27 H new ATOM 0 HG23 ILE A 53 14.781 8.408 1.119 1.00 0.27 H new ATOM 0 HD11 ILE A 53 14.008 12.477 2.164 1.00 0.58 H new ATOM 0 HD12 ILE A 53 14.666 11.710 3.629 1.00 0.58 H new ATOM 0 HD13 ILE A 53 15.350 11.316 2.034 1.00 0.58 H new ATOM 857 N ILE A 54 13.330 5.724 2.774 1.00 0.24 N ATOM 858 CA ILE A 54 13.923 4.473 3.182 1.00 0.26 C ATOM 859 C ILE A 54 15.344 4.398 2.633 1.00 0.29 C ATOM 860 O ILE A 54 15.549 4.411 1.422 1.00 0.31 O ATOM 861 CB ILE A 54 13.077 3.255 2.731 1.00 0.26 C ATOM 862 CG1 ILE A 54 11.777 3.214 3.536 1.00 0.32 C ATOM 863 CG2 ILE A 54 13.856 1.958 2.912 1.00 0.32 C ATOM 864 CD1 ILE A 54 10.716 2.321 2.943 1.00 0.35 C ATOM 0 H ILE A 54 12.938 5.721 1.832 1.00 0.24 H new ATOM 0 HA ILE A 54 13.952 4.436 4.271 1.00 0.26 H new ATOM 0 HB ILE A 54 12.843 3.359 1.672 1.00 0.26 H new ATOM 0 HG12 ILE A 54 11.999 2.875 4.548 1.00 0.32 H new ATOM 0 HG13 ILE A 54 11.381 4.226 3.619 1.00 0.32 H new ATOM 0 HG21 ILE A 54 13.242 1.117 2.589 1.00 0.32 H new ATOM 0 HG22 ILE A 54 14.766 1.994 2.314 1.00 0.32 H new ATOM 0 HG23 ILE A 54 14.117 1.834 3.963 1.00 0.32 H new ATOM 0 HD11 ILE A 54 9.826 2.346 3.572 1.00 0.35 H new ATOM 0 HD12 ILE A 54 10.463 2.671 1.942 1.00 0.35 H new ATOM 0 HD13 ILE A 54 11.091 1.299 2.886 1.00 0.35 H new ATOM 876 N PRO A 55 16.332 4.404 3.542 1.00 0.36 N ATOM 877 CA PRO A 55 17.768 4.367 3.212 1.00 0.44 C ATOM 878 C PRO A 55 18.200 3.061 2.549 1.00 0.47 C ATOM 879 O PRO A 55 19.081 2.352 3.041 1.00 0.62 O ATOM 880 CB PRO A 55 18.460 4.525 4.572 1.00 0.54 C ATOM 881 CG PRO A 55 17.409 5.046 5.492 1.00 0.53 C ATOM 882 CD PRO A 55 16.112 4.494 4.984 1.00 0.42 C ATOM 0 HA PRO A 55 18.024 5.143 2.491 1.00 0.44 H new ATOM 0 HB2 PRO A 55 18.854 3.572 4.925 1.00 0.54 H new ATOM 0 HB3 PRO A 55 19.302 5.214 4.507 1.00 0.54 H new ATOM 0 HG2 PRO A 55 17.594 4.728 6.518 1.00 0.53 H new ATOM 0 HG3 PRO A 55 17.396 6.136 5.494 1.00 0.53 H new ATOM 0 HD2 PRO A 55 15.890 3.520 5.420 1.00 0.42 H new ATOM 0 HD3 PRO A 55 15.274 5.148 5.224 1.00 0.42 H new ATOM 890 N GLU A 56 17.557 2.750 1.442 1.00 0.43 N ATOM 891 CA GLU A 56 17.870 1.600 0.652 1.00 0.49 C ATOM 892 C GLU A 56 17.366 1.844 -0.764 1.00 0.46 C ATOM 893 O GLU A 56 16.609 2.786 -0.994 1.00 0.60 O ATOM 894 CB GLU A 56 17.204 0.391 1.283 1.00 0.66 C ATOM 895 CG GLU A 56 17.355 -0.878 0.496 1.00 0.77 C ATOM 896 CD GLU A 56 18.798 -1.289 0.282 1.00 1.18 C ATOM 897 OE1 GLU A 56 19.411 -1.842 1.221 1.00 1.38 O ATOM 898 OE2 GLU A 56 19.305 -1.107 -0.846 1.00 1.68 O ATOM 0 H GLU A 56 16.789 3.307 1.068 1.00 0.43 H new ATOM 0 HA GLU A 56 18.944 1.418 0.610 1.00 0.49 H new ATOM 0 HB2 GLU A 56 17.621 0.239 2.278 1.00 0.66 H new ATOM 0 HB3 GLU A 56 16.142 0.601 1.411 1.00 0.66 H new ATOM 0 HG2 GLU A 56 16.830 -1.681 1.013 1.00 0.77 H new ATOM 0 HG3 GLU A 56 16.873 -0.754 -0.474 1.00 0.77 H new ATOM 905 N SER A 57 17.774 1.008 -1.698 1.00 0.45 N ATOM 906 CA SER A 57 17.435 1.190 -3.074 1.00 0.45 C ATOM 907 C SER A 57 15.957 0.944 -3.324 1.00 0.43 C ATOM 908 O SER A 57 15.339 0.036 -2.761 1.00 0.43 O ATOM 909 CB SER A 57 18.299 0.264 -3.935 1.00 0.53 C ATOM 910 OG SER A 57 18.262 -1.067 -3.444 1.00 1.18 O ATOM 0 H SER A 57 18.350 0.187 -1.513 1.00 0.45 H new ATOM 0 HA SER A 57 17.634 2.226 -3.348 1.00 0.45 H new ATOM 0 HB2 SER A 57 17.946 0.285 -4.966 1.00 0.53 H new ATOM 0 HB3 SER A 57 19.328 0.624 -3.943 1.00 0.53 H new ATOM 0 HG SER A 57 18.754 -1.117 -2.598 1.00 1.18 H new ATOM 916 N PRO A 58 15.397 1.779 -4.205 1.00 0.44 N ATOM 917 CA PRO A 58 13.995 1.720 -4.630 1.00 0.43 C ATOM 918 C PRO A 58 13.688 0.377 -5.268 1.00 0.46 C ATOM 919 O PRO A 58 12.533 -0.011 -5.431 1.00 0.46 O ATOM 920 CB PRO A 58 13.883 2.852 -5.666 1.00 0.44 C ATOM 921 CG PRO A 58 15.059 3.739 -5.406 1.00 0.49 C ATOM 922 CD PRO A 58 16.134 2.859 -4.857 1.00 0.52 C ATOM 0 HA PRO A 58 13.294 1.832 -3.803 1.00 0.43 H new ATOM 0 HB2 PRO A 58 13.903 2.459 -6.682 1.00 0.44 H new ATOM 0 HB3 PRO A 58 12.946 3.397 -5.554 1.00 0.44 H new ATOM 0 HG2 PRO A 58 15.387 4.228 -6.323 1.00 0.49 H new ATOM 0 HG3 PRO A 58 14.803 4.527 -4.698 1.00 0.49 H new ATOM 0 HD2 PRO A 58 16.784 2.481 -5.646 1.00 0.52 H new ATOM 0 HD3 PRO A 58 16.768 3.395 -4.151 1.00 0.52 H new ATOM 930 N ALA A 59 14.759 -0.320 -5.605 1.00 0.50 N ATOM 931 CA ALA A 59 14.703 -1.644 -6.178 1.00 0.54 C ATOM 932 C ALA A 59 14.217 -2.652 -5.165 1.00 0.50 C ATOM 933 O ALA A 59 13.262 -3.381 -5.414 1.00 0.51 O ATOM 934 CB ALA A 59 16.080 -2.045 -6.661 1.00 0.64 C ATOM 0 H ALA A 59 15.709 0.030 -5.484 1.00 0.50 H new ATOM 0 HA ALA A 59 14.004 -1.626 -7.014 1.00 0.54 H new ATOM 0 HB1 ALA A 59 16.037 -3.045 -7.093 1.00 0.64 H new ATOM 0 HB2 ALA A 59 16.421 -1.337 -7.416 1.00 0.64 H new ATOM 0 HB3 ALA A 59 16.775 -2.042 -5.821 1.00 0.64 H new ATOM 940 N LYS A 60 14.871 -2.683 -4.013 1.00 0.49 N ATOM 941 CA LYS A 60 14.521 -3.640 -2.989 1.00 0.49 C ATOM 942 C LYS A 60 13.187 -3.252 -2.395 1.00 0.42 C ATOM 943 O LYS A 60 12.471 -4.077 -1.831 1.00 0.43 O ATOM 944 CB LYS A 60 15.598 -3.706 -1.915 1.00 0.58 C ATOM 945 CG LYS A 60 15.413 -4.855 -0.940 1.00 0.65 C ATOM 946 CD LYS A 60 16.749 -5.325 -0.418 1.00 1.35 C ATOM 947 CE LYS A 60 17.437 -4.248 0.391 1.00 2.45 C ATOM 948 NZ LYS A 60 18.919 -4.368 0.344 1.00 3.30 N ATOM 0 H LYS A 60 15.641 -2.059 -3.771 1.00 0.49 H new ATOM 0 HA LYS A 60 14.445 -4.633 -3.431 1.00 0.49 H new ATOM 0 HB2 LYS A 60 16.572 -3.800 -2.394 1.00 0.58 H new ATOM 0 HB3 LYS A 60 15.605 -2.767 -1.361 1.00 0.58 H new ATOM 0 HG2 LYS A 60 14.783 -4.537 -0.109 1.00 0.65 H new ATOM 0 HG3 LYS A 60 14.898 -5.679 -1.434 1.00 0.65 H new ATOM 0 HD2 LYS A 60 16.608 -6.212 0.200 1.00 1.35 H new ATOM 0 HD3 LYS A 60 17.385 -5.617 -1.254 1.00 1.35 H new ATOM 0 HE2 LYS A 60 17.142 -3.269 0.014 1.00 2.45 H new ATOM 0 HE3 LYS A 60 17.103 -4.305 1.427 1.00 2.45 H new ATOM 0 HZ1 LYS A 60 19.347 -3.620 0.926 1.00 3.30 H new ATOM 0 HZ2 LYS A 60 19.204 -5.298 0.712 1.00 3.30 H new ATOM 0 HZ3 LYS A 60 19.244 -4.270 -0.639 1.00 3.30 H new ATOM 962 N LEU A 61 12.867 -1.974 -2.525 1.00 0.37 N ATOM 963 CA LEU A 61 11.551 -1.481 -2.172 1.00 0.35 C ATOM 964 C LEU A 61 10.495 -2.172 -3.028 1.00 0.38 C ATOM 965 O LEU A 61 9.589 -2.830 -2.509 1.00 0.41 O ATOM 966 CB LEU A 61 11.488 0.036 -2.337 1.00 0.34 C ATOM 967 CG LEU A 61 12.289 0.834 -1.296 1.00 0.31 C ATOM 968 CD1 LEU A 61 12.095 2.326 -1.499 1.00 0.34 C ATOM 969 CD2 LEU A 61 11.860 0.432 0.104 1.00 0.30 C ATOM 0 H LEU A 61 13.506 -1.259 -2.874 1.00 0.37 H new ATOM 0 HA LEU A 61 11.351 -1.710 -1.125 1.00 0.35 H new ATOM 0 HB2 LEU A 61 11.853 0.294 -3.331 1.00 0.34 H new ATOM 0 HB3 LEU A 61 10.445 0.349 -2.289 1.00 0.34 H new ATOM 0 HG LEU A 61 13.348 0.608 -1.422 1.00 0.31 H new ATOM 0 HD11 LEU A 61 12.670 2.873 -0.752 1.00 0.34 H new ATOM 0 HD12 LEU A 61 12.437 2.605 -2.496 1.00 0.34 H new ATOM 0 HD13 LEU A 61 11.038 2.573 -1.395 1.00 0.34 H new ATOM 0 HD21 LEU A 61 12.431 1.001 0.837 1.00 0.30 H new ATOM 0 HD22 LEU A 61 10.797 0.639 0.232 1.00 0.30 H new ATOM 0 HD23 LEU A 61 12.043 -0.633 0.249 1.00 0.30 H new ATOM 981 N SER A 62 10.645 -2.085 -4.341 1.00 0.41 N ATOM 982 CA SER A 62 9.727 -2.767 -5.243 1.00 0.46 C ATOM 983 C SER A 62 9.904 -4.281 -5.151 1.00 0.46 C ATOM 984 O SER A 62 9.107 -5.045 -5.689 1.00 0.50 O ATOM 985 CB SER A 62 9.937 -2.278 -6.678 1.00 0.53 C ATOM 986 OG SER A 62 11.311 -2.295 -7.032 1.00 1.29 O ATOM 0 H SER A 62 11.385 -1.555 -4.803 1.00 0.41 H new ATOM 0 HA SER A 62 8.705 -2.531 -4.945 1.00 0.46 H new ATOM 0 HB2 SER A 62 9.374 -2.909 -7.366 1.00 0.53 H new ATOM 0 HB3 SER A 62 9.545 -1.266 -6.781 1.00 0.53 H new ATOM 0 HG SER A 62 11.812 -2.821 -6.374 1.00 1.29 H new ATOM 992 N ASP A 63 10.949 -4.704 -4.448 1.00 0.44 N ATOM 993 CA ASP A 63 11.227 -6.126 -4.277 1.00 0.48 C ATOM 994 C ASP A 63 10.542 -6.694 -3.032 1.00 0.49 C ATOM 995 O ASP A 63 10.193 -7.875 -2.995 1.00 0.60 O ATOM 996 CB ASP A 63 12.738 -6.356 -4.201 1.00 0.53 C ATOM 997 CG ASP A 63 13.111 -7.811 -3.993 1.00 0.87 C ATOM 998 OD1 ASP A 63 12.684 -8.659 -4.810 1.00 1.10 O ATOM 999 OD2 ASP A 63 13.804 -8.122 -3.008 1.00 1.32 O ATOM 0 H ASP A 63 11.616 -4.084 -3.988 1.00 0.44 H new ATOM 0 HA ASP A 63 10.822 -6.651 -5.142 1.00 0.48 H new ATOM 0 HB2 ASP A 63 13.200 -5.997 -5.120 1.00 0.53 H new ATOM 0 HB3 ASP A 63 13.149 -5.762 -3.385 1.00 0.53 H new ATOM 1004 N PHE A 64 10.320 -5.859 -2.017 1.00 0.44 N ATOM 1005 CA PHE A 64 9.773 -6.355 -0.761 1.00 0.48 C ATOM 1006 C PHE A 64 8.244 -6.391 -0.806 1.00 0.51 C ATOM 1007 O PHE A 64 7.631 -7.371 -0.385 1.00 0.61 O ATOM 1008 CB PHE A 64 10.277 -5.530 0.452 1.00 0.51 C ATOM 1009 CG PHE A 64 9.571 -4.215 0.656 1.00 0.46 C ATOM 1010 CD1 PHE A 64 8.352 -4.162 1.290 1.00 0.59 C ATOM 1011 CD2 PHE A 64 10.148 -3.029 0.236 1.00 0.50 C ATOM 1012 CE1 PHE A 64 7.724 -2.954 1.510 1.00 0.59 C ATOM 1013 CE2 PHE A 64 9.531 -1.821 0.460 1.00 0.50 C ATOM 1014 CZ PHE A 64 8.227 -1.813 0.963 1.00 0.47 C ATOM 0 H PHE A 64 10.507 -4.857 -2.040 1.00 0.44 H new ATOM 0 HA PHE A 64 10.132 -7.376 -0.629 1.00 0.48 H new ATOM 0 HB2 PHE A 64 10.165 -6.131 1.354 1.00 0.51 H new ATOM 0 HB3 PHE A 64 11.343 -5.339 0.327 1.00 0.51 H new ATOM 0 HD1 PHE A 64 7.881 -5.076 1.619 1.00 0.59 H new ATOM 0 HD2 PHE A 64 11.099 -3.053 -0.276 1.00 0.50 H new ATOM 0 HE1 PHE A 64 6.832 -2.913 2.117 1.00 0.59 H new ATOM 0 HE2 PHE A 64 10.045 -0.894 0.251 1.00 0.50 H new ATOM 0 HZ PHE A 64 7.628 -0.916 0.919 1.00 0.47 H new ATOM 1024 N LEU A 65 7.625 -5.332 -1.336 1.00 0.49 N ATOM 1025 CA LEU A 65 6.165 -5.223 -1.313 1.00 0.58 C ATOM 1026 C LEU A 65 5.553 -5.857 -2.550 1.00 0.64 C ATOM 1027 O LEU A 65 4.341 -5.806 -2.746 1.00 0.81 O ATOM 1028 CB LEU A 65 5.734 -3.740 -1.153 1.00 0.66 C ATOM 1029 CG LEU A 65 5.708 -2.819 -2.402 1.00 0.78 C ATOM 1030 CD1 LEU A 65 6.825 -3.118 -3.381 1.00 1.25 C ATOM 1031 CD2 LEU A 65 4.361 -2.871 -3.100 1.00 1.50 C ATOM 0 H LEU A 65 8.104 -4.549 -1.780 1.00 0.49 H new ATOM 0 HA LEU A 65 5.789 -5.773 -0.450 1.00 0.58 H new ATOM 0 HB2 LEU A 65 4.734 -3.734 -0.720 1.00 0.66 H new ATOM 0 HB3 LEU A 65 6.400 -3.282 -0.422 1.00 0.66 H new ATOM 0 HG LEU A 65 5.872 -1.807 -2.032 1.00 0.78 H new ATOM 0 HD11 LEU A 65 6.753 -2.441 -4.233 1.00 1.25 H new ATOM 0 HD12 LEU A 65 7.787 -2.980 -2.888 1.00 1.25 H new ATOM 0 HD13 LEU A 65 6.739 -4.148 -3.728 1.00 1.25 H new ATOM 0 HD21 LEU A 65 4.377 -2.215 -3.970 1.00 1.50 H new ATOM 0 HD22 LEU A 65 4.156 -3.893 -3.419 1.00 1.50 H new ATOM 0 HD23 LEU A 65 3.582 -2.543 -2.412 1.00 1.50 H new ATOM 1043 N TYR A 66 6.400 -6.520 -3.331 1.00 0.58 N ATOM 1044 CA TYR A 66 6.063 -6.894 -4.699 1.00 0.64 C ATOM 1045 C TYR A 66 4.742 -7.661 -4.771 1.00 0.72 C ATOM 1046 O TYR A 66 3.733 -7.115 -5.213 1.00 0.89 O ATOM 1047 CB TYR A 66 7.210 -7.710 -5.320 1.00 0.73 C ATOM 1048 CG TYR A 66 6.955 -8.181 -6.737 1.00 0.88 C ATOM 1049 CD1 TYR A 66 6.525 -7.289 -7.713 1.00 0.82 C ATOM 1050 CD2 TYR A 66 7.148 -9.509 -7.102 1.00 1.27 C ATOM 1051 CE1 TYR A 66 6.297 -7.704 -9.011 1.00 1.01 C ATOM 1052 CE2 TYR A 66 6.920 -9.932 -8.399 1.00 1.47 C ATOM 1053 CZ TYR A 66 6.475 -9.067 -9.332 1.00 1.29 C ATOM 1054 OH TYR A 66 6.285 -9.439 -10.646 1.00 1.52 O ATOM 0 H TYR A 66 7.332 -6.811 -3.036 1.00 0.58 H new ATOM 0 HA TYR A 66 5.930 -5.978 -5.275 1.00 0.64 H new ATOM 0 HB2 TYR A 66 8.116 -7.104 -5.310 1.00 0.73 H new ATOM 0 HB3 TYR A 66 7.401 -8.580 -4.691 1.00 0.73 H new ATOM 0 HD1 TYR A 66 6.366 -6.253 -7.452 1.00 0.82 H new ATOM 0 HD2 TYR A 66 7.481 -10.221 -6.361 1.00 1.27 H new ATOM 0 HE1 TYR A 66 5.988 -6.998 -9.767 1.00 1.01 H new ATOM 0 HE2 TYR A 66 7.100 -10.963 -8.666 1.00 1.47 H new ATOM 0 HH TYR A 66 6.438 -10.403 -10.739 1.00 1.52 H new ATOM 1064 N GLN A 67 4.755 -8.908 -4.298 1.00 0.89 N ATOM 1065 CA GLN A 67 3.592 -9.777 -4.293 1.00 1.13 C ATOM 1066 C GLN A 67 4.053 -11.182 -4.041 1.00 1.10 C ATOM 1067 O GLN A 67 5.040 -11.631 -4.619 1.00 1.76 O ATOM 1068 CB GLN A 67 2.793 -9.759 -5.596 1.00 1.54 C ATOM 1069 CG GLN A 67 3.649 -9.824 -6.846 1.00 2.13 C ATOM 1070 CD GLN A 67 2.849 -10.110 -8.093 1.00 2.94 C ATOM 1071 OE1 GLN A 67 1.666 -9.788 -8.181 1.00 3.50 O ATOM 1072 NE2 GLN A 67 3.501 -10.709 -9.074 1.00 3.60 N ATOM 0 H GLN A 67 5.589 -9.343 -3.903 1.00 0.89 H new ATOM 0 HA GLN A 67 2.927 -9.407 -3.512 1.00 1.13 H new ATOM 0 HB2 GLN A 67 2.101 -10.601 -5.598 1.00 1.54 H new ATOM 0 HB3 GLN A 67 2.190 -8.852 -5.628 1.00 1.54 H new ATOM 0 HG2 GLN A 67 4.177 -8.878 -6.968 1.00 2.13 H new ATOM 0 HG3 GLN A 67 4.407 -10.598 -6.721 1.00 2.13 H new ATOM 0 HE21 GLN A 67 4.483 -10.958 -8.956 1.00 3.60 H new ATOM 0 HE22 GLN A 67 3.022 -10.922 -9.949 1.00 3.60 H new ATOM 1081 N THR A 68 3.356 -11.836 -3.141 1.00 0.83 N ATOM 1082 CA THR A 68 3.602 -13.221 -2.773 1.00 0.93 C ATOM 1083 C THR A 68 5.082 -13.511 -2.528 1.00 1.09 C ATOM 1084 O THR A 68 5.568 -14.624 -2.726 1.00 1.39 O ATOM 1085 CB THR A 68 2.983 -14.232 -3.783 1.00 1.18 C ATOM 1086 OG1 THR A 68 2.917 -15.540 -3.198 1.00 1.48 O ATOM 1087 CG2 THR A 68 3.772 -14.303 -5.086 1.00 1.29 C ATOM 0 H THR A 68 2.582 -11.414 -2.629 1.00 0.83 H new ATOM 0 HA THR A 68 3.087 -13.366 -1.823 1.00 0.93 H new ATOM 0 HB THR A 68 1.980 -13.875 -4.016 1.00 1.18 H new ATOM 0 HG1 THR A 68 3.793 -15.778 -2.830 1.00 1.48 H new ATOM 0 HG21 THR A 68 3.301 -15.021 -5.758 1.00 1.29 H new ATOM 0 HG22 THR A 68 3.785 -13.320 -5.557 1.00 1.29 H new ATOM 0 HG23 THR A 68 4.794 -14.619 -4.876 1.00 1.29 H new ATOM 1095 N GLY A 69 5.777 -12.504 -2.046 1.00 1.06 N ATOM 1096 CA GLY A 69 7.183 -12.629 -1.838 1.00 1.39 C ATOM 1097 C GLY A 69 7.473 -13.165 -0.476 1.00 1.17 C ATOM 1098 O GLY A 69 8.248 -14.110 -0.314 1.00 1.46 O ATOM 0 H GLY A 69 5.384 -11.597 -1.795 1.00 1.06 H new ATOM 0 HA2 GLY A 69 7.609 -13.291 -2.592 1.00 1.39 H new ATOM 0 HA3 GLY A 69 7.661 -11.657 -1.960 1.00 1.39 H new ATOM 1102 N ASP A 70 6.750 -12.590 0.475 1.00 0.84 N ATOM 1103 CA ASP A 70 7.029 -12.714 1.894 1.00 0.83 C ATOM 1104 C ASP A 70 6.504 -11.466 2.594 1.00 0.65 C ATOM 1105 O ASP A 70 6.534 -11.370 3.811 1.00 0.61 O ATOM 1106 CB ASP A 70 8.530 -12.881 2.164 1.00 1.12 C ATOM 1107 CG ASP A 70 9.361 -11.644 1.864 1.00 1.45 C ATOM 1108 OD1 ASP A 70 8.898 -10.765 1.103 1.00 2.19 O ATOM 1109 OD2 ASP A 70 10.491 -11.554 2.388 1.00 1.68 O ATOM 0 H ASP A 70 5.935 -12.011 0.274 1.00 0.84 H new ATOM 0 HA ASP A 70 6.534 -13.606 2.278 1.00 0.83 H new ATOM 0 HB2 ASP A 70 8.671 -13.154 3.210 1.00 1.12 H new ATOM 0 HB3 ASP A 70 8.905 -13.710 1.565 1.00 1.12 H new ATOM 1114 N ARG A 71 6.020 -10.511 1.789 1.00 0.60 N ATOM 1115 CA ARG A 71 5.454 -9.266 2.267 1.00 0.51 C ATOM 1116 C ARG A 71 4.458 -9.448 3.407 1.00 0.43 C ATOM 1117 O ARG A 71 4.321 -8.564 4.223 1.00 0.49 O ATOM 1118 CB ARG A 71 4.834 -8.494 1.087 1.00 0.59 C ATOM 1119 CG ARG A 71 4.085 -9.352 0.082 1.00 0.83 C ATOM 1120 CD ARG A 71 2.678 -9.657 0.541 1.00 0.87 C ATOM 1121 NE ARG A 71 2.139 -10.877 -0.073 1.00 1.77 N ATOM 1122 CZ ARG A 71 2.666 -12.097 0.095 1.00 2.46 C ATOM 1123 NH1 ARG A 71 3.824 -12.250 0.724 1.00 2.69 N ATOM 1124 NH2 ARG A 71 2.035 -13.168 -0.367 1.00 3.38 N ATOM 0 H ARG A 71 6.016 -10.594 0.772 1.00 0.60 H new ATOM 0 HA ARG A 71 6.269 -8.681 2.694 1.00 0.51 H new ATOM 0 HB2 ARG A 71 4.150 -7.743 1.483 1.00 0.59 H new ATOM 0 HB3 ARG A 71 5.627 -7.959 0.565 1.00 0.59 H new ATOM 0 HG2 ARG A 71 4.050 -8.839 -0.879 1.00 0.83 H new ATOM 0 HG3 ARG A 71 4.626 -10.285 -0.074 1.00 0.83 H new ATOM 0 HD2 ARG A 71 2.668 -9.765 1.626 1.00 0.87 H new ATOM 0 HD3 ARG A 71 2.030 -8.815 0.299 1.00 0.87 H new ATOM 0 HE ARG A 71 1.312 -10.790 -0.664 1.00 1.77 H new ATOM 0 HH11 ARG A 71 4.320 -11.435 1.084 1.00 2.69 H new ATOM 0 HH12 ARG A 71 4.218 -13.183 0.847 1.00 2.69 H new ATOM 0 HH21 ARG A 71 1.144 -13.065 -0.853 1.00 3.38 H new ATOM 0 HH22 ARG A 71 2.441 -14.095 -0.236 1.00 3.38 H new ATOM 1138 N ILE A 72 3.781 -10.591 3.490 1.00 0.44 N ATOM 1139 CA ILE A 72 2.839 -10.786 4.603 1.00 0.44 C ATOM 1140 C ILE A 72 3.517 -11.466 5.778 1.00 0.54 C ATOM 1141 O ILE A 72 2.987 -11.486 6.885 1.00 0.64 O ATOM 1142 CB ILE A 72 1.582 -11.616 4.247 1.00 0.45 C ATOM 1143 CG1 ILE A 72 1.901 -13.116 4.159 1.00 0.62 C ATOM 1144 CG2 ILE A 72 0.961 -11.119 2.962 1.00 0.47 C ATOM 1145 CD1 ILE A 72 2.046 -13.661 2.764 1.00 0.71 C ATOM 0 H ILE A 72 3.856 -11.369 2.834 1.00 0.44 H new ATOM 0 HA ILE A 72 2.513 -9.777 4.855 1.00 0.44 H new ATOM 0 HB ILE A 72 0.859 -11.484 5.052 1.00 0.45 H new ATOM 0 HG12 ILE A 72 2.826 -13.307 4.704 1.00 0.62 H new ATOM 0 HG13 ILE A 72 1.111 -13.669 4.667 1.00 0.62 H new ATOM 0 HG21 ILE A 72 0.079 -11.716 2.730 1.00 0.47 H new ATOM 0 HG22 ILE A 72 0.672 -10.074 3.078 1.00 0.47 H new ATOM 0 HG23 ILE A 72 1.683 -11.208 2.151 1.00 0.47 H new ATOM 0 HD11 ILE A 72 2.270 -14.727 2.811 1.00 0.71 H new ATOM 0 HD12 ILE A 72 1.116 -13.510 2.216 1.00 0.71 H new ATOM 0 HD13 ILE A 72 2.857 -13.142 2.253 1.00 0.71 H new ATOM 1157 N THR A 73 4.686 -12.026 5.540 1.00 0.59 N ATOM 1158 CA THR A 73 5.337 -12.809 6.559 1.00 0.72 C ATOM 1159 C THR A 73 6.158 -11.907 7.473 1.00 0.74 C ATOM 1160 O THR A 73 6.362 -12.224 8.643 1.00 0.88 O ATOM 1161 CB THR A 73 6.226 -13.931 5.961 1.00 0.81 C ATOM 1162 OG1 THR A 73 6.255 -15.051 6.851 1.00 0.97 O ATOM 1163 CG2 THR A 73 7.656 -13.459 5.708 1.00 0.80 C ATOM 0 H THR A 73 5.196 -11.953 4.660 1.00 0.59 H new ATOM 0 HA THR A 73 4.556 -13.297 7.143 1.00 0.72 H new ATOM 0 HB THR A 73 5.789 -14.215 5.003 1.00 0.81 H new ATOM 0 HG1 THR A 73 6.757 -14.814 7.659 1.00 0.97 H new ATOM 0 HG21 THR A 73 8.241 -14.278 5.289 1.00 0.80 H new ATOM 0 HG22 THR A 73 7.645 -12.625 5.006 1.00 0.80 H new ATOM 0 HG23 THR A 73 8.104 -13.136 6.648 1.00 0.80 H new ATOM 1171 N TRP A 74 6.627 -10.781 6.938 1.00 0.64 N ATOM 1172 CA TRP A 74 7.395 -9.838 7.750 1.00 0.66 C ATOM 1173 C TRP A 74 6.592 -8.579 8.075 1.00 0.63 C ATOM 1174 O TRP A 74 7.054 -7.718 8.832 1.00 0.75 O ATOM 1175 CB TRP A 74 8.710 -9.461 7.052 1.00 0.66 C ATOM 1176 CG TRP A 74 8.557 -9.035 5.620 1.00 0.59 C ATOM 1177 CD1 TRP A 74 8.951 -9.732 4.518 1.00 0.66 C ATOM 1178 CD2 TRP A 74 7.977 -7.819 5.133 1.00 0.53 C ATOM 1179 NE1 TRP A 74 8.647 -9.029 3.380 1.00 0.65 N ATOM 1180 CE2 TRP A 74 8.052 -7.851 3.731 1.00 0.58 C ATOM 1181 CE3 TRP A 74 7.403 -6.708 5.744 1.00 0.52 C ATOM 1182 CZ2 TRP A 74 7.569 -6.817 2.937 1.00 0.62 C ATOM 1183 CZ3 TRP A 74 6.926 -5.687 4.959 1.00 0.56 C ATOM 1184 CH2 TRP A 74 7.011 -5.742 3.570 1.00 0.61 C ATOM 0 H TRP A 74 6.493 -10.503 5.966 1.00 0.64 H new ATOM 0 HA TRP A 74 7.624 -10.339 8.691 1.00 0.66 H new ATOM 0 HB2 TRP A 74 9.183 -8.653 7.609 1.00 0.66 H new ATOM 0 HB3 TRP A 74 9.386 -10.315 7.093 1.00 0.66 H new ATOM 0 HD1 TRP A 74 9.433 -10.698 4.537 1.00 0.66 H new ATOM 0 HE1 TRP A 74 8.835 -9.336 2.426 1.00 0.65 H new ATOM 0 HE3 TRP A 74 7.334 -6.650 6.820 1.00 0.52 H new ATOM 0 HZ2 TRP A 74 7.632 -6.862 1.860 1.00 0.62 H new ATOM 0 HZ3 TRP A 74 6.476 -4.824 5.428 1.00 0.56 H new ATOM 0 HH2 TRP A 74 6.629 -4.920 2.982 1.00 0.61 H new ATOM 1195 N ASP A 75 5.394 -8.480 7.508 1.00 0.55 N ATOM 1196 CA ASP A 75 4.594 -7.259 7.613 1.00 0.58 C ATOM 1197 C ASP A 75 4.034 -7.079 9.018 1.00 0.58 C ATOM 1198 O ASP A 75 4.183 -7.941 9.886 1.00 0.73 O ATOM 1199 CB ASP A 75 3.444 -7.288 6.607 1.00 0.83 C ATOM 1200 CG ASP A 75 2.920 -5.903 6.265 1.00 1.44 C ATOM 1201 OD1 ASP A 75 2.076 -5.380 7.024 1.00 1.44 O ATOM 1202 OD2 ASP A 75 3.348 -5.343 5.242 1.00 2.19 O ATOM 0 H ASP A 75 4.954 -9.228 6.971 1.00 0.55 H new ATOM 0 HA ASP A 75 5.251 -6.417 7.393 1.00 0.58 H new ATOM 0 HB2 ASP A 75 3.780 -7.779 5.694 1.00 0.83 H new ATOM 0 HB3 ASP A 75 2.630 -7.889 7.011 1.00 0.83 H new ATOM 1207 N LYS A 76 3.387 -5.945 9.225 1.00 0.58 N ATOM 1208 CA LYS A 76 2.837 -5.588 10.521 1.00 0.65 C ATOM 1209 C LYS A 76 1.318 -5.668 10.475 1.00 0.62 C ATOM 1210 O LYS A 76 0.655 -5.844 11.498 1.00 0.75 O ATOM 1211 CB LYS A 76 3.226 -4.157 10.888 1.00 0.88 C ATOM 1212 CG LYS A 76 4.506 -3.686 10.231 1.00 0.78 C ATOM 1213 CD LYS A 76 5.728 -4.406 10.772 1.00 1.63 C ATOM 1214 CE LYS A 76 6.262 -3.756 12.025 1.00 1.97 C ATOM 1215 NZ LYS A 76 7.630 -4.248 12.363 1.00 3.19 N ATOM 0 H LYS A 76 3.228 -5.246 8.499 1.00 0.58 H new ATOM 0 HA LYS A 76 3.233 -6.282 11.262 1.00 0.65 H new ATOM 0 HB2 LYS A 76 2.415 -3.486 10.606 1.00 0.88 H new ATOM 0 HB3 LYS A 76 3.336 -4.086 11.970 1.00 0.88 H new ATOM 0 HG2 LYS A 76 4.440 -3.845 9.155 1.00 0.78 H new ATOM 0 HG3 LYS A 76 4.619 -2.613 10.388 1.00 0.78 H new ATOM 0 HD2 LYS A 76 5.472 -5.444 10.984 1.00 1.63 H new ATOM 0 HD3 LYS A 76 6.508 -4.419 10.010 1.00 1.63 H new ATOM 0 HE2 LYS A 76 6.287 -2.675 11.891 1.00 1.97 H new ATOM 0 HE3 LYS A 76 5.587 -3.959 12.856 1.00 1.97 H new ATOM 0 HZ1 LYS A 76 7.922 -3.857 13.281 1.00 3.19 H new ATOM 0 HZ2 LYS A 76 7.622 -5.287 12.415 1.00 3.19 H new ATOM 0 HZ3 LYS A 76 8.300 -3.943 11.628 1.00 3.19 H new ATOM 1229 N SER A 77 0.777 -5.508 9.274 1.00 0.61 N ATOM 1230 CA SER A 77 -0.657 -5.414 9.083 1.00 0.72 C ATOM 1231 C SER A 77 -1.143 -6.411 8.029 1.00 0.61 C ATOM 1232 O SER A 77 -2.295 -6.356 7.602 1.00 0.65 O ATOM 1233 CB SER A 77 -1.014 -3.989 8.655 1.00 0.91 C ATOM 1234 OG SER A 77 -0.269 -3.033 9.397 1.00 1.58 O ATOM 0 H SER A 77 1.319 -5.441 8.413 1.00 0.61 H new ATOM 0 HA SER A 77 -1.150 -5.656 10.025 1.00 0.72 H new ATOM 0 HB2 SER A 77 -0.815 -3.864 7.591 1.00 0.91 H new ATOM 0 HB3 SER A 77 -2.080 -3.818 8.802 1.00 0.91 H new ATOM 0 HG SER A 77 -0.883 -2.459 9.901 1.00 1.58 H new ATOM 1240 N LEU A 78 -0.284 -7.339 7.635 1.00 0.54 N ATOM 1241 CA LEU A 78 -0.648 -8.309 6.603 1.00 0.50 C ATOM 1242 C LEU A 78 -0.872 -9.691 7.193 1.00 0.53 C ATOM 1243 O LEU A 78 -0.313 -10.037 8.231 1.00 0.71 O ATOM 1244 CB LEU A 78 0.428 -8.401 5.516 1.00 0.45 C ATOM 1245 CG LEU A 78 0.430 -7.277 4.478 1.00 0.45 C ATOM 1246 CD1 LEU A 78 1.412 -7.595 3.347 1.00 0.49 C ATOM 1247 CD2 LEU A 78 -0.979 -7.064 3.938 1.00 0.51 C ATOM 0 H LEU A 78 0.660 -7.444 8.007 1.00 0.54 H new ATOM 0 HA LEU A 78 -1.578 -7.955 6.158 1.00 0.50 H new ATOM 0 HB2 LEU A 78 1.404 -8.423 6.000 1.00 0.45 H new ATOM 0 HB3 LEU A 78 0.309 -9.351 4.994 1.00 0.45 H new ATOM 0 HG LEU A 78 0.758 -6.353 4.955 1.00 0.45 H new ATOM 0 HD11 LEU A 78 1.401 -6.785 2.617 1.00 0.49 H new ATOM 0 HD12 LEU A 78 2.417 -7.701 3.756 1.00 0.49 H new ATOM 0 HD13 LEU A 78 1.118 -8.525 2.861 1.00 0.49 H new ATOM 0 HD21 LEU A 78 -0.968 -6.262 3.200 1.00 0.51 H new ATOM 0 HD22 LEU A 78 -1.332 -7.983 3.470 1.00 0.51 H new ATOM 0 HD23 LEU A 78 -1.646 -6.794 4.757 1.00 0.51 H new ATOM 1259 N GLN A 79 -1.716 -10.464 6.527 1.00 0.46 N ATOM 1260 CA GLN A 79 -2.011 -11.824 6.942 1.00 0.50 C ATOM 1261 C GLN A 79 -1.617 -12.824 5.869 1.00 0.48 C ATOM 1262 O GLN A 79 -0.662 -13.584 6.024 1.00 0.55 O ATOM 1263 CB GLN A 79 -3.505 -12.006 7.238 1.00 0.56 C ATOM 1264 CG GLN A 79 -3.960 -11.436 8.560 1.00 0.55 C ATOM 1265 CD GLN A 79 -5.285 -12.011 9.029 1.00 1.03 C ATOM 1266 OE1 GLN A 79 -5.615 -13.162 8.739 1.00 1.66 O ATOM 1267 NE2 GLN A 79 -6.062 -11.216 9.744 1.00 1.73 N ATOM 0 H GLN A 79 -2.213 -10.167 5.687 1.00 0.46 H new ATOM 0 HA GLN A 79 -1.432 -12.005 7.847 1.00 0.50 H new ATOM 0 HB2 GLN A 79 -4.080 -11.538 6.439 1.00 0.56 H new ATOM 0 HB3 GLN A 79 -3.739 -13.070 7.217 1.00 0.56 H new ATOM 0 HG2 GLN A 79 -3.198 -11.631 9.315 1.00 0.55 H new ATOM 0 HG3 GLN A 79 -4.051 -10.353 8.471 1.00 0.55 H new ATOM 0 HE21 GLN A 79 -5.756 -10.268 9.965 1.00 1.73 H new ATOM 0 HE22 GLN A 79 -6.967 -11.550 10.074 1.00 1.73 H new ATOM 1276 N VAL A 80 -2.371 -12.816 4.777 1.00 0.41 N ATOM 1277 CA VAL A 80 -2.313 -13.886 3.790 1.00 0.43 C ATOM 1278 C VAL A 80 -2.607 -13.343 2.392 1.00 0.39 C ATOM 1279 O VAL A 80 -3.646 -12.733 2.181 1.00 0.45 O ATOM 1280 CB VAL A 80 -3.367 -14.976 4.114 1.00 0.48 C ATOM 1281 CG1 VAL A 80 -3.194 -16.182 3.205 1.00 0.78 C ATOM 1282 CG2 VAL A 80 -3.319 -15.387 5.587 1.00 0.74 C ATOM 0 H VAL A 80 -3.034 -12.075 4.552 1.00 0.41 H new ATOM 0 HA VAL A 80 -1.310 -14.311 3.821 1.00 0.43 H new ATOM 0 HB VAL A 80 -4.352 -14.547 3.928 1.00 0.48 H new ATOM 0 HG11 VAL A 80 -3.944 -16.933 3.451 1.00 0.78 H new ATOM 0 HG12 VAL A 80 -3.315 -15.875 2.166 1.00 0.78 H new ATOM 0 HG13 VAL A 80 -2.199 -16.604 3.345 1.00 0.78 H new ATOM 0 HG21 VAL A 80 -4.072 -16.152 5.776 1.00 0.74 H new ATOM 0 HG22 VAL A 80 -2.331 -15.784 5.822 1.00 0.74 H new ATOM 0 HG23 VAL A 80 -3.520 -14.518 6.214 1.00 0.74 H new ATOM 1292 N TYR A 81 -1.708 -13.555 1.438 1.00 0.42 N ATOM 1293 CA TYR A 81 -1.962 -13.110 0.071 1.00 0.46 C ATOM 1294 C TYR A 81 -2.204 -14.292 -0.857 1.00 0.51 C ATOM 1295 O TYR A 81 -1.559 -15.334 -0.739 1.00 0.78 O ATOM 1296 CB TYR A 81 -0.807 -12.251 -0.448 1.00 0.74 C ATOM 1297 CG TYR A 81 -0.829 -12.029 -1.949 1.00 1.91 C ATOM 1298 CD1 TYR A 81 -1.711 -11.121 -2.524 1.00 3.05 C ATOM 1299 CD2 TYR A 81 0.033 -12.717 -2.787 1.00 2.02 C ATOM 1300 CE1 TYR A 81 -1.731 -10.909 -3.890 1.00 4.21 C ATOM 1301 CE2 TYR A 81 0.016 -12.509 -4.150 1.00 3.15 C ATOM 1302 CZ TYR A 81 -0.868 -11.640 -4.703 1.00 4.24 C ATOM 1303 OH TYR A 81 -0.883 -11.400 -6.059 1.00 5.40 O ATOM 0 H TYR A 81 -0.813 -14.023 1.580 1.00 0.42 H new ATOM 0 HA TYR A 81 -2.865 -12.500 0.086 1.00 0.46 H new ATOM 0 HB2 TYR A 81 -0.834 -11.283 0.053 1.00 0.74 H new ATOM 0 HB3 TYR A 81 0.136 -12.725 -0.175 1.00 0.74 H new ATOM 0 HD1 TYR A 81 -2.393 -10.571 -1.892 1.00 3.05 H new ATOM 0 HD2 TYR A 81 0.729 -13.427 -2.366 1.00 2.02 H new ATOM 0 HE1 TYR A 81 -2.407 -10.186 -4.321 1.00 4.21 H new ATOM 0 HE2 TYR A 81 0.711 -13.041 -4.782 1.00 3.15 H new ATOM 0 HH TYR A 81 0.033 -11.256 -6.376 1.00 5.40 H new ATOM 1313 N ASN A 82 -3.128 -14.096 -1.788 1.00 0.42 N ATOM 1314 CA ASN A 82 -3.522 -15.091 -2.765 1.00 0.46 C ATOM 1315 C ASN A 82 -3.645 -14.400 -4.113 1.00 0.44 C ATOM 1316 O ASN A 82 -4.427 -13.460 -4.274 1.00 0.45 O ATOM 1317 CB ASN A 82 -4.867 -15.737 -2.397 1.00 0.50 C ATOM 1318 CG ASN A 82 -4.762 -16.921 -1.439 1.00 0.93 C ATOM 1319 OD1 ASN A 82 -3.716 -16.973 -0.631 1.00 1.69 O flip ATOM 1320 ND2 ASN A 82 -5.625 -17.800 -1.441 1.00 1.40 N flip ATOM 0 H ASN A 82 -3.635 -13.216 -1.883 1.00 0.42 H new ATOM 0 HA ASN A 82 -2.772 -15.881 -2.794 1.00 0.46 H new ATOM 0 HB2 ASN A 82 -5.509 -14.979 -1.948 1.00 0.50 H new ATOM 0 HB3 ASN A 82 -5.358 -16.069 -3.312 1.00 0.50 H new ATOM 0 HD21 ASN A 82 -6.421 -17.732 -2.076 1.00 1.40 H new ATOM 0 HD22 ASN A 82 -5.544 -18.596 -0.808 1.00 1.40 H new ATOM 1327 N MET A 83 -2.841 -14.838 -5.052 1.00 0.47 N ATOM 1328 CA MET A 83 -2.819 -14.272 -6.392 1.00 0.48 C ATOM 1329 C MET A 83 -4.125 -14.616 -7.109 1.00 0.47 C ATOM 1330 O MET A 83 -4.345 -15.772 -7.477 1.00 0.57 O ATOM 1331 CB MET A 83 -1.619 -14.882 -7.101 1.00 0.58 C ATOM 1332 CG MET A 83 -0.811 -13.929 -7.977 1.00 0.63 C ATOM 1333 SD MET A 83 0.694 -14.715 -8.588 1.00 1.66 S ATOM 1334 CE MET A 83 1.663 -13.287 -9.057 1.00 2.05 C ATOM 0 H MET A 83 -2.178 -15.601 -4.914 1.00 0.47 H new ATOM 0 HA MET A 83 -2.733 -13.186 -6.377 1.00 0.48 H new ATOM 0 HB2 MET A 83 -0.954 -15.307 -6.349 1.00 0.58 H new ATOM 0 HB3 MET A 83 -1.968 -15.708 -7.721 1.00 0.58 H new ATOM 0 HG2 MET A 83 -1.420 -13.601 -8.819 1.00 0.63 H new ATOM 0 HG3 MET A 83 -0.552 -13.038 -7.405 1.00 0.63 H new ATOM 0 HE1 MET A 83 2.294 -13.540 -9.909 1.00 2.05 H new ATOM 0 HE2 MET A 83 0.997 -12.469 -9.329 1.00 2.05 H new ATOM 0 HE3 MET A 83 2.289 -12.981 -8.219 1.00 2.05 H new ATOM 1344 N VAL A 84 -5.007 -13.627 -7.293 1.00 0.38 N ATOM 1345 CA VAL A 84 -6.359 -13.924 -7.785 1.00 0.39 C ATOM 1346 C VAL A 84 -6.389 -14.019 -9.298 1.00 0.42 C ATOM 1347 O VAL A 84 -6.546 -15.102 -9.864 1.00 0.64 O ATOM 1348 CB VAL A 84 -7.418 -12.881 -7.356 1.00 0.38 C ATOM 1349 CG1 VAL A 84 -8.606 -13.555 -6.690 1.00 0.55 C ATOM 1350 CG2 VAL A 84 -6.832 -11.816 -6.455 1.00 0.42 C ATOM 0 H VAL A 84 -4.818 -12.641 -7.115 1.00 0.38 H new ATOM 0 HA VAL A 84 -6.613 -14.882 -7.331 1.00 0.39 H new ATOM 0 HB VAL A 84 -7.766 -12.385 -8.262 1.00 0.38 H new ATOM 0 HG11 VAL A 84 -9.336 -12.800 -6.398 1.00 0.55 H new ATOM 0 HG12 VAL A 84 -9.066 -14.254 -7.388 1.00 0.55 H new ATOM 0 HG13 VAL A 84 -8.269 -14.095 -5.805 1.00 0.55 H new ATOM 0 HG21 VAL A 84 -7.610 -11.105 -6.178 1.00 0.42 H new ATOM 0 HG22 VAL A 84 -6.429 -12.282 -5.555 1.00 0.42 H new ATOM 0 HG23 VAL A 84 -6.033 -11.293 -6.981 1.00 0.42 H new ATOM 1360 N HIS A 85 -6.251 -12.880 -9.953 1.00 0.30 N ATOM 1361 CA HIS A 85 -6.301 -12.834 -11.398 1.00 0.31 C ATOM 1362 C HIS A 85 -5.222 -11.907 -11.922 1.00 0.32 C ATOM 1363 O HIS A 85 -5.291 -10.695 -11.744 1.00 0.38 O ATOM 1364 CB HIS A 85 -7.683 -12.366 -11.870 1.00 0.37 C ATOM 1365 CG HIS A 85 -7.984 -12.714 -13.298 1.00 0.80 C ATOM 1366 ND1 HIS A 85 -8.761 -13.793 -13.655 1.00 1.36 N ATOM 1367 CD2 HIS A 85 -7.617 -12.117 -14.458 1.00 1.71 C ATOM 1368 CE1 HIS A 85 -8.856 -13.849 -14.968 1.00 1.75 C ATOM 1369 NE2 HIS A 85 -8.174 -12.843 -15.483 1.00 1.96 N ATOM 0 H HIS A 85 -6.104 -11.976 -9.504 1.00 0.30 H new ATOM 0 HA HIS A 85 -6.126 -13.836 -11.789 1.00 0.31 H new ATOM 0 HB2 HIS A 85 -8.445 -12.809 -11.229 1.00 0.37 H new ATOM 0 HB3 HIS A 85 -7.752 -11.285 -11.747 1.00 0.37 H new ATOM 0 HD1 HIS A 85 -9.196 -14.447 -13.004 1.00 1.36 H new ATOM 0 HD2 HIS A 85 -7.002 -11.235 -14.558 1.00 1.71 H new ATOM 0 HE1 HIS A 85 -9.401 -14.594 -15.529 1.00 1.75 H new ATOM 1378 N ARG A 86 -4.212 -12.488 -12.533 1.00 0.34 N ATOM 1379 CA ARG A 86 -3.157 -11.722 -13.166 1.00 0.36 C ATOM 1380 C ARG A 86 -3.580 -11.354 -14.571 1.00 0.38 C ATOM 1381 O ARG A 86 -4.029 -12.203 -15.342 1.00 0.52 O ATOM 1382 CB ARG A 86 -1.875 -12.527 -13.178 1.00 0.40 C ATOM 1383 CG ARG A 86 -1.317 -12.774 -11.789 1.00 0.45 C ATOM 1384 CD ARG A 86 -0.245 -13.836 -11.842 1.00 0.69 C ATOM 1385 NE ARG A 86 0.965 -13.347 -12.501 1.00 1.15 N ATOM 1386 CZ ARG A 86 1.828 -14.119 -13.159 1.00 1.68 C ATOM 1387 NH1 ARG A 86 1.631 -15.429 -13.245 1.00 1.98 N ATOM 1388 NH2 ARG A 86 2.898 -13.576 -13.731 1.00 2.44 N ATOM 0 H ARG A 86 -4.098 -13.499 -12.606 1.00 0.34 H new ATOM 0 HA ARG A 86 -2.977 -10.805 -12.605 1.00 0.36 H new ATOM 0 HB2 ARG A 86 -2.058 -13.485 -13.665 1.00 0.40 H new ATOM 0 HB3 ARG A 86 -1.129 -12.003 -13.775 1.00 0.40 H new ATOM 0 HG2 ARG A 86 -0.904 -11.850 -11.385 1.00 0.45 H new ATOM 0 HG3 ARG A 86 -2.117 -13.087 -11.118 1.00 0.45 H new ATOM 0 HD2 ARG A 86 -0.003 -14.160 -10.830 1.00 0.69 H new ATOM 0 HD3 ARG A 86 -0.623 -14.709 -12.375 1.00 0.69 H new ATOM 0 HE ARG A 86 1.161 -12.347 -12.454 1.00 1.15 H new ATOM 0 HH11 ARG A 86 0.814 -15.852 -12.805 1.00 1.98 H new ATOM 0 HH12 ARG A 86 2.297 -16.013 -13.751 1.00 1.98 H new ATOM 0 HH21 ARG A 86 3.056 -12.571 -13.665 1.00 2.44 H new ATOM 0 HH22 ARG A 86 3.561 -14.165 -14.236 1.00 2.44 H new ATOM 1402 N ILE A 87 -3.455 -10.081 -14.884 1.00 0.35 N ATOM 1403 CA ILE A 87 -3.971 -9.547 -16.129 1.00 0.36 C ATOM 1404 C ILE A 87 -2.940 -9.702 -17.224 1.00 0.39 C ATOM 1405 O ILE A 87 -3.202 -10.276 -18.281 1.00 0.47 O ATOM 1406 CB ILE A 87 -4.318 -8.045 -16.013 1.00 0.38 C ATOM 1407 CG1 ILE A 87 -4.561 -7.621 -14.557 1.00 0.32 C ATOM 1408 CG2 ILE A 87 -5.536 -7.737 -16.853 1.00 0.44 C ATOM 1409 CD1 ILE A 87 -5.686 -8.350 -13.872 1.00 0.27 C ATOM 0 H ILE A 87 -2.997 -9.391 -14.288 1.00 0.35 H new ATOM 0 HA ILE A 87 -4.878 -10.105 -16.363 1.00 0.36 H new ATOM 0 HB ILE A 87 -3.463 -7.477 -16.380 1.00 0.38 H new ATOM 0 HG12 ILE A 87 -3.644 -7.778 -13.989 1.00 0.32 H new ATOM 0 HG13 ILE A 87 -4.771 -6.552 -14.534 1.00 0.32 H new ATOM 0 HG21 ILE A 87 -5.778 -6.677 -16.769 1.00 0.44 H new ATOM 0 HG22 ILE A 87 -5.330 -7.981 -17.895 1.00 0.44 H new ATOM 0 HG23 ILE A 87 -6.380 -8.331 -16.502 1.00 0.44 H new ATOM 0 HD11 ILE A 87 -5.785 -7.987 -12.849 1.00 0.27 H new ATOM 0 HD12 ILE A 87 -6.616 -8.173 -14.412 1.00 0.27 H new ATOM 0 HD13 ILE A 87 -5.472 -9.419 -13.858 1.00 0.27 H new ATOM 1421 N ASP A 88 -1.763 -9.182 -16.947 1.00 0.42 N ATOM 1422 CA ASP A 88 -0.674 -9.188 -17.898 1.00 0.56 C ATOM 1423 C ASP A 88 0.602 -9.582 -17.178 1.00 0.67 C ATOM 1424 O ASP A 88 0.573 -10.421 -16.274 1.00 1.18 O ATOM 1425 CB ASP A 88 -0.515 -7.800 -18.533 1.00 0.65 C ATOM 1426 CG ASP A 88 -1.800 -7.271 -19.144 1.00 1.16 C ATOM 1427 OD1 ASP A 88 -2.586 -6.623 -18.423 1.00 1.86 O ATOM 1428 OD2 ASP A 88 -2.035 -7.520 -20.347 1.00 1.35 O ATOM 0 H ASP A 88 -1.535 -8.743 -16.055 1.00 0.42 H new ATOM 0 HA ASP A 88 -0.885 -9.905 -18.692 1.00 0.56 H new ATOM 0 HB2 ASP A 88 -0.165 -7.099 -17.775 1.00 0.65 H new ATOM 0 HB3 ASP A 88 0.254 -7.846 -19.304 1.00 0.65 H new ATOM 1433 N SER A 89 1.712 -8.977 -17.555 1.00 0.65 N ATOM 1434 CA SER A 89 2.966 -9.220 -16.870 1.00 0.70 C ATOM 1435 C SER A 89 3.185 -8.147 -15.806 1.00 0.53 C ATOM 1436 O SER A 89 4.040 -8.289 -14.925 1.00 0.59 O ATOM 1437 CB SER A 89 4.120 -9.218 -17.878 1.00 0.94 C ATOM 1438 OG SER A 89 5.270 -9.869 -17.360 1.00 1.44 O ATOM 0 H SER A 89 1.771 -8.316 -18.329 1.00 0.65 H new ATOM 0 HA SER A 89 2.931 -10.195 -16.385 1.00 0.70 H new ATOM 0 HB2 SER A 89 3.803 -9.714 -18.795 1.00 0.94 H new ATOM 0 HB3 SER A 89 4.371 -8.191 -18.142 1.00 0.94 H new ATOM 0 HG SER A 89 5.986 -9.851 -18.029 1.00 1.44 H new ATOM 1444 N ASP A 90 2.375 -7.091 -15.865 1.00 0.47 N ATOM 1445 CA ASP A 90 2.591 -5.917 -15.035 1.00 0.48 C ATOM 1446 C ASP A 90 1.320 -5.554 -14.290 1.00 0.39 C ATOM 1447 O ASP A 90 1.279 -4.557 -13.570 1.00 0.41 O ATOM 1448 CB ASP A 90 3.018 -4.723 -15.899 1.00 0.73 C ATOM 1449 CG ASP A 90 4.214 -5.014 -16.788 1.00 1.21 C ATOM 1450 OD1 ASP A 90 4.044 -5.688 -17.826 1.00 1.87 O ATOM 1451 OD2 ASP A 90 5.338 -4.593 -16.434 1.00 1.70 O ATOM 0 H ASP A 90 1.564 -7.029 -16.481 1.00 0.47 H new ATOM 0 HA ASP A 90 3.379 -6.151 -14.319 1.00 0.48 H new ATOM 0 HB2 ASP A 90 2.178 -4.417 -16.523 1.00 0.73 H new ATOM 0 HB3 ASP A 90 3.255 -3.881 -15.249 1.00 0.73 H new ATOM 1456 N THR A 91 0.283 -6.369 -14.446 1.00 0.35 N ATOM 1457 CA THR A 91 -1.005 -6.028 -13.922 1.00 0.32 C ATOM 1458 C THR A 91 -1.553 -7.219 -13.182 1.00 0.28 C ATOM 1459 O THR A 91 -1.677 -8.308 -13.750 1.00 0.30 O ATOM 1460 CB THR A 91 -1.977 -5.627 -15.044 1.00 0.36 C ATOM 1461 OG1 THR A 91 -1.256 -5.355 -16.256 1.00 0.46 O ATOM 1462 CG2 THR A 91 -2.773 -4.400 -14.645 1.00 0.35 C ATOM 0 H THR A 91 0.323 -7.265 -14.932 1.00 0.35 H new ATOM 0 HA THR A 91 -0.898 -5.175 -13.252 1.00 0.32 H new ATOM 0 HB THR A 91 -2.663 -6.458 -15.212 1.00 0.36 H new ATOM 0 HG1 THR A 91 -1.707 -5.790 -17.009 1.00 0.46 H new ATOM 0 HG21 THR A 91 -3.455 -4.131 -15.451 1.00 0.35 H new ATOM 0 HG22 THR A 91 -3.345 -4.615 -13.742 1.00 0.35 H new ATOM 0 HG23 THR A 91 -2.092 -3.571 -14.454 1.00 0.35 H new ATOM 1470 N PHE A 92 -1.839 -7.036 -11.918 1.00 0.25 N ATOM 1471 CA PHE A 92 -2.344 -8.118 -11.110 1.00 0.25 C ATOM 1472 C PHE A 92 -3.535 -7.659 -10.308 1.00 0.22 C ATOM 1473 O PHE A 92 -3.905 -6.491 -10.341 1.00 0.21 O ATOM 1474 CB PHE A 92 -1.287 -8.624 -10.131 1.00 0.30 C ATOM 1475 CG PHE A 92 0.061 -8.844 -10.733 1.00 0.32 C ATOM 1476 CD1 PHE A 92 0.932 -7.790 -10.884 1.00 0.33 C ATOM 1477 CD2 PHE A 92 0.449 -10.102 -11.158 1.00 0.39 C ATOM 1478 CE1 PHE A 92 2.171 -7.974 -11.446 1.00 0.38 C ATOM 1479 CE2 PHE A 92 1.688 -10.303 -11.722 1.00 0.43 C ATOM 1480 CZ PHE A 92 2.569 -9.269 -11.829 1.00 0.41 C ATOM 0 H PHE A 92 -1.731 -6.149 -11.426 1.00 0.25 H new ATOM 0 HA PHE A 92 -2.624 -8.922 -11.791 1.00 0.25 H new ATOM 0 HB2 PHE A 92 -1.194 -7.908 -9.315 1.00 0.30 H new ATOM 0 HB3 PHE A 92 -1.633 -9.561 -9.695 1.00 0.30 H new ATOM 0 HD1 PHE A 92 0.637 -6.804 -10.556 1.00 0.33 H new ATOM 0 HD2 PHE A 92 -0.228 -10.936 -11.046 1.00 0.39 H new ATOM 0 HE1 PHE A 92 2.834 -7.134 -11.593 1.00 0.38 H new ATOM 0 HE2 PHE A 92 1.963 -11.284 -12.081 1.00 0.43 H new ATOM 0 HZ PHE A 92 3.566 -9.442 -12.205 1.00 0.41 H new ATOM 1490 N ILE A 93 -4.126 -8.588 -9.593 1.00 0.23 N ATOM 1491 CA ILE A 93 -5.115 -8.275 -8.590 1.00 0.23 C ATOM 1492 C ILE A 93 -4.761 -9.065 -7.343 1.00 0.28 C ATOM 1493 O ILE A 93 -4.566 -10.287 -7.405 1.00 0.33 O ATOM 1494 CB ILE A 93 -6.543 -8.608 -9.065 1.00 0.23 C ATOM 1495 CG1 ILE A 93 -6.758 -8.073 -10.476 1.00 0.24 C ATOM 1496 CG2 ILE A 93 -7.574 -8.009 -8.119 1.00 0.26 C ATOM 1497 CD1 ILE A 93 -8.093 -8.427 -11.063 1.00 0.41 C ATOM 0 H ILE A 93 -3.933 -9.585 -9.692 1.00 0.23 H new ATOM 0 HA ILE A 93 -5.106 -7.204 -8.386 1.00 0.23 H new ATOM 0 HB ILE A 93 -6.665 -9.691 -9.070 1.00 0.23 H new ATOM 0 HG12 ILE A 93 -6.654 -6.988 -10.463 1.00 0.24 H new ATOM 0 HG13 ILE A 93 -5.972 -8.460 -11.125 1.00 0.24 H new ATOM 0 HG21 ILE A 93 -8.576 -8.254 -8.470 1.00 0.26 H new ATOM 0 HG22 ILE A 93 -7.430 -8.417 -7.119 1.00 0.26 H new ATOM 0 HG23 ILE A 93 -7.455 -6.926 -8.090 1.00 0.26 H new ATOM 0 HD11 ILE A 93 -8.171 -8.011 -12.068 1.00 0.41 H new ATOM 0 HD12 ILE A 93 -8.194 -9.511 -11.110 1.00 0.41 H new ATOM 0 HD13 ILE A 93 -8.886 -8.016 -10.438 1.00 0.41 H new ATOM 1509 N CYS A 94 -4.633 -8.368 -6.232 1.00 0.36 N ATOM 1510 CA CYS A 94 -4.079 -8.955 -5.032 1.00 0.48 C ATOM 1511 C CYS A 94 -5.143 -9.222 -3.981 1.00 0.39 C ATOM 1512 O CYS A 94 -5.666 -8.291 -3.376 1.00 0.47 O ATOM 1513 CB CYS A 94 -3.001 -8.034 -4.458 1.00 0.74 C ATOM 1514 SG CYS A 94 -1.507 -7.924 -5.472 1.00 2.01 S ATOM 0 H CYS A 94 -4.907 -7.390 -6.137 1.00 0.36 H new ATOM 0 HA CYS A 94 -3.642 -9.915 -5.306 1.00 0.48 H new ATOM 0 HB2 CYS A 94 -3.419 -7.035 -4.337 1.00 0.74 H new ATOM 0 HB3 CYS A 94 -2.727 -8.388 -3.464 1.00 0.74 H new ATOM 0 HG CYS A 94 -0.843 -9.038 -5.388 1.00 2.01 H new ATOM 1520 N HIS A 95 -5.456 -10.496 -3.773 1.00 0.37 N ATOM 1521 CA HIS A 95 -6.312 -10.898 -2.670 1.00 0.36 C ATOM 1522 C HIS A 95 -5.465 -11.055 -1.417 1.00 0.39 C ATOM 1523 O HIS A 95 -4.739 -12.034 -1.267 1.00 0.56 O ATOM 1524 CB HIS A 95 -7.062 -12.198 -2.996 1.00 0.41 C ATOM 1525 CG HIS A 95 -7.710 -12.859 -1.813 1.00 0.50 C ATOM 1526 ND1 HIS A 95 -7.704 -14.155 -1.426 1.00 1.20 N flip ATOM 1527 CD2 HIS A 95 -8.447 -12.184 -0.861 1.00 1.23 C flip ATOM 1528 CE1 HIS A 95 -8.422 -14.245 -0.263 1.00 0.99 C flip ATOM 1529 NE2 HIS A 95 -8.855 -13.040 0.058 1.00 0.95 N flip ATOM 0 H HIS A 95 -5.128 -11.266 -4.356 1.00 0.37 H new ATOM 0 HA HIS A 95 -7.065 -10.128 -2.501 1.00 0.36 H new ATOM 0 HB2 HIS A 95 -7.829 -11.983 -3.741 1.00 0.41 H new ATOM 0 HB3 HIS A 95 -6.364 -12.901 -3.451 1.00 0.41 H new ATOM 0 HD2 HIS A 95 -8.657 -11.125 -0.867 1.00 1.23 H new ATOM 0 HE1 HIS A 95 -8.603 -15.150 0.297 1.00 0.99 H new ATOM 0 HE2 HIS A 95 -9.413 -12.808 0.880 1.00 0.95 H new ATOM 1538 N THR A 96 -5.549 -10.085 -0.533 1.00 0.35 N ATOM 1539 CA THR A 96 -4.682 -10.046 0.630 1.00 0.38 C ATOM 1540 C THR A 96 -5.475 -9.900 1.924 1.00 0.36 C ATOM 1541 O THR A 96 -6.182 -8.921 2.115 1.00 0.41 O ATOM 1542 CB THR A 96 -3.701 -8.868 0.515 1.00 0.43 C ATOM 1543 OG1 THR A 96 -3.025 -8.918 -0.750 1.00 0.50 O ATOM 1544 CG2 THR A 96 -2.677 -8.895 1.647 1.00 0.47 C ATOM 0 H THR A 96 -6.209 -9.310 -0.595 1.00 0.35 H new ATOM 0 HA THR A 96 -4.140 -10.991 0.661 1.00 0.38 H new ATOM 0 HB THR A 96 -4.271 -7.942 0.589 1.00 0.43 H new ATOM 0 HG1 THR A 96 -2.402 -8.164 -0.818 1.00 0.50 H new ATOM 0 HG21 THR A 96 -1.996 -8.051 1.541 1.00 0.47 H new ATOM 0 HG22 THR A 96 -3.192 -8.828 2.605 1.00 0.47 H new ATOM 0 HG23 THR A 96 -2.111 -9.826 1.604 1.00 0.47 H new ATOM 1552 N ILE A 97 -5.348 -10.862 2.820 1.00 0.38 N ATOM 1553 CA ILE A 97 -5.979 -10.745 4.120 1.00 0.40 C ATOM 1554 C ILE A 97 -5.151 -9.805 4.994 1.00 0.41 C ATOM 1555 O ILE A 97 -3.919 -9.837 4.970 1.00 0.42 O ATOM 1556 CB ILE A 97 -6.147 -12.109 4.823 1.00 0.47 C ATOM 1557 CG1 ILE A 97 -6.812 -13.124 3.884 1.00 0.56 C ATOM 1558 CG2 ILE A 97 -6.987 -11.938 6.083 1.00 0.51 C ATOM 1559 CD1 ILE A 97 -8.211 -12.733 3.457 1.00 1.03 C ATOM 0 H ILE A 97 -4.820 -11.723 2.674 1.00 0.38 H new ATOM 0 HA ILE A 97 -6.981 -10.343 3.969 1.00 0.40 H new ATOM 0 HB ILE A 97 -5.161 -12.485 5.094 1.00 0.47 H new ATOM 0 HG12 ILE A 97 -6.191 -13.245 2.996 1.00 0.56 H new ATOM 0 HG13 ILE A 97 -6.851 -14.094 4.380 1.00 0.56 H new ATOM 0 HG21 ILE A 97 -7.103 -12.903 6.576 1.00 0.51 H new ATOM 0 HG22 ILE A 97 -6.491 -11.242 6.759 1.00 0.51 H new ATOM 0 HG23 ILE A 97 -7.969 -11.547 5.816 1.00 0.51 H new ATOM 0 HD11 ILE A 97 -8.616 -13.498 2.795 1.00 1.03 H new ATOM 0 HD12 ILE A 97 -8.847 -12.640 4.337 1.00 1.03 H new ATOM 0 HD13 ILE A 97 -8.178 -11.779 2.931 1.00 1.03 H new ATOM 1571 N THR A 98 -5.840 -8.963 5.734 1.00 0.49 N ATOM 1572 CA THR A 98 -5.229 -7.885 6.477 1.00 0.56 C ATOM 1573 C THR A 98 -5.379 -8.125 7.973 1.00 0.63 C ATOM 1574 O THR A 98 -6.331 -8.770 8.411 1.00 0.77 O ATOM 1575 CB THR A 98 -5.892 -6.545 6.110 1.00 0.71 C ATOM 1576 OG1 THR A 98 -6.278 -6.553 4.730 1.00 1.38 O ATOM 1577 CG2 THR A 98 -4.943 -5.389 6.350 1.00 0.86 C ATOM 0 H THR A 98 -6.854 -9.010 5.837 1.00 0.49 H new ATOM 0 HA THR A 98 -4.170 -7.848 6.221 1.00 0.56 H new ATOM 0 HB THR A 98 -6.771 -6.419 6.742 1.00 0.71 H new ATOM 0 HG1 THR A 98 -5.706 -5.936 4.227 1.00 1.38 H new ATOM 0 HG21 THR A 98 -5.434 -4.453 6.083 1.00 0.86 H new ATOM 0 HG22 THR A 98 -4.660 -5.363 7.402 1.00 0.86 H new ATOM 0 HG23 THR A 98 -4.051 -5.518 5.737 1.00 0.86 H new ATOM 1585 N GLN A 99 -4.453 -7.598 8.746 1.00 0.59 N ATOM 1586 CA GLN A 99 -4.514 -7.701 10.191 1.00 0.72 C ATOM 1587 C GLN A 99 -5.287 -6.522 10.769 1.00 0.99 C ATOM 1588 O GLN A 99 -5.539 -5.534 10.078 1.00 1.32 O ATOM 1589 CB GLN A 99 -3.109 -7.770 10.786 1.00 0.61 C ATOM 1590 CG GLN A 99 -2.591 -9.189 10.966 1.00 0.80 C ATOM 1591 CD GLN A 99 -1.233 -9.232 11.648 1.00 1.04 C ATOM 1592 OE1 GLN A 99 -1.145 -9.241 12.875 1.00 1.62 O ATOM 1593 NE2 GLN A 99 -0.168 -9.296 10.864 1.00 1.82 N ATOM 0 H GLN A 99 -3.642 -7.089 8.395 1.00 0.59 H new ATOM 0 HA GLN A 99 -5.037 -8.621 10.453 1.00 0.72 H new ATOM 0 HB2 GLN A 99 -2.423 -7.221 10.141 1.00 0.61 H new ATOM 0 HB3 GLN A 99 -3.108 -7.267 11.753 1.00 0.61 H new ATOM 0 HG2 GLN A 99 -3.308 -9.762 11.555 1.00 0.80 H new ATOM 0 HG3 GLN A 99 -2.520 -9.673 9.992 1.00 0.80 H new ATOM 0 HE21 GLN A 99 -0.280 -9.286 9.850 1.00 1.82 H new ATOM 0 HE22 GLN A 99 0.764 -9.355 11.274 1.00 1.82 H new ATOM 1602 N SER A 100 -5.652 -6.632 12.033 1.00 1.67 N ATOM 1603 CA SER A 100 -6.527 -5.665 12.671 1.00 2.03 C ATOM 1604 C SER A 100 -5.731 -4.511 13.277 1.00 1.60 C ATOM 1605 O SER A 100 -5.342 -4.567 14.446 1.00 2.41 O ATOM 1606 CB SER A 100 -7.336 -6.365 13.766 1.00 3.23 C ATOM 1607 OG SER A 100 -7.857 -7.599 13.301 1.00 3.91 O ATOM 0 H SER A 100 -5.352 -7.391 12.645 1.00 1.67 H new ATOM 0 HA SER A 100 -7.196 -5.252 11.916 1.00 2.03 H new ATOM 0 HB2 SER A 100 -6.703 -6.538 14.637 1.00 3.23 H new ATOM 0 HB3 SER A 100 -8.153 -5.720 14.089 1.00 3.23 H new ATOM 0 HG SER A 100 -8.083 -8.168 14.066 1.00 3.91 H new ATOM 1613 N PHE A 101 -5.478 -3.473 12.488 1.00 0.91 N ATOM 1614 CA PHE A 101 -4.793 -2.299 13.000 1.00 1.37 C ATOM 1615 C PHE A 101 -5.791 -1.327 13.619 1.00 1.09 C ATOM 1616 O PHE A 101 -6.393 -0.502 12.933 1.00 1.69 O ATOM 1617 CB PHE A 101 -3.949 -1.617 11.906 1.00 2.29 C ATOM 1618 CG PHE A 101 -4.599 -1.558 10.549 1.00 2.99 C ATOM 1619 CD1 PHE A 101 -4.434 -2.585 9.632 1.00 3.48 C ATOM 1620 CD2 PHE A 101 -5.386 -0.473 10.195 1.00 3.67 C ATOM 1621 CE1 PHE A 101 -5.037 -2.528 8.392 1.00 4.58 C ATOM 1622 CE2 PHE A 101 -5.992 -0.413 8.957 1.00 4.71 C ATOM 1623 CZ PHE A 101 -5.781 -1.455 8.038 1.00 5.16 C ATOM 0 H PHE A 101 -5.735 -3.423 11.502 1.00 0.91 H new ATOM 0 HA PHE A 101 -4.105 -2.622 13.781 1.00 1.37 H new ATOM 0 HB2 PHE A 101 -3.717 -0.601 12.226 1.00 2.29 H new ATOM 0 HB3 PHE A 101 -3.001 -2.147 11.816 1.00 2.29 H new ATOM 0 HD1 PHE A 101 -3.826 -3.439 9.891 1.00 3.48 H new ATOM 0 HD2 PHE A 101 -5.526 0.335 10.897 1.00 3.67 H new ATOM 0 HE1 PHE A 101 -4.914 -3.347 7.698 1.00 4.58 H new ATOM 0 HE2 PHE A 101 -6.621 0.425 8.697 1.00 4.71 H new ATOM 0 HZ PHE A 101 -6.213 -1.399 7.050 1.00 5.16 H new ATOM 1633 N ALA A 102 -5.912 -1.450 14.939 1.00 1.17 N ATOM 1634 CA ALA A 102 -6.837 -0.677 15.785 1.00 1.07 C ATOM 1635 C ALA A 102 -7.188 -1.504 17.011 1.00 1.42 C ATOM 1636 O ALA A 102 -8.114 -1.171 17.750 1.00 1.98 O ATOM 1637 CB ALA A 102 -8.134 -0.305 15.073 1.00 0.98 C ATOM 0 H ALA A 102 -5.351 -2.113 15.474 1.00 1.17 H new ATOM 0 HA ALA A 102 -6.328 0.250 16.049 1.00 1.07 H new ATOM 0 HB1 ALA A 102 -8.771 0.263 15.751 1.00 0.98 H new ATOM 0 HB2 ALA A 102 -7.907 0.301 14.196 1.00 0.98 H new ATOM 0 HB3 ALA A 102 -8.652 -1.213 14.763 1.00 0.98 H new ATOM 1643 N VAL A 103 -6.464 -2.614 17.185 1.00 1.54 N ATOM 1644 CA VAL A 103 -6.694 -3.567 18.274 1.00 2.05 C ATOM 1645 C VAL A 103 -7.984 -4.374 18.073 1.00 1.79 C ATOM 1646 O VAL A 103 -8.015 -5.576 18.344 1.00 2.21 O ATOM 1647 CB VAL A 103 -6.709 -2.881 19.662 1.00 2.56 C ATOM 1648 CG1 VAL A 103 -6.923 -3.902 20.773 1.00 3.03 C ATOM 1649 CG2 VAL A 103 -5.416 -2.112 19.891 1.00 3.17 C ATOM 0 H VAL A 103 -5.695 -2.878 16.569 1.00 1.54 H new ATOM 0 HA VAL A 103 -5.851 -4.257 18.247 1.00 2.05 H new ATOM 0 HB VAL A 103 -7.541 -2.178 19.682 1.00 2.56 H new ATOM 0 HG11 VAL A 103 -6.929 -3.394 21.737 1.00 3.03 H new ATOM 0 HG12 VAL A 103 -7.877 -4.408 20.623 1.00 3.03 H new ATOM 0 HG13 VAL A 103 -6.116 -4.635 20.754 1.00 3.03 H new ATOM 0 HG21 VAL A 103 -5.444 -1.636 20.871 1.00 3.17 H new ATOM 0 HG22 VAL A 103 -4.571 -2.799 19.845 1.00 3.17 H new ATOM 0 HG23 VAL A 103 -5.305 -1.349 19.121 1.00 3.17 H new ATOM 1659 N GLY A 104 -9.040 -3.730 17.585 1.00 1.47 N ATOM 1660 CA GLY A 104 -10.296 -4.431 17.399 1.00 1.84 C ATOM 1661 C GLY A 104 -11.289 -3.681 16.531 1.00 1.67 C ATOM 1662 O GLY A 104 -12.196 -4.292 15.967 1.00 1.96 O ATOM 0 H GLY A 104 -9.049 -2.746 17.318 1.00 1.47 H new ATOM 0 HA2 GLY A 104 -10.096 -5.404 16.950 1.00 1.84 H new ATOM 0 HA3 GLY A 104 -10.746 -4.617 18.374 1.00 1.84 H new ATOM 1666 N SER A 105 -11.132 -2.365 16.426 1.00 1.38 N ATOM 1667 CA SER A 105 -12.045 -1.547 15.630 1.00 1.39 C ATOM 1668 C SER A 105 -12.081 -2.018 14.176 1.00 1.19 C ATOM 1669 O SER A 105 -13.121 -2.456 13.680 1.00 1.34 O ATOM 1670 CB SER A 105 -11.623 -0.083 15.698 1.00 1.59 C ATOM 1671 OG SER A 105 -11.543 0.359 17.041 1.00 1.88 O ATOM 0 H SER A 105 -10.383 -1.842 16.880 1.00 1.38 H new ATOM 0 HA SER A 105 -13.048 -1.652 16.043 1.00 1.39 H new ATOM 0 HB2 SER A 105 -10.656 0.044 15.211 1.00 1.59 H new ATOM 0 HB3 SER A 105 -12.338 0.531 15.151 1.00 1.59 H new ATOM 0 HG SER A 105 -11.269 1.300 17.060 1.00 1.88 H new ATOM 1677 N ILE A 106 -10.948 -1.929 13.498 1.00 1.05 N ATOM 1678 CA ILE A 106 -10.844 -2.426 12.140 1.00 0.96 C ATOM 1679 C ILE A 106 -10.578 -3.923 12.170 1.00 0.94 C ATOM 1680 O ILE A 106 -9.479 -4.363 12.509 1.00 1.12 O ATOM 1681 CB ILE A 106 -9.739 -1.702 11.327 1.00 0.93 C ATOM 1682 CG1 ILE A 106 -10.040 -0.202 11.225 1.00 1.01 C ATOM 1683 CG2 ILE A 106 -9.609 -2.306 9.935 1.00 0.98 C ATOM 1684 CD1 ILE A 106 -9.402 0.633 12.311 1.00 0.94 C ATOM 0 H ILE A 106 -10.090 -1.518 13.867 1.00 1.05 H new ATOM 0 HA ILE A 106 -11.790 -2.223 11.638 1.00 0.96 H new ATOM 0 HB ILE A 106 -8.793 -1.834 11.852 1.00 0.93 H new ATOM 0 HG12 ILE A 106 -9.698 0.161 10.255 1.00 1.01 H new ATOM 0 HG13 ILE A 106 -11.120 -0.056 11.257 1.00 1.01 H new ATOM 0 HG21 ILE A 106 -8.828 -1.783 9.383 1.00 0.98 H new ATOM 0 HG22 ILE A 106 -9.349 -3.361 10.019 1.00 0.98 H new ATOM 0 HG23 ILE A 106 -10.557 -2.207 9.405 1.00 0.98 H new ATOM 0 HD11 ILE A 106 -9.664 1.681 12.166 1.00 0.94 H new ATOM 0 HD12 ILE A 106 -9.762 0.300 13.285 1.00 0.94 H new ATOM 0 HD13 ILE A 106 -8.319 0.521 12.267 1.00 0.94 H new ATOM 1696 N SER A 107 -11.607 -4.696 11.853 1.00 0.84 N ATOM 1697 CA SER A 107 -11.525 -6.150 11.876 1.00 0.86 C ATOM 1698 C SER A 107 -10.655 -6.670 10.727 1.00 0.79 C ATOM 1699 O SER A 107 -10.354 -5.917 9.794 1.00 0.77 O ATOM 1700 CB SER A 107 -12.939 -6.730 11.783 1.00 0.97 C ATOM 1701 OG SER A 107 -13.783 -6.168 12.779 1.00 1.35 O ATOM 0 H SER A 107 -12.519 -4.335 11.574 1.00 0.84 H new ATOM 0 HA SER A 107 -11.060 -6.466 12.810 1.00 0.86 H new ATOM 0 HB2 SER A 107 -13.354 -6.532 10.795 1.00 0.97 H new ATOM 0 HB3 SER A 107 -12.901 -7.813 11.901 1.00 0.97 H new ATOM 0 HG SER A 107 -14.682 -6.551 12.700 1.00 1.35 H new ATOM 1707 N PRO A 108 -10.227 -7.956 10.794 1.00 0.82 N ATOM 1708 CA PRO A 108 -9.446 -8.603 9.734 1.00 0.82 C ATOM 1709 C PRO A 108 -10.027 -8.310 8.359 1.00 0.73 C ATOM 1710 O PRO A 108 -11.141 -8.725 8.037 1.00 0.81 O ATOM 1711 CB PRO A 108 -9.543 -10.106 10.059 1.00 0.91 C ATOM 1712 CG PRO A 108 -10.485 -10.215 11.215 1.00 1.07 C ATOM 1713 CD PRO A 108 -10.468 -8.881 11.904 1.00 0.92 C ATOM 0 HA PRO A 108 -8.418 -8.243 9.703 1.00 0.82 H new ATOM 0 HB2 PRO A 108 -9.911 -10.668 9.201 1.00 0.91 H new ATOM 0 HB3 PRO A 108 -8.565 -10.515 10.312 1.00 0.91 H new ATOM 0 HG2 PRO A 108 -11.490 -10.463 10.875 1.00 1.07 H new ATOM 0 HG3 PRO A 108 -10.174 -11.008 11.896 1.00 1.07 H new ATOM 0 HD2 PRO A 108 -11.411 -8.673 12.409 1.00 0.92 H new ATOM 0 HD3 PRO A 108 -9.683 -8.823 12.658 1.00 0.92 H new ATOM 1721 N ARG A 109 -9.269 -7.593 7.552 1.00 0.61 N ATOM 1722 CA ARG A 109 -9.809 -7.037 6.326 1.00 0.56 C ATOM 1723 C ARG A 109 -9.363 -7.851 5.120 1.00 0.52 C ATOM 1724 O ARG A 109 -8.379 -8.582 5.183 1.00 0.66 O ATOM 1725 CB ARG A 109 -9.389 -5.567 6.204 1.00 0.64 C ATOM 1726 CG ARG A 109 -10.053 -4.831 5.062 1.00 1.05 C ATOM 1727 CD ARG A 109 -10.069 -3.334 5.295 1.00 0.88 C ATOM 1728 NE ARG A 109 -8.803 -2.694 4.930 1.00 1.89 N ATOM 1729 CZ ARG A 109 -8.284 -1.634 5.560 1.00 2.34 C ATOM 1730 NH1 ARG A 109 -8.886 -1.132 6.635 1.00 2.06 N ATOM 1731 NH2 ARG A 109 -7.155 -1.086 5.123 1.00 3.45 N ATOM 0 H ARG A 109 -8.285 -7.383 7.721 1.00 0.61 H new ATOM 0 HA ARG A 109 -10.898 -7.084 6.357 1.00 0.56 H new ATOM 0 HB2 ARG A 109 -9.622 -5.054 7.137 1.00 0.64 H new ATOM 0 HB3 ARG A 109 -8.308 -5.518 6.075 1.00 0.64 H new ATOM 0 HG2 ARG A 109 -9.526 -5.049 4.133 1.00 1.05 H new ATOM 0 HG3 ARG A 109 -11.075 -5.192 4.941 1.00 1.05 H new ATOM 0 HD2 ARG A 109 -10.878 -2.888 4.716 1.00 0.88 H new ATOM 0 HD3 ARG A 109 -10.283 -3.136 6.345 1.00 0.88 H new ATOM 0 HE ARG A 109 -8.283 -3.082 4.143 1.00 1.89 H new ATOM 0 HH11 ARG A 109 -9.747 -1.555 6.982 1.00 2.06 H new ATOM 0 HH12 ARG A 109 -8.487 -0.324 7.112 1.00 2.06 H new ATOM 0 HH21 ARG A 109 -6.683 -1.473 4.306 1.00 3.45 H new ATOM 0 HH22 ARG A 109 -6.761 -0.278 5.604 1.00 3.45 H new ATOM 1745 N ASP A 110 -10.106 -7.737 4.034 1.00 0.46 N ATOM 1746 CA ASP A 110 -9.799 -8.465 2.815 1.00 0.47 C ATOM 1747 C ASP A 110 -9.394 -7.475 1.734 1.00 0.44 C ATOM 1748 O ASP A 110 -10.140 -6.554 1.427 1.00 0.64 O ATOM 1749 CB ASP A 110 -11.023 -9.263 2.358 1.00 0.62 C ATOM 1750 CG ASP A 110 -10.683 -10.382 1.389 1.00 0.83 C ATOM 1751 OD1 ASP A 110 -10.033 -10.118 0.354 1.00 1.37 O ATOM 1752 OD2 ASP A 110 -11.083 -11.537 1.659 1.00 1.32 O ATOM 0 H ASP A 110 -10.933 -7.143 3.971 1.00 0.46 H new ATOM 0 HA ASP A 110 -8.980 -9.159 3.002 1.00 0.47 H new ATOM 0 HB2 ASP A 110 -11.519 -9.686 3.231 1.00 0.62 H new ATOM 0 HB3 ASP A 110 -11.734 -8.586 1.885 1.00 0.62 H new ATOM 1757 N PHE A 111 -8.217 -7.635 1.178 1.00 0.39 N ATOM 1758 CA PHE A 111 -7.764 -6.750 0.123 1.00 0.43 C ATOM 1759 C PHE A 111 -7.967 -7.393 -1.230 1.00 0.41 C ATOM 1760 O PHE A 111 -7.621 -8.552 -1.434 1.00 0.54 O ATOM 1761 CB PHE A 111 -6.287 -6.388 0.283 1.00 0.61 C ATOM 1762 CG PHE A 111 -6.011 -5.328 1.312 1.00 0.94 C ATOM 1763 CD1 PHE A 111 -6.921 -4.306 1.539 1.00 1.36 C ATOM 1764 CD2 PHE A 111 -4.829 -5.340 2.032 1.00 1.60 C ATOM 1765 CE1 PHE A 111 -6.656 -3.320 2.468 1.00 2.01 C ATOM 1766 CE2 PHE A 111 -4.560 -4.358 2.965 1.00 2.30 C ATOM 1767 CZ PHE A 111 -5.475 -3.345 3.183 1.00 2.41 C ATOM 0 H PHE A 111 -7.555 -8.367 1.435 1.00 0.39 H new ATOM 0 HA PHE A 111 -8.357 -5.838 0.194 1.00 0.43 H new ATOM 0 HB2 PHE A 111 -5.733 -7.288 0.550 1.00 0.61 H new ATOM 0 HB3 PHE A 111 -5.903 -6.050 -0.680 1.00 0.61 H new ATOM 0 HD1 PHE A 111 -7.847 -4.281 0.983 1.00 1.36 H new ATOM 0 HD2 PHE A 111 -4.109 -6.127 1.862 1.00 1.60 H new ATOM 0 HE1 PHE A 111 -7.372 -2.529 2.636 1.00 2.01 H new ATOM 0 HE2 PHE A 111 -3.636 -4.381 3.524 1.00 2.30 H new ATOM 0 HZ PHE A 111 -5.267 -2.575 3.911 1.00 2.41 H new ATOM 1777 N ILE A 112 -8.544 -6.629 -2.134 1.00 0.34 N ATOM 1778 CA ILE A 112 -8.647 -7.014 -3.532 1.00 0.33 C ATOM 1779 C ILE A 112 -8.234 -5.830 -4.376 1.00 0.35 C ATOM 1780 O ILE A 112 -9.049 -5.198 -5.054 1.00 0.43 O ATOM 1781 CB ILE A 112 -10.051 -7.497 -3.980 1.00 0.34 C ATOM 1782 CG1 ILE A 112 -10.573 -8.602 -3.065 1.00 0.40 C ATOM 1783 CG2 ILE A 112 -9.957 -8.009 -5.395 1.00 0.36 C ATOM 1784 CD1 ILE A 112 -9.757 -9.869 -3.149 1.00 0.42 C ATOM 0 H ILE A 112 -8.957 -5.721 -1.923 1.00 0.34 H new ATOM 0 HA ILE A 112 -7.991 -7.875 -3.666 1.00 0.33 H new ATOM 0 HB ILE A 112 -10.747 -6.660 -3.924 1.00 0.34 H new ATOM 0 HG12 ILE A 112 -10.574 -8.244 -2.035 1.00 0.40 H new ATOM 0 HG13 ILE A 112 -11.608 -8.824 -3.326 1.00 0.40 H new ATOM 0 HG21 ILE A 112 -10.938 -8.352 -5.724 1.00 0.36 H new ATOM 0 HG22 ILE A 112 -9.615 -7.208 -6.050 1.00 0.36 H new ATOM 0 HG23 ILE A 112 -9.250 -8.838 -5.436 1.00 0.36 H new ATOM 0 HD11 ILE A 112 -10.177 -10.617 -2.476 1.00 0.42 H new ATOM 0 HD12 ILE A 112 -9.777 -10.248 -4.171 1.00 0.42 H new ATOM 0 HD13 ILE A 112 -8.727 -9.658 -2.860 1.00 0.42 H new ATOM 1796 N ASP A 113 -6.966 -5.515 -4.294 1.00 0.36 N ATOM 1797 CA ASP A 113 -6.429 -4.375 -4.987 1.00 0.42 C ATOM 1798 C ASP A 113 -5.946 -4.789 -6.353 1.00 0.33 C ATOM 1799 O ASP A 113 -5.044 -5.619 -6.477 1.00 0.35 O ATOM 1800 CB ASP A 113 -5.279 -3.750 -4.193 1.00 0.58 C ATOM 1801 CG ASP A 113 -5.742 -3.135 -2.889 1.00 1.23 C ATOM 1802 OD1 ASP A 113 -5.956 -3.889 -1.916 1.00 1.32 O ATOM 1803 OD2 ASP A 113 -5.900 -1.897 -2.836 1.00 1.86 O ATOM 0 H ASP A 113 -6.282 -6.039 -3.748 1.00 0.36 H new ATOM 0 HA ASP A 113 -7.218 -3.630 -5.093 1.00 0.42 H new ATOM 0 HB2 ASP A 113 -4.529 -4.513 -3.985 1.00 0.58 H new ATOM 0 HB3 ASP A 113 -4.796 -2.985 -4.801 1.00 0.58 H new ATOM 1808 N LEU A 114 -6.578 -4.254 -7.375 1.00 0.28 N ATOM 1809 CA LEU A 114 -6.056 -4.391 -8.714 1.00 0.23 C ATOM 1810 C LEU A 114 -4.878 -3.482 -8.861 1.00 0.22 C ATOM 1811 O LEU A 114 -4.991 -2.270 -8.729 1.00 0.24 O ATOM 1812 CB LEU A 114 -7.076 -4.048 -9.770 1.00 0.23 C ATOM 1813 CG LEU A 114 -6.465 -3.650 -11.113 1.00 0.22 C ATOM 1814 CD1 LEU A 114 -6.003 -4.885 -11.867 1.00 0.21 C ATOM 1815 CD2 LEU A 114 -7.451 -2.822 -11.925 1.00 0.26 C ATOM 0 H LEU A 114 -7.447 -3.725 -7.304 1.00 0.28 H new ATOM 0 HA LEU A 114 -5.775 -5.434 -8.858 1.00 0.23 H new ATOM 0 HB2 LEU A 114 -7.732 -4.905 -9.920 1.00 0.23 H new ATOM 0 HB3 LEU A 114 -7.699 -3.230 -9.408 1.00 0.23 H new ATOM 0 HG LEU A 114 -5.589 -3.026 -10.935 1.00 0.22 H new ATOM 0 HD11 LEU A 114 -5.570 -4.587 -12.822 1.00 0.21 H new ATOM 0 HD12 LEU A 114 -5.253 -5.412 -11.277 1.00 0.21 H new ATOM 0 HD13 LEU A 114 -6.854 -5.543 -12.044 1.00 0.21 H new ATOM 0 HD21 LEU A 114 -6.998 -2.548 -12.878 1.00 0.26 H new ATOM 0 HD22 LEU A 114 -8.353 -3.406 -12.107 1.00 0.26 H new ATOM 0 HD23 LEU A 114 -7.709 -1.918 -11.373 1.00 0.26 H new ATOM 1827 N VAL A 115 -3.768 -4.068 -9.170 1.00 0.23 N ATOM 1828 CA VAL A 115 -2.514 -3.404 -9.023 1.00 0.23 C ATOM 1829 C VAL A 115 -1.727 -3.405 -10.305 1.00 0.23 C ATOM 1830 O VAL A 115 -1.507 -4.445 -10.931 1.00 0.24 O ATOM 1831 CB VAL A 115 -1.735 -4.067 -7.889 1.00 0.24 C ATOM 1832 CG1 VAL A 115 -2.201 -5.510 -7.731 1.00 0.25 C ATOM 1833 CG2 VAL A 115 -0.232 -3.978 -8.101 1.00 0.26 C ATOM 0 H VAL A 115 -3.704 -5.020 -9.531 1.00 0.23 H new ATOM 0 HA VAL A 115 -2.693 -2.358 -8.776 1.00 0.23 H new ATOM 0 HB VAL A 115 -1.940 -3.528 -6.964 1.00 0.24 H new ATOM 0 HG11 VAL A 115 -1.646 -5.985 -6.922 1.00 0.25 H new ATOM 0 HG12 VAL A 115 -3.266 -5.525 -7.498 1.00 0.25 H new ATOM 0 HG13 VAL A 115 -2.025 -6.053 -8.660 1.00 0.25 H new ATOM 0 HG21 VAL A 115 0.282 -4.462 -7.271 1.00 0.26 H new ATOM 0 HG22 VAL A 115 0.034 -4.477 -9.033 1.00 0.26 H new ATOM 0 HG23 VAL A 115 0.067 -2.931 -8.152 1.00 0.26 H new ATOM 1843 N TYR A 116 -1.336 -2.220 -10.702 1.00 0.25 N ATOM 1844 CA TYR A 116 -0.484 -2.072 -11.848 1.00 0.25 C ATOM 1845 C TYR A 116 0.896 -1.611 -11.419 1.00 0.26 C ATOM 1846 O TYR A 116 1.049 -0.550 -10.815 1.00 0.28 O ATOM 1847 CB TYR A 116 -1.094 -1.097 -12.858 1.00 0.31 C ATOM 1848 CG TYR A 116 -0.212 -0.806 -14.046 1.00 0.83 C ATOM 1849 CD1 TYR A 116 0.166 -1.812 -14.926 1.00 1.31 C ATOM 1850 CD2 TYR A 116 0.246 0.480 -14.283 1.00 1.10 C ATOM 1851 CE1 TYR A 116 0.975 -1.541 -16.011 1.00 1.87 C ATOM 1852 CE2 TYR A 116 1.050 0.760 -15.364 1.00 1.65 C ATOM 1853 CZ TYR A 116 1.416 -0.251 -16.223 1.00 1.99 C ATOM 1854 OH TYR A 116 2.215 0.035 -17.305 1.00 2.57 O ATOM 0 H TYR A 116 -1.596 -1.345 -10.246 1.00 0.25 H new ATOM 0 HA TYR A 116 -0.389 -3.042 -12.336 1.00 0.25 H new ATOM 0 HB2 TYR A 116 -2.040 -1.504 -13.213 1.00 0.31 H new ATOM 0 HB3 TYR A 116 -1.321 -0.160 -12.350 1.00 0.31 H new ATOM 0 HD1 TYR A 116 -0.178 -2.822 -14.759 1.00 1.31 H new ATOM 0 HD2 TYR A 116 -0.033 1.276 -13.608 1.00 1.10 H new ATOM 0 HE1 TYR A 116 1.260 -2.332 -16.688 1.00 1.87 H new ATOM 0 HE2 TYR A 116 1.393 1.769 -15.538 1.00 1.65 H new ATOM 0 HH TYR A 116 1.685 -0.024 -18.127 1.00 2.57 H new ATOM 1864 N ILE A 117 1.892 -2.415 -11.730 1.00 0.30 N ATOM 1865 CA ILE A 117 3.255 -2.126 -11.330 1.00 0.33 C ATOM 1866 C ILE A 117 4.032 -1.523 -12.493 1.00 0.38 C ATOM 1867 O ILE A 117 4.428 -2.230 -13.419 1.00 0.46 O ATOM 1868 CB ILE A 117 3.964 -3.405 -10.829 1.00 0.42 C ATOM 1869 CG1 ILE A 117 3.176 -4.021 -9.666 1.00 0.45 C ATOM 1870 CG2 ILE A 117 5.392 -3.094 -10.396 1.00 0.52 C ATOM 1871 CD1 ILE A 117 3.667 -5.386 -9.245 1.00 0.89 C ATOM 0 H ILE A 117 1.783 -3.279 -12.262 1.00 0.30 H new ATOM 0 HA ILE A 117 3.222 -1.405 -10.513 1.00 0.33 H new ATOM 0 HB ILE A 117 4.005 -4.123 -11.648 1.00 0.42 H new ATOM 0 HG12 ILE A 117 3.227 -3.348 -8.810 1.00 0.45 H new ATOM 0 HG13 ILE A 117 2.127 -4.096 -9.951 1.00 0.45 H new ATOM 0 HG21 ILE A 117 5.873 -4.007 -10.047 1.00 0.52 H new ATOM 0 HG22 ILE A 117 5.949 -2.691 -11.242 1.00 0.52 H new ATOM 0 HG23 ILE A 117 5.376 -2.361 -9.589 1.00 0.52 H new ATOM 0 HD11 ILE A 117 3.058 -5.753 -8.418 1.00 0.89 H new ATOM 0 HD12 ILE A 117 3.590 -6.076 -10.086 1.00 0.89 H new ATOM 0 HD13 ILE A 117 4.707 -5.316 -8.927 1.00 0.89 H new ATOM 1883 N LYS A 118 4.234 -0.214 -12.456 1.00 0.42 N ATOM 1884 CA LYS A 118 5.008 0.462 -13.485 1.00 0.52 C ATOM 1885 C LYS A 118 6.137 1.241 -12.860 1.00 0.39 C ATOM 1886 O LYS A 118 5.950 1.949 -11.872 1.00 0.34 O ATOM 1887 CB LYS A 118 4.153 1.418 -14.319 1.00 0.70 C ATOM 1888 CG LYS A 118 4.887 1.930 -15.553 1.00 0.93 C ATOM 1889 CD LYS A 118 4.410 3.306 -15.995 1.00 0.94 C ATOM 1890 CE LYS A 118 2.959 3.307 -16.451 1.00 0.72 C ATOM 1891 NZ LYS A 118 2.579 4.607 -17.070 1.00 1.20 N ATOM 0 H LYS A 118 3.873 0.400 -11.726 1.00 0.42 H new ATOM 0 HA LYS A 118 5.399 -0.312 -14.145 1.00 0.52 H new ATOM 0 HB2 LYS A 118 3.240 0.909 -14.628 1.00 0.70 H new ATOM 0 HB3 LYS A 118 3.852 2.264 -13.702 1.00 0.70 H new ATOM 0 HG2 LYS A 118 5.956 1.971 -15.343 1.00 0.93 H new ATOM 0 HG3 LYS A 118 4.750 1.223 -16.371 1.00 0.93 H new ATOM 0 HD2 LYS A 118 4.528 4.009 -15.170 1.00 0.94 H new ATOM 0 HD3 LYS A 118 5.042 3.661 -16.809 1.00 0.94 H new ATOM 0 HE2 LYS A 118 2.802 2.502 -17.169 1.00 0.72 H new ATOM 0 HE3 LYS A 118 2.309 3.105 -15.599 1.00 0.72 H new ATOM 0 HZ1 LYS A 118 1.554 4.622 -17.245 1.00 1.20 H new ATOM 0 HZ2 LYS A 118 2.832 5.385 -16.427 1.00 1.20 H new ATOM 0 HZ3 LYS A 118 3.086 4.724 -17.971 1.00 1.20 H new ATOM 1905 N ARG A 119 7.312 1.108 -13.427 1.00 0.52 N ATOM 1906 CA ARG A 119 8.418 1.902 -13.020 1.00 0.52 C ATOM 1907 C ARG A 119 8.756 2.867 -14.137 1.00 0.49 C ATOM 1908 O ARG A 119 8.983 2.477 -15.281 1.00 0.58 O ATOM 1909 CB ARG A 119 9.594 0.990 -12.655 1.00 0.79 C ATOM 1910 CG ARG A 119 10.124 0.161 -13.811 1.00 1.00 C ATOM 1911 CD ARG A 119 11.219 0.910 -14.535 1.00 1.25 C ATOM 1912 NE ARG A 119 11.644 0.255 -15.767 1.00 1.68 N ATOM 1913 CZ ARG A 119 12.913 -0.021 -16.060 1.00 2.18 C ATOM 1914 NH1 ARG A 119 13.863 0.173 -15.153 1.00 2.57 N ATOM 1915 NH2 ARG A 119 13.230 -0.509 -17.251 1.00 2.80 N ATOM 0 H ARG A 119 7.515 0.448 -14.177 1.00 0.52 H new ATOM 0 HA ARG A 119 8.178 2.486 -12.132 1.00 0.52 H new ATOM 0 HB2 ARG A 119 10.405 1.603 -12.261 1.00 0.79 H new ATOM 0 HB3 ARG A 119 9.283 0.319 -11.854 1.00 0.79 H new ATOM 0 HG2 ARG A 119 10.508 -0.789 -13.440 1.00 1.00 H new ATOM 0 HG3 ARG A 119 9.314 -0.071 -14.503 1.00 1.00 H new ATOM 0 HD2 ARG A 119 10.870 1.916 -14.768 1.00 1.25 H new ATOM 0 HD3 ARG A 119 12.078 1.016 -13.872 1.00 1.25 H new ATOM 0 HE ARG A 119 10.927 -0.007 -16.444 1.00 1.68 H new ATOM 0 HH11 ARG A 119 13.621 0.534 -14.230 1.00 2.57 H new ATOM 0 HH12 ARG A 119 14.835 -0.039 -15.379 1.00 2.57 H new ATOM 0 HH21 ARG A 119 12.501 -0.674 -17.945 1.00 2.80 H new ATOM 0 HH22 ARG A 119 14.203 -0.720 -17.473 1.00 2.80 H new ATOM 1929 N TYR A 120 8.672 4.129 -13.829 1.00 0.43 N ATOM 1930 CA TYR A 120 9.266 5.129 -14.672 1.00 0.46 C ATOM 1931 C TYR A 120 10.756 5.078 -14.413 1.00 0.50 C ATOM 1932 O TYR A 120 11.210 5.479 -13.347 1.00 0.48 O ATOM 1933 CB TYR A 120 8.686 6.514 -14.380 1.00 0.46 C ATOM 1934 CG TYR A 120 7.203 6.614 -14.652 1.00 0.51 C ATOM 1935 CD1 TYR A 120 6.729 6.876 -15.930 1.00 0.76 C ATOM 1936 CD2 TYR A 120 6.279 6.457 -13.627 1.00 0.58 C ATOM 1937 CE1 TYR A 120 5.375 6.981 -16.180 1.00 0.83 C ATOM 1938 CE2 TYR A 120 4.923 6.557 -13.870 1.00 0.66 C ATOM 1939 CZ TYR A 120 4.475 6.777 -15.155 1.00 0.70 C ATOM 1940 OH TYR A 120 3.126 6.932 -15.393 1.00 0.81 O ATOM 0 H TYR A 120 8.199 4.491 -13.001 1.00 0.43 H new ATOM 0 HA TYR A 120 9.053 4.934 -15.723 1.00 0.46 H new ATOM 0 HB2 TYR A 120 8.874 6.766 -13.336 1.00 0.46 H new ATOM 0 HB3 TYR A 120 9.209 7.254 -14.986 1.00 0.46 H new ATOM 0 HD1 TYR A 120 7.430 7.000 -16.742 1.00 0.76 H new ATOM 0 HD2 TYR A 120 6.626 6.254 -12.625 1.00 0.58 H new ATOM 0 HE1 TYR A 120 5.023 7.221 -17.172 1.00 0.83 H new ATOM 0 HE2 TYR A 120 4.218 6.463 -13.058 1.00 0.66 H new ATOM 0 HH TYR A 120 2.626 6.752 -14.570 1.00 0.81 H new ATOM 1950 N GLU A 121 11.481 4.502 -15.360 1.00 0.61 N ATOM 1951 CA GLU A 121 12.895 4.192 -15.207 1.00 0.73 C ATOM 1952 C GLU A 121 13.711 5.393 -14.752 1.00 0.70 C ATOM 1953 O GLU A 121 14.085 6.270 -15.534 1.00 0.79 O ATOM 1954 CB GLU A 121 13.443 3.593 -16.501 1.00 0.96 C ATOM 1955 CG GLU A 121 12.969 4.290 -17.766 1.00 1.06 C ATOM 1956 CD GLU A 121 13.267 3.483 -19.009 1.00 1.69 C ATOM 1957 OE1 GLU A 121 14.435 3.465 -19.445 1.00 2.28 O ATOM 1958 OE2 GLU A 121 12.336 2.854 -19.554 1.00 2.27 O ATOM 0 H GLU A 121 11.100 4.233 -16.267 1.00 0.61 H new ATOM 0 HA GLU A 121 12.988 3.451 -14.413 1.00 0.73 H new ATOM 0 HB2 GLU A 121 14.532 3.625 -16.469 1.00 0.96 H new ATOM 0 HB3 GLU A 121 13.157 2.542 -16.551 1.00 0.96 H new ATOM 0 HG2 GLU A 121 11.896 4.469 -17.700 1.00 1.06 H new ATOM 0 HG3 GLU A 121 13.450 5.265 -17.844 1.00 1.06 H new ATOM 1965 N GLY A 122 13.947 5.406 -13.455 1.00 0.67 N ATOM 1966 CA GLY A 122 14.725 6.444 -12.812 1.00 0.71 C ATOM 1967 C GLY A 122 13.890 7.647 -12.467 1.00 0.66 C ATOM 1968 O GLY A 122 14.389 8.765 -12.346 1.00 0.76 O ATOM 0 H GLY A 122 13.602 4.691 -12.814 1.00 0.67 H new ATOM 0 HA2 GLY A 122 15.179 6.046 -11.904 1.00 0.71 H new ATOM 0 HA3 GLY A 122 15.540 6.746 -13.470 1.00 0.71 H new ATOM 1972 N ASN A 123 12.608 7.402 -12.320 1.00 0.57 N ATOM 1973 CA ASN A 123 11.661 8.409 -11.890 1.00 0.54 C ATOM 1974 C ASN A 123 10.890 7.902 -10.687 1.00 0.45 C ATOM 1975 O ASN A 123 10.942 8.496 -9.610 1.00 0.45 O ATOM 1976 CB ASN A 123 10.672 8.749 -13.009 1.00 0.60 C ATOM 1977 CG ASN A 123 11.175 9.800 -13.983 1.00 1.01 C ATOM 1978 OD1 ASN A 123 12.464 9.794 -14.276 1.00 1.65 O flip ATOM 1979 ND2 ASN A 123 10.397 10.610 -14.482 1.00 1.61 N flip ATOM 0 H ASN A 123 12.188 6.490 -12.497 1.00 0.57 H new ATOM 0 HA ASN A 123 12.218 9.309 -11.629 1.00 0.54 H new ATOM 0 HB2 ASN A 123 10.438 7.839 -13.562 1.00 0.60 H new ATOM 0 HB3 ASN A 123 9.741 9.099 -12.563 1.00 0.60 H new ATOM 0 HD21 ASN A 123 9.408 10.587 -14.234 1.00 1.61 H new ATOM 0 HD22 ASN A 123 10.740 11.306 -15.144 1.00 1.61 H new ATOM 1986 N MET A 124 10.222 6.762 -10.862 1.00 0.39 N ATOM 1987 CA MET A 124 9.273 6.263 -9.865 1.00 0.34 C ATOM 1988 C MET A 124 9.026 4.775 -10.061 1.00 0.33 C ATOM 1989 O MET A 124 8.827 4.318 -11.181 1.00 0.40 O ATOM 1990 CB MET A 124 7.917 6.995 -9.946 1.00 0.34 C ATOM 1991 CG MET A 124 7.825 8.295 -9.148 1.00 0.56 C ATOM 1992 SD MET A 124 8.339 9.757 -10.079 1.00 1.09 S ATOM 1993 CE MET A 124 7.201 9.714 -11.459 1.00 1.12 C ATOM 0 H MET A 124 10.320 6.166 -11.684 1.00 0.39 H new ATOM 0 HA MET A 124 9.718 6.448 -8.888 1.00 0.34 H new ATOM 0 HB2 MET A 124 7.704 7.215 -10.992 1.00 0.34 H new ATOM 0 HB3 MET A 124 7.137 6.318 -9.597 1.00 0.34 H new ATOM 0 HG2 MET A 124 6.797 8.432 -8.811 1.00 0.56 H new ATOM 0 HG3 MET A 124 8.444 8.208 -8.255 1.00 0.56 H new ATOM 0 HE1 MET A 124 7.747 9.885 -12.387 1.00 1.12 H new ATOM 0 HE2 MET A 124 6.714 8.740 -11.499 1.00 1.12 H new ATOM 0 HE3 MET A 124 6.447 10.491 -11.333 1.00 1.12 H new ATOM 2003 N ASN A 125 9.031 4.030 -8.974 1.00 0.34 N ATOM 2004 CA ASN A 125 8.730 2.605 -9.009 1.00 0.37 C ATOM 2005 C ASN A 125 7.447 2.369 -8.231 1.00 0.32 C ATOM 2006 O ASN A 125 7.468 2.115 -7.028 1.00 0.37 O ATOM 2007 CB ASN A 125 9.882 1.791 -8.406 1.00 0.50 C ATOM 2008 CG ASN A 125 11.222 2.108 -9.050 1.00 0.95 C ATOM 2009 OD1 ASN A 125 11.620 1.488 -10.037 1.00 1.58 O ATOM 2010 ND2 ASN A 125 11.927 3.085 -8.495 1.00 1.62 N ATOM 0 H ASN A 125 9.242 4.389 -8.043 1.00 0.34 H new ATOM 0 HA ASN A 125 8.605 2.280 -10.042 1.00 0.37 H new ATOM 0 HB2 ASN A 125 9.941 1.990 -7.336 1.00 0.50 H new ATOM 0 HB3 ASN A 125 9.670 0.728 -8.521 1.00 0.50 H new ATOM 0 HD21 ASN A 125 12.832 3.346 -8.885 1.00 1.62 H new ATOM 0 HD22 ASN A 125 11.564 3.575 -7.678 1.00 1.62 H new ATOM 2017 N ILE A 126 6.330 2.495 -8.919 1.00 0.26 N ATOM 2018 CA ILE A 126 5.026 2.500 -8.276 1.00 0.23 C ATOM 2019 C ILE A 126 4.212 1.243 -8.570 1.00 0.27 C ATOM 2020 O ILE A 126 4.263 0.697 -9.673 1.00 0.30 O ATOM 2021 CB ILE A 126 4.202 3.725 -8.738 1.00 0.22 C ATOM 2022 CG1 ILE A 126 2.715 3.521 -8.418 1.00 0.24 C ATOM 2023 CG2 ILE A 126 4.428 4.000 -10.215 1.00 0.24 C ATOM 2024 CD1 ILE A 126 1.775 4.490 -9.102 1.00 0.26 C ATOM 0 H ILE A 126 6.297 2.596 -9.933 1.00 0.26 H new ATOM 0 HA ILE A 126 5.220 2.540 -7.204 1.00 0.23 H new ATOM 0 HB ILE A 126 4.542 4.603 -8.189 1.00 0.22 H new ATOM 0 HG12 ILE A 126 2.434 2.506 -8.699 1.00 0.24 H new ATOM 0 HG13 ILE A 126 2.576 3.603 -7.340 1.00 0.24 H new ATOM 0 HG21 ILE A 126 3.839 4.865 -10.518 1.00 0.24 H new ATOM 0 HG22 ILE A 126 5.485 4.201 -10.390 1.00 0.24 H new ATOM 0 HG23 ILE A 126 4.123 3.131 -10.798 1.00 0.24 H new ATOM 0 HD11 ILE A 126 0.748 4.266 -8.814 1.00 0.26 H new ATOM 0 HD12 ILE A 126 2.022 5.509 -8.803 1.00 0.26 H new ATOM 0 HD13 ILE A 126 1.877 4.395 -10.183 1.00 0.26 H new ATOM 2036 N ILE A 127 3.460 0.791 -7.572 1.00 0.30 N ATOM 2037 CA ILE A 127 2.363 -0.124 -7.817 1.00 0.34 C ATOM 2038 C ILE A 127 1.045 0.617 -7.559 1.00 0.38 C ATOM 2039 O ILE A 127 0.780 1.091 -6.453 1.00 0.45 O ATOM 2040 CB ILE A 127 2.441 -1.426 -6.969 1.00 0.41 C ATOM 2041 CG1 ILE A 127 2.020 -1.197 -5.513 1.00 0.42 C ATOM 2042 CG2 ILE A 127 3.853 -1.989 -7.007 1.00 0.50 C ATOM 2043 CD1 ILE A 127 1.555 -2.460 -4.820 1.00 0.59 C ATOM 0 H ILE A 127 3.593 1.044 -6.593 1.00 0.30 H new ATOM 0 HA ILE A 127 2.424 -0.451 -8.855 1.00 0.34 H new ATOM 0 HB ILE A 127 1.743 -2.138 -7.408 1.00 0.41 H new ATOM 0 HG12 ILE A 127 2.860 -0.776 -4.961 1.00 0.42 H new ATOM 0 HG13 ILE A 127 1.218 -0.459 -5.485 1.00 0.42 H new ATOM 0 HG21 ILE A 127 3.898 -2.900 -6.411 1.00 0.50 H new ATOM 0 HG22 ILE A 127 4.127 -2.216 -8.037 1.00 0.50 H new ATOM 0 HG23 ILE A 127 4.548 -1.255 -6.600 1.00 0.50 H new ATOM 0 HD11 ILE A 127 1.272 -2.228 -3.793 1.00 0.59 H new ATOM 0 HD12 ILE A 127 0.695 -2.870 -5.350 1.00 0.59 H new ATOM 0 HD13 ILE A 127 2.363 -3.192 -4.817 1.00 0.59 H new ATOM 2055 N SER A 128 0.273 0.811 -8.605 1.00 0.39 N ATOM 2056 CA SER A 128 -1.016 1.475 -8.489 1.00 0.50 C ATOM 2057 C SER A 128 -2.132 0.456 -8.318 1.00 0.55 C ATOM 2058 O SER A 128 -2.319 -0.412 -9.159 1.00 1.00 O ATOM 2059 CB SER A 128 -1.261 2.327 -9.722 1.00 0.68 C ATOM 2060 OG SER A 128 -1.054 1.574 -10.906 1.00 1.18 O ATOM 0 H SER A 128 0.513 0.518 -9.552 1.00 0.39 H new ATOM 0 HA SER A 128 -1.006 2.115 -7.607 1.00 0.50 H new ATOM 0 HB2 SER A 128 -2.280 2.714 -9.705 1.00 0.68 H new ATOM 0 HB3 SER A 128 -0.593 3.188 -9.712 1.00 0.68 H new ATOM 0 HG SER A 128 -0.117 1.652 -11.184 1.00 1.18 H new ATOM 2066 N SER A 129 -2.891 0.599 -7.256 1.00 0.30 N ATOM 2067 CA SER A 129 -3.852 -0.416 -6.856 1.00 0.31 C ATOM 2068 C SER A 129 -5.262 0.163 -6.707 1.00 0.31 C ATOM 2069 O SER A 129 -5.442 1.282 -6.228 1.00 0.43 O ATOM 2070 CB SER A 129 -3.403 -1.050 -5.539 1.00 0.40 C ATOM 2071 OG SER A 129 -2.072 -1.537 -5.635 1.00 1.24 O ATOM 0 H SER A 129 -2.864 1.415 -6.645 1.00 0.30 H new ATOM 0 HA SER A 129 -3.891 -1.174 -7.639 1.00 0.31 H new ATOM 0 HB2 SER A 129 -3.468 -0.315 -4.737 1.00 0.40 H new ATOM 0 HB3 SER A 129 -4.075 -1.867 -5.277 1.00 0.40 H new ATOM 0 HG SER A 129 -1.807 -1.936 -4.780 1.00 1.24 H new ATOM 2077 N LYS A 130 -6.259 -0.614 -7.116 1.00 0.27 N ATOM 2078 CA LYS A 130 -7.645 -0.214 -7.014 1.00 0.32 C ATOM 2079 C LYS A 130 -8.409 -1.346 -6.392 1.00 0.37 C ATOM 2080 O LYS A 130 -8.340 -2.462 -6.889 1.00 0.41 O ATOM 2081 CB LYS A 130 -8.260 0.046 -8.393 1.00 0.40 C ATOM 2082 CG LYS A 130 -7.457 0.964 -9.284 1.00 0.90 C ATOM 2083 CD LYS A 130 -8.053 1.047 -10.683 1.00 0.80 C ATOM 2084 CE LYS A 130 -9.343 1.862 -10.719 1.00 1.42 C ATOM 2085 NZ LYS A 130 -10.545 1.051 -10.372 1.00 2.26 N ATOM 0 H LYS A 130 -6.122 -1.538 -7.527 1.00 0.27 H new ATOM 0 HA LYS A 130 -7.696 0.701 -6.423 1.00 0.32 H new ATOM 0 HB2 LYS A 130 -8.390 -0.909 -8.903 1.00 0.40 H new ATOM 0 HB3 LYS A 130 -9.254 0.473 -8.257 1.00 0.40 H new ATOM 0 HG2 LYS A 130 -7.421 1.960 -8.843 1.00 0.90 H new ATOM 0 HG3 LYS A 130 -6.430 0.605 -9.346 1.00 0.90 H new ATOM 0 HD2 LYS A 130 -7.325 1.495 -11.359 1.00 0.80 H new ATOM 0 HD3 LYS A 130 -8.252 0.040 -11.050 1.00 0.80 H new ATOM 0 HE2 LYS A 130 -9.260 2.697 -10.024 1.00 1.42 H new ATOM 0 HE3 LYS A 130 -9.472 2.288 -11.714 1.00 1.42 H new ATOM 0 HZ1 LYS A 130 -11.310 1.259 -11.045 1.00 2.26 H new ATOM 0 HZ2 LYS A 130 -10.307 0.040 -10.420 1.00 2.26 H new ATOM 0 HZ3 LYS A 130 -10.858 1.288 -9.409 1.00 2.26 H new ATOM 2099 N SER A 131 -9.130 -1.088 -5.331 1.00 0.41 N ATOM 2100 CA SER A 131 -9.997 -2.104 -4.798 1.00 0.44 C ATOM 2101 C SER A 131 -11.061 -2.379 -5.837 1.00 0.41 C ATOM 2102 O SER A 131 -12.044 -1.646 -5.960 1.00 0.47 O ATOM 2103 CB SER A 131 -10.605 -1.662 -3.479 1.00 0.56 C ATOM 2104 OG SER A 131 -11.193 -0.378 -3.594 1.00 1.39 O ATOM 0 H SER A 131 -9.135 -0.201 -4.828 1.00 0.41 H new ATOM 0 HA SER A 131 -9.437 -3.015 -4.587 1.00 0.44 H new ATOM 0 HB2 SER A 131 -11.358 -2.383 -3.162 1.00 0.56 H new ATOM 0 HB3 SER A 131 -9.835 -1.645 -2.707 1.00 0.56 H new ATOM 0 HG SER A 131 -11.671 -0.312 -4.447 1.00 1.39 H new ATOM 2110 N VAL A 132 -10.844 -3.415 -6.609 1.00 0.35 N ATOM 2111 CA VAL A 132 -11.599 -3.597 -7.801 1.00 0.36 C ATOM 2112 C VAL A 132 -12.562 -4.734 -7.595 1.00 0.37 C ATOM 2113 O VAL A 132 -12.243 -5.741 -6.955 1.00 0.46 O ATOM 2114 CB VAL A 132 -10.692 -3.817 -9.045 1.00 0.40 C ATOM 2115 CG1 VAL A 132 -10.662 -5.251 -9.525 1.00 0.88 C ATOM 2116 CG2 VAL A 132 -11.098 -2.884 -10.171 1.00 1.05 C ATOM 0 H VAL A 132 -10.149 -4.139 -6.425 1.00 0.35 H new ATOM 0 HA VAL A 132 -12.160 -2.686 -8.008 1.00 0.36 H new ATOM 0 HB VAL A 132 -9.676 -3.582 -8.728 1.00 0.40 H new ATOM 0 HG11 VAL A 132 -10.010 -5.330 -10.395 1.00 0.88 H new ATOM 0 HG12 VAL A 132 -10.285 -5.893 -8.729 1.00 0.88 H new ATOM 0 HG13 VAL A 132 -11.670 -5.565 -9.797 1.00 0.88 H new ATOM 0 HG21 VAL A 132 -10.453 -3.052 -11.033 1.00 1.05 H new ATOM 0 HG22 VAL A 132 -12.134 -3.079 -10.449 1.00 1.05 H new ATOM 0 HG23 VAL A 132 -11.000 -1.850 -9.840 1.00 1.05 H new ATOM 2126 N ASP A 133 -13.742 -4.558 -8.108 1.00 0.39 N ATOM 2127 CA ASP A 133 -14.804 -5.490 -7.859 1.00 0.43 C ATOM 2128 C ASP A 133 -14.886 -6.445 -9.014 1.00 0.43 C ATOM 2129 O ASP A 133 -15.671 -6.270 -9.948 1.00 0.59 O ATOM 2130 CB ASP A 133 -16.098 -4.735 -7.647 1.00 0.54 C ATOM 2131 CG ASP A 133 -17.237 -5.633 -7.195 1.00 1.27 C ATOM 2132 OD1 ASP A 133 -17.803 -6.362 -8.032 1.00 1.39 O ATOM 2133 OD2 ASP A 133 -17.574 -5.611 -5.994 1.00 2.17 O ATOM 0 H ASP A 133 -13.996 -3.772 -8.706 1.00 0.39 H new ATOM 0 HA ASP A 133 -14.613 -6.067 -6.954 1.00 0.43 H new ATOM 0 HB2 ASP A 133 -15.940 -3.954 -6.903 1.00 0.54 H new ATOM 0 HB3 ASP A 133 -16.380 -4.238 -8.575 1.00 0.54 H new ATOM 2138 N PHE A 134 -14.018 -7.427 -8.967 1.00 0.35 N ATOM 2139 CA PHE A 134 -13.878 -8.353 -10.062 1.00 0.40 C ATOM 2140 C PHE A 134 -14.374 -9.745 -9.637 1.00 0.46 C ATOM 2141 O PHE A 134 -14.342 -10.090 -8.455 1.00 0.50 O ATOM 2142 CB PHE A 134 -12.414 -8.363 -10.529 1.00 0.39 C ATOM 2143 CG PHE A 134 -11.528 -9.235 -9.706 1.00 0.38 C ATOM 2144 CD1 PHE A 134 -11.496 -9.101 -8.335 1.00 0.36 C ATOM 2145 CD2 PHE A 134 -10.747 -10.199 -10.305 1.00 0.51 C ATOM 2146 CE1 PHE A 134 -10.707 -9.919 -7.572 1.00 0.42 C ATOM 2147 CE2 PHE A 134 -9.944 -11.013 -9.544 1.00 0.53 C ATOM 2148 CZ PHE A 134 -9.930 -10.874 -8.174 1.00 0.45 C ATOM 0 H PHE A 134 -13.396 -7.605 -8.178 1.00 0.35 H new ATOM 0 HA PHE A 134 -14.493 -8.043 -10.907 1.00 0.40 H new ATOM 0 HB2 PHE A 134 -12.375 -8.696 -11.566 1.00 0.39 H new ATOM 0 HB3 PHE A 134 -12.028 -7.344 -10.507 1.00 0.39 H new ATOM 0 HD1 PHE A 134 -12.099 -8.343 -7.858 1.00 0.36 H new ATOM 0 HD2 PHE A 134 -10.766 -10.315 -11.379 1.00 0.51 H new ATOM 0 HE1 PHE A 134 -10.697 -9.812 -6.497 1.00 0.42 H new ATOM 0 HE2 PHE A 134 -9.325 -11.760 -10.019 1.00 0.53 H new ATOM 0 HZ PHE A 134 -9.306 -11.519 -7.573 1.00 0.45 H new ATOM 2158 N PRO A 135 -14.844 -10.545 -10.604 1.00 0.61 N ATOM 2159 CA PRO A 135 -15.601 -11.790 -10.345 1.00 0.75 C ATOM 2160 C PRO A 135 -14.845 -12.898 -9.615 1.00 0.92 C ATOM 2161 O PRO A 135 -15.470 -13.815 -9.079 1.00 1.13 O ATOM 2162 CB PRO A 135 -15.928 -12.300 -11.739 1.00 1.28 C ATOM 2163 CG PRO A 135 -15.806 -11.116 -12.631 1.00 1.19 C ATOM 2164 CD PRO A 135 -14.704 -10.292 -12.048 1.00 0.76 C ATOM 0 HA PRO A 135 -16.442 -11.556 -9.692 1.00 0.75 H new ATOM 0 HB2 PRO A 135 -15.241 -13.091 -12.039 1.00 1.28 H new ATOM 0 HB3 PRO A 135 -16.933 -12.720 -11.778 1.00 1.28 H new ATOM 0 HG2 PRO A 135 -15.574 -11.416 -13.653 1.00 1.19 H new ATOM 0 HG3 PRO A 135 -16.739 -10.554 -12.668 1.00 1.19 H new ATOM 0 HD2 PRO A 135 -13.727 -10.600 -12.421 1.00 0.76 H new ATOM 0 HD3 PRO A 135 -14.818 -9.235 -12.287 1.00 0.76 H new ATOM 2172 N GLU A 136 -13.519 -12.851 -9.604 1.00 1.10 N ATOM 2173 CA GLU A 136 -12.744 -13.946 -9.084 1.00 1.59 C ATOM 2174 C GLU A 136 -12.929 -14.038 -7.596 1.00 1.68 C ATOM 2175 O GLU A 136 -12.864 -15.117 -7.002 1.00 2.17 O ATOM 2176 CB GLU A 136 -11.287 -13.720 -9.405 1.00 1.78 C ATOM 2177 CG GLU A 136 -10.548 -14.975 -9.747 1.00 2.38 C ATOM 2178 CD GLU A 136 -11.005 -15.558 -11.065 1.00 3.03 C ATOM 2179 OE1 GLU A 136 -11.953 -16.369 -11.056 1.00 3.30 O ATOM 2180 OE2 GLU A 136 -10.403 -15.229 -12.110 1.00 3.50 O ATOM 0 H GLU A 136 -12.969 -12.065 -9.950 1.00 1.10 H new ATOM 0 HA GLU A 136 -13.077 -14.878 -9.541 1.00 1.59 H new ATOM 0 HB2 GLU A 136 -11.211 -13.024 -10.241 1.00 1.78 H new ATOM 0 HB3 GLU A 136 -10.805 -13.245 -8.551 1.00 1.78 H new ATOM 0 HG2 GLU A 136 -9.479 -14.765 -9.794 1.00 2.38 H new ATOM 0 HG3 GLU A 136 -10.694 -15.710 -8.955 1.00 2.38 H new ATOM 2187 N TYR A 137 -13.184 -12.894 -7.000 1.00 1.38 N ATOM 2188 CA TYR A 137 -13.296 -12.832 -5.561 1.00 1.79 C ATOM 2189 C TYR A 137 -14.084 -11.626 -5.055 1.00 1.42 C ATOM 2190 O TYR A 137 -13.615 -10.485 -5.102 1.00 1.58 O ATOM 2191 CB TYR A 137 -11.906 -12.822 -4.952 1.00 2.49 C ATOM 2192 CG TYR A 137 -11.906 -13.134 -3.470 1.00 3.43 C ATOM 2193 CD1 TYR A 137 -11.818 -14.445 -3.025 1.00 4.47 C ATOM 2194 CD2 TYR A 137 -11.982 -12.125 -2.519 1.00 3.49 C ATOM 2195 CE1 TYR A 137 -11.811 -14.744 -1.681 1.00 5.35 C ATOM 2196 CE2 TYR A 137 -11.974 -12.418 -1.166 1.00 4.37 C ATOM 2197 CZ TYR A 137 -11.922 -13.684 -0.745 1.00 5.22 C ATOM 2198 OH TYR A 137 -11.887 -14.033 0.588 1.00 6.12 O ATOM 0 H TYR A 137 -13.316 -12.005 -7.483 1.00 1.38 H new ATOM 0 HA TYR A 137 -13.855 -13.715 -5.252 1.00 1.79 H new ATOM 0 HB2 TYR A 137 -11.283 -13.550 -5.471 1.00 2.49 H new ATOM 0 HB3 TYR A 137 -11.453 -11.844 -5.112 1.00 2.49 H new ATOM 0 HD1 TYR A 137 -11.754 -15.246 -3.746 1.00 4.47 H new ATOM 0 HD2 TYR A 137 -12.048 -11.096 -2.840 1.00 3.49 H new ATOM 0 HE1 TYR A 137 -11.723 -15.767 -1.346 1.00 5.35 H new ATOM 0 HE2 TYR A 137 -12.010 -11.615 -0.444 1.00 4.37 H new ATOM 0 HH TYR A 137 -11.601 -13.262 1.121 1.00 6.12 H new ATOM 2208 N PRO A 138 -15.306 -11.873 -4.579 1.00 1.33 N ATOM 2209 CA PRO A 138 -16.027 -10.948 -3.720 1.00 1.10 C ATOM 2210 C PRO A 138 -15.657 -11.202 -2.253 1.00 0.99 C ATOM 2211 O PRO A 138 -15.234 -12.308 -1.908 1.00 0.99 O ATOM 2212 CB PRO A 138 -17.505 -11.291 -3.980 1.00 0.97 C ATOM 2213 CG PRO A 138 -17.511 -12.510 -4.856 1.00 1.56 C ATOM 2214 CD PRO A 138 -16.110 -13.058 -4.869 1.00 1.77 C ATOM 0 HA PRO A 138 -15.799 -9.901 -3.921 1.00 1.10 H new ATOM 0 HB2 PRO A 138 -18.029 -11.483 -3.044 1.00 0.97 H new ATOM 0 HB3 PRO A 138 -18.016 -10.461 -4.467 1.00 0.97 H new ATOM 0 HG2 PRO A 138 -18.211 -13.254 -4.475 1.00 1.56 H new ATOM 0 HG3 PRO A 138 -17.834 -12.256 -5.866 1.00 1.56 H new ATOM 0 HD2 PRO A 138 -15.971 -13.836 -4.119 1.00 1.77 H new ATOM 0 HD3 PRO A 138 -15.854 -13.496 -5.834 1.00 1.77 H new ATOM 2222 N PRO A 139 -15.785 -10.192 -1.373 1.00 0.96 N ATOM 2223 CA PRO A 139 -15.459 -10.354 0.050 1.00 0.91 C ATOM 2224 C PRO A 139 -16.420 -11.303 0.764 1.00 1.00 C ATOM 2225 O PRO A 139 -17.191 -12.021 0.127 1.00 1.25 O ATOM 2226 CB PRO A 139 -15.572 -8.945 0.629 1.00 0.82 C ATOM 2227 CG PRO A 139 -16.383 -8.160 -0.348 1.00 0.89 C ATOM 2228 CD PRO A 139 -16.246 -8.832 -1.691 1.00 1.06 C ATOM 0 HA PRO A 139 -14.470 -10.794 0.181 1.00 0.91 H new ATOM 0 HB2 PRO A 139 -16.051 -8.963 1.608 1.00 0.82 H new ATOM 0 HB3 PRO A 139 -14.587 -8.499 0.765 1.00 0.82 H new ATOM 0 HG2 PRO A 139 -17.428 -8.127 -0.040 1.00 0.89 H new ATOM 0 HG3 PRO A 139 -16.032 -7.129 -0.397 1.00 0.89 H new ATOM 0 HD2 PRO A 139 -17.196 -8.849 -2.226 1.00 1.06 H new ATOM 0 HD3 PRO A 139 -15.532 -8.309 -2.326 1.00 1.06 H new ATOM 2236 N SER A 140 -16.400 -11.278 2.087 1.00 0.90 N ATOM 2237 CA SER A 140 -17.105 -12.262 2.867 1.00 1.01 C ATOM 2238 C SER A 140 -17.823 -11.566 4.014 1.00 1.01 C ATOM 2239 O SER A 140 -18.059 -10.357 3.954 1.00 1.13 O ATOM 2240 CB SER A 140 -16.110 -13.306 3.384 1.00 1.09 C ATOM 2241 OG SER A 140 -16.768 -14.422 3.956 1.00 1.60 O ATOM 0 H SER A 140 -15.899 -10.581 2.638 1.00 0.90 H new ATOM 0 HA SER A 140 -17.848 -12.773 2.255 1.00 1.01 H new ATOM 0 HB2 SER A 140 -15.475 -13.640 2.564 1.00 1.09 H new ATOM 0 HB3 SER A 140 -15.457 -12.849 4.127 1.00 1.09 H new ATOM 0 HG SER A 140 -16.102 -15.067 4.273 1.00 1.60 H new ATOM 2247 N SER A 141 -18.164 -12.302 5.049 1.00 1.07 N ATOM 2248 CA SER A 141 -18.917 -11.726 6.139 1.00 1.19 C ATOM 2249 C SER A 141 -18.009 -10.985 7.125 1.00 1.07 C ATOM 2250 O SER A 141 -18.340 -9.890 7.582 1.00 1.22 O ATOM 2251 CB SER A 141 -19.731 -12.811 6.844 1.00 1.47 C ATOM 2252 OG SER A 141 -20.595 -13.470 5.927 1.00 1.97 O ATOM 0 H SER A 141 -17.935 -13.290 5.158 1.00 1.07 H new ATOM 0 HA SER A 141 -19.604 -10.988 5.725 1.00 1.19 H new ATOM 0 HB2 SER A 141 -19.059 -13.536 7.302 1.00 1.47 H new ATOM 0 HB3 SER A 141 -20.317 -12.367 7.648 1.00 1.47 H new ATOM 0 HG SER A 141 -21.105 -14.162 6.398 1.00 1.97 H new ATOM 2258 N ASN A 142 -16.860 -11.572 7.439 1.00 0.97 N ATOM 2259 CA ASN A 142 -15.905 -10.928 8.336 1.00 0.95 C ATOM 2260 C ASN A 142 -14.851 -10.189 7.529 1.00 0.86 C ATOM 2261 O ASN A 142 -14.315 -9.171 7.965 1.00 1.07 O ATOM 2262 CB ASN A 142 -15.234 -11.947 9.262 1.00 1.01 C ATOM 2263 CG ASN A 142 -16.203 -12.581 10.242 1.00 1.37 C ATOM 2264 OD1 ASN A 142 -16.462 -12.036 11.317 1.00 2.18 O ATOM 2265 ND2 ASN A 142 -16.733 -13.743 9.886 1.00 1.73 N ATOM 0 H ASN A 142 -16.568 -12.485 7.090 1.00 0.97 H new ATOM 0 HA ASN A 142 -16.452 -10.218 8.956 1.00 0.95 H new ATOM 0 HB2 ASN A 142 -14.771 -12.728 8.659 1.00 1.01 H new ATOM 0 HB3 ASN A 142 -14.434 -11.456 9.816 1.00 1.01 H new ATOM 0 HD21 ASN A 142 -17.382 -14.220 10.511 1.00 1.73 H new ATOM 0 HD22 ASN A 142 -16.492 -14.159 8.987 1.00 1.73 H new ATOM 2272 N TYR A 143 -14.573 -10.702 6.338 1.00 0.71 N ATOM 2273 CA TYR A 143 -13.601 -10.092 5.457 1.00 0.67 C ATOM 2274 C TYR A 143 -14.250 -9.000 4.646 1.00 0.61 C ATOM 2275 O TYR A 143 -15.068 -9.260 3.760 1.00 0.67 O ATOM 2276 CB TYR A 143 -12.970 -11.134 4.533 1.00 0.76 C ATOM 2277 CG TYR A 143 -12.144 -12.171 5.265 1.00 0.84 C ATOM 2278 CD1 TYR A 143 -11.219 -11.790 6.232 1.00 0.91 C ATOM 2279 CD2 TYR A 143 -12.282 -13.525 4.988 1.00 0.97 C ATOM 2280 CE1 TYR A 143 -10.456 -12.729 6.900 1.00 1.02 C ATOM 2281 CE2 TYR A 143 -11.522 -14.469 5.654 1.00 1.09 C ATOM 2282 CZ TYR A 143 -10.613 -14.066 6.608 1.00 1.09 C ATOM 2283 OH TYR A 143 -9.851 -15.003 7.271 1.00 1.23 O ATOM 0 H TYR A 143 -15.012 -11.543 5.963 1.00 0.71 H new ATOM 0 HA TYR A 143 -12.810 -9.658 6.069 1.00 0.67 H new ATOM 0 HB2 TYR A 143 -13.759 -11.638 3.975 1.00 0.76 H new ATOM 0 HB3 TYR A 143 -12.338 -10.626 3.804 1.00 0.76 H new ATOM 0 HD1 TYR A 143 -11.095 -10.743 6.465 1.00 0.91 H new ATOM 0 HD2 TYR A 143 -12.993 -13.845 4.241 1.00 0.97 H new ATOM 0 HE1 TYR A 143 -9.741 -12.416 7.647 1.00 1.02 H new ATOM 0 HE2 TYR A 143 -11.640 -15.518 5.427 1.00 1.09 H new ATOM 0 HH TYR A 143 -10.083 -15.900 6.951 1.00 1.23 H new ATOM 2293 N ILE A 144 -13.889 -7.776 4.963 1.00 0.56 N ATOM 2294 CA ILE A 144 -14.386 -6.641 4.240 1.00 0.53 C ATOM 2295 C ILE A 144 -13.361 -6.250 3.204 1.00 0.46 C ATOM 2296 O ILE A 144 -12.236 -5.904 3.548 1.00 0.47 O ATOM 2297 CB ILE A 144 -14.685 -5.447 5.179 1.00 0.61 C ATOM 2298 CG1 ILE A 144 -14.746 -4.130 4.391 1.00 0.62 C ATOM 2299 CG2 ILE A 144 -13.653 -5.368 6.293 1.00 0.68 C ATOM 2300 CD1 ILE A 144 -15.881 -4.071 3.387 1.00 0.82 C ATOM 0 H ILE A 144 -13.248 -7.547 5.723 1.00 0.56 H new ATOM 0 HA ILE A 144 -15.327 -6.911 3.761 1.00 0.53 H new ATOM 0 HB ILE A 144 -15.662 -5.609 5.634 1.00 0.61 H new ATOM 0 HG12 ILE A 144 -14.850 -3.302 5.092 1.00 0.62 H new ATOM 0 HG13 ILE A 144 -13.801 -3.987 3.867 1.00 0.62 H new ATOM 0 HG21 ILE A 144 -13.882 -4.522 6.941 1.00 0.68 H new ATOM 0 HG22 ILE A 144 -13.676 -6.289 6.876 1.00 0.68 H new ATOM 0 HG23 ILE A 144 -12.661 -5.236 5.861 1.00 0.68 H new ATOM 0 HD11 ILE A 144 -15.860 -3.112 2.870 1.00 0.82 H new ATOM 0 HD12 ILE A 144 -15.768 -4.877 2.662 1.00 0.82 H new ATOM 0 HD13 ILE A 144 -16.833 -4.182 3.907 1.00 0.82 H new ATOM 2312 N ARG A 145 -13.725 -6.372 1.943 1.00 0.43 N ATOM 2313 CA ARG A 145 -12.858 -5.910 0.877 1.00 0.41 C ATOM 2314 C ARG A 145 -12.522 -4.443 1.109 1.00 0.45 C ATOM 2315 O ARG A 145 -13.384 -3.572 0.978 1.00 0.48 O ATOM 2316 CB ARG A 145 -13.496 -6.075 -0.503 1.00 0.44 C ATOM 2317 CG ARG A 145 -12.485 -5.901 -1.630 1.00 0.81 C ATOM 2318 CD ARG A 145 -13.150 -5.632 -2.967 1.00 2.08 C ATOM 2319 NE ARG A 145 -13.649 -6.849 -3.603 1.00 2.70 N ATOM 2320 CZ ARG A 145 -14.780 -6.905 -4.300 1.00 3.63 C ATOM 2321 NH1 ARG A 145 -15.597 -5.858 -4.320 1.00 4.14 N ATOM 2322 NH2 ARG A 145 -15.109 -8.015 -4.956 1.00 4.42 N ATOM 0 H ARG A 145 -14.606 -6.783 1.633 1.00 0.43 H new ATOM 0 HA ARG A 145 -11.955 -6.520 0.894 1.00 0.41 H new ATOM 0 HB2 ARG A 145 -13.951 -7.063 -0.575 1.00 0.44 H new ATOM 0 HB3 ARG A 145 -14.297 -5.345 -0.620 1.00 0.44 H new ATOM 0 HG2 ARG A 145 -11.814 -5.077 -1.389 1.00 0.81 H new ATOM 0 HG3 ARG A 145 -11.872 -6.799 -1.706 1.00 0.81 H new ATOM 0 HD2 ARG A 145 -13.977 -4.937 -2.824 1.00 2.08 H new ATOM 0 HD3 ARG A 145 -12.436 -5.146 -3.632 1.00 2.08 H new ATOM 0 HE ARG A 145 -13.099 -7.703 -3.507 1.00 2.70 H new ATOM 0 HH11 ARG A 145 -15.356 -5.013 -3.801 1.00 4.14 H new ATOM 0 HH12 ARG A 145 -16.465 -5.899 -4.854 1.00 4.14 H new ATOM 0 HH21 ARG A 145 -14.493 -8.827 -4.925 1.00 4.42 H new ATOM 0 HH22 ARG A 145 -15.978 -8.054 -5.489 1.00 4.42 H new ATOM 2336 N GLY A 146 -11.282 -4.187 1.500 1.00 0.62 N ATOM 2337 CA GLY A 146 -10.842 -2.837 1.745 1.00 0.79 C ATOM 2338 C GLY A 146 -10.983 -1.994 0.511 1.00 0.57 C ATOM 2339 O GLY A 146 -10.269 -2.199 -0.466 1.00 0.62 O ATOM 0 H GLY A 146 -10.570 -4.901 1.652 1.00 0.62 H new ATOM 0 HA2 GLY A 146 -11.426 -2.402 2.556 1.00 0.79 H new ATOM 0 HA3 GLY A 146 -9.801 -2.843 2.069 1.00 0.79 H new ATOM 2343 N TYR A 147 -11.906 -1.048 0.542 1.00 0.58 N ATOM 2344 CA TYR A 147 -12.180 -0.255 -0.635 1.00 0.56 C ATOM 2345 C TYR A 147 -11.219 0.900 -0.758 1.00 0.54 C ATOM 2346 O TYR A 147 -11.542 2.052 -0.481 1.00 0.67 O ATOM 2347 CB TYR A 147 -13.626 0.216 -0.671 1.00 0.86 C ATOM 2348 CG TYR A 147 -14.448 -0.555 -1.673 1.00 1.69 C ATOM 2349 CD1 TYR A 147 -14.916 -1.828 -1.380 1.00 2.19 C ATOM 2350 CD2 TYR A 147 -14.777 -0.001 -2.902 1.00 2.23 C ATOM 2351 CE1 TYR A 147 -15.689 -2.528 -2.283 1.00 3.07 C ATOM 2352 CE2 TYR A 147 -15.546 -0.695 -3.813 1.00 3.13 C ATOM 2353 CZ TYR A 147 -15.926 -1.990 -3.536 1.00 3.51 C ATOM 2354 OH TYR A 147 -16.772 -2.653 -4.403 1.00 4.44 O ATOM 0 H TYR A 147 -12.470 -0.815 1.360 1.00 0.58 H new ATOM 0 HA TYR A 147 -12.029 -0.899 -1.501 1.00 0.56 H new ATOM 0 HB2 TYR A 147 -14.067 0.107 0.320 1.00 0.86 H new ATOM 0 HB3 TYR A 147 -13.655 1.277 -0.918 1.00 0.86 H new ATOM 0 HD1 TYR A 147 -14.671 -2.278 -0.429 1.00 2.19 H new ATOM 0 HD2 TYR A 147 -14.425 0.990 -3.149 1.00 2.23 H new ATOM 0 HE1 TYR A 147 -16.106 -3.488 -2.015 1.00 3.07 H new ATOM 0 HE2 TYR A 147 -15.848 -0.226 -4.738 1.00 3.13 H new ATOM 0 HH TYR A 147 -16.839 -2.151 -5.242 1.00 4.44 H new ATOM 2364 N ASN A 148 -10.025 0.551 -1.165 1.00 0.46 N ATOM 2365 CA ASN A 148 -9.014 1.513 -1.509 1.00 0.47 C ATOM 2366 C ASN A 148 -9.303 2.041 -2.909 1.00 0.45 C ATOM 2367 O ASN A 148 -9.033 1.363 -3.904 1.00 0.58 O ATOM 2368 CB ASN A 148 -7.634 0.850 -1.483 1.00 0.49 C ATOM 2369 CG ASN A 148 -7.401 -0.003 -0.245 1.00 1.08 C ATOM 2370 OD1 ASN A 148 -7.906 0.287 0.839 1.00 1.45 O ATOM 2371 ND2 ASN A 148 -6.650 -1.079 -0.404 1.00 1.62 N ATOM 0 H ASN A 148 -9.726 -0.419 -1.267 1.00 0.46 H new ATOM 0 HA ASN A 148 -9.023 2.333 -0.791 1.00 0.47 H new ATOM 0 HB2 ASN A 148 -7.520 0.228 -2.371 1.00 0.49 H new ATOM 0 HB3 ASN A 148 -6.866 1.622 -1.534 1.00 0.49 H new ATOM 0 HD21 ASN A 148 -6.474 -1.699 0.386 1.00 1.62 H new ATOM 0 HD22 ASN A 148 -6.247 -1.289 -1.317 1.00 1.62 H new ATOM 2378 N HIS A 149 -9.914 3.216 -2.987 1.00 0.43 N ATOM 2379 CA HIS A 149 -10.113 3.879 -4.274 1.00 0.45 C ATOM 2380 C HIS A 149 -8.744 4.123 -4.878 1.00 0.40 C ATOM 2381 O HIS A 149 -7.804 4.275 -4.115 1.00 0.69 O ATOM 2382 CB HIS A 149 -10.813 5.224 -4.105 1.00 0.60 C ATOM 2383 CG HIS A 149 -12.188 5.169 -3.505 1.00 1.08 C ATOM 2384 ND1 HIS A 149 -13.336 5.176 -4.265 1.00 1.67 N ATOM 2385 CD2 HIS A 149 -12.598 5.156 -2.214 1.00 1.88 C ATOM 2386 CE1 HIS A 149 -14.389 5.172 -3.471 1.00 2.14 C ATOM 2387 NE2 HIS A 149 -13.971 5.163 -2.221 1.00 2.32 N ATOM 0 H HIS A 149 -10.278 3.728 -2.183 1.00 0.43 H new ATOM 0 HA HIS A 149 -10.735 3.248 -4.909 1.00 0.45 H new ATOM 0 HB2 HIS A 149 -10.189 5.862 -3.480 1.00 0.60 H new ATOM 0 HB3 HIS A 149 -10.881 5.703 -5.082 1.00 0.60 H new ATOM 0 HD2 HIS A 149 -11.963 5.143 -1.341 1.00 1.88 H new ATOM 0 HE1 HIS A 149 -15.420 5.176 -3.791 1.00 2.14 H new ATOM 0 HE2 HIS A 149 -14.569 5.161 -1.395 1.00 2.32 H new ATOM 2396 N PRO A 150 -8.644 4.192 -6.233 1.00 0.32 N ATOM 2397 CA PRO A 150 -7.391 4.287 -7.010 1.00 0.32 C ATOM 2398 C PRO A 150 -6.197 4.884 -6.265 1.00 0.36 C ATOM 2399 O PRO A 150 -5.762 6.004 -6.535 1.00 0.47 O ATOM 2400 CB PRO A 150 -7.798 5.194 -8.173 1.00 0.41 C ATOM 2401 CG PRO A 150 -9.298 5.111 -8.269 1.00 0.53 C ATOM 2402 CD PRO A 150 -9.780 4.214 -7.154 1.00 0.46 C ATOM 0 HA PRO A 150 -7.031 3.295 -7.283 1.00 0.32 H new ATOM 0 HB2 PRO A 150 -7.476 6.220 -7.997 1.00 0.41 H new ATOM 0 HB3 PRO A 150 -7.330 4.868 -9.102 1.00 0.41 H new ATOM 0 HG2 PRO A 150 -9.742 6.102 -8.182 1.00 0.53 H new ATOM 0 HG3 PRO A 150 -9.598 4.712 -9.238 1.00 0.53 H new ATOM 0 HD2 PRO A 150 -10.678 4.609 -6.678 1.00 0.46 H new ATOM 0 HD3 PRO A 150 -10.025 3.216 -7.517 1.00 0.46 H new ATOM 2410 N CYS A 151 -5.689 4.118 -5.327 1.00 0.38 N ATOM 2411 CA CYS A 151 -4.515 4.475 -4.574 1.00 0.48 C ATOM 2412 C CYS A 151 -3.294 3.805 -5.173 1.00 0.43 C ATOM 2413 O CYS A 151 -3.372 3.171 -6.226 1.00 0.77 O ATOM 2414 CB CYS A 151 -4.694 4.045 -3.121 1.00 0.84 C ATOM 2415 SG CYS A 151 -5.004 2.277 -2.914 1.00 1.58 S ATOM 0 H CYS A 151 -6.088 3.217 -5.064 1.00 0.38 H new ATOM 0 HA CYS A 151 -4.373 5.555 -4.612 1.00 0.48 H new ATOM 0 HB2 CYS A 151 -3.800 4.315 -2.559 1.00 0.84 H new ATOM 0 HB3 CYS A 151 -5.524 4.603 -2.687 1.00 0.84 H new ATOM 0 HG CYS A 151 -5.196 1.731 -4.078 1.00 1.58 H new ATOM 2421 N GLY A 152 -2.165 3.949 -4.516 1.00 0.34 N ATOM 2422 CA GLY A 152 -0.967 3.345 -5.019 1.00 0.39 C ATOM 2423 C GLY A 152 0.169 3.459 -4.049 1.00 0.36 C ATOM 2424 O GLY A 152 -0.029 3.753 -2.870 1.00 0.43 O ATOM 0 H GLY A 152 -2.058 4.472 -3.647 1.00 0.34 H new ATOM 0 HA2 GLY A 152 -1.155 2.293 -5.236 1.00 0.39 H new ATOM 0 HA3 GLY A 152 -0.689 3.820 -5.960 1.00 0.39 H new ATOM 2428 N PHE A 153 1.359 3.279 -4.565 1.00 0.32 N ATOM 2429 CA PHE A 153 2.537 3.120 -3.740 1.00 0.31 C ATOM 2430 C PHE A 153 3.757 3.382 -4.590 1.00 0.30 C ATOM 2431 O PHE A 153 4.272 2.474 -5.245 1.00 0.38 O ATOM 2432 CB PHE A 153 2.567 1.700 -3.161 1.00 0.36 C ATOM 2433 CG PHE A 153 3.678 1.444 -2.179 1.00 0.38 C ATOM 2434 CD1 PHE A 153 3.558 1.837 -0.856 1.00 0.54 C ATOM 2435 CD2 PHE A 153 4.849 0.829 -2.586 1.00 0.49 C ATOM 2436 CE1 PHE A 153 4.585 1.615 0.042 1.00 0.60 C ATOM 2437 CE2 PHE A 153 5.879 0.607 -1.694 1.00 0.55 C ATOM 2438 CZ PHE A 153 5.712 0.940 -0.353 1.00 0.52 C ATOM 0 H PHE A 153 1.542 3.238 -5.568 1.00 0.32 H new ATOM 0 HA PHE A 153 2.522 3.826 -2.910 1.00 0.31 H new ATOM 0 HB2 PHE A 153 1.614 1.502 -2.670 1.00 0.36 H new ATOM 0 HB3 PHE A 153 2.656 0.989 -3.983 1.00 0.36 H new ATOM 0 HD1 PHE A 153 2.652 2.322 -0.523 1.00 0.54 H new ATOM 0 HD2 PHE A 153 4.958 0.519 -3.615 1.00 0.49 H new ATOM 0 HE1 PHE A 153 4.500 1.974 1.057 1.00 0.60 H new ATOM 0 HE2 PHE A 153 6.809 0.177 -2.035 1.00 0.55 H new ATOM 0 HZ PHE A 153 6.465 0.669 0.372 1.00 0.52 H new ATOM 2448 N VAL A 154 4.201 4.621 -4.617 1.00 0.25 N ATOM 2449 CA VAL A 154 5.270 4.984 -5.511 1.00 0.25 C ATOM 2450 C VAL A 154 6.598 5.062 -4.765 1.00 0.24 C ATOM 2451 O VAL A 154 6.702 5.638 -3.682 1.00 0.31 O ATOM 2452 CB VAL A 154 4.986 6.302 -6.277 1.00 0.25 C ATOM 2453 CG1 VAL A 154 3.543 6.372 -6.753 1.00 0.27 C ATOM 2454 CG2 VAL A 154 5.326 7.534 -5.471 1.00 0.26 C ATOM 0 H VAL A 154 3.842 5.380 -4.038 1.00 0.25 H new ATOM 0 HA VAL A 154 5.337 4.195 -6.260 1.00 0.25 H new ATOM 0 HB VAL A 154 5.644 6.288 -7.146 1.00 0.25 H new ATOM 0 HG11 VAL A 154 3.381 7.309 -7.286 1.00 0.27 H new ATOM 0 HG12 VAL A 154 3.339 5.535 -7.421 1.00 0.27 H new ATOM 0 HG13 VAL A 154 2.874 6.322 -5.894 1.00 0.27 H new ATOM 0 HG21 VAL A 154 5.106 8.425 -6.059 1.00 0.26 H new ATOM 0 HG22 VAL A 154 4.732 7.546 -4.557 1.00 0.26 H new ATOM 0 HG23 VAL A 154 6.385 7.520 -5.215 1.00 0.26 H new ATOM 2464 N CYS A 155 7.591 4.422 -5.331 1.00 0.21 N ATOM 2465 CA CYS A 155 8.935 4.444 -4.768 1.00 0.23 C ATOM 2466 C CYS A 155 9.854 5.257 -5.670 1.00 0.27 C ATOM 2467 O CYS A 155 10.202 4.822 -6.765 1.00 0.42 O ATOM 2468 CB CYS A 155 9.453 3.020 -4.628 1.00 0.27 C ATOM 2469 SG CYS A 155 8.473 1.978 -3.526 1.00 1.55 S ATOM 0 H CYS A 155 7.501 3.874 -6.187 1.00 0.21 H new ATOM 0 HA CYS A 155 8.911 4.908 -3.782 1.00 0.23 H new ATOM 0 HB2 CYS A 155 9.483 2.558 -5.615 1.00 0.27 H new ATOM 0 HB3 CYS A 155 10.479 3.053 -4.261 1.00 0.27 H new ATOM 0 HG CYS A 155 8.710 0.727 -3.788 1.00 1.55 H new ATOM 2475 N SER A 156 10.256 6.424 -5.209 1.00 0.25 N ATOM 2476 CA SER A 156 10.909 7.386 -6.081 1.00 0.29 C ATOM 2477 C SER A 156 12.409 7.471 -5.822 1.00 0.30 C ATOM 2478 O SER A 156 12.842 7.744 -4.703 1.00 0.29 O ATOM 2479 CB SER A 156 10.267 8.761 -5.896 1.00 0.32 C ATOM 2480 OG SER A 156 8.862 8.692 -6.084 1.00 1.06 O ATOM 0 H SER A 156 10.144 6.730 -4.242 1.00 0.25 H new ATOM 0 HA SER A 156 10.777 7.048 -7.109 1.00 0.29 H new ATOM 0 HB2 SER A 156 10.486 9.138 -4.897 1.00 0.32 H new ATOM 0 HB3 SER A 156 10.699 9.467 -6.605 1.00 0.32 H new ATOM 0 HG SER A 156 8.462 9.563 -5.882 1.00 1.06 H new ATOM 2486 N PRO A 157 13.221 7.197 -6.857 1.00 0.36 N ATOM 2487 CA PRO A 157 14.667 7.422 -6.816 1.00 0.39 C ATOM 2488 C PRO A 157 15.010 8.843 -6.367 1.00 0.40 C ATOM 2489 O PRO A 157 14.516 9.819 -6.934 1.00 0.49 O ATOM 2490 CB PRO A 157 15.100 7.206 -8.268 1.00 0.51 C ATOM 2491 CG PRO A 157 14.073 6.298 -8.846 1.00 0.56 C ATOM 2492 CD PRO A 157 12.785 6.613 -8.139 1.00 0.45 C ATOM 0 HA PRO A 157 15.166 6.763 -6.106 1.00 0.39 H new ATOM 0 HB2 PRO A 157 15.143 8.150 -8.811 1.00 0.51 H new ATOM 0 HB3 PRO A 157 16.094 6.762 -8.321 1.00 0.51 H new ATOM 0 HG2 PRO A 157 13.975 6.455 -9.920 1.00 0.56 H new ATOM 0 HG3 PRO A 157 14.351 5.254 -8.701 1.00 0.56 H new ATOM 0 HD2 PRO A 157 12.176 7.313 -8.711 1.00 0.45 H new ATOM 0 HD3 PRO A 157 12.183 5.717 -7.986 1.00 0.45 H new ATOM 2500 N MET A 158 15.844 8.952 -5.339 1.00 0.37 N ATOM 2501 CA MET A 158 16.222 10.249 -4.796 1.00 0.43 C ATOM 2502 C MET A 158 17.432 10.824 -5.514 1.00 0.48 C ATOM 2503 O MET A 158 17.885 10.291 -6.527 1.00 0.49 O ATOM 2504 CB MET A 158 16.573 10.132 -3.316 1.00 0.43 C ATOM 2505 CG MET A 158 15.526 10.698 -2.389 1.00 0.50 C ATOM 2506 SD MET A 158 15.131 12.415 -2.774 1.00 0.95 S ATOM 2507 CE MET A 158 13.927 12.779 -1.499 1.00 1.16 C ATOM 0 H MET A 158 16.271 8.156 -4.865 1.00 0.37 H new ATOM 0 HA MET A 158 15.365 10.908 -4.936 1.00 0.43 H new ATOM 0 HB2 MET A 158 16.729 9.081 -3.072 1.00 0.43 H new ATOM 0 HB3 MET A 158 17.518 10.645 -3.136 1.00 0.43 H new ATOM 0 HG2 MET A 158 14.620 10.095 -2.455 1.00 0.50 H new ATOM 0 HG3 MET A 158 15.879 10.630 -1.360 1.00 0.50 H new ATOM 0 HE1 MET A 158 13.850 13.858 -1.369 1.00 1.16 H new ATOM 0 HE2 MET A 158 12.956 12.378 -1.790 1.00 1.16 H new ATOM 0 HE3 MET A 158 14.241 12.322 -0.561 1.00 1.16 H new ATOM 2517 N GLU A 159 17.970 11.907 -4.971 1.00 0.57 N ATOM 2518 CA GLU A 159 19.262 12.400 -5.409 1.00 0.62 C ATOM 2519 C GLU A 159 20.365 11.552 -4.795 1.00 0.54 C ATOM 2520 O GLU A 159 21.468 11.449 -5.330 1.00 0.59 O ATOM 2521 CB GLU A 159 19.443 13.872 -5.049 1.00 0.76 C ATOM 2522 CG GLU A 159 18.889 14.813 -6.101 1.00 1.38 C ATOM 2523 CD GLU A 159 19.513 14.568 -7.460 1.00 1.87 C ATOM 2524 OE1 GLU A 159 20.701 14.909 -7.642 1.00 2.63 O ATOM 2525 OE2 GLU A 159 18.830 14.005 -8.340 1.00 2.09 O ATOM 0 H GLU A 159 17.533 12.456 -4.231 1.00 0.57 H new ATOM 0 HA GLU A 159 19.316 12.323 -6.495 1.00 0.62 H new ATOM 0 HB2 GLU A 159 18.951 14.070 -4.097 1.00 0.76 H new ATOM 0 HB3 GLU A 159 20.504 14.078 -4.908 1.00 0.76 H new ATOM 0 HG2 GLU A 159 17.809 14.686 -6.169 1.00 1.38 H new ATOM 0 HG3 GLU A 159 19.071 15.844 -5.798 1.00 1.38 H new ATOM 2532 N GLU A 160 20.033 10.936 -3.671 1.00 0.52 N ATOM 2533 CA GLU A 160 20.890 9.955 -3.025 1.00 0.55 C ATOM 2534 C GLU A 160 20.366 8.569 -3.373 1.00 0.58 C ATOM 2535 O GLU A 160 20.534 7.614 -2.623 1.00 0.76 O ATOM 2536 CB GLU A 160 20.869 10.173 -1.519 1.00 0.63 C ATOM 2537 CG GLU A 160 21.240 11.592 -1.117 1.00 0.77 C ATOM 2538 CD GLU A 160 21.112 11.834 0.369 1.00 1.32 C ATOM 2539 OE1 GLU A 160 19.973 12.011 0.851 1.00 2.05 O ATOM 2540 OE2 GLU A 160 22.146 11.822 1.067 1.00 1.61 O ATOM 0 H GLU A 160 19.156 11.104 -3.179 1.00 0.52 H new ATOM 0 HA GLU A 160 21.919 10.056 -3.369 1.00 0.55 H new ATOM 0 HB2 GLU A 160 19.874 9.942 -1.138 1.00 0.63 H new ATOM 0 HB3 GLU A 160 21.561 9.475 -1.047 1.00 0.63 H new ATOM 0 HG2 GLU A 160 22.265 11.796 -1.426 1.00 0.77 H new ATOM 0 HG3 GLU A 160 20.600 12.295 -1.651 1.00 0.77 H new ATOM 2547 N ASN A 161 19.719 8.532 -4.537 1.00 0.51 N ATOM 2548 CA ASN A 161 18.992 7.377 -5.101 1.00 0.65 C ATOM 2549 C ASN A 161 19.296 6.024 -4.431 1.00 0.53 C ATOM 2550 O ASN A 161 18.424 5.484 -3.756 1.00 0.53 O ATOM 2551 CB ASN A 161 19.247 7.304 -6.622 1.00 0.92 C ATOM 2552 CG ASN A 161 18.348 6.325 -7.386 1.00 1.07 C ATOM 2553 OD1 ASN A 161 17.840 5.290 -6.727 1.00 1.93 O flip ATOM 2554 ND2 ASN A 161 18.107 6.510 -8.577 1.00 1.62 N flip ATOM 0 H ASN A 161 19.681 9.346 -5.151 1.00 0.51 H new ATOM 0 HA ASN A 161 17.937 7.554 -4.893 1.00 0.65 H new ATOM 0 HB2 ASN A 161 19.115 8.300 -7.045 1.00 0.92 H new ATOM 0 HB3 ASN A 161 20.287 7.023 -6.787 1.00 0.92 H new ATOM 0 HD21 ASN A 161 18.510 7.313 -9.060 1.00 1.62 H new ATOM 0 HD22 ASN A 161 17.504 5.861 -9.082 1.00 1.62 H new ATOM 2561 N PRO A 162 20.488 5.421 -4.623 1.00 0.55 N ATOM 2562 CA PRO A 162 20.729 4.051 -4.166 1.00 0.57 C ATOM 2563 C PRO A 162 20.883 3.932 -2.650 1.00 0.55 C ATOM 2564 O PRO A 162 20.804 2.839 -2.092 1.00 0.63 O ATOM 2565 CB PRO A 162 22.036 3.675 -4.862 1.00 0.71 C ATOM 2566 CG PRO A 162 22.747 4.971 -5.020 1.00 0.73 C ATOM 2567 CD PRO A 162 21.675 5.983 -5.299 1.00 0.67 C ATOM 0 HA PRO A 162 19.887 3.401 -4.404 1.00 0.57 H new ATOM 0 HB2 PRO A 162 22.617 2.971 -4.266 1.00 0.71 H new ATOM 0 HB3 PRO A 162 21.852 3.201 -5.826 1.00 0.71 H new ATOM 0 HG2 PRO A 162 23.303 5.226 -4.118 1.00 0.73 H new ATOM 0 HG3 PRO A 162 23.467 4.927 -5.837 1.00 0.73 H new ATOM 0 HD2 PRO A 162 21.936 6.964 -4.903 1.00 0.67 H new ATOM 0 HD3 PRO A 162 21.507 6.106 -6.369 1.00 0.67 H new ATOM 2575 N ALA A 163 21.107 5.062 -1.995 1.00 0.53 N ATOM 2576 CA ALA A 163 21.349 5.084 -0.559 1.00 0.59 C ATOM 2577 C ALA A 163 20.123 5.582 0.193 1.00 0.53 C ATOM 2578 O ALA A 163 19.937 5.271 1.365 1.00 0.58 O ATOM 2579 CB ALA A 163 22.555 5.958 -0.243 1.00 0.68 C ATOM 0 H ALA A 163 21.126 5.981 -2.438 1.00 0.53 H new ATOM 0 HA ALA A 163 21.556 4.065 -0.232 1.00 0.59 H new ATOM 0 HB1 ALA A 163 22.726 5.967 0.833 1.00 0.68 H new ATOM 0 HB2 ALA A 163 23.435 5.559 -0.747 1.00 0.68 H new ATOM 0 HB3 ALA A 163 22.368 6.975 -0.589 1.00 0.68 H new ATOM 2585 N TYR A 164 19.302 6.373 -0.484 1.00 0.45 N ATOM 2586 CA TYR A 164 18.071 6.889 0.088 1.00 0.40 C ATOM 2587 C TYR A 164 16.981 6.883 -0.967 1.00 0.32 C ATOM 2588 O TYR A 164 17.137 7.491 -2.025 1.00 0.38 O ATOM 2589 CB TYR A 164 18.269 8.316 0.610 1.00 0.46 C ATOM 2590 CG TYR A 164 18.993 8.394 1.936 1.00 0.56 C ATOM 2591 CD1 TYR A 164 18.323 8.134 3.122 1.00 0.61 C ATOM 2592 CD2 TYR A 164 20.339 8.733 2.006 1.00 0.67 C ATOM 2593 CE1 TYR A 164 18.966 8.208 4.339 1.00 0.73 C ATOM 2594 CE2 TYR A 164 20.991 8.810 3.222 1.00 0.78 C ATOM 2595 CZ TYR A 164 20.299 8.547 4.385 1.00 0.79 C ATOM 2596 OH TYR A 164 20.940 8.625 5.600 1.00 0.93 O ATOM 0 H TYR A 164 19.472 6.673 -1.444 1.00 0.45 H new ATOM 0 HA TYR A 164 17.783 6.251 0.923 1.00 0.40 H new ATOM 0 HB2 TYR A 164 18.828 8.888 -0.131 1.00 0.46 H new ATOM 0 HB3 TYR A 164 17.294 8.793 0.712 1.00 0.46 H new ATOM 0 HD1 TYR A 164 17.277 7.868 3.092 1.00 0.61 H new ATOM 0 HD2 TYR A 164 20.884 8.939 1.096 1.00 0.67 H new ATOM 0 HE1 TYR A 164 18.427 8.001 5.251 1.00 0.73 H new ATOM 0 HE2 TYR A 164 22.037 9.075 3.261 1.00 0.78 H new ATOM 0 HH TYR A 164 21.877 8.875 5.460 1.00 0.93 H new ATOM 2606 N SER A 165 15.884 6.198 -0.696 1.00 0.26 N ATOM 2607 CA SER A 165 14.803 6.133 -1.656 1.00 0.24 C ATOM 2608 C SER A 165 13.571 6.833 -1.119 1.00 0.23 C ATOM 2609 O SER A 165 13.297 6.801 0.083 1.00 0.26 O ATOM 2610 CB SER A 165 14.473 4.687 -2.001 1.00 0.30 C ATOM 2611 OG SER A 165 13.424 4.623 -2.953 1.00 1.41 O ATOM 0 H SER A 165 15.721 5.686 0.171 1.00 0.26 H new ATOM 0 HA SER A 165 15.128 6.641 -2.564 1.00 0.24 H new ATOM 0 HB2 SER A 165 15.360 4.191 -2.396 1.00 0.30 H new ATOM 0 HB3 SER A 165 14.184 4.150 -1.098 1.00 0.30 H new ATOM 0 HG SER A 165 12.566 4.777 -2.505 1.00 1.41 H new ATOM 2617 N LYS A 166 12.824 7.458 -2.011 1.00 0.24 N ATOM 2618 CA LYS A 166 11.641 8.183 -1.618 1.00 0.26 C ATOM 2619 C LYS A 166 10.404 7.297 -1.691 1.00 0.28 C ATOM 2620 O LYS A 166 9.855 7.036 -2.751 1.00 0.43 O ATOM 2621 CB LYS A 166 11.488 9.468 -2.448 1.00 0.36 C ATOM 2622 CG LYS A 166 10.113 10.116 -2.351 1.00 0.32 C ATOM 2623 CD LYS A 166 9.645 10.244 -0.911 1.00 0.37 C ATOM 2624 CE LYS A 166 10.494 11.218 -0.114 1.00 0.47 C ATOM 2625 NZ LYS A 166 10.319 12.620 -0.588 1.00 0.74 N ATOM 0 H LYS A 166 13.020 7.475 -3.012 1.00 0.24 H new ATOM 0 HA LYS A 166 11.751 8.484 -0.576 1.00 0.26 H new ATOM 0 HB2 LYS A 166 12.240 10.188 -2.124 1.00 0.36 H new ATOM 0 HB3 LYS A 166 11.696 9.239 -3.493 1.00 0.36 H new ATOM 0 HG2 LYS A 166 10.144 11.104 -2.811 1.00 0.32 H new ATOM 0 HG3 LYS A 166 9.392 9.524 -2.915 1.00 0.32 H new ATOM 0 HD2 LYS A 166 8.606 10.575 -0.897 1.00 0.37 H new ATOM 0 HD3 LYS A 166 9.674 9.265 -0.433 1.00 0.37 H new ATOM 0 HE2 LYS A 166 10.227 11.155 0.941 1.00 0.47 H new ATOM 0 HE3 LYS A 166 11.544 10.935 -0.194 1.00 0.47 H new ATOM 0 HZ1 LYS A 166 11.180 13.166 -0.382 1.00 0.74 H new ATOM 0 HZ2 LYS A 166 10.146 12.621 -1.613 1.00 0.74 H new ATOM 0 HZ3 LYS A 166 9.509 13.053 -0.100 1.00 0.74 H new ATOM 2639 N LEU A 167 9.994 6.842 -0.530 1.00 0.20 N ATOM 2640 CA LEU A 167 8.825 6.006 -0.368 1.00 0.21 C ATOM 2641 C LEU A 167 7.594 6.888 -0.202 1.00 0.20 C ATOM 2642 O LEU A 167 7.401 7.483 0.856 1.00 0.24 O ATOM 2643 CB LEU A 167 9.033 5.148 0.884 1.00 0.23 C ATOM 2644 CG LEU A 167 8.212 3.859 0.980 1.00 0.24 C ATOM 2645 CD1 LEU A 167 6.721 4.137 1.009 1.00 0.27 C ATOM 2646 CD2 LEU A 167 8.571 2.935 -0.173 1.00 0.25 C ATOM 0 H LEU A 167 10.473 7.046 0.347 1.00 0.20 H new ATOM 0 HA LEU A 167 8.679 5.367 -1.239 1.00 0.21 H new ATOM 0 HB2 LEU A 167 10.089 4.884 0.944 1.00 0.23 H new ATOM 0 HB3 LEU A 167 8.808 5.760 1.757 1.00 0.23 H new ATOM 0 HG LEU A 167 8.459 3.369 1.922 1.00 0.24 H new ATOM 0 HD11 LEU A 167 6.177 3.195 1.077 1.00 0.27 H new ATOM 0 HD12 LEU A 167 6.483 4.757 1.873 1.00 0.27 H new ATOM 0 HD13 LEU A 167 6.430 4.659 0.097 1.00 0.27 H new ATOM 0 HD21 LEU A 167 7.985 2.019 -0.101 1.00 0.25 H new ATOM 0 HD22 LEU A 167 8.354 3.432 -1.119 1.00 0.25 H new ATOM 0 HD23 LEU A 167 9.632 2.691 -0.127 1.00 0.25 H new ATOM 2658 N VAL A 168 6.771 6.992 -1.234 1.00 0.19 N ATOM 2659 CA VAL A 168 5.551 7.792 -1.119 1.00 0.20 C ATOM 2660 C VAL A 168 4.310 7.013 -1.564 1.00 0.23 C ATOM 2661 O VAL A 168 4.175 6.598 -2.713 1.00 0.28 O ATOM 2662 CB VAL A 168 5.684 9.161 -1.852 1.00 0.20 C ATOM 2663 CG1 VAL A 168 6.708 9.091 -2.970 1.00 0.21 C ATOM 2664 CG2 VAL A 168 4.341 9.657 -2.381 1.00 0.26 C ATOM 0 H VAL A 168 6.915 6.547 -2.141 1.00 0.19 H new ATOM 0 HA VAL A 168 5.414 8.015 -0.061 1.00 0.20 H new ATOM 0 HB VAL A 168 6.034 9.883 -1.114 1.00 0.20 H new ATOM 0 HG11 VAL A 168 6.777 10.061 -3.461 1.00 0.21 H new ATOM 0 HG12 VAL A 168 7.680 8.824 -2.557 1.00 0.21 H new ATOM 0 HG13 VAL A 168 6.403 8.338 -3.696 1.00 0.21 H new ATOM 0 HG21 VAL A 168 4.479 10.614 -2.885 1.00 0.26 H new ATOM 0 HG22 VAL A 168 3.937 8.931 -3.086 1.00 0.26 H new ATOM 0 HG23 VAL A 168 3.646 9.781 -1.550 1.00 0.26 H new ATOM 2674 N MET A 169 3.407 6.814 -0.613 1.00 0.29 N ATOM 2675 CA MET A 169 2.192 6.062 -0.824 1.00 0.32 C ATOM 2676 C MET A 169 0.991 6.973 -0.628 1.00 0.34 C ATOM 2677 O MET A 169 1.027 7.897 0.182 1.00 0.45 O ATOM 2678 CB MET A 169 2.128 4.887 0.161 1.00 0.35 C ATOM 2679 CG MET A 169 0.822 4.107 0.117 1.00 0.40 C ATOM 2680 SD MET A 169 0.734 2.815 1.370 1.00 0.74 S ATOM 2681 CE MET A 169 -0.914 2.176 1.074 1.00 1.24 C ATOM 0 H MET A 169 3.505 7.177 0.335 1.00 0.29 H new ATOM 0 HA MET A 169 2.182 5.669 -1.841 1.00 0.32 H new ATOM 0 HB2 MET A 169 2.952 4.206 -0.049 1.00 0.35 H new ATOM 0 HB3 MET A 169 2.278 5.266 1.172 1.00 0.35 H new ATOM 0 HG2 MET A 169 -0.012 4.796 0.254 1.00 0.40 H new ATOM 0 HG3 MET A 169 0.706 3.658 -0.869 1.00 0.40 H new ATOM 0 HE1 MET A 169 -1.121 1.366 1.773 1.00 1.24 H new ATOM 0 HE2 MET A 169 -1.644 2.973 1.216 1.00 1.24 H new ATOM 0 HE3 MET A 169 -0.981 1.800 0.053 1.00 1.24 H new ATOM 2691 N PHE A 170 -0.058 6.712 -1.372 1.00 0.36 N ATOM 2692 CA PHE A 170 -1.289 7.475 -1.255 1.00 0.42 C ATOM 2693 C PHE A 170 -2.420 6.537 -0.929 1.00 0.37 C ATOM 2694 O PHE A 170 -2.608 5.531 -1.613 1.00 0.38 O ATOM 2695 CB PHE A 170 -1.610 8.223 -2.547 1.00 0.69 C ATOM 2696 CG PHE A 170 -0.564 9.219 -2.940 1.00 1.26 C ATOM 2697 CD1 PHE A 170 0.502 8.845 -3.742 1.00 1.74 C ATOM 2698 CD2 PHE A 170 -0.645 10.528 -2.502 1.00 2.02 C ATOM 2699 CE1 PHE A 170 1.467 9.762 -4.098 1.00 2.73 C ATOM 2700 CE2 PHE A 170 0.317 11.448 -2.856 1.00 3.07 C ATOM 2701 CZ PHE A 170 1.375 11.065 -3.652 1.00 3.37 C ATOM 0 H PHE A 170 -0.088 5.971 -2.072 1.00 0.36 H new ATOM 0 HA PHE A 170 -1.161 8.211 -0.461 1.00 0.42 H new ATOM 0 HB2 PHE A 170 -1.733 7.501 -3.354 1.00 0.69 H new ATOM 0 HB3 PHE A 170 -2.564 8.737 -2.431 1.00 0.69 H new ATOM 0 HD1 PHE A 170 0.577 7.826 -4.091 1.00 1.74 H new ATOM 0 HD2 PHE A 170 -1.471 10.832 -1.876 1.00 2.02 H new ATOM 0 HE1 PHE A 170 2.294 9.462 -4.725 1.00 2.73 H new ATOM 0 HE2 PHE A 170 0.242 12.468 -2.510 1.00 3.07 H new ATOM 0 HZ PHE A 170 2.132 11.784 -3.927 1.00 3.37 H new ATOM 2711 N VAL A 171 -3.162 6.852 0.112 1.00 0.43 N ATOM 2712 CA VAL A 171 -4.259 6.008 0.513 1.00 0.50 C ATOM 2713 C VAL A 171 -5.590 6.719 0.251 1.00 0.49 C ATOM 2714 O VAL A 171 -5.853 7.812 0.759 1.00 0.50 O ATOM 2715 CB VAL A 171 -4.109 5.557 1.991 1.00 0.66 C ATOM 2716 CG1 VAL A 171 -4.591 6.607 2.984 1.00 1.28 C ATOM 2717 CG2 VAL A 171 -4.801 4.227 2.215 1.00 1.40 C ATOM 0 H VAL A 171 -3.024 7.681 0.690 1.00 0.43 H new ATOM 0 HA VAL A 171 -4.246 5.099 -0.089 1.00 0.50 H new ATOM 0 HB VAL A 171 -3.043 5.431 2.178 1.00 0.66 H new ATOM 0 HG11 VAL A 171 -4.461 6.234 4.000 1.00 1.28 H new ATOM 0 HG12 VAL A 171 -4.012 7.522 2.856 1.00 1.28 H new ATOM 0 HG13 VAL A 171 -5.646 6.818 2.807 1.00 1.28 H new ATOM 0 HG21 VAL A 171 -4.685 3.927 3.257 1.00 1.40 H new ATOM 0 HG22 VAL A 171 -5.861 4.325 1.981 1.00 1.40 H new ATOM 0 HG23 VAL A 171 -4.355 3.471 1.568 1.00 1.40 H new ATOM 2727 N GLN A 172 -6.393 6.123 -0.612 1.00 0.57 N ATOM 2728 CA GLN A 172 -7.684 6.685 -0.975 1.00 0.65 C ATOM 2729 C GLN A 172 -8.772 5.753 -0.460 1.00 0.65 C ATOM 2730 O GLN A 172 -9.699 5.372 -1.174 1.00 0.95 O ATOM 2731 CB GLN A 172 -7.768 6.859 -2.495 1.00 0.80 C ATOM 2732 CG GLN A 172 -8.667 8.002 -2.935 1.00 1.01 C ATOM 2733 CD GLN A 172 -8.663 8.206 -4.442 1.00 1.54 C ATOM 2734 OE1 GLN A 172 -9.492 7.655 -5.160 1.00 2.17 O ATOM 2735 NE2 GLN A 172 -7.723 8.997 -4.929 1.00 2.15 N ATOM 0 H GLN A 172 -6.172 5.243 -1.078 1.00 0.57 H new ATOM 0 HA GLN A 172 -7.816 7.669 -0.526 1.00 0.65 H new ATOM 0 HB2 GLN A 172 -6.765 7.027 -2.888 1.00 0.80 H new ATOM 0 HB3 GLN A 172 -8.133 5.932 -2.937 1.00 0.80 H new ATOM 0 HG2 GLN A 172 -9.686 7.806 -2.602 1.00 1.01 H new ATOM 0 HG3 GLN A 172 -8.344 8.922 -2.447 1.00 1.01 H new ATOM 0 HE21 GLN A 172 -7.051 9.438 -4.301 1.00 2.15 H new ATOM 0 HE22 GLN A 172 -7.669 9.167 -5.933 1.00 2.15 H new ATOM 2744 N THR A 173 -8.622 5.397 0.795 1.00 0.59 N ATOM 2745 CA THR A 173 -9.422 4.367 1.442 1.00 0.66 C ATOM 2746 C THR A 173 -10.862 4.801 1.709 1.00 0.75 C ATOM 2747 O THR A 173 -11.118 5.923 2.146 1.00 1.01 O ATOM 2748 CB THR A 173 -8.755 3.998 2.767 1.00 0.93 C ATOM 2749 OG1 THR A 173 -7.830 5.034 3.125 1.00 1.65 O ATOM 2750 CG2 THR A 173 -8.030 2.668 2.668 1.00 1.12 C ATOM 0 H THR A 173 -7.929 5.820 1.412 1.00 0.59 H new ATOM 0 HA THR A 173 -9.471 3.515 0.764 1.00 0.66 H new ATOM 0 HB THR A 173 -9.525 3.900 3.532 1.00 0.93 H new ATOM 0 HG1 THR A 173 -8.241 5.624 3.791 1.00 1.65 H new ATOM 0 HG21 THR A 173 -7.566 2.434 3.626 1.00 1.12 H new ATOM 0 HG22 THR A 173 -8.742 1.884 2.408 1.00 1.12 H new ATOM 0 HG23 THR A 173 -7.261 2.729 1.898 1.00 1.12 H new ATOM 2758 N GLU A 174 -11.805 3.900 1.426 1.00 0.69 N ATOM 2759 CA GLU A 174 -13.203 4.134 1.737 1.00 0.87 C ATOM 2760 C GLU A 174 -13.570 3.570 3.103 1.00 0.99 C ATOM 2761 O GLU A 174 -14.423 4.122 3.792 1.00 1.32 O ATOM 2762 CB GLU A 174 -14.077 3.488 0.670 1.00 0.97 C ATOM 2763 CG GLU A 174 -15.547 3.804 0.826 1.00 1.10 C ATOM 2764 CD GLU A 174 -15.812 5.294 0.810 1.00 1.80 C ATOM 2765 OE1 GLU A 174 -15.515 5.940 -0.220 1.00 2.30 O ATOM 2766 OE2 GLU A 174 -16.279 5.825 1.839 1.00 2.45 O ATOM 0 H GLU A 174 -11.618 3.002 0.981 1.00 0.69 H new ATOM 0 HA GLU A 174 -13.370 5.211 1.757 1.00 0.87 H new ATOM 0 HB2 GLU A 174 -13.744 3.821 -0.313 1.00 0.97 H new ATOM 0 HB3 GLU A 174 -13.940 2.407 0.704 1.00 0.97 H new ATOM 0 HG2 GLU A 174 -16.107 3.328 0.022 1.00 1.10 H new ATOM 0 HG3 GLU A 174 -15.911 3.381 1.762 1.00 1.10 H new ATOM 2773 N MET A 175 -12.919 2.482 3.499 1.00 1.04 N ATOM 2774 CA MET A 175 -13.298 1.770 4.718 1.00 1.36 C ATOM 2775 C MET A 175 -14.775 1.391 4.670 1.00 1.31 C ATOM 2776 O MET A 175 -15.559 1.779 5.536 1.00 1.63 O ATOM 2777 CB MET A 175 -13.013 2.598 5.977 1.00 1.69 C ATOM 2778 CG MET A 175 -11.569 2.532 6.451 1.00 2.10 C ATOM 2779 SD MET A 175 -10.419 3.350 5.337 1.00 3.24 S ATOM 2780 CE MET A 175 -10.936 5.057 5.503 1.00 3.74 C ATOM 0 H MET A 175 -12.130 2.074 2.998 1.00 1.04 H new ATOM 0 HA MET A 175 -12.691 0.866 4.770 1.00 1.36 H new ATOM 0 HB2 MET A 175 -13.272 3.638 5.781 1.00 1.69 H new ATOM 0 HB3 MET A 175 -13.664 2.253 6.780 1.00 1.69 H new ATOM 0 HG2 MET A 175 -11.496 2.989 7.438 1.00 2.10 H new ATOM 0 HG3 MET A 175 -11.277 1.488 6.561 1.00 2.10 H new ATOM 0 HE1 MET A 175 -10.314 5.689 4.870 1.00 3.74 H new ATOM 0 HE2 MET A 175 -11.978 5.153 5.199 1.00 3.74 H new ATOM 0 HE3 MET A 175 -10.831 5.370 6.542 1.00 3.74 H new ATOM 2790 N ARG A 176 -15.141 0.641 3.637 1.00 1.20 N ATOM 2791 CA ARG A 176 -16.515 0.146 3.467 1.00 1.41 C ATOM 2792 C ARG A 176 -16.959 -0.739 4.634 1.00 1.43 C ATOM 2793 O ARG A 176 -18.130 -1.087 4.740 1.00 2.27 O ATOM 2794 CB ARG A 176 -16.635 -0.652 2.169 1.00 1.92 C ATOM 2795 CG ARG A 176 -16.664 0.206 0.922 1.00 2.40 C ATOM 2796 CD ARG A 176 -17.982 0.952 0.788 1.00 3.21 C ATOM 2797 NE ARG A 176 -18.098 1.629 -0.504 1.00 3.99 N ATOM 2798 CZ ARG A 176 -19.216 1.657 -1.228 1.00 4.83 C ATOM 2799 NH1 ARG A 176 -20.294 1.000 -0.824 1.00 5.05 N ATOM 2800 NH2 ARG A 176 -19.241 2.320 -2.375 1.00 5.78 N ATOM 0 H ARG A 176 -14.503 0.356 2.894 1.00 1.20 H new ATOM 0 HA ARG A 176 -17.164 1.021 3.434 1.00 1.41 H new ATOM 0 HB2 ARG A 176 -15.797 -1.346 2.102 1.00 1.92 H new ATOM 0 HB3 ARG A 176 -17.544 -1.253 2.206 1.00 1.92 H new ATOM 0 HG2 ARG A 176 -15.842 0.921 0.952 1.00 2.40 H new ATOM 0 HG3 ARG A 176 -16.509 -0.421 0.044 1.00 2.40 H new ATOM 0 HD2 ARG A 176 -18.809 0.252 0.906 1.00 3.21 H new ATOM 0 HD3 ARG A 176 -18.067 1.685 1.591 1.00 3.21 H new ATOM 0 HE ARG A 176 -17.275 2.107 -0.872 1.00 3.99 H new ATOM 0 HH11 ARG A 176 -20.271 0.469 0.046 1.00 5.05 H new ATOM 0 HH12 ARG A 176 -21.147 1.026 -1.383 1.00 5.05 H new ATOM 0 HH21 ARG A 176 -18.406 2.807 -2.701 1.00 5.78 H new ATOM 0 HH22 ARG A 176 -20.095 2.344 -2.932 1.00 5.78 H new ATOM 2814 N GLY A 177 -16.019 -1.087 5.506 1.00 1.09 N ATOM 2815 CA GLY A 177 -16.316 -1.970 6.622 1.00 1.32 C ATOM 2816 C GLY A 177 -17.033 -1.274 7.764 1.00 1.51 C ATOM 2817 O GLY A 177 -17.037 -1.775 8.888 1.00 2.26 O ATOM 0 H GLY A 177 -15.050 -0.772 5.460 1.00 1.09 H new ATOM 0 HA2 GLY A 177 -16.930 -2.798 6.268 1.00 1.32 H new ATOM 0 HA3 GLY A 177 -15.386 -2.399 6.994 1.00 1.32 H new ATOM 2821 N LYS A 178 -17.621 -0.116 7.472 1.00 1.79 N ATOM 2822 CA LYS A 178 -18.426 0.626 8.436 1.00 2.45 C ATOM 2823 C LYS A 178 -17.613 0.998 9.677 1.00 2.04 C ATOM 2824 O LYS A 178 -17.823 0.464 10.769 1.00 2.30 O ATOM 2825 CB LYS A 178 -19.664 -0.190 8.828 1.00 3.40 C ATOM 2826 CG LYS A 178 -20.674 0.576 9.666 1.00 4.30 C ATOM 2827 CD LYS A 178 -21.790 -0.338 10.130 1.00 4.79 C ATOM 2828 CE LYS A 178 -22.775 0.390 11.024 1.00 5.70 C ATOM 2829 NZ LYS A 178 -23.736 -0.551 11.648 1.00 6.23 N ATOM 0 H LYS A 178 -17.552 0.334 6.559 1.00 1.79 H new ATOM 0 HA LYS A 178 -18.747 1.554 7.963 1.00 2.45 H new ATOM 0 HB2 LYS A 178 -20.155 -0.544 7.921 1.00 3.40 H new ATOM 0 HB3 LYS A 178 -19.344 -1.072 9.382 1.00 3.40 H new ATOM 0 HG2 LYS A 178 -20.177 1.018 10.529 1.00 4.30 H new ATOM 0 HG3 LYS A 178 -21.089 1.398 9.082 1.00 4.30 H new ATOM 0 HD2 LYS A 178 -22.314 -0.741 9.264 1.00 4.79 H new ATOM 0 HD3 LYS A 178 -21.366 -1.185 10.669 1.00 4.79 H new ATOM 0 HE2 LYS A 178 -22.234 0.929 11.802 1.00 5.70 H new ATOM 0 HE3 LYS A 178 -23.318 1.133 10.440 1.00 5.70 H new ATOM 0 HZ1 LYS A 178 -24.396 -0.022 12.253 1.00 6.23 H new ATOM 0 HZ2 LYS A 178 -24.269 -1.047 10.905 1.00 6.23 H new ATOM 0 HZ3 LYS A 178 -23.218 -1.245 12.224 1.00 6.23 H new ATOM 2843 N LEU A 179 -16.673 1.910 9.500 1.00 1.64 N ATOM 2844 CA LEU A 179 -15.914 2.444 10.600 1.00 1.35 C ATOM 2845 C LEU A 179 -16.522 3.780 10.981 1.00 1.40 C ATOM 2846 O LEU A 179 -17.440 4.269 10.321 1.00 1.56 O ATOM 2847 CB LEU A 179 -14.431 2.625 10.236 1.00 1.23 C ATOM 2848 CG LEU A 179 -13.642 1.355 9.900 1.00 1.17 C ATOM 2849 CD1 LEU A 179 -14.160 0.661 8.648 1.00 1.61 C ATOM 2850 CD2 LEU A 179 -12.175 1.703 9.734 1.00 1.15 C ATOM 0 H LEU A 179 -16.420 2.295 8.590 1.00 1.64 H new ATOM 0 HA LEU A 179 -15.954 1.745 11.435 1.00 1.35 H new ATOM 0 HB2 LEU A 179 -14.371 3.298 9.381 1.00 1.23 H new ATOM 0 HB3 LEU A 179 -13.935 3.123 11.069 1.00 1.23 H new ATOM 0 HG LEU A 179 -13.772 0.656 10.727 1.00 1.17 H new ATOM 0 HD11 LEU A 179 -13.566 -0.232 8.455 1.00 1.61 H new ATOM 0 HD12 LEU A 179 -15.203 0.379 8.793 1.00 1.61 H new ATOM 0 HD13 LEU A 179 -14.082 1.339 7.798 1.00 1.61 H new ATOM 0 HD21 LEU A 179 -11.612 0.801 9.495 1.00 1.15 H new ATOM 0 HD22 LEU A 179 -12.062 2.426 8.926 1.00 1.15 H new ATOM 0 HD23 LEU A 179 -11.796 2.132 10.661 1.00 1.15 H new ATOM 2862 N SER A 180 -16.026 4.352 12.044 1.00 1.31 N ATOM 2863 CA SER A 180 -16.518 5.621 12.537 1.00 1.39 C ATOM 2864 C SER A 180 -15.437 6.673 12.352 1.00 1.32 C ATOM 2865 O SER A 180 -14.269 6.309 12.256 1.00 1.19 O ATOM 2866 CB SER A 180 -16.891 5.489 14.016 1.00 1.41 C ATOM 2867 OG SER A 180 -17.795 4.414 14.221 1.00 2.04 O ATOM 0 H SER A 180 -15.267 3.955 12.598 1.00 1.31 H new ATOM 0 HA SER A 180 -17.408 5.919 11.982 1.00 1.39 H new ATOM 0 HB2 SER A 180 -15.990 5.329 14.609 1.00 1.41 H new ATOM 0 HB3 SER A 180 -17.341 6.418 14.365 1.00 1.41 H new ATOM 0 HG SER A 180 -18.016 4.350 15.174 1.00 2.04 H new ATOM 2873 N PRO A 181 -15.776 7.969 12.287 1.00 1.45 N ATOM 2874 CA PRO A 181 -14.769 9.031 12.155 1.00 1.44 C ATOM 2875 C PRO A 181 -13.607 8.829 13.129 1.00 1.30 C ATOM 2876 O PRO A 181 -12.435 8.993 12.777 1.00 1.20 O ATOM 2877 CB PRO A 181 -15.557 10.292 12.503 1.00 1.65 C ATOM 2878 CG PRO A 181 -16.951 9.984 12.081 1.00 1.74 C ATOM 2879 CD PRO A 181 -17.147 8.512 12.332 1.00 1.64 C ATOM 0 HA PRO A 181 -14.311 9.061 11.166 1.00 1.44 H new ATOM 0 HB2 PRO A 181 -15.504 10.512 13.569 1.00 1.65 H new ATOM 0 HB3 PRO A 181 -15.166 11.163 11.977 1.00 1.65 H new ATOM 0 HG2 PRO A 181 -17.670 10.575 12.648 1.00 1.74 H new ATOM 0 HG3 PRO A 181 -17.102 10.223 11.028 1.00 1.74 H new ATOM 0 HD2 PRO A 181 -17.620 8.329 13.297 1.00 1.64 H new ATOM 0 HD3 PRO A 181 -17.784 8.057 11.574 1.00 1.64 H new ATOM 2887 N SER A 182 -13.952 8.400 14.334 1.00 1.34 N ATOM 2888 CA SER A 182 -12.991 8.166 15.396 1.00 1.28 C ATOM 2889 C SER A 182 -12.185 6.875 15.189 1.00 1.11 C ATOM 2890 O SER A 182 -11.230 6.629 15.902 1.00 1.09 O ATOM 2891 CB SER A 182 -13.746 8.125 16.719 1.00 1.40 C ATOM 2892 OG SER A 182 -15.031 7.552 16.531 1.00 2.14 O ATOM 0 H SER A 182 -14.916 8.203 14.602 1.00 1.34 H new ATOM 0 HA SER A 182 -12.264 8.978 15.394 1.00 1.28 H new ATOM 0 HB2 SER A 182 -13.184 7.543 17.449 1.00 1.40 H new ATOM 0 HB3 SER A 182 -13.844 9.133 17.122 1.00 1.40 H new ATOM 0 HG SER A 182 -14.953 6.750 15.973 1.00 2.14 H new ATOM 2898 N ILE A 183 -12.588 6.046 14.231 1.00 1.04 N ATOM 2899 CA ILE A 183 -11.867 4.805 13.911 1.00 0.90 C ATOM 2900 C ILE A 183 -10.851 5.080 12.820 1.00 0.79 C ATOM 2901 O ILE A 183 -9.800 4.457 12.717 1.00 0.69 O ATOM 2902 CB ILE A 183 -12.829 3.719 13.401 1.00 0.96 C ATOM 2903 CG1 ILE A 183 -14.031 3.600 14.331 1.00 1.09 C ATOM 2904 CG2 ILE A 183 -12.115 2.384 13.282 1.00 0.92 C ATOM 2905 CD1 ILE A 183 -13.729 2.869 15.622 1.00 1.12 C ATOM 0 H ILE A 183 -13.415 6.207 13.656 1.00 1.04 H new ATOM 0 HA ILE A 183 -11.380 4.456 14.822 1.00 0.90 H new ATOM 0 HB ILE A 183 -13.181 4.007 12.411 1.00 0.96 H new ATOM 0 HG12 ILE A 183 -14.398 4.599 14.566 1.00 1.09 H new ATOM 0 HG13 ILE A 183 -14.834 3.080 13.808 1.00 1.09 H new ATOM 0 HG21 ILE A 183 -12.813 1.629 12.920 1.00 0.92 H new ATOM 0 HG22 ILE A 183 -11.285 2.477 12.582 1.00 0.92 H new ATOM 0 HG23 ILE A 183 -11.734 2.087 14.259 1.00 0.92 H new ATOM 0 HD11 ILE A 183 -14.630 2.823 16.233 1.00 1.12 H new ATOM 0 HD12 ILE A 183 -13.391 1.858 15.397 1.00 1.12 H new ATOM 0 HD13 ILE A 183 -12.948 3.400 16.167 1.00 1.12 H new ATOM 2917 N ILE A 184 -11.203 6.057 12.035 1.00 0.87 N ATOM 2918 CA ILE A 184 -10.531 6.383 10.808 1.00 0.83 C ATOM 2919 C ILE A 184 -9.362 7.317 11.077 1.00 0.81 C ATOM 2920 O ILE A 184 -8.319 7.239 10.424 1.00 0.75 O ATOM 2921 CB ILE A 184 -11.544 6.999 9.816 1.00 0.96 C ATOM 2922 CG1 ILE A 184 -12.275 5.886 9.062 1.00 0.98 C ATOM 2923 CG2 ILE A 184 -10.890 7.982 8.839 1.00 1.00 C ATOM 2924 CD1 ILE A 184 -13.719 5.722 9.468 1.00 1.13 C ATOM 0 H ILE A 184 -11.993 6.670 12.238 1.00 0.87 H new ATOM 0 HA ILE A 184 -10.123 5.477 10.359 1.00 0.83 H new ATOM 0 HB ILE A 184 -12.263 7.576 10.398 1.00 0.96 H new ATOM 0 HG12 ILE A 184 -12.229 6.093 7.993 1.00 0.98 H new ATOM 0 HG13 ILE A 184 -11.752 4.944 9.227 1.00 0.98 H new ATOM 0 HG21 ILE A 184 -11.647 8.384 8.166 1.00 1.00 H new ATOM 0 HG22 ILE A 184 -10.430 8.798 9.397 1.00 1.00 H new ATOM 0 HG23 ILE A 184 -10.127 7.464 8.258 1.00 1.00 H new ATOM 0 HD11 ILE A 184 -14.170 4.915 8.891 1.00 1.13 H new ATOM 0 HD12 ILE A 184 -13.773 5.483 10.530 1.00 1.13 H new ATOM 0 HD13 ILE A 184 -14.258 6.650 9.277 1.00 1.13 H new ATOM 2936 N GLU A 185 -9.532 8.171 12.069 1.00 0.91 N ATOM 2937 CA GLU A 185 -8.451 9.037 12.525 1.00 0.99 C ATOM 2938 C GLU A 185 -7.272 8.207 13.024 1.00 0.91 C ATOM 2939 O GLU A 185 -6.131 8.668 13.020 1.00 0.99 O ATOM 2940 CB GLU A 185 -8.949 10.013 13.604 1.00 1.17 C ATOM 2941 CG GLU A 185 -9.781 9.374 14.716 1.00 1.58 C ATOM 2942 CD GLU A 185 -8.955 8.829 15.867 1.00 2.26 C ATOM 2943 OE1 GLU A 185 -8.586 9.604 16.768 1.00 2.46 O ATOM 2944 OE2 GLU A 185 -8.650 7.622 15.864 1.00 2.89 O ATOM 0 H GLU A 185 -10.408 8.287 12.578 1.00 0.91 H new ATOM 0 HA GLU A 185 -8.106 9.631 11.679 1.00 0.99 H new ATOM 0 HB2 GLU A 185 -8.087 10.506 14.053 1.00 1.17 H new ATOM 0 HB3 GLU A 185 -9.546 10.789 13.124 1.00 1.17 H new ATOM 0 HG2 GLU A 185 -10.482 10.114 15.103 1.00 1.58 H new ATOM 0 HG3 GLU A 185 -10.375 8.564 14.292 1.00 1.58 H new ATOM 2951 N LYS A 186 -7.558 6.986 13.462 1.00 0.82 N ATOM 2952 CA LYS A 186 -6.511 6.057 13.858 1.00 0.79 C ATOM 2953 C LYS A 186 -6.119 5.164 12.686 1.00 0.70 C ATOM 2954 O LYS A 186 -4.944 4.841 12.519 1.00 0.86 O ATOM 2955 CB LYS A 186 -6.954 5.206 15.060 1.00 0.80 C ATOM 2956 CG LYS A 186 -7.561 3.860 14.703 1.00 1.27 C ATOM 2957 CD LYS A 186 -8.403 3.301 15.836 1.00 1.28 C ATOM 2958 CE LYS A 186 -9.588 4.208 16.123 1.00 0.96 C ATOM 2959 NZ LYS A 186 -9.264 5.277 17.105 1.00 1.09 N ATOM 0 H LYS A 186 -8.505 6.619 13.551 1.00 0.82 H new ATOM 0 HA LYS A 186 -5.639 6.638 14.159 1.00 0.79 H new ATOM 0 HB2 LYS A 186 -6.092 5.039 15.706 1.00 0.80 H new ATOM 0 HB3 LYS A 186 -7.682 5.774 15.640 1.00 0.80 H new ATOM 0 HG2 LYS A 186 -8.177 3.965 13.810 1.00 1.27 H new ATOM 0 HG3 LYS A 186 -6.765 3.156 14.460 1.00 1.27 H new ATOM 0 HD2 LYS A 186 -8.757 2.304 15.575 1.00 1.28 H new ATOM 0 HD3 LYS A 186 -7.792 3.198 16.733 1.00 1.28 H new ATOM 0 HE2 LYS A 186 -9.925 4.664 15.192 1.00 0.96 H new ATOM 0 HE3 LYS A 186 -10.416 3.609 16.503 1.00 0.96 H new ATOM 0 HZ1 LYS A 186 -9.873 5.175 17.942 1.00 1.09 H new ATOM 0 HZ2 LYS A 186 -8.267 5.196 17.390 1.00 1.09 H new ATOM 0 HZ3 LYS A 186 -9.426 6.208 16.671 1.00 1.09 H new ATOM 2973 N THR A 187 -7.102 4.781 11.862 1.00 0.59 N ATOM 2974 CA THR A 187 -6.861 3.775 10.829 1.00 0.54 C ATOM 2975 C THR A 187 -5.892 4.280 9.758 1.00 0.50 C ATOM 2976 O THR A 187 -5.192 3.486 9.130 1.00 0.53 O ATOM 2977 CB THR A 187 -8.177 3.297 10.164 1.00 0.58 C ATOM 2978 OG1 THR A 187 -7.954 2.073 9.456 1.00 0.62 O ATOM 2979 CG2 THR A 187 -8.716 4.333 9.194 1.00 0.60 C ATOM 0 H THR A 187 -8.054 5.146 11.891 1.00 0.59 H new ATOM 0 HA THR A 187 -6.405 2.924 11.335 1.00 0.54 H new ATOM 0 HB THR A 187 -8.909 3.144 10.957 1.00 0.58 H new ATOM 0 HG1 THR A 187 -8.791 1.778 9.041 1.00 0.62 H new ATOM 0 HG21 THR A 187 -9.639 3.966 8.745 1.00 0.60 H new ATOM 0 HG22 THR A 187 -8.916 5.262 9.728 1.00 0.60 H new ATOM 0 HG23 THR A 187 -7.980 4.516 8.411 1.00 0.60 H new ATOM 2987 N MET A 188 -5.834 5.592 9.558 1.00 0.52 N ATOM 2988 CA MET A 188 -4.982 6.149 8.512 1.00 0.53 C ATOM 2989 C MET A 188 -3.509 6.159 8.929 1.00 0.54 C ATOM 2990 O MET A 188 -2.687 5.517 8.275 1.00 0.54 O ATOM 2991 CB MET A 188 -5.450 7.549 8.093 1.00 0.62 C ATOM 2992 CG MET A 188 -6.882 7.602 7.566 1.00 0.80 C ATOM 2993 SD MET A 188 -7.067 7.003 5.866 1.00 1.06 S ATOM 2994 CE MET A 188 -6.748 5.246 6.036 1.00 0.83 C ATOM 0 H MET A 188 -6.358 6.281 10.097 1.00 0.52 H new ATOM 0 HA MET A 188 -5.071 5.497 7.643 1.00 0.53 H new ATOM 0 HB2 MET A 188 -5.365 8.219 8.949 1.00 0.62 H new ATOM 0 HB3 MET A 188 -4.778 7.929 7.323 1.00 0.62 H new ATOM 0 HG2 MET A 188 -7.521 7.009 8.220 1.00 0.80 H new ATOM 0 HG3 MET A 188 -7.239 8.630 7.618 1.00 0.80 H new ATOM 0 HE1 MET A 188 -5.839 4.987 5.493 1.00 0.83 H new ATOM 0 HE2 MET A 188 -6.623 4.999 7.090 1.00 0.83 H new ATOM 0 HE3 MET A 188 -7.587 4.683 5.628 1.00 0.83 H new ATOM 3004 N PRO A 189 -3.135 6.855 10.024 1.00 0.60 N ATOM 3005 CA PRO A 189 -1.740 6.896 10.470 1.00 0.71 C ATOM 3006 C PRO A 189 -1.214 5.506 10.809 1.00 0.74 C ATOM 3007 O PRO A 189 -0.067 5.179 10.520 1.00 0.91 O ATOM 3008 CB PRO A 189 -1.769 7.780 11.723 1.00 0.84 C ATOM 3009 CG PRO A 189 -3.194 7.794 12.158 1.00 0.83 C ATOM 3010 CD PRO A 189 -4.011 7.645 10.908 1.00 0.63 C ATOM 0 HA PRO A 189 -1.079 7.280 9.693 1.00 0.71 H new ATOM 0 HB2 PRO A 189 -1.123 7.378 12.504 1.00 0.84 H new ATOM 0 HB3 PRO A 189 -1.415 8.787 11.503 1.00 0.84 H new ATOM 0 HG2 PRO A 189 -3.397 6.981 12.856 1.00 0.83 H new ATOM 0 HG3 PRO A 189 -3.435 8.724 12.673 1.00 0.83 H new ATOM 0 HD2 PRO A 189 -4.954 7.134 11.102 1.00 0.63 H new ATOM 0 HD3 PRO A 189 -4.257 8.612 10.470 1.00 0.63 H new ATOM 3018 N SER A 190 -2.074 4.674 11.382 1.00 0.66 N ATOM 3019 CA SER A 190 -1.671 3.345 11.816 1.00 0.76 C ATOM 3020 C SER A 190 -1.396 2.447 10.619 1.00 0.72 C ATOM 3021 O SER A 190 -0.650 1.478 10.715 1.00 0.90 O ATOM 3022 CB SER A 190 -2.754 2.731 12.707 1.00 0.84 C ATOM 3023 OG SER A 190 -2.265 1.616 13.432 1.00 1.50 O ATOM 0 H SER A 190 -3.054 4.897 11.556 1.00 0.66 H new ATOM 0 HA SER A 190 -0.750 3.434 12.392 1.00 0.76 H new ATOM 0 HB2 SER A 190 -3.123 3.484 13.403 1.00 0.84 H new ATOM 0 HB3 SER A 190 -3.600 2.423 12.092 1.00 0.84 H new ATOM 0 HG SER A 190 -2.982 1.250 13.991 1.00 1.50 H new ATOM 3029 N ASN A 191 -1.990 2.781 9.487 1.00 0.57 N ATOM 3030 CA ASN A 191 -1.817 1.981 8.282 1.00 0.61 C ATOM 3031 C ASN A 191 -0.641 2.492 7.469 1.00 0.51 C ATOM 3032 O ASN A 191 0.197 1.717 7.018 1.00 0.52 O ATOM 3033 CB ASN A 191 -3.094 2.001 7.427 1.00 0.70 C ATOM 3034 CG ASN A 191 -3.164 0.888 6.380 1.00 1.08 C ATOM 3035 OD1 ASN A 191 -2.019 0.400 5.919 1.00 1.88 O flip ATOM 3036 ND2 ASN A 191 -4.253 0.465 5.990 1.00 1.46 N flip ATOM 0 H ASN A 191 -2.594 3.595 9.374 1.00 0.57 H new ATOM 0 HA ASN A 191 -1.617 0.953 8.585 1.00 0.61 H new ATOM 0 HB2 ASN A 191 -3.960 1.921 8.085 1.00 0.70 H new ATOM 0 HB3 ASN A 191 -3.165 2.964 6.922 1.00 0.70 H new ATOM 0 HD21 ASN A 191 -5.117 0.860 6.363 1.00 1.46 H new ATOM 0 HD22 ASN A 191 -4.291 -0.280 5.294 1.00 1.46 H new ATOM 3043 N LEU A 192 -0.574 3.801 7.304 1.00 0.45 N ATOM 3044 CA LEU A 192 0.379 4.402 6.393 1.00 0.42 C ATOM 3045 C LEU A 192 1.797 4.327 6.919 1.00 0.36 C ATOM 3046 O LEU A 192 2.716 3.953 6.195 1.00 0.35 O ATOM 3047 CB LEU A 192 0.002 5.852 6.140 1.00 0.48 C ATOM 3048 CG LEU A 192 -1.376 6.051 5.524 1.00 0.62 C ATOM 3049 CD1 LEU A 192 -1.628 7.521 5.267 1.00 1.04 C ATOM 3050 CD2 LEU A 192 -1.504 5.250 4.238 1.00 1.09 C ATOM 0 H LEU A 192 -1.171 4.469 7.792 1.00 0.45 H new ATOM 0 HA LEU A 192 0.344 3.838 5.461 1.00 0.42 H new ATOM 0 HB2 LEU A 192 0.045 6.395 7.084 1.00 0.48 H new ATOM 0 HB3 LEU A 192 0.748 6.298 5.482 1.00 0.48 H new ATOM 0 HG LEU A 192 -2.128 5.690 6.226 1.00 0.62 H new ATOM 0 HD11 LEU A 192 -2.617 7.649 4.826 1.00 1.04 H new ATOM 0 HD12 LEU A 192 -1.576 8.069 6.208 1.00 1.04 H new ATOM 0 HD13 LEU A 192 -0.873 7.905 4.581 1.00 1.04 H new ATOM 0 HD21 LEU A 192 -2.495 5.404 3.811 1.00 1.09 H new ATOM 0 HD22 LEU A 192 -0.747 5.580 3.527 1.00 1.09 H new ATOM 0 HD23 LEU A 192 -1.362 4.191 4.453 1.00 1.09 H new ATOM 3062 N VAL A 193 1.975 4.662 8.184 1.00 0.36 N ATOM 3063 CA VAL A 193 3.321 4.758 8.736 1.00 0.36 C ATOM 3064 C VAL A 193 3.856 3.365 8.969 1.00 0.39 C ATOM 3065 O VAL A 193 5.047 3.096 8.820 1.00 0.42 O ATOM 3066 CB VAL A 193 3.363 5.574 10.047 1.00 0.44 C ATOM 3067 CG1 VAL A 193 2.434 6.766 9.946 1.00 0.68 C ATOM 3068 CG2 VAL A 193 3.012 4.733 11.270 1.00 0.59 C ATOM 0 H VAL A 193 1.223 4.869 8.841 1.00 0.36 H new ATOM 0 HA VAL A 193 3.945 5.288 8.017 1.00 0.36 H new ATOM 0 HB VAL A 193 4.388 5.919 10.181 1.00 0.44 H new ATOM 0 HG11 VAL A 193 2.470 7.335 10.875 1.00 0.68 H new ATOM 0 HG12 VAL A 193 2.747 7.402 9.118 1.00 0.68 H new ATOM 0 HG13 VAL A 193 1.415 6.420 9.772 1.00 0.68 H new ATOM 0 HG21 VAL A 193 3.057 5.355 12.164 1.00 0.59 H new ATOM 0 HG22 VAL A 193 2.005 4.330 11.158 1.00 0.59 H new ATOM 0 HG23 VAL A 193 3.723 3.912 11.363 1.00 0.59 H new ATOM 3078 N ASN A 194 2.937 2.488 9.312 1.00 0.43 N ATOM 3079 CA ASN A 194 3.227 1.087 9.492 1.00 0.48 C ATOM 3080 C ASN A 194 3.693 0.491 8.188 1.00 0.45 C ATOM 3081 O ASN A 194 4.735 -0.153 8.142 1.00 0.49 O ATOM 3082 CB ASN A 194 1.975 0.375 9.966 1.00 0.58 C ATOM 3083 CG ASN A 194 2.162 -0.361 11.281 1.00 1.28 C ATOM 3084 OD1 ASN A 194 3.010 0.003 12.100 1.00 1.80 O ATOM 3085 ND2 ASN A 194 1.357 -1.394 11.497 1.00 2.07 N ATOM 0 H ASN A 194 1.960 2.732 9.474 1.00 0.43 H new ATOM 0 HA ASN A 194 4.015 0.970 10.236 1.00 0.48 H new ATOM 0 HB2 ASN A 194 1.172 1.103 10.077 1.00 0.58 H new ATOM 0 HB3 ASN A 194 1.659 -0.335 9.202 1.00 0.58 H new ATOM 0 HD21 ASN A 194 1.426 -1.921 12.368 1.00 2.07 H new ATOM 0 HD22 ASN A 194 0.670 -1.661 10.792 1.00 2.07 H new ATOM 3092 N PHE A 195 2.937 0.753 7.122 1.00 0.44 N ATOM 3093 CA PHE A 195 3.262 0.232 5.800 1.00 0.44 C ATOM 3094 C PHE A 195 4.670 0.663 5.401 1.00 0.36 C ATOM 3095 O PHE A 195 5.383 -0.048 4.689 1.00 0.36 O ATOM 3096 CB PHE A 195 2.241 0.709 4.766 1.00 0.47 C ATOM 3097 CG PHE A 195 2.058 -0.253 3.625 1.00 0.73 C ATOM 3098 CD1 PHE A 195 2.850 -0.155 2.492 1.00 1.51 C ATOM 3099 CD2 PHE A 195 1.096 -1.246 3.681 1.00 1.06 C ATOM 3100 CE1 PHE A 195 2.687 -1.032 1.437 1.00 2.00 C ATOM 3101 CE2 PHE A 195 0.928 -2.125 2.628 1.00 1.43 C ATOM 3102 CZ PHE A 195 1.713 -2.042 1.526 1.00 1.76 C ATOM 0 H PHE A 195 2.093 1.325 7.152 1.00 0.44 H new ATOM 0 HA PHE A 195 3.225 -0.857 5.835 1.00 0.44 H new ATOM 0 HB2 PHE A 195 1.281 0.865 5.258 1.00 0.47 H new ATOM 0 HB3 PHE A 195 2.558 1.674 4.371 1.00 0.47 H new ATOM 0 HD1 PHE A 195 3.604 0.616 2.433 1.00 1.51 H new ATOM 0 HD2 PHE A 195 0.470 -1.335 4.557 1.00 1.06 H new ATOM 0 HE1 PHE A 195 3.301 -0.943 0.553 1.00 2.00 H new ATOM 0 HE2 PHE A 195 0.164 -2.886 2.684 1.00 1.43 H new ATOM 0 HZ PHE A 195 1.591 -2.749 0.719 1.00 1.76 H new ATOM 3112 N ILE A 196 5.082 1.823 5.889 1.00 0.31 N ATOM 3113 CA ILE A 196 6.410 2.313 5.627 1.00 0.27 C ATOM 3114 C ILE A 196 7.457 1.647 6.503 1.00 0.28 C ATOM 3115 O ILE A 196 8.560 1.358 6.053 1.00 0.28 O ATOM 3116 CB ILE A 196 6.472 3.818 5.838 1.00 0.25 C ATOM 3117 CG1 ILE A 196 5.869 4.515 4.626 1.00 0.25 C ATOM 3118 CG2 ILE A 196 7.899 4.245 6.118 1.00 0.29 C ATOM 3119 CD1 ILE A 196 6.021 6.009 4.646 1.00 0.26 C ATOM 0 H ILE A 196 4.509 2.437 6.468 1.00 0.31 H new ATOM 0 HA ILE A 196 6.633 2.069 4.588 1.00 0.27 H new ATOM 0 HB ILE A 196 5.885 4.109 6.710 1.00 0.25 H new ATOM 0 HG12 ILE A 196 6.338 4.124 3.723 1.00 0.25 H new ATOM 0 HG13 ILE A 196 4.809 4.268 4.567 1.00 0.25 H new ATOM 0 HG21 ILE A 196 7.933 5.324 6.268 1.00 0.29 H new ATOM 0 HG22 ILE A 196 8.260 3.743 7.016 1.00 0.29 H new ATOM 0 HG23 ILE A 196 8.532 3.976 5.272 1.00 0.29 H new ATOM 0 HD11 ILE A 196 5.567 6.433 3.750 1.00 0.26 H new ATOM 0 HD12 ILE A 196 5.527 6.413 5.530 1.00 0.26 H new ATOM 0 HD13 ILE A 196 7.080 6.267 4.673 1.00 0.26 H new ATOM 3131 N LEU A 197 7.144 1.421 7.754 1.00 0.33 N ATOM 3132 CA LEU A 197 8.139 0.860 8.643 1.00 0.37 C ATOM 3133 C LEU A 197 8.247 -0.648 8.462 1.00 0.36 C ATOM 3134 O LEU A 197 9.266 -1.237 8.802 1.00 0.38 O ATOM 3135 CB LEU A 197 7.890 1.241 10.093 1.00 0.50 C ATOM 3136 CG LEU A 197 6.472 1.034 10.579 1.00 0.52 C ATOM 3137 CD1 LEU A 197 6.206 -0.447 10.759 1.00 1.00 C ATOM 3138 CD2 LEU A 197 6.229 1.792 11.871 1.00 1.03 C ATOM 0 H LEU A 197 6.234 1.609 8.175 1.00 0.33 H new ATOM 0 HA LEU A 197 9.101 1.294 8.371 1.00 0.37 H new ATOM 0 HB2 LEU A 197 8.562 0.661 10.725 1.00 0.50 H new ATOM 0 HB3 LEU A 197 8.153 2.290 10.227 1.00 0.50 H new ATOM 0 HG LEU A 197 5.781 1.426 9.833 1.00 0.52 H new ATOM 0 HD11 LEU A 197 5.184 -0.593 11.109 1.00 1.00 H new ATOM 0 HD12 LEU A 197 6.340 -0.959 9.806 1.00 1.00 H new ATOM 0 HD13 LEU A 197 6.902 -0.855 11.491 1.00 1.00 H new ATOM 0 HD21 LEU A 197 5.203 1.628 12.201 1.00 1.03 H new ATOM 0 HD22 LEU A 197 6.918 1.436 12.637 1.00 1.03 H new ATOM 0 HD23 LEU A 197 6.391 2.857 11.704 1.00 1.03 H new ATOM 3150 N ASN A 198 7.210 -1.287 7.923 1.00 0.38 N ATOM 3151 CA ASN A 198 7.392 -2.653 7.461 1.00 0.43 C ATOM 3152 C ASN A 198 8.177 -2.616 6.166 1.00 0.31 C ATOM 3153 O ASN A 198 8.704 -3.622 5.722 1.00 0.32 O ATOM 3154 CB ASN A 198 6.088 -3.458 7.296 1.00 0.65 C ATOM 3155 CG ASN A 198 5.073 -2.862 6.343 1.00 1.05 C ATOM 3156 OD1 ASN A 198 4.107 -2.250 6.773 1.00 1.90 O ATOM 3157 ND2 ASN A 198 5.272 -3.051 5.049 1.00 1.61 N ATOM 0 H ASN A 198 6.275 -0.898 7.800 1.00 0.38 H new ATOM 0 HA ASN A 198 7.939 -3.187 8.238 1.00 0.43 H new ATOM 0 HB2 ASN A 198 6.341 -4.460 6.950 1.00 0.65 H new ATOM 0 HB3 ASN A 198 5.622 -3.567 8.275 1.00 0.65 H new ATOM 0 HD21 ASN A 198 4.606 -2.680 4.371 1.00 1.61 H new ATOM 0 HD22 ASN A 198 6.091 -3.568 4.729 1.00 1.61 H new ATOM 3164 N ALA A 199 8.286 -1.435 5.572 1.00 0.29 N ATOM 3165 CA ALA A 199 9.186 -1.258 4.455 1.00 0.25 C ATOM 3166 C ALA A 199 10.582 -1.030 5.001 1.00 0.23 C ATOM 3167 O ALA A 199 11.575 -1.357 4.360 1.00 0.26 O ATOM 3168 CB ALA A 199 8.744 -0.110 3.577 1.00 0.26 C ATOM 0 H ALA A 199 7.768 -0.600 5.845 1.00 0.29 H new ATOM 0 HA ALA A 199 9.180 -2.151 3.829 1.00 0.25 H new ATOM 0 HB1 ALA A 199 9.439 0.000 2.745 1.00 0.26 H new ATOM 0 HB2 ALA A 199 7.745 -0.311 3.191 1.00 0.26 H new ATOM 0 HB3 ALA A 199 8.729 0.810 4.161 1.00 0.26 H new ATOM 3174 N LYS A 200 10.642 -0.485 6.215 1.00 0.26 N ATOM 3175 CA LYS A 200 11.907 -0.330 6.922 1.00 0.29 C ATOM 3176 C LYS A 200 12.427 -1.698 7.328 1.00 0.31 C ATOM 3177 O LYS A 200 13.623 -1.977 7.265 1.00 0.36 O ATOM 3178 CB LYS A 200 11.718 0.500 8.187 1.00 0.34 C ATOM 3179 CG LYS A 200 11.236 1.928 7.964 1.00 0.57 C ATOM 3180 CD LYS A 200 12.269 2.769 7.235 1.00 0.54 C ATOM 3181 CE LYS A 200 12.116 4.251 7.552 1.00 0.64 C ATOM 3182 NZ LYS A 200 12.174 4.517 9.018 1.00 0.97 N ATOM 0 H LYS A 200 9.828 -0.144 6.727 1.00 0.26 H new ATOM 0 HA LYS A 200 12.611 0.172 6.259 1.00 0.29 H new ATOM 0 HB2 LYS A 200 11.003 -0.010 8.833 1.00 0.34 H new ATOM 0 HB3 LYS A 200 12.666 0.534 8.724 1.00 0.34 H new ATOM 0 HG2 LYS A 200 10.310 1.913 7.389 1.00 0.57 H new ATOM 0 HG3 LYS A 200 11.007 2.388 8.925 1.00 0.57 H new ATOM 0 HD2 LYS A 200 13.270 2.439 7.514 1.00 0.54 H new ATOM 0 HD3 LYS A 200 12.171 2.615 6.160 1.00 0.54 H new ATOM 0 HE2 LYS A 200 12.904 4.812 7.050 1.00 0.64 H new ATOM 0 HE3 LYS A 200 11.166 4.611 7.155 1.00 0.64 H new ATOM 0 HZ1 LYS A 200 12.568 5.465 9.183 1.00 0.97 H new ATOM 0 HZ2 LYS A 200 11.215 4.466 9.418 1.00 0.97 H new ATOM 0 HZ3 LYS A 200 12.779 3.806 9.476 1.00 0.97 H new ATOM 3196 N ASP A 201 11.496 -2.547 7.737 1.00 0.30 N ATOM 3197 CA ASP A 201 11.817 -3.877 8.245 1.00 0.33 C ATOM 3198 C ASP A 201 11.917 -4.857 7.107 1.00 0.31 C ATOM 3199 O ASP A 201 12.787 -5.713 7.095 1.00 0.36 O ATOM 3200 CB ASP A 201 10.759 -4.377 9.239 1.00 0.40 C ATOM 3201 CG ASP A 201 10.942 -3.844 10.646 1.00 1.10 C ATOM 3202 OD1 ASP A 201 12.085 -3.874 11.157 1.00 1.18 O ATOM 3203 OD2 ASP A 201 9.933 -3.445 11.269 1.00 1.94 O ATOM 0 H ASP A 201 10.498 -2.336 7.727 1.00 0.30 H new ATOM 0 HA ASP A 201 12.773 -3.803 8.763 1.00 0.33 H new ATOM 0 HB2 ASP A 201 9.771 -4.092 8.878 1.00 0.40 H new ATOM 0 HB3 ASP A 201 10.786 -5.466 9.267 1.00 0.40 H new ATOM 3208 N GLY A 202 11.026 -4.715 6.147 1.00 0.31 N ATOM 3209 CA GLY A 202 10.993 -5.625 5.018 1.00 0.37 C ATOM 3210 C GLY A 202 12.173 -5.423 4.110 1.00 0.37 C ATOM 3211 O GLY A 202 12.634 -6.357 3.459 1.00 0.47 O ATOM 0 H GLY A 202 10.317 -3.982 6.125 1.00 0.31 H new ATOM 0 HA2 GLY A 202 10.983 -6.653 5.379 1.00 0.37 H new ATOM 0 HA3 GLY A 202 10.071 -5.475 4.456 1.00 0.37 H new ATOM 3215 N ILE A 203 12.670 -4.202 4.068 1.00 0.30 N ATOM 3216 CA ILE A 203 13.837 -3.890 3.281 1.00 0.37 C ATOM 3217 C ILE A 203 15.070 -4.498 3.933 1.00 0.47 C ATOM 3218 O ILE A 203 16.006 -4.908 3.252 1.00 0.61 O ATOM 3219 CB ILE A 203 14.016 -2.366 3.108 1.00 0.32 C ATOM 3220 CG1 ILE A 203 14.591 -2.058 1.749 1.00 0.41 C ATOM 3221 CG2 ILE A 203 14.921 -1.773 4.155 1.00 0.38 C ATOM 3222 CD1 ILE A 203 13.603 -2.203 0.637 1.00 0.52 C ATOM 0 H ILE A 203 12.278 -3.408 4.575 1.00 0.30 H new ATOM 0 HA ILE A 203 13.702 -4.317 2.287 1.00 0.37 H new ATOM 0 HB ILE A 203 13.026 -1.922 3.215 1.00 0.32 H new ATOM 0 HG12 ILE A 203 14.979 -1.039 1.750 1.00 0.41 H new ATOM 0 HG13 ILE A 203 15.436 -2.720 1.562 1.00 0.41 H new ATOM 0 HG21 ILE A 203 15.014 -0.700 3.990 1.00 0.38 H new ATOM 0 HG22 ILE A 203 14.500 -1.952 5.144 1.00 0.38 H new ATOM 0 HG23 ILE A 203 15.905 -2.237 4.090 1.00 0.38 H new ATOM 0 HD11 ILE A 203 14.085 -1.966 -0.311 1.00 0.52 H new ATOM 0 HD12 ILE A 203 13.233 -3.228 0.610 1.00 0.52 H new ATOM 0 HD13 ILE A 203 12.769 -1.521 0.800 1.00 0.52 H new ATOM 3234 N LYS A 204 15.047 -4.589 5.260 1.00 0.47 N ATOM 3235 CA LYS A 204 16.135 -5.223 5.985 1.00 0.63 C ATOM 3236 C LYS A 204 15.874 -6.707 6.055 1.00 0.64 C ATOM 3237 O LYS A 204 16.771 -7.486 6.253 1.00 0.78 O ATOM 3238 CB LYS A 204 16.294 -4.690 7.401 1.00 0.74 C ATOM 3239 CG LYS A 204 16.442 -3.189 7.504 1.00 1.21 C ATOM 3240 CD LYS A 204 16.898 -2.813 8.898 1.00 1.55 C ATOM 3241 CE LYS A 204 16.955 -1.312 9.096 1.00 2.41 C ATOM 3242 NZ LYS A 204 15.606 -0.692 9.035 1.00 3.37 N ATOM 0 H LYS A 204 14.292 -4.234 5.847 1.00 0.47 H new ATOM 0 HA LYS A 204 17.056 -5.001 5.446 1.00 0.63 H new ATOM 0 HB2 LYS A 204 15.428 -4.996 7.988 1.00 0.74 H new ATOM 0 HB3 LYS A 204 17.168 -5.158 7.854 1.00 0.74 H new ATOM 0 HG2 LYS A 204 17.163 -2.834 6.768 1.00 1.21 H new ATOM 0 HG3 LYS A 204 15.492 -2.704 7.279 1.00 1.21 H new ATOM 0 HD2 LYS A 204 16.219 -3.249 9.631 1.00 1.55 H new ATOM 0 HD3 LYS A 204 17.884 -3.240 9.084 1.00 1.55 H new ATOM 0 HE2 LYS A 204 17.413 -1.090 10.060 1.00 2.41 H new ATOM 0 HE3 LYS A 204 17.593 -0.869 8.331 1.00 2.41 H new ATOM 0 HZ1 LYS A 204 15.606 0.072 8.329 1.00 3.37 H new ATOM 0 HZ2 LYS A 204 14.905 -1.412 8.766 1.00 3.37 H new ATOM 0 HZ3 LYS A 204 15.361 -0.301 9.967 1.00 3.37 H new ATOM 3256 N ALA A 205 14.622 -7.087 5.938 1.00 0.57 N ATOM 3257 CA ALA A 205 14.274 -8.482 5.765 1.00 0.69 C ATOM 3258 C ALA A 205 14.795 -8.965 4.420 1.00 0.87 C ATOM 3259 O ALA A 205 15.149 -10.130 4.254 1.00 1.02 O ATOM 3260 CB ALA A 205 12.769 -8.662 5.859 1.00 0.68 C ATOM 0 H ALA A 205 13.826 -6.450 5.959 1.00 0.57 H new ATOM 0 HA ALA A 205 14.733 -9.075 6.556 1.00 0.69 H new ATOM 0 HB1 ALA A 205 12.520 -9.715 5.727 1.00 0.68 H new ATOM 0 HB2 ALA A 205 12.423 -8.327 6.837 1.00 0.68 H new ATOM 0 HB3 ALA A 205 12.283 -8.074 5.081 1.00 0.68 H new ATOM 3266 N HIS A 206 14.839 -8.049 3.459 1.00 0.89 N ATOM 3267 CA HIS A 206 15.380 -8.360 2.138 1.00 1.11 C ATOM 3268 C HIS A 206 16.872 -8.034 2.025 1.00 1.21 C ATOM 3269 O HIS A 206 17.503 -8.343 1.017 1.00 1.52 O ATOM 3270 CB HIS A 206 14.591 -7.626 1.054 1.00 1.29 C ATOM 3271 CG HIS A 206 13.280 -8.279 0.747 1.00 2.13 C ATOM 3272 ND1 HIS A 206 12.163 -8.122 1.531 1.00 2.83 N ATOM 3273 CD2 HIS A 206 12.919 -9.119 -0.252 1.00 2.92 C ATOM 3274 CE1 HIS A 206 11.175 -8.839 1.035 1.00 3.56 C ATOM 3275 NE2 HIS A 206 11.604 -9.454 -0.046 1.00 3.63 N ATOM 0 H HIS A 206 14.509 -7.090 3.567 1.00 0.89 H new ATOM 0 HA HIS A 206 15.276 -9.435 1.994 1.00 1.11 H new ATOM 0 HB2 HIS A 206 14.414 -6.599 1.373 1.00 1.29 H new ATOM 0 HB3 HIS A 206 15.190 -7.579 0.144 1.00 1.29 H new ATOM 0 HD1 HIS A 206 12.107 -7.541 2.367 1.00 2.83 H new ATOM 0 HD2 HIS A 206 13.548 -9.461 -1.060 1.00 2.92 H new ATOM 0 HE1 HIS A 206 10.179 -8.910 1.447 1.00 3.56 H new ATOM 3284 N ARG A 207 17.431 -7.403 3.048 1.00 1.11 N ATOM 3285 CA ARG A 207 18.861 -7.102 3.079 1.00 1.23 C ATOM 3286 C ARG A 207 19.550 -7.957 4.137 1.00 1.36 C ATOM 3287 O ARG A 207 20.443 -8.751 3.851 1.00 1.67 O ATOM 3288 CB ARG A 207 19.063 -5.611 3.389 1.00 1.20 C ATOM 3289 CG ARG A 207 20.486 -5.109 3.196 1.00 1.41 C ATOM 3290 CD ARG A 207 21.371 -5.386 4.404 1.00 1.49 C ATOM 3291 NE ARG A 207 22.779 -5.100 4.126 1.00 1.73 N ATOM 3292 CZ ARG A 207 23.523 -4.233 4.812 1.00 2.04 C ATOM 3293 NH1 ARG A 207 23.007 -3.549 5.826 1.00 2.47 N ATOM 3294 NH2 ARG A 207 24.795 -4.050 4.477 1.00 2.59 N ATOM 0 H ARG A 207 16.917 -7.088 3.871 1.00 1.11 H new ATOM 0 HA ARG A 207 19.300 -7.329 2.107 1.00 1.23 H new ATOM 0 HB2 ARG A 207 18.397 -5.028 2.753 1.00 1.20 H new ATOM 0 HB3 ARG A 207 18.763 -5.424 4.420 1.00 1.20 H new ATOM 0 HG2 ARG A 207 20.919 -5.584 2.316 1.00 1.41 H new ATOM 0 HG3 ARG A 207 20.466 -4.037 3.002 1.00 1.41 H new ATOM 0 HD2 ARG A 207 21.037 -4.779 5.246 1.00 1.49 H new ATOM 0 HD3 ARG A 207 21.264 -6.429 4.701 1.00 1.49 H new ATOM 0 HE ARG A 207 23.221 -5.599 3.354 1.00 1.73 H new ATOM 0 HH11 ARG A 207 22.031 -3.684 6.088 1.00 2.47 H new ATOM 0 HH12 ARG A 207 23.587 -2.888 6.343 1.00 2.47 H new ATOM 0 HH21 ARG A 207 25.197 -4.572 3.698 1.00 2.59 H new ATOM 0 HH22 ARG A 207 25.369 -3.388 4.998 1.00 2.59 H new ATOM 3308 N THR A 208 19.104 -7.767 5.355 1.00 1.20 N ATOM 3309 CA THR A 208 19.603 -8.465 6.519 1.00 1.41 C ATOM 3310 C THR A 208 18.894 -9.817 6.660 1.00 1.48 C ATOM 3311 O THR A 208 17.709 -9.938 6.341 1.00 1.35 O ATOM 3312 CB THR A 208 19.326 -7.587 7.764 1.00 1.37 C ATOM 3313 OG1 THR A 208 19.994 -6.327 7.625 1.00 1.84 O ATOM 3314 CG2 THR A 208 19.761 -8.249 9.061 1.00 1.53 C ATOM 0 H THR A 208 18.361 -7.103 5.572 1.00 1.20 H new ATOM 0 HA THR A 208 20.673 -8.647 6.420 1.00 1.41 H new ATOM 0 HB THR A 208 18.247 -7.444 7.819 1.00 1.37 H new ATOM 0 HG1 THR A 208 19.815 -5.773 8.414 1.00 1.84 H new ATOM 0 HG21 THR A 208 19.542 -7.587 9.899 1.00 1.53 H new ATOM 0 HG22 THR A 208 19.221 -9.187 9.189 1.00 1.53 H new ATOM 0 HG23 THR A 208 20.832 -8.448 9.026 1.00 1.53 H new ATOM 3322 N PRO A 209 19.605 -10.864 7.098 1.00 1.78 N ATOM 3323 CA PRO A 209 18.994 -12.166 7.405 1.00 1.95 C ATOM 3324 C PRO A 209 18.106 -12.098 8.652 1.00 1.87 C ATOM 3325 O PRO A 209 18.229 -12.908 9.568 1.00 2.12 O ATOM 3326 CB PRO A 209 20.200 -13.087 7.646 1.00 2.33 C ATOM 3327 CG PRO A 209 21.377 -12.343 7.110 1.00 2.35 C ATOM 3328 CD PRO A 209 21.058 -10.891 7.289 1.00 2.03 C ATOM 0 HA PRO A 209 18.341 -12.513 6.604 1.00 1.95 H new ATOM 0 HB2 PRO A 209 20.322 -13.305 8.707 1.00 2.33 H new ATOM 0 HB3 PRO A 209 20.073 -14.042 7.137 1.00 2.33 H new ATOM 0 HG2 PRO A 209 22.287 -12.612 7.646 1.00 2.35 H new ATOM 0 HG3 PRO A 209 21.544 -12.580 6.059 1.00 2.35 H new ATOM 0 HD2 PRO A 209 21.345 -10.530 8.277 1.00 2.03 H new ATOM 0 HD3 PRO A 209 21.576 -10.268 6.560 1.00 2.03 H new ATOM 3336 N SER A 210 17.199 -11.127 8.664 1.00 1.76 N ATOM 3337 CA SER A 210 16.337 -10.876 9.807 1.00 1.78 C ATOM 3338 C SER A 210 15.364 -12.033 10.028 1.00 1.74 C ATOM 3339 O SER A 210 14.955 -12.305 11.158 1.00 2.01 O ATOM 3340 CB SER A 210 15.571 -9.564 9.591 1.00 1.85 C ATOM 3341 OG SER A 210 14.769 -9.231 10.713 1.00 2.31 O ATOM 0 H SER A 210 17.043 -10.493 7.880 1.00 1.76 H new ATOM 0 HA SER A 210 16.956 -10.790 10.700 1.00 1.78 H new ATOM 0 HB2 SER A 210 16.279 -8.758 9.398 1.00 1.85 H new ATOM 0 HB3 SER A 210 14.940 -9.653 8.707 1.00 1.85 H new ATOM 0 HG SER A 210 14.298 -8.389 10.540 1.00 2.31 H new ATOM 3347 N ARG A 211 15.007 -12.730 8.955 1.00 1.75 N ATOM 3348 CA ARG A 211 14.069 -13.840 9.069 1.00 1.94 C ATOM 3349 C ARG A 211 14.803 -15.177 9.074 1.00 2.32 C ATOM 3350 O ARG A 211 14.189 -16.229 8.899 1.00 2.55 O ATOM 3351 CB ARG A 211 13.014 -13.819 7.951 1.00 2.31 C ATOM 3352 CG ARG A 211 13.530 -14.223 6.576 1.00 2.60 C ATOM 3353 CD ARG A 211 14.154 -13.058 5.827 1.00 3.06 C ATOM 3354 NE ARG A 211 14.617 -13.463 4.500 1.00 3.80 N ATOM 3355 CZ ARG A 211 13.987 -13.163 3.363 1.00 4.56 C ATOM 3356 NH1 ARG A 211 12.870 -12.443 3.396 1.00 4.78 N ATOM 3357 NH2 ARG A 211 14.471 -13.585 2.199 1.00 5.45 N ATOM 0 H ARG A 211 15.347 -12.550 8.010 1.00 1.75 H new ATOM 0 HA ARG A 211 13.549 -13.720 10.020 1.00 1.94 H new ATOM 0 HB2 ARG A 211 12.199 -14.487 8.228 1.00 2.31 H new ATOM 0 HB3 ARG A 211 12.595 -12.815 7.885 1.00 2.31 H new ATOM 0 HG2 ARG A 211 14.268 -15.017 6.687 1.00 2.60 H new ATOM 0 HG3 ARG A 211 12.708 -14.631 5.988 1.00 2.60 H new ATOM 0 HD2 ARG A 211 13.425 -12.254 5.730 1.00 3.06 H new ATOM 0 HD3 ARG A 211 14.992 -12.661 6.401 1.00 3.06 H new ATOM 0 HE ARG A 211 15.476 -14.010 4.440 1.00 3.80 H new ATOM 0 HH11 ARG A 211 12.497 -12.121 4.289 1.00 4.78 H new ATOM 0 HH12 ARG A 211 12.386 -12.212 2.528 1.00 4.78 H new ATOM 0 HH21 ARG A 211 15.326 -14.140 2.173 1.00 5.45 H new ATOM 0 HH22 ARG A 211 13.987 -13.354 1.331 1.00 5.45 H new ATOM 3371 N ARG A 212 16.119 -15.132 9.279 1.00 2.62 N ATOM 3372 CA ARG A 212 16.909 -16.353 9.401 1.00 3.26 C ATOM 3373 C ARG A 212 16.431 -17.137 10.616 1.00 3.32 C ATOM 3374 O ARG A 212 16.281 -18.357 10.567 1.00 3.71 O ATOM 3375 CB ARG A 212 18.402 -16.024 9.518 1.00 3.80 C ATOM 3376 CG ARG A 212 19.284 -17.242 9.750 1.00 4.37 C ATOM 3377 CD ARG A 212 20.758 -16.869 9.787 1.00 4.99 C ATOM 3378 NE ARG A 212 21.594 -17.991 10.209 1.00 5.44 N ATOM 3379 CZ ARG A 212 22.756 -18.320 9.645 1.00 6.24 C ATOM 3380 NH1 ARG A 212 23.259 -17.588 8.659 1.00 6.66 N ATOM 3381 NH2 ARG A 212 23.423 -19.377 10.084 1.00 6.86 N ATOM 0 H ARG A 212 16.656 -14.269 9.363 1.00 2.62 H new ATOM 0 HA ARG A 212 16.775 -16.960 8.506 1.00 3.26 H new ATOM 0 HB2 ARG A 212 18.726 -15.521 8.607 1.00 3.80 H new ATOM 0 HB3 ARG A 212 18.546 -15.321 10.339 1.00 3.80 H new ATOM 0 HG2 ARG A 212 19.006 -17.720 10.689 1.00 4.37 H new ATOM 0 HG3 ARG A 212 19.113 -17.972 8.959 1.00 4.37 H new ATOM 0 HD2 ARG A 212 21.072 -16.534 8.799 1.00 4.99 H new ATOM 0 HD3 ARG A 212 20.903 -16.031 10.469 1.00 4.99 H new ATOM 0 HE ARG A 212 21.266 -18.561 10.988 1.00 5.44 H new ATOM 0 HH11 ARG A 212 22.756 -16.766 8.326 1.00 6.66 H new ATOM 0 HH12 ARG A 212 24.149 -17.848 8.234 1.00 6.66 H new ATOM 0 HH21 ARG A 212 23.047 -19.935 10.850 1.00 6.86 H new ATOM 0 HH22 ARG A 212 24.313 -19.633 9.656 1.00 6.86 H new ATOM 3395 N GLY A 213 16.171 -16.412 11.694 1.00 3.12 N ATOM 3396 CA GLY A 213 15.561 -17.004 12.862 1.00 3.37 C ATOM 3397 C GLY A 213 14.086 -16.665 12.932 1.00 2.92 C ATOM 3398 O GLY A 213 13.664 -15.847 13.751 1.00 3.19 O ATOM 0 H GLY A 213 16.374 -15.416 11.778 1.00 3.12 H new ATOM 0 HA2 GLY A 213 15.689 -18.086 12.835 1.00 3.37 H new ATOM 0 HA3 GLY A 213 16.064 -16.646 13.761 1.00 3.37 H new ATOM 3402 N PHE A 214 13.306 -17.271 12.049 1.00 2.56 N ATOM 3403 CA PHE A 214 11.880 -16.990 11.962 1.00 2.44 C ATOM 3404 C PHE A 214 11.101 -17.876 12.926 1.00 2.70 C ATOM 3405 O PHE A 214 11.173 -19.103 12.854 1.00 3.00 O ATOM 3406 CB PHE A 214 11.392 -17.207 10.526 1.00 2.65 C ATOM 3407 CG PHE A 214 9.956 -16.831 10.298 1.00 3.21 C ATOM 3408 CD1 PHE A 214 9.603 -15.512 10.062 1.00 3.82 C ATOM 3409 CD2 PHE A 214 8.961 -17.794 10.319 1.00 3.73 C ATOM 3410 CE1 PHE A 214 8.286 -15.160 9.850 1.00 4.85 C ATOM 3411 CE2 PHE A 214 7.641 -17.447 10.108 1.00 4.67 C ATOM 3412 CZ PHE A 214 7.304 -16.129 9.873 1.00 5.21 C ATOM 0 H PHE A 214 13.639 -17.964 11.379 1.00 2.56 H new ATOM 0 HA PHE A 214 11.710 -15.950 12.240 1.00 2.44 H new ATOM 0 HB2 PHE A 214 12.019 -16.626 9.850 1.00 2.65 H new ATOM 0 HB3 PHE A 214 11.527 -18.256 10.263 1.00 2.65 H new ATOM 0 HD1 PHE A 214 10.368 -14.750 10.044 1.00 3.82 H new ATOM 0 HD2 PHE A 214 9.220 -18.826 10.502 1.00 3.73 H new ATOM 0 HE1 PHE A 214 8.024 -14.128 9.666 1.00 4.85 H new ATOM 0 HE2 PHE A 214 6.873 -18.206 10.127 1.00 4.67 H new ATOM 0 HZ PHE A 214 6.272 -15.857 9.707 1.00 5.21 H new ATOM 3422 N HIS A 215 10.365 -17.253 13.837 1.00 2.97 N ATOM 3423 CA HIS A 215 9.573 -17.997 14.809 1.00 3.39 C ATOM 3424 C HIS A 215 8.160 -17.443 14.902 1.00 3.17 C ATOM 3425 O HIS A 215 7.846 -16.684 15.815 1.00 3.66 O ATOM 3426 CB HIS A 215 10.237 -17.977 16.193 1.00 4.23 C ATOM 3427 CG HIS A 215 11.478 -18.805 16.274 1.00 4.93 C ATOM 3428 ND1 HIS A 215 11.480 -20.126 16.658 1.00 5.70 N ATOM 3429 CD2 HIS A 215 12.763 -18.494 15.999 1.00 5.40 C ATOM 3430 CE1 HIS A 215 12.713 -20.592 16.612 1.00 6.46 C ATOM 3431 NE2 HIS A 215 13.514 -19.620 16.214 1.00 6.32 N ATOM 0 H HIS A 215 10.299 -16.239 13.924 1.00 2.97 H new ATOM 0 HA HIS A 215 9.519 -19.030 14.465 1.00 3.39 H new ATOM 0 HB2 HIS A 215 10.480 -16.947 16.455 1.00 4.23 H new ATOM 0 HB3 HIS A 215 9.523 -18.335 16.934 1.00 4.23 H new ATOM 0 HD2 HIS A 215 13.131 -17.534 15.670 1.00 5.40 H new ATOM 0 HE1 HIS A 215 13.017 -21.599 16.858 1.00 6.46 H new ATOM 0 HE2 HIS A 215 14.523 -19.695 16.088 1.00 6.32 H new ATOM 3440 N HIS A 216 7.322 -17.830 13.937 1.00 2.99 N ATOM 3441 CA HIS A 216 5.893 -17.481 13.915 1.00 3.27 C ATOM 3442 C HIS A 216 5.659 -15.995 13.644 1.00 3.26 C ATOM 3443 O HIS A 216 6.080 -15.128 14.412 1.00 3.78 O ATOM 3444 CB HIS A 216 5.190 -17.862 15.226 1.00 3.92 C ATOM 3445 CG HIS A 216 5.218 -19.327 15.552 1.00 4.66 C ATOM 3446 ND1 HIS A 216 4.352 -20.245 14.996 1.00 5.31 N ATOM 3447 CD2 HIS A 216 6.005 -20.025 16.404 1.00 5.27 C ATOM 3448 CE1 HIS A 216 4.603 -21.442 15.497 1.00 6.09 C ATOM 3449 NE2 HIS A 216 5.604 -21.336 16.350 1.00 6.09 N ATOM 0 H HIS A 216 7.615 -18.398 13.142 1.00 2.99 H new ATOM 0 HA HIS A 216 5.466 -18.058 13.095 1.00 3.27 H new ATOM 0 HB2 HIS A 216 5.656 -17.313 16.044 1.00 3.92 H new ATOM 0 HB3 HIS A 216 4.151 -17.536 15.173 1.00 3.92 H new ATOM 0 HD2 HIS A 216 6.801 -19.624 17.014 1.00 5.27 H new ATOM 0 HE1 HIS A 216 4.078 -22.353 15.250 1.00 6.09 H new ATOM 0 HE2 HIS A 216 6.013 -22.104 16.883 1.00 6.09 H new ATOM 3458 N ASN A 217 4.965 -15.708 12.554 1.00 3.18 N ATOM 3459 CA ASN A 217 4.510 -14.348 12.275 1.00 3.63 C ATOM 3460 C ASN A 217 3.037 -14.227 12.646 1.00 4.03 C ATOM 3461 O ASN A 217 2.300 -13.420 12.080 1.00 4.27 O ATOM 3462 CB ASN A 217 4.712 -13.965 10.799 1.00 3.95 C ATOM 3463 CG ASN A 217 3.823 -14.745 9.843 1.00 4.57 C ATOM 3464 OD1 ASN A 217 3.552 -15.928 10.043 1.00 5.00 O ATOM 3465 ND2 ASN A 217 3.343 -14.077 8.807 1.00 5.12 N ATOM 0 H ASN A 217 4.703 -16.395 11.847 1.00 3.18 H new ATOM 0 HA ASN A 217 5.108 -13.661 12.874 1.00 3.63 H new ATOM 0 HB2 ASN A 217 4.515 -12.900 10.678 1.00 3.95 H new ATOM 0 HB3 ASN A 217 5.755 -14.129 10.529 1.00 3.95 H new ATOM 0 HD21 ASN A 217 2.726 -14.543 8.141 1.00 5.12 H new ATOM 0 HD22 ASN A 217 3.590 -13.096 8.674 1.00 5.12 H new ATOM 3472 N SER A 218 2.623 -15.052 13.599 1.00 4.58 N ATOM 3473 CA SER A 218 1.239 -15.109 14.036 1.00 5.38 C ATOM 3474 C SER A 218 0.788 -13.764 14.602 1.00 5.75 C ATOM 3475 O SER A 218 -0.355 -13.348 14.408 1.00 6.25 O ATOM 3476 CB SER A 218 1.087 -16.206 15.086 1.00 6.28 C ATOM 3477 OG SER A 218 1.704 -17.408 14.648 1.00 6.76 O ATOM 0 H SER A 218 3.240 -15.700 14.089 1.00 4.58 H new ATOM 0 HA SER A 218 0.607 -15.337 13.178 1.00 5.38 H new ATOM 0 HB2 SER A 218 1.536 -15.882 16.025 1.00 6.28 H new ATOM 0 HB3 SER A 218 0.030 -16.384 15.283 1.00 6.28 H new ATOM 0 HG SER A 218 1.598 -18.099 15.335 1.00 6.76 H new ATOM 3483 N HIS A 219 1.693 -13.093 15.304 1.00 5.79 N ATOM 3484 CA HIS A 219 1.410 -11.774 15.847 1.00 6.41 C ATOM 3485 C HIS A 219 2.689 -10.964 15.978 1.00 6.51 C ATOM 3486 O HIS A 219 3.785 -11.519 16.051 1.00 6.61 O ATOM 3487 CB HIS A 219 0.725 -11.870 17.220 1.00 7.04 C ATOM 3488 CG HIS A 219 1.587 -12.455 18.309 1.00 7.61 C ATOM 3489 ND1 HIS A 219 2.585 -11.748 18.953 1.00 8.17 N ATOM 3490 CD2 HIS A 219 1.582 -13.686 18.873 1.00 8.02 C ATOM 3491 CE1 HIS A 219 3.150 -12.521 19.861 1.00 8.82 C ATOM 3492 NE2 HIS A 219 2.561 -13.699 19.835 1.00 8.76 N ATOM 0 H HIS A 219 2.629 -13.442 15.510 1.00 5.79 H new ATOM 0 HA HIS A 219 0.734 -11.274 15.153 1.00 6.41 H new ATOM 0 HB2 HIS A 219 0.406 -10.873 17.523 1.00 7.04 H new ATOM 0 HB3 HIS A 219 -0.175 -12.477 17.121 1.00 7.04 H new ATOM 0 HD1 HIS A 219 2.844 -10.781 18.757 1.00 8.17 H new ATOM 0 HD2 HIS A 219 0.929 -14.506 18.614 1.00 8.02 H new ATOM 0 HE1 HIS A 219 3.960 -12.236 20.516 1.00 8.82 H new ATOM 3501 N SER A 220 2.542 -9.656 15.998 1.00 6.83 N ATOM 3502 CA SER A 220 3.648 -8.781 16.322 1.00 7.31 C ATOM 3503 C SER A 220 3.555 -8.398 17.796 1.00 7.98 C ATOM 3504 O SER A 220 4.011 -9.192 18.649 1.00 8.48 O ATOM 3505 CB SER A 220 3.621 -7.533 15.436 1.00 7.71 C ATOM 3506 OG SER A 220 3.684 -7.880 14.063 1.00 7.85 O ATOM 3507 OXT SER A 220 2.979 -7.333 18.102 1.00 8.25 O ATOM 0 H SER A 220 1.666 -9.175 15.793 1.00 6.83 H new ATOM 0 HA SER A 220 4.591 -9.297 16.139 1.00 7.31 H new ATOM 0 HB2 SER A 220 2.711 -6.966 15.629 1.00 7.71 H new ATOM 0 HB3 SER A 220 4.460 -6.885 15.689 1.00 7.71 H new ATOM 0 HG SER A 220 3.663 -7.065 13.518 1.00 7.85 H new TER 3513 SER A 220