USER MOD reduce.3.24.130724 H: found=0, std=0, add=1065, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 1052 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 27 THR OG1 : rot 79:sc= 0.818 USER MOD Set 1.2: A 91 HIS : no HD1:sc= -0.147 K(o=1.9,f=-2.6!) USER MOD Set 1.3: A 116 THR OG1 : rot 115:sc= 1.24 USER MOD Set 2.1: A 54 SER OG : rot 48:sc= 0.838 USER MOD Set 2.2: A 105 HIS : no HD1:sc= -0.731 K(o=0.11,f=-7.4!) USER MOD Set 3.1: A 82 HIS : no HD1:sc= -0.387 K(o=-0.21,f=-6.6!) USER MOD Set 3.2: A 88 SER OG : rot 106:sc= 0.174 USER MOD Set 4.1: A 73 CYS SG : rot 180:sc= -1.16 USER MOD Set 4.2: A 80 HIS : no HD1:sc= 0.696 K(o=-0.47,f=-4.1!) USER MOD Set 5.1: A 40 TYR OH : rot 23:sc= 0.862 USER MOD Set 5.2: A 89 MET CE :methyl -169:sc= -0.0445 (180deg=-0.241) USER MOD Single : A 3 LYS NZ :NH3+ -173:sc= 1.84 (180deg=1.78) USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 6 TYR OH : rot -23:sc= 0.926 USER MOD Single : A 9 MET CE :methyl 171:sc= -0.714 (180deg=-0.961) USER MOD Single : A 11 ASN : amide:sc=-0.000388 X(o=-0.00039,f=0) USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 ASN : amide:sc=-0.00437 X(o=-0.0044,f=0) USER MOD Single : A 30 ASN : amide:sc= -0.276 K(o=-0.28,f=-1.7!) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 ASN : amide:sc= -0.116 K(o=-0.12,f=-1.6!) USER MOD Single : A 41 ASN : amide:sc= -1.26! C(o=-1.3!,f=-7.6!) USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 46 HIS : no HD1:sc= -0.0136 K(o=-0.014,f=-1.5) USER MOD Single : A 55 GLN : amide:sc= 0 K(o=0,f=-0.94) USER MOD Single : A 58 CYS SG : rot 170:sc= 0.283 USER MOD Single : A 62 ASN : amide:sc= -0.0123 K(o=-0.012,f=-1.1) USER MOD Single : A 64 THR OG1 : rot 180:sc= 0 USER MOD Single : A 69 TYR OH : rot 180:sc= -0.184 USER MOD Single : A 70 THR OG1 : rot 180:sc= 0 USER MOD Single : A 75 THR OG1 : rot 180:sc= 0 USER MOD Single : A 77 ASN : amide:sc= -0.0196 K(o=-0.02,f=-1.1) USER MOD Single : A 78 ASN : amide:sc= 1.67 K(o=1.7,f=-0.049) USER MOD Single : A 84 THR OG1 : rot -75:sc= 0.314 USER MOD Single : A 87 MET CE :methyl 159:sc= -0.104 (180deg=-0.599) USER MOD Single : A 96 THR OG1 : rot 77:sc= 0.691 USER MOD Single : A 98 SER OG : rot -64:sc= 0.769 USER MOD Single : A 99 CYS SG : rot 55:sc= -0.599 USER MOD Single : A 100 GLN : amide:sc= 1.5 K(o=1.5,f=-3.5!) USER MOD Single : A 108 GLN : amide:sc= -0.0531 X(o=-0.053,f=-0.3) USER MOD Single : A 110 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 115 HIS : no HD1:sc= 0.815 K(o=0.82,f=-4.8!) USER MOD Single : A 120 GLN : amide:sc= 0 K(o=0,f=-0.83) USER MOD Single : A 122 THR OG1 : rot 180:sc= 0 USER MOD Single : A 123 SER OG : rot 180:sc= 0 USER MOD Single : A 125 MET CE :methyl 168:sc= 0 (180deg=-0.155) USER MOD Single : A 130 THR OG1 : rot -62:sc= 0.27 USER MOD Single : A 131 MET CE :methyl 171:sc= -0.117 (180deg=-0.332) USER MOD Single : A 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 133 ASN : amide:sc= 0.648 K(o=0.65,f=-3.3!) USER MOD Single : A 137 MET CE :methyl 162:sc= -0.0939 (180deg=-0.197) USER MOD Single : A 138 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 141 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 18 N ALA A 2 -5.839 2.779 -11.851 1.00 0.00 N ATOM 19 CA ALA A 2 -5.192 1.635 -11.221 1.00 0.00 C ATOM 20 C ALA A 2 -3.717 1.913 -10.957 1.00 0.00 C ATOM 21 O ALA A 2 -3.031 2.513 -11.785 1.00 0.00 O ATOM 22 CB ALA A 2 -5.348 0.393 -12.087 1.00 0.00 C ATOM 0 HA ALA A 2 -5.680 1.460 -10.262 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -4.859 -0.452 -11.602 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -6.407 0.173 -12.220 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -4.889 0.568 -13.060 1.00 0.00 H new ATOM 28 N LYS A 3 -3.235 1.473 -9.799 1.00 0.00 N ATOM 29 CA LYS A 3 -1.845 1.690 -9.417 1.00 0.00 C ATOM 30 C LYS A 3 -1.264 0.459 -8.731 1.00 0.00 C ATOM 31 O LYS A 3 -1.983 -0.296 -8.077 1.00 0.00 O ATOM 32 CB LYS A 3 -1.725 2.908 -8.500 1.00 0.00 C ATOM 33 CG LYS A 3 -2.135 4.224 -9.146 1.00 0.00 C ATOM 34 CD LYS A 3 -2.164 5.354 -8.128 1.00 0.00 C ATOM 35 CE LYS A 3 -2.823 6.600 -8.703 1.00 0.00 C ATOM 36 NZ LYS A 3 -1.999 7.223 -9.774 1.00 0.00 N ATOM 0 H LYS A 3 -3.787 0.964 -9.109 1.00 0.00 H new ATOM 0 HA LYS A 3 -1.274 1.875 -10.327 1.00 0.00 H new ATOM 0 HB2 LYS A 3 -2.341 2.744 -7.616 1.00 0.00 H new ATOM 0 HB3 LYS A 3 -0.693 2.991 -8.159 1.00 0.00 H new ATOM 0 HG2 LYS A 3 -1.438 4.471 -9.947 1.00 0.00 H new ATOM 0 HG3 LYS A 3 -3.119 4.117 -9.602 1.00 0.00 H new ATOM 0 HD2 LYS A 3 -2.705 5.031 -7.239 1.00 0.00 H new ATOM 0 HD3 LYS A 3 -1.147 5.590 -7.814 1.00 0.00 H new ATOM 0 HE2 LYS A 3 -3.802 6.340 -9.104 1.00 0.00 H new ATOM 0 HE3 LYS A 3 -2.988 7.324 -7.905 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 -2.423 8.130 -10.055 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 -1.035 7.387 -9.419 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 -1.962 6.588 -10.597 1.00 0.00 H new ATOM 50 N LYS A 4 0.041 0.264 -8.885 1.00 0.00 N ATOM 51 CA LYS A 4 0.723 -0.871 -8.274 1.00 0.00 C ATOM 52 C LYS A 4 2.131 -0.495 -7.831 1.00 0.00 C ATOM 53 O LYS A 4 2.850 0.202 -8.544 1.00 0.00 O ATOM 54 CB LYS A 4 0.775 -2.051 -9.247 1.00 0.00 C ATOM 55 CG LYS A 4 1.322 -3.339 -8.644 1.00 0.00 C ATOM 56 CD LYS A 4 1.236 -4.492 -9.633 1.00 0.00 C ATOM 57 CE LYS A 4 1.766 -5.783 -9.027 1.00 0.00 C ATOM 58 NZ LYS A 4 1.685 -6.920 -9.983 1.00 0.00 N ATOM 0 H LYS A 4 0.648 0.878 -9.428 1.00 0.00 H new ATOM 0 HA LYS A 4 0.156 -1.165 -7.391 1.00 0.00 H new ATOM 0 HB2 LYS A 4 -0.230 -2.239 -9.625 1.00 0.00 H new ATOM 0 HB3 LYS A 4 1.391 -1.774 -10.103 1.00 0.00 H new ATOM 0 HG2 LYS A 4 2.359 -3.191 -8.344 1.00 0.00 H new ATOM 0 HG3 LYS A 4 0.762 -3.588 -7.743 1.00 0.00 H new ATOM 0 HD2 LYS A 4 0.200 -4.632 -9.942 1.00 0.00 H new ATOM 0 HD3 LYS A 4 1.806 -4.248 -10.529 1.00 0.00 H new ATOM 0 HE2 LYS A 4 2.802 -5.641 -8.719 1.00 0.00 H new ATOM 0 HE3 LYS A 4 1.197 -6.023 -8.129 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 2.056 -7.780 -9.531 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 0.694 -7.073 -10.258 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 2.249 -6.703 -10.829 1.00 0.00 H new ATOM 72 N GLY A 5 2.517 -0.961 -6.648 1.00 0.00 N ATOM 73 CA GLY A 5 3.802 -0.597 -6.063 1.00 0.00 C ATOM 74 C GLY A 5 4.414 -1.767 -5.305 1.00 0.00 C ATOM 75 O GLY A 5 3.866 -2.869 -5.297 1.00 0.00 O ATOM 0 H GLY A 5 1.957 -1.592 -6.075 1.00 0.00 H new ATOM 0 HA2 GLY A 5 4.484 -0.273 -6.849 1.00 0.00 H new ATOM 0 HA3 GLY A 5 3.670 0.248 -5.388 1.00 0.00 H new ATOM 79 N TYR A 6 5.554 -1.522 -4.668 1.00 0.00 N ATOM 80 CA TYR A 6 6.226 -2.546 -3.878 1.00 0.00 C ATOM 81 C TYR A 6 7.102 -1.923 -2.798 1.00 0.00 C ATOM 82 O TYR A 6 7.600 -0.808 -2.957 1.00 0.00 O ATOM 83 CB TYR A 6 7.062 -3.455 -4.779 1.00 0.00 C ATOM 84 CG TYR A 6 8.200 -2.744 -5.478 1.00 0.00 C ATOM 85 CD1 TYR A 6 9.419 -2.587 -4.834 1.00 0.00 C ATOM 86 CD2 TYR A 6 8.024 -2.248 -6.761 1.00 0.00 C ATOM 87 CE1 TYR A 6 10.458 -1.937 -5.472 1.00 0.00 C ATOM 88 CE2 TYR A 6 9.064 -1.598 -7.398 1.00 0.00 C ATOM 89 CZ TYR A 6 10.275 -1.442 -6.758 1.00 0.00 C ATOM 90 OH TYR A 6 11.311 -0.794 -7.393 1.00 0.00 O ATOM 0 H TYR A 6 6.032 -0.621 -4.684 1.00 0.00 H new ATOM 0 HA TYR A 6 5.459 -3.146 -3.388 1.00 0.00 H new ATOM 0 HB2 TYR A 6 7.469 -4.270 -4.180 1.00 0.00 H new ATOM 0 HB3 TYR A 6 6.412 -3.905 -5.529 1.00 0.00 H new ATOM 0 HD1 TYR A 6 9.556 -2.973 -3.835 1.00 0.00 H new ATOM 0 HD2 TYR A 6 7.075 -2.370 -7.262 1.00 0.00 H new ATOM 0 HE1 TYR A 6 11.408 -1.814 -4.974 1.00 0.00 H new ATOM 0 HE2 TYR A 6 8.928 -1.212 -8.398 1.00 0.00 H new ATOM 0 HH TYR A 6 11.935 -0.442 -6.725 1.00 0.00 H new ATOM 100 N ILE A 7 7.284 -2.647 -1.700 1.00 0.00 N ATOM 101 CA ILE A 7 8.273 -2.276 -0.693 1.00 0.00 C ATOM 102 C ILE A 7 9.421 -3.277 -0.653 1.00 0.00 C ATOM 103 O ILE A 7 9.244 -4.424 -0.243 1.00 0.00 O ATOM 104 CB ILE A 7 7.626 -2.181 0.701 1.00 0.00 C ATOM 105 CG1 ILE A 7 6.547 -1.095 0.716 1.00 0.00 C ATOM 106 CG2 ILE A 7 8.683 -1.901 1.759 1.00 0.00 C ATOM 107 CD1 ILE A 7 5.760 -1.034 2.004 1.00 0.00 C ATOM 0 H ILE A 7 6.760 -3.495 -1.484 1.00 0.00 H new ATOM 0 HA ILE A 7 8.669 -1.299 -0.971 1.00 0.00 H new ATOM 0 HB ILE A 7 7.155 -3.137 0.931 1.00 0.00 H new ATOM 0 HG12 ILE A 7 7.017 -0.127 0.542 1.00 0.00 H new ATOM 0 HG13 ILE A 7 5.859 -1.268 -0.111 1.00 0.00 H new ATOM 0 HG21 ILE A 7 8.209 -1.837 2.739 1.00 0.00 H new ATOM 0 HG22 ILE A 7 9.417 -2.707 1.763 1.00 0.00 H new ATOM 0 HG23 ILE A 7 9.182 -0.958 1.535 1.00 0.00 H new ATOM 0 HD11 ILE A 7 5.015 -0.241 1.938 1.00 0.00 H new ATOM 0 HD12 ILE A 7 5.260 -1.988 2.170 1.00 0.00 H new ATOM 0 HD13 ILE A 7 6.436 -0.829 2.834 1.00 0.00 H new ATOM 119 N LEU A 8 10.598 -2.835 -1.084 1.00 0.00 N ATOM 120 CA LEU A 8 11.809 -3.639 -0.961 1.00 0.00 C ATOM 121 C LEU A 8 12.507 -3.382 0.368 1.00 0.00 C ATOM 122 O LEU A 8 12.815 -2.239 0.708 1.00 0.00 O ATOM 123 CB LEU A 8 12.768 -3.333 -2.118 1.00 0.00 C ATOM 124 CG LEU A 8 14.121 -4.053 -2.069 1.00 0.00 C ATOM 125 CD1 LEU A 8 13.905 -5.552 -2.229 1.00 0.00 C ATOM 126 CD2 LEU A 8 15.026 -3.512 -3.166 1.00 0.00 C ATOM 0 H LEU A 8 10.739 -1.924 -1.522 1.00 0.00 H new ATOM 0 HA LEU A 8 11.519 -4.689 -1.000 1.00 0.00 H new ATOM 0 HB2 LEU A 8 12.273 -3.592 -3.054 1.00 0.00 H new ATOM 0 HB3 LEU A 8 12.950 -2.258 -2.140 1.00 0.00 H new ATOM 0 HG LEU A 8 14.602 -3.875 -1.107 1.00 0.00 H new ATOM 0 HD11 LEU A 8 14.867 -6.064 -2.194 1.00 0.00 H new ATOM 0 HD12 LEU A 8 13.270 -5.916 -1.421 1.00 0.00 H new ATOM 0 HD13 LEU A 8 13.423 -5.750 -3.186 1.00 0.00 H new ATOM 0 HD21 LEU A 8 15.987 -4.024 -3.130 1.00 0.00 H new ATOM 0 HD22 LEU A 8 14.561 -3.680 -4.137 1.00 0.00 H new ATOM 0 HD23 LEU A 8 15.179 -2.443 -3.017 1.00 0.00 H new ATOM 138 N MET A 9 12.757 -4.452 1.116 1.00 0.00 N ATOM 139 CA MET A 9 13.416 -4.343 2.412 1.00 0.00 C ATOM 140 C MET A 9 14.932 -4.399 2.266 1.00 0.00 C ATOM 141 O MET A 9 15.450 -4.871 1.254 1.00 0.00 O ATOM 142 CB MET A 9 12.929 -5.449 3.346 1.00 0.00 C ATOM 143 CG MET A 9 11.428 -5.448 3.595 1.00 0.00 C ATOM 144 SD MET A 9 10.856 -3.929 4.382 1.00 0.00 S ATOM 145 CE MET A 9 9.085 -4.193 4.378 1.00 0.00 C ATOM 0 H MET A 9 12.513 -5.405 0.846 1.00 0.00 H new ATOM 0 HA MET A 9 13.157 -3.376 2.844 1.00 0.00 H new ATOM 0 HB2 MET A 9 13.214 -6.414 2.926 1.00 0.00 H new ATOM 0 HB3 MET A 9 13.443 -5.353 4.302 1.00 0.00 H new ATOM 0 HG2 MET A 9 10.906 -5.580 2.647 1.00 0.00 H new ATOM 0 HG3 MET A 9 11.167 -6.299 4.224 1.00 0.00 H new ATOM 0 HE1 MET A 9 8.600 -3.418 4.972 1.00 0.00 H new ATOM 0 HE2 MET A 9 8.713 -4.151 3.354 1.00 0.00 H new ATOM 0 HE3 MET A 9 8.862 -5.171 4.805 1.00 0.00 H new ATOM 155 N GLU A 10 15.637 -3.914 3.281 1.00 0.00 N ATOM 156 CA GLU A 10 17.093 -3.991 3.309 1.00 0.00 C ATOM 157 C GLU A 10 17.567 -5.436 3.392 1.00 0.00 C ATOM 158 O GLU A 10 18.733 -5.733 3.131 1.00 0.00 O ATOM 159 CB GLU A 10 17.647 -3.193 4.492 1.00 0.00 C ATOM 160 CG GLU A 10 17.568 -1.682 4.323 1.00 0.00 C ATOM 161 CD GLU A 10 18.561 -1.153 3.326 1.00 0.00 C ATOM 162 OE1 GLU A 10 19.398 -1.906 2.892 1.00 0.00 O ATOM 163 OE2 GLU A 10 18.480 0.008 2.997 1.00 0.00 O ATOM 0 H GLU A 10 15.224 -3.463 4.097 1.00 0.00 H new ATOM 0 HA GLU A 10 17.467 -3.560 2.380 1.00 0.00 H new ATOM 0 HB2 GLU A 10 17.101 -3.475 5.392 1.00 0.00 H new ATOM 0 HB3 GLU A 10 18.688 -3.475 4.649 1.00 0.00 H new ATOM 0 HG2 GLU A 10 16.562 -1.409 4.006 1.00 0.00 H new ATOM 0 HG3 GLU A 10 17.739 -1.204 5.288 1.00 0.00 H new ATOM 170 N ASN A 11 16.657 -6.332 3.757 1.00 0.00 N ATOM 171 CA ASN A 11 16.969 -7.754 3.831 1.00 0.00 C ATOM 172 C ASN A 11 16.727 -8.441 2.493 1.00 0.00 C ATOM 173 O ASN A 11 16.929 -9.649 2.359 1.00 0.00 O ATOM 174 CB ASN A 11 16.159 -8.422 4.928 1.00 0.00 C ATOM 175 CG ASN A 11 16.534 -7.936 6.300 1.00 0.00 C ATOM 176 OD1 ASN A 11 17.685 -8.077 6.730 1.00 0.00 O ATOM 177 ND2 ASN A 11 15.585 -7.365 6.997 1.00 0.00 N ATOM 0 H ASN A 11 15.696 -6.098 4.007 1.00 0.00 H new ATOM 0 HA ASN A 11 18.027 -7.853 4.072 1.00 0.00 H new ATOM 0 HB2 ASN A 11 15.099 -8.235 4.757 1.00 0.00 H new ATOM 0 HB3 ASN A 11 16.304 -9.501 4.876 1.00 0.00 H new ATOM 0 HD21 ASN A 11 15.781 -7.015 7.935 1.00 0.00 H new ATOM 0 HD22 ASN A 11 14.649 -7.270 6.602 1.00 0.00 H new ATOM 184 N GLY A 12 16.294 -7.666 1.505 1.00 0.00 N ATOM 185 CA GLY A 12 16.063 -8.190 0.164 1.00 0.00 C ATOM 186 C GLY A 12 14.631 -8.687 0.006 1.00 0.00 C ATOM 187 O GLY A 12 14.268 -9.242 -1.030 1.00 0.00 O ATOM 0 H GLY A 12 16.096 -6.671 1.608 1.00 0.00 H new ATOM 0 HA2 GLY A 12 16.264 -7.412 -0.573 1.00 0.00 H new ATOM 0 HA3 GLY A 12 16.758 -9.006 -0.035 1.00 0.00 H new ATOM 191 N GLY A 13 13.823 -8.484 1.040 1.00 0.00 N ATOM 192 CA GLY A 13 12.426 -8.902 1.014 1.00 0.00 C ATOM 193 C GLY A 13 11.574 -7.927 0.212 1.00 0.00 C ATOM 194 O GLY A 13 11.252 -6.836 0.682 1.00 0.00 O ATOM 0 H GLY A 13 14.111 -8.032 1.908 1.00 0.00 H new ATOM 0 HA2 GLY A 13 12.350 -9.898 0.579 1.00 0.00 H new ATOM 0 HA3 GLY A 13 12.045 -8.969 2.033 1.00 0.00 H new ATOM 198 N LYS A 14 11.211 -8.328 -1.002 1.00 0.00 N ATOM 199 CA LYS A 14 10.374 -7.500 -1.863 1.00 0.00 C ATOM 200 C LYS A 14 8.904 -7.877 -1.729 1.00 0.00 C ATOM 201 O LYS A 14 8.502 -8.984 -2.088 1.00 0.00 O ATOM 202 CB LYS A 14 10.818 -7.624 -3.321 1.00 0.00 C ATOM 203 CG LYS A 14 10.077 -6.708 -4.285 1.00 0.00 C ATOM 204 CD LYS A 14 10.542 -6.920 -5.719 1.00 0.00 C ATOM 205 CE LYS A 14 9.827 -5.981 -6.679 1.00 0.00 C ATOM 206 NZ LYS A 14 10.222 -6.223 -8.093 1.00 0.00 N ATOM 0 H LYS A 14 11.483 -9.221 -1.412 1.00 0.00 H new ATOM 0 HA LYS A 14 10.490 -6.464 -1.545 1.00 0.00 H new ATOM 0 HB2 LYS A 14 11.885 -7.409 -3.383 1.00 0.00 H new ATOM 0 HB3 LYS A 14 10.682 -8.656 -3.643 1.00 0.00 H new ATOM 0 HG2 LYS A 14 9.005 -6.895 -4.217 1.00 0.00 H new ATOM 0 HG3 LYS A 14 10.238 -5.669 -3.998 1.00 0.00 H new ATOM 0 HD2 LYS A 14 11.618 -6.757 -5.782 1.00 0.00 H new ATOM 0 HD3 LYS A 14 10.358 -7.953 -6.014 1.00 0.00 H new ATOM 0 HE2 LYS A 14 8.749 -6.109 -6.577 1.00 0.00 H new ATOM 0 HE3 LYS A 14 10.052 -4.949 -6.411 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 9.712 -5.562 -8.714 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 11.246 -6.076 -8.197 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 9.984 -7.200 -8.358 1.00 0.00 H new ATOM 220 N ILE A 15 8.106 -6.950 -1.211 1.00 0.00 N ATOM 221 CA ILE A 15 6.672 -7.170 -1.063 1.00 0.00 C ATOM 222 C ILE A 15 5.879 -6.304 -2.032 1.00 0.00 C ATOM 223 O ILE A 15 5.962 -5.077 -1.994 1.00 0.00 O ATOM 224 CB ILE A 15 6.218 -6.877 0.379 1.00 0.00 C ATOM 225 CG1 ILE A 15 6.916 -7.822 1.361 1.00 0.00 C ATOM 226 CG2 ILE A 15 4.707 -7.003 0.497 1.00 0.00 C ATOM 227 CD1 ILE A 15 8.154 -7.233 1.998 1.00 0.00 C ATOM 0 H ILE A 15 8.428 -6.038 -0.886 1.00 0.00 H new ATOM 0 HA ILE A 15 6.479 -8.218 -1.292 1.00 0.00 H new ATOM 0 HB ILE A 15 6.497 -5.853 0.629 1.00 0.00 H new ATOM 0 HG12 ILE A 15 6.212 -8.100 2.145 1.00 0.00 H new ATOM 0 HG13 ILE A 15 7.189 -8.738 0.838 1.00 0.00 H new ATOM 0 HG21 ILE A 15 4.403 -6.793 1.523 1.00 0.00 H new ATOM 0 HG22 ILE A 15 4.229 -6.291 -0.176 1.00 0.00 H new ATOM 0 HG23 ILE A 15 4.404 -8.015 0.229 1.00 0.00 H new ATOM 0 HD11 ILE A 15 8.593 -7.960 2.681 1.00 0.00 H new ATOM 0 HD12 ILE A 15 8.877 -6.980 1.223 1.00 0.00 H new ATOM 0 HD13 ILE A 15 7.886 -6.333 2.551 1.00 0.00 H new ATOM 239 N GLU A 16 5.108 -6.951 -2.900 1.00 0.00 N ATOM 240 CA GLU A 16 4.361 -6.245 -3.936 1.00 0.00 C ATOM 241 C GLU A 16 2.894 -6.101 -3.556 1.00 0.00 C ATOM 242 O GLU A 16 2.302 -7.007 -2.970 1.00 0.00 O ATOM 243 CB GLU A 16 4.482 -6.979 -5.273 1.00 0.00 C ATOM 244 CG GLU A 16 5.899 -7.057 -5.822 1.00 0.00 C ATOM 245 CD GLU A 16 5.975 -7.756 -7.151 1.00 0.00 C ATOM 246 OE1 GLU A 16 4.964 -8.234 -7.608 1.00 0.00 O ATOM 247 OE2 GLU A 16 7.044 -7.812 -7.712 1.00 0.00 O ATOM 0 H GLU A 16 4.984 -7.963 -2.907 1.00 0.00 H new ATOM 0 HA GLU A 16 4.789 -5.247 -4.034 1.00 0.00 H new ATOM 0 HB2 GLU A 16 4.095 -7.991 -5.154 1.00 0.00 H new ATOM 0 HB3 GLU A 16 3.848 -6.480 -6.006 1.00 0.00 H new ATOM 0 HG2 GLU A 16 6.299 -6.048 -5.924 1.00 0.00 H new ATOM 0 HG3 GLU A 16 6.532 -7.580 -5.106 1.00 0.00 H new ATOM 254 N PHE A 17 2.310 -4.955 -3.891 1.00 0.00 N ATOM 255 CA PHE A 17 0.940 -4.650 -3.502 1.00 0.00 C ATOM 256 C PHE A 17 0.226 -3.846 -4.582 1.00 0.00 C ATOM 257 O PHE A 17 0.865 -3.188 -5.402 1.00 0.00 O ATOM 258 CB PHE A 17 0.918 -3.874 -2.184 1.00 0.00 C ATOM 259 CG PHE A 17 1.648 -2.561 -2.241 1.00 0.00 C ATOM 260 CD1 PHE A 17 1.002 -1.411 -2.670 1.00 0.00 C ATOM 261 CD2 PHE A 17 2.980 -2.474 -1.868 1.00 0.00 C ATOM 262 CE1 PHE A 17 1.671 -0.203 -2.723 1.00 0.00 C ATOM 263 CE2 PHE A 17 3.651 -1.269 -1.919 1.00 0.00 C ATOM 264 CZ PHE A 17 2.996 -0.132 -2.348 1.00 0.00 C ATOM 0 H PHE A 17 2.767 -4.221 -4.433 1.00 0.00 H new ATOM 0 HA PHE A 17 0.415 -5.596 -3.371 1.00 0.00 H new ATOM 0 HB2 PHE A 17 -0.118 -3.691 -1.898 1.00 0.00 H new ATOM 0 HB3 PHE A 17 1.360 -4.491 -1.402 1.00 0.00 H new ATOM 0 HD1 PHE A 17 -0.035 -1.460 -2.966 1.00 0.00 H new ATOM 0 HD2 PHE A 17 3.499 -3.360 -1.533 1.00 0.00 H new ATOM 0 HE1 PHE A 17 1.156 0.685 -3.058 1.00 0.00 H new ATOM 0 HE2 PHE A 17 4.688 -1.216 -1.623 1.00 0.00 H new ATOM 0 HZ PHE A 17 3.520 0.811 -2.390 1.00 0.00 H new ATOM 274 N GLU A 18 -1.101 -3.903 -4.575 1.00 0.00 N ATOM 275 CA GLU A 18 -1.906 -3.156 -5.535 1.00 0.00 C ATOM 276 C GLU A 18 -2.755 -2.101 -4.838 1.00 0.00 C ATOM 277 O GLU A 18 -3.223 -2.307 -3.718 1.00 0.00 O ATOM 278 CB GLU A 18 -2.805 -4.105 -6.331 1.00 0.00 C ATOM 279 CG GLU A 18 -2.056 -5.047 -7.262 1.00 0.00 C ATOM 280 CD GLU A 18 -2.975 -5.915 -8.078 1.00 0.00 C ATOM 281 OE1 GLU A 18 -4.164 -5.825 -7.893 1.00 0.00 O ATOM 282 OE2 GLU A 18 -2.485 -6.668 -8.887 1.00 0.00 O ATOM 0 H GLU A 18 -1.643 -4.460 -3.914 1.00 0.00 H new ATOM 0 HA GLU A 18 -1.225 -2.651 -6.220 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -3.396 -4.698 -5.633 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -3.506 -3.513 -6.920 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -1.426 -4.463 -7.932 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -1.393 -5.681 -6.673 1.00 0.00 H new ATOM 289 N LEU A 19 -2.951 -0.970 -5.507 1.00 0.00 N ATOM 290 CA LEU A 19 -3.696 0.143 -4.930 1.00 0.00 C ATOM 291 C LEU A 19 -4.988 0.396 -5.694 1.00 0.00 C ATOM 292 O LEU A 19 -5.105 0.045 -6.868 1.00 0.00 O ATOM 293 CB LEU A 19 -2.836 1.413 -4.932 1.00 0.00 C ATOM 294 CG LEU A 19 -1.490 1.308 -4.202 1.00 0.00 C ATOM 295 CD1 LEU A 19 -0.735 2.622 -4.338 1.00 0.00 C ATOM 296 CD2 LEU A 19 -1.732 0.964 -2.739 1.00 0.00 C ATOM 0 H LEU A 19 -2.604 -0.800 -6.451 1.00 0.00 H new ATOM 0 HA LEU A 19 -3.950 -0.121 -3.903 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -2.646 1.699 -5.966 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -3.412 2.220 -4.479 1.00 0.00 H new ATOM 0 HG LEU A 19 -0.885 0.517 -4.646 1.00 0.00 H new ATOM 0 HD11 LEU A 19 0.221 2.548 -3.820 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -0.560 2.834 -5.393 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -1.324 3.427 -3.899 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -0.776 0.889 -2.220 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -2.336 1.745 -2.277 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -2.257 0.011 -2.671 1.00 0.00 H new ATOM 308 N PHE A 20 -5.958 1.006 -5.021 1.00 0.00 N ATOM 309 CA PHE A 20 -7.270 1.239 -5.611 1.00 0.00 C ATOM 310 C PHE A 20 -7.627 2.720 -5.593 1.00 0.00 C ATOM 311 O PHE A 20 -8.439 3.162 -4.780 1.00 0.00 O ATOM 312 CB PHE A 20 -8.342 0.442 -4.864 1.00 0.00 C ATOM 313 CG PHE A 20 -8.069 -1.035 -4.809 1.00 0.00 C ATOM 314 CD1 PHE A 20 -8.391 -1.854 -5.879 1.00 0.00 C ATOM 315 CD2 PHE A 20 -7.491 -1.606 -3.685 1.00 0.00 C ATOM 316 CE1 PHE A 20 -8.143 -3.213 -5.829 1.00 0.00 C ATOM 317 CE2 PHE A 20 -7.240 -2.964 -3.634 1.00 0.00 C ATOM 318 CZ PHE A 20 -7.566 -3.767 -4.705 1.00 0.00 C ATOM 0 H PHE A 20 -5.859 1.348 -4.065 1.00 0.00 H new ATOM 0 HA PHE A 20 -7.231 0.905 -6.648 1.00 0.00 H new ATOM 0 HB2 PHE A 20 -8.424 0.825 -3.847 1.00 0.00 H new ATOM 0 HB3 PHE A 20 -9.306 0.607 -5.346 1.00 0.00 H new ATOM 0 HD1 PHE A 20 -8.841 -1.426 -6.762 1.00 0.00 H new ATOM 0 HD2 PHE A 20 -7.234 -0.983 -2.841 1.00 0.00 H new ATOM 0 HE1 PHE A 20 -8.401 -3.841 -6.669 1.00 0.00 H new ATOM 0 HE2 PHE A 20 -6.788 -3.396 -2.754 1.00 0.00 H new ATOM 0 HZ PHE A 20 -7.370 -4.828 -4.665 1.00 0.00 H new ATOM 328 N PRO A 21 -7.017 3.482 -6.494 1.00 0.00 N ATOM 329 CA PRO A 21 -7.274 4.914 -6.588 1.00 0.00 C ATOM 330 C PRO A 21 -8.690 5.188 -7.079 1.00 0.00 C ATOM 331 O PRO A 21 -9.217 6.285 -6.901 1.00 0.00 O ATOM 332 CB PRO A 21 -6.224 5.387 -7.598 1.00 0.00 C ATOM 333 CG PRO A 21 -5.946 4.182 -8.429 1.00 0.00 C ATOM 334 CD PRO A 21 -5.994 3.035 -7.453 1.00 0.00 C ATOM 0 HA PRO A 21 -7.203 5.429 -5.630 1.00 0.00 H new ATOM 0 HB2 PRO A 21 -6.598 6.211 -8.205 1.00 0.00 H new ATOM 0 HB3 PRO A 21 -5.323 5.743 -7.098 1.00 0.00 H new ATOM 0 HG2 PRO A 21 -6.688 4.064 -9.218 1.00 0.00 H new ATOM 0 HG3 PRO A 21 -4.973 4.250 -8.915 1.00 0.00 H new ATOM 0 HD2 PRO A 21 -6.273 2.100 -7.938 1.00 0.00 H new ATOM 0 HD3 PRO A 21 -5.030 2.870 -6.972 1.00 0.00 H new ATOM 342 N ASN A 22 -9.301 4.184 -7.699 1.00 0.00 N ATOM 343 CA ASN A 22 -10.695 4.275 -8.115 1.00 0.00 C ATOM 344 C ASN A 22 -11.630 4.283 -6.913 1.00 0.00 C ATOM 345 O ASN A 22 -12.719 4.855 -6.965 1.00 0.00 O ATOM 346 CB ASN A 22 -11.047 3.138 -9.058 1.00 0.00 C ATOM 347 CG ASN A 22 -12.412 3.294 -9.667 1.00 0.00 C ATOM 348 OD1 ASN A 22 -12.673 4.256 -10.399 1.00 0.00 O ATOM 349 ND2 ASN A 22 -13.290 2.366 -9.379 1.00 0.00 N ATOM 0 H ASN A 22 -8.851 3.297 -7.925 1.00 0.00 H new ATOM 0 HA ASN A 22 -10.824 5.218 -8.646 1.00 0.00 H new ATOM 0 HB2 ASN A 22 -10.303 3.086 -9.852 1.00 0.00 H new ATOM 0 HB3 ASN A 22 -11.001 2.194 -8.516 1.00 0.00 H new ATOM 0 HD21 ASN A 22 -14.233 2.419 -9.763 1.00 0.00 H new ATOM 0 HD22 ASN A 22 -13.031 1.590 -8.770 1.00 0.00 H new ATOM 356 N GLU A 23 -11.198 3.646 -5.830 1.00 0.00 N ATOM 357 CA GLU A 23 -12.021 3.527 -4.632 1.00 0.00 C ATOM 358 C GLU A 23 -11.614 4.551 -3.581 1.00 0.00 C ATOM 359 O GLU A 23 -12.448 5.030 -2.812 1.00 0.00 O ATOM 360 CB GLU A 23 -11.916 2.115 -4.050 1.00 0.00 C ATOM 361 CG GLU A 23 -12.366 1.011 -4.995 1.00 0.00 C ATOM 362 CD GLU A 23 -12.189 -0.365 -4.414 1.00 0.00 C ATOM 363 OE1 GLU A 23 -11.706 -0.466 -3.312 1.00 0.00 O ATOM 364 OE2 GLU A 23 -12.538 -1.316 -5.073 1.00 0.00 O ATOM 0 H GLU A 23 -10.282 3.204 -5.757 1.00 0.00 H new ATOM 0 HA GLU A 23 -13.055 3.720 -4.918 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -10.881 1.930 -3.761 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -12.515 2.065 -3.140 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -13.416 1.161 -5.247 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -11.801 1.083 -5.925 1.00 0.00 H new ATOM 371 N ALA A 24 -10.328 4.884 -3.552 1.00 0.00 N ATOM 372 CA ALA A 24 -9.819 5.898 -2.637 1.00 0.00 C ATOM 373 C ALA A 24 -8.847 6.837 -3.340 1.00 0.00 C ATOM 374 O ALA A 24 -7.633 6.742 -3.156 1.00 0.00 O ATOM 375 CB ALA A 24 -9.147 5.242 -1.440 1.00 0.00 C ATOM 0 H ALA A 24 -9.618 4.465 -4.153 1.00 0.00 H new ATOM 0 HA ALA A 24 -10.665 6.489 -2.287 1.00 0.00 H new ATOM 0 HB1 ALA A 24 -8.772 6.012 -0.766 1.00 0.00 H new ATOM 0 HB2 ALA A 24 -9.870 4.619 -0.913 1.00 0.00 H new ATOM 0 HB3 ALA A 24 -8.317 4.624 -1.782 1.00 0.00 H new ATOM 381 N PRO A 25 -9.388 7.744 -4.146 1.00 0.00 N ATOM 382 CA PRO A 25 -8.566 8.641 -4.950 1.00 0.00 C ATOM 383 C PRO A 25 -7.547 9.376 -4.088 1.00 0.00 C ATOM 384 O PRO A 25 -6.343 9.294 -4.329 1.00 0.00 O ATOM 385 CB PRO A 25 -9.596 9.604 -5.552 1.00 0.00 C ATOM 386 CG PRO A 25 -10.825 8.775 -5.707 1.00 0.00 C ATOM 387 CD PRO A 25 -10.839 7.896 -4.484 1.00 0.00 C ATOM 0 HA PRO A 25 -7.975 8.124 -5.706 1.00 0.00 H new ATOM 0 HB2 PRO A 25 -9.772 10.458 -4.898 1.00 0.00 H new ATOM 0 HB3 PRO A 25 -9.259 10.000 -6.510 1.00 0.00 H new ATOM 0 HG2 PRO A 25 -11.719 9.396 -5.761 1.00 0.00 H new ATOM 0 HG3 PRO A 25 -10.793 8.183 -6.622 1.00 0.00 H new ATOM 0 HD2 PRO A 25 -11.396 8.354 -3.667 1.00 0.00 H new ATOM 0 HD3 PRO A 25 -11.307 6.933 -4.687 1.00 0.00 H new ATOM 395 N VAL A 26 -8.037 10.092 -3.083 1.00 0.00 N ATOM 396 CA VAL A 26 -7.198 10.997 -2.306 1.00 0.00 C ATOM 397 C VAL A 26 -6.139 10.230 -1.525 1.00 0.00 C ATOM 398 O VAL A 26 -4.954 10.563 -1.576 1.00 0.00 O ATOM 399 CB VAL A 26 -8.059 11.817 -1.328 1.00 0.00 C ATOM 400 CG1 VAL A 26 -7.176 12.629 -0.392 1.00 0.00 C ATOM 401 CG2 VAL A 26 -9.000 12.726 -2.104 1.00 0.00 C ATOM 0 H VAL A 26 -9.013 10.063 -2.786 1.00 0.00 H new ATOM 0 HA VAL A 26 -6.699 11.669 -3.005 1.00 0.00 H new ATOM 0 HB VAL A 26 -8.654 11.133 -0.722 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -7.802 13.202 0.292 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -6.536 11.956 0.179 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -6.557 13.311 -0.976 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -9.606 13.303 -1.406 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -8.418 13.405 -2.727 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -9.651 12.122 -2.736 1.00 0.00 H new ATOM 411 N THR A 27 -6.571 9.204 -0.801 1.00 0.00 N ATOM 412 CA THR A 27 -5.672 8.433 0.049 1.00 0.00 C ATOM 413 C THR A 27 -4.558 7.791 -0.766 1.00 0.00 C ATOM 414 O THR A 27 -3.381 7.903 -0.425 1.00 0.00 O ATOM 415 CB THR A 27 -6.439 7.346 0.825 1.00 0.00 C ATOM 416 OG1 THR A 27 -7.472 7.955 1.611 1.00 0.00 O ATOM 417 CG2 THR A 27 -5.497 6.579 1.741 1.00 0.00 C ATOM 0 H THR A 27 -7.540 8.886 -0.786 1.00 0.00 H new ATOM 0 HA THR A 27 -5.228 9.128 0.762 1.00 0.00 H new ATOM 0 HB THR A 27 -6.879 6.652 0.109 1.00 0.00 H new ATOM 0 HG1 THR A 27 -8.236 8.172 1.036 1.00 0.00 H new ATOM 0 HG21 THR A 27 -6.056 5.815 2.281 1.00 0.00 H new ATOM 0 HG22 THR A 27 -4.717 6.104 1.146 1.00 0.00 H new ATOM 0 HG23 THR A 27 -5.042 7.267 2.453 1.00 0.00 H new ATOM 425 N VAL A 28 -4.937 7.116 -1.847 1.00 0.00 N ATOM 426 CA VAL A 28 -3.973 6.422 -2.694 1.00 0.00 C ATOM 427 C VAL A 28 -3.021 7.403 -3.363 1.00 0.00 C ATOM 428 O VAL A 28 -1.818 7.155 -3.450 1.00 0.00 O ATOM 429 CB VAL A 28 -4.704 5.602 -3.773 1.00 0.00 C ATOM 430 CG1 VAL A 28 -3.713 5.066 -4.796 1.00 0.00 C ATOM 431 CG2 VAL A 28 -5.478 4.465 -3.125 1.00 0.00 C ATOM 0 H VAL A 28 -5.905 7.035 -2.157 1.00 0.00 H new ATOM 0 HA VAL A 28 -3.393 5.754 -2.058 1.00 0.00 H new ATOM 0 HB VAL A 28 -5.409 6.251 -4.293 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -4.246 4.489 -5.551 1.00 0.00 H new ATOM 0 HG12 VAL A 28 -3.197 5.899 -5.273 1.00 0.00 H new ATOM 0 HG13 VAL A 28 -2.985 4.426 -4.297 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -5.992 3.890 -3.895 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -4.788 3.815 -2.587 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -6.210 4.874 -2.428 1.00 0.00 H new ATOM 441 N ALA A 29 -3.565 8.520 -3.836 1.00 0.00 N ATOM 442 CA ALA A 29 -2.765 9.538 -4.506 1.00 0.00 C ATOM 443 C ALA A 29 -1.666 10.064 -3.593 1.00 0.00 C ATOM 444 O ALA A 29 -0.512 10.188 -4.002 1.00 0.00 O ATOM 445 CB ALA A 29 -3.651 10.681 -4.980 1.00 0.00 C ATOM 0 H ALA A 29 -4.558 8.743 -3.767 1.00 0.00 H new ATOM 0 HA ALA A 29 -2.291 9.077 -5.372 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -3.039 11.433 -5.478 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -4.396 10.299 -5.678 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -4.153 11.131 -4.124 1.00 0.00 H new ATOM 451 N ASN A 30 -2.031 10.374 -2.353 1.00 0.00 N ATOM 452 CA ASN A 30 -1.080 10.905 -1.384 1.00 0.00 C ATOM 453 C ASN A 30 -0.004 9.880 -1.050 1.00 0.00 C ATOM 454 O ASN A 30 1.177 10.216 -0.952 1.00 0.00 O ATOM 455 CB ASN A 30 -1.797 11.356 -0.125 1.00 0.00 C ATOM 456 CG ASN A 30 -2.555 12.640 -0.320 1.00 0.00 C ATOM 457 OD1 ASN A 30 -2.290 13.394 -1.262 1.00 0.00 O ATOM 458 ND2 ASN A 30 -3.493 12.903 0.555 1.00 0.00 N ATOM 0 H ASN A 30 -2.980 10.266 -1.996 1.00 0.00 H new ATOM 0 HA ASN A 30 -0.591 11.770 -1.833 1.00 0.00 H new ATOM 0 HB2 ASN A 30 -2.488 10.576 0.195 1.00 0.00 H new ATOM 0 HB3 ASN A 30 -1.070 11.486 0.676 1.00 0.00 H new ATOM 0 HD21 ASN A 30 -4.040 13.760 0.474 1.00 0.00 H new ATOM 0 HD22 ASN A 30 -3.677 12.251 1.317 1.00 0.00 H new ATOM 465 N PHE A 31 -0.418 8.630 -0.876 1.00 0.00 N ATOM 466 CA PHE A 31 0.517 7.543 -0.607 1.00 0.00 C ATOM 467 C PHE A 31 1.550 7.419 -1.719 1.00 0.00 C ATOM 468 O PHE A 31 2.753 7.378 -1.460 1.00 0.00 O ATOM 469 CB PHE A 31 -0.233 6.220 -0.450 1.00 0.00 C ATOM 470 CG PHE A 31 0.658 5.052 -0.136 1.00 0.00 C ATOM 471 CD1 PHE A 31 1.071 4.806 1.165 1.00 0.00 C ATOM 472 CD2 PHE A 31 1.087 4.197 -1.140 1.00 0.00 C ATOM 473 CE1 PHE A 31 1.890 3.733 1.456 1.00 0.00 C ATOM 474 CE2 PHE A 31 1.906 3.122 -0.853 1.00 0.00 C ATOM 475 CZ PHE A 31 2.307 2.890 0.447 1.00 0.00 C ATOM 0 H PHE A 31 -1.396 8.344 -0.916 1.00 0.00 H new ATOM 0 HA PHE A 31 1.036 7.774 0.323 1.00 0.00 H new ATOM 0 HB2 PHE A 31 -0.973 6.324 0.344 1.00 0.00 H new ATOM 0 HB3 PHE A 31 -0.779 6.011 -1.370 1.00 0.00 H new ATOM 0 HD1 PHE A 31 0.748 5.462 1.960 1.00 0.00 H new ATOM 0 HD2 PHE A 31 0.777 4.374 -2.159 1.00 0.00 H new ATOM 0 HE1 PHE A 31 2.204 3.554 2.474 1.00 0.00 H new ATOM 0 HE2 PHE A 31 2.232 2.464 -1.645 1.00 0.00 H new ATOM 0 HZ PHE A 31 2.946 2.050 0.674 1.00 0.00 H new ATOM 485 N GLU A 32 1.075 7.359 -2.958 1.00 0.00 N ATOM 486 CA GLU A 32 1.958 7.268 -4.114 1.00 0.00 C ATOM 487 C GLU A 32 2.889 8.471 -4.193 1.00 0.00 C ATOM 488 O GLU A 32 4.083 8.328 -4.452 1.00 0.00 O ATOM 489 CB GLU A 32 1.140 7.160 -5.403 1.00 0.00 C ATOM 490 CG GLU A 32 1.972 7.170 -6.678 1.00 0.00 C ATOM 491 CD GLU A 32 1.139 7.019 -7.920 1.00 0.00 C ATOM 492 OE1 GLU A 32 0.288 7.845 -8.148 1.00 0.00 O ATOM 493 OE2 GLU A 32 1.353 6.075 -8.644 1.00 0.00 O ATOM 0 H GLU A 32 0.081 7.372 -3.188 1.00 0.00 H new ATOM 0 HA GLU A 32 2.566 6.370 -3.998 1.00 0.00 H new ATOM 0 HB2 GLU A 32 0.556 6.240 -5.372 1.00 0.00 H new ATOM 0 HB3 GLU A 32 0.431 7.987 -5.440 1.00 0.00 H new ATOM 0 HG2 GLU A 32 2.532 8.103 -6.733 1.00 0.00 H new ATOM 0 HG3 GLU A 32 2.702 6.362 -6.636 1.00 0.00 H new ATOM 500 N LYS A 33 2.334 9.657 -3.967 1.00 0.00 N ATOM 501 CA LYS A 33 3.117 10.887 -3.996 1.00 0.00 C ATOM 502 C LYS A 33 4.313 10.802 -3.056 1.00 0.00 C ATOM 503 O LYS A 33 5.443 11.099 -3.446 1.00 0.00 O ATOM 504 CB LYS A 33 2.243 12.087 -3.629 1.00 0.00 C ATOM 505 CG LYS A 33 2.967 13.427 -3.667 1.00 0.00 C ATOM 506 CD LYS A 33 2.017 14.576 -3.360 1.00 0.00 C ATOM 507 CE LYS A 33 2.748 15.910 -3.350 1.00 0.00 C ATOM 508 NZ LYS A 33 1.829 17.047 -3.073 1.00 0.00 N ATOM 0 H LYS A 33 1.344 9.793 -3.762 1.00 0.00 H new ATOM 0 HA LYS A 33 3.491 11.020 -5.011 1.00 0.00 H new ATOM 0 HB2 LYS A 33 1.395 12.126 -4.313 1.00 0.00 H new ATOM 0 HB3 LYS A 33 1.839 11.934 -2.628 1.00 0.00 H new ATOM 0 HG2 LYS A 33 3.783 13.423 -2.944 1.00 0.00 H new ATOM 0 HG3 LYS A 33 3.414 13.574 -4.650 1.00 0.00 H new ATOM 0 HD2 LYS A 33 1.221 14.601 -4.104 1.00 0.00 H new ATOM 0 HD3 LYS A 33 1.544 14.411 -2.392 1.00 0.00 H new ATOM 0 HE2 LYS A 33 3.534 15.887 -2.595 1.00 0.00 H new ATOM 0 HE3 LYS A 33 3.235 16.064 -4.313 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 2.367 17.937 -3.075 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 1.093 17.086 -3.807 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 1.383 16.914 -2.143 1.00 0.00 H new ATOM 522 N LEU A 34 4.058 10.395 -1.818 1.00 0.00 N ATOM 523 CA LEU A 34 5.117 10.248 -0.826 1.00 0.00 C ATOM 524 C LEU A 34 6.180 9.264 -1.299 1.00 0.00 C ATOM 525 O LEU A 34 7.377 9.537 -1.208 1.00 0.00 O ATOM 526 CB LEU A 34 4.531 9.773 0.509 1.00 0.00 C ATOM 527 CG LEU A 34 3.691 10.806 1.271 1.00 0.00 C ATOM 528 CD1 LEU A 34 3.027 10.140 2.468 1.00 0.00 C ATOM 529 CD2 LEU A 34 4.581 11.959 1.711 1.00 0.00 C ATOM 0 H LEU A 34 3.126 10.161 -1.477 1.00 0.00 H new ATOM 0 HA LEU A 34 5.585 11.223 -0.689 1.00 0.00 H new ATOM 0 HB2 LEU A 34 3.912 8.895 0.322 1.00 0.00 H new ATOM 0 HB3 LEU A 34 5.351 9.453 1.152 1.00 0.00 H new ATOM 0 HG LEU A 34 2.910 11.202 0.622 1.00 0.00 H new ATOM 0 HD11 LEU A 34 2.430 10.875 3.009 1.00 0.00 H new ATOM 0 HD12 LEU A 34 2.382 9.332 2.123 1.00 0.00 H new ATOM 0 HD13 LEU A 34 3.792 9.736 3.130 1.00 0.00 H new ATOM 0 HD21 LEU A 34 3.984 12.693 2.252 1.00 0.00 H new ATOM 0 HD22 LEU A 34 5.370 11.582 2.362 1.00 0.00 H new ATOM 0 HD23 LEU A 34 5.027 12.429 0.835 1.00 0.00 H new ATOM 541 N ALA A 35 5.736 8.117 -1.803 1.00 0.00 N ATOM 542 CA ALA A 35 6.649 7.097 -2.306 1.00 0.00 C ATOM 543 C ALA A 35 7.512 7.639 -3.437 1.00 0.00 C ATOM 544 O ALA A 35 8.712 7.367 -3.499 1.00 0.00 O ATOM 545 CB ALA A 35 5.871 5.874 -2.772 1.00 0.00 C ATOM 0 H ALA A 35 4.749 7.871 -1.874 1.00 0.00 H new ATOM 0 HA ALA A 35 7.310 6.805 -1.490 1.00 0.00 H new ATOM 0 HB1 ALA A 35 6.566 5.121 -3.145 1.00 0.00 H new ATOM 0 HB2 ALA A 35 5.305 5.463 -1.936 1.00 0.00 H new ATOM 0 HB3 ALA A 35 5.185 6.161 -3.569 1.00 0.00 H new ATOM 551 N ASN A 36 6.896 8.405 -4.330 1.00 0.00 N ATOM 552 CA ASN A 36 7.603 8.970 -5.474 1.00 0.00 C ATOM 553 C ASN A 36 8.631 10.003 -5.029 1.00 0.00 C ATOM 554 O ASN A 36 9.669 10.175 -5.669 1.00 0.00 O ATOM 555 CB ASN A 36 6.624 9.579 -6.459 1.00 0.00 C ATOM 556 CG ASN A 36 5.888 8.540 -7.260 1.00 0.00 C ATOM 557 OD1 ASN A 36 6.321 7.386 -7.348 1.00 0.00 O ATOM 558 ND2 ASN A 36 4.784 8.928 -7.845 1.00 0.00 N ATOM 0 H ASN A 36 5.907 8.650 -4.284 1.00 0.00 H new ATOM 0 HA ASN A 36 8.136 8.161 -5.973 1.00 0.00 H new ATOM 0 HB2 ASN A 36 5.904 10.193 -5.918 1.00 0.00 H new ATOM 0 HB3 ASN A 36 7.161 10.242 -7.137 1.00 0.00 H new ATOM 0 HD21 ASN A 36 4.242 8.267 -8.402 1.00 0.00 H new ATOM 0 HD22 ASN A 36 4.465 9.892 -7.744 1.00 0.00 H new ATOM 565 N GLU A 37 8.335 10.690 -3.931 1.00 0.00 N ATOM 566 CA GLU A 37 9.248 11.684 -3.381 1.00 0.00 C ATOM 567 C GLU A 37 10.334 11.029 -2.538 1.00 0.00 C ATOM 568 O GLU A 37 11.189 11.709 -1.971 1.00 0.00 O ATOM 569 CB GLU A 37 8.480 12.704 -2.537 1.00 0.00 C ATOM 570 CG GLU A 37 7.555 13.612 -3.335 1.00 0.00 C ATOM 571 CD GLU A 37 6.747 14.535 -2.466 1.00 0.00 C ATOM 572 OE1 GLU A 37 6.853 14.435 -1.267 1.00 0.00 O ATOM 573 OE2 GLU A 37 6.023 15.341 -3.002 1.00 0.00 O ATOM 0 H GLU A 37 7.469 10.576 -3.404 1.00 0.00 H new ATOM 0 HA GLU A 37 9.725 12.196 -4.217 1.00 0.00 H new ATOM 0 HB2 GLU A 37 7.891 12.170 -1.791 1.00 0.00 H new ATOM 0 HB3 GLU A 37 9.196 13.321 -1.995 1.00 0.00 H new ATOM 0 HG2 GLU A 37 8.148 14.204 -4.032 1.00 0.00 H new ATOM 0 HG3 GLU A 37 6.879 12.999 -3.932 1.00 0.00 H new ATOM 580 N GLY A 38 10.295 9.703 -2.459 1.00 0.00 N ATOM 581 CA GLY A 38 11.303 8.949 -1.725 1.00 0.00 C ATOM 582 C GLY A 38 11.095 9.069 -0.221 1.00 0.00 C ATOM 583 O GLY A 38 12.028 8.884 0.561 1.00 0.00 O ATOM 0 H GLY A 38 9.574 9.128 -2.895 1.00 0.00 H new ATOM 0 HA2 GLY A 38 11.261 7.900 -2.018 1.00 0.00 H new ATOM 0 HA3 GLY A 38 12.296 9.314 -1.988 1.00 0.00 H new ATOM 587 N PHE A 39 9.867 9.381 0.179 1.00 0.00 N ATOM 588 CA PHE A 39 9.543 9.560 1.589 1.00 0.00 C ATOM 589 C PHE A 39 9.701 8.256 2.361 1.00 0.00 C ATOM 590 O PHE A 39 10.462 8.183 3.325 1.00 0.00 O ATOM 591 CB PHE A 39 8.113 10.082 1.746 1.00 0.00 C ATOM 592 CG PHE A 39 7.673 10.222 3.175 1.00 0.00 C ATOM 593 CD1 PHE A 39 8.121 11.279 3.954 1.00 0.00 C ATOM 594 CD2 PHE A 39 6.810 9.298 3.745 1.00 0.00 C ATOM 595 CE1 PHE A 39 7.716 11.409 5.268 1.00 0.00 C ATOM 596 CE2 PHE A 39 6.403 9.426 5.058 1.00 0.00 C ATOM 597 CZ PHE A 39 6.857 10.483 5.821 1.00 0.00 C ATOM 0 H PHE A 39 9.079 9.515 -0.454 1.00 0.00 H new ATOM 0 HA PHE A 39 10.240 10.291 1.999 1.00 0.00 H new ATOM 0 HB2 PHE A 39 8.034 11.052 1.255 1.00 0.00 H new ATOM 0 HB3 PHE A 39 7.431 9.407 1.230 1.00 0.00 H new ATOM 0 HD1 PHE A 39 8.794 12.008 3.528 1.00 0.00 H new ATOM 0 HD2 PHE A 39 6.452 8.468 3.154 1.00 0.00 H new ATOM 0 HE1 PHE A 39 8.073 12.237 5.863 1.00 0.00 H new ATOM 0 HE2 PHE A 39 5.730 8.699 5.488 1.00 0.00 H new ATOM 0 HZ PHE A 39 6.540 10.584 6.848 1.00 0.00 H new ATOM 607 N TYR A 40 8.976 7.229 1.932 1.00 0.00 N ATOM 608 CA TYR A 40 8.981 5.946 2.623 1.00 0.00 C ATOM 609 C TYR A 40 10.308 5.222 2.432 1.00 0.00 C ATOM 610 O TYR A 40 10.717 4.423 3.274 1.00 0.00 O ATOM 611 CB TYR A 40 7.825 5.070 2.134 1.00 0.00 C ATOM 612 CG TYR A 40 6.458 5.596 2.515 1.00 0.00 C ATOM 613 CD1 TYR A 40 6.100 5.694 3.851 1.00 0.00 C ATOM 614 CD2 TYR A 40 5.563 5.979 1.527 1.00 0.00 C ATOM 615 CE1 TYR A 40 4.852 6.174 4.198 1.00 0.00 C ATOM 616 CE2 TYR A 40 4.315 6.459 1.873 1.00 0.00 C ATOM 617 CZ TYR A 40 3.962 6.555 3.215 1.00 0.00 C ATOM 618 OH TYR A 40 2.718 7.033 3.560 1.00 0.00 O ATOM 0 H TYR A 40 8.376 7.261 1.107 1.00 0.00 H new ATOM 0 HA TYR A 40 8.851 6.140 3.688 1.00 0.00 H new ATOM 0 HB2 TYR A 40 7.881 4.983 1.049 1.00 0.00 H new ATOM 0 HB3 TYR A 40 7.944 4.066 2.541 1.00 0.00 H new ATOM 0 HD1 TYR A 40 6.797 5.395 4.620 1.00 0.00 H new ATOM 0 HD2 TYR A 40 5.842 5.902 0.487 1.00 0.00 H new ATOM 0 HE1 TYR A 40 4.573 6.251 5.239 1.00 0.00 H new ATOM 0 HE2 TYR A 40 3.617 6.758 1.105 1.00 0.00 H new ATOM 0 HH TYR A 40 2.744 7.381 4.476 1.00 0.00 H new ATOM 628 N ASN A 41 10.977 5.508 1.320 1.00 0.00 N ATOM 629 CA ASN A 41 12.307 4.966 1.065 1.00 0.00 C ATOM 630 C ASN A 41 13.301 5.428 2.122 1.00 0.00 C ATOM 631 O ASN A 41 13.669 6.601 2.171 1.00 0.00 O ATOM 632 CB ASN A 41 12.783 5.352 -0.323 1.00 0.00 C ATOM 633 CG ASN A 41 14.123 4.758 -0.660 1.00 0.00 C ATOM 634 OD1 ASN A 41 14.920 4.447 0.233 1.00 0.00 O ATOM 635 ND2 ASN A 41 14.386 4.595 -1.931 1.00 0.00 N ATOM 0 H ASN A 41 10.620 6.113 0.580 1.00 0.00 H new ATOM 0 HA ASN A 41 12.243 3.879 1.119 1.00 0.00 H new ATOM 0 HB2 ASN A 41 12.049 5.024 -1.059 1.00 0.00 H new ATOM 0 HB3 ASN A 41 12.843 6.438 -0.394 1.00 0.00 H new ATOM 0 HD21 ASN A 41 15.279 4.197 -2.220 1.00 0.00 H new ATOM 0 HD22 ASN A 41 13.698 4.866 -2.633 1.00 0.00 H new ATOM 642 N GLY A 42 13.736 4.498 2.966 1.00 0.00 N ATOM 643 CA GLY A 42 14.704 4.803 4.011 1.00 0.00 C ATOM 644 C GLY A 42 14.062 4.745 5.391 1.00 0.00 C ATOM 645 O GLY A 42 14.755 4.705 6.407 1.00 0.00 O ATOM 0 H GLY A 42 13.432 3.525 2.946 1.00 0.00 H new ATOM 0 HA2 GLY A 42 15.531 4.095 3.962 1.00 0.00 H new ATOM 0 HA3 GLY A 42 15.123 5.795 3.844 1.00 0.00 H new ATOM 649 N LEU A 43 12.734 4.742 5.420 1.00 0.00 N ATOM 650 CA LEU A 43 11.996 4.652 6.674 1.00 0.00 C ATOM 651 C LEU A 43 11.748 3.200 7.065 1.00 0.00 C ATOM 652 O LEU A 43 12.048 2.282 6.301 1.00 0.00 O ATOM 653 CB LEU A 43 10.658 5.392 6.556 1.00 0.00 C ATOM 654 CG LEU A 43 10.750 6.881 6.202 1.00 0.00 C ATOM 655 CD1 LEU A 43 9.355 7.491 6.204 1.00 0.00 C ATOM 656 CD2 LEU A 43 11.656 7.585 7.202 1.00 0.00 C ATOM 0 H LEU A 43 12.146 4.801 4.588 1.00 0.00 H new ATOM 0 HA LEU A 43 12.600 5.119 7.452 1.00 0.00 H new ATOM 0 HB2 LEU A 43 10.054 4.894 5.798 1.00 0.00 H new ATOM 0 HB3 LEU A 43 10.125 5.295 7.502 1.00 0.00 H new ATOM 0 HG LEU A 43 11.177 7.002 5.206 1.00 0.00 H new ATOM 0 HD11 LEU A 43 9.420 8.550 5.952 1.00 0.00 H new ATOM 0 HD12 LEU A 43 8.734 6.981 5.468 1.00 0.00 H new ATOM 0 HD13 LEU A 43 8.911 7.380 7.193 1.00 0.00 H new ATOM 0 HD21 LEU A 43 11.722 8.644 6.951 1.00 0.00 H new ATOM 0 HD22 LEU A 43 11.245 7.475 8.206 1.00 0.00 H new ATOM 0 HD23 LEU A 43 12.651 7.141 7.167 1.00 0.00 H new ATOM 668 N THR A 44 11.199 2.999 8.258 1.00 0.00 N ATOM 669 CA THR A 44 11.087 1.664 8.834 1.00 0.00 C ATOM 670 C THR A 44 9.663 1.383 9.300 1.00 0.00 C ATOM 671 O THR A 44 8.804 2.265 9.269 1.00 0.00 O ATOM 672 CB THR A 44 12.061 1.485 10.013 1.00 0.00 C ATOM 673 OG1 THR A 44 11.613 2.265 11.130 1.00 0.00 O ATOM 674 CG2 THR A 44 13.461 1.928 9.619 1.00 0.00 C ATOM 0 H THR A 44 10.824 3.744 8.845 1.00 0.00 H new ATOM 0 HA THR A 44 11.347 0.952 8.051 1.00 0.00 H new ATOM 0 HB THR A 44 12.088 0.430 10.286 1.00 0.00 H new ATOM 0 HG1 THR A 44 12.233 2.149 11.880 1.00 0.00 H new ATOM 0 HG21 THR A 44 14.136 1.795 10.464 1.00 0.00 H new ATOM 0 HG22 THR A 44 13.809 1.328 8.778 1.00 0.00 H new ATOM 0 HG23 THR A 44 13.443 2.979 9.332 1.00 0.00 H new ATOM 682 N PHE A 45 9.419 0.150 9.729 1.00 0.00 N ATOM 683 CA PHE A 45 8.202 -0.178 10.463 1.00 0.00 C ATOM 684 C PHE A 45 8.462 -0.241 11.962 1.00 0.00 C ATOM 685 O PHE A 45 8.907 -1.265 12.482 1.00 0.00 O ATOM 686 CB PHE A 45 7.634 -1.515 9.981 1.00 0.00 C ATOM 687 CG PHE A 45 7.005 -1.450 8.619 1.00 0.00 C ATOM 688 CD1 PHE A 45 7.786 -1.516 7.475 1.00 0.00 C ATOM 689 CD2 PHE A 45 5.631 -1.324 8.478 1.00 0.00 C ATOM 690 CE1 PHE A 45 7.209 -1.457 6.220 1.00 0.00 C ATOM 691 CE2 PHE A 45 5.051 -1.266 7.226 1.00 0.00 C ATOM 692 CZ PHE A 45 5.841 -1.333 6.096 1.00 0.00 C ATOM 0 H PHE A 45 10.048 -0.639 9.581 1.00 0.00 H new ATOM 0 HA PHE A 45 7.476 0.612 10.273 1.00 0.00 H new ATOM 0 HB2 PHE A 45 8.434 -2.255 9.967 1.00 0.00 H new ATOM 0 HB3 PHE A 45 6.891 -1.863 10.698 1.00 0.00 H new ATOM 0 HD1 PHE A 45 8.858 -1.615 7.565 1.00 0.00 H new ATOM 0 HD2 PHE A 45 5.007 -1.271 9.358 1.00 0.00 H new ATOM 0 HE1 PHE A 45 7.829 -1.508 5.337 1.00 0.00 H new ATOM 0 HE2 PHE A 45 3.980 -1.168 7.131 1.00 0.00 H new ATOM 0 HZ PHE A 45 5.389 -1.288 5.116 1.00 0.00 H new ATOM 702 N HIS A 46 8.183 0.859 12.652 1.00 0.00 N ATOM 703 CA HIS A 46 8.522 0.983 14.065 1.00 0.00 C ATOM 704 C HIS A 46 7.633 0.093 14.926 1.00 0.00 C ATOM 705 O HIS A 46 8.063 -0.411 15.963 1.00 0.00 O ATOM 706 CB HIS A 46 8.396 2.439 14.525 1.00 0.00 C ATOM 707 CG HIS A 46 8.812 2.659 15.947 1.00 0.00 C ATOM 708 ND1 HIS A 46 7.924 2.589 17.001 1.00 0.00 N ATOM 709 CD2 HIS A 46 10.018 2.946 16.489 1.00 0.00 C ATOM 710 CE1 HIS A 46 8.568 2.824 18.131 1.00 0.00 C ATOM 711 NE2 HIS A 46 9.839 3.044 17.848 1.00 0.00 N ATOM 0 H HIS A 46 7.723 1.678 12.256 1.00 0.00 H new ATOM 0 HA HIS A 46 9.556 0.659 14.185 1.00 0.00 H new ATOM 0 HB2 HIS A 46 9.004 3.070 13.876 1.00 0.00 H new ATOM 0 HB3 HIS A 46 7.362 2.761 14.404 1.00 0.00 H new ATOM 0 HD2 HIS A 46 10.947 3.074 15.954 1.00 0.00 H new ATOM 0 HE1 HIS A 46 8.129 2.834 19.118 1.00 0.00 H new ATOM 0 HE2 HIS A 46 10.570 3.253 18.528 1.00 0.00 H new ATOM 718 N ARG A 47 6.393 -0.094 14.489 1.00 0.00 N ATOM 719 CA ARG A 47 5.391 -0.778 15.298 1.00 0.00 C ATOM 720 C ARG A 47 4.882 -2.033 14.601 1.00 0.00 C ATOM 721 O ARG A 47 3.782 -2.046 14.049 1.00 0.00 O ATOM 722 CB ARG A 47 4.218 0.147 15.591 1.00 0.00 C ATOM 723 CG ARG A 47 4.552 1.347 16.462 1.00 0.00 C ATOM 724 CD ARG A 47 3.375 2.235 16.647 1.00 0.00 C ATOM 725 NE ARG A 47 3.739 3.492 17.281 1.00 0.00 N ATOM 726 CZ ARG A 47 3.941 3.651 18.604 1.00 0.00 C ATOM 727 NH1 ARG A 47 3.811 2.626 19.416 1.00 0.00 N ATOM 728 NH2 ARG A 47 4.269 4.838 19.085 1.00 0.00 N ATOM 0 H ARG A 47 6.057 0.219 13.578 1.00 0.00 H new ATOM 0 HA ARG A 47 5.868 -1.067 16.235 1.00 0.00 H new ATOM 0 HB2 ARG A 47 3.811 0.505 14.645 1.00 0.00 H new ATOM 0 HB3 ARG A 47 3.432 -0.430 16.078 1.00 0.00 H new ATOM 0 HG2 ARG A 47 4.906 1.004 17.434 1.00 0.00 H new ATOM 0 HG3 ARG A 47 5.366 1.911 16.008 1.00 0.00 H new ATOM 0 HD2 ARG A 47 2.916 2.436 15.679 1.00 0.00 H new ATOM 0 HD3 ARG A 47 2.627 1.725 17.254 1.00 0.00 H new ATOM 0 HE ARG A 47 3.849 4.311 16.683 1.00 0.00 H new ATOM 0 HH11 ARG A 47 3.557 1.710 19.045 1.00 0.00 H new ATOM 0 HH12 ARG A 47 3.964 2.746 20.417 1.00 0.00 H new ATOM 0 HH21 ARG A 47 4.369 5.634 18.455 1.00 0.00 H new ATOM 0 HH22 ARG A 47 4.422 4.958 20.086 1.00 0.00 H new ATOM 742 N VAL A 48 5.691 -3.088 14.629 1.00 0.00 N ATOM 743 CA VAL A 48 5.311 -4.360 14.028 1.00 0.00 C ATOM 744 C VAL A 48 4.846 -5.352 15.086 1.00 0.00 C ATOM 745 O VAL A 48 5.600 -5.707 15.992 1.00 0.00 O ATOM 746 CB VAL A 48 6.498 -4.960 13.252 1.00 0.00 C ATOM 747 CG1 VAL A 48 6.111 -6.297 12.637 1.00 0.00 C ATOM 748 CG2 VAL A 48 6.961 -3.987 12.179 1.00 0.00 C ATOM 0 H VAL A 48 6.614 -3.086 15.062 1.00 0.00 H new ATOM 0 HA VAL A 48 4.485 -4.169 13.342 1.00 0.00 H new ATOM 0 HB VAL A 48 7.322 -5.132 13.945 1.00 0.00 H new ATOM 0 HG11 VAL A 48 6.962 -6.707 12.092 1.00 0.00 H new ATOM 0 HG12 VAL A 48 5.818 -6.989 13.426 1.00 0.00 H new ATOM 0 HG13 VAL A 48 5.276 -6.154 11.951 1.00 0.00 H new ATOM 0 HG21 VAL A 48 7.801 -4.419 11.634 1.00 0.00 H new ATOM 0 HG22 VAL A 48 6.142 -3.792 11.487 1.00 0.00 H new ATOM 0 HG23 VAL A 48 7.273 -3.052 12.645 1.00 0.00 H new ATOM 758 N ILE A 49 3.600 -5.796 14.966 1.00 0.00 N ATOM 759 CA ILE A 49 3.105 -6.915 15.761 1.00 0.00 C ATOM 760 C ILE A 49 2.719 -8.092 14.873 1.00 0.00 C ATOM 761 O ILE A 49 1.648 -8.100 14.266 1.00 0.00 O ATOM 762 CB ILE A 49 1.893 -6.493 16.611 1.00 0.00 C ATOM 763 CG1 ILE A 49 2.258 -5.307 17.507 1.00 0.00 C ATOM 764 CG2 ILE A 49 1.395 -7.663 17.445 1.00 0.00 C ATOM 765 CD1 ILE A 49 1.071 -4.680 18.202 1.00 0.00 C ATOM 0 H ILE A 49 2.913 -5.398 14.325 1.00 0.00 H new ATOM 0 HA ILE A 49 3.913 -7.225 16.424 1.00 0.00 H new ATOM 0 HB ILE A 49 1.090 -6.184 15.942 1.00 0.00 H new ATOM 0 HG12 ILE A 49 2.974 -5.638 18.259 1.00 0.00 H new ATOM 0 HG13 ILE A 49 2.757 -4.548 16.904 1.00 0.00 H new ATOM 0 HG21 ILE A 49 0.538 -7.347 18.040 1.00 0.00 H new ATOM 0 HG22 ILE A 49 1.099 -8.479 16.786 1.00 0.00 H new ATOM 0 HG23 ILE A 49 2.191 -8.002 18.108 1.00 0.00 H new ATOM 0 HD11 ILE A 49 1.409 -3.847 18.818 1.00 0.00 H new ATOM 0 HD12 ILE A 49 0.363 -4.317 17.457 1.00 0.00 H new ATOM 0 HD13 ILE A 49 0.584 -5.424 18.833 1.00 0.00 H new ATOM 777 N PRO A 50 3.598 -9.087 14.802 1.00 0.00 N ATOM 778 CA PRO A 50 3.382 -10.239 13.936 1.00 0.00 C ATOM 779 C PRO A 50 2.047 -10.909 14.232 1.00 0.00 C ATOM 780 O PRO A 50 1.709 -11.157 15.389 1.00 0.00 O ATOM 781 CB PRO A 50 4.562 -11.154 14.279 1.00 0.00 C ATOM 782 CG PRO A 50 5.646 -10.215 14.684 1.00 0.00 C ATOM 783 CD PRO A 50 4.936 -9.127 15.445 1.00 0.00 C ATOM 0 HA PRO A 50 3.338 -9.981 12.878 1.00 0.00 H new ATOM 0 HB2 PRO A 50 4.310 -11.843 15.085 1.00 0.00 H new ATOM 0 HB3 PRO A 50 4.859 -11.759 13.423 1.00 0.00 H new ATOM 0 HG2 PRO A 50 6.391 -10.713 15.305 1.00 0.00 H new ATOM 0 HG3 PRO A 50 6.170 -9.815 13.816 1.00 0.00 H new ATOM 0 HD2 PRO A 50 4.866 -9.358 16.508 1.00 0.00 H new ATOM 0 HD3 PRO A 50 5.453 -8.171 15.360 1.00 0.00 H new ATOM 791 N GLY A 51 1.289 -11.199 13.179 1.00 0.00 N ATOM 792 CA GLY A 51 -0.001 -11.862 13.322 1.00 0.00 C ATOM 793 C GLY A 51 -1.087 -10.874 13.726 1.00 0.00 C ATOM 794 O GLY A 51 -2.207 -11.267 14.051 1.00 0.00 O ATOM 0 H GLY A 51 1.547 -10.984 12.216 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -0.273 -12.341 12.381 1.00 0.00 H new ATOM 0 HA3 GLY A 51 0.074 -12.651 14.071 1.00 0.00 H new ATOM 798 N PHE A 52 -0.748 -9.589 13.705 1.00 0.00 N ATOM 799 CA PHE A 52 -1.708 -8.539 14.026 1.00 0.00 C ATOM 800 C PHE A 52 -1.653 -7.412 13.003 1.00 0.00 C ATOM 801 O PHE A 52 -2.509 -7.318 12.123 1.00 0.00 O ATOM 802 CB PHE A 52 -1.438 -7.979 15.424 1.00 0.00 C ATOM 803 CG PHE A 52 -2.428 -6.936 15.860 1.00 0.00 C ATOM 804 CD1 PHE A 52 -3.505 -6.601 15.052 1.00 0.00 C ATOM 805 CD2 PHE A 52 -2.287 -6.290 17.078 1.00 0.00 C ATOM 806 CE1 PHE A 52 -4.416 -5.642 15.451 1.00 0.00 C ATOM 807 CE2 PHE A 52 -3.197 -5.333 17.481 1.00 0.00 C ATOM 808 CZ PHE A 52 -4.263 -5.009 16.666 1.00 0.00 C ATOM 0 H PHE A 52 0.185 -9.250 13.469 1.00 0.00 H new ATOM 0 HA PHE A 52 -2.704 -8.981 14.001 1.00 0.00 H new ATOM 0 HB2 PHE A 52 -1.448 -8.799 16.142 1.00 0.00 H new ATOM 0 HB3 PHE A 52 -0.437 -7.548 15.446 1.00 0.00 H new ATOM 0 HD1 PHE A 52 -3.633 -7.095 14.100 1.00 0.00 H new ATOM 0 HD2 PHE A 52 -1.455 -6.538 17.720 1.00 0.00 H new ATOM 0 HE1 PHE A 52 -5.248 -5.388 14.811 1.00 0.00 H new ATOM 0 HE2 PHE A 52 -3.075 -4.838 18.433 1.00 0.00 H new ATOM 0 HZ PHE A 52 -4.976 -4.261 16.980 1.00 0.00 H new ATOM 818 N VAL A 53 -0.642 -6.559 13.122 1.00 0.00 N ATOM 819 CA VAL A 53 -0.556 -5.354 12.307 1.00 0.00 C ATOM 820 C VAL A 53 0.861 -4.794 12.298 1.00 0.00 C ATOM 821 O VAL A 53 1.539 -4.780 13.326 1.00 0.00 O ATOM 822 CB VAL A 53 -1.525 -4.280 12.836 1.00 0.00 C ATOM 823 CG1 VAL A 53 -1.132 -3.854 14.242 1.00 0.00 C ATOM 824 CG2 VAL A 53 -1.540 -3.086 11.894 1.00 0.00 C ATOM 0 H VAL A 53 0.131 -6.680 13.777 1.00 0.00 H new ATOM 0 HA VAL A 53 -0.831 -5.624 11.288 1.00 0.00 H new ATOM 0 HB VAL A 53 -2.529 -4.701 12.880 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -1.827 -3.095 14.600 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -1.164 -4.718 14.906 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -0.122 -3.444 14.229 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -2.228 -2.331 12.275 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -0.538 -2.663 11.827 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -1.866 -3.407 10.905 1.00 0.00 H new ATOM 834 N SER A 54 1.303 -4.334 11.133 1.00 0.00 N ATOM 835 CA SER A 54 2.622 -3.729 10.999 1.00 0.00 C ATOM 836 C SER A 54 2.519 -2.269 10.575 1.00 0.00 C ATOM 837 O SER A 54 2.313 -1.968 9.399 1.00 0.00 O ATOM 838 CB SER A 54 3.450 -4.501 9.990 1.00 0.00 C ATOM 839 OG SER A 54 2.719 -4.740 8.819 1.00 0.00 O ATOM 0 H SER A 54 0.766 -4.369 10.267 1.00 0.00 H new ATOM 0 HA SER A 54 3.110 -3.768 11.973 1.00 0.00 H new ATOM 0 HB2 SER A 54 4.354 -3.941 9.751 1.00 0.00 H new ATOM 0 HB3 SER A 54 3.768 -5.449 10.424 1.00 0.00 H new ATOM 0 HG SER A 54 2.294 -3.908 8.523 1.00 0.00 H new ATOM 845 N GLN A 55 2.664 -1.367 11.539 1.00 0.00 N ATOM 846 CA GLN A 55 2.594 0.064 11.265 1.00 0.00 C ATOM 847 C GLN A 55 3.985 0.660 11.087 1.00 0.00 C ATOM 848 O GLN A 55 4.892 0.388 11.874 1.00 0.00 O ATOM 849 CB GLN A 55 1.855 0.789 12.393 1.00 0.00 C ATOM 850 CG GLN A 55 1.675 2.280 12.161 1.00 0.00 C ATOM 851 CD GLN A 55 0.858 2.942 13.254 1.00 0.00 C ATOM 852 OE1 GLN A 55 0.357 2.274 14.164 1.00 0.00 O ATOM 853 NE2 GLN A 55 0.717 4.259 13.172 1.00 0.00 N ATOM 0 H GLN A 55 2.831 -1.601 12.518 1.00 0.00 H new ATOM 0 HA GLN A 55 2.043 0.198 10.334 1.00 0.00 H new ATOM 0 HB2 GLN A 55 0.874 0.332 12.523 1.00 0.00 H new ATOM 0 HB3 GLN A 55 2.401 0.641 13.324 1.00 0.00 H new ATOM 0 HG2 GLN A 55 2.654 2.757 12.104 1.00 0.00 H new ATOM 0 HG3 GLN A 55 1.187 2.439 11.200 1.00 0.00 H new ATOM 0 HE21 GLN A 55 1.148 4.771 12.403 1.00 0.00 H new ATOM 0 HE22 GLN A 55 0.177 4.759 13.878 1.00 0.00 H new ATOM 862 N GLY A 56 4.146 1.473 10.050 1.00 0.00 N ATOM 863 CA GLY A 56 5.438 2.074 9.741 1.00 0.00 C ATOM 864 C GLY A 56 5.276 3.309 8.864 1.00 0.00 C ATOM 865 O GLY A 56 4.173 3.832 8.711 1.00 0.00 O ATOM 0 H GLY A 56 3.397 1.732 9.408 1.00 0.00 H new ATOM 0 HA2 GLY A 56 5.946 2.346 10.666 1.00 0.00 H new ATOM 0 HA3 GLY A 56 6.069 1.345 9.233 1.00 0.00 H new ATOM 869 N GLY A 57 6.382 3.771 8.290 1.00 0.00 N ATOM 870 CA GLY A 57 6.365 4.948 7.430 1.00 0.00 C ATOM 871 C GLY A 57 6.543 6.225 8.240 1.00 0.00 C ATOM 872 O GLY A 57 6.308 7.326 7.742 1.00 0.00 O ATOM 0 H GLY A 57 7.303 3.347 8.405 1.00 0.00 H new ATOM 0 HA2 GLY A 57 7.160 4.871 6.688 1.00 0.00 H new ATOM 0 HA3 GLY A 57 5.422 4.989 6.884 1.00 0.00 H new ATOM 876 N CYS A 58 6.960 6.072 9.493 1.00 0.00 N ATOM 877 CA CYS A 58 7.198 7.215 10.366 1.00 0.00 C ATOM 878 C CYS A 58 8.524 7.891 10.039 1.00 0.00 C ATOM 879 O CYS A 58 9.572 7.245 10.016 1.00 0.00 O ATOM 880 CB CYS A 58 7.202 6.781 11.832 1.00 0.00 C ATOM 881 SG CYS A 58 7.439 8.138 13.004 1.00 0.00 S ATOM 0 H CYS A 58 7.140 5.166 9.926 1.00 0.00 H new ATOM 0 HA CYS A 58 6.389 7.927 10.200 1.00 0.00 H new ATOM 0 HB2 CYS A 58 6.258 6.283 12.055 1.00 0.00 H new ATOM 0 HB3 CYS A 58 7.993 6.045 11.980 1.00 0.00 H new ATOM 0 HG CYS A 58 7.216 7.712 14.212 1.00 0.00 H new ATOM 887 N PRO A 59 8.471 9.194 9.784 1.00 0.00 N ATOM 888 CA PRO A 59 9.658 9.948 9.399 1.00 0.00 C ATOM 889 C PRO A 59 10.552 10.222 10.602 1.00 0.00 C ATOM 890 O PRO A 59 11.744 10.490 10.453 1.00 0.00 O ATOM 891 CB PRO A 59 9.073 11.241 8.823 1.00 0.00 C ATOM 892 CG PRO A 59 7.787 11.418 9.555 1.00 0.00 C ATOM 893 CD PRO A 59 7.251 10.020 9.715 1.00 0.00 C ATOM 0 HA PRO A 59 10.295 9.418 8.691 1.00 0.00 H new ATOM 0 HB2 PRO A 59 9.742 12.087 8.983 1.00 0.00 H new ATOM 0 HB3 PRO A 59 8.912 11.161 7.748 1.00 0.00 H new ATOM 0 HG2 PRO A 59 7.943 11.897 10.522 1.00 0.00 H new ATOM 0 HG3 PRO A 59 7.095 12.047 8.996 1.00 0.00 H new ATOM 0 HD2 PRO A 59 6.647 9.922 10.617 1.00 0.00 H new ATOM 0 HD3 PRO A 59 6.618 9.733 8.875 1.00 0.00 H new ATOM 901 N ARG A 60 9.969 10.153 11.793 1.00 0.00 N ATOM 902 CA ARG A 60 10.700 10.438 13.022 1.00 0.00 C ATOM 903 C ARG A 60 11.335 9.175 13.590 1.00 0.00 C ATOM 904 O ARG A 60 12.333 9.239 14.308 1.00 0.00 O ATOM 905 CB ARG A 60 9.778 11.052 14.065 1.00 0.00 C ATOM 906 CG ARG A 60 9.131 12.365 13.653 1.00 0.00 C ATOM 907 CD ARG A 60 8.418 13.005 14.788 1.00 0.00 C ATOM 908 NE ARG A 60 9.330 13.408 15.845 1.00 0.00 N ATOM 909 CZ ARG A 60 8.953 13.984 17.003 1.00 0.00 C ATOM 910 NH1 ARG A 60 7.681 14.218 17.237 1.00 0.00 N ATOM 911 NH2 ARG A 60 9.863 14.314 17.904 1.00 0.00 N ATOM 0 H ARG A 60 8.991 9.902 11.934 1.00 0.00 H new ATOM 0 HA ARG A 60 11.490 11.148 12.776 1.00 0.00 H new ATOM 0 HB2 ARG A 60 8.992 10.335 14.301 1.00 0.00 H new ATOM 0 HB3 ARG A 60 10.347 11.215 14.981 1.00 0.00 H new ATOM 0 HG2 ARG A 60 9.895 13.044 13.273 1.00 0.00 H new ATOM 0 HG3 ARG A 60 8.430 12.186 12.838 1.00 0.00 H new ATOM 0 HD2 ARG A 60 7.872 13.877 14.428 1.00 0.00 H new ATOM 0 HD3 ARG A 60 7.680 12.311 15.191 1.00 0.00 H new ATOM 0 HE ARG A 60 10.326 13.243 15.700 1.00 0.00 H new ATOM 0 HH11 ARG A 60 6.979 13.963 16.542 1.00 0.00 H new ATOM 0 HH12 ARG A 60 7.396 14.654 18.114 1.00 0.00 H new ATOM 0 HH21 ARG A 60 10.850 14.132 17.722 1.00 0.00 H new ATOM 0 HH22 ARG A 60 9.578 14.750 18.781 1.00 0.00 H new ATOM 925 N GLY A 61 10.750 8.027 13.264 1.00 0.00 N ATOM 926 CA GLY A 61 11.277 6.744 13.715 1.00 0.00 C ATOM 927 C GLY A 61 10.974 6.511 15.189 1.00 0.00 C ATOM 928 O GLY A 61 11.573 5.644 15.826 1.00 0.00 O ATOM 0 H GLY A 61 9.910 7.959 12.689 1.00 0.00 H new ATOM 0 HA2 GLY A 61 10.843 5.940 13.120 1.00 0.00 H new ATOM 0 HA3 GLY A 61 12.355 6.714 13.553 1.00 0.00 H new ATOM 932 N ASN A 62 10.041 7.290 15.727 1.00 0.00 N ATOM 933 CA ASN A 62 9.688 7.197 17.138 1.00 0.00 C ATOM 934 C ASN A 62 8.376 6.447 17.329 1.00 0.00 C ATOM 935 O ASN A 62 7.926 6.242 18.457 1.00 0.00 O ATOM 936 CB ASN A 62 9.607 8.580 17.759 1.00 0.00 C ATOM 937 CG ASN A 62 10.949 9.250 17.854 1.00 0.00 C ATOM 938 OD1 ASN A 62 11.981 8.584 17.997 1.00 0.00 O ATOM 939 ND2 ASN A 62 10.956 10.556 17.776 1.00 0.00 N ATOM 0 H ASN A 62 9.516 7.993 15.206 1.00 0.00 H new ATOM 0 HA ASN A 62 10.472 6.634 17.644 1.00 0.00 H new ATOM 0 HB2 ASN A 62 8.936 9.202 17.166 1.00 0.00 H new ATOM 0 HB3 ASN A 62 9.173 8.502 18.756 1.00 0.00 H new ATOM 0 HD21 ASN A 62 11.838 11.066 17.833 1.00 0.00 H new ATOM 0 HD22 ASN A 62 10.080 11.065 17.658 1.00 0.00 H new ATOM 946 N GLY A 63 7.767 6.039 16.221 1.00 0.00 N ATOM 947 CA GLY A 63 6.476 5.363 16.261 1.00 0.00 C ATOM 948 C GLY A 63 5.336 6.335 15.985 1.00 0.00 C ATOM 949 O GLY A 63 4.235 5.926 15.615 1.00 0.00 O ATOM 0 H GLY A 63 8.147 6.165 15.283 1.00 0.00 H new ATOM 0 HA2 GLY A 63 6.460 4.561 15.523 1.00 0.00 H new ATOM 0 HA3 GLY A 63 6.335 4.901 17.238 1.00 0.00 H new ATOM 953 N THR A 64 5.607 7.623 16.166 1.00 0.00 N ATOM 954 CA THR A 64 4.632 8.661 15.853 1.00 0.00 C ATOM 955 C THR A 64 5.254 9.759 14.999 1.00 0.00 C ATOM 956 O THR A 64 6.224 10.399 15.403 1.00 0.00 O ATOM 957 CB THR A 64 4.044 9.275 17.136 1.00 0.00 C ATOM 958 OG1 THR A 64 3.414 8.249 17.914 1.00 0.00 O ATOM 959 CG2 THR A 64 3.021 10.347 16.795 1.00 0.00 C ATOM 0 H THR A 64 6.494 7.973 16.528 1.00 0.00 H new ATOM 0 HA THR A 64 3.828 8.189 15.288 1.00 0.00 H new ATOM 0 HB THR A 64 4.854 9.729 17.707 1.00 0.00 H new ATOM 0 HG1 THR A 64 3.041 8.641 18.731 1.00 0.00 H new ATOM 0 HG21 THR A 64 2.616 10.769 17.715 1.00 0.00 H new ATOM 0 HG22 THR A 64 3.500 11.135 16.214 1.00 0.00 H new ATOM 0 HG23 THR A 64 2.213 9.906 16.212 1.00 0.00 H new ATOM 967 N GLY A 65 4.687 9.974 13.816 1.00 0.00 N ATOM 968 CA GLY A 65 5.245 10.923 12.860 1.00 0.00 C ATOM 969 C GLY A 65 4.675 12.320 13.077 1.00 0.00 C ATOM 970 O GLY A 65 3.981 12.573 14.061 1.00 0.00 O ATOM 0 H GLY A 65 3.840 9.503 13.497 1.00 0.00 H new ATOM 0 HA2 GLY A 65 6.330 10.950 12.961 1.00 0.00 H new ATOM 0 HA3 GLY A 65 5.027 10.592 11.845 1.00 0.00 H new ATOM 974 N ASP A 66 4.972 13.224 12.150 1.00 0.00 N ATOM 975 CA ASP A 66 4.484 14.595 12.232 1.00 0.00 C ATOM 976 C ASP A 66 3.961 15.076 10.885 1.00 0.00 C ATOM 977 O ASP A 66 4.701 15.661 10.093 1.00 0.00 O ATOM 978 CB ASP A 66 5.592 15.532 12.720 1.00 0.00 C ATOM 979 CG ASP A 66 5.110 16.960 12.932 1.00 0.00 C ATOM 980 OD1 ASP A 66 3.957 17.222 12.681 1.00 0.00 O ATOM 981 OD2 ASP A 66 5.898 17.777 13.344 1.00 0.00 O ATOM 0 H ASP A 66 5.550 13.031 11.332 1.00 0.00 H new ATOM 0 HA ASP A 66 3.662 14.610 12.947 1.00 0.00 H new ATOM 0 HB2 ASP A 66 5.999 15.149 13.656 1.00 0.00 H new ATOM 0 HB3 ASP A 66 6.406 15.533 11.995 1.00 0.00 H new ATOM 986 N ALA A 67 2.682 14.827 10.629 1.00 0.00 N ATOM 987 CA ALA A 67 2.065 15.206 9.362 1.00 0.00 C ATOM 988 C ALA A 67 0.598 15.570 9.551 1.00 0.00 C ATOM 989 O ALA A 67 -0.039 15.143 10.513 1.00 0.00 O ATOM 990 CB ALA A 67 2.204 14.080 8.348 1.00 0.00 C ATOM 0 H ALA A 67 2.051 14.364 11.283 1.00 0.00 H new ATOM 0 HA ALA A 67 2.585 16.087 8.985 1.00 0.00 H new ATOM 0 HB1 ALA A 67 1.739 14.377 7.408 1.00 0.00 H new ATOM 0 HB2 ALA A 67 3.260 13.870 8.180 1.00 0.00 H new ATOM 0 HB3 ALA A 67 1.712 13.185 8.729 1.00 0.00 H new ATOM 996 N GLY A 68 0.068 16.364 8.627 1.00 0.00 N ATOM 997 CA GLY A 68 -1.320 16.803 8.699 1.00 0.00 C ATOM 998 C GLY A 68 -1.926 16.948 7.309 1.00 0.00 C ATOM 999 O GLY A 68 -1.976 18.046 6.755 1.00 0.00 O ATOM 0 H GLY A 68 0.580 16.717 7.818 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -1.901 16.086 9.279 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -1.376 17.757 9.224 1.00 0.00 H new ATOM 1003 N TYR A 69 -2.384 15.833 6.750 1.00 0.00 N ATOM 1004 CA TYR A 69 -2.969 15.830 5.414 1.00 0.00 C ATOM 1005 C TYR A 69 -4.490 15.883 5.479 1.00 0.00 C ATOM 1006 O TYR A 69 -5.104 15.285 6.361 1.00 0.00 O ATOM 1007 CB TYR A 69 -2.514 14.595 4.633 1.00 0.00 C ATOM 1008 CG TYR A 69 -1.044 14.607 4.274 1.00 0.00 C ATOM 1009 CD1 TYR A 69 -0.609 15.303 3.156 1.00 0.00 C ATOM 1010 CD2 TYR A 69 -0.132 13.923 5.064 1.00 0.00 C ATOM 1011 CE1 TYR A 69 0.733 15.314 2.828 1.00 0.00 C ATOM 1012 CE2 TYR A 69 1.210 13.934 4.736 1.00 0.00 C ATOM 1013 CZ TYR A 69 1.640 14.632 3.614 1.00 0.00 C ATOM 1014 OH TYR A 69 2.977 14.644 3.287 1.00 0.00 O ATOM 0 H TYR A 69 -2.361 14.919 7.202 1.00 0.00 H new ATOM 0 HA TYR A 69 -2.621 16.723 4.894 1.00 0.00 H new ATOM 0 HB2 TYR A 69 -2.727 13.704 5.224 1.00 0.00 H new ATOM 0 HB3 TYR A 69 -3.101 14.518 3.718 1.00 0.00 H new ATOM 0 HD1 TYR A 69 -1.319 15.836 2.542 1.00 0.00 H new ATOM 0 HD2 TYR A 69 -0.471 13.382 5.935 1.00 0.00 H new ATOM 0 HE1 TYR A 69 1.072 15.856 1.957 1.00 0.00 H new ATOM 0 HE2 TYR A 69 1.922 13.402 5.349 1.00 0.00 H new ATOM 0 HH TYR A 69 3.479 14.117 3.943 1.00 0.00 H new ATOM 1024 N THR A 70 -5.092 16.603 4.538 1.00 0.00 N ATOM 1025 CA THR A 70 -6.545 16.681 4.446 1.00 0.00 C ATOM 1026 C THR A 70 -7.109 15.528 3.625 1.00 0.00 C ATOM 1027 O THR A 70 -7.176 15.601 2.399 1.00 0.00 O ATOM 1028 CB THR A 70 -6.990 18.021 3.829 1.00 0.00 C ATOM 1029 OG1 THR A 70 -6.512 19.103 4.637 1.00 0.00 O ATOM 1030 CG2 THR A 70 -8.507 18.089 3.742 1.00 0.00 C ATOM 0 H THR A 70 -4.595 17.141 3.828 1.00 0.00 H new ATOM 0 HA THR A 70 -6.936 16.612 5.461 1.00 0.00 H new ATOM 0 HB THR A 70 -6.575 18.098 2.824 1.00 0.00 H new ATOM 0 HG1 THR A 70 -6.794 19.955 4.243 1.00 0.00 H new ATOM 0 HG21 THR A 70 -8.804 19.042 3.304 1.00 0.00 H new ATOM 0 HG22 THR A 70 -8.873 17.273 3.118 1.00 0.00 H new ATOM 0 HG23 THR A 70 -8.933 18.001 4.741 1.00 0.00 H new ATOM 1038 N ILE A 71 -7.512 14.463 4.310 1.00 0.00 N ATOM 1039 CA ILE A 71 -8.085 13.298 3.647 1.00 0.00 C ATOM 1040 C ILE A 71 -9.482 12.995 4.174 1.00 0.00 C ATOM 1041 O ILE A 71 -9.642 12.523 5.300 1.00 0.00 O ATOM 1042 CB ILE A 71 -7.186 12.062 3.834 1.00 0.00 C ATOM 1043 CG1 ILE A 71 -5.780 12.338 3.294 1.00 0.00 C ATOM 1044 CG2 ILE A 71 -7.796 10.851 3.144 1.00 0.00 C ATOM 1045 CD1 ILE A 71 -4.787 11.236 3.585 1.00 0.00 C ATOM 0 H ILE A 71 -7.452 14.383 5.325 1.00 0.00 H new ATOM 0 HA ILE A 71 -8.154 13.531 2.584 1.00 0.00 H new ATOM 0 HB ILE A 71 -7.110 11.847 4.900 1.00 0.00 H new ATOM 0 HG12 ILE A 71 -5.838 12.487 2.216 1.00 0.00 H new ATOM 0 HG13 ILE A 71 -5.412 13.269 3.725 1.00 0.00 H new ATOM 0 HG21 ILE A 71 -7.148 9.986 3.286 1.00 0.00 H new ATOM 0 HG22 ILE A 71 -8.777 10.644 3.572 1.00 0.00 H new ATOM 0 HG23 ILE A 71 -7.901 11.054 2.078 1.00 0.00 H new ATOM 0 HD11 ILE A 71 -3.815 11.504 3.172 1.00 0.00 H new ATOM 0 HD12 ILE A 71 -4.698 11.101 4.663 1.00 0.00 H new ATOM 0 HD13 ILE A 71 -5.131 10.307 3.130 1.00 0.00 H new ATOM 1057 N PRO A 72 -10.491 13.269 3.355 1.00 0.00 N ATOM 1058 CA PRO A 72 -11.876 13.007 3.729 1.00 0.00 C ATOM 1059 C PRO A 72 -12.151 11.511 3.801 1.00 0.00 C ATOM 1060 O PRO A 72 -11.460 10.711 3.171 1.00 0.00 O ATOM 1061 CB PRO A 72 -12.669 13.674 2.602 1.00 0.00 C ATOM 1062 CG PRO A 72 -11.749 13.631 1.430 1.00 0.00 C ATOM 1063 CD PRO A 72 -10.386 13.889 2.016 1.00 0.00 C ATOM 0 HA PRO A 72 -12.138 13.390 4.715 1.00 0.00 H new ATOM 0 HB2 PRO A 72 -13.597 13.140 2.399 1.00 0.00 H new ATOM 0 HB3 PRO A 72 -12.940 14.698 2.858 1.00 0.00 H new ATOM 0 HG2 PRO A 72 -11.789 12.664 0.928 1.00 0.00 H new ATOM 0 HG3 PRO A 72 -12.013 14.386 0.689 1.00 0.00 H new ATOM 0 HD2 PRO A 72 -9.595 13.435 1.419 1.00 0.00 H new ATOM 0 HD3 PRO A 72 -10.166 14.955 2.078 1.00 0.00 H new ATOM 1071 N CYS A 73 -13.167 11.138 4.573 1.00 0.00 N ATOM 1072 CA CYS A 73 -13.523 9.735 4.747 1.00 0.00 C ATOM 1073 C CYS A 73 -13.958 9.111 3.427 1.00 0.00 C ATOM 1074 O CYS A 73 -15.098 9.281 2.994 1.00 0.00 O ATOM 1075 CB CYS A 73 -14.649 9.588 5.770 1.00 0.00 C ATOM 1076 SG CYS A 73 -15.102 7.874 6.129 1.00 0.00 S ATOM 0 H CYS A 73 -13.759 11.789 5.089 1.00 0.00 H new ATOM 0 HA CYS A 73 -12.636 9.214 5.108 1.00 0.00 H new ATOM 0 HB2 CYS A 73 -14.348 10.075 6.698 1.00 0.00 H new ATOM 0 HB3 CYS A 73 -15.529 10.116 5.404 1.00 0.00 H new ATOM 0 HG CYS A 73 -16.061 7.853 7.006 1.00 0.00 H new ATOM 1082 N GLU A 74 -13.044 8.386 2.792 1.00 0.00 N ATOM 1083 CA GLU A 74 -13.301 7.811 1.477 1.00 0.00 C ATOM 1084 C GLU A 74 -13.911 6.420 1.594 1.00 0.00 C ATOM 1085 O GLU A 74 -13.208 5.413 1.499 1.00 0.00 O ATOM 1086 CB GLU A 74 -12.008 7.744 0.661 1.00 0.00 C ATOM 1087 CG GLU A 74 -11.380 9.099 0.366 1.00 0.00 C ATOM 1088 CD GLU A 74 -10.324 9.034 -0.701 1.00 0.00 C ATOM 1089 OE1 GLU A 74 -9.327 8.389 -0.485 1.00 0.00 O ATOM 1090 OE2 GLU A 74 -10.513 9.632 -1.734 1.00 0.00 O ATOM 0 H GLU A 74 -12.118 8.182 3.167 1.00 0.00 H new ATOM 0 HA GLU A 74 -14.014 8.457 0.965 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -11.285 7.131 1.199 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -12.214 7.239 -0.283 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -12.159 9.795 0.057 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -10.941 9.497 1.281 1.00 0.00 H new ATOM 1097 N THR A 75 -15.222 6.369 1.800 1.00 0.00 N ATOM 1098 CA THR A 75 -15.950 5.106 1.799 1.00 0.00 C ATOM 1099 C THR A 75 -16.732 4.921 0.504 1.00 0.00 C ATOM 1100 O THR A 75 -17.374 3.893 0.297 1.00 0.00 O ATOM 1101 CB THR A 75 -16.910 5.017 3.000 1.00 0.00 C ATOM 1102 OG1 THR A 75 -17.825 6.119 2.966 1.00 0.00 O ATOM 1103 CG2 THR A 75 -16.132 5.049 4.308 1.00 0.00 C ATOM 0 H THR A 75 -15.803 7.190 1.970 1.00 0.00 H new ATOM 0 HA THR A 75 -15.211 4.309 1.879 1.00 0.00 H new ATOM 0 HB THR A 75 -17.459 4.078 2.938 1.00 0.00 H new ATOM 0 HG1 THR A 75 -18.436 6.060 3.730 1.00 0.00 H new ATOM 0 HG21 THR A 75 -16.826 4.985 5.146 1.00 0.00 H new ATOM 0 HG22 THR A 75 -15.443 4.205 4.342 1.00 0.00 H new ATOM 0 HG23 THR A 75 -15.569 5.980 4.374 1.00 0.00 H new ATOM 1111 N ASP A 76 -16.673 5.926 -0.363 1.00 0.00 N ATOM 1112 CA ASP A 76 -17.377 5.876 -1.640 1.00 0.00 C ATOM 1113 C ASP A 76 -16.917 4.689 -2.476 1.00 0.00 C ATOM 1114 O ASP A 76 -15.869 4.740 -3.120 1.00 0.00 O ATOM 1115 CB ASP A 76 -17.159 7.174 -2.423 1.00 0.00 C ATOM 1116 CG ASP A 76 -17.933 7.212 -3.733 1.00 0.00 C ATOM 1117 OD1 ASP A 76 -18.533 6.220 -4.075 1.00 0.00 O ATOM 1118 OD2 ASP A 76 -17.917 8.232 -4.379 1.00 0.00 O ATOM 0 H ASP A 76 -16.145 6.785 -0.205 1.00 0.00 H new ATOM 0 HA ASP A 76 -18.440 5.759 -1.428 1.00 0.00 H new ATOM 0 HB2 ASP A 76 -17.459 8.020 -1.805 1.00 0.00 H new ATOM 0 HB3 ASP A 76 -16.096 7.293 -2.631 1.00 0.00 H new ATOM 1123 N ASN A 77 -17.708 3.621 -2.463 1.00 0.00 N ATOM 1124 CA ASN A 77 -17.316 2.370 -3.102 1.00 0.00 C ATOM 1125 C ASN A 77 -15.973 1.880 -2.575 1.00 0.00 C ATOM 1126 O ASN A 77 -15.155 1.351 -3.329 1.00 0.00 O ATOM 1127 CB ASN A 77 -17.272 2.531 -4.610 1.00 0.00 C ATOM 1128 CG ASN A 77 -18.632 2.768 -5.206 1.00 0.00 C ATOM 1129 OD1 ASN A 77 -19.649 2.330 -4.656 1.00 0.00 O ATOM 1130 ND2 ASN A 77 -18.670 3.451 -6.321 1.00 0.00 N ATOM 0 H ASN A 77 -18.625 3.597 -2.017 1.00 0.00 H new ATOM 0 HA ASN A 77 -18.067 1.619 -2.856 1.00 0.00 H new ATOM 0 HB2 ASN A 77 -16.618 3.365 -4.864 1.00 0.00 H new ATOM 0 HB3 ASN A 77 -16.835 1.637 -5.055 1.00 0.00 H new ATOM 0 HD21 ASN A 77 -19.565 3.642 -6.772 1.00 0.00 H new ATOM 0 HD22 ASN A 77 -17.805 3.793 -6.739 1.00 0.00 H new ATOM 1137 N ASN A 78 -15.752 2.057 -1.277 1.00 0.00 N ATOM 1138 CA ASN A 78 -14.490 1.674 -0.656 1.00 0.00 C ATOM 1139 C ASN A 78 -14.696 1.245 0.792 1.00 0.00 C ATOM 1140 O ASN A 78 -14.412 2.003 1.719 1.00 0.00 O ATOM 1141 CB ASN A 78 -13.486 2.809 -0.739 1.00 0.00 C ATOM 1142 CG ASN A 78 -12.118 2.407 -0.265 1.00 0.00 C ATOM 1143 OD1 ASN A 78 -11.556 1.406 -0.726 1.00 0.00 O ATOM 1144 ND2 ASN A 78 -11.570 3.167 0.648 1.00 0.00 N ATOM 0 H ASN A 78 -16.431 2.464 -0.634 1.00 0.00 H new ATOM 0 HA ASN A 78 -14.093 0.820 -1.205 1.00 0.00 H new ATOM 0 HB2 ASN A 78 -13.421 3.157 -1.770 1.00 0.00 H new ATOM 0 HB3 ASN A 78 -13.842 3.648 -0.141 1.00 0.00 H new ATOM 0 HD21 ASN A 78 -10.642 2.943 1.008 1.00 0.00 H new ATOM 0 HD22 ASN A 78 -12.070 3.983 1.000 1.00 0.00 H new ATOM 1151 N PRO A 79 -15.191 0.027 0.977 1.00 0.00 N ATOM 1152 CA PRO A 79 -15.319 -0.553 2.309 1.00 0.00 C ATOM 1153 C PRO A 79 -13.971 -0.611 3.017 1.00 0.00 C ATOM 1154 O PRO A 79 -12.988 -1.102 2.461 1.00 0.00 O ATOM 1155 CB PRO A 79 -15.868 -1.955 2.024 1.00 0.00 C ATOM 1156 CG PRO A 79 -16.523 -1.827 0.691 1.00 0.00 C ATOM 1157 CD PRO A 79 -15.632 -0.885 -0.074 1.00 0.00 C ATOM 0 HA PRO A 79 -15.961 0.027 2.972 1.00 0.00 H new ATOM 0 HB2 PRO A 79 -15.071 -2.699 2.007 1.00 0.00 H new ATOM 0 HB3 PRO A 79 -16.579 -2.267 2.789 1.00 0.00 H new ATOM 0 HG2 PRO A 79 -16.602 -2.793 0.192 1.00 0.00 H new ATOM 0 HG3 PRO A 79 -17.535 -1.432 0.782 1.00 0.00 H new ATOM 0 HD2 PRO A 79 -14.796 -1.403 -0.543 1.00 0.00 H new ATOM 0 HD3 PRO A 79 -16.170 -0.366 -0.867 1.00 0.00 H new ATOM 1165 N HIS A 80 -13.931 -0.106 4.245 1.00 0.00 N ATOM 1166 CA HIS A 80 -12.705 -0.107 5.034 1.00 0.00 C ATOM 1167 C HIS A 80 -12.545 -1.413 5.804 1.00 0.00 C ATOM 1168 O HIS A 80 -12.448 -1.412 7.031 1.00 0.00 O ATOM 1169 CB HIS A 80 -12.689 1.073 6.011 1.00 0.00 C ATOM 1170 CG HIS A 80 -12.684 2.411 5.337 1.00 0.00 C ATOM 1171 ND1 HIS A 80 -12.844 3.593 6.031 1.00 0.00 N ATOM 1172 CD2 HIS A 80 -12.539 2.754 4.036 1.00 0.00 C ATOM 1173 CE1 HIS A 80 -12.798 4.606 5.182 1.00 0.00 C ATOM 1174 NE2 HIS A 80 -12.614 4.123 3.968 1.00 0.00 N ATOM 0 H HIS A 80 -14.735 0.310 4.716 1.00 0.00 H new ATOM 0 HA HIS A 80 -11.869 -0.008 4.341 1.00 0.00 H new ATOM 0 HB2 HIS A 80 -13.561 1.007 6.662 1.00 0.00 H new ATOM 0 HB3 HIS A 80 -11.809 0.994 6.649 1.00 0.00 H new ATOM 0 HD2 HIS A 80 -12.392 2.078 3.207 1.00 0.00 H new ATOM 0 HE1 HIS A 80 -12.895 5.651 5.439 1.00 0.00 H new ATOM 0 HE2 HIS A 80 -12.539 4.678 3.115 1.00 0.00 H new ATOM 1181 N ARG A 81 -12.519 -2.523 5.075 1.00 0.00 N ATOM 1182 CA ARG A 81 -12.360 -3.836 5.687 1.00 0.00 C ATOM 1183 C ARG A 81 -10.898 -4.123 6.002 1.00 0.00 C ATOM 1184 O ARG A 81 -10.057 -4.179 5.103 1.00 0.00 O ATOM 1185 CB ARG A 81 -12.899 -4.924 4.769 1.00 0.00 C ATOM 1186 CG ARG A 81 -12.828 -6.333 5.336 1.00 0.00 C ATOM 1187 CD ARG A 81 -13.339 -7.340 4.372 1.00 0.00 C ATOM 1188 NE ARG A 81 -14.765 -7.189 4.133 1.00 0.00 N ATOM 1189 CZ ARG A 81 -15.731 -7.688 4.929 1.00 0.00 C ATOM 1190 NH1 ARG A 81 -15.409 -8.367 6.007 1.00 0.00 N ATOM 1191 NH2 ARG A 81 -17.003 -7.495 4.625 1.00 0.00 N ATOM 0 H ARG A 81 -12.606 -2.539 4.059 1.00 0.00 H new ATOM 0 HA ARG A 81 -12.927 -3.833 6.618 1.00 0.00 H new ATOM 0 HB2 ARG A 81 -13.938 -4.696 4.530 1.00 0.00 H new ATOM 0 HB3 ARG A 81 -12.343 -4.897 3.832 1.00 0.00 H new ATOM 0 HG2 ARG A 81 -11.796 -6.569 5.596 1.00 0.00 H new ATOM 0 HG3 ARG A 81 -13.408 -6.384 6.257 1.00 0.00 H new ATOM 0 HD2 ARG A 81 -12.801 -7.245 3.429 1.00 0.00 H new ATOM 0 HD3 ARG A 81 -13.139 -8.341 4.753 1.00 0.00 H new ATOM 0 HE ARG A 81 -15.055 -6.669 3.305 1.00 0.00 H new ATOM 0 HH11 ARG A 81 -14.428 -8.516 6.241 1.00 0.00 H new ATOM 0 HH12 ARG A 81 -16.140 -8.745 6.609 1.00 0.00 H new ATOM 0 HH21 ARG A 81 -17.253 -6.968 3.788 1.00 0.00 H new ATOM 0 HH22 ARG A 81 -17.734 -7.873 5.227 1.00 0.00 H new ATOM 1205 N HIS A 82 -10.597 -4.304 7.284 1.00 0.00 N ATOM 1206 CA HIS A 82 -9.228 -4.543 7.725 1.00 0.00 C ATOM 1207 C HIS A 82 -8.989 -6.022 8.003 1.00 0.00 C ATOM 1208 O HIS A 82 -9.128 -6.480 9.137 1.00 0.00 O ATOM 1209 CB HIS A 82 -8.913 -3.724 8.981 1.00 0.00 C ATOM 1210 CG HIS A 82 -8.850 -2.248 8.735 1.00 0.00 C ATOM 1211 ND1 HIS A 82 -9.976 -1.452 8.701 1.00 0.00 N ATOM 1212 CD2 HIS A 82 -7.799 -1.425 8.513 1.00 0.00 C ATOM 1213 CE1 HIS A 82 -9.618 -0.200 8.468 1.00 0.00 C ATOM 1214 NE2 HIS A 82 -8.304 -0.159 8.350 1.00 0.00 N ATOM 0 H HIS A 82 -11.285 -4.290 8.037 1.00 0.00 H new ATOM 0 HA HIS A 82 -8.564 -4.230 6.919 1.00 0.00 H new ATOM 0 HB2 HIS A 82 -9.673 -3.926 9.736 1.00 0.00 H new ATOM 0 HB3 HIS A 82 -7.960 -4.056 9.392 1.00 0.00 H new ATOM 0 HD2 HIS A 82 -6.758 -1.711 8.472 1.00 0.00 H new ATOM 0 HE1 HIS A 82 -10.287 0.644 8.388 1.00 0.00 H new ATOM 0 HE2 HIS A 82 -7.752 0.679 8.167 1.00 0.00 H new ATOM 1221 N VAL A 83 -8.630 -6.764 6.962 1.00 0.00 N ATOM 1222 CA VAL A 83 -8.319 -8.182 7.102 1.00 0.00 C ATOM 1223 C VAL A 83 -6.941 -8.502 6.537 1.00 0.00 C ATOM 1224 O VAL A 83 -6.203 -7.604 6.128 1.00 0.00 O ATOM 1225 CB VAL A 83 -9.377 -9.035 6.379 1.00 0.00 C ATOM 1226 CG1 VAL A 83 -10.742 -8.853 7.026 1.00 0.00 C ATOM 1227 CG2 VAL A 83 -9.425 -8.661 4.905 1.00 0.00 C ATOM 0 H VAL A 83 -8.547 -6.407 6.010 1.00 0.00 H new ATOM 0 HA VAL A 83 -8.324 -8.418 8.166 1.00 0.00 H new ATOM 0 HB VAL A 83 -9.101 -10.086 6.463 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -11.477 -9.463 6.502 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -10.693 -9.160 8.071 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -11.034 -7.804 6.970 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -10.176 -9.269 4.400 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -9.684 -7.607 4.805 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -8.450 -8.839 4.452 1.00 0.00 H new ATOM 1237 N THR A 84 -6.598 -9.785 6.519 1.00 0.00 N ATOM 1238 CA THR A 84 -5.282 -10.220 6.066 1.00 0.00 C ATOM 1239 C THR A 84 -4.931 -9.602 4.719 1.00 0.00 C ATOM 1240 O THR A 84 -5.611 -9.840 3.721 1.00 0.00 O ATOM 1241 CB THR A 84 -5.210 -11.755 5.966 1.00 0.00 C ATOM 1242 OG1 THR A 84 -5.530 -12.335 7.238 1.00 0.00 O ATOM 1243 CG2 THR A 84 -3.816 -12.197 5.548 1.00 0.00 C ATOM 0 H THR A 84 -7.214 -10.543 6.813 1.00 0.00 H new ATOM 0 HA THR A 84 -4.557 -9.881 6.806 1.00 0.00 H new ATOM 0 HB THR A 84 -5.927 -12.089 5.216 1.00 0.00 H new ATOM 0 HG1 THR A 84 -4.770 -12.228 7.847 1.00 0.00 H new ATOM 0 HG21 THR A 84 -3.784 -13.285 5.482 1.00 0.00 H new ATOM 0 HG22 THR A 84 -3.574 -11.767 4.576 1.00 0.00 H new ATOM 0 HG23 THR A 84 -3.090 -11.856 6.286 1.00 0.00 H new ATOM 1251 N GLY A 85 -3.865 -8.809 4.697 1.00 0.00 N ATOM 1252 CA GLY A 85 -3.308 -8.308 3.447 1.00 0.00 C ATOM 1253 C GLY A 85 -3.695 -6.853 3.214 1.00 0.00 C ATOM 1254 O GLY A 85 -3.080 -6.158 2.406 1.00 0.00 O ATOM 0 H GLY A 85 -3.369 -8.499 5.533 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -2.222 -8.399 3.468 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -3.663 -8.919 2.617 1.00 0.00 H new ATOM 1258 N ALA A 86 -4.719 -6.398 3.929 1.00 0.00 N ATOM 1259 CA ALA A 86 -5.262 -5.060 3.723 1.00 0.00 C ATOM 1260 C ALA A 86 -4.233 -3.990 4.064 1.00 0.00 C ATOM 1261 O ALA A 86 -3.475 -4.127 5.023 1.00 0.00 O ATOM 1262 CB ALA A 86 -6.522 -4.866 4.555 1.00 0.00 C ATOM 0 H ALA A 86 -5.190 -6.936 4.656 1.00 0.00 H new ATOM 0 HA ALA A 86 -5.517 -4.959 2.668 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -6.916 -3.863 4.391 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -7.270 -5.602 4.260 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -6.284 -4.994 5.611 1.00 0.00 H new ATOM 1268 N MET A 87 -4.212 -2.923 3.272 1.00 0.00 N ATOM 1269 CA MET A 87 -3.353 -1.778 3.552 1.00 0.00 C ATOM 1270 C MET A 87 -4.177 -0.533 3.855 1.00 0.00 C ATOM 1271 O MET A 87 -5.056 -0.155 3.081 1.00 0.00 O ATOM 1272 CB MET A 87 -2.415 -1.522 2.374 1.00 0.00 C ATOM 1273 CG MET A 87 -1.512 -2.695 2.022 1.00 0.00 C ATOM 1274 SD MET A 87 -0.360 -2.310 0.688 1.00 0.00 S ATOM 1275 CE MET A 87 0.675 -1.082 1.478 1.00 0.00 C ATOM 0 H MET A 87 -4.780 -2.827 2.431 1.00 0.00 H new ATOM 0 HA MET A 87 -2.757 -2.009 4.435 1.00 0.00 H new ATOM 0 HB2 MET A 87 -3.012 -1.264 1.499 1.00 0.00 H new ATOM 0 HB3 MET A 87 -1.793 -0.656 2.602 1.00 0.00 H new ATOM 0 HG2 MET A 87 -0.950 -2.994 2.907 1.00 0.00 H new ATOM 0 HG3 MET A 87 -2.127 -3.547 1.731 1.00 0.00 H new ATOM 0 HE1 MET A 87 1.628 -1.017 0.953 1.00 0.00 H new ATOM 0 HE2 MET A 87 0.177 -0.113 1.448 1.00 0.00 H new ATOM 0 HE3 MET A 87 0.851 -1.367 2.515 1.00 0.00 H new ATOM 1285 N SER A 88 -3.889 0.099 4.988 1.00 0.00 N ATOM 1286 CA SER A 88 -4.696 1.213 5.471 1.00 0.00 C ATOM 1287 C SER A 88 -3.822 2.320 6.043 1.00 0.00 C ATOM 1288 O SER A 88 -2.840 2.054 6.736 1.00 0.00 O ATOM 1289 CB SER A 88 -5.672 0.730 6.527 1.00 0.00 C ATOM 1290 OG SER A 88 -6.446 1.790 7.017 1.00 0.00 O ATOM 0 H SER A 88 -3.101 -0.142 5.590 1.00 0.00 H new ATOM 0 HA SER A 88 -5.250 1.619 4.624 1.00 0.00 H new ATOM 0 HB2 SER A 88 -6.323 -0.035 6.103 1.00 0.00 H new ATOM 0 HB3 SER A 88 -5.125 0.265 7.347 1.00 0.00 H new ATOM 0 HG SER A 88 -7.355 1.726 6.656 1.00 0.00 H new ATOM 1296 N MET A 89 -4.184 3.564 5.750 1.00 0.00 N ATOM 1297 CA MET A 89 -3.449 4.716 6.259 1.00 0.00 C ATOM 1298 C MET A 89 -3.867 5.051 7.684 1.00 0.00 C ATOM 1299 O MET A 89 -5.017 4.840 8.070 1.00 0.00 O ATOM 1300 CB MET A 89 -3.659 5.922 5.344 1.00 0.00 C ATOM 1301 CG MET A 89 -3.047 5.775 3.958 1.00 0.00 C ATOM 1302 SD MET A 89 -1.257 5.556 4.008 1.00 0.00 S ATOM 1303 CE MET A 89 -0.732 7.180 4.545 1.00 0.00 C ATOM 0 H MET A 89 -4.983 3.801 5.162 1.00 0.00 H new ATOM 0 HA MET A 89 -2.389 4.462 6.273 1.00 0.00 H new ATOM 0 HB2 MET A 89 -4.729 6.100 5.238 1.00 0.00 H new ATOM 0 HB3 MET A 89 -3.235 6.804 5.823 1.00 0.00 H new ATOM 0 HG2 MET A 89 -3.500 4.921 3.454 1.00 0.00 H new ATOM 0 HG3 MET A 89 -3.285 6.658 3.365 1.00 0.00 H new ATOM 0 HE1 MET A 89 0.349 7.267 4.437 1.00 0.00 H new ATOM 0 HE2 MET A 89 -1.220 7.940 3.935 1.00 0.00 H new ATOM 0 HE3 MET A 89 -1.005 7.323 5.590 1.00 0.00 H new ATOM 1313 N ALA A 90 -2.927 5.574 8.464 1.00 0.00 N ATOM 1314 CA ALA A 90 -3.216 6.010 9.825 1.00 0.00 C ATOM 1315 C ALA A 90 -3.970 7.333 9.832 1.00 0.00 C ATOM 1316 O ALA A 90 -3.389 8.392 9.593 1.00 0.00 O ATOM 1317 CB ALA A 90 -1.928 6.131 10.627 1.00 0.00 C ATOM 0 H ALA A 90 -1.957 5.706 8.176 1.00 0.00 H new ATOM 0 HA ALA A 90 -3.852 5.258 10.291 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -2.160 6.457 11.641 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -1.429 5.162 10.663 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -1.271 6.860 10.153 1.00 0.00 H new ATOM 1323 N HIS A 91 -5.268 7.267 10.107 1.00 0.00 N ATOM 1324 CA HIS A 91 -6.118 8.452 10.086 1.00 0.00 C ATOM 1325 C HIS A 91 -6.755 8.697 11.447 1.00 0.00 C ATOM 1326 O HIS A 91 -7.011 7.760 12.202 1.00 0.00 O ATOM 1327 CB HIS A 91 -7.211 8.315 9.021 1.00 0.00 C ATOM 1328 CG HIS A 91 -6.697 8.392 7.617 1.00 0.00 C ATOM 1329 ND1 HIS A 91 -7.473 8.075 6.522 1.00 0.00 N ATOM 1330 CD2 HIS A 91 -5.485 8.746 7.129 1.00 0.00 C ATOM 1331 CE1 HIS A 91 -6.761 8.235 5.421 1.00 0.00 C ATOM 1332 NE2 HIS A 91 -5.551 8.640 5.762 1.00 0.00 N ATOM 0 H HIS A 91 -5.755 6.404 10.348 1.00 0.00 H new ATOM 0 HA HIS A 91 -5.486 9.305 9.840 1.00 0.00 H new ATOM 0 HB2 HIS A 91 -7.723 7.363 9.159 1.00 0.00 H new ATOM 0 HB3 HIS A 91 -7.952 9.100 9.171 1.00 0.00 H new ATOM 0 HD2 HIS A 91 -4.626 9.054 7.707 1.00 0.00 H new ATOM 0 HE1 HIS A 91 -7.109 8.064 4.413 1.00 0.00 H new ATOM 0 HE2 HIS A 91 -4.789 8.841 5.114 1.00 0.00 H new ATOM 1339 N ARG A 92 -7.009 9.965 11.755 1.00 0.00 N ATOM 1340 CA ARG A 92 -7.619 10.337 13.027 1.00 0.00 C ATOM 1341 C ARG A 92 -8.942 11.061 12.812 1.00 0.00 C ATOM 1342 O ARG A 92 -9.238 12.047 13.486 1.00 0.00 O ATOM 1343 CB ARG A 92 -6.682 11.228 13.830 1.00 0.00 C ATOM 1344 CG ARG A 92 -5.374 10.571 14.244 1.00 0.00 C ATOM 1345 CD ARG A 92 -4.514 11.503 15.017 1.00 0.00 C ATOM 1346 NE ARG A 92 -3.249 10.889 15.389 1.00 0.00 N ATOM 1347 CZ ARG A 92 -2.331 11.458 16.196 1.00 0.00 C ATOM 1348 NH1 ARG A 92 -2.552 12.649 16.705 1.00 0.00 N ATOM 1349 NH2 ARG A 92 -1.209 10.817 16.474 1.00 0.00 N ATOM 0 H ARG A 92 -6.802 10.753 11.141 1.00 0.00 H new ATOM 0 HA ARG A 92 -7.808 9.417 13.581 1.00 0.00 H new ATOM 0 HB2 ARG A 92 -6.455 12.117 13.241 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -7.203 11.564 14.727 1.00 0.00 H new ATOM 0 HG2 ARG A 92 -5.585 9.687 14.845 1.00 0.00 H new ATOM 0 HG3 ARG A 92 -4.839 10.233 13.356 1.00 0.00 H new ATOM 0 HD2 ARG A 92 -4.323 12.398 14.424 1.00 0.00 H new ATOM 0 HD3 ARG A 92 -5.041 11.823 15.916 1.00 0.00 H new ATOM 0 HE ARG A 92 -3.042 9.964 15.013 1.00 0.00 H new ATOM 0 HH11 ARG A 92 -3.418 13.143 16.490 1.00 0.00 H new ATOM 0 HH12 ARG A 92 -1.858 13.080 17.316 1.00 0.00 H new ATOM 0 HH21 ARG A 92 -1.038 9.893 16.078 1.00 0.00 H new ATOM 0 HH22 ARG A 92 -0.514 11.247 17.084 1.00 0.00 H new ATOM 1363 N GLY A 93 -9.736 10.564 11.869 1.00 0.00 N ATOM 1364 CA GLY A 93 -11.014 11.183 11.539 1.00 0.00 C ATOM 1365 C GLY A 93 -11.009 11.732 10.118 1.00 0.00 C ATOM 1366 O GLY A 93 -10.006 11.642 9.412 1.00 0.00 O ATOM 0 H GLY A 93 -9.516 9.733 11.319 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -11.814 10.451 11.646 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -11.223 11.989 12.242 1.00 0.00 H new ATOM 1370 N ARG A 94 -12.137 12.299 9.705 1.00 0.00 N ATOM 1371 CA ARG A 94 -12.258 12.885 8.375 1.00 0.00 C ATOM 1372 C ARG A 94 -11.333 14.084 8.215 1.00 0.00 C ATOM 1373 O ARG A 94 -11.073 14.812 9.173 1.00 0.00 O ATOM 1374 CB ARG A 94 -13.693 13.315 8.108 1.00 0.00 C ATOM 1375 CG ARG A 94 -14.176 14.486 8.950 1.00 0.00 C ATOM 1376 CD ARG A 94 -15.525 14.943 8.531 1.00 0.00 C ATOM 1377 NE ARG A 94 -16.013 16.030 9.365 1.00 0.00 N ATOM 1378 CZ ARG A 94 -15.696 17.328 9.193 1.00 0.00 C ATOM 1379 NH1 ARG A 94 -14.892 17.684 8.215 1.00 0.00 N ATOM 1380 NH2 ARG A 94 -16.193 18.244 10.007 1.00 0.00 N ATOM 0 H ARG A 94 -12.982 12.365 10.273 1.00 0.00 H new ATOM 0 HA ARG A 94 -11.969 12.121 7.653 1.00 0.00 H new ATOM 0 HB2 ARG A 94 -13.788 13.580 7.055 1.00 0.00 H new ATOM 0 HB3 ARG A 94 -14.351 12.464 8.283 1.00 0.00 H new ATOM 0 HG2 ARG A 94 -14.200 14.194 10.000 1.00 0.00 H new ATOM 0 HG3 ARG A 94 -13.469 15.311 8.865 1.00 0.00 H new ATOM 0 HD2 ARG A 94 -15.491 15.270 7.492 1.00 0.00 H new ATOM 0 HD3 ARG A 94 -16.223 14.107 8.579 1.00 0.00 H new ATOM 0 HE ARG A 94 -16.639 15.793 10.134 1.00 0.00 H new ATOM 0 HH11 ARG A 94 -14.509 16.977 7.587 1.00 0.00 H new ATOM 0 HH12 ARG A 94 -14.652 18.667 8.084 1.00 0.00 H new ATOM 0 HH21 ARG A 94 -16.817 17.968 10.765 1.00 0.00 H new ATOM 0 HH22 ARG A 94 -15.953 19.227 9.876 1.00 0.00 H new ATOM 1394 N ASP A 95 -10.837 14.284 6.999 1.00 0.00 N ATOM 1395 CA ASP A 95 -9.983 15.427 6.698 1.00 0.00 C ATOM 1396 C ASP A 95 -8.805 15.502 7.662 1.00 0.00 C ATOM 1397 O ASP A 95 -8.304 16.586 7.961 1.00 0.00 O ATOM 1398 CB ASP A 95 -10.784 16.729 6.761 1.00 0.00 C ATOM 1399 CG ASP A 95 -11.945 16.757 5.775 1.00 0.00 C ATOM 1400 OD1 ASP A 95 -11.712 16.551 4.608 1.00 0.00 O ATOM 1401 OD2 ASP A 95 -13.053 16.986 6.199 1.00 0.00 O ATOM 0 H ASP A 95 -11.012 13.668 6.205 1.00 0.00 H new ATOM 0 HA ASP A 95 -9.597 15.293 5.687 1.00 0.00 H new ATOM 0 HB2 ASP A 95 -11.169 16.865 7.772 1.00 0.00 H new ATOM 0 HB3 ASP A 95 -10.120 17.569 6.557 1.00 0.00 H new ATOM 1406 N THR A 96 -8.368 14.344 8.146 1.00 0.00 N ATOM 1407 CA THR A 96 -7.315 14.283 9.152 1.00 0.00 C ATOM 1408 C THR A 96 -6.509 12.996 9.028 1.00 0.00 C ATOM 1409 O THR A 96 -6.742 12.034 9.760 1.00 0.00 O ATOM 1410 CB THR A 96 -7.898 14.393 10.572 1.00 0.00 C ATOM 1411 OG1 THR A 96 -8.735 15.554 10.660 1.00 0.00 O ATOM 1412 CG2 THR A 96 -6.783 14.498 11.601 1.00 0.00 C ATOM 0 H THR A 96 -8.728 13.434 7.857 1.00 0.00 H new ATOM 0 HA THR A 96 -6.652 15.130 8.977 1.00 0.00 H new ATOM 0 HB THR A 96 -8.484 13.497 10.777 1.00 0.00 H new ATOM 0 HG1 THR A 96 -9.595 15.371 10.227 1.00 0.00 H new ATOM 0 HG21 THR A 96 -7.215 14.575 12.599 1.00 0.00 H new ATOM 0 HG22 THR A 96 -6.152 13.611 11.546 1.00 0.00 H new ATOM 0 HG23 THR A 96 -6.182 15.384 11.397 1.00 0.00 H new ATOM 1420 N GLY A 97 -5.560 12.985 8.098 1.00 0.00 N ATOM 1421 CA GLY A 97 -4.708 11.821 7.886 1.00 0.00 C ATOM 1422 C GLY A 97 -3.248 12.147 8.176 1.00 0.00 C ATOM 1423 O GLY A 97 -2.833 13.304 8.094 1.00 0.00 O ATOM 0 H GLY A 97 -5.361 13.770 7.478 1.00 0.00 H new ATOM 0 HA2 GLY A 97 -5.036 11.005 8.530 1.00 0.00 H new ATOM 0 HA3 GLY A 97 -4.809 11.476 6.857 1.00 0.00 H new ATOM 1427 N SER A 98 -2.474 11.122 8.513 1.00 0.00 N ATOM 1428 CA SER A 98 -1.039 11.281 8.721 1.00 0.00 C ATOM 1429 C SER A 98 -0.245 10.687 7.564 1.00 0.00 C ATOM 1430 O SER A 98 -0.820 10.197 6.593 1.00 0.00 O ATOM 1431 CB SER A 98 -0.624 10.622 10.022 1.00 0.00 C ATOM 1432 OG SER A 98 -0.572 9.229 9.885 1.00 0.00 O ATOM 0 H SER A 98 -2.816 10.171 8.648 1.00 0.00 H new ATOM 0 HA SER A 98 -0.823 12.348 8.771 1.00 0.00 H new ATOM 0 HB2 SER A 98 0.352 10.997 10.329 1.00 0.00 H new ATOM 0 HB3 SER A 98 -1.329 10.887 10.809 1.00 0.00 H new ATOM 0 HG SER A 98 -1.469 8.886 9.689 1.00 0.00 H new ATOM 1438 N CYS A 99 1.078 10.735 7.676 1.00 0.00 N ATOM 1439 CA CYS A 99 1.952 10.144 6.670 1.00 0.00 C ATOM 1440 C CYS A 99 2.252 8.685 6.988 1.00 0.00 C ATOM 1441 O CYS A 99 2.957 8.008 6.240 1.00 0.00 O ATOM 1442 CB CYS A 99 3.266 10.920 6.577 1.00 0.00 C ATOM 1443 SG CYS A 99 4.235 10.918 8.104 1.00 0.00 S ATOM 0 H CYS A 99 1.568 11.177 8.453 1.00 0.00 H new ATOM 0 HA CYS A 99 1.431 10.195 5.714 1.00 0.00 H new ATOM 0 HB2 CYS A 99 3.870 10.495 5.775 1.00 0.00 H new ATOM 0 HB3 CYS A 99 3.048 11.951 6.299 1.00 0.00 H new ATOM 0 HG CYS A 99 4.436 9.693 8.489 1.00 0.00 H new ATOM 1449 N GLN A 100 1.712 8.205 8.103 1.00 0.00 N ATOM 1450 CA GLN A 100 1.965 6.841 8.552 1.00 0.00 C ATOM 1451 C GLN A 100 0.930 5.876 7.990 1.00 0.00 C ATOM 1452 O GLN A 100 -0.217 6.253 7.746 1.00 0.00 O ATOM 1453 CB GLN A 100 1.969 6.771 10.081 1.00 0.00 C ATOM 1454 CG GLN A 100 3.154 7.462 10.733 1.00 0.00 C ATOM 1455 CD GLN A 100 3.115 7.374 12.247 1.00 0.00 C ATOM 1456 OE1 GLN A 100 2.549 8.243 12.917 1.00 0.00 O ATOM 1457 NE2 GLN A 100 3.716 6.324 12.794 1.00 0.00 N ATOM 0 H GLN A 100 1.095 8.741 8.713 1.00 0.00 H new ATOM 0 HA GLN A 100 2.946 6.546 8.181 1.00 0.00 H new ATOM 0 HB2 GLN A 100 1.049 7.220 10.456 1.00 0.00 H new ATOM 0 HB3 GLN A 100 1.960 5.724 10.386 1.00 0.00 H new ATOM 0 HG2 GLN A 100 4.078 7.012 10.370 1.00 0.00 H new ATOM 0 HG3 GLN A 100 3.170 8.510 10.433 1.00 0.00 H new ATOM 0 HE21 GLN A 100 4.171 5.631 12.201 1.00 0.00 H new ATOM 0 HE22 GLN A 100 3.722 6.211 13.808 1.00 0.00 H new ATOM 1466 N PHE A 101 1.340 4.629 7.785 1.00 0.00 N ATOM 1467 CA PHE A 101 0.425 3.583 7.342 1.00 0.00 C ATOM 1468 C PHE A 101 0.687 2.274 8.075 1.00 0.00 C ATOM 1469 O PHE A 101 1.685 2.137 8.783 1.00 0.00 O ATOM 1470 CB PHE A 101 0.555 3.364 5.833 1.00 0.00 C ATOM 1471 CG PHE A 101 1.829 2.679 5.428 1.00 0.00 C ATOM 1472 CD1 PHE A 101 3.007 3.397 5.289 1.00 0.00 C ATOM 1473 CD2 PHE A 101 1.852 1.313 5.186 1.00 0.00 C ATOM 1474 CE1 PHE A 101 4.179 2.769 4.915 1.00 0.00 C ATOM 1475 CE2 PHE A 101 3.023 0.682 4.813 1.00 0.00 C ATOM 1476 CZ PHE A 101 4.187 1.409 4.678 1.00 0.00 C ATOM 0 H PHE A 101 2.302 4.317 7.919 1.00 0.00 H new ATOM 0 HA PHE A 101 -0.589 3.910 7.572 1.00 0.00 H new ATOM 0 HB2 PHE A 101 -0.291 2.771 5.487 1.00 0.00 H new ATOM 0 HB3 PHE A 101 0.496 4.329 5.329 1.00 0.00 H new ATOM 0 HD1 PHE A 101 3.008 4.461 5.476 1.00 0.00 H new ATOM 0 HD2 PHE A 101 0.945 0.737 5.290 1.00 0.00 H new ATOM 0 HE1 PHE A 101 5.088 3.342 4.808 1.00 0.00 H new ATOM 0 HE2 PHE A 101 3.027 -0.382 4.627 1.00 0.00 H new ATOM 0 HZ PHE A 101 5.103 0.916 4.388 1.00 0.00 H new ATOM 1486 N PHE A 102 -0.214 1.313 7.901 1.00 0.00 N ATOM 1487 CA PHE A 102 -0.055 -0.005 8.503 1.00 0.00 C ATOM 1488 C PHE A 102 -0.689 -1.086 7.636 1.00 0.00 C ATOM 1489 O PHE A 102 -1.683 -0.843 6.953 1.00 0.00 O ATOM 1490 CB PHE A 102 -0.677 -0.033 9.900 1.00 0.00 C ATOM 1491 CG PHE A 102 -2.153 0.249 9.912 1.00 0.00 C ATOM 1492 CD1 PHE A 102 -2.624 1.550 10.002 1.00 0.00 C ATOM 1493 CD2 PHE A 102 -3.072 -0.786 9.831 1.00 0.00 C ATOM 1494 CE1 PHE A 102 -3.981 1.810 10.015 1.00 0.00 C ATOM 1495 CE2 PHE A 102 -4.430 -0.528 9.841 1.00 0.00 C ATOM 1496 CZ PHE A 102 -4.884 0.770 9.934 1.00 0.00 C ATOM 0 H PHE A 102 -1.063 1.423 7.347 1.00 0.00 H new ATOM 0 HA PHE A 102 1.013 -0.207 8.582 1.00 0.00 H new ATOM 0 HB2 PHE A 102 -0.500 -1.011 10.347 1.00 0.00 H new ATOM 0 HB3 PHE A 102 -0.171 0.701 10.528 1.00 0.00 H new ATOM 0 HD1 PHE A 102 -1.923 2.369 10.063 1.00 0.00 H new ATOM 0 HD2 PHE A 102 -2.723 -1.805 9.759 1.00 0.00 H new ATOM 0 HE1 PHE A 102 -4.335 2.828 10.089 1.00 0.00 H new ATOM 0 HE2 PHE A 102 -5.135 -1.343 9.776 1.00 0.00 H new ATOM 0 HZ PHE A 102 -5.945 0.973 9.943 1.00 0.00 H new ATOM 1506 N ILE A 103 -0.107 -2.280 7.669 1.00 0.00 N ATOM 1507 CA ILE A 103 -0.658 -3.420 6.948 1.00 0.00 C ATOM 1508 C ILE A 103 -1.239 -4.451 7.907 1.00 0.00 C ATOM 1509 O ILE A 103 -0.594 -4.839 8.882 1.00 0.00 O ATOM 1510 CB ILE A 103 0.417 -4.085 6.068 1.00 0.00 C ATOM 1511 CG1 ILE A 103 1.032 -3.061 5.111 1.00 0.00 C ATOM 1512 CG2 ILE A 103 -0.175 -5.253 5.295 1.00 0.00 C ATOM 1513 CD1 ILE A 103 2.250 -3.569 4.374 1.00 0.00 C ATOM 0 H ILE A 103 0.747 -2.483 8.188 1.00 0.00 H new ATOM 0 HA ILE A 103 -1.458 -3.044 6.311 1.00 0.00 H new ATOM 0 HB ILE A 103 1.206 -4.468 6.715 1.00 0.00 H new ATOM 0 HG12 ILE A 103 0.278 -2.759 4.384 1.00 0.00 H new ATOM 0 HG13 ILE A 103 1.306 -2.169 5.675 1.00 0.00 H new ATOM 0 HG21 ILE A 103 0.599 -5.711 4.679 1.00 0.00 H new ATOM 0 HG22 ILE A 103 -0.566 -5.992 5.995 1.00 0.00 H new ATOM 0 HG23 ILE A 103 -0.983 -4.895 4.657 1.00 0.00 H new ATOM 0 HD11 ILE A 103 2.629 -2.787 3.715 1.00 0.00 H new ATOM 0 HD12 ILE A 103 3.022 -3.844 5.093 1.00 0.00 H new ATOM 0 HD13 ILE A 103 1.979 -4.443 3.781 1.00 0.00 H new ATOM 1525 N VAL A 104 -2.460 -4.892 7.625 1.00 0.00 N ATOM 1526 CA VAL A 104 -3.175 -5.794 8.520 1.00 0.00 C ATOM 1527 C VAL A 104 -2.800 -7.247 8.255 1.00 0.00 C ATOM 1528 O VAL A 104 -2.733 -7.679 7.104 1.00 0.00 O ATOM 1529 CB VAL A 104 -4.696 -5.621 8.351 1.00 0.00 C ATOM 1530 CG1 VAL A 104 -5.446 -6.582 9.260 1.00 0.00 C ATOM 1531 CG2 VAL A 104 -5.089 -4.181 8.647 1.00 0.00 C ATOM 0 H VAL A 104 -2.976 -4.639 6.782 1.00 0.00 H new ATOM 0 HA VAL A 104 -2.889 -5.541 9.541 1.00 0.00 H new ATOM 0 HB VAL A 104 -4.966 -5.852 7.320 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -6.519 -6.446 9.127 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -5.176 -7.607 9.007 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -5.181 -6.383 10.298 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -6.166 -4.065 8.526 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -4.810 -3.931 9.671 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -4.573 -3.514 7.957 1.00 0.00 H new ATOM 1541 N HIS A 105 -2.556 -7.994 9.325 1.00 0.00 N ATOM 1542 CA HIS A 105 -2.090 -9.371 9.207 1.00 0.00 C ATOM 1543 C HIS A 105 -3.244 -10.356 9.341 1.00 0.00 C ATOM 1544 O HIS A 105 -3.282 -11.380 8.658 1.00 0.00 O ATOM 1545 CB HIS A 105 -1.026 -9.675 10.267 1.00 0.00 C ATOM 1546 CG HIS A 105 0.168 -8.774 10.197 1.00 0.00 C ATOM 1547 ND1 HIS A 105 1.138 -8.747 11.177 1.00 0.00 N ATOM 1548 CD2 HIS A 105 0.546 -7.867 9.266 1.00 0.00 C ATOM 1549 CE1 HIS A 105 2.064 -7.862 10.850 1.00 0.00 C ATOM 1550 NE2 HIS A 105 1.728 -7.315 9.696 1.00 0.00 N ATOM 0 H HIS A 105 -2.673 -7.669 10.285 1.00 0.00 H new ATOM 0 HA HIS A 105 -1.649 -9.485 8.217 1.00 0.00 H new ATOM 0 HB2 HIS A 105 -1.476 -9.590 11.256 1.00 0.00 H new ATOM 0 HB3 HIS A 105 -0.698 -10.708 10.154 1.00 0.00 H new ATOM 0 HD2 HIS A 105 0.018 -7.623 8.356 1.00 0.00 H new ATOM 0 HE1 HIS A 105 2.945 -7.626 11.428 1.00 0.00 H new ATOM 0 HE2 HIS A 105 2.260 -6.598 9.203 1.00 0.00 H new ATOM 1557 N GLU A 106 -4.185 -10.042 10.225 1.00 0.00 N ATOM 1558 CA GLU A 106 -5.338 -10.903 10.456 1.00 0.00 C ATOM 1559 C GLU A 106 -6.631 -10.098 10.479 1.00 0.00 C ATOM 1560 O GLU A 106 -6.619 -8.893 10.732 1.00 0.00 O ATOM 1561 CB GLU A 106 -5.179 -11.667 11.772 1.00 0.00 C ATOM 1562 CG GLU A 106 -3.974 -12.596 11.818 1.00 0.00 C ATOM 1563 CD GLU A 106 -4.088 -13.749 10.859 1.00 0.00 C ATOM 1564 OE1 GLU A 106 -5.143 -14.332 10.783 1.00 0.00 O ATOM 1565 OE2 GLU A 106 -3.119 -14.046 10.202 1.00 0.00 O ATOM 0 H GLU A 106 -4.171 -9.196 10.794 1.00 0.00 H new ATOM 0 HA GLU A 106 -5.391 -11.615 9.633 1.00 0.00 H new ATOM 0 HB2 GLU A 106 -5.100 -10.949 12.588 1.00 0.00 H new ATOM 0 HB3 GLU A 106 -6.081 -12.253 11.949 1.00 0.00 H new ATOM 0 HG2 GLU A 106 -3.073 -12.027 11.588 1.00 0.00 H new ATOM 0 HG3 GLU A 106 -3.858 -12.982 12.831 1.00 0.00 H new ATOM 1572 N PRO A 107 -7.745 -10.771 10.213 1.00 0.00 N ATOM 1573 CA PRO A 107 -9.059 -10.141 10.293 1.00 0.00 C ATOM 1574 C PRO A 107 -9.250 -9.434 11.628 1.00 0.00 C ATOM 1575 O PRO A 107 -9.159 -10.053 12.688 1.00 0.00 O ATOM 1576 CB PRO A 107 -10.019 -11.326 10.138 1.00 0.00 C ATOM 1577 CG PRO A 107 -9.256 -12.310 9.319 1.00 0.00 C ATOM 1578 CD PRO A 107 -7.840 -12.197 9.819 1.00 0.00 C ATOM 0 HA PRO A 107 -9.214 -9.368 9.540 1.00 0.00 H new ATOM 0 HB2 PRO A 107 -10.296 -11.743 11.106 1.00 0.00 H new ATOM 0 HB3 PRO A 107 -10.943 -11.028 9.643 1.00 0.00 H new ATOM 0 HG2 PRO A 107 -9.644 -13.320 9.449 1.00 0.00 H new ATOM 0 HG3 PRO A 107 -9.322 -12.078 8.256 1.00 0.00 H new ATOM 0 HD2 PRO A 107 -7.654 -12.863 10.662 1.00 0.00 H new ATOM 0 HD3 PRO A 107 -7.116 -12.452 9.045 1.00 0.00 H new ATOM 1586 N GLN A 108 -9.513 -8.133 11.569 1.00 0.00 N ATOM 1587 CA GLN A 108 -9.762 -7.347 12.772 1.00 0.00 C ATOM 1588 C GLN A 108 -11.062 -6.562 12.658 1.00 0.00 C ATOM 1589 O GLN A 108 -11.073 -5.424 12.190 1.00 0.00 O ATOM 1590 CB GLN A 108 -8.596 -6.391 13.038 1.00 0.00 C ATOM 1591 CG GLN A 108 -7.295 -7.083 13.406 1.00 0.00 C ATOM 1592 CD GLN A 108 -7.372 -7.786 14.749 1.00 0.00 C ATOM 1593 OE1 GLN A 108 -7.879 -7.231 15.727 1.00 0.00 O ATOM 1594 NE2 GLN A 108 -6.869 -9.014 14.803 1.00 0.00 N ATOM 0 H GLN A 108 -9.559 -7.600 10.700 1.00 0.00 H new ATOM 0 HA GLN A 108 -9.853 -8.040 13.609 1.00 0.00 H new ATOM 0 HB2 GLN A 108 -8.431 -5.781 12.150 1.00 0.00 H new ATOM 0 HB3 GLN A 108 -8.874 -5.712 13.844 1.00 0.00 H new ATOM 0 HG2 GLN A 108 -7.042 -7.809 12.633 1.00 0.00 H new ATOM 0 HG3 GLN A 108 -6.490 -6.348 13.429 1.00 0.00 H new ATOM 0 HE21 GLN A 108 -6.459 -9.434 13.969 1.00 0.00 H new ATOM 0 HE22 GLN A 108 -6.893 -9.537 15.679 1.00 0.00 H new ATOM 1603 N PRO A 109 -12.158 -7.177 13.090 1.00 0.00 N ATOM 1604 CA PRO A 109 -13.464 -6.530 13.053 1.00 0.00 C ATOM 1605 C PRO A 109 -13.438 -5.192 13.781 1.00 0.00 C ATOM 1606 O PRO A 109 -14.177 -4.271 13.433 1.00 0.00 O ATOM 1607 CB PRO A 109 -14.370 -7.542 13.762 1.00 0.00 C ATOM 1608 CG PRO A 109 -13.715 -8.857 13.513 1.00 0.00 C ATOM 1609 CD PRO A 109 -12.240 -8.562 13.594 1.00 0.00 C ATOM 0 HA PRO A 109 -13.800 -6.294 12.043 1.00 0.00 H new ATOM 0 HB2 PRO A 109 -14.445 -7.330 14.829 1.00 0.00 H new ATOM 0 HB3 PRO A 109 -15.383 -7.519 13.360 1.00 0.00 H new ATOM 0 HG2 PRO A 109 -14.014 -9.597 14.256 1.00 0.00 H new ATOM 0 HG3 PRO A 109 -13.987 -9.258 12.537 1.00 0.00 H new ATOM 0 HD2 PRO A 109 -11.866 -8.644 14.615 1.00 0.00 H new ATOM 0 HD3 PRO A 109 -11.655 -9.250 12.984 1.00 0.00 H new ATOM 1617 N HIS A 110 -12.583 -5.092 14.793 1.00 0.00 N ATOM 1618 CA HIS A 110 -12.531 -3.904 15.637 1.00 0.00 C ATOM 1619 C HIS A 110 -11.828 -2.755 14.925 1.00 0.00 C ATOM 1620 O HIS A 110 -11.974 -1.593 15.307 1.00 0.00 O ATOM 1621 CB HIS A 110 -11.816 -4.209 16.957 1.00 0.00 C ATOM 1622 CG HIS A 110 -12.555 -5.173 17.833 1.00 0.00 C ATOM 1623 ND1 HIS A 110 -13.716 -4.836 18.495 1.00 0.00 N ATOM 1624 CD2 HIS A 110 -12.297 -6.463 18.154 1.00 0.00 C ATOM 1625 CE1 HIS A 110 -14.142 -5.878 19.188 1.00 0.00 C ATOM 1626 NE2 HIS A 110 -13.299 -6.877 18.998 1.00 0.00 N ATOM 0 H HIS A 110 -11.916 -5.820 15.049 1.00 0.00 H new ATOM 0 HA HIS A 110 -13.558 -3.605 15.849 1.00 0.00 H new ATOM 0 HB2 HIS A 110 -10.828 -4.614 16.740 1.00 0.00 H new ATOM 0 HB3 HIS A 110 -11.666 -3.277 17.503 1.00 0.00 H new ATOM 0 HD2 HIS A 110 -11.461 -7.055 17.811 1.00 0.00 H new ATOM 0 HE1 HIS A 110 -15.028 -5.907 19.804 1.00 0.00 H new ATOM 0 HE2 HIS A 110 -13.379 -7.806 19.411 1.00 0.00 H new ATOM 1633 N LEU A 111 -11.063 -3.085 13.890 1.00 0.00 N ATOM 1634 CA LEU A 111 -10.362 -2.078 13.104 1.00 0.00 C ATOM 1635 C LEU A 111 -11.201 -1.623 11.917 1.00 0.00 C ATOM 1636 O LEU A 111 -10.923 -0.590 11.307 1.00 0.00 O ATOM 1637 CB LEU A 111 -9.022 -2.634 12.606 1.00 0.00 C ATOM 1638 CG LEU A 111 -7.817 -2.390 13.525 1.00 0.00 C ATOM 1639 CD1 LEU A 111 -8.132 -2.908 14.922 1.00 0.00 C ATOM 1640 CD2 LEU A 111 -6.590 -3.081 12.949 1.00 0.00 C ATOM 0 H LEU A 111 -10.913 -4.044 13.576 1.00 0.00 H new ATOM 0 HA LEU A 111 -10.181 -1.217 13.748 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -9.129 -3.708 12.455 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -8.807 -2.195 11.632 1.00 0.00 H new ATOM 0 HG LEU A 111 -7.609 -1.322 13.592 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -7.277 -2.735 15.575 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -9.002 -2.384 15.317 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -8.343 -3.976 14.875 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -5.735 -2.907 13.602 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -6.777 -4.152 12.874 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -6.378 -2.679 11.958 1.00 0.00 H new ATOM 1652 N ASP A 112 -12.231 -2.398 11.594 1.00 0.00 N ATOM 1653 CA ASP A 112 -13.058 -2.127 10.425 1.00 0.00 C ATOM 1654 C ASP A 112 -13.746 -0.772 10.538 1.00 0.00 C ATOM 1655 O ASP A 112 -14.419 -0.488 11.528 1.00 0.00 O ATOM 1656 CB ASP A 112 -14.108 -3.225 10.243 1.00 0.00 C ATOM 1657 CG ASP A 112 -13.507 -4.549 9.791 1.00 0.00 C ATOM 1658 OD1 ASP A 112 -12.330 -4.585 9.521 1.00 0.00 O ATOM 1659 OD2 ASP A 112 -14.232 -5.514 9.720 1.00 0.00 O ATOM 0 H ASP A 112 -12.513 -3.221 12.127 1.00 0.00 H new ATOM 0 HA ASP A 112 -12.402 -2.110 9.554 1.00 0.00 H new ATOM 0 HB2 ASP A 112 -14.637 -3.374 11.184 1.00 0.00 H new ATOM 0 HB3 ASP A 112 -14.846 -2.898 9.511 1.00 0.00 H new ATOM 1664 N GLY A 113 -13.572 0.061 9.518 1.00 0.00 N ATOM 1665 CA GLY A 113 -14.271 1.338 9.444 1.00 0.00 C ATOM 1666 C GLY A 113 -13.582 2.393 10.301 1.00 0.00 C ATOM 1667 O GLY A 113 -14.063 3.519 10.422 1.00 0.00 O ATOM 0 H GLY A 113 -12.952 -0.126 8.730 1.00 0.00 H new ATOM 0 HA2 GLY A 113 -14.309 1.675 8.408 1.00 0.00 H new ATOM 0 HA3 GLY A 113 -15.301 1.212 9.776 1.00 0.00 H new ATOM 1671 N VAL A 114 -12.453 2.021 10.894 1.00 0.00 N ATOM 1672 CA VAL A 114 -11.697 2.933 11.744 1.00 0.00 C ATOM 1673 C VAL A 114 -10.716 3.762 10.925 1.00 0.00 C ATOM 1674 O VAL A 114 -10.664 4.986 11.054 1.00 0.00 O ATOM 1675 CB VAL A 114 -10.926 2.146 12.819 1.00 0.00 C ATOM 1676 CG1 VAL A 114 -10.068 3.085 13.654 1.00 0.00 C ATOM 1677 CG2 VAL A 114 -11.902 1.380 13.701 1.00 0.00 C ATOM 0 H VAL A 114 -12.041 1.093 10.801 1.00 0.00 H new ATOM 0 HA VAL A 114 -12.408 3.606 12.223 1.00 0.00 H new ATOM 0 HB VAL A 114 -10.265 1.432 12.328 1.00 0.00 H new ATOM 0 HG11 VAL A 114 -9.530 2.512 14.409 1.00 0.00 H new ATOM 0 HG12 VAL A 114 -9.353 3.596 13.009 1.00 0.00 H new ATOM 0 HG13 VAL A 114 -10.705 3.821 14.144 1.00 0.00 H new ATOM 0 HG21 VAL A 114 -11.349 0.826 14.459 1.00 0.00 H new ATOM 0 HG22 VAL A 114 -12.581 2.081 14.187 1.00 0.00 H new ATOM 0 HG23 VAL A 114 -12.476 0.684 13.089 1.00 0.00 H new ATOM 1687 N HIS A 115 -9.939 3.090 10.083 1.00 0.00 N ATOM 1688 CA HIS A 115 -9.007 3.769 9.191 1.00 0.00 C ATOM 1689 C HIS A 115 -9.391 3.562 7.731 1.00 0.00 C ATOM 1690 O HIS A 115 -10.283 2.772 7.420 1.00 0.00 O ATOM 1691 CB HIS A 115 -7.576 3.275 9.424 1.00 0.00 C ATOM 1692 CG HIS A 115 -7.045 3.591 10.787 1.00 0.00 C ATOM 1693 ND1 HIS A 115 -6.504 4.819 11.108 1.00 0.00 N ATOM 1694 CD2 HIS A 115 -6.970 2.842 11.911 1.00 0.00 C ATOM 1695 CE1 HIS A 115 -6.121 4.810 12.374 1.00 0.00 C ATOM 1696 NE2 HIS A 115 -6.392 3.622 12.882 1.00 0.00 N ATOM 0 H HIS A 115 -9.936 2.073 10.000 1.00 0.00 H new ATOM 0 HA HIS A 115 -9.057 4.835 9.415 1.00 0.00 H new ATOM 0 HB2 HIS A 115 -7.544 2.196 9.273 1.00 0.00 H new ATOM 0 HB3 HIS A 115 -6.921 3.721 8.676 1.00 0.00 H new ATOM 0 HD2 HIS A 115 -7.303 1.821 12.024 1.00 0.00 H new ATOM 0 HE1 HIS A 115 -5.664 5.634 12.902 1.00 0.00 H new ATOM 0 HE2 HIS A 115 -6.203 3.331 13.841 1.00 0.00 H new ATOM 1703 N THR A 116 -8.712 4.275 6.839 1.00 0.00 N ATOM 1704 CA THR A 116 -9.033 4.229 5.417 1.00 0.00 C ATOM 1705 C THR A 116 -8.169 3.206 4.691 1.00 0.00 C ATOM 1706 O THR A 116 -6.966 3.405 4.521 1.00 0.00 O ATOM 1707 CB THR A 116 -8.856 5.613 4.764 1.00 0.00 C ATOM 1708 OG1 THR A 116 -9.669 6.575 5.450 1.00 0.00 O ATOM 1709 CG2 THR A 116 -9.261 5.566 3.299 1.00 0.00 C ATOM 0 H THR A 116 -7.935 4.892 7.076 1.00 0.00 H new ATOM 0 HA THR A 116 -10.078 3.930 5.331 1.00 0.00 H new ATOM 0 HB THR A 116 -7.806 5.899 4.832 1.00 0.00 H new ATOM 0 HG1 THR A 116 -9.094 7.238 5.886 1.00 0.00 H new ATOM 0 HG21 THR A 116 -9.130 6.552 2.853 1.00 0.00 H new ATOM 0 HG22 THR A 116 -8.637 4.844 2.772 1.00 0.00 H new ATOM 0 HG23 THR A 116 -10.307 5.269 3.220 1.00 0.00 H new ATOM 1717 N VAL A 117 -8.789 2.112 4.264 1.00 0.00 N ATOM 1718 CA VAL A 117 -8.122 1.136 3.411 1.00 0.00 C ATOM 1719 C VAL A 117 -7.997 1.649 1.982 1.00 0.00 C ATOM 1720 O VAL A 117 -8.960 2.160 1.409 1.00 0.00 O ATOM 1721 CB VAL A 117 -8.899 -0.194 3.411 1.00 0.00 C ATOM 1722 CG1 VAL A 117 -8.260 -1.183 2.448 1.00 0.00 C ATOM 1723 CG2 VAL A 117 -8.947 -0.765 4.819 1.00 0.00 C ATOM 0 H VAL A 117 -9.755 1.878 4.495 1.00 0.00 H new ATOM 0 HA VAL A 117 -7.122 0.974 3.812 1.00 0.00 H new ATOM 0 HB VAL A 117 -9.920 -0.008 3.076 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -8.821 -2.117 2.460 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -8.269 -0.767 1.440 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -7.231 -1.374 2.752 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -9.498 -1.705 4.812 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -7.932 -0.942 5.175 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -9.446 -0.058 5.482 1.00 0.00 H new ATOM 1733 N PHE A 118 -6.807 1.507 1.410 1.00 0.00 N ATOM 1734 CA PHE A 118 -6.474 2.176 0.157 1.00 0.00 C ATOM 1735 C PHE A 118 -5.803 1.216 -0.817 1.00 0.00 C ATOM 1736 O PHE A 118 -5.708 1.495 -2.013 1.00 0.00 O ATOM 1737 CB PHE A 118 -5.557 3.372 0.416 1.00 0.00 C ATOM 1738 CG PHE A 118 -4.177 2.991 0.869 1.00 0.00 C ATOM 1739 CD1 PHE A 118 -3.918 2.722 2.204 1.00 0.00 C ATOM 1740 CD2 PHE A 118 -3.133 2.899 -0.041 1.00 0.00 C ATOM 1741 CE1 PHE A 118 -2.648 2.372 2.622 1.00 0.00 C ATOM 1742 CE2 PHE A 118 -1.862 2.548 0.374 1.00 0.00 C ATOM 1743 CZ PHE A 118 -1.620 2.284 1.706 1.00 0.00 C ATOM 0 H PHE A 118 -6.056 0.934 1.794 1.00 0.00 H new ATOM 0 HA PHE A 118 -7.405 2.527 -0.289 1.00 0.00 H new ATOM 0 HB2 PHE A 118 -5.479 3.963 -0.497 1.00 0.00 H new ATOM 0 HB3 PHE A 118 -6.014 4.011 1.172 1.00 0.00 H new ATOM 0 HD1 PHE A 118 -4.718 2.787 2.926 1.00 0.00 H new ATOM 0 HD2 PHE A 118 -3.316 3.104 -1.085 1.00 0.00 H new ATOM 0 HE1 PHE A 118 -2.460 2.167 3.666 1.00 0.00 H new ATOM 0 HE2 PHE A 118 -1.059 2.480 -0.345 1.00 0.00 H new ATOM 0 HZ PHE A 118 -0.628 2.009 2.031 1.00 0.00 H new ATOM 1753 N GLY A 119 -5.337 0.085 -0.300 1.00 0.00 N ATOM 1754 CA GLY A 119 -4.618 -0.890 -1.112 1.00 0.00 C ATOM 1755 C GLY A 119 -4.598 -2.258 -0.440 1.00 0.00 C ATOM 1756 O GLY A 119 -5.192 -2.448 0.621 1.00 0.00 O ATOM 0 H GLY A 119 -5.444 -0.180 0.679 1.00 0.00 H new ATOM 0 HA2 GLY A 119 -5.089 -0.970 -2.092 1.00 0.00 H new ATOM 0 HA3 GLY A 119 -3.596 -0.548 -1.277 1.00 0.00 H new ATOM 1760 N GLN A 120 -3.910 -3.207 -1.065 1.00 0.00 N ATOM 1761 CA GLN A 120 -3.818 -4.562 -0.535 1.00 0.00 C ATOM 1762 C GLN A 120 -2.584 -5.279 -1.065 1.00 0.00 C ATOM 1763 O GLN A 120 -2.299 -5.243 -2.262 1.00 0.00 O ATOM 1764 CB GLN A 120 -5.077 -5.360 -0.884 1.00 0.00 C ATOM 1765 CG GLN A 120 -5.089 -6.776 -0.334 1.00 0.00 C ATOM 1766 CD GLN A 120 -6.355 -7.529 -0.697 1.00 0.00 C ATOM 1767 OE1 GLN A 120 -7.272 -6.971 -1.308 1.00 0.00 O ATOM 1768 NE2 GLN A 120 -6.414 -8.802 -0.324 1.00 0.00 N ATOM 0 H GLN A 120 -3.407 -3.062 -1.941 1.00 0.00 H new ATOM 0 HA GLN A 120 -3.732 -4.490 0.549 1.00 0.00 H new ATOM 0 HB2 GLN A 120 -5.948 -4.827 -0.504 1.00 0.00 H new ATOM 0 HB3 GLN A 120 -5.178 -5.403 -1.969 1.00 0.00 H new ATOM 0 HG2 GLN A 120 -4.225 -7.319 -0.717 1.00 0.00 H new ATOM 0 HG3 GLN A 120 -4.989 -6.742 0.751 1.00 0.00 H new ATOM 0 HE21 GLN A 120 -5.633 -9.223 0.179 1.00 0.00 H new ATOM 0 HE22 GLN A 120 -7.240 -9.359 -0.541 1.00 0.00 H new ATOM 1777 N VAL A 121 -1.854 -5.931 -0.166 1.00 0.00 N ATOM 1778 CA VAL A 121 -0.662 -6.680 -0.546 1.00 0.00 C ATOM 1779 C VAL A 121 -1.027 -7.953 -1.299 1.00 0.00 C ATOM 1780 O VAL A 121 -1.965 -8.658 -0.927 1.00 0.00 O ATOM 1781 CB VAL A 121 0.161 -7.045 0.703 1.00 0.00 C ATOM 1782 CG1 VAL A 121 1.345 -7.922 0.324 1.00 0.00 C ATOM 1783 CG2 VAL A 121 0.630 -5.779 1.403 1.00 0.00 C ATOM 0 H VAL A 121 -2.067 -5.956 0.831 1.00 0.00 H new ATOM 0 HA VAL A 121 -0.068 -6.044 -1.203 1.00 0.00 H new ATOM 0 HB VAL A 121 -0.471 -7.609 1.389 1.00 0.00 H new ATOM 0 HG11 VAL A 121 1.915 -8.170 1.219 1.00 0.00 H new ATOM 0 HG12 VAL A 121 0.984 -8.839 -0.142 1.00 0.00 H new ATOM 0 HG13 VAL A 121 1.985 -7.386 -0.377 1.00 0.00 H new ATOM 0 HG21 VAL A 121 1.211 -6.045 2.286 1.00 0.00 H new ATOM 0 HG22 VAL A 121 1.250 -5.195 0.723 1.00 0.00 H new ATOM 0 HG23 VAL A 121 -0.235 -5.188 1.703 1.00 0.00 H new ATOM 1793 N THR A 122 -0.282 -8.242 -2.361 1.00 0.00 N ATOM 1794 CA THR A 122 -0.607 -9.353 -3.246 1.00 0.00 C ATOM 1795 C THR A 122 0.490 -10.410 -3.231 1.00 0.00 C ATOM 1796 O THR A 122 0.228 -11.594 -3.437 1.00 0.00 O ATOM 1797 CB THR A 122 -0.835 -8.864 -4.688 1.00 0.00 C ATOM 1798 OG1 THR A 122 0.370 -8.271 -5.191 1.00 0.00 O ATOM 1799 CG2 THR A 122 -1.957 -7.838 -4.733 1.00 0.00 C ATOM 0 H THR A 122 0.553 -7.721 -2.629 1.00 0.00 H new ATOM 0 HA THR A 122 -1.529 -9.801 -2.876 1.00 0.00 H new ATOM 0 HB THR A 122 -1.113 -9.718 -5.305 1.00 0.00 H new ATOM 0 HG1 THR A 122 0.224 -7.962 -6.109 1.00 0.00 H new ATOM 0 HG21 THR A 122 -2.104 -7.504 -5.760 1.00 0.00 H new ATOM 0 HG22 THR A 122 -2.878 -8.289 -4.363 1.00 0.00 H new ATOM 0 HG23 THR A 122 -1.695 -6.984 -4.108 1.00 0.00 H new ATOM 1807 N SER A 123 1.721 -9.973 -2.987 1.00 0.00 N ATOM 1808 CA SER A 123 2.862 -10.879 -2.954 1.00 0.00 C ATOM 1809 C SER A 123 3.861 -10.468 -1.879 1.00 0.00 C ATOM 1810 O SER A 123 4.279 -9.313 -1.815 1.00 0.00 O ATOM 1811 CB SER A 123 3.546 -10.906 -4.307 1.00 0.00 C ATOM 1812 OG SER A 123 4.641 -11.780 -4.298 1.00 0.00 O ATOM 0 H SER A 123 1.954 -8.996 -2.809 1.00 0.00 H new ATOM 0 HA SER A 123 2.493 -11.876 -2.715 1.00 0.00 H new ATOM 0 HB2 SER A 123 2.834 -11.216 -5.072 1.00 0.00 H new ATOM 0 HB3 SER A 123 3.879 -9.902 -4.570 1.00 0.00 H new ATOM 0 HG SER A 123 5.065 -11.782 -5.181 1.00 0.00 H new ATOM 1818 N GLY A 124 4.240 -11.422 -1.035 1.00 0.00 N ATOM 1819 CA GLY A 124 5.063 -11.130 0.132 1.00 0.00 C ATOM 1820 C GLY A 124 4.203 -10.805 1.345 1.00 0.00 C ATOM 1821 O GLY A 124 4.707 -10.341 2.369 1.00 0.00 O ATOM 0 H GLY A 124 3.990 -12.405 -1.138 1.00 0.00 H new ATOM 0 HA2 GLY A 124 5.701 -11.986 0.354 1.00 0.00 H new ATOM 0 HA3 GLY A 124 5.722 -10.289 -0.086 1.00 0.00 H new ATOM 1825 N MET A 125 2.902 -11.048 1.225 1.00 0.00 N ATOM 1826 CA MET A 125 1.971 -10.792 2.317 1.00 0.00 C ATOM 1827 C MET A 125 2.393 -11.524 3.585 1.00 0.00 C ATOM 1828 O MET A 125 2.341 -10.966 4.681 1.00 0.00 O ATOM 1829 CB MET A 125 0.556 -11.202 1.912 1.00 0.00 C ATOM 1830 CG MET A 125 -0.512 -10.895 2.951 1.00 0.00 C ATOM 1831 SD MET A 125 -2.158 -11.417 2.434 1.00 0.00 S ATOM 1832 CE MET A 125 -2.020 -13.193 2.609 1.00 0.00 C ATOM 0 H MET A 125 2.468 -11.422 0.381 1.00 0.00 H new ATOM 0 HA MET A 125 1.983 -9.723 2.528 1.00 0.00 H new ATOM 0 HB2 MET A 125 0.297 -10.695 0.982 1.00 0.00 H new ATOM 0 HB3 MET A 125 0.547 -12.272 1.705 1.00 0.00 H new ATOM 0 HG2 MET A 125 -0.255 -11.391 3.887 1.00 0.00 H new ATOM 0 HG3 MET A 125 -0.521 -9.823 3.150 1.00 0.00 H new ATOM 0 HE1 MET A 125 -3.010 -13.644 2.534 1.00 0.00 H new ATOM 0 HE2 MET A 125 -1.381 -13.588 1.819 1.00 0.00 H new ATOM 0 HE3 MET A 125 -1.586 -13.430 3.580 1.00 0.00 H new ATOM 1842 N ASP A 126 2.813 -12.773 3.428 1.00 0.00 N ATOM 1843 CA ASP A 126 3.243 -13.585 4.561 1.00 0.00 C ATOM 1844 C ASP A 126 4.494 -13.009 5.208 1.00 0.00 C ATOM 1845 O ASP A 126 4.642 -13.037 6.431 1.00 0.00 O ATOM 1846 CB ASP A 126 3.507 -15.027 4.118 1.00 0.00 C ATOM 1847 CG ASP A 126 2.229 -15.803 3.830 1.00 0.00 C ATOM 1848 OD1 ASP A 126 1.176 -15.325 4.178 1.00 0.00 O ATOM 1849 OD2 ASP A 126 2.319 -16.866 3.264 1.00 0.00 O ATOM 0 H ASP A 126 2.865 -13.247 2.526 1.00 0.00 H new ATOM 0 HA ASP A 126 2.439 -13.578 5.297 1.00 0.00 H new ATOM 0 HB2 ASP A 126 4.130 -15.018 3.224 1.00 0.00 H new ATOM 0 HB3 ASP A 126 4.072 -15.543 4.895 1.00 0.00 H new ATOM 1854 N VAL A 127 5.394 -12.484 4.383 1.00 0.00 N ATOM 1855 CA VAL A 127 6.591 -11.817 4.879 1.00 0.00 C ATOM 1856 C VAL A 127 6.234 -10.638 5.775 1.00 0.00 C ATOM 1857 O VAL A 127 6.871 -10.413 6.804 1.00 0.00 O ATOM 1858 CB VAL A 127 7.452 -11.321 3.702 1.00 0.00 C ATOM 1859 CG1 VAL A 127 8.602 -10.463 4.208 1.00 0.00 C ATOM 1860 CG2 VAL A 127 7.974 -12.506 2.906 1.00 0.00 C ATOM 0 H VAL A 127 5.316 -12.508 3.366 1.00 0.00 H new ATOM 0 HA VAL A 127 7.155 -12.542 5.465 1.00 0.00 H new ATOM 0 HB VAL A 127 6.834 -10.706 3.047 1.00 0.00 H new ATOM 0 HG11 VAL A 127 9.200 -10.121 3.363 1.00 0.00 H new ATOM 0 HG12 VAL A 127 8.204 -9.601 4.744 1.00 0.00 H new ATOM 0 HG13 VAL A 127 9.227 -11.051 4.880 1.00 0.00 H new ATOM 0 HG21 VAL A 127 8.582 -12.147 2.075 1.00 0.00 H new ATOM 0 HG22 VAL A 127 8.581 -13.140 3.553 1.00 0.00 H new ATOM 0 HG23 VAL A 127 7.134 -13.082 2.518 1.00 0.00 H new ATOM 1870 N VAL A 128 5.212 -9.889 5.379 1.00 0.00 N ATOM 1871 CA VAL A 128 4.696 -8.799 6.199 1.00 0.00 C ATOM 1872 C VAL A 128 4.037 -9.328 7.466 1.00 0.00 C ATOM 1873 O VAL A 128 4.241 -8.791 8.555 1.00 0.00 O ATOM 1874 CB VAL A 128 3.675 -7.966 5.402 1.00 0.00 C ATOM 1875 CG1 VAL A 128 2.999 -6.945 6.305 1.00 0.00 C ATOM 1876 CG2 VAL A 128 4.366 -7.280 4.233 1.00 0.00 C ATOM 0 H VAL A 128 4.723 -10.017 4.493 1.00 0.00 H new ATOM 0 HA VAL A 128 5.540 -8.169 6.481 1.00 0.00 H new ATOM 0 HB VAL A 128 2.905 -8.631 5.010 1.00 0.00 H new ATOM 0 HG11 VAL A 128 2.281 -6.365 5.725 1.00 0.00 H new ATOM 0 HG12 VAL A 128 2.481 -7.461 7.113 1.00 0.00 H new ATOM 0 HG13 VAL A 128 3.751 -6.276 6.725 1.00 0.00 H new ATOM 0 HG21 VAL A 128 3.638 -6.693 3.674 1.00 0.00 H new ATOM 0 HG22 VAL A 128 5.151 -6.623 4.609 1.00 0.00 H new ATOM 0 HG23 VAL A 128 4.805 -8.032 3.578 1.00 0.00 H new ATOM 1886 N ARG A 129 3.245 -10.385 7.318 1.00 0.00 N ATOM 1887 CA ARG A 129 2.482 -10.932 8.433 1.00 0.00 C ATOM 1888 C ARG A 129 3.398 -11.354 9.574 1.00 0.00 C ATOM 1889 O ARG A 129 3.051 -11.210 10.747 1.00 0.00 O ATOM 1890 CB ARG A 129 1.656 -12.128 7.980 1.00 0.00 C ATOM 1891 CG ARG A 129 0.449 -11.784 7.123 1.00 0.00 C ATOM 1892 CD ARG A 129 -0.159 -12.996 6.518 1.00 0.00 C ATOM 1893 NE ARG A 129 -0.872 -13.795 7.503 1.00 0.00 N ATOM 1894 CZ ARG A 129 -1.034 -15.131 7.432 1.00 0.00 C ATOM 1895 NH1 ARG A 129 -0.531 -15.801 6.420 1.00 0.00 N ATOM 1896 NH2 ARG A 129 -1.699 -15.766 8.381 1.00 0.00 N ATOM 0 H ARG A 129 3.115 -10.880 6.436 1.00 0.00 H new ATOM 0 HA ARG A 129 1.816 -10.146 8.791 1.00 0.00 H new ATOM 0 HB2 ARG A 129 2.301 -12.805 7.419 1.00 0.00 H new ATOM 0 HB3 ARG A 129 1.315 -12.670 8.862 1.00 0.00 H new ATOM 0 HG2 ARG A 129 -0.294 -11.269 7.732 1.00 0.00 H new ATOM 0 HG3 ARG A 129 0.748 -11.094 6.334 1.00 0.00 H new ATOM 0 HD2 ARG A 129 -0.846 -12.700 5.725 1.00 0.00 H new ATOM 0 HD3 ARG A 129 0.621 -13.601 6.056 1.00 0.00 H new ATOM 0 HE ARG A 129 -1.278 -13.310 8.303 1.00 0.00 H new ATOM 0 HH11 ARG A 129 -0.018 -15.310 5.688 1.00 0.00 H new ATOM 0 HH12 ARG A 129 -0.654 -16.812 6.366 1.00 0.00 H new ATOM 0 HH21 ARG A 129 -2.089 -15.245 9.166 1.00 0.00 H new ATOM 0 HH22 ARG A 129 -1.822 -16.777 8.328 1.00 0.00 H new ATOM 1910 N THR A 130 4.568 -11.876 9.224 1.00 0.00 N ATOM 1911 CA THR A 130 5.555 -12.279 10.218 1.00 0.00 C ATOM 1912 C THR A 130 6.804 -11.411 10.137 1.00 0.00 C ATOM 1913 O THR A 130 7.904 -11.855 10.470 1.00 0.00 O ATOM 1914 CB THR A 130 5.943 -13.760 10.047 1.00 0.00 C ATOM 1915 OG1 THR A 130 6.432 -13.977 8.718 1.00 0.00 O ATOM 1916 CG2 THR A 130 4.739 -14.657 10.295 1.00 0.00 C ATOM 0 H THR A 130 4.856 -12.030 8.258 1.00 0.00 H new ATOM 0 HA THR A 130 5.098 -12.146 11.198 1.00 0.00 H new ATOM 0 HB THR A 130 6.720 -14.004 10.771 1.00 0.00 H new ATOM 0 HG1 THR A 130 5.724 -13.774 8.072 1.00 0.00 H new ATOM 0 HG21 THR A 130 5.030 -15.700 10.170 1.00 0.00 H new ATOM 0 HG22 THR A 130 4.372 -14.502 11.310 1.00 0.00 H new ATOM 0 HG23 THR A 130 3.951 -14.413 9.583 1.00 0.00 H new ATOM 1924 N MET A 131 6.630 -10.171 9.694 1.00 0.00 N ATOM 1925 CA MET A 131 7.742 -9.236 9.574 1.00 0.00 C ATOM 1926 C MET A 131 8.355 -8.930 10.934 1.00 0.00 C ATOM 1927 O MET A 131 7.667 -8.955 11.955 1.00 0.00 O ATOM 1928 CB MET A 131 7.279 -7.948 8.896 1.00 0.00 C ATOM 1929 CG MET A 131 8.382 -6.926 8.662 1.00 0.00 C ATOM 1930 SD MET A 131 7.911 -5.651 7.477 1.00 0.00 S ATOM 1931 CE MET A 131 6.451 -4.978 8.265 1.00 0.00 C ATOM 0 H MET A 131 5.727 -9.789 9.411 1.00 0.00 H new ATOM 0 HA MET A 131 8.511 -9.703 8.958 1.00 0.00 H new ATOM 0 HB2 MET A 131 6.825 -8.200 7.937 1.00 0.00 H new ATOM 0 HB3 MET A 131 6.501 -7.490 9.507 1.00 0.00 H new ATOM 0 HG2 MET A 131 8.643 -6.456 9.610 1.00 0.00 H new ATOM 0 HG3 MET A 131 9.275 -7.437 8.303 1.00 0.00 H new ATOM 0 HE1 MET A 131 6.135 -4.078 7.738 1.00 0.00 H new ATOM 0 HE2 MET A 131 5.649 -5.716 8.236 1.00 0.00 H new ATOM 0 HE3 MET A 131 6.678 -4.731 9.302 1.00 0.00 H new ATOM 1941 N LYS A 132 9.652 -8.641 10.942 1.00 0.00 N ATOM 1942 CA LYS A 132 10.349 -8.282 12.172 1.00 0.00 C ATOM 1943 C LYS A 132 10.164 -6.807 12.501 1.00 0.00 C ATOM 1944 O LYS A 132 10.011 -5.976 11.606 1.00 0.00 O ATOM 1945 CB LYS A 132 11.838 -8.614 12.058 1.00 0.00 C ATOM 1946 CG LYS A 132 12.146 -10.102 11.966 1.00 0.00 C ATOM 1947 CD LYS A 132 13.642 -10.350 11.843 1.00 0.00 C ATOM 1948 CE LYS A 132 13.954 -11.838 11.775 1.00 0.00 C ATOM 1949 NZ LYS A 132 15.413 -12.095 11.644 1.00 0.00 N ATOM 0 H LYS A 132 10.242 -8.648 10.110 1.00 0.00 H new ATOM 0 HA LYS A 132 9.916 -8.867 12.984 1.00 0.00 H new ATOM 0 HB2 LYS A 132 12.242 -8.117 11.176 1.00 0.00 H new ATOM 0 HB3 LYS A 132 12.357 -8.201 12.923 1.00 0.00 H new ATOM 0 HG2 LYS A 132 11.762 -10.610 12.851 1.00 0.00 H new ATOM 0 HG3 LYS A 132 11.632 -10.529 11.105 1.00 0.00 H new ATOM 0 HD2 LYS A 132 14.022 -9.856 10.949 1.00 0.00 H new ATOM 0 HD3 LYS A 132 14.157 -9.907 12.695 1.00 0.00 H new ATOM 0 HE2 LYS A 132 13.578 -12.329 12.673 1.00 0.00 H new ATOM 0 HE3 LYS A 132 13.430 -12.280 10.927 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 15.582 -13.120 11.601 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 15.767 -11.649 10.774 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 15.911 -11.696 12.465 1.00 0.00 H new ATOM 1963 N ASN A 133 10.179 -6.487 13.791 1.00 0.00 N ATOM 1964 CA ASN A 133 10.009 -5.111 14.240 1.00 0.00 C ATOM 1965 C ASN A 133 11.226 -4.263 13.891 1.00 0.00 C ATOM 1966 O ASN A 133 12.363 -4.654 14.156 1.00 0.00 O ATOM 1967 CB ASN A 133 9.737 -5.067 15.733 1.00 0.00 C ATOM 1968 CG ASN A 133 9.160 -3.752 16.176 1.00 0.00 C ATOM 1969 OD1 ASN A 133 8.489 -3.061 15.401 1.00 0.00 O ATOM 1970 ND2 ASN A 133 9.408 -3.392 17.410 1.00 0.00 N ATOM 0 H ASN A 133 10.307 -7.163 14.544 1.00 0.00 H new ATOM 0 HA ASN A 133 9.149 -4.692 13.718 1.00 0.00 H new ATOM 0 HB2 ASN A 133 9.048 -5.869 15.997 1.00 0.00 H new ATOM 0 HB3 ASN A 133 10.665 -5.253 16.273 1.00 0.00 H new ATOM 0 HD21 ASN A 133 9.042 -2.509 17.767 1.00 0.00 H new ATOM 0 HD22 ASN A 133 9.967 -3.994 18.014 1.00 0.00 H new ATOM 1977 N GLY A 134 10.979 -3.101 13.297 1.00 0.00 N ATOM 1978 CA GLY A 134 12.052 -2.179 12.942 1.00 0.00 C ATOM 1979 C GLY A 134 12.637 -2.514 11.576 1.00 0.00 C ATOM 1980 O GLY A 134 13.729 -2.062 11.230 1.00 0.00 O ATOM 0 H GLY A 134 10.044 -2.775 13.051 1.00 0.00 H new ATOM 0 HA2 GLY A 134 11.671 -1.158 12.937 1.00 0.00 H new ATOM 0 HA3 GLY A 134 12.837 -2.222 13.697 1.00 0.00 H new ATOM 1984 N ASP A 135 11.906 -3.310 10.804 1.00 0.00 N ATOM 1985 CA ASP A 135 12.325 -3.664 9.453 1.00 0.00 C ATOM 1986 C ASP A 135 12.470 -2.423 8.580 1.00 0.00 C ATOM 1987 O ASP A 135 11.570 -1.586 8.519 1.00 0.00 O ATOM 1988 CB ASP A 135 11.323 -4.629 8.815 1.00 0.00 C ATOM 1989 CG ASP A 135 11.828 -5.232 7.512 1.00 0.00 C ATOM 1990 OD1 ASP A 135 12.899 -4.867 7.086 1.00 0.00 O ATOM 1991 OD2 ASP A 135 11.140 -6.052 6.954 1.00 0.00 O ATOM 0 H ASP A 135 11.019 -3.723 11.091 1.00 0.00 H new ATOM 0 HA ASP A 135 13.296 -4.153 9.525 1.00 0.00 H new ATOM 0 HB2 ASP A 135 11.101 -5.431 9.519 1.00 0.00 H new ATOM 0 HB3 ASP A 135 10.388 -4.102 8.627 1.00 0.00 H new ATOM 1996 N VAL A 136 13.609 -2.312 7.904 1.00 0.00 N ATOM 1997 CA VAL A 136 13.940 -1.106 7.154 1.00 0.00 C ATOM 1998 C VAL A 136 13.505 -1.226 5.699 1.00 0.00 C ATOM 1999 O VAL A 136 13.823 -2.207 5.026 1.00 0.00 O ATOM 2000 CB VAL A 136 15.456 -0.838 7.214 1.00 0.00 C ATOM 2001 CG1 VAL A 136 15.802 0.435 6.457 1.00 0.00 C ATOM 2002 CG2 VAL A 136 15.908 -0.744 8.663 1.00 0.00 C ATOM 0 H VAL A 136 14.319 -3.043 7.860 1.00 0.00 H new ATOM 0 HA VAL A 136 13.404 -0.274 7.611 1.00 0.00 H new ATOM 0 HB VAL A 136 15.981 -1.666 6.738 1.00 0.00 H new ATOM 0 HG11 VAL A 136 16.877 0.609 6.510 1.00 0.00 H new ATOM 0 HG12 VAL A 136 15.502 0.331 5.414 1.00 0.00 H new ATOM 0 HG13 VAL A 136 15.276 1.278 6.904 1.00 0.00 H new ATOM 0 HG21 VAL A 136 16.981 -0.554 8.698 1.00 0.00 H new ATOM 0 HG22 VAL A 136 15.379 0.071 9.157 1.00 0.00 H new ATOM 0 HG23 VAL A 136 15.688 -1.681 9.174 1.00 0.00 H new ATOM 2012 N MET A 137 12.778 -0.223 5.220 1.00 0.00 N ATOM 2013 CA MET A 137 12.331 -0.196 3.832 1.00 0.00 C ATOM 2014 C MET A 137 13.413 0.360 2.915 1.00 0.00 C ATOM 2015 O MET A 137 13.607 1.572 2.832 1.00 0.00 O ATOM 2016 CB MET A 137 11.051 0.627 3.706 1.00 0.00 C ATOM 2017 CG MET A 137 9.864 0.070 4.481 1.00 0.00 C ATOM 2018 SD MET A 137 8.351 1.010 4.204 1.00 0.00 S ATOM 2019 CE MET A 137 8.613 2.404 5.298 1.00 0.00 C ATOM 0 H MET A 137 12.485 0.583 5.773 1.00 0.00 H new ATOM 0 HA MET A 137 12.124 -1.221 3.523 1.00 0.00 H new ATOM 0 HB2 MET A 137 11.251 1.641 4.051 1.00 0.00 H new ATOM 0 HB3 MET A 137 10.781 0.696 2.652 1.00 0.00 H new ATOM 0 HG2 MET A 137 9.700 -0.968 4.191 1.00 0.00 H new ATOM 0 HG3 MET A 137 10.098 0.070 5.546 1.00 0.00 H new ATOM 0 HE1 MET A 137 7.945 3.218 5.016 1.00 0.00 H new ATOM 0 HE2 MET A 137 8.407 2.104 6.325 1.00 0.00 H new ATOM 0 HE3 MET A 137 9.647 2.739 5.219 1.00 0.00 H new ATOM 2029 N LYS A 138 14.115 -0.534 2.228 1.00 0.00 N ATOM 2030 CA LYS A 138 15.221 -0.140 1.363 1.00 0.00 C ATOM 2031 C LYS A 138 14.739 0.750 0.223 1.00 0.00 C ATOM 2032 O LYS A 138 15.349 1.776 -0.077 1.00 0.00 O ATOM 2033 CB LYS A 138 15.930 -1.373 0.803 1.00 0.00 C ATOM 2034 CG LYS A 138 17.098 -1.061 -0.123 1.00 0.00 C ATOM 2035 CD LYS A 138 17.808 -2.333 -0.564 1.00 0.00 C ATOM 2036 CE LYS A 138 18.951 -2.026 -1.521 1.00 0.00 C ATOM 2037 NZ LYS A 138 19.631 -3.263 -1.991 1.00 0.00 N ATOM 0 H LYS A 138 13.938 -1.538 2.253 1.00 0.00 H new ATOM 0 HA LYS A 138 15.928 0.430 1.966 1.00 0.00 H new ATOM 0 HB2 LYS A 138 16.293 -1.977 1.634 1.00 0.00 H new ATOM 0 HB3 LYS A 138 15.204 -1.979 0.261 1.00 0.00 H new ATOM 0 HG2 LYS A 138 16.737 -0.521 -0.998 1.00 0.00 H new ATOM 0 HG3 LYS A 138 17.804 -0.406 0.387 1.00 0.00 H new ATOM 0 HD2 LYS A 138 18.194 -2.858 0.310 1.00 0.00 H new ATOM 0 HD3 LYS A 138 17.095 -3.001 -1.048 1.00 0.00 H new ATOM 0 HE2 LYS A 138 18.567 -1.475 -2.379 1.00 0.00 H new ATOM 0 HE3 LYS A 138 19.675 -1.380 -1.025 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 20.403 -3.010 -2.640 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 20.020 -3.777 -1.175 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 18.946 -3.869 -2.487 1.00 0.00 H new ATOM 2051 N GLU A 139 13.640 0.350 -0.408 1.00 0.00 N ATOM 2052 CA GLU A 139 13.137 1.047 -1.585 1.00 0.00 C ATOM 2053 C GLU A 139 11.627 0.888 -1.716 1.00 0.00 C ATOM 2054 O GLU A 139 11.128 -0.209 -1.965 1.00 0.00 O ATOM 2055 CB GLU A 139 13.826 0.524 -2.849 1.00 0.00 C ATOM 2056 CG GLU A 139 13.499 1.307 -4.112 1.00 0.00 C ATOM 2057 CD GLU A 139 14.181 0.757 -5.334 1.00 0.00 C ATOM 2058 OE1 GLU A 139 15.380 0.609 -5.306 1.00 0.00 O ATOM 2059 OE2 GLU A 139 13.503 0.484 -6.296 1.00 0.00 O ATOM 0 H GLU A 139 13.081 -0.454 -0.123 1.00 0.00 H new ATOM 0 HA GLU A 139 13.362 2.107 -1.466 1.00 0.00 H new ATOM 0 HB2 GLU A 139 14.905 0.542 -2.694 1.00 0.00 H new ATOM 0 HB3 GLU A 139 13.543 -0.518 -2.998 1.00 0.00 H new ATOM 0 HG2 GLU A 139 12.420 1.299 -4.269 1.00 0.00 H new ATOM 0 HG3 GLU A 139 13.793 2.347 -3.975 1.00 0.00 H new ATOM 2066 N VAL A 140 10.906 1.991 -1.548 1.00 0.00 N ATOM 2067 CA VAL A 140 9.458 1.991 -1.716 1.00 0.00 C ATOM 2068 C VAL A 140 9.050 2.740 -2.978 1.00 0.00 C ATOM 2069 O VAL A 140 9.288 3.941 -3.103 1.00 0.00 O ATOM 2070 CB VAL A 140 8.778 2.640 -0.496 1.00 0.00 C ATOM 2071 CG1 VAL A 140 7.267 2.653 -0.672 1.00 0.00 C ATOM 2072 CG2 VAL A 140 9.167 1.893 0.771 1.00 0.00 C ATOM 0 H VAL A 140 11.301 2.897 -1.295 1.00 0.00 H new ATOM 0 HA VAL A 140 9.135 0.954 -1.806 1.00 0.00 H new ATOM 0 HB VAL A 140 9.116 3.673 -0.410 1.00 0.00 H new ATOM 0 HG11 VAL A 140 6.803 3.115 0.199 1.00 0.00 H new ATOM 0 HG12 VAL A 140 7.010 3.223 -1.565 1.00 0.00 H new ATOM 0 HG13 VAL A 140 6.904 1.631 -0.777 1.00 0.00 H new ATOM 0 HG21 VAL A 140 8.683 2.357 1.630 1.00 0.00 H new ATOM 0 HG22 VAL A 140 8.849 0.853 0.693 1.00 0.00 H new ATOM 0 HG23 VAL A 140 10.249 1.933 0.899 1.00 0.00 H new ATOM 2082 N LYS A 141 8.435 2.023 -3.912 1.00 0.00 N ATOM 2083 CA LYS A 141 8.058 2.601 -5.197 1.00 0.00 C ATOM 2084 C LYS A 141 6.600 2.309 -5.526 1.00 0.00 C ATOM 2085 O LYS A 141 6.094 1.223 -5.242 1.00 0.00 O ATOM 2086 CB LYS A 141 8.963 2.070 -6.309 1.00 0.00 C ATOM 2087 CG LYS A 141 10.439 2.403 -6.131 1.00 0.00 C ATOM 2088 CD LYS A 141 10.704 3.883 -6.366 1.00 0.00 C ATOM 2089 CE LYS A 141 12.183 4.211 -6.224 1.00 0.00 C ATOM 2090 NZ LYS A 141 12.452 5.663 -6.418 1.00 0.00 N ATOM 0 H LYS A 141 8.187 1.040 -3.803 1.00 0.00 H new ATOM 0 HA LYS A 141 8.182 3.682 -5.125 1.00 0.00 H new ATOM 0 HB2 LYS A 141 8.851 0.987 -6.366 1.00 0.00 H new ATOM 0 HB3 LYS A 141 8.624 2.476 -7.262 1.00 0.00 H new ATOM 0 HG2 LYS A 141 10.757 2.130 -5.125 1.00 0.00 H new ATOM 0 HG3 LYS A 141 11.034 1.810 -6.825 1.00 0.00 H new ATOM 0 HD2 LYS A 141 10.362 4.162 -7.363 1.00 0.00 H new ATOM 0 HD3 LYS A 141 10.128 4.475 -5.654 1.00 0.00 H new ATOM 0 HE2 LYS A 141 12.529 3.907 -5.236 1.00 0.00 H new ATOM 0 HE3 LYS A 141 12.754 3.636 -6.953 1.00 0.00 H new ATOM 0 HZ1 LYS A 141 13.471 5.844 -6.313 1.00 0.00 H new ATOM 0 HZ2 LYS A 141 12.146 5.949 -7.370 1.00 0.00 H new ATOM 0 HZ3 LYS A 141 11.928 6.211 -5.707 1.00 0.00 H new ATOM 2104 N VAL A 142 5.927 3.286 -6.125 1.00 0.00 N ATOM 2105 CA VAL A 142 4.568 3.091 -6.618 1.00 0.00 C ATOM 2106 C VAL A 142 4.400 3.669 -8.017 1.00 0.00 C ATOM 2107 O VAL A 142 4.725 4.831 -8.261 1.00 0.00 O ATOM 2108 CB VAL A 142 3.554 3.754 -5.666 1.00 0.00 C ATOM 2109 CG1 VAL A 142 2.137 3.568 -6.185 1.00 0.00 C ATOM 2110 CG2 VAL A 142 3.698 3.170 -4.268 1.00 0.00 C ATOM 0 H VAL A 142 6.301 4.222 -6.281 1.00 0.00 H new ATOM 0 HA VAL A 142 4.382 2.018 -6.660 1.00 0.00 H new ATOM 0 HB VAL A 142 3.759 4.824 -5.620 1.00 0.00 H new ATOM 0 HG11 VAL A 142 1.434 4.042 -5.501 1.00 0.00 H new ATOM 0 HG12 VAL A 142 2.048 4.024 -7.171 1.00 0.00 H new ATOM 0 HG13 VAL A 142 1.912 2.504 -6.256 1.00 0.00 H new ATOM 0 HG21 VAL A 142 2.978 3.643 -3.600 1.00 0.00 H new ATOM 0 HG22 VAL A 142 3.511 2.097 -4.301 1.00 0.00 H new ATOM 0 HG23 VAL A 142 4.708 3.351 -3.900 1.00 0.00 H new ATOM 2120 N PHE A 143 3.891 2.852 -8.932 1.00 0.00 N ATOM 2121 CA PHE A 143 3.765 3.250 -10.329 1.00 0.00 C ATOM 2122 C PHE A 143 2.315 3.189 -10.790 1.00 0.00 C ATOM 2123 O PHE A 143 1.589 2.249 -10.466 1.00 0.00 O ATOM 2124 CB PHE A 143 4.627 2.354 -11.220 1.00 0.00 C ATOM 2125 CG PHE A 143 6.093 2.409 -10.897 1.00 0.00 C ATOM 2126 CD1 PHE A 143 6.904 3.390 -11.449 1.00 0.00 C ATOM 2127 CD2 PHE A 143 6.664 1.481 -10.039 1.00 0.00 C ATOM 2128 CE1 PHE A 143 8.252 3.440 -11.155 1.00 0.00 C ATOM 2129 CE2 PHE A 143 8.013 1.530 -9.742 1.00 0.00 C ATOM 2130 CZ PHE A 143 8.807 2.510 -10.298 1.00 0.00 C ATOM 0 H PHE A 143 3.559 1.909 -8.731 1.00 0.00 H new ATOM 0 HA PHE A 143 4.111 4.280 -10.413 1.00 0.00 H new ATOM 0 HB2 PHE A 143 4.282 1.324 -11.126 1.00 0.00 H new ATOM 0 HB3 PHE A 143 4.482 2.645 -12.260 1.00 0.00 H new ATOM 0 HD1 PHE A 143 6.476 4.123 -12.117 1.00 0.00 H new ATOM 0 HD2 PHE A 143 6.048 0.711 -9.598 1.00 0.00 H new ATOM 0 HE1 PHE A 143 8.873 4.206 -11.595 1.00 0.00 H new ATOM 0 HE2 PHE A 143 8.445 0.800 -9.074 1.00 0.00 H new ATOM 0 HZ PHE A 143 9.861 2.550 -10.064 1.00 0.00 H new ATOM 2140 N ASP A 144 1.898 4.197 -11.549 1.00 0.00 N ATOM 2141 CA ASP A 144 0.553 4.226 -12.114 1.00 0.00 C ATOM 2142 C ASP A 144 0.437 3.291 -13.310 1.00 0.00 C ATOM 2143 O ASP A 144 1.261 3.331 -14.223 1.00 0.00 O ATOM 2144 CB ASP A 144 0.178 5.649 -12.532 1.00 0.00 C ATOM 2145 CG ASP A 144 -1.258 5.763 -13.025 1.00 0.00 C ATOM 2146 OD1 ASP A 144 -2.150 5.717 -12.211 1.00 0.00 O ATOM 2147 OD2 ASP A 144 -1.450 5.895 -14.210 1.00 0.00 O ATOM 0 H ASP A 144 2.472 5.005 -11.787 1.00 0.00 H new ATOM 0 HA ASP A 144 -0.137 3.886 -11.342 1.00 0.00 H new ATOM 0 HB2 ASP A 144 0.320 6.320 -11.685 1.00 0.00 H new ATOM 0 HB3 ASP A 144 0.855 5.981 -13.319 1.00 0.00 H new ATOM 2152 N GLU A 145 -0.591 2.449 -13.299 1.00 0.00 N ATOM 2153 CA GLU A 145 -0.774 1.450 -14.345 1.00 0.00 C ATOM 2154 C GLU A 145 -1.365 2.071 -15.603 1.00 0.00 C ATOM 2155 O GLU A 145 -2.113 3.046 -15.533 1.00 0.00 O ATOM 2156 CB GLU A 145 -1.677 0.318 -13.849 1.00 0.00 C ATOM 2157 CG GLU A 145 -1.103 -0.484 -12.691 1.00 0.00 C ATOM 2158 CD GLU A 145 -2.001 -1.606 -12.252 1.00 0.00 C ATOM 2159 OE1 GLU A 145 -2.346 -2.421 -13.074 1.00 0.00 O ATOM 2160 OE2 GLU A 145 -2.344 -1.649 -11.094 1.00 0.00 O ATOM 0 H GLU A 145 -1.311 2.439 -12.576 1.00 0.00 H new ATOM 0 HA GLU A 145 0.207 1.043 -14.592 1.00 0.00 H new ATOM 0 HB2 GLU A 145 -2.634 0.741 -13.543 1.00 0.00 H new ATOM 0 HB3 GLU A 145 -1.879 -0.359 -14.679 1.00 0.00 H new ATOM 0 HG2 GLU A 145 -0.136 -0.893 -12.984 1.00 0.00 H new ATOM 0 HG3 GLU A 145 -0.925 0.183 -11.847 1.00 0.00 H new ATOM 2167 N PRO A 146 -1.027 1.501 -16.754 1.00 0.00 N ATOM 2168 CA PRO A 146 -1.572 1.961 -18.026 1.00 0.00 C ATOM 2169 C PRO A 146 -3.091 2.051 -17.975 1.00 0.00 C ATOM 2170 O PRO A 146 -3.545 2.928 -18.134 1.00 0.00 O ATOM 2171 CB PRO A 146 -1.102 0.884 -19.011 1.00 0.00 C ATOM 2172 CG PRO A 146 0.171 0.380 -18.423 1.00 0.00 C ATOM 2173 CD PRO A 146 -0.080 0.373 -16.939 1.00 0.00 C ATOM 2174 OXT PRO A 146 -3.743 1.071 -17.744 1.00 0.00 O ATOM 0 HA PRO A 146 -1.240 2.962 -18.301 1.00 0.00 H new ATOM 0 HB2 PRO A 146 -1.838 0.086 -19.110 1.00 0.00 H new ATOM 0 HB3 PRO A 146 -0.944 1.297 -20.007 1.00 0.00 H new ATOM 0 HG2 PRO A 146 0.411 -0.618 -18.790 1.00 0.00 H new ATOM 0 HG3 PRO A 146 1.011 1.025 -18.681 1.00 0.00 H new ATOM 0 HD2 PRO A 146 -0.509 -0.572 -16.607 1.00 0.00 H new ATOM 0 HD3 PRO A 146 0.840 0.522 -16.374 1.00 0.00 H new