USER MOD reduce.3.24.130724 H: found=0, std=0, add=1227, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 1229 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: B 43 GLN : amide:sc= -2.65 K(o=-5.8,f=-9.3!) USER MOD Set 1.2: B 49 ASN : amide:sc= -3.18 K(o=-5.8,f=-7.8!) USER MOD Set 2.1: B 2 ASN : amide:sc= -0.749 K(o=-0.75,f=-13!) USER MOD Set 2.2: B 4 THR OG1 : rot 180:sc= 0 USER MOD Set 3.1: A 45 THR OG1 : rot -150:sc= -0.509 USER MOD Set 3.2: B 3 LYS NZ :NH3+ -125:sc= 0.207 (180deg=-1.06!) USER MOD Set 4.1: A 35 THR OG1 : rot -137:sc= 1.28 USER MOD Set 4.2: B 1 MET CE :methyl 162:sc= -0.687 (180deg=-1.26) USER MOD Set 5.1: A 3 LYS NZ :NH3+ -157:sc= -0.263 (180deg=-0.655) USER MOD Set 5.2: B 45 THR OG1 : rot 180:sc= -0.596 USER MOD Set 6.1: A 1 MET CE :methyl 149:sc= -5.79! (180deg=-6.77!) USER MOD Set 6.2: B 35 THR OG1 : rot -130:sc= -0.368! USER MOD Single : A 1 MET N :NH3+ -118:sc= 0.0625 (180deg=-0.312) USER MOD Single : A 2 ASN : amide:sc= -4.39 X(o=-4.4,f=-4.8!) USER MOD Single : A 4 THR OG1 : rot 180:sc= 0 USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 GLN :FLIP amide:sc= -0.115 F(o=-2.1,f=-0.12) USER MOD Single : A 14 THR OG1 : rot -71:sc= -9.73! USER MOD Single : A 17 THR OG1 : rot 180:sc= 0 USER MOD Single : A 18 GLN : amide:sc= 0 K(o=0,f=-0.63) USER MOD Single : A 20 SER OG : rot 175:sc= -10.8! USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 MET CE :methyl -147:sc= -5.14! (180deg=-7.29!) USER MOD Single : A 27 SER OG : rot -6:sc= -3.54 USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 THR OG1 : rot 109:sc= -6.67! USER MOD Single : A 38 LYS NZ :NH3+ 167:sc= -0.255 (180deg=-0.431) USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 49 ASN : amide:sc= -0.349 K(o=-0.35,f=-2.1) USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 SER OG : rot 90:sc= -0.407 USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 SER OG : rot -156:sc= 0.416 USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 TYR OH : rot 180:sc= 0 USER MOD Single : B 1 MET N :NH3+ 141:sc= -0.878! (180deg=-3.24!) USER MOD Single : B 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 12 GLN : amide:sc= -0.272 X(o=-0.27,f=-0.068) USER MOD Single : B 14 THR OG1 : rot -120:sc= -4.5! USER MOD Single : B 17 THR OG1 : rot 180:sc= 0 USER MOD Single : B 18 GLN : amide:sc= -0.132 X(o=-0.13,f=0) USER MOD Single : B 20 SER OG : rot -24:sc= -5.62! USER MOD Single : B 22 SER OG : rot 180:sc= 0 USER MOD Single : B 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 24 MET CE :methyl -158:sc= -4.07! (180deg=-6.39!) USER MOD Single : B 27 SER OG : rot 40:sc= -2.43 USER MOD Single : B 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 33 THR OG1 : rot 88:sc= -1.3 USER MOD Single : B 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 41 LYS NZ :NH3+ -137:sc= -0.0141 (180deg=-0.0624) USER MOD Single : B 51 LYS NZ :NH3+ 142:sc= -0.242 (180deg=-1.57!) USER MOD Single : B 78 SER OG : rot 180:sc= 0 USER MOD Single : B 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 84 SER OG : rot -40:sc= -0.127! USER MOD Single : B 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 94 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 5.016 3.865 10.086 1.00 0.00 N ATOM 2 CA MET A 1 4.220 5.126 10.094 1.00 0.00 C ATOM 3 C MET A 1 2.735 4.813 9.895 1.00 0.00 C ATOM 4 O MET A 1 2.321 3.674 9.995 1.00 0.00 O ATOM 5 CB MET A 1 4.761 5.941 8.921 1.00 0.00 C ATOM 6 CG MET A 1 5.993 6.727 9.374 1.00 0.00 C ATOM 7 SD MET A 1 7.209 6.773 8.035 1.00 0.00 S ATOM 8 CE MET A 1 6.140 7.545 6.798 1.00 0.00 C ATOM 0 H1 MET A 1 5.486 3.746 11.006 1.00 0.00 H new ATOM 0 H2 MET A 1 4.385 3.057 9.913 1.00 0.00 H new ATOM 0 H3 MET A 1 5.733 3.912 9.334 1.00 0.00 H new ATOM 0 HA MET A 1 4.306 5.665 11.037 1.00 0.00 H new ATOM 0 HB2 MET A 1 5.021 5.280 8.094 1.00 0.00 H new ATOM 0 HB3 MET A 1 3.995 6.624 8.554 1.00 0.00 H new ATOM 0 HG2 MET A 1 5.707 7.741 9.654 1.00 0.00 H new ATOM 0 HG3 MET A 1 6.428 6.262 10.259 1.00 0.00 H new ATOM 0 HE1 MET A 1 6.743 8.156 6.126 1.00 0.00 H new ATOM 0 HE2 MET A 1 5.629 6.771 6.225 1.00 0.00 H new ATOM 0 HE3 MET A 1 5.402 8.174 7.296 1.00 0.00 H new ATOM 20 N ASN A 2 1.922 5.806 9.615 1.00 0.00 N ATOM 21 CA ASN A 2 0.466 5.526 9.415 1.00 0.00 C ATOM 22 C ASN A 2 -0.296 6.763 8.934 1.00 0.00 C ATOM 23 O ASN A 2 0.285 7.764 8.566 1.00 0.00 O ATOM 24 CB ASN A 2 -0.051 5.087 10.790 1.00 0.00 C ATOM 25 CG ASN A 2 -0.415 3.601 10.760 1.00 0.00 C ATOM 26 OD1 ASN A 2 0.357 2.765 11.187 1.00 0.00 O ATOM 27 ND2 ASN A 2 -1.570 3.234 10.275 1.00 0.00 N ATOM 0 H ASN A 2 2.199 6.783 9.518 1.00 0.00 H new ATOM 0 HA ASN A 2 0.318 4.766 8.648 1.00 0.00 H new ATOM 0 HB2 ASN A 2 0.710 5.269 11.549 1.00 0.00 H new ATOM 0 HB3 ASN A 2 -0.924 5.679 11.066 1.00 0.00 H new ATOM 0 HD21 ASN A 2 -1.824 2.246 10.255 1.00 0.00 H new ATOM 0 HD22 ASN A 2 -2.219 3.935 9.916 1.00 0.00 H new ATOM 34 N LYS A 3 -1.611 6.693 8.945 1.00 0.00 N ATOM 35 CA LYS A 3 -2.438 7.858 8.498 1.00 0.00 C ATOM 36 C LYS A 3 -1.996 9.127 9.241 1.00 0.00 C ATOM 37 O LYS A 3 -2.307 10.229 8.838 1.00 0.00 O ATOM 38 CB LYS A 3 -3.891 7.495 8.864 1.00 0.00 C ATOM 39 CG LYS A 3 -4.795 7.626 7.626 1.00 0.00 C ATOM 40 CD LYS A 3 -6.224 7.995 8.055 1.00 0.00 C ATOM 41 CE LYS A 3 -7.237 7.527 6.991 1.00 0.00 C ATOM 42 NZ LYS A 3 -8.284 6.795 7.758 1.00 0.00 N ATOM 0 H LYS A 3 -2.144 5.877 9.245 1.00 0.00 H new ATOM 0 HA LYS A 3 -2.331 8.054 7.431 1.00 0.00 H new ATOM 0 HB2 LYS A 3 -3.934 6.476 9.249 1.00 0.00 H new ATOM 0 HB3 LYS A 3 -4.250 8.151 9.657 1.00 0.00 H new ATOM 0 HG2 LYS A 3 -4.399 8.389 6.956 1.00 0.00 H new ATOM 0 HG3 LYS A 3 -4.804 6.688 7.071 1.00 0.00 H new ATOM 0 HD2 LYS A 3 -6.454 7.533 9.015 1.00 0.00 H new ATOM 0 HD3 LYS A 3 -6.303 9.073 8.193 1.00 0.00 H new ATOM 0 HE2 LYS A 3 -7.662 8.373 6.450 1.00 0.00 H new ATOM 0 HE3 LYS A 3 -6.764 6.881 6.252 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 -8.777 6.132 7.126 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 -7.839 6.266 8.535 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 -8.967 7.475 8.148 1.00 0.00 H new ATOM 56 N THR A 4 -1.269 8.974 10.323 1.00 0.00 N ATOM 57 CA THR A 4 -0.795 10.163 11.094 1.00 0.00 C ATOM 58 C THR A 4 0.730 10.277 10.992 1.00 0.00 C ATOM 59 O THR A 4 1.275 11.301 10.611 1.00 0.00 O ATOM 60 CB THR A 4 -1.223 9.891 12.542 1.00 0.00 C ATOM 61 OG1 THR A 4 -2.576 10.287 12.714 1.00 0.00 O ATOM 62 CG2 THR A 4 -0.333 10.680 13.511 1.00 0.00 C ATOM 0 H THR A 4 -0.984 8.072 10.705 1.00 0.00 H new ATOM 0 HA THR A 4 -1.210 11.098 10.718 1.00 0.00 H new ATOM 0 HB THR A 4 -1.120 8.826 12.752 1.00 0.00 H new ATOM 0 HG1 THR A 4 -2.853 10.113 13.638 1.00 0.00 H new ATOM 0 HG21 THR A 4 -0.645 10.480 14.536 1.00 0.00 H new ATOM 0 HG22 THR A 4 0.705 10.375 13.382 1.00 0.00 H new ATOM 0 HG23 THR A 4 -0.426 11.746 13.305 1.00 0.00 H new ATOM 70 N GLU A 5 1.425 9.229 11.327 1.00 0.00 N ATOM 71 CA GLU A 5 2.911 9.270 11.253 1.00 0.00 C ATOM 72 C GLU A 5 3.327 9.835 9.899 1.00 0.00 C ATOM 73 O GLU A 5 4.144 10.734 9.808 1.00 0.00 O ATOM 74 CB GLU A 5 3.365 7.819 11.410 1.00 0.00 C ATOM 75 CG GLU A 5 4.140 7.652 12.723 1.00 0.00 C ATOM 76 CD GLU A 5 3.278 6.895 13.735 1.00 0.00 C ATOM 77 OE1 GLU A 5 2.162 7.326 13.974 1.00 0.00 O ATOM 78 OE2 GLU A 5 3.749 5.895 14.253 1.00 0.00 O ATOM 0 H GLU A 5 1.030 8.346 11.649 1.00 0.00 H new ATOM 0 HA GLU A 5 3.358 9.902 12.020 1.00 0.00 H new ATOM 0 HB2 GLU A 5 2.500 7.156 11.402 1.00 0.00 H new ATOM 0 HB3 GLU A 5 3.995 7.533 10.567 1.00 0.00 H new ATOM 0 HG2 GLU A 5 5.068 7.109 12.543 1.00 0.00 H new ATOM 0 HG3 GLU A 5 4.414 8.629 13.122 1.00 0.00 H new ATOM 85 N LEU A 6 2.750 9.330 8.846 1.00 0.00 N ATOM 86 CA LEU A 6 3.097 9.861 7.497 1.00 0.00 C ATOM 87 C LEU A 6 2.745 11.353 7.401 1.00 0.00 C ATOM 88 O LEU A 6 3.393 12.098 6.688 1.00 0.00 O ATOM 89 CB LEU A 6 2.265 9.043 6.508 1.00 0.00 C ATOM 90 CG LEU A 6 2.965 7.714 6.218 1.00 0.00 C ATOM 91 CD1 LEU A 6 1.932 6.581 6.201 1.00 0.00 C ATOM 92 CD2 LEU A 6 3.663 7.791 4.857 1.00 0.00 C ATOM 0 H LEU A 6 2.059 8.580 8.858 1.00 0.00 H new ATOM 0 HA LEU A 6 4.164 9.776 7.289 1.00 0.00 H new ATOM 0 HB2 LEU A 6 1.272 8.860 6.918 1.00 0.00 H new ATOM 0 HB3 LEU A 6 2.129 9.603 5.583 1.00 0.00 H new ATOM 0 HG LEU A 6 3.704 7.517 6.995 1.00 0.00 H new ATOM 0 HD11 LEU A 6 2.433 5.635 5.994 1.00 0.00 H new ATOM 0 HD12 LEU A 6 1.437 6.525 7.171 1.00 0.00 H new ATOM 0 HD13 LEU A 6 1.191 6.776 5.426 1.00 0.00 H new ATOM 0 HD21 LEU A 6 4.162 6.844 4.650 1.00 0.00 H new ATOM 0 HD22 LEU A 6 2.925 7.990 4.080 1.00 0.00 H new ATOM 0 HD23 LEU A 6 4.400 8.594 4.871 1.00 0.00 H new ATOM 104 N ILE A 7 1.741 11.815 8.117 1.00 0.00 N ATOM 105 CA ILE A 7 1.413 13.272 8.029 1.00 0.00 C ATOM 106 C ILE A 7 2.626 14.051 8.498 1.00 0.00 C ATOM 107 O ILE A 7 3.046 14.998 7.871 1.00 0.00 O ATOM 108 CB ILE A 7 0.170 13.553 8.906 1.00 0.00 C ATOM 109 CG1 ILE A 7 0.539 13.741 10.386 1.00 0.00 C ATOM 110 CG2 ILE A 7 -0.848 12.421 8.773 1.00 0.00 C ATOM 111 CD1 ILE A 7 0.895 15.207 10.644 1.00 0.00 C ATOM 0 H ILE A 7 1.152 11.262 8.740 1.00 0.00 H new ATOM 0 HA ILE A 7 1.178 13.576 7.009 1.00 0.00 H new ATOM 0 HB ILE A 7 -0.269 14.484 8.546 1.00 0.00 H new ATOM 0 HG12 ILE A 7 -0.296 13.442 11.020 1.00 0.00 H new ATOM 0 HG13 ILE A 7 1.382 13.100 10.645 1.00 0.00 H new ATOM 0 HG21 ILE A 7 -1.715 12.636 9.397 1.00 0.00 H new ATOM 0 HG22 ILE A 7 -1.162 12.334 7.733 1.00 0.00 H new ATOM 0 HG23 ILE A 7 -0.394 11.484 9.094 1.00 0.00 H new ATOM 0 HD11 ILE A 7 1.156 15.339 11.694 1.00 0.00 H new ATOM 0 HD12 ILE A 7 1.743 15.491 10.021 1.00 0.00 H new ATOM 0 HD13 ILE A 7 0.039 15.837 10.401 1.00 0.00 H new ATOM 123 N LYS A 8 3.223 13.622 9.574 1.00 0.00 N ATOM 124 CA LYS A 8 4.445 14.309 10.054 1.00 0.00 C ATOM 125 C LYS A 8 5.533 14.122 8.998 1.00 0.00 C ATOM 126 O LYS A 8 6.354 14.989 8.774 1.00 0.00 O ATOM 127 CB LYS A 8 4.800 13.630 11.392 1.00 0.00 C ATOM 128 CG LYS A 8 6.178 12.959 11.321 1.00 0.00 C ATOM 129 CD LYS A 8 6.351 12.018 12.512 1.00 0.00 C ATOM 130 CE LYS A 8 5.960 10.599 12.095 1.00 0.00 C ATOM 131 NZ LYS A 8 6.974 9.715 12.733 1.00 0.00 N ATOM 0 H LYS A 8 2.917 12.829 10.137 1.00 0.00 H new ATOM 0 HA LYS A 8 4.322 15.381 10.208 1.00 0.00 H new ATOM 0 HB2 LYS A 8 4.793 14.370 12.192 1.00 0.00 H new ATOM 0 HB3 LYS A 8 4.042 12.887 11.639 1.00 0.00 H new ATOM 0 HG2 LYS A 8 6.276 12.403 10.388 1.00 0.00 H new ATOM 0 HG3 LYS A 8 6.963 13.715 11.325 1.00 0.00 H new ATOM 0 HD2 LYS A 8 7.385 12.036 12.858 1.00 0.00 H new ATOM 0 HD3 LYS A 8 5.731 12.349 13.345 1.00 0.00 H new ATOM 0 HE2 LYS A 8 4.953 10.352 12.432 1.00 0.00 H new ATOM 0 HE3 LYS A 8 5.968 10.490 11.010 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 6.771 8.724 12.492 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 7.922 9.968 12.388 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 6.938 9.834 13.765 1.00 0.00 H new ATOM 145 N ALA A 9 5.524 12.994 8.328 1.00 0.00 N ATOM 146 CA ALA A 9 6.535 12.755 7.265 1.00 0.00 C ATOM 147 C ALA A 9 6.460 13.881 6.241 1.00 0.00 C ATOM 148 O ALA A 9 7.468 14.362 5.761 1.00 0.00 O ATOM 149 CB ALA A 9 6.138 11.432 6.628 1.00 0.00 C ATOM 0 H ALA A 9 4.860 12.234 8.475 1.00 0.00 H new ATOM 0 HA ALA A 9 7.554 12.724 7.651 1.00 0.00 H new ATOM 0 HB1 ALA A 9 6.840 11.187 5.831 1.00 0.00 H new ATOM 0 HB2 ALA A 9 6.156 10.645 7.382 1.00 0.00 H new ATOM 0 HB3 ALA A 9 5.133 11.515 6.214 1.00 0.00 H new ATOM 155 N ILE A 10 5.272 14.334 5.928 1.00 0.00 N ATOM 156 CA ILE A 10 5.144 15.449 4.975 1.00 0.00 C ATOM 157 C ILE A 10 5.153 16.729 5.794 1.00 0.00 C ATOM 158 O ILE A 10 5.673 17.745 5.391 1.00 0.00 O ATOM 159 CB ILE A 10 3.791 15.222 4.269 1.00 0.00 C ATOM 160 CG1 ILE A 10 4.024 14.804 2.814 1.00 0.00 C ATOM 161 CG2 ILE A 10 2.952 16.506 4.284 1.00 0.00 C ATOM 162 CD1 ILE A 10 4.795 13.481 2.772 1.00 0.00 C ATOM 0 H ILE A 10 4.393 13.972 6.297 1.00 0.00 H new ATOM 0 HA ILE A 10 5.941 15.512 4.234 1.00 0.00 H new ATOM 0 HB ILE A 10 3.258 14.435 4.803 1.00 0.00 H new ATOM 0 HG12 ILE A 10 3.069 14.696 2.300 1.00 0.00 H new ATOM 0 HG13 ILE A 10 4.583 15.578 2.289 1.00 0.00 H new ATOM 0 HG21 ILE A 10 2.002 16.326 3.781 1.00 0.00 H new ATOM 0 HG22 ILE A 10 2.766 16.807 5.315 1.00 0.00 H new ATOM 0 HG23 ILE A 10 3.491 17.299 3.766 1.00 0.00 H new ATOM 0 HD11 ILE A 10 4.958 13.188 1.735 1.00 0.00 H new ATOM 0 HD12 ILE A 10 5.757 13.604 3.270 1.00 0.00 H new ATOM 0 HD13 ILE A 10 4.219 12.708 3.281 1.00 0.00 H new ATOM 174 N ALA A 11 4.619 16.679 6.969 1.00 0.00 N ATOM 175 CA ALA A 11 4.642 17.892 7.806 1.00 0.00 C ATOM 176 C ALA A 11 6.100 18.254 8.104 1.00 0.00 C ATOM 177 O ALA A 11 6.402 19.341 8.556 1.00 0.00 O ATOM 178 CB ALA A 11 3.889 17.500 9.073 1.00 0.00 C ATOM 0 H ALA A 11 4.172 15.861 7.383 1.00 0.00 H new ATOM 0 HA ALA A 11 4.185 18.762 7.334 1.00 0.00 H new ATOM 0 HB1 ALA A 11 3.858 18.349 9.756 1.00 0.00 H new ATOM 0 HB2 ALA A 11 2.872 17.205 8.815 1.00 0.00 H new ATOM 0 HB3 ALA A 11 4.398 16.665 9.555 1.00 0.00 H new ATOM 184 N GLN A 12 7.011 17.344 7.837 1.00 0.00 N ATOM 185 CA GLN A 12 8.445 17.634 8.087 1.00 0.00 C ATOM 186 C GLN A 12 9.222 17.641 6.764 1.00 0.00 C ATOM 187 O GLN A 12 10.034 18.515 6.525 1.00 0.00 O ATOM 188 CB GLN A 12 8.923 16.517 9.031 1.00 0.00 C ATOM 189 CG GLN A 12 9.213 15.232 8.246 1.00 0.00 C ATOM 190 CD GLN A 12 9.692 14.143 9.208 1.00 0.00 C ATOM 191 OE1 GLN A 12 8.822 13.334 9.746 1.00 0.00 O flip ATOM 192 NE2 GLN A 12 10.873 14.027 9.471 1.00 0.00 N flip ATOM 0 H GLN A 12 6.815 16.418 7.458 1.00 0.00 H new ATOM 0 HA GLN A 12 8.605 18.615 8.534 1.00 0.00 H new ATOM 0 HB2 GLN A 12 9.822 16.838 9.557 1.00 0.00 H new ATOM 0 HB3 GLN A 12 8.163 16.323 9.788 1.00 0.00 H new ATOM 0 HG2 GLN A 12 8.315 14.902 7.724 1.00 0.00 H new ATOM 0 HG3 GLN A 12 9.972 15.421 7.487 1.00 0.00 H new ATOM 0 HE21 GLN A 12 11.554 14.660 9.050 1.00 0.00 H new ATOM 0 HE22 GLN A 12 11.183 13.297 10.112 1.00 0.00 H new ATOM 201 N ASP A 13 8.956 16.708 5.882 1.00 0.00 N ATOM 202 CA ASP A 13 9.663 16.726 4.568 1.00 0.00 C ATOM 203 C ASP A 13 9.129 17.922 3.799 1.00 0.00 C ATOM 204 O ASP A 13 9.812 18.562 3.023 1.00 0.00 O ATOM 205 CB ASP A 13 9.274 15.425 3.868 1.00 0.00 C ATOM 206 CG ASP A 13 9.993 14.250 4.535 1.00 0.00 C ATOM 207 OD1 ASP A 13 11.145 14.415 4.898 1.00 0.00 O ATOM 208 OD2 ASP A 13 9.378 13.206 4.670 1.00 0.00 O ATOM 0 H ASP A 13 8.290 15.947 6.014 1.00 0.00 H new ATOM 0 HA ASP A 13 10.747 16.803 4.652 1.00 0.00 H new ATOM 0 HB2 ASP A 13 8.195 15.281 3.919 1.00 0.00 H new ATOM 0 HB3 ASP A 13 9.539 15.475 2.812 1.00 0.00 H new ATOM 213 N THR A 14 7.893 18.223 4.057 1.00 0.00 N ATOM 214 CA THR A 14 7.221 19.372 3.423 1.00 0.00 C ATOM 215 C THR A 14 7.250 20.531 4.433 1.00 0.00 C ATOM 216 O THR A 14 7.953 21.506 4.258 1.00 0.00 O ATOM 217 CB THR A 14 5.802 18.842 3.169 1.00 0.00 C ATOM 218 OG1 THR A 14 5.765 17.454 3.445 1.00 0.00 O ATOM 219 CG2 THR A 14 5.418 19.013 1.721 1.00 0.00 C ATOM 0 H THR A 14 7.305 17.698 4.705 1.00 0.00 H new ATOM 0 HA THR A 14 7.670 19.743 2.502 1.00 0.00 H new ATOM 0 HB THR A 14 5.117 19.398 3.808 1.00 0.00 H new ATOM 0 HG1 THR A 14 6.259 16.969 2.751 1.00 0.00 H new ATOM 0 HG21 THR A 14 4.409 18.631 1.564 1.00 0.00 H new ATOM 0 HG22 THR A 14 5.450 20.070 1.458 1.00 0.00 H new ATOM 0 HG23 THR A 14 6.117 18.462 1.092 1.00 0.00 H new ATOM 227 N GLY A 15 6.527 20.396 5.516 1.00 0.00 N ATOM 228 CA GLY A 15 6.538 21.445 6.590 1.00 0.00 C ATOM 229 C GLY A 15 6.232 22.829 6.021 1.00 0.00 C ATOM 230 O GLY A 15 6.589 23.840 6.596 1.00 0.00 O ATOM 0 H GLY A 15 5.922 19.597 5.707 1.00 0.00 H new ATOM 0 HA2 GLY A 15 5.802 21.193 7.354 1.00 0.00 H new ATOM 0 HA3 GLY A 15 7.513 21.458 7.078 1.00 0.00 H new ATOM 234 N LEU A 16 5.569 22.880 4.911 1.00 0.00 N ATOM 235 CA LEU A 16 5.222 24.206 4.303 1.00 0.00 C ATOM 236 C LEU A 16 4.214 24.931 5.177 1.00 0.00 C ATOM 237 O LEU A 16 4.503 25.934 5.799 1.00 0.00 O ATOM 238 CB LEU A 16 4.570 23.892 2.959 1.00 0.00 C ATOM 239 CG LEU A 16 5.578 23.221 2.049 1.00 0.00 C ATOM 240 CD1 LEU A 16 5.401 21.715 2.130 1.00 0.00 C ATOM 241 CD2 LEU A 16 5.345 23.677 0.603 1.00 0.00 C ATOM 0 H LEU A 16 5.246 22.066 4.388 1.00 0.00 H new ATOM 0 HA LEU A 16 6.106 24.836 4.200 1.00 0.00 H new ATOM 0 HB2 LEU A 16 3.708 23.242 3.105 1.00 0.00 H new ATOM 0 HB3 LEU A 16 4.203 24.809 2.498 1.00 0.00 H new ATOM 0 HG LEU A 16 6.587 23.493 2.361 1.00 0.00 H new ATOM 0 HD11 LEU A 16 6.125 21.228 1.476 1.00 0.00 H new ATOM 0 HD12 LEU A 16 5.559 21.385 3.157 1.00 0.00 H new ATOM 0 HD13 LEU A 16 4.392 21.450 1.815 1.00 0.00 H new ATOM 0 HD21 LEU A 16 6.070 23.194 -0.052 1.00 0.00 H new ATOM 0 HD22 LEU A 16 4.337 23.402 0.293 1.00 0.00 H new ATOM 0 HD23 LEU A 16 5.462 24.759 0.539 1.00 0.00 H new ATOM 253 N THR A 17 3.026 24.415 5.215 1.00 0.00 N ATOM 254 CA THR A 17 1.958 25.029 6.025 1.00 0.00 C ATOM 255 C THR A 17 1.309 23.950 6.881 1.00 0.00 C ATOM 256 O THR A 17 0.292 24.170 7.512 1.00 0.00 O ATOM 257 CB THR A 17 0.966 25.577 4.985 1.00 0.00 C ATOM 258 OG1 THR A 17 0.395 26.786 5.465 1.00 0.00 O ATOM 259 CG2 THR A 17 -0.145 24.556 4.717 1.00 0.00 C ATOM 0 H THR A 17 2.747 23.576 4.707 1.00 0.00 H new ATOM 0 HA THR A 17 2.310 25.810 6.699 1.00 0.00 H new ATOM 0 HB THR A 17 1.501 25.767 4.054 1.00 0.00 H new ATOM 0 HG1 THR A 17 -0.236 27.136 4.802 1.00 0.00 H new ATOM 0 HG21 THR A 17 -0.839 24.959 3.979 1.00 0.00 H new ATOM 0 HG22 THR A 17 0.293 23.633 4.338 1.00 0.00 H new ATOM 0 HG23 THR A 17 -0.681 24.349 5.644 1.00 0.00 H new ATOM 267 N GLN A 18 1.854 22.760 6.855 1.00 0.00 N ATOM 268 CA GLN A 18 1.221 21.646 7.600 1.00 0.00 C ATOM 269 C GLN A 18 -0.202 21.528 7.079 1.00 0.00 C ATOM 270 O GLN A 18 -1.104 21.109 7.773 1.00 0.00 O ATOM 271 CB GLN A 18 1.250 22.039 9.082 1.00 0.00 C ATOM 272 CG GLN A 18 2.614 22.635 9.430 1.00 0.00 C ATOM 273 CD GLN A 18 2.834 22.566 10.943 1.00 0.00 C ATOM 274 OE1 GLN A 18 1.888 22.560 11.705 1.00 0.00 O ATOM 275 NE2 GLN A 18 4.051 22.513 11.411 1.00 0.00 N ATOM 0 H GLN A 18 2.707 22.519 6.350 1.00 0.00 H new ATOM 0 HA GLN A 18 1.726 20.688 7.475 1.00 0.00 H new ATOM 0 HB2 GLN A 18 0.462 22.762 9.292 1.00 0.00 H new ATOM 0 HB3 GLN A 18 1.055 21.165 9.704 1.00 0.00 H new ATOM 0 HG2 GLN A 18 3.403 22.090 8.912 1.00 0.00 H new ATOM 0 HG3 GLN A 18 2.667 23.670 9.092 1.00 0.00 H new ATOM 0 HE21 GLN A 18 4.845 22.518 10.770 1.00 0.00 H new ATOM 0 HE22 GLN A 18 4.209 22.466 12.418 1.00 0.00 H new ATOM 284 N VAL A 19 -0.375 21.927 5.832 1.00 0.00 N ATOM 285 CA VAL A 19 -1.707 21.898 5.151 1.00 0.00 C ATOM 286 C VAL A 19 -2.726 21.148 6.010 1.00 0.00 C ATOM 287 O VAL A 19 -3.281 21.683 6.951 1.00 0.00 O ATOM 288 CB VAL A 19 -1.426 21.217 3.772 1.00 0.00 C ATOM 289 CG1 VAL A 19 -0.369 20.125 3.912 1.00 0.00 C ATOM 290 CG2 VAL A 19 -2.679 20.572 3.164 1.00 0.00 C ATOM 0 H VAL A 19 0.381 22.282 5.246 1.00 0.00 H new ATOM 0 HA VAL A 19 -2.146 22.885 5.004 1.00 0.00 H new ATOM 0 HB VAL A 19 -1.080 22.014 3.114 1.00 0.00 H new ATOM 0 HG11 VAL A 19 -0.190 19.665 2.940 1.00 0.00 H new ATOM 0 HG12 VAL A 19 0.558 20.562 4.283 1.00 0.00 H new ATOM 0 HG13 VAL A 19 -0.719 19.367 4.613 1.00 0.00 H new ATOM 0 HG21 VAL A 19 -2.425 20.115 2.208 1.00 0.00 H new ATOM 0 HG22 VAL A 19 -3.060 19.808 3.842 1.00 0.00 H new ATOM 0 HG23 VAL A 19 -3.443 21.335 3.010 1.00 0.00 H new ATOM 300 N SER A 20 -2.936 19.922 5.716 1.00 0.00 N ATOM 301 CA SER A 20 -3.845 19.090 6.487 1.00 0.00 C ATOM 302 C SER A 20 -3.135 17.765 6.669 1.00 0.00 C ATOM 303 O SER A 20 -3.763 16.748 6.792 1.00 0.00 O ATOM 304 CB SER A 20 -5.111 18.986 5.645 1.00 0.00 C ATOM 305 OG SER A 20 -5.135 17.748 4.962 1.00 0.00 O ATOM 0 H SER A 20 -2.491 19.442 4.933 1.00 0.00 H new ATOM 0 HA SER A 20 -4.115 19.470 7.472 1.00 0.00 H new ATOM 0 HB2 SER A 20 -5.990 19.077 6.282 1.00 0.00 H new ATOM 0 HB3 SER A 20 -5.150 19.807 4.929 1.00 0.00 H new ATOM 0 HG SER A 20 -5.987 17.653 4.488 1.00 0.00 H new ATOM 311 N VAL A 21 -1.812 17.771 6.614 1.00 0.00 N ATOM 312 CA VAL A 21 -1.004 16.517 6.731 1.00 0.00 C ATOM 313 C VAL A 21 -1.835 15.411 7.345 1.00 0.00 C ATOM 314 O VAL A 21 -1.804 14.267 6.928 1.00 0.00 O ATOM 315 CB VAL A 21 0.163 16.892 7.643 1.00 0.00 C ATOM 316 CG1 VAL A 21 1.021 17.959 6.962 1.00 0.00 C ATOM 317 CG2 VAL A 21 -0.364 17.441 8.973 1.00 0.00 C ATOM 0 H VAL A 21 -1.255 18.616 6.490 1.00 0.00 H new ATOM 0 HA VAL A 21 -0.664 16.148 5.764 1.00 0.00 H new ATOM 0 HB VAL A 21 0.763 16.002 7.834 1.00 0.00 H new ATOM 0 HG11 VAL A 21 1.853 18.226 7.613 1.00 0.00 H new ATOM 0 HG12 VAL A 21 1.407 17.569 6.020 1.00 0.00 H new ATOM 0 HG13 VAL A 21 0.415 18.843 6.767 1.00 0.00 H new ATOM 0 HG21 VAL A 21 0.476 17.705 9.616 1.00 0.00 H new ATOM 0 HG22 VAL A 21 -0.971 18.327 8.786 1.00 0.00 H new ATOM 0 HG23 VAL A 21 -0.972 16.682 9.465 1.00 0.00 H new ATOM 327 N SER A 22 -2.613 15.781 8.300 1.00 0.00 N ATOM 328 CA SER A 22 -3.508 14.791 8.960 1.00 0.00 C ATOM 329 C SER A 22 -4.738 14.574 8.086 1.00 0.00 C ATOM 330 O SER A 22 -5.243 13.477 7.957 1.00 0.00 O ATOM 331 CB SER A 22 -3.892 15.418 10.299 1.00 0.00 C ATOM 332 OG SER A 22 -2.836 15.220 11.231 1.00 0.00 O ATOM 0 H SER A 22 -2.676 16.732 8.663 1.00 0.00 H new ATOM 0 HA SER A 22 -3.033 13.821 9.106 1.00 0.00 H new ATOM 0 HB2 SER A 22 -4.086 16.483 10.173 1.00 0.00 H new ATOM 0 HB3 SER A 22 -4.812 14.969 10.673 1.00 0.00 H new ATOM 0 HG SER A 22 -3.079 15.623 12.091 1.00 0.00 H new ATOM 338 N LYS A 23 -5.208 15.621 7.478 1.00 0.00 N ATOM 339 CA LYS A 23 -6.390 15.522 6.598 1.00 0.00 C ATOM 340 C LYS A 23 -5.985 15.171 5.161 1.00 0.00 C ATOM 341 O LYS A 23 -6.738 14.533 4.457 1.00 0.00 O ATOM 342 CB LYS A 23 -7.023 16.909 6.651 1.00 0.00 C ATOM 343 CG LYS A 23 -8.403 16.828 7.298 1.00 0.00 C ATOM 344 CD LYS A 23 -9.018 18.232 7.390 1.00 0.00 C ATOM 345 CE LYS A 23 -8.815 18.984 6.068 1.00 0.00 C ATOM 346 NZ LYS A 23 -10.026 19.840 5.921 1.00 0.00 N ATOM 0 H LYS A 23 -4.813 16.558 7.558 1.00 0.00 H new ATOM 0 HA LYS A 23 -7.073 14.736 6.920 1.00 0.00 H new ATOM 0 HB2 LYS A 23 -6.386 17.587 7.218 1.00 0.00 H new ATOM 0 HB3 LYS A 23 -7.108 17.318 5.644 1.00 0.00 H new ATOM 0 HG2 LYS A 23 -9.051 16.175 6.713 1.00 0.00 H new ATOM 0 HG3 LYS A 23 -8.323 16.390 8.293 1.00 0.00 H new ATOM 0 HD2 LYS A 23 -10.082 18.157 7.615 1.00 0.00 H new ATOM 0 HD3 LYS A 23 -8.557 18.787 8.207 1.00 0.00 H new ATOM 0 HE2 LYS A 23 -7.907 19.586 6.092 1.00 0.00 H new ATOM 0 HE3 LYS A 23 -8.717 18.292 5.231 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 -9.960 20.386 5.038 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 -10.875 19.239 5.894 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 -10.090 20.493 6.728 1.00 0.00 H new ATOM 360 N MET A 24 -4.816 15.571 4.697 1.00 0.00 N ATOM 361 CA MET A 24 -4.463 15.217 3.296 1.00 0.00 C ATOM 362 C MET A 24 -4.102 13.736 3.230 1.00 0.00 C ATOM 363 O MET A 24 -4.456 13.056 2.285 1.00 0.00 O ATOM 364 CB MET A 24 -3.304 16.116 2.811 1.00 0.00 C ATOM 365 CG MET A 24 -2.542 16.785 3.956 1.00 0.00 C ATOM 366 SD MET A 24 -0.795 16.769 3.539 1.00 0.00 S ATOM 367 CE MET A 24 -0.674 14.986 3.729 1.00 0.00 C ATOM 0 H MET A 24 -4.120 16.108 5.214 1.00 0.00 H new ATOM 0 HA MET A 24 -5.312 15.388 2.634 1.00 0.00 H new ATOM 0 HB2 MET A 24 -2.610 15.517 2.222 1.00 0.00 H new ATOM 0 HB3 MET A 24 -3.702 16.885 2.149 1.00 0.00 H new ATOM 0 HG2 MET A 24 -2.891 17.808 4.100 1.00 0.00 H new ATOM 0 HG3 MET A 24 -2.716 16.254 4.892 1.00 0.00 H new ATOM 0 HE1 MET A 24 0.316 14.726 4.103 1.00 0.00 H new ATOM 0 HE2 MET A 24 -1.430 14.643 4.435 1.00 0.00 H new ATOM 0 HE3 MET A 24 -0.835 14.506 2.764 1.00 0.00 H new ATOM 377 N LEU A 25 -3.450 13.198 4.233 1.00 0.00 N ATOM 378 CA LEU A 25 -3.162 11.741 4.180 1.00 0.00 C ATOM 379 C LEU A 25 -4.443 10.999 4.534 1.00 0.00 C ATOM 380 O LEU A 25 -4.857 10.088 3.843 1.00 0.00 O ATOM 381 CB LEU A 25 -2.086 11.474 5.214 1.00 0.00 C ATOM 382 CG LEU A 25 -0.713 11.661 4.575 1.00 0.00 C ATOM 383 CD1 LEU A 25 0.363 11.403 5.620 1.00 0.00 C ATOM 384 CD2 LEU A 25 -0.538 10.670 3.419 1.00 0.00 C ATOM 0 H LEU A 25 -3.116 13.692 5.061 1.00 0.00 H new ATOM 0 HA LEU A 25 -2.825 11.413 3.197 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -2.202 12.153 6.059 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -2.183 10.461 5.603 1.00 0.00 H new ATOM 0 HG LEU A 25 -0.628 12.679 4.194 1.00 0.00 H new ATOM 0 HD11 LEU A 25 1.347 11.535 5.170 1.00 0.00 H new ATOM 0 HD12 LEU A 25 0.245 12.105 6.445 1.00 0.00 H new ATOM 0 HD13 LEU A 25 0.269 10.384 5.995 1.00 0.00 H new ATOM 0 HD21 LEU A 25 0.444 10.808 2.967 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -0.623 9.651 3.797 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -1.310 10.845 2.670 1.00 0.00 H new ATOM 396 N ALA A 26 -5.100 11.412 5.591 1.00 0.00 N ATOM 397 CA ALA A 26 -6.385 10.759 5.965 1.00 0.00 C ATOM 398 C ALA A 26 -7.312 10.818 4.756 1.00 0.00 C ATOM 399 O ALA A 26 -8.080 9.912 4.499 1.00 0.00 O ATOM 400 CB ALA A 26 -6.948 11.585 7.121 1.00 0.00 C ATOM 0 H ALA A 26 -4.801 12.169 6.205 1.00 0.00 H new ATOM 0 HA ALA A 26 -6.269 9.716 6.260 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -7.897 11.157 7.446 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -6.243 11.576 7.952 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -7.107 12.612 6.791 1.00 0.00 H new ATOM 406 N SER A 27 -7.207 11.873 3.985 1.00 0.00 N ATOM 407 CA SER A 27 -8.043 11.980 2.764 1.00 0.00 C ATOM 408 C SER A 27 -7.417 11.106 1.684 1.00 0.00 C ATOM 409 O SER A 27 -8.104 10.502 0.895 1.00 0.00 O ATOM 410 CB SER A 27 -8.025 13.452 2.359 1.00 0.00 C ATOM 411 OG SER A 27 -6.698 13.841 2.046 1.00 0.00 O ATOM 0 H SER A 27 -6.579 12.659 4.153 1.00 0.00 H new ATOM 0 HA SER A 27 -9.069 11.649 2.921 1.00 0.00 H new ATOM 0 HB2 SER A 27 -8.674 13.611 1.498 1.00 0.00 H new ATOM 0 HB3 SER A 27 -8.414 14.068 3.170 1.00 0.00 H new ATOM 0 HG SER A 27 -6.083 13.108 2.260 1.00 0.00 H new ATOM 417 N PHE A 28 -6.108 11.012 1.668 1.00 0.00 N ATOM 418 CA PHE A 28 -5.433 10.142 0.657 1.00 0.00 C ATOM 419 C PHE A 28 -5.795 8.693 0.949 1.00 0.00 C ATOM 420 O PHE A 28 -5.918 7.882 0.065 1.00 0.00 O ATOM 421 CB PHE A 28 -3.930 10.384 0.833 1.00 0.00 C ATOM 422 CG PHE A 28 -3.166 9.071 0.879 1.00 0.00 C ATOM 423 CD1 PHE A 28 -2.855 8.383 -0.305 1.00 0.00 C ATOM 424 CD2 PHE A 28 -2.735 8.562 2.109 1.00 0.00 C ATOM 425 CE1 PHE A 28 -2.120 7.198 -0.249 1.00 0.00 C ATOM 426 CE2 PHE A 28 -1.991 7.382 2.160 1.00 0.00 C ATOM 427 CZ PHE A 28 -1.684 6.700 0.981 1.00 0.00 C ATOM 0 H PHE A 28 -5.482 11.499 2.309 1.00 0.00 H new ATOM 0 HA PHE A 28 -5.736 10.363 -0.366 1.00 0.00 H new ATOM 0 HB2 PHE A 28 -3.558 10.996 0.011 1.00 0.00 H new ATOM 0 HB3 PHE A 28 -3.754 10.943 1.752 1.00 0.00 H new ATOM 0 HD1 PHE A 28 -3.184 8.770 -1.258 1.00 0.00 H new ATOM 0 HD2 PHE A 28 -2.979 9.084 3.022 1.00 0.00 H new ATOM 0 HE1 PHE A 28 -1.888 6.665 -1.159 1.00 0.00 H new ATOM 0 HE2 PHE A 28 -1.653 6.997 3.111 1.00 0.00 H new ATOM 0 HZ PHE A 28 -1.109 5.787 1.020 1.00 0.00 H new ATOM 437 N GLU A 29 -6.007 8.381 2.184 1.00 0.00 N ATOM 438 CA GLU A 29 -6.405 7.011 2.543 1.00 0.00 C ATOM 439 C GLU A 29 -7.899 6.945 2.412 1.00 0.00 C ATOM 440 O GLU A 29 -8.464 5.959 1.994 1.00 0.00 O ATOM 441 CB GLU A 29 -5.922 6.852 3.971 1.00 0.00 C ATOM 442 CG GLU A 29 -4.472 6.407 3.894 1.00 0.00 C ATOM 443 CD GLU A 29 -3.641 7.093 4.978 1.00 0.00 C ATOM 444 OE1 GLU A 29 -3.594 8.312 4.979 1.00 0.00 O ATOM 445 OE2 GLU A 29 -3.060 6.388 5.786 1.00 0.00 O ATOM 0 H GLU A 29 -5.920 9.026 2.969 1.00 0.00 H new ATOM 0 HA GLU A 29 -5.992 6.216 1.922 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -6.010 7.792 4.516 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -6.525 6.117 4.504 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -4.411 5.325 4.012 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -4.065 6.644 2.911 1.00 0.00 H new ATOM 452 N LYS A 30 -8.535 8.033 2.697 1.00 0.00 N ATOM 453 CA LYS A 30 -9.994 8.086 2.514 1.00 0.00 C ATOM 454 C LYS A 30 -10.267 8.052 1.015 1.00 0.00 C ATOM 455 O LYS A 30 -11.255 7.528 0.587 1.00 0.00 O ATOM 456 CB LYS A 30 -10.456 9.410 3.116 1.00 0.00 C ATOM 457 CG LYS A 30 -11.971 9.536 2.946 1.00 0.00 C ATOM 458 CD LYS A 30 -12.513 10.578 3.927 1.00 0.00 C ATOM 459 CE LYS A 30 -13.901 10.151 4.412 1.00 0.00 C ATOM 460 NZ LYS A 30 -14.852 10.756 3.439 1.00 0.00 N ATOM 0 H LYS A 30 -8.106 8.888 3.049 1.00 0.00 H new ATOM 0 HA LYS A 30 -10.516 7.256 2.990 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -10.191 9.455 4.172 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -9.952 10.242 2.625 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -12.209 9.827 1.923 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -12.448 8.572 3.123 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -11.836 10.681 4.775 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -12.569 11.553 3.443 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -13.995 9.065 4.433 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -14.092 10.507 5.424 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -15.826 10.507 3.705 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -14.745 11.790 3.446 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -14.650 10.393 2.485 1.00 0.00 H new ATOM 474 N ILE A 31 -9.369 8.586 0.209 1.00 0.00 N ATOM 475 CA ILE A 31 -9.577 8.554 -1.267 1.00 0.00 C ATOM 476 C ILE A 31 -8.932 7.300 -1.841 1.00 0.00 C ATOM 477 O ILE A 31 -9.457 6.683 -2.734 1.00 0.00 O ATOM 478 CB ILE A 31 -8.938 9.816 -1.837 1.00 0.00 C ATOM 479 CG1 ILE A 31 -7.457 9.875 -1.510 1.00 0.00 C ATOM 480 CG2 ILE A 31 -9.645 11.049 -1.276 1.00 0.00 C ATOM 481 CD1 ILE A 31 -6.646 9.596 -2.778 1.00 0.00 C ATOM 0 H ILE A 31 -8.508 9.038 0.516 1.00 0.00 H new ATOM 0 HA ILE A 31 -10.636 8.527 -1.525 1.00 0.00 H new ATOM 0 HB ILE A 31 -9.045 9.795 -2.922 1.00 0.00 H new ATOM 0 HG12 ILE A 31 -7.200 10.856 -1.109 1.00 0.00 H new ATOM 0 HG13 ILE A 31 -7.214 9.142 -0.741 1.00 0.00 H new ATOM 0 HG21 ILE A 31 -9.186 11.949 -1.685 1.00 0.00 H new ATOM 0 HG22 ILE A 31 -10.699 11.021 -1.552 1.00 0.00 H new ATOM 0 HG23 ILE A 31 -9.555 11.057 -0.190 1.00 0.00 H new ATOM 0 HD11 ILE A 31 -5.582 9.638 -2.546 1.00 0.00 H new ATOM 0 HD12 ILE A 31 -6.896 8.606 -3.159 1.00 0.00 H new ATOM 0 HD13 ILE A 31 -6.882 10.346 -3.533 1.00 0.00 H new ATOM 493 N ILE A 32 -7.816 6.890 -1.308 1.00 0.00 N ATOM 494 CA ILE A 32 -7.186 5.629 -1.804 1.00 0.00 C ATOM 495 C ILE A 32 -8.197 4.532 -1.613 1.00 0.00 C ATOM 496 O ILE A 32 -8.571 3.818 -2.522 1.00 0.00 O ATOM 497 CB ILE A 32 -5.992 5.333 -0.893 1.00 0.00 C ATOM 498 CG1 ILE A 32 -4.782 6.153 -1.333 1.00 0.00 C ATOM 499 CG2 ILE A 32 -5.641 3.838 -0.964 1.00 0.00 C ATOM 500 CD1 ILE A 32 -4.133 5.524 -2.567 1.00 0.00 C ATOM 0 H ILE A 32 -7.315 7.366 -0.558 1.00 0.00 H new ATOM 0 HA ILE A 32 -6.876 5.707 -2.846 1.00 0.00 H new ATOM 0 HB ILE A 32 -6.257 5.599 0.130 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -5.089 7.175 -1.556 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -4.057 6.208 -0.521 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -4.791 3.633 -0.314 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -6.497 3.247 -0.639 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -5.386 3.573 -1.990 1.00 0.00 H new ATOM 0 HD11 ILE A 32 -3.272 6.120 -2.869 1.00 0.00 H new ATOM 0 HD12 ILE A 32 -3.808 4.511 -2.331 1.00 0.00 H new ATOM 0 HD13 ILE A 32 -4.856 5.492 -3.382 1.00 0.00 H new ATOM 512 N THR A 33 -8.639 4.412 -0.399 1.00 0.00 N ATOM 513 CA THR A 33 -9.630 3.384 -0.078 1.00 0.00 C ATOM 514 C THR A 33 -10.913 3.680 -0.865 1.00 0.00 C ATOM 515 O THR A 33 -11.602 2.790 -1.337 1.00 0.00 O ATOM 516 CB THR A 33 -9.826 3.490 1.447 1.00 0.00 C ATOM 517 OG1 THR A 33 -9.524 2.247 2.057 1.00 0.00 O ATOM 518 CG2 THR A 33 -11.260 3.874 1.783 1.00 0.00 C ATOM 0 H THR A 33 -8.347 4.993 0.387 1.00 0.00 H new ATOM 0 HA THR A 33 -9.329 2.372 -0.348 1.00 0.00 H new ATOM 0 HB THR A 33 -9.156 4.263 1.824 1.00 0.00 H new ATOM 0 HG1 THR A 33 -8.687 2.324 2.560 1.00 0.00 H new ATOM 0 HG21 THR A 33 -11.374 3.943 2.865 1.00 0.00 H new ATOM 0 HG22 THR A 33 -11.494 4.838 1.331 1.00 0.00 H new ATOM 0 HG23 THR A 33 -11.940 3.116 1.394 1.00 0.00 H new ATOM 526 N GLU A 34 -11.226 4.941 -1.007 1.00 0.00 N ATOM 527 CA GLU A 34 -12.454 5.338 -1.749 1.00 0.00 C ATOM 528 C GLU A 34 -12.300 5.129 -3.261 1.00 0.00 C ATOM 529 O GLU A 34 -13.181 4.581 -3.882 1.00 0.00 O ATOM 530 CB GLU A 34 -12.641 6.817 -1.429 1.00 0.00 C ATOM 531 CG GLU A 34 -13.431 6.959 -0.120 1.00 0.00 C ATOM 532 CD GLU A 34 -14.916 6.699 -0.383 1.00 0.00 C ATOM 533 OE1 GLU A 34 -15.214 5.910 -1.264 1.00 0.00 O ATOM 534 OE2 GLU A 34 -15.731 7.294 0.304 1.00 0.00 O ATOM 0 H GLU A 34 -10.678 5.717 -0.637 1.00 0.00 H new ATOM 0 HA GLU A 34 -13.311 4.733 -1.453 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -11.671 7.306 -1.336 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -13.171 7.312 -2.242 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -13.054 6.255 0.622 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -13.294 7.959 0.292 1.00 0.00 H new ATOM 541 N THR A 35 -11.211 5.552 -3.874 1.00 0.00 N ATOM 542 CA THR A 35 -11.084 5.349 -5.353 1.00 0.00 C ATOM 543 C THR A 35 -11.242 3.882 -5.682 1.00 0.00 C ATOM 544 O THR A 35 -12.031 3.516 -6.530 1.00 0.00 O ATOM 545 CB THR A 35 -9.700 5.820 -5.778 1.00 0.00 C ATOM 546 OG1 THR A 35 -9.577 7.215 -5.533 1.00 0.00 O ATOM 547 CG2 THR A 35 -9.543 5.532 -7.279 1.00 0.00 C ATOM 0 H THR A 35 -10.424 6.018 -3.423 1.00 0.00 H new ATOM 0 HA THR A 35 -11.855 5.912 -5.878 1.00 0.00 H new ATOM 0 HB THR A 35 -8.926 5.300 -5.214 1.00 0.00 H new ATOM 0 HG1 THR A 35 -9.141 7.644 -6.299 1.00 0.00 H new ATOM 0 HG21 THR A 35 -8.558 5.860 -7.611 1.00 0.00 H new ATOM 0 HG22 THR A 35 -9.648 4.462 -7.457 1.00 0.00 H new ATOM 0 HG23 THR A 35 -10.311 6.069 -7.835 1.00 0.00 H new ATOM 555 N VAL A 36 -10.517 3.033 -5.014 1.00 0.00 N ATOM 556 CA VAL A 36 -10.673 1.583 -5.294 1.00 0.00 C ATOM 557 C VAL A 36 -12.160 1.266 -5.244 1.00 0.00 C ATOM 558 O VAL A 36 -12.704 0.588 -6.094 1.00 0.00 O ATOM 559 CB VAL A 36 -9.924 0.880 -4.161 1.00 0.00 C ATOM 560 CG1 VAL A 36 -10.584 -0.467 -3.841 1.00 0.00 C ATOM 561 CG2 VAL A 36 -8.473 0.661 -4.584 1.00 0.00 C ATOM 0 H VAL A 36 -9.833 3.275 -4.297 1.00 0.00 H new ATOM 0 HA VAL A 36 -10.287 1.272 -6.265 1.00 0.00 H new ATOM 0 HB VAL A 36 -9.957 1.501 -3.266 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -10.040 -0.956 -3.033 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -11.617 -0.302 -3.535 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -10.564 -1.101 -4.727 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -7.932 0.160 -3.781 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -8.445 0.043 -5.481 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -8.005 1.623 -4.791 1.00 0.00 H new ATOM 571 N ALA A 37 -12.813 1.786 -4.250 1.00 0.00 N ATOM 572 CA ALA A 37 -14.267 1.567 -4.117 1.00 0.00 C ATOM 573 C ALA A 37 -15.028 2.582 -4.965 1.00 0.00 C ATOM 574 O ALA A 37 -16.232 2.518 -5.111 1.00 0.00 O ATOM 575 CB ALA A 37 -14.533 1.781 -2.653 1.00 0.00 C ATOM 0 H ALA A 37 -12.394 2.359 -3.518 1.00 0.00 H new ATOM 0 HA ALA A 37 -14.586 0.581 -4.455 1.00 0.00 H new ATOM 0 HB1 ALA A 37 -15.595 1.639 -2.452 1.00 0.00 H new ATOM 0 HB2 ALA A 37 -13.954 1.065 -2.070 1.00 0.00 H new ATOM 0 HB3 ALA A 37 -14.243 2.794 -2.375 1.00 0.00 H new ATOM 581 N LYS A 38 -14.325 3.497 -5.560 1.00 0.00 N ATOM 582 CA LYS A 38 -14.995 4.485 -6.445 1.00 0.00 C ATOM 583 C LYS A 38 -14.980 3.891 -7.834 1.00 0.00 C ATOM 584 O LYS A 38 -15.839 4.150 -8.655 1.00 0.00 O ATOM 585 CB LYS A 38 -14.166 5.766 -6.379 1.00 0.00 C ATOM 586 CG LYS A 38 -15.080 6.981 -6.565 1.00 0.00 C ATOM 587 CD LYS A 38 -14.743 8.043 -5.514 1.00 0.00 C ATOM 588 CE LYS A 38 -15.048 7.495 -4.117 1.00 0.00 C ATOM 589 NZ LYS A 38 -15.073 8.691 -3.230 1.00 0.00 N ATOM 0 H LYS A 38 -13.314 3.605 -5.473 1.00 0.00 H new ATOM 0 HA LYS A 38 -16.022 4.709 -6.158 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -13.652 5.829 -5.420 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -13.398 5.754 -7.153 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -14.955 7.393 -7.566 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -16.124 6.681 -6.472 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -13.691 8.320 -5.586 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -15.324 8.947 -5.696 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -16.003 6.970 -4.099 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -14.287 6.783 -3.798 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -15.487 8.433 -2.312 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -14.103 9.038 -3.087 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -15.646 9.438 -3.671 1.00 0.00 H new ATOM 603 N GLY A 39 -14.020 3.045 -8.076 1.00 0.00 N ATOM 604 CA GLY A 39 -13.946 2.370 -9.375 1.00 0.00 C ATOM 605 C GLY A 39 -12.655 2.727 -10.110 1.00 0.00 C ATOM 606 O GLY A 39 -12.647 2.862 -11.319 1.00 0.00 O ATOM 0 H GLY A 39 -13.282 2.798 -7.416 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -13.999 1.291 -9.231 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -14.805 2.653 -9.984 1.00 0.00 H new ATOM 610 N ASP A 40 -11.558 2.871 -9.410 1.00 0.00 N ATOM 611 CA ASP A 40 -10.285 3.206 -10.119 1.00 0.00 C ATOM 612 C ASP A 40 -9.090 2.539 -9.431 1.00 0.00 C ATOM 613 O ASP A 40 -9.015 2.465 -8.220 1.00 0.00 O ATOM 614 CB ASP A 40 -10.172 4.731 -10.055 1.00 0.00 C ATOM 615 CG ASP A 40 -10.309 5.315 -11.464 1.00 0.00 C ATOM 616 OD1 ASP A 40 -11.129 4.811 -12.215 1.00 0.00 O ATOM 617 OD2 ASP A 40 -9.592 6.254 -11.767 1.00 0.00 O ATOM 0 H ASP A 40 -11.487 2.773 -8.397 1.00 0.00 H new ATOM 0 HA ASP A 40 -10.288 2.847 -11.148 1.00 0.00 H new ATOM 0 HB2 ASP A 40 -10.948 5.136 -9.405 1.00 0.00 H new ATOM 0 HB3 ASP A 40 -9.213 5.017 -9.623 1.00 0.00 H new ATOM 622 N LYS A 41 -8.156 2.056 -10.207 1.00 0.00 N ATOM 623 CA LYS A 41 -6.955 1.392 -9.626 1.00 0.00 C ATOM 624 C LYS A 41 -5.845 2.424 -9.442 1.00 0.00 C ATOM 625 O LYS A 41 -5.081 2.702 -10.347 1.00 0.00 O ATOM 626 CB LYS A 41 -6.540 0.338 -10.656 1.00 0.00 C ATOM 627 CG LYS A 41 -7.708 -0.620 -10.919 1.00 0.00 C ATOM 628 CD LYS A 41 -7.962 -0.716 -12.425 1.00 0.00 C ATOM 629 CE LYS A 41 -8.767 -1.980 -12.729 1.00 0.00 C ATOM 630 NZ LYS A 41 -9.635 -1.616 -13.882 1.00 0.00 N ATOM 0 H LYS A 41 -8.175 2.094 -11.226 1.00 0.00 H new ATOM 0 HA LYS A 41 -7.154 0.944 -8.652 1.00 0.00 H new ATOM 0 HB2 LYS A 41 -6.239 0.823 -11.585 1.00 0.00 H new ATOM 0 HB3 LYS A 41 -5.676 -0.218 -10.293 1.00 0.00 H new ATOM 0 HG2 LYS A 41 -7.481 -1.606 -10.514 1.00 0.00 H new ATOM 0 HG3 LYS A 41 -8.604 -0.265 -10.410 1.00 0.00 H new ATOM 0 HD2 LYS A 41 -8.504 0.165 -12.770 1.00 0.00 H new ATOM 0 HD3 LYS A 41 -7.014 -0.738 -12.963 1.00 0.00 H new ATOM 0 HE2 LYS A 41 -8.112 -2.815 -12.976 1.00 0.00 H new ATOM 0 HE3 LYS A 41 -9.362 -2.286 -11.868 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 -10.219 -2.434 -14.149 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 -10.252 -0.823 -13.615 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 -9.041 -1.336 -14.689 1.00 0.00 H new ATOM 644 N VAL A 42 -5.759 2.998 -8.279 1.00 0.00 N ATOM 645 CA VAL A 42 -4.707 4.028 -8.027 1.00 0.00 C ATOM 646 C VAL A 42 -3.314 3.426 -8.223 1.00 0.00 C ATOM 647 O VAL A 42 -3.040 2.318 -7.803 1.00 0.00 O ATOM 648 CB VAL A 42 -4.911 4.471 -6.575 1.00 0.00 C ATOM 649 CG1 VAL A 42 -6.322 5.038 -6.409 1.00 0.00 C ATOM 650 CG2 VAL A 42 -4.730 3.277 -5.637 1.00 0.00 C ATOM 0 H VAL A 42 -6.371 2.801 -7.487 1.00 0.00 H new ATOM 0 HA VAL A 42 -4.784 4.869 -8.717 1.00 0.00 H new ATOM 0 HB VAL A 42 -4.176 5.237 -6.327 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -6.468 5.354 -5.376 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -6.450 5.894 -7.071 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -7.054 4.271 -6.661 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -4.876 3.599 -4.606 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -5.460 2.506 -5.884 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -3.724 2.873 -5.752 1.00 0.00 H new ATOM 660 N GLN A 43 -2.434 4.148 -8.864 1.00 0.00 N ATOM 661 CA GLN A 43 -1.057 3.620 -9.097 1.00 0.00 C ATOM 662 C GLN A 43 -0.020 4.612 -8.569 1.00 0.00 C ATOM 663 O GLN A 43 0.195 5.657 -9.144 1.00 0.00 O ATOM 664 CB GLN A 43 -0.923 3.477 -10.619 1.00 0.00 C ATOM 665 CG GLN A 43 -2.263 3.051 -11.229 1.00 0.00 C ATOM 666 CD GLN A 43 -2.013 2.206 -12.478 1.00 0.00 C ATOM 667 OE1 GLN A 43 -1.875 1.002 -12.395 1.00 0.00 O ATOM 668 NE2 GLN A 43 -1.948 2.791 -13.644 1.00 0.00 N ATOM 0 H GLN A 43 -2.609 5.081 -9.237 1.00 0.00 H new ATOM 0 HA GLN A 43 -0.893 2.672 -8.585 1.00 0.00 H new ATOM 0 HB2 GLN A 43 -0.601 4.423 -11.054 1.00 0.00 H new ATOM 0 HB3 GLN A 43 -0.156 2.740 -10.857 1.00 0.00 H new ATOM 0 HG2 GLN A 43 -2.840 2.480 -10.501 1.00 0.00 H new ATOM 0 HG3 GLN A 43 -2.853 3.931 -11.485 1.00 0.00 H new ATOM 0 HE21 GLN A 43 -2.064 3.802 -13.715 1.00 0.00 H new ATOM 0 HE22 GLN A 43 -1.781 2.237 -14.484 1.00 0.00 H new ATOM 677 N LEU A 44 0.628 4.293 -7.484 1.00 0.00 N ATOM 678 CA LEU A 44 1.651 5.225 -6.931 1.00 0.00 C ATOM 679 C LEU A 44 2.895 5.218 -7.819 1.00 0.00 C ATOM 680 O LEU A 44 3.684 4.296 -7.778 1.00 0.00 O ATOM 681 CB LEU A 44 1.970 4.683 -5.539 1.00 0.00 C ATOM 682 CG LEU A 44 0.902 5.163 -4.558 1.00 0.00 C ATOM 683 CD1 LEU A 44 1.065 4.454 -3.210 1.00 0.00 C ATOM 684 CD2 LEU A 44 1.061 6.667 -4.362 1.00 0.00 C ATOM 0 H LEU A 44 0.495 3.430 -6.957 1.00 0.00 H new ATOM 0 HA LEU A 44 1.299 6.256 -6.888 1.00 0.00 H new ATOM 0 HB2 LEU A 44 2.001 3.594 -5.558 1.00 0.00 H new ATOM 0 HB3 LEU A 44 2.955 5.024 -5.219 1.00 0.00 H new ATOM 0 HG LEU A 44 -0.087 4.936 -4.956 1.00 0.00 H new ATOM 0 HD11 LEU A 44 0.298 4.805 -2.519 1.00 0.00 H new ATOM 0 HD12 LEU A 44 0.963 3.378 -3.350 1.00 0.00 H new ATOM 0 HD13 LEU A 44 2.051 4.674 -2.800 1.00 0.00 H new ATOM 0 HD21 LEU A 44 0.305 7.025 -3.663 1.00 0.00 H new ATOM 0 HD22 LEU A 44 2.053 6.879 -3.963 1.00 0.00 H new ATOM 0 HD23 LEU A 44 0.939 7.174 -5.319 1.00 0.00 H new ATOM 696 N THR A 45 3.066 6.242 -8.621 1.00 0.00 N ATOM 697 CA THR A 45 4.253 6.330 -9.539 1.00 0.00 C ATOM 698 C THR A 45 4.678 4.935 -10.035 1.00 0.00 C ATOM 699 O THR A 45 4.120 4.419 -10.983 1.00 0.00 O ATOM 700 CB THR A 45 5.373 7.017 -8.730 1.00 0.00 C ATOM 701 OG1 THR A 45 6.636 6.663 -9.276 1.00 0.00 O ATOM 702 CG2 THR A 45 5.322 6.597 -7.256 1.00 0.00 C ATOM 0 H THR A 45 2.425 7.033 -8.681 1.00 0.00 H new ATOM 0 HA THR A 45 4.019 6.903 -10.436 1.00 0.00 H new ATOM 0 HB THR A 45 5.228 8.096 -8.789 1.00 0.00 H new ATOM 0 HG1 THR A 45 7.312 6.666 -8.566 1.00 0.00 H new ATOM 0 HG21 THR A 45 6.122 7.095 -6.708 1.00 0.00 H new ATOM 0 HG22 THR A 45 4.359 6.880 -6.830 1.00 0.00 H new ATOM 0 HG23 THR A 45 5.449 5.517 -7.181 1.00 0.00 H new ATOM 710 N GLY A 46 5.650 4.320 -9.410 1.00 0.00 N ATOM 711 CA GLY A 46 6.082 2.969 -9.862 1.00 0.00 C ATOM 712 C GLY A 46 6.467 2.115 -8.653 1.00 0.00 C ATOM 713 O GLY A 46 7.298 1.233 -8.753 1.00 0.00 O ATOM 0 H GLY A 46 6.159 4.695 -8.610 1.00 0.00 H new ATOM 0 HA2 GLY A 46 5.277 2.487 -10.417 1.00 0.00 H new ATOM 0 HA3 GLY A 46 6.930 3.057 -10.541 1.00 0.00 H new ATOM 717 N PHE A 47 5.874 2.360 -7.510 1.00 0.00 N ATOM 718 CA PHE A 47 6.224 1.541 -6.312 1.00 0.00 C ATOM 719 C PHE A 47 4.964 0.991 -5.625 1.00 0.00 C ATOM 720 O PHE A 47 5.016 -0.040 -4.987 1.00 0.00 O ATOM 721 CB PHE A 47 7.070 2.464 -5.416 1.00 0.00 C ATOM 722 CG PHE A 47 6.208 3.305 -4.512 1.00 0.00 C ATOM 723 CD1 PHE A 47 5.633 2.743 -3.372 1.00 0.00 C ATOM 724 CD2 PHE A 47 5.995 4.652 -4.811 1.00 0.00 C ATOM 725 CE1 PHE A 47 4.839 3.525 -2.536 1.00 0.00 C ATOM 726 CE2 PHE A 47 5.199 5.435 -3.974 1.00 0.00 C ATOM 727 CZ PHE A 47 4.621 4.870 -2.836 1.00 0.00 C ATOM 0 H PHE A 47 5.171 3.083 -7.357 1.00 0.00 H new ATOM 0 HA PHE A 47 6.794 0.648 -6.568 1.00 0.00 H new ATOM 0 HB2 PHE A 47 7.751 1.862 -4.814 1.00 0.00 H new ATOM 0 HB3 PHE A 47 7.685 3.113 -6.040 1.00 0.00 H new ATOM 0 HD1 PHE A 47 5.803 1.703 -3.138 1.00 0.00 H new ATOM 0 HD2 PHE A 47 6.446 5.088 -5.690 1.00 0.00 H new ATOM 0 HE1 PHE A 47 4.392 3.090 -1.655 1.00 0.00 H new ATOM 0 HE2 PHE A 47 5.030 6.476 -4.206 1.00 0.00 H new ATOM 0 HZ PHE A 47 4.005 5.474 -2.187 1.00 0.00 H new ATOM 737 N LEU A 48 3.830 1.625 -5.768 1.00 0.00 N ATOM 738 CA LEU A 48 2.601 1.058 -5.132 1.00 0.00 C ATOM 739 C LEU A 48 1.421 1.091 -6.113 1.00 0.00 C ATOM 740 O LEU A 48 0.739 2.086 -6.251 1.00 0.00 O ATOM 741 CB LEU A 48 2.320 1.927 -3.910 1.00 0.00 C ATOM 742 CG LEU A 48 2.853 1.261 -2.633 1.00 0.00 C ATOM 743 CD1 LEU A 48 2.204 1.918 -1.420 1.00 0.00 C ATOM 744 CD2 LEU A 48 2.526 -0.239 -2.631 1.00 0.00 C ATOM 0 H LEU A 48 3.700 2.494 -6.286 1.00 0.00 H new ATOM 0 HA LEU A 48 2.742 0.015 -4.849 1.00 0.00 H new ATOM 0 HB2 LEU A 48 2.786 2.904 -4.038 1.00 0.00 H new ATOM 0 HB3 LEU A 48 1.247 2.096 -3.817 1.00 0.00 H new ATOM 0 HG LEU A 48 3.935 1.384 -2.595 1.00 0.00 H new ATOM 0 HD11 LEU A 48 2.578 1.450 -0.509 1.00 0.00 H new ATOM 0 HD12 LEU A 48 2.447 2.980 -1.408 1.00 0.00 H new ATOM 0 HD13 LEU A 48 1.122 1.794 -1.474 1.00 0.00 H new ATOM 0 HD21 LEU A 48 2.911 -0.694 -1.719 1.00 0.00 H new ATOM 0 HD22 LEU A 48 1.446 -0.376 -2.677 1.00 0.00 H new ATOM 0 HD23 LEU A 48 2.989 -0.713 -3.496 1.00 0.00 H new ATOM 756 N ASN A 49 1.177 0.002 -6.797 1.00 0.00 N ATOM 757 CA ASN A 49 0.048 -0.035 -7.775 1.00 0.00 C ATOM 758 C ASN A 49 -1.143 -0.816 -7.206 1.00 0.00 C ATOM 759 O ASN A 49 -1.257 -2.010 -7.396 1.00 0.00 O ATOM 760 CB ASN A 49 0.618 -0.752 -9.000 1.00 0.00 C ATOM 761 CG ASN A 49 1.117 0.281 -10.012 1.00 0.00 C ATOM 762 OD1 ASN A 49 1.408 1.407 -9.657 1.00 0.00 O ATOM 763 ND2 ASN A 49 1.230 -0.056 -11.268 1.00 0.00 N ATOM 0 H ASN A 49 1.711 -0.864 -6.720 1.00 0.00 H new ATOM 0 HA ASN A 49 -0.320 0.963 -8.010 1.00 0.00 H new ATOM 0 HB2 ASN A 49 1.435 -1.409 -8.702 1.00 0.00 H new ATOM 0 HB3 ASN A 49 -0.147 -1.381 -9.455 1.00 0.00 H new ATOM 0 HD21 ASN A 49 1.562 0.625 -11.951 1.00 0.00 H new ATOM 0 HD22 ASN A 49 0.986 -1.000 -11.567 1.00 0.00 H new ATOM 770 N ILE A 50 -2.034 -0.147 -6.521 1.00 0.00 N ATOM 771 CA ILE A 50 -3.225 -0.848 -5.945 1.00 0.00 C ATOM 772 C ILE A 50 -4.290 -1.052 -7.019 1.00 0.00 C ATOM 773 O ILE A 50 -4.381 -0.290 -7.962 1.00 0.00 O ATOM 774 CB ILE A 50 -3.774 0.096 -4.877 1.00 0.00 C ATOM 775 CG1 ILE A 50 -2.662 0.464 -3.881 1.00 0.00 C ATOM 776 CG2 ILE A 50 -4.944 -0.588 -4.158 1.00 0.00 C ATOM 777 CD1 ILE A 50 -3.064 0.066 -2.460 1.00 0.00 C ATOM 0 H ILE A 50 -1.990 0.855 -6.334 1.00 0.00 H new ATOM 0 HA ILE A 50 -2.956 -1.826 -5.545 1.00 0.00 H new ATOM 0 HB ILE A 50 -4.131 1.015 -5.342 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -1.736 -0.040 -4.158 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -2.467 1.536 -3.924 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -5.342 0.080 -3.394 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -5.727 -0.822 -4.879 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -4.595 -1.509 -3.690 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -2.266 0.333 -1.768 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -3.978 0.590 -2.180 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -3.235 -1.010 -2.418 1.00 0.00 H new ATOM 789 N LYS A 51 -5.117 -2.055 -6.877 1.00 0.00 N ATOM 790 CA LYS A 51 -6.189 -2.260 -7.899 1.00 0.00 C ATOM 791 C LYS A 51 -7.249 -3.241 -7.375 1.00 0.00 C ATOM 792 O LYS A 51 -6.957 -4.394 -7.140 1.00 0.00 O ATOM 793 CB LYS A 51 -5.480 -2.826 -9.136 1.00 0.00 C ATOM 794 CG LYS A 51 -4.674 -4.072 -8.761 1.00 0.00 C ATOM 795 CD LYS A 51 -4.101 -4.707 -10.029 1.00 0.00 C ATOM 796 CE LYS A 51 -5.121 -5.689 -10.610 1.00 0.00 C ATOM 797 NZ LYS A 51 -4.500 -6.191 -11.868 1.00 0.00 N ATOM 0 H LYS A 51 -5.100 -2.730 -6.113 1.00 0.00 H new ATOM 0 HA LYS A 51 -6.711 -1.332 -8.132 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -6.214 -3.076 -9.902 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -4.819 -2.071 -9.562 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -3.867 -3.805 -8.078 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -5.310 -4.787 -8.239 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -3.865 -3.935 -10.761 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -3.170 -5.225 -9.801 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -5.322 -6.505 -9.916 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -6.073 -5.197 -10.809 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -5.141 -6.871 -12.325 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -4.326 -5.393 -12.512 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -3.599 -6.660 -11.647 1.00 0.00 H new ATOM 811 N PRO A 52 -8.451 -2.749 -7.196 1.00 0.00 N ATOM 812 CA PRO A 52 -9.542 -3.608 -6.686 1.00 0.00 C ATOM 813 C PRO A 52 -10.097 -4.498 -7.786 1.00 0.00 C ATOM 814 O PRO A 52 -10.242 -4.094 -8.922 1.00 0.00 O ATOM 815 CB PRO A 52 -10.604 -2.623 -6.237 1.00 0.00 C ATOM 816 CG PRO A 52 -10.367 -1.397 -7.056 1.00 0.00 C ATOM 817 CD PRO A 52 -8.906 -1.375 -7.438 1.00 0.00 C ATOM 0 HA PRO A 52 -9.204 -4.272 -5.890 1.00 0.00 H new ATOM 0 HB2 PRO A 52 -11.605 -3.020 -6.402 1.00 0.00 H new ATOM 0 HB3 PRO A 52 -10.518 -2.408 -5.172 1.00 0.00 H new ATOM 0 HG2 PRO A 52 -10.995 -1.405 -7.947 1.00 0.00 H new ATOM 0 HG3 PRO A 52 -10.628 -0.503 -6.490 1.00 0.00 H new ATOM 0 HD2 PRO A 52 -8.771 -1.089 -8.481 1.00 0.00 H new ATOM 0 HD3 PRO A 52 -8.347 -0.658 -6.836 1.00 0.00 H new ATOM 825 N VAL A 53 -10.416 -5.707 -7.443 1.00 0.00 N ATOM 826 CA VAL A 53 -10.979 -6.647 -8.447 1.00 0.00 C ATOM 827 C VAL A 53 -11.989 -7.587 -7.789 1.00 0.00 C ATOM 828 O VAL A 53 -11.655 -8.380 -6.933 1.00 0.00 O ATOM 829 CB VAL A 53 -9.778 -7.411 -8.989 1.00 0.00 C ATOM 830 CG1 VAL A 53 -8.769 -6.416 -9.571 1.00 0.00 C ATOM 831 CG2 VAL A 53 -9.113 -8.190 -7.855 1.00 0.00 C ATOM 0 H VAL A 53 -10.311 -6.090 -6.504 1.00 0.00 H new ATOM 0 HA VAL A 53 -11.517 -6.133 -9.244 1.00 0.00 H new ATOM 0 HB VAL A 53 -10.107 -8.103 -9.764 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -7.907 -6.958 -9.960 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -9.238 -5.852 -10.377 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -8.443 -5.729 -8.790 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -8.254 -8.736 -8.244 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -8.782 -7.496 -7.082 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -9.828 -8.894 -7.429 1.00 0.00 H new ATOM 841 N ALA A 54 -13.227 -7.481 -8.187 1.00 0.00 N ATOM 842 CA ALA A 54 -14.318 -8.332 -7.601 1.00 0.00 C ATOM 843 C ALA A 54 -13.802 -9.713 -7.176 1.00 0.00 C ATOM 844 O ALA A 54 -13.527 -10.562 -8.002 1.00 0.00 O ATOM 845 CB ALA A 54 -15.352 -8.467 -8.720 1.00 0.00 C ATOM 0 H ALA A 54 -13.540 -6.830 -8.907 1.00 0.00 H new ATOM 0 HA ALA A 54 -14.731 -7.881 -6.699 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -16.186 -9.077 -8.373 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -15.717 -7.479 -8.999 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -14.891 -8.942 -9.586 1.00 0.00 H new ATOM 1164 N VAL A 75 -14.613 -7.348 -3.004 1.00 0.00 N ATOM 1165 CA VAL A 75 -13.779 -6.980 -4.203 1.00 0.00 C ATOM 1166 C VAL A 75 -12.400 -7.613 -4.016 1.00 0.00 C ATOM 1167 O VAL A 75 -12.179 -8.354 -3.078 1.00 0.00 O ATOM 1168 CB VAL A 75 -13.676 -5.441 -4.284 1.00 0.00 C ATOM 1169 CG1 VAL A 75 -12.662 -4.918 -3.259 1.00 0.00 C ATOM 1170 CG2 VAL A 75 -13.227 -5.031 -5.691 1.00 0.00 C ATOM 0 HA VAL A 75 -14.223 -7.342 -5.130 1.00 0.00 H new ATOM 0 HB VAL A 75 -14.655 -5.013 -4.067 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -12.601 -3.832 -3.329 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -12.981 -5.200 -2.255 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -11.682 -5.350 -3.463 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -13.154 -3.945 -5.748 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -12.253 -5.471 -5.905 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -13.954 -5.385 -6.422 1.00 0.00 H new ATOM 1180 N GLY A 76 -11.467 -7.324 -4.875 1.00 0.00 N ATOM 1181 CA GLY A 76 -10.110 -7.910 -4.709 1.00 0.00 C ATOM 1182 C GLY A 76 -9.088 -6.780 -4.640 1.00 0.00 C ATOM 1183 O GLY A 76 -8.213 -6.669 -5.472 1.00 0.00 O ATOM 0 H GLY A 76 -11.583 -6.710 -5.682 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -10.068 -8.512 -3.801 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -9.882 -8.574 -5.543 1.00 0.00 H new ATOM 1187 N VAL A 77 -9.211 -5.935 -3.656 1.00 0.00 N ATOM 1188 CA VAL A 77 -8.269 -4.784 -3.508 1.00 0.00 C ATOM 1189 C VAL A 77 -6.820 -5.247 -3.650 1.00 0.00 C ATOM 1190 O VAL A 77 -6.134 -5.470 -2.673 1.00 0.00 O ATOM 1191 CB VAL A 77 -8.523 -4.256 -2.087 1.00 0.00 C ATOM 1192 CG1 VAL A 77 -8.427 -5.412 -1.088 1.00 0.00 C ATOM 1193 CG2 VAL A 77 -7.483 -3.187 -1.713 1.00 0.00 C ATOM 0 H VAL A 77 -9.932 -5.991 -2.937 1.00 0.00 H new ATOM 0 HA VAL A 77 -8.429 -4.023 -4.272 1.00 0.00 H new ATOM 0 HB VAL A 77 -9.518 -3.812 -2.055 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -8.607 -5.038 -0.080 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -9.173 -6.168 -1.333 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -7.432 -5.855 -1.138 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -7.680 -2.826 -0.704 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -6.484 -3.621 -1.755 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -7.547 -2.356 -2.415 1.00 0.00 H new ATOM 1203 N SER A 78 -6.343 -5.395 -4.849 1.00 0.00 N ATOM 1204 CA SER A 78 -4.934 -5.844 -5.004 1.00 0.00 C ATOM 1205 C SER A 78 -3.986 -4.647 -4.898 1.00 0.00 C ATOM 1206 O SER A 78 -4.400 -3.508 -4.810 1.00 0.00 O ATOM 1207 CB SER A 78 -4.844 -6.484 -6.392 1.00 0.00 C ATOM 1208 OG SER A 78 -6.152 -6.704 -6.907 1.00 0.00 O ATOM 0 H SER A 78 -6.855 -5.229 -5.715 1.00 0.00 H new ATOM 0 HA SER A 78 -4.648 -6.551 -4.226 1.00 0.00 H new ATOM 0 HB2 SER A 78 -4.282 -5.837 -7.065 1.00 0.00 H new ATOM 0 HB3 SER A 78 -4.303 -7.428 -6.333 1.00 0.00 H new ATOM 0 HG SER A 78 -6.442 -5.915 -7.410 1.00 0.00 H new ATOM 1214 N VAL A 79 -2.714 -4.919 -4.913 1.00 0.00 N ATOM 1215 CA VAL A 79 -1.673 -3.848 -4.821 1.00 0.00 C ATOM 1216 C VAL A 79 -0.296 -4.520 -4.744 1.00 0.00 C ATOM 1217 O VAL A 79 -0.203 -5.729 -4.658 1.00 0.00 O ATOM 1218 CB VAL A 79 -1.988 -3.091 -3.513 1.00 0.00 C ATOM 1219 CG1 VAL A 79 -2.160 -4.089 -2.367 1.00 0.00 C ATOM 1220 CG2 VAL A 79 -0.848 -2.129 -3.165 1.00 0.00 C ATOM 0 H VAL A 79 -2.337 -5.864 -4.987 1.00 0.00 H new ATOM 0 HA VAL A 79 -1.671 -3.170 -5.675 1.00 0.00 H new ATOM 0 HB VAL A 79 -2.908 -2.524 -3.655 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -2.382 -3.550 -1.446 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -2.980 -4.769 -2.597 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -1.240 -4.660 -2.241 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -1.085 -1.603 -2.240 1.00 0.00 H new ATOM 0 HG22 VAL A 79 0.076 -2.692 -3.035 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -0.723 -1.407 -3.971 1.00 0.00 H new ATOM 1230 N LYS A 80 0.769 -3.760 -4.720 1.00 0.00 N ATOM 1231 CA LYS A 80 2.116 -4.372 -4.587 1.00 0.00 C ATOM 1232 C LYS A 80 3.188 -3.280 -4.512 1.00 0.00 C ATOM 1233 O LYS A 80 2.909 -2.116 -4.710 1.00 0.00 O ATOM 1234 CB LYS A 80 2.307 -5.214 -5.856 1.00 0.00 C ATOM 1235 CG LYS A 80 2.126 -4.332 -7.097 1.00 0.00 C ATOM 1236 CD LYS A 80 0.768 -4.620 -7.738 1.00 0.00 C ATOM 1237 CE LYS A 80 0.776 -4.144 -9.191 1.00 0.00 C ATOM 1238 NZ LYS A 80 1.094 -5.359 -9.992 1.00 0.00 N ATOM 0 H LYS A 80 0.759 -2.742 -4.787 1.00 0.00 H new ATOM 0 HA LYS A 80 2.202 -4.973 -3.682 1.00 0.00 H new ATOM 0 HB2 LYS A 80 3.300 -5.663 -5.859 1.00 0.00 H new ATOM 0 HB3 LYS A 80 1.587 -6.032 -5.872 1.00 0.00 H new ATOM 0 HG2 LYS A 80 2.193 -3.280 -6.821 1.00 0.00 H new ATOM 0 HG3 LYS A 80 2.925 -4.525 -7.812 1.00 0.00 H new ATOM 0 HD2 LYS A 80 0.554 -5.688 -7.696 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -0.022 -4.114 -7.183 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -0.190 -3.726 -9.475 1.00 0.00 H new ATOM 0 HE3 LYS A 80 1.520 -3.363 -9.346 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 1.117 -5.113 -11.002 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 2.022 -5.731 -9.705 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 0.365 -6.083 -9.829 1.00 0.00 H new ATOM 1252 N PRO A 81 4.388 -3.712 -4.251 1.00 0.00 N ATOM 1253 CA PRO A 81 5.548 -2.816 -4.166 1.00 0.00 C ATOM 1254 C PRO A 81 6.338 -2.831 -5.477 1.00 0.00 C ATOM 1255 O PRO A 81 6.613 -3.878 -6.032 1.00 0.00 O ATOM 1256 CB PRO A 81 6.377 -3.467 -3.067 1.00 0.00 C ATOM 1257 CG PRO A 81 5.988 -4.924 -3.078 1.00 0.00 C ATOM 1258 CD PRO A 81 4.776 -5.077 -3.970 1.00 0.00 C ATOM 0 HA PRO A 81 5.280 -1.777 -3.975 1.00 0.00 H new ATOM 0 HB2 PRO A 81 7.444 -3.344 -3.255 1.00 0.00 H new ATOM 0 HB3 PRO A 81 6.170 -3.013 -2.098 1.00 0.00 H new ATOM 0 HG2 PRO A 81 6.812 -5.536 -3.446 1.00 0.00 H new ATOM 0 HG3 PRO A 81 5.763 -5.266 -2.068 1.00 0.00 H new ATOM 0 HD2 PRO A 81 5.016 -5.622 -4.883 1.00 0.00 H new ATOM 0 HD3 PRO A 81 3.978 -5.627 -3.471 1.00 0.00 H new ATOM 1266 N GLY A 82 6.734 -1.689 -5.960 1.00 0.00 N ATOM 1267 CA GLY A 82 7.538 -1.652 -7.212 1.00 0.00 C ATOM 1268 C GLY A 82 9.013 -1.740 -6.827 1.00 0.00 C ATOM 1269 O GLY A 82 9.348 -2.194 -5.750 1.00 0.00 O ATOM 0 H GLY A 82 6.536 -0.779 -5.543 1.00 0.00 H new ATOM 0 HA2 GLY A 82 7.264 -2.480 -7.865 1.00 0.00 H new ATOM 0 HA3 GLY A 82 7.342 -0.733 -7.764 1.00 0.00 H new ATOM 1273 N GLU A 83 9.899 -1.304 -7.677 1.00 0.00 N ATOM 1274 CA GLU A 83 11.345 -1.366 -7.320 1.00 0.00 C ATOM 1275 C GLU A 83 11.771 -0.078 -6.617 1.00 0.00 C ATOM 1276 O GLU A 83 12.805 -0.026 -5.980 1.00 0.00 O ATOM 1277 CB GLU A 83 12.098 -1.530 -8.637 1.00 0.00 C ATOM 1278 CG GLU A 83 11.753 -0.377 -9.587 1.00 0.00 C ATOM 1279 CD GLU A 83 11.049 -0.928 -10.830 1.00 0.00 C ATOM 1280 OE1 GLU A 83 10.126 -1.709 -10.665 1.00 0.00 O ATOM 1281 OE2 GLU A 83 11.446 -0.560 -11.923 1.00 0.00 O ATOM 0 H GLU A 83 9.689 -0.911 -8.595 1.00 0.00 H new ATOM 0 HA GLU A 83 11.555 -2.190 -6.638 1.00 0.00 H new ATOM 0 HB2 GLU A 83 13.172 -1.550 -8.451 1.00 0.00 H new ATOM 0 HB3 GLU A 83 11.837 -2.482 -9.098 1.00 0.00 H new ATOM 0 HG2 GLU A 83 11.110 0.344 -9.082 1.00 0.00 H new ATOM 0 HG3 GLU A 83 12.660 0.153 -9.876 1.00 0.00 H new ATOM 1288 N SER A 84 10.981 0.961 -6.716 1.00 0.00 N ATOM 1289 CA SER A 84 11.347 2.238 -6.036 1.00 0.00 C ATOM 1290 C SER A 84 11.620 1.962 -4.558 1.00 0.00 C ATOM 1291 O SER A 84 12.506 2.540 -3.959 1.00 0.00 O ATOM 1292 CB SER A 84 10.132 3.147 -6.201 1.00 0.00 C ATOM 1293 OG SER A 84 10.567 4.494 -6.341 1.00 0.00 O ATOM 0 H SER A 84 10.103 0.980 -7.235 1.00 0.00 H new ATOM 0 HA SER A 84 12.243 2.696 -6.455 1.00 0.00 H new ATOM 0 HB2 SER A 84 9.555 2.847 -7.076 1.00 0.00 H new ATOM 0 HB3 SER A 84 9.474 3.053 -5.337 1.00 0.00 H new ATOM 0 HG SER A 84 9.845 5.100 -6.075 1.00 0.00 H new ATOM 1299 N LEU A 85 10.872 1.063 -3.974 1.00 0.00 N ATOM 1300 CA LEU A 85 11.096 0.728 -2.540 1.00 0.00 C ATOM 1301 C LEU A 85 12.241 -0.275 -2.433 1.00 0.00 C ATOM 1302 O LEU A 85 12.995 -0.274 -1.481 1.00 0.00 O ATOM 1303 CB LEU A 85 9.800 0.079 -2.033 1.00 0.00 C ATOM 1304 CG LEU A 85 8.564 0.781 -2.613 1.00 0.00 C ATOM 1305 CD1 LEU A 85 7.826 -0.183 -3.544 1.00 0.00 C ATOM 1306 CD2 LEU A 85 7.629 1.203 -1.473 1.00 0.00 C ATOM 0 H LEU A 85 10.118 0.548 -4.428 1.00 0.00 H new ATOM 0 HA LEU A 85 11.349 1.614 -1.957 1.00 0.00 H new ATOM 0 HB2 LEU A 85 9.786 -0.975 -2.309 1.00 0.00 H new ATOM 0 HB3 LEU A 85 9.770 0.124 -0.944 1.00 0.00 H new ATOM 0 HG LEU A 85 8.876 1.664 -3.170 1.00 0.00 H new ATOM 0 HD11 LEU A 85 6.947 0.312 -3.958 1.00 0.00 H new ATOM 0 HD12 LEU A 85 8.489 -0.484 -4.355 1.00 0.00 H new ATOM 0 HD13 LEU A 85 7.515 -1.064 -2.983 1.00 0.00 H new ATOM 0 HD21 LEU A 85 6.752 1.701 -1.887 1.00 0.00 H new ATOM 0 HD22 LEU A 85 7.315 0.321 -0.914 1.00 0.00 H new ATOM 0 HD23 LEU A 85 8.154 1.887 -0.806 1.00 0.00 H new ATOM 1318 N LYS A 86 12.372 -1.139 -3.407 1.00 0.00 N ATOM 1319 CA LYS A 86 13.469 -2.149 -3.360 1.00 0.00 C ATOM 1320 C LYS A 86 14.805 -1.466 -3.586 1.00 0.00 C ATOM 1321 O LYS A 86 15.764 -1.711 -2.880 1.00 0.00 O ATOM 1322 CB LYS A 86 13.167 -3.142 -4.483 1.00 0.00 C ATOM 1323 CG LYS A 86 12.967 -4.539 -3.893 1.00 0.00 C ATOM 1324 CD LYS A 86 12.910 -5.569 -5.023 1.00 0.00 C ATOM 1325 CE LYS A 86 12.210 -6.836 -4.526 1.00 0.00 C ATOM 1326 NZ LYS A 86 12.958 -7.959 -5.156 1.00 0.00 N ATOM 0 H LYS A 86 11.769 -1.188 -4.229 1.00 0.00 H new ATOM 0 HA LYS A 86 13.524 -2.653 -2.395 1.00 0.00 H new ATOM 0 HB2 LYS A 86 12.273 -2.833 -5.024 1.00 0.00 H new ATOM 0 HB3 LYS A 86 13.986 -3.154 -5.202 1.00 0.00 H new ATOM 0 HG2 LYS A 86 13.783 -4.777 -3.211 1.00 0.00 H new ATOM 0 HG3 LYS A 86 12.046 -4.571 -3.311 1.00 0.00 H new ATOM 0 HD2 LYS A 86 12.374 -5.157 -5.878 1.00 0.00 H new ATOM 0 HD3 LYS A 86 13.918 -5.807 -5.363 1.00 0.00 H new ATOM 0 HE2 LYS A 86 12.239 -6.903 -3.438 1.00 0.00 H new ATOM 0 HE3 LYS A 86 11.160 -6.848 -4.818 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 12.537 -8.864 -4.863 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 12.907 -7.873 -6.191 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 13.953 -7.926 -4.854 1.00 0.00 H new ATOM 1340 N LYS A 87 14.869 -0.583 -4.532 1.00 0.00 N ATOM 1341 CA LYS A 87 16.139 0.145 -4.759 1.00 0.00 C ATOM 1342 C LYS A 87 16.389 0.977 -3.511 1.00 0.00 C ATOM 1343 O LYS A 87 17.494 1.060 -2.982 1.00 0.00 O ATOM 1344 CB LYS A 87 15.893 1.024 -5.988 1.00 0.00 C ATOM 1345 CG LYS A 87 17.176 1.780 -6.343 1.00 0.00 C ATOM 1346 CD LYS A 87 17.897 1.055 -7.482 1.00 0.00 C ATOM 1347 CE LYS A 87 19.271 1.691 -7.704 1.00 0.00 C ATOM 1348 NZ LYS A 87 19.651 1.308 -9.093 1.00 0.00 N ATOM 0 H LYS A 87 14.102 -0.334 -5.156 1.00 0.00 H new ATOM 0 HA LYS A 87 17.005 -0.494 -4.933 1.00 0.00 H new ATOM 0 HB2 LYS A 87 15.576 0.409 -6.830 1.00 0.00 H new ATOM 0 HB3 LYS A 87 15.087 1.730 -5.788 1.00 0.00 H new ATOM 0 HG2 LYS A 87 16.938 2.801 -6.641 1.00 0.00 H new ATOM 0 HG3 LYS A 87 17.826 1.845 -5.470 1.00 0.00 H new ATOM 0 HD2 LYS A 87 18.009 -0.002 -7.241 1.00 0.00 H new ATOM 0 HD3 LYS A 87 17.306 1.113 -8.396 1.00 0.00 H new ATOM 0 HE2 LYS A 87 19.228 2.774 -7.591 1.00 0.00 H new ATOM 0 HE3 LYS A 87 19.998 1.323 -6.980 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 20.584 1.708 -9.320 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 19.690 0.272 -9.169 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 18.944 1.677 -9.761 1.00 0.00 H new ATOM 1362 N ALA A 88 15.335 1.530 -2.978 1.00 0.00 N ATOM 1363 CA ALA A 88 15.480 2.283 -1.724 1.00 0.00 C ATOM 1364 C ALA A 88 15.908 1.280 -0.659 1.00 0.00 C ATOM 1365 O ALA A 88 16.689 1.576 0.221 1.00 0.00 O ATOM 1366 CB ALA A 88 14.091 2.854 -1.432 1.00 0.00 C ATOM 0 H ALA A 88 14.391 1.488 -3.361 1.00 0.00 H new ATOM 0 HA ALA A 88 16.213 3.089 -1.761 1.00 0.00 H new ATOM 0 HB1 ALA A 88 14.122 3.430 -0.507 1.00 0.00 H new ATOM 0 HB2 ALA A 88 13.784 3.501 -2.253 1.00 0.00 H new ATOM 0 HB3 ALA A 88 13.377 2.037 -1.327 1.00 0.00 H new ATOM 1372 N ALA A 89 15.410 0.070 -0.759 1.00 0.00 N ATOM 1373 CA ALA A 89 15.790 -0.978 0.232 1.00 0.00 C ATOM 1374 C ALA A 89 17.302 -1.093 0.282 1.00 0.00 C ATOM 1375 O ALA A 89 17.895 -1.089 1.343 1.00 0.00 O ATOM 1376 CB ALA A 89 15.153 -2.274 -0.267 1.00 0.00 C ATOM 0 H ALA A 89 14.759 -0.233 -1.483 1.00 0.00 H new ATOM 0 HA ALA A 89 15.448 -0.745 1.240 1.00 0.00 H new ATOM 0 HB1 ALA A 89 15.395 -3.086 0.419 1.00 0.00 H new ATOM 0 HB2 ALA A 89 14.071 -2.152 -0.317 1.00 0.00 H new ATOM 0 HB3 ALA A 89 15.538 -2.510 -1.259 1.00 0.00 H new ATOM 1382 N GLU A 90 17.938 -1.144 -0.857 1.00 0.00 N ATOM 1383 CA GLU A 90 19.424 -1.195 -0.858 1.00 0.00 C ATOM 1384 C GLU A 90 19.906 -0.027 -0.002 1.00 0.00 C ATOM 1385 O GLU A 90 20.905 -0.100 0.685 1.00 0.00 O ATOM 1386 CB GLU A 90 19.843 -1.019 -2.319 1.00 0.00 C ATOM 1387 CG GLU A 90 20.090 -2.390 -2.950 1.00 0.00 C ATOM 1388 CD GLU A 90 18.815 -2.869 -3.645 1.00 0.00 C ATOM 1389 OE1 GLU A 90 18.509 -2.348 -4.705 1.00 0.00 O ATOM 1390 OE2 GLU A 90 18.163 -3.749 -3.105 1.00 0.00 O ATOM 0 H GLU A 90 17.497 -1.152 -1.777 1.00 0.00 H new ATOM 0 HA GLU A 90 19.839 -2.121 -0.460 1.00 0.00 H new ATOM 0 HB2 GLU A 90 19.066 -0.489 -2.869 1.00 0.00 H new ATOM 0 HB3 GLU A 90 20.746 -0.412 -2.378 1.00 0.00 H new ATOM 0 HG2 GLU A 90 20.908 -2.330 -3.668 1.00 0.00 H new ATOM 0 HG3 GLU A 90 20.390 -3.106 -2.185 1.00 0.00 H new ATOM 1397 N GLY A 91 19.155 1.047 -0.028 1.00 0.00 N ATOM 1398 CA GLY A 91 19.507 2.235 0.797 1.00 0.00 C ATOM 1399 C GLY A 91 19.418 1.887 2.296 1.00 0.00 C ATOM 1400 O GLY A 91 20.230 2.333 3.082 1.00 0.00 O ATOM 0 H GLY A 91 18.310 1.148 -0.590 1.00 0.00 H new ATOM 0 HA2 GLY A 91 20.515 2.570 0.553 1.00 0.00 H new ATOM 0 HA3 GLY A 91 18.832 3.060 0.567 1.00 0.00 H new ATOM 1404 N LEU A 92 18.443 1.097 2.713 1.00 0.00 N ATOM 1405 CA LEU A 92 18.333 0.747 4.164 1.00 0.00 C ATOM 1406 C LEU A 92 19.435 -0.230 4.581 1.00 0.00 C ATOM 1407 O LEU A 92 19.378 -0.807 5.649 1.00 0.00 O ATOM 1408 CB LEU A 92 16.952 0.082 4.303 1.00 0.00 C ATOM 1409 CG LEU A 92 17.039 -1.439 4.081 1.00 0.00 C ATOM 1410 CD1 LEU A 92 17.112 -2.157 5.432 1.00 0.00 C ATOM 1411 CD2 LEU A 92 15.795 -1.917 3.320 1.00 0.00 C ATOM 0 H LEU A 92 17.729 0.687 2.112 1.00 0.00 H new ATOM 0 HA LEU A 92 18.442 1.625 4.801 1.00 0.00 H new ATOM 0 HB2 LEU A 92 16.547 0.284 5.294 1.00 0.00 H new ATOM 0 HB3 LEU A 92 16.262 0.518 3.581 1.00 0.00 H new ATOM 0 HG LEU A 92 17.934 -1.666 3.502 1.00 0.00 H new ATOM 0 HD11 LEU A 92 17.173 -3.233 5.269 1.00 0.00 H new ATOM 0 HD12 LEU A 92 17.995 -1.821 5.975 1.00 0.00 H new ATOM 0 HD13 LEU A 92 16.219 -1.928 6.014 1.00 0.00 H new ATOM 0 HD21 LEU A 92 15.856 -2.994 3.163 1.00 0.00 H new ATOM 0 HD22 LEU A 92 14.902 -1.685 3.900 1.00 0.00 H new ATOM 0 HD23 LEU A 92 15.742 -1.412 2.356 1.00 0.00 H new ATOM 1423 N LYS A 93 20.410 -0.463 3.741 1.00 0.00 N ATOM 1424 CA LYS A 93 21.466 -1.453 4.095 1.00 0.00 C ATOM 1425 C LYS A 93 20.772 -2.801 4.267 1.00 0.00 C ATOM 1426 O LYS A 93 21.039 -3.552 5.186 1.00 0.00 O ATOM 1427 CB LYS A 93 22.096 -0.976 5.413 1.00 0.00 C ATOM 1428 CG LYS A 93 22.589 0.467 5.261 1.00 0.00 C ATOM 1429 CD LYS A 93 24.010 0.465 4.694 1.00 0.00 C ATOM 1430 CE LYS A 93 24.772 1.682 5.223 1.00 0.00 C ATOM 1431 NZ LYS A 93 25.874 1.900 4.245 1.00 0.00 N ATOM 0 H LYS A 93 20.519 -0.013 2.832 1.00 0.00 H new ATOM 0 HA LYS A 93 22.244 -1.547 3.338 1.00 0.00 H new ATOM 0 HB2 LYS A 93 21.365 -1.037 6.219 1.00 0.00 H new ATOM 0 HB3 LYS A 93 22.927 -1.627 5.686 1.00 0.00 H new ATOM 0 HG2 LYS A 93 21.923 1.022 4.600 1.00 0.00 H new ATOM 0 HG3 LYS A 93 22.572 0.972 6.227 1.00 0.00 H new ATOM 0 HD2 LYS A 93 24.525 -0.452 4.979 1.00 0.00 H new ATOM 0 HD3 LYS A 93 23.978 0.488 3.605 1.00 0.00 H new ATOM 0 HE2 LYS A 93 24.124 2.556 5.289 1.00 0.00 H new ATOM 0 HE3 LYS A 93 25.163 1.499 6.224 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 26.443 2.719 4.540 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 26.478 1.054 4.209 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 25.472 2.079 3.303 1.00 0.00 H new ATOM 1445 N TYR A 94 19.849 -3.079 3.378 1.00 0.00 N ATOM 1446 CA TYR A 94 19.069 -4.349 3.430 1.00 0.00 C ATOM 1447 C TYR A 94 19.958 -5.524 3.867 1.00 0.00 C ATOM 1448 O TYR A 94 19.549 -6.371 4.635 1.00 0.00 O ATOM 1449 CB TYR A 94 18.551 -4.532 1.995 1.00 0.00 C ATOM 1450 CG TYR A 94 18.976 -5.874 1.467 1.00 0.00 C ATOM 1451 CD1 TYR A 94 18.306 -7.025 1.885 1.00 0.00 C ATOM 1452 CD2 TYR A 94 20.055 -5.963 0.588 1.00 0.00 C ATOM 1453 CE1 TYR A 94 18.718 -8.279 1.421 1.00 0.00 C ATOM 1454 CE2 TYR A 94 20.467 -7.215 0.117 1.00 0.00 C ATOM 1455 CZ TYR A 94 19.800 -8.374 0.536 1.00 0.00 C ATOM 1456 OH TYR A 94 20.213 -9.608 0.078 1.00 0.00 O ATOM 0 H TYR A 94 19.601 -2.464 2.603 1.00 0.00 H new ATOM 0 HA TYR A 94 18.257 -4.315 4.157 1.00 0.00 H new ATOM 0 HB2 TYR A 94 17.464 -4.452 1.978 1.00 0.00 H new ATOM 0 HB3 TYR A 94 18.939 -3.740 1.355 1.00 0.00 H new ATOM 0 HD1 TYR A 94 17.471 -6.948 2.565 1.00 0.00 H new ATOM 0 HD2 TYR A 94 20.571 -5.069 0.272 1.00 0.00 H new ATOM 0 HE1 TYR A 94 18.203 -9.172 1.744 1.00 0.00 H new ATOM 0 HE2 TYR A 94 21.298 -7.288 -0.569 1.00 0.00 H new ATOM 0 HH TYR A 94 20.975 -9.494 -0.528 1.00 0.00 H new ATOM 1466 N GLU A 95 21.171 -5.572 3.385 1.00 0.00 N ATOM 1467 CA GLU A 95 22.084 -6.687 3.779 1.00 0.00 C ATOM 1468 C GLU A 95 22.308 -6.662 5.290 1.00 0.00 C ATOM 1469 O GLU A 95 22.332 -7.688 5.941 1.00 0.00 O ATOM 1470 CB GLU A 95 23.392 -6.446 3.022 1.00 0.00 C ATOM 1471 CG GLU A 95 23.962 -5.067 3.369 1.00 0.00 C ATOM 1472 CD GLU A 95 24.923 -5.192 4.554 1.00 0.00 C ATOM 1473 OE1 GLU A 95 25.775 -6.064 4.509 1.00 0.00 O ATOM 1474 OE2 GLU A 95 24.789 -4.415 5.484 1.00 0.00 O ATOM 0 H GLU A 95 21.569 -4.891 2.738 1.00 0.00 H new ATOM 0 HA GLU A 95 21.669 -7.665 3.534 1.00 0.00 H new ATOM 0 HB2 GLU A 95 24.115 -7.220 3.277 1.00 0.00 H new ATOM 0 HB3 GLU A 95 23.217 -6.515 1.948 1.00 0.00 H new ATOM 0 HG2 GLU A 95 24.484 -4.651 2.507 1.00 0.00 H new ATOM 0 HG3 GLU A 95 23.153 -4.379 3.615 1.00 0.00 H new ATOM 1547 N MET B 1 -5.648 7.235 -10.858 1.00 0.00 N ATOM 1548 CA MET B 1 -4.771 8.307 -10.293 1.00 0.00 C ATOM 1549 C MET B 1 -3.371 7.778 -10.029 1.00 0.00 C ATOM 1550 O MET B 1 -3.053 6.646 -10.333 1.00 0.00 O ATOM 1551 CB MET B 1 -5.393 8.733 -8.961 1.00 0.00 C ATOM 1552 CG MET B 1 -5.823 7.512 -8.141 1.00 0.00 C ATOM 1553 SD MET B 1 -7.414 7.856 -7.351 1.00 0.00 S ATOM 1554 CE MET B 1 -6.792 8.957 -6.057 1.00 0.00 C ATOM 0 H1 MET B 1 -6.601 7.316 -10.450 1.00 0.00 H new ATOM 0 H2 MET B 1 -5.703 7.340 -11.891 1.00 0.00 H new ATOM 0 H3 MET B 1 -5.250 6.303 -10.626 1.00 0.00 H new ATOM 0 HA MET B 1 -4.696 9.137 -10.996 1.00 0.00 H new ATOM 0 HB2 MET B 1 -4.674 9.323 -8.392 1.00 0.00 H new ATOM 0 HB3 MET B 1 -6.255 9.373 -9.146 1.00 0.00 H new ATOM 0 HG2 MET B 1 -5.905 6.637 -8.785 1.00 0.00 H new ATOM 0 HG3 MET B 1 -5.071 7.283 -7.386 1.00 0.00 H new ATOM 0 HE1 MET B 1 -7.617 9.540 -5.647 1.00 0.00 H new ATOM 0 HE2 MET B 1 -6.337 8.365 -5.263 1.00 0.00 H new ATOM 0 HE3 MET B 1 -6.047 9.631 -6.480 1.00 0.00 H new ATOM 1566 N ASN B 2 -2.540 8.593 -9.436 1.00 0.00 N ATOM 1567 CA ASN B 2 -1.160 8.148 -9.118 1.00 0.00 C ATOM 1568 C ASN B 2 -0.393 9.256 -8.391 1.00 0.00 C ATOM 1569 O ASN B 2 -0.977 10.087 -7.723 1.00 0.00 O ATOM 1570 CB ASN B 2 -0.509 7.824 -10.471 1.00 0.00 C ATOM 1571 CG ASN B 2 -0.539 9.063 -11.369 1.00 0.00 C ATOM 1572 OD1 ASN B 2 0.161 10.025 -11.122 1.00 0.00 O ATOM 1573 ND2 ASN B 2 -1.328 9.080 -12.409 1.00 0.00 N ATOM 0 H ASN B 2 -2.762 9.549 -9.159 1.00 0.00 H new ATOM 0 HA ASN B 2 -1.155 7.282 -8.457 1.00 0.00 H new ATOM 0 HB2 ASN B 2 0.520 7.497 -10.321 1.00 0.00 H new ATOM 0 HB3 ASN B 2 -1.038 7.002 -10.952 1.00 0.00 H new ATOM 0 HD21 ASN B 2 -1.357 9.901 -13.014 1.00 0.00 H new ATOM 0 HD22 ASN B 2 -1.916 8.273 -12.617 1.00 0.00 H new ATOM 1580 N LYS B 3 0.913 9.285 -8.521 1.00 0.00 N ATOM 1581 CA LYS B 3 1.707 10.351 -7.839 1.00 0.00 C ATOM 1582 C LYS B 3 1.250 11.742 -8.316 1.00 0.00 C ATOM 1583 O LYS B 3 1.724 12.745 -7.836 1.00 0.00 O ATOM 1584 CB LYS B 3 3.172 10.091 -8.231 1.00 0.00 C ATOM 1585 CG LYS B 3 4.016 9.821 -6.971 1.00 0.00 C ATOM 1586 CD LYS B 3 5.479 10.213 -7.234 1.00 0.00 C ATOM 1587 CE LYS B 3 6.404 9.613 -6.156 1.00 0.00 C ATOM 1588 NZ LYS B 3 7.644 9.232 -6.889 1.00 0.00 N ATOM 0 H LYS B 3 1.459 8.619 -9.068 1.00 0.00 H new ATOM 0 HA LYS B 3 1.576 10.329 -6.757 1.00 0.00 H new ATOM 0 HB2 LYS B 3 3.230 9.238 -8.907 1.00 0.00 H new ATOM 0 HB3 LYS B 3 3.571 10.951 -8.768 1.00 0.00 H new ATOM 0 HG2 LYS B 3 3.623 10.390 -6.129 1.00 0.00 H new ATOM 0 HG3 LYS B 3 3.955 8.767 -6.699 1.00 0.00 H new ATOM 0 HD2 LYS B 3 5.784 9.861 -8.219 1.00 0.00 H new ATOM 0 HD3 LYS B 3 5.575 11.299 -7.240 1.00 0.00 H new ATOM 0 HE2 LYS B 3 6.616 10.337 -5.369 1.00 0.00 H new ATOM 0 HE3 LYS B 3 5.945 8.748 -5.678 1.00 0.00 H new ATOM 0 HZ1 LYS B 3 7.851 8.227 -6.722 1.00 0.00 H new ATOM 0 HZ2 LYS B 3 7.509 9.393 -7.907 1.00 0.00 H new ATOM 0 HZ3 LYS B 3 8.439 9.810 -6.550 1.00 0.00 H new ATOM 1602 N THR B 4 0.328 11.809 -9.251 1.00 0.00 N ATOM 1603 CA THR B 4 -0.158 13.138 -9.738 1.00 0.00 C ATOM 1604 C THR B 4 -1.591 13.383 -9.249 1.00 0.00 C ATOM 1605 O THR B 4 -1.895 14.398 -8.638 1.00 0.00 O ATOM 1606 CB THR B 4 -0.119 13.038 -11.267 1.00 0.00 C ATOM 1607 OG1 THR B 4 1.232 12.974 -11.702 1.00 0.00 O ATOM 1608 CG2 THR B 4 -0.798 14.264 -11.885 1.00 0.00 C ATOM 0 H THR B 4 -0.107 11.001 -9.696 1.00 0.00 H new ATOM 0 HA THR B 4 0.450 13.964 -9.370 1.00 0.00 H new ATOM 0 HB THR B 4 -0.648 12.138 -11.583 1.00 0.00 H new ATOM 0 HG1 THR B 4 1.258 12.908 -12.679 1.00 0.00 H new ATOM 0 HG21 THR B 4 -0.767 14.188 -12.972 1.00 0.00 H new ATOM 0 HG22 THR B 4 -1.835 14.311 -11.554 1.00 0.00 H new ATOM 0 HG23 THR B 4 -0.275 15.167 -11.570 1.00 0.00 H new ATOM 1616 N GLU B 5 -2.473 12.462 -9.507 1.00 0.00 N ATOM 1617 CA GLU B 5 -3.877 12.645 -9.051 1.00 0.00 C ATOM 1618 C GLU B 5 -3.924 12.631 -7.525 1.00 0.00 C ATOM 1619 O GLU B 5 -4.540 13.482 -6.917 1.00 0.00 O ATOM 1620 CB GLU B 5 -4.666 11.478 -9.639 1.00 0.00 C ATOM 1621 CG GLU B 5 -5.385 11.935 -10.910 1.00 0.00 C ATOM 1622 CD GLU B 5 -6.718 11.195 -11.038 1.00 0.00 C ATOM 1623 OE1 GLU B 5 -7.486 11.231 -10.092 1.00 0.00 O ATOM 1624 OE2 GLU B 5 -6.948 10.606 -12.082 1.00 0.00 O ATOM 0 H GLU B 5 -2.285 11.595 -10.011 1.00 0.00 H new ATOM 0 HA GLU B 5 -4.297 13.596 -9.377 1.00 0.00 H new ATOM 0 HB2 GLU B 5 -3.995 10.650 -9.866 1.00 0.00 H new ATOM 0 HB3 GLU B 5 -5.390 11.111 -8.911 1.00 0.00 H new ATOM 0 HG2 GLU B 5 -5.556 13.011 -10.876 1.00 0.00 H new ATOM 0 HG3 GLU B 5 -4.763 11.738 -11.783 1.00 0.00 H new ATOM 1631 N LEU B 6 -3.271 11.682 -6.894 1.00 0.00 N ATOM 1632 CA LEU B 6 -3.279 11.648 -5.395 1.00 0.00 C ATOM 1633 C LEU B 6 -2.934 13.035 -4.847 1.00 0.00 C ATOM 1634 O LEU B 6 -3.668 13.590 -4.049 1.00 0.00 O ATOM 1635 CB LEU B 6 -2.222 10.619 -4.999 1.00 0.00 C ATOM 1636 CG LEU B 6 -2.802 9.210 -5.142 1.00 0.00 C ATOM 1637 CD1 LEU B 6 -1.710 8.176 -4.869 1.00 0.00 C ATOM 1638 CD2 LEU B 6 -3.943 9.023 -4.138 1.00 0.00 C ATOM 0 H LEU B 6 -2.739 10.938 -7.345 1.00 0.00 H new ATOM 0 HA LEU B 6 -4.255 11.378 -4.991 1.00 0.00 H new ATOM 0 HB2 LEU B 6 -1.340 10.726 -5.630 1.00 0.00 H new ATOM 0 HB3 LEU B 6 -1.901 10.789 -3.971 1.00 0.00 H new ATOM 0 HG LEU B 6 -3.182 9.077 -6.155 1.00 0.00 H new ATOM 0 HD11 LEU B 6 -2.125 7.173 -4.971 1.00 0.00 H new ATOM 0 HD12 LEU B 6 -0.898 8.307 -5.584 1.00 0.00 H new ATOM 0 HD13 LEU B 6 -1.328 8.309 -3.857 1.00 0.00 H new ATOM 0 HD21 LEU B 6 -4.356 8.020 -4.240 1.00 0.00 H new ATOM 0 HD22 LEU B 6 -3.562 9.158 -3.126 1.00 0.00 H new ATOM 0 HD23 LEU B 6 -4.724 9.758 -4.333 1.00 0.00 H new ATOM 1650 N ILE B 7 -1.850 13.625 -5.297 1.00 0.00 N ATOM 1651 CA ILE B 7 -1.520 15.010 -4.820 1.00 0.00 C ATOM 1652 C ILE B 7 -2.785 15.841 -5.003 1.00 0.00 C ATOM 1653 O ILE B 7 -3.273 16.473 -4.090 1.00 0.00 O ATOM 1654 CB ILE B 7 -0.344 15.552 -5.677 1.00 0.00 C ATOM 1655 CG1 ILE B 7 -0.777 16.774 -6.493 1.00 0.00 C ATOM 1656 CG2 ILE B 7 0.187 14.495 -6.640 1.00 0.00 C ATOM 1657 CD1 ILE B 7 0.466 17.543 -6.926 1.00 0.00 C ATOM 0 H ILE B 7 -1.191 13.218 -5.961 1.00 0.00 H new ATOM 0 HA ILE B 7 -1.211 15.040 -3.775 1.00 0.00 H new ATOM 0 HB ILE B 7 0.445 15.831 -4.979 1.00 0.00 H new ATOM 0 HG12 ILE B 7 -1.350 16.461 -7.366 1.00 0.00 H new ATOM 0 HG13 ILE B 7 -1.428 17.414 -5.897 1.00 0.00 H new ATOM 0 HG21 ILE B 7 1.009 14.913 -7.222 1.00 0.00 H new ATOM 0 HG22 ILE B 7 0.543 13.634 -6.075 1.00 0.00 H new ATOM 0 HG23 ILE B 7 -0.611 14.182 -7.313 1.00 0.00 H new ATOM 0 HD11 ILE B 7 0.170 18.416 -7.508 1.00 0.00 H new ATOM 0 HD12 ILE B 7 1.020 17.866 -6.044 1.00 0.00 H new ATOM 0 HD13 ILE B 7 1.099 16.898 -7.536 1.00 0.00 H new ATOM 1669 N LYS B 8 -3.339 15.788 -6.183 1.00 0.00 N ATOM 1670 CA LYS B 8 -4.603 16.512 -6.457 1.00 0.00 C ATOM 1671 C LYS B 8 -5.663 16.061 -5.455 1.00 0.00 C ATOM 1672 O LYS B 8 -6.460 16.846 -4.987 1.00 0.00 O ATOM 1673 CB LYS B 8 -4.988 16.078 -7.870 1.00 0.00 C ATOM 1674 CG LYS B 8 -5.498 17.275 -8.668 1.00 0.00 C ATOM 1675 CD LYS B 8 -6.815 16.910 -9.370 1.00 0.00 C ATOM 1676 CE LYS B 8 -6.689 15.537 -10.046 1.00 0.00 C ATOM 1677 NZ LYS B 8 -7.279 15.720 -11.402 1.00 0.00 N ATOM 0 H LYS B 8 -2.962 15.267 -6.975 1.00 0.00 H new ATOM 0 HA LYS B 8 -4.508 17.595 -6.372 1.00 0.00 H new ATOM 0 HB2 LYS B 8 -4.126 15.638 -8.371 1.00 0.00 H new ATOM 0 HB3 LYS B 8 -5.757 15.307 -7.825 1.00 0.00 H new ATOM 0 HG2 LYS B 8 -5.652 18.126 -8.005 1.00 0.00 H new ATOM 0 HG3 LYS B 8 -4.754 17.576 -9.405 1.00 0.00 H new ATOM 0 HD2 LYS B 8 -7.630 16.894 -8.646 1.00 0.00 H new ATOM 0 HD3 LYS B 8 -7.063 17.668 -10.113 1.00 0.00 H new ATOM 0 HE2 LYS B 8 -5.647 15.222 -10.108 1.00 0.00 H new ATOM 0 HE3 LYS B 8 -7.222 14.770 -9.484 1.00 0.00 H new ATOM 0 HZ1 LYS B 8 -7.229 14.823 -11.926 1.00 0.00 H new ATOM 0 HZ2 LYS B 8 -8.273 16.014 -11.312 1.00 0.00 H new ATOM 0 HZ3 LYS B 8 -6.747 16.451 -11.916 1.00 0.00 H new ATOM 1691 N ALA B 9 -5.668 14.795 -5.110 1.00 0.00 N ATOM 1692 CA ALA B 9 -6.665 14.302 -4.121 1.00 0.00 C ATOM 1693 C ALA B 9 -6.548 15.132 -2.850 1.00 0.00 C ATOM 1694 O ALA B 9 -7.529 15.449 -2.210 1.00 0.00 O ATOM 1695 CB ALA B 9 -6.271 12.858 -3.848 1.00 0.00 C ATOM 0 H ALA B 9 -5.026 14.089 -5.471 1.00 0.00 H new ATOM 0 HA ALA B 9 -7.692 14.376 -4.478 1.00 0.00 H new ATOM 0 HB1 ALA B 9 -6.961 12.423 -3.125 1.00 0.00 H new ATOM 0 HB2 ALA B 9 -6.311 12.288 -4.776 1.00 0.00 H new ATOM 0 HB3 ALA B 9 -5.258 12.827 -3.446 1.00 0.00 H new ATOM 1701 N ILE B 10 -5.349 15.515 -2.501 1.00 0.00 N ATOM 1702 CA ILE B 10 -5.155 16.352 -1.304 1.00 0.00 C ATOM 1703 C ILE B 10 -5.261 17.794 -1.751 1.00 0.00 C ATOM 1704 O ILE B 10 -5.774 18.646 -1.066 1.00 0.00 O ATOM 1705 CB ILE B 10 -3.737 16.005 -0.829 1.00 0.00 C ATOM 1706 CG1 ILE B 10 -3.798 14.821 0.135 1.00 0.00 C ATOM 1707 CG2 ILE B 10 -3.098 17.206 -0.126 1.00 0.00 C ATOM 1708 CD1 ILE B 10 -4.289 13.579 -0.610 1.00 0.00 C ATOM 0 H ILE B 10 -4.495 15.277 -3.005 1.00 0.00 H new ATOM 0 HA ILE B 10 -5.878 16.193 -0.504 1.00 0.00 H new ATOM 0 HB ILE B 10 -3.130 15.743 -1.696 1.00 0.00 H new ATOM 0 HG12 ILE B 10 -2.813 14.636 0.562 1.00 0.00 H new ATOM 0 HG13 ILE B 10 -4.467 15.048 0.965 1.00 0.00 H new ATOM 0 HG21 ILE B 10 -2.093 16.942 0.204 1.00 0.00 H new ATOM 0 HG22 ILE B 10 -3.044 18.046 -0.818 1.00 0.00 H new ATOM 0 HG23 ILE B 10 -3.702 17.486 0.737 1.00 0.00 H new ATOM 0 HD11 ILE B 10 -4.332 12.735 0.078 1.00 0.00 H new ATOM 0 HD12 ILE B 10 -5.283 13.767 -1.016 1.00 0.00 H new ATOM 0 HD13 ILE B 10 -3.602 13.348 -1.424 1.00 0.00 H new ATOM 1720 N ALA B 11 -4.813 18.065 -2.932 1.00 0.00 N ATOM 1721 CA ALA B 11 -4.927 19.443 -3.442 1.00 0.00 C ATOM 1722 C ALA B 11 -6.415 19.754 -3.649 1.00 0.00 C ATOM 1723 O ALA B 11 -6.810 20.891 -3.827 1.00 0.00 O ATOM 1724 CB ALA B 11 -4.155 19.421 -4.760 1.00 0.00 C ATOM 0 H ALA B 11 -4.375 17.395 -3.564 1.00 0.00 H new ATOM 0 HA ALA B 11 -4.530 20.208 -2.774 1.00 0.00 H new ATOM 0 HB1 ALA B 11 -4.185 20.411 -5.216 1.00 0.00 H new ATOM 0 HB2 ALA B 11 -3.119 19.140 -4.570 1.00 0.00 H new ATOM 0 HB3 ALA B 11 -4.609 18.696 -5.436 1.00 0.00 H new ATOM 1730 N GLN B 12 -7.244 18.736 -3.600 1.00 0.00 N ATOM 1731 CA GLN B 12 -8.706 18.936 -3.761 1.00 0.00 C ATOM 1732 C GLN B 12 -9.402 18.620 -2.435 1.00 0.00 C ATOM 1733 O GLN B 12 -10.236 19.375 -1.974 1.00 0.00 O ATOM 1734 CB GLN B 12 -9.125 17.954 -4.860 1.00 0.00 C ATOM 1735 CG GLN B 12 -10.650 17.929 -4.986 1.00 0.00 C ATOM 1736 CD GLN B 12 -11.145 19.292 -5.471 1.00 0.00 C ATOM 1737 OE1 GLN B 12 -12.039 19.871 -4.885 1.00 0.00 O ATOM 1738 NE2 GLN B 12 -10.599 19.833 -6.526 1.00 0.00 N ATOM 0 H GLN B 12 -6.959 17.768 -3.453 1.00 0.00 H new ATOM 0 HA GLN B 12 -8.973 19.958 -4.029 1.00 0.00 H new ATOM 0 HB2 GLN B 12 -8.678 18.247 -5.810 1.00 0.00 H new ATOM 0 HB3 GLN B 12 -8.755 16.956 -4.628 1.00 0.00 H new ATOM 0 HG2 GLN B 12 -10.955 17.150 -5.685 1.00 0.00 H new ATOM 0 HG3 GLN B 12 -11.101 17.688 -4.023 1.00 0.00 H new ATOM 0 HE21 GLN B 12 -9.849 19.347 -7.018 1.00 0.00 H new ATOM 0 HE22 GLN B 12 -10.922 20.741 -6.859 1.00 0.00 H new ATOM 1747 N ASP B 13 -9.028 17.544 -1.783 1.00 0.00 N ATOM 1748 CA ASP B 13 -9.644 17.252 -0.456 1.00 0.00 C ATOM 1749 C ASP B 13 -9.132 18.314 0.501 1.00 0.00 C ATOM 1750 O ASP B 13 -9.723 18.619 1.518 1.00 0.00 O ATOM 1751 CB ASP B 13 -9.131 15.874 -0.042 1.00 0.00 C ATOM 1752 CG ASP B 13 -9.800 14.797 -0.899 1.00 0.00 C ATOM 1753 OD1 ASP B 13 -10.014 15.051 -2.073 1.00 0.00 O ATOM 1754 OD2 ASP B 13 -10.087 13.737 -0.367 1.00 0.00 O ATOM 0 H ASP B 13 -8.336 16.869 -2.107 1.00 0.00 H new ATOM 0 HA ASP B 13 -10.734 17.259 -0.468 1.00 0.00 H new ATOM 0 HB2 ASP B 13 -8.049 15.827 -0.161 1.00 0.00 H new ATOM 0 HB3 ASP B 13 -9.343 15.698 1.012 1.00 0.00 H new ATOM 1759 N THR B 14 -8.017 18.884 0.142 1.00 0.00 N ATOM 1760 CA THR B 14 -7.392 19.944 0.948 1.00 0.00 C ATOM 1761 C THR B 14 -7.298 21.208 0.083 1.00 0.00 C ATOM 1762 O THR B 14 -8.158 22.065 0.143 1.00 0.00 O ATOM 1763 CB THR B 14 -6.020 19.374 1.308 1.00 0.00 C ATOM 1764 OG1 THR B 14 -5.959 17.997 0.956 1.00 0.00 O ATOM 1765 CG2 THR B 14 -5.826 19.496 2.798 1.00 0.00 C ATOM 0 H THR B 14 -7.504 18.644 -0.706 1.00 0.00 H new ATOM 0 HA THR B 14 -7.941 20.221 1.848 1.00 0.00 H new ATOM 0 HB THR B 14 -5.247 19.922 0.770 1.00 0.00 H new ATOM 0 HG1 THR B 14 -5.782 17.462 1.758 1.00 0.00 H new ATOM 0 HG21 THR B 14 -4.851 19.093 3.072 1.00 0.00 H new ATOM 0 HG22 THR B 14 -5.880 20.546 3.087 1.00 0.00 H new ATOM 0 HG23 THR B 14 -6.607 18.937 3.314 1.00 0.00 H new ATOM 1773 N GLY B 15 -6.282 21.330 -0.736 1.00 0.00 N ATOM 1774 CA GLY B 15 -6.165 22.535 -1.616 1.00 0.00 C ATOM 1775 C GLY B 15 -5.883 23.783 -0.775 1.00 0.00 C ATOM 1776 O GLY B 15 -5.379 24.770 -1.271 1.00 0.00 O ATOM 0 H GLY B 15 -5.529 20.648 -0.833 1.00 0.00 H new ATOM 0 HA2 GLY B 15 -5.364 22.388 -2.341 1.00 0.00 H new ATOM 0 HA3 GLY B 15 -7.086 22.671 -2.182 1.00 0.00 H new ATOM 1780 N LEU B 16 -6.216 23.737 0.492 1.00 0.00 N ATOM 1781 CA LEU B 16 -5.984 24.918 1.410 1.00 0.00 C ATOM 1782 C LEU B 16 -4.843 25.784 0.898 1.00 0.00 C ATOM 1783 O LEU B 16 -4.989 26.963 0.643 1.00 0.00 O ATOM 1784 CB LEU B 16 -5.588 24.394 2.808 1.00 0.00 C ATOM 1785 CG LEU B 16 -5.640 22.879 2.874 1.00 0.00 C ATOM 1786 CD1 LEU B 16 -4.539 22.288 1.989 1.00 0.00 C ATOM 1787 CD2 LEU B 16 -5.415 22.423 4.321 1.00 0.00 C ATOM 0 H LEU B 16 -6.643 22.928 0.942 1.00 0.00 H new ATOM 0 HA LEU B 16 -6.899 25.508 1.451 1.00 0.00 H new ATOM 0 HB2 LEU B 16 -4.582 24.735 3.053 1.00 0.00 H new ATOM 0 HB3 LEU B 16 -6.258 24.814 3.558 1.00 0.00 H new ATOM 0 HG LEU B 16 -6.615 22.538 2.525 1.00 0.00 H new ATOM 0 HD11 LEU B 16 -4.578 21.200 2.038 1.00 0.00 H new ATOM 0 HD12 LEU B 16 -4.688 22.611 0.959 1.00 0.00 H new ATOM 0 HD13 LEU B 16 -3.566 22.632 2.340 1.00 0.00 H new ATOM 0 HD21 LEU B 16 -5.452 21.335 4.369 1.00 0.00 H new ATOM 0 HD22 LEU B 16 -4.440 22.768 4.664 1.00 0.00 H new ATOM 0 HD23 LEU B 16 -6.193 22.841 4.959 1.00 0.00 H new ATOM 1799 N THR B 17 -3.704 25.183 0.763 1.00 0.00 N ATOM 1800 CA THR B 17 -2.511 25.910 0.288 1.00 0.00 C ATOM 1801 C THR B 17 -1.772 25.056 -0.741 1.00 0.00 C ATOM 1802 O THR B 17 -0.737 25.444 -1.247 1.00 0.00 O ATOM 1803 CB THR B 17 -1.670 26.100 1.563 1.00 0.00 C ATOM 1804 OG1 THR B 17 -1.178 27.430 1.615 1.00 0.00 O ATOM 1805 CG2 THR B 17 -0.498 25.121 1.584 1.00 0.00 C ATOM 0 H THR B 17 -3.548 24.196 0.967 1.00 0.00 H new ATOM 0 HA THR B 17 -2.737 26.858 -0.199 1.00 0.00 H new ATOM 0 HB THR B 17 -2.302 25.908 2.430 1.00 0.00 H new ATOM 0 HG1 THR B 17 -0.644 27.550 2.428 1.00 0.00 H new ATOM 0 HG21 THR B 17 0.085 25.271 2.493 1.00 0.00 H new ATOM 0 HG22 THR B 17 -0.877 24.099 1.560 1.00 0.00 H new ATOM 0 HG23 THR B 17 0.136 25.293 0.714 1.00 0.00 H new ATOM 1813 N GLN B 18 -2.263 23.869 -1.021 1.00 0.00 N ATOM 1814 CA GLN B 18 -1.532 22.981 -1.964 1.00 0.00 C ATOM 1815 C GLN B 18 -0.126 22.838 -1.414 1.00 0.00 C ATOM 1816 O GLN B 18 0.835 22.702 -2.143 1.00 0.00 O ATOM 1817 CB GLN B 18 -1.533 23.695 -3.319 1.00 0.00 C ATOM 1818 CG GLN B 18 -2.929 24.255 -3.598 1.00 0.00 C ATOM 1819 CD GLN B 18 -3.146 24.367 -5.108 1.00 0.00 C ATOM 1820 OE1 GLN B 18 -4.219 24.082 -5.601 1.00 0.00 O ATOM 1821 NE2 GLN B 18 -2.166 24.772 -5.868 1.00 0.00 N ATOM 0 H GLN B 18 -3.128 23.487 -0.639 1.00 0.00 H new ATOM 0 HA GLN B 18 -1.976 21.992 -2.078 1.00 0.00 H new ATOM 0 HB2 GLN B 18 -0.799 24.501 -3.318 1.00 0.00 H new ATOM 0 HB3 GLN B 18 -1.243 23.001 -4.108 1.00 0.00 H new ATOM 0 HG2 GLN B 18 -3.686 23.606 -3.159 1.00 0.00 H new ATOM 0 HG3 GLN B 18 -3.039 25.234 -3.131 1.00 0.00 H new ATOM 0 HE21 GLN B 18 -1.265 25.011 -5.454 1.00 0.00 H new ATOM 0 HE22 GLN B 18 -2.301 24.849 -6.876 1.00 0.00 H new ATOM 1830 N VAL B 19 -0.033 22.900 -0.102 1.00 0.00 N ATOM 1831 CA VAL B 19 1.276 22.808 0.607 1.00 0.00 C ATOM 1832 C VAL B 19 2.393 22.539 -0.399 1.00 0.00 C ATOM 1833 O VAL B 19 2.937 23.447 -0.996 1.00 0.00 O ATOM 1834 CB VAL B 19 1.095 21.668 1.654 1.00 0.00 C ATOM 1835 CG1 VAL B 19 0.307 20.491 1.066 1.00 0.00 C ATOM 1836 CG2 VAL B 19 2.453 21.159 2.149 1.00 0.00 C ATOM 0 H VAL B 19 -0.836 23.014 0.517 1.00 0.00 H new ATOM 0 HA VAL B 19 1.562 23.731 1.111 1.00 0.00 H new ATOM 0 HB VAL B 19 0.537 22.089 2.491 1.00 0.00 H new ATOM 0 HG11 VAL B 19 0.198 19.713 1.821 1.00 0.00 H new ATOM 0 HG12 VAL B 19 -0.679 20.834 0.753 1.00 0.00 H new ATOM 0 HG13 VAL B 19 0.842 20.089 0.205 1.00 0.00 H new ATOM 0 HG21 VAL B 19 2.300 20.364 2.879 1.00 0.00 H new ATOM 0 HG22 VAL B 19 3.026 20.772 1.306 1.00 0.00 H new ATOM 0 HG23 VAL B 19 3.001 21.978 2.615 1.00 0.00 H new ATOM 1846 N SER B 20 2.699 21.313 -0.616 1.00 0.00 N ATOM 1847 CA SER B 20 3.719 20.943 -1.593 1.00 0.00 C ATOM 1848 C SER B 20 3.155 19.826 -2.428 1.00 0.00 C ATOM 1849 O SER B 20 3.894 19.016 -2.916 1.00 0.00 O ATOM 1850 CB SER B 20 4.911 20.469 -0.789 1.00 0.00 C ATOM 1851 OG SER B 20 5.959 21.429 -0.868 1.00 0.00 O ATOM 0 H SER B 20 2.266 20.523 -0.137 1.00 0.00 H new ATOM 0 HA SER B 20 4.011 21.761 -2.251 1.00 0.00 H new ATOM 0 HB2 SER B 20 4.622 20.317 0.251 1.00 0.00 H new ATOM 0 HB3 SER B 20 5.257 19.507 -1.168 1.00 0.00 H new ATOM 0 HG SER B 20 5.855 21.961 -1.684 1.00 0.00 H new ATOM 1857 N VAL B 21 1.846 19.728 -2.554 1.00 0.00 N ATOM 1858 CA VAL B 21 1.233 18.614 -3.342 1.00 0.00 C ATOM 1859 C VAL B 21 2.287 17.990 -4.234 1.00 0.00 C ATOM 1860 O VAL B 21 2.375 16.792 -4.396 1.00 0.00 O ATOM 1861 CB VAL B 21 0.141 19.276 -4.178 1.00 0.00 C ATOM 1862 CG1 VAL B 21 -0.945 19.831 -3.256 1.00 0.00 C ATOM 1863 CG2 VAL B 21 0.735 20.418 -5.009 1.00 0.00 C ATOM 0 H VAL B 21 1.177 20.378 -2.141 1.00 0.00 H new ATOM 0 HA VAL B 21 0.830 17.821 -2.712 1.00 0.00 H new ATOM 0 HB VAL B 21 -0.292 18.533 -4.848 1.00 0.00 H new ATOM 0 HG11 VAL B 21 -1.724 20.303 -3.855 1.00 0.00 H new ATOM 0 HG12 VAL B 21 -1.378 19.018 -2.673 1.00 0.00 H new ATOM 0 HG13 VAL B 21 -0.508 20.568 -2.582 1.00 0.00 H new ATOM 0 HG21 VAL B 21 -0.052 20.884 -5.602 1.00 0.00 H new ATOM 0 HG22 VAL B 21 1.176 21.160 -4.344 1.00 0.00 H new ATOM 0 HG23 VAL B 21 1.504 20.023 -5.673 1.00 0.00 H new ATOM 1873 N SER B 22 3.128 18.821 -4.753 1.00 0.00 N ATOM 1874 CA SER B 22 4.245 18.331 -5.610 1.00 0.00 C ATOM 1875 C SER B 22 5.387 17.806 -4.730 1.00 0.00 C ATOM 1876 O SER B 22 5.988 16.788 -5.016 1.00 0.00 O ATOM 1877 CB SER B 22 4.697 19.549 -6.414 1.00 0.00 C ATOM 1878 OG SER B 22 5.584 19.130 -7.442 1.00 0.00 O ATOM 0 H SER B 22 3.096 19.832 -4.624 1.00 0.00 H new ATOM 0 HA SER B 22 3.941 17.511 -6.261 1.00 0.00 H new ATOM 0 HB2 SER B 22 3.834 20.055 -6.846 1.00 0.00 H new ATOM 0 HB3 SER B 22 5.192 20.267 -5.761 1.00 0.00 H new ATOM 0 HG SER B 22 5.875 19.909 -7.961 1.00 0.00 H new ATOM 1884 N LYS B 23 5.686 18.497 -3.661 1.00 0.00 N ATOM 1885 CA LYS B 23 6.779 18.053 -2.758 1.00 0.00 C ATOM 1886 C LYS B 23 6.268 17.068 -1.700 1.00 0.00 C ATOM 1887 O LYS B 23 6.968 16.140 -1.347 1.00 0.00 O ATOM 1888 CB LYS B 23 7.295 19.333 -2.103 1.00 0.00 C ATOM 1889 CG LYS B 23 8.780 19.518 -2.415 1.00 0.00 C ATOM 1890 CD LYS B 23 9.591 19.486 -1.114 1.00 0.00 C ATOM 1891 CE LYS B 23 9.059 20.548 -0.145 1.00 0.00 C ATOM 1892 NZ LYS B 23 10.271 21.231 0.388 1.00 0.00 N ATOM 0 H LYS B 23 5.214 19.355 -3.376 1.00 0.00 H new ATOM 0 HA LYS B 23 7.560 17.525 -3.304 1.00 0.00 H new ATOM 0 HB2 LYS B 23 6.729 20.191 -2.466 1.00 0.00 H new ATOM 0 HB3 LYS B 23 7.145 19.285 -1.024 1.00 0.00 H new ATOM 0 HG2 LYS B 23 9.121 18.730 -3.087 1.00 0.00 H new ATOM 0 HG3 LYS B 23 8.938 20.466 -2.930 1.00 0.00 H new ATOM 0 HD2 LYS B 23 9.525 18.498 -0.658 1.00 0.00 H new ATOM 0 HD3 LYS B 23 10.644 19.669 -1.327 1.00 0.00 H new ATOM 0 HE2 LYS B 23 8.402 21.253 -0.655 1.00 0.00 H new ATOM 0 HE3 LYS B 23 8.478 20.093 0.657 1.00 0.00 H new ATOM 0 HZ1 LYS B 23 9.985 21.972 1.059 1.00 0.00 H new ATOM 0 HZ2 LYS B 23 10.875 20.538 0.874 1.00 0.00 H new ATOM 0 HZ3 LYS B 23 10.801 21.661 -0.397 1.00 0.00 H new ATOM 1906 N MET B 24 5.065 17.229 -1.188 1.00 0.00 N ATOM 1907 CA MET B 24 4.598 16.242 -0.172 1.00 0.00 C ATOM 1908 C MET B 24 4.318 14.920 -0.875 1.00 0.00 C ATOM 1909 O MET B 24 4.499 13.864 -0.305 1.00 0.00 O ATOM 1910 CB MET B 24 3.341 16.786 0.540 1.00 0.00 C ATOM 1911 CG MET B 24 2.562 17.781 -0.320 1.00 0.00 C ATOM 1912 SD MET B 24 0.835 17.280 -0.342 1.00 0.00 S ATOM 1913 CE MET B 24 1.138 15.848 -1.392 1.00 0.00 C ATOM 0 H MET B 24 4.411 17.976 -1.423 1.00 0.00 H new ATOM 0 HA MET B 24 5.362 16.079 0.588 1.00 0.00 H new ATOM 0 HB2 MET B 24 2.690 15.953 0.806 1.00 0.00 H new ATOM 0 HB3 MET B 24 3.636 17.270 1.471 1.00 0.00 H new ATOM 0 HG2 MET B 24 2.660 18.789 0.083 1.00 0.00 H new ATOM 0 HG3 MET B 24 2.964 17.803 -1.333 1.00 0.00 H new ATOM 0 HE1 MET B 24 0.213 15.560 -1.891 1.00 0.00 H new ATOM 0 HE2 MET B 24 1.891 16.098 -2.139 1.00 0.00 H new ATOM 0 HE3 MET B 24 1.494 15.018 -0.782 1.00 0.00 H new ATOM 1923 N LEU B 25 3.924 14.954 -2.128 1.00 0.00 N ATOM 1924 CA LEU B 25 3.705 13.668 -2.842 1.00 0.00 C ATOM 1925 C LEU B 25 5.076 13.083 -3.185 1.00 0.00 C ATOM 1926 O LEU B 25 5.321 11.903 -3.024 1.00 0.00 O ATOM 1927 CB LEU B 25 2.895 14.016 -4.096 1.00 0.00 C ATOM 1928 CG LEU B 25 3.810 14.184 -5.320 1.00 0.00 C ATOM 1929 CD1 LEU B 25 4.188 12.805 -5.868 1.00 0.00 C ATOM 1930 CD2 LEU B 25 3.088 14.981 -6.404 1.00 0.00 C ATOM 0 H LEU B 25 3.750 15.799 -2.671 1.00 0.00 H new ATOM 0 HA LEU B 25 3.166 12.926 -2.254 1.00 0.00 H new ATOM 0 HB2 LEU B 25 2.164 13.231 -4.290 1.00 0.00 H new ATOM 0 HB3 LEU B 25 2.336 14.937 -3.927 1.00 0.00 H new ATOM 0 HG LEU B 25 4.711 14.720 -5.022 1.00 0.00 H new ATOM 0 HD11 LEU B 25 4.837 12.924 -6.736 1.00 0.00 H new ATOM 0 HD12 LEU B 25 4.712 12.239 -5.098 1.00 0.00 H new ATOM 0 HD13 LEU B 25 3.285 12.270 -6.161 1.00 0.00 H new ATOM 0 HD21 LEU B 25 3.743 15.096 -7.268 1.00 0.00 H new ATOM 0 HD22 LEU B 25 2.183 14.452 -6.702 1.00 0.00 H new ATOM 0 HD23 LEU B 25 2.823 15.965 -6.017 1.00 0.00 H new ATOM 1942 N ALA B 26 5.985 13.920 -3.623 1.00 0.00 N ATOM 1943 CA ALA B 26 7.352 13.435 -3.937 1.00 0.00 C ATOM 1944 C ALA B 26 8.005 13.044 -2.621 1.00 0.00 C ATOM 1945 O ALA B 26 8.885 12.209 -2.565 1.00 0.00 O ATOM 1946 CB ALA B 26 8.072 14.625 -4.574 1.00 0.00 C ATOM 0 H ALA B 26 5.833 14.917 -3.775 1.00 0.00 H new ATOM 0 HA ALA B 26 7.373 12.576 -4.607 1.00 0.00 H new ATOM 0 HB1 ALA B 26 9.091 14.338 -4.832 1.00 0.00 H new ATOM 0 HB2 ALA B 26 7.542 14.931 -5.476 1.00 0.00 H new ATOM 0 HB3 ALA B 26 8.097 15.455 -3.868 1.00 0.00 H new ATOM 1952 N SER B 27 7.534 13.629 -1.550 1.00 0.00 N ATOM 1953 CA SER B 27 8.071 13.284 -0.214 1.00 0.00 C ATOM 1954 C SER B 27 7.333 12.048 0.276 1.00 0.00 C ATOM 1955 O SER B 27 7.901 11.168 0.885 1.00 0.00 O ATOM 1956 CB SER B 27 7.763 14.486 0.675 1.00 0.00 C ATOM 1957 OG SER B 27 7.810 14.084 2.038 1.00 0.00 O ATOM 0 H SER B 27 6.797 14.334 -1.551 1.00 0.00 H new ATOM 0 HA SER B 27 9.140 13.072 -0.216 1.00 0.00 H new ATOM 0 HB2 SER B 27 8.485 15.282 0.493 1.00 0.00 H new ATOM 0 HB3 SER B 27 6.778 14.888 0.436 1.00 0.00 H new ATOM 0 HG SER B 27 8.557 13.464 2.171 1.00 0.00 H new ATOM 1963 N PHE B 28 6.062 11.967 -0.026 1.00 0.00 N ATOM 1964 CA PHE B 28 5.267 10.778 0.381 1.00 0.00 C ATOM 1965 C PHE B 28 6.003 9.537 -0.087 1.00 0.00 C ATOM 1966 O PHE B 28 6.320 8.665 0.688 1.00 0.00 O ATOM 1967 CB PHE B 28 3.918 10.943 -0.327 1.00 0.00 C ATOM 1968 CG PHE B 28 3.395 9.608 -0.811 1.00 0.00 C ATOM 1969 CD1 PHE B 28 3.767 9.130 -2.073 1.00 0.00 C ATOM 1970 CD2 PHE B 28 2.513 8.862 -0.017 1.00 0.00 C ATOM 1971 CE1 PHE B 28 3.265 7.925 -2.538 1.00 0.00 C ATOM 1972 CE2 PHE B 28 2.016 7.652 -0.486 1.00 0.00 C ATOM 1973 CZ PHE B 28 2.388 7.184 -1.747 1.00 0.00 C ATOM 0 H PHE B 28 5.542 12.679 -0.539 1.00 0.00 H new ATOM 0 HA PHE B 28 5.123 10.686 1.458 1.00 0.00 H new ATOM 0 HB2 PHE B 28 3.198 11.395 0.355 1.00 0.00 H new ATOM 0 HB3 PHE B 28 4.027 11.623 -1.172 1.00 0.00 H new ATOM 0 HD1 PHE B 28 4.447 9.702 -2.686 1.00 0.00 H new ATOM 0 HD2 PHE B 28 2.221 9.227 0.957 1.00 0.00 H new ATOM 0 HE1 PHE B 28 3.553 7.560 -3.513 1.00 0.00 H new ATOM 0 HE2 PHE B 28 1.341 7.073 0.126 1.00 0.00 H new ATOM 0 HZ PHE B 28 1.996 6.246 -2.111 1.00 0.00 H new ATOM 1983 N GLU B 29 6.327 9.480 -1.346 1.00 0.00 N ATOM 1984 CA GLU B 29 7.087 8.321 -1.846 1.00 0.00 C ATOM 1985 C GLU B 29 8.430 8.336 -1.156 1.00 0.00 C ATOM 1986 O GLU B 29 8.962 7.319 -0.758 1.00 0.00 O ATOM 1987 CB GLU B 29 7.254 8.549 -3.341 1.00 0.00 C ATOM 1988 CG GLU B 29 7.595 7.217 -3.990 1.00 0.00 C ATOM 1989 CD GLU B 29 8.978 7.294 -4.641 1.00 0.00 C ATOM 1990 OE1 GLU B 29 9.915 7.663 -3.954 1.00 0.00 O ATOM 1991 OE2 GLU B 29 9.076 6.981 -5.816 1.00 0.00 O ATOM 0 H GLU B 29 6.096 10.187 -2.044 1.00 0.00 H new ATOM 0 HA GLU B 29 6.599 7.365 -1.658 1.00 0.00 H new ATOM 0 HB2 GLU B 29 6.338 8.956 -3.768 1.00 0.00 H new ATOM 0 HB3 GLU B 29 8.044 9.276 -3.529 1.00 0.00 H new ATOM 0 HG2 GLU B 29 7.579 6.424 -3.243 1.00 0.00 H new ATOM 0 HG3 GLU B 29 6.844 6.965 -4.739 1.00 0.00 H new ATOM 1998 N LYS B 30 8.967 9.507 -0.990 1.00 0.00 N ATOM 1999 CA LYS B 30 10.265 9.624 -0.298 1.00 0.00 C ATOM 2000 C LYS B 30 10.162 8.980 1.078 1.00 0.00 C ATOM 2001 O LYS B 30 11.111 8.449 1.563 1.00 0.00 O ATOM 2002 CB LYS B 30 10.568 11.112 -0.171 1.00 0.00 C ATOM 2003 CG LYS B 30 12.016 11.270 0.287 1.00 0.00 C ATOM 2004 CD LYS B 30 12.454 12.726 0.119 1.00 0.00 C ATOM 2005 CE LYS B 30 13.640 13.013 1.043 1.00 0.00 C ATOM 2006 NZ LYS B 30 13.041 13.645 2.251 1.00 0.00 N ATOM 0 H LYS B 30 8.559 10.387 -1.306 1.00 0.00 H new ATOM 0 HA LYS B 30 11.060 9.120 -0.848 1.00 0.00 H new ATOM 0 HB2 LYS B 30 10.415 11.613 -1.127 1.00 0.00 H new ATOM 0 HB3 LYS B 30 9.891 11.578 0.545 1.00 0.00 H new ATOM 0 HG2 LYS B 30 12.112 10.969 1.330 1.00 0.00 H new ATOM 0 HG3 LYS B 30 12.665 10.615 -0.295 1.00 0.00 H new ATOM 0 HD2 LYS B 30 12.733 12.916 -0.918 1.00 0.00 H new ATOM 0 HD3 LYS B 30 11.626 13.395 0.354 1.00 0.00 H new ATOM 0 HE2 LYS B 30 14.172 12.097 1.299 1.00 0.00 H new ATOM 0 HE3 LYS B 30 14.361 13.677 0.566 1.00 0.00 H new ATOM 0 HZ1 LYS B 30 13.793 13.872 2.933 1.00 0.00 H new ATOM 0 HZ2 LYS B 30 12.547 14.518 1.977 1.00 0.00 H new ATOM 0 HZ3 LYS B 30 12.364 12.987 2.688 1.00 0.00 H new ATOM 2020 N ILE B 31 9.021 8.962 1.708 1.00 0.00 N ATOM 2021 CA ILE B 31 8.978 8.265 3.027 1.00 0.00 C ATOM 2022 C ILE B 31 8.282 6.934 2.841 1.00 0.00 C ATOM 2023 O ILE B 31 8.512 6.004 3.567 1.00 0.00 O ATOM 2024 CB ILE B 31 8.243 9.124 4.059 1.00 0.00 C ATOM 2025 CG1 ILE B 31 8.123 10.578 3.609 1.00 0.00 C ATOM 2026 CG2 ILE B 31 9.039 9.074 5.362 1.00 0.00 C ATOM 2027 CD1 ILE B 31 6.680 10.824 3.207 1.00 0.00 C ATOM 0 H ILE B 31 8.148 9.380 1.386 1.00 0.00 H new ATOM 0 HA ILE B 31 9.990 8.100 3.396 1.00 0.00 H new ATOM 0 HB ILE B 31 7.234 8.732 4.186 1.00 0.00 H new ATOM 0 HG12 ILE B 31 8.415 11.252 4.414 1.00 0.00 H new ATOM 0 HG13 ILE B 31 8.791 10.774 2.771 1.00 0.00 H new ATOM 0 HG21 ILE B 31 8.538 9.679 6.118 1.00 0.00 H new ATOM 0 HG22 ILE B 31 9.106 8.043 5.708 1.00 0.00 H new ATOM 0 HG23 ILE B 31 10.042 9.465 5.191 1.00 0.00 H new ATOM 0 HD11 ILE B 31 6.564 11.857 2.880 1.00 0.00 H new ATOM 0 HD12 ILE B 31 6.410 10.153 2.391 1.00 0.00 H new ATOM 0 HD13 ILE B 31 6.028 10.638 4.060 1.00 0.00 H new ATOM 2039 N ILE B 32 7.468 6.816 1.839 1.00 0.00 N ATOM 2040 CA ILE B 32 6.816 5.503 1.597 1.00 0.00 C ATOM 2041 C ILE B 32 7.866 4.569 1.045 1.00 0.00 C ATOM 2042 O ILE B 32 8.211 3.560 1.643 1.00 0.00 O ATOM 2043 CB ILE B 32 5.724 5.735 0.557 1.00 0.00 C ATOM 2044 CG1 ILE B 32 4.709 6.758 1.092 1.00 0.00 C ATOM 2045 CG2 ILE B 32 5.028 4.402 0.266 1.00 0.00 C ATOM 2046 CD1 ILE B 32 3.425 6.059 1.541 1.00 0.00 C ATOM 0 H ILE B 32 7.226 7.559 1.183 1.00 0.00 H new ATOM 0 HA ILE B 32 6.387 5.076 2.503 1.00 0.00 H new ATOM 0 HB ILE B 32 6.161 6.126 -0.362 1.00 0.00 H new ATOM 0 HG12 ILE B 32 5.143 7.305 1.929 1.00 0.00 H new ATOM 0 HG13 ILE B 32 4.479 7.490 0.317 1.00 0.00 H new ATOM 0 HG21 ILE B 32 4.245 4.555 -0.476 1.00 0.00 H new ATOM 0 HG22 ILE B 32 5.756 3.687 -0.117 1.00 0.00 H new ATOM 0 HG23 ILE B 32 4.587 4.014 1.184 1.00 0.00 H new ATOM 0 HD11 ILE B 32 2.719 6.800 1.916 1.00 0.00 H new ATOM 0 HD12 ILE B 32 2.983 5.532 0.695 1.00 0.00 H new ATOM 0 HD13 ILE B 32 3.657 5.345 2.332 1.00 0.00 H new ATOM 2058 N THR B 33 8.400 4.918 -0.084 1.00 0.00 N ATOM 2059 CA THR B 33 9.443 4.085 -0.681 1.00 0.00 C ATOM 2060 C THR B 33 10.689 4.154 0.212 1.00 0.00 C ATOM 2061 O THR B 33 11.401 3.178 0.382 1.00 0.00 O ATOM 2062 CB THR B 33 9.670 4.689 -2.076 1.00 0.00 C ATOM 2063 OG1 THR B 33 9.132 3.815 -3.060 1.00 0.00 O ATOM 2064 CG2 THR B 33 11.157 4.893 -2.337 1.00 0.00 C ATOM 0 H THR B 33 8.150 5.752 -0.615 1.00 0.00 H new ATOM 0 HA THR B 33 9.185 3.030 -0.768 1.00 0.00 H new ATOM 0 HB THR B 33 9.171 5.657 -2.125 1.00 0.00 H new ATOM 0 HG1 THR B 33 8.186 4.027 -3.204 1.00 0.00 H new ATOM 0 HG21 THR B 33 11.297 5.321 -3.330 1.00 0.00 H new ATOM 0 HG22 THR B 33 11.568 5.570 -1.588 1.00 0.00 H new ATOM 0 HG23 THR B 33 11.671 3.934 -2.280 1.00 0.00 H new ATOM 2072 N GLU B 34 10.960 5.300 0.793 1.00 0.00 N ATOM 2073 CA GLU B 34 12.154 5.409 1.663 1.00 0.00 C ATOM 2074 C GLU B 34 11.904 4.796 3.047 1.00 0.00 C ATOM 2075 O GLU B 34 12.802 4.207 3.600 1.00 0.00 O ATOM 2076 CB GLU B 34 12.422 6.895 1.759 1.00 0.00 C ATOM 2077 CG GLU B 34 12.788 7.425 0.355 1.00 0.00 C ATOM 2078 CD GLU B 34 14.238 7.060 0.026 1.00 0.00 C ATOM 2079 OE1 GLU B 34 14.750 6.129 0.628 1.00 0.00 O ATOM 2080 OE2 GLU B 34 14.815 7.719 -0.824 1.00 0.00 O ATOM 0 H GLU B 34 10.406 6.151 0.698 1.00 0.00 H new ATOM 0 HA GLU B 34 13.005 4.862 1.257 1.00 0.00 H new ATOM 0 HB2 GLU B 34 11.543 7.413 2.141 1.00 0.00 H new ATOM 0 HB3 GLU B 34 13.235 7.088 2.459 1.00 0.00 H new ATOM 0 HG2 GLU B 34 12.118 6.999 -0.391 1.00 0.00 H new ATOM 0 HG3 GLU B 34 12.658 8.507 0.319 1.00 0.00 H new ATOM 2087 N THR B 35 10.710 4.889 3.619 1.00 0.00 N ATOM 2088 CA THR B 35 10.520 4.243 4.964 1.00 0.00 C ATOM 2089 C THR B 35 10.885 2.791 4.816 1.00 0.00 C ATOM 2090 O THR B 35 11.656 2.255 5.587 1.00 0.00 O ATOM 2091 CB THR B 35 9.051 4.365 5.375 1.00 0.00 C ATOM 2092 OG1 THR B 35 8.797 5.683 5.845 1.00 0.00 O ATOM 2093 CG2 THR B 35 8.770 3.359 6.500 1.00 0.00 C ATOM 0 H THR B 35 9.896 5.364 3.229 1.00 0.00 H new ATOM 0 HA THR B 35 11.140 4.721 5.723 1.00 0.00 H new ATOM 0 HB THR B 35 8.407 4.159 4.520 1.00 0.00 H new ATOM 0 HG1 THR B 35 8.334 5.639 6.708 1.00 0.00 H new ATOM 0 HG21 THR B 35 7.726 3.435 6.803 1.00 0.00 H new ATOM 0 HG22 THR B 35 8.972 2.349 6.144 1.00 0.00 H new ATOM 0 HG23 THR B 35 9.412 3.578 7.353 1.00 0.00 H new ATOM 2101 N VAL B 36 10.373 2.155 3.803 1.00 0.00 N ATOM 2102 CA VAL B 36 10.759 0.738 3.593 1.00 0.00 C ATOM 2103 C VAL B 36 12.283 0.692 3.559 1.00 0.00 C ATOM 2104 O VAL B 36 12.912 -0.163 4.150 1.00 0.00 O ATOM 2105 CB VAL B 36 10.168 0.364 2.238 1.00 0.00 C ATOM 2106 CG1 VAL B 36 10.823 -0.915 1.710 1.00 0.00 C ATOM 2107 CG2 VAL B 36 8.669 0.151 2.401 1.00 0.00 C ATOM 0 H VAL B 36 9.718 2.545 3.125 1.00 0.00 H new ATOM 0 HA VAL B 36 10.406 0.055 4.366 1.00 0.00 H new ATOM 0 HB VAL B 36 10.354 1.166 1.523 1.00 0.00 H new ATOM 0 HG11 VAL B 36 10.392 -1.171 0.742 1.00 0.00 H new ATOM 0 HG12 VAL B 36 11.896 -0.755 1.599 1.00 0.00 H new ATOM 0 HG13 VAL B 36 10.648 -1.730 2.412 1.00 0.00 H new ATOM 0 HG21 VAL B 36 8.233 -0.117 1.439 1.00 0.00 H new ATOM 0 HG22 VAL B 36 8.491 -0.652 3.116 1.00 0.00 H new ATOM 0 HG23 VAL B 36 8.208 1.070 2.765 1.00 0.00 H new ATOM 2117 N ALA B 37 12.871 1.645 2.887 1.00 0.00 N ATOM 2118 CA ALA B 37 14.351 1.706 2.830 1.00 0.00 C ATOM 2119 C ALA B 37 14.888 2.400 4.083 1.00 0.00 C ATOM 2120 O ALA B 37 16.080 2.525 4.278 1.00 0.00 O ATOM 2121 CB ALA B 37 14.664 2.514 1.593 1.00 0.00 C ATOM 0 H ALA B 37 12.386 2.382 2.376 1.00 0.00 H new ATOM 0 HA ALA B 37 14.810 0.718 2.790 1.00 0.00 H new ATOM 0 HB1 ALA B 37 15.744 2.604 1.481 1.00 0.00 H new ATOM 0 HB2 ALA B 37 14.249 2.015 0.718 1.00 0.00 H new ATOM 0 HB3 ALA B 37 14.225 3.507 1.686 1.00 0.00 H new ATOM 2127 N LYS B 38 14.011 2.828 4.945 1.00 0.00 N ATOM 2128 CA LYS B 38 14.463 3.470 6.207 1.00 0.00 C ATOM 2129 C LYS B 38 14.362 2.427 7.300 1.00 0.00 C ATOM 2130 O LYS B 38 14.990 2.518 8.336 1.00 0.00 O ATOM 2131 CB LYS B 38 13.509 4.640 6.460 1.00 0.00 C ATOM 2132 CG LYS B 38 14.294 5.831 7.011 1.00 0.00 C ATOM 2133 CD LYS B 38 15.176 6.423 5.907 1.00 0.00 C ATOM 2134 CE LYS B 38 14.296 6.935 4.762 1.00 0.00 C ATOM 2135 NZ LYS B 38 14.826 8.291 4.445 1.00 0.00 N ATOM 0 H LYS B 38 13.000 2.761 4.830 1.00 0.00 H new ATOM 0 HA LYS B 38 15.488 3.838 6.168 1.00 0.00 H new ATOM 0 HB2 LYS B 38 13.007 4.920 5.534 1.00 0.00 H new ATOM 0 HB3 LYS B 38 12.734 4.344 7.167 1.00 0.00 H new ATOM 0 HG2 LYS B 38 13.607 6.589 7.387 1.00 0.00 H new ATOM 0 HG3 LYS B 38 14.911 5.515 7.852 1.00 0.00 H new ATOM 0 HD2 LYS B 38 15.779 7.238 6.308 1.00 0.00 H new ATOM 0 HD3 LYS B 38 15.868 5.667 5.536 1.00 0.00 H new ATOM 0 HE2 LYS B 38 14.353 6.276 3.895 1.00 0.00 H new ATOM 0 HE3 LYS B 38 13.248 6.980 5.059 1.00 0.00 H new ATOM 0 HZ1 LYS B 38 14.273 8.707 3.669 1.00 0.00 H new ATOM 0 HZ2 LYS B 38 14.752 8.898 5.286 1.00 0.00 H new ATOM 0 HZ3 LYS B 38 15.823 8.216 4.159 1.00 0.00 H new ATOM 2149 N GLY B 39 13.593 1.408 7.043 1.00 0.00 N ATOM 2150 CA GLY B 39 13.459 0.319 8.016 1.00 0.00 C ATOM 2151 C GLY B 39 12.147 0.440 8.785 1.00 0.00 C ATOM 2152 O GLY B 39 12.106 0.239 9.983 1.00 0.00 O ATOM 0 H GLY B 39 13.050 1.292 6.187 1.00 0.00 H new ATOM 0 HA2 GLY B 39 13.497 -0.641 7.502 1.00 0.00 H new ATOM 0 HA3 GLY B 39 14.297 0.342 8.712 1.00 0.00 H new ATOM 2156 N ASP B 40 11.069 0.754 8.115 1.00 0.00 N ATOM 2157 CA ASP B 40 9.768 0.863 8.841 1.00 0.00 C ATOM 2158 C ASP B 40 8.625 0.376 7.950 1.00 0.00 C ATOM 2159 O ASP B 40 8.690 0.455 6.739 1.00 0.00 O ATOM 2160 CB ASP B 40 9.611 2.347 9.182 1.00 0.00 C ATOM 2161 CG ASP B 40 9.744 2.542 10.694 1.00 0.00 C ATOM 2162 OD1 ASP B 40 9.157 1.762 11.426 1.00 0.00 O ATOM 2163 OD2 ASP B 40 10.431 3.468 11.095 1.00 0.00 O ATOM 0 H ASP B 40 11.031 0.937 7.112 1.00 0.00 H new ATOM 0 HA ASP B 40 9.746 0.248 9.741 1.00 0.00 H new ATOM 0 HB2 ASP B 40 10.369 2.932 8.661 1.00 0.00 H new ATOM 0 HB3 ASP B 40 8.640 2.708 8.842 1.00 0.00 H new ATOM 2168 N LYS B 41 7.584 -0.139 8.546 1.00 0.00 N ATOM 2169 CA LYS B 41 6.437 -0.648 7.744 1.00 0.00 C ATOM 2170 C LYS B 41 5.336 0.410 7.665 1.00 0.00 C ATOM 2171 O LYS B 41 4.469 0.481 8.512 1.00 0.00 O ATOM 2172 CB LYS B 41 5.942 -1.883 8.499 1.00 0.00 C ATOM 2173 CG LYS B 41 7.073 -2.908 8.607 1.00 0.00 C ATOM 2174 CD LYS B 41 6.659 -4.027 9.564 1.00 0.00 C ATOM 2175 CE LYS B 41 7.855 -4.945 9.827 1.00 0.00 C ATOM 2176 NZ LYS B 41 7.259 -6.258 10.198 1.00 0.00 N ATOM 0 H LYS B 41 7.479 -0.229 9.557 1.00 0.00 H new ATOM 0 HA LYS B 41 6.723 -0.885 6.719 1.00 0.00 H new ATOM 0 HB2 LYS B 41 5.599 -1.600 9.494 1.00 0.00 H new ATOM 0 HB3 LYS B 41 5.089 -2.321 7.980 1.00 0.00 H new ATOM 0 HG2 LYS B 41 7.299 -3.321 7.624 1.00 0.00 H new ATOM 0 HG3 LYS B 41 7.982 -2.426 8.966 1.00 0.00 H new ATOM 0 HD2 LYS B 41 6.300 -3.603 10.502 1.00 0.00 H new ATOM 0 HD3 LYS B 41 5.835 -4.599 9.137 1.00 0.00 H new ATOM 0 HE2 LYS B 41 8.486 -5.034 8.943 1.00 0.00 H new ATOM 0 HE3 LYS B 41 8.482 -4.556 10.629 1.00 0.00 H new ATOM 0 HZ1 LYS B 41 7.776 -6.657 11.007 1.00 0.00 H new ATOM 0 HZ2 LYS B 41 6.260 -6.125 10.456 1.00 0.00 H new ATOM 0 HZ3 LYS B 41 7.324 -6.910 9.390 1.00 0.00 H new ATOM 2190 N VAL B 42 5.364 1.225 6.648 1.00 0.00 N ATOM 2191 CA VAL B 42 4.311 2.276 6.504 1.00 0.00 C ATOM 2192 C VAL B 42 2.936 1.610 6.423 1.00 0.00 C ATOM 2193 O VAL B 42 2.731 0.686 5.660 1.00 0.00 O ATOM 2194 CB VAL B 42 4.640 3.000 5.196 1.00 0.00 C ATOM 2195 CG1 VAL B 42 3.608 4.101 4.944 1.00 0.00 C ATOM 2196 CG2 VAL B 42 6.035 3.625 5.295 1.00 0.00 C ATOM 0 H VAL B 42 6.068 1.211 5.910 1.00 0.00 H new ATOM 0 HA VAL B 42 4.290 2.967 7.346 1.00 0.00 H new ATOM 0 HB VAL B 42 4.617 2.286 4.373 1.00 0.00 H new ATOM 0 HG11 VAL B 42 3.844 4.615 4.012 1.00 0.00 H new ATOM 0 HG12 VAL B 42 2.614 3.659 4.872 1.00 0.00 H new ATOM 0 HG13 VAL B 42 3.629 4.815 5.768 1.00 0.00 H new ATOM 0 HG21 VAL B 42 6.270 4.141 4.364 1.00 0.00 H new ATOM 0 HG22 VAL B 42 6.057 4.337 6.120 1.00 0.00 H new ATOM 0 HG23 VAL B 42 6.773 2.842 5.472 1.00 0.00 H new ATOM 2206 N GLN B 43 1.995 2.053 7.215 1.00 0.00 N ATOM 2207 CA GLN B 43 0.645 1.418 7.185 1.00 0.00 C ATOM 2208 C GLN B 43 -0.448 2.458 6.930 1.00 0.00 C ATOM 2209 O GLN B 43 -0.830 3.195 7.816 1.00 0.00 O ATOM 2210 CB GLN B 43 0.467 0.794 8.573 1.00 0.00 C ATOM 2211 CG GLN B 43 1.680 -0.075 8.915 1.00 0.00 C ATOM 2212 CD GLN B 43 1.211 -1.416 9.482 1.00 0.00 C ATOM 2213 OE1 GLN B 43 1.695 -2.459 9.090 1.00 0.00 O ATOM 2214 NE2 GLN B 43 0.280 -1.434 10.398 1.00 0.00 N ATOM 0 H GLN B 43 2.102 2.822 7.877 1.00 0.00 H new ATOM 0 HA GLN B 43 0.567 0.682 6.385 1.00 0.00 H new ATOM 0 HB2 GLN B 43 0.348 1.578 9.321 1.00 0.00 H new ATOM 0 HB3 GLN B 43 -0.441 0.191 8.596 1.00 0.00 H new ATOM 0 HG2 GLN B 43 2.285 -0.238 8.023 1.00 0.00 H new ATOM 0 HG3 GLN B 43 2.313 0.436 9.641 1.00 0.00 H new ATOM 0 HE21 GLN B 43 -0.127 -0.559 10.728 1.00 0.00 H new ATOM 0 HE22 GLN B 43 -0.040 -2.323 10.783 1.00 0.00 H new ATOM 2223 N LEU B 44 -0.973 2.507 5.735 1.00 0.00 N ATOM 2224 CA LEU B 44 -2.061 3.489 5.444 1.00 0.00 C ATOM 2225 C LEU B 44 -3.274 3.165 6.316 1.00 0.00 C ATOM 2226 O LEU B 44 -3.880 2.125 6.163 1.00 0.00 O ATOM 2227 CB LEU B 44 -2.411 3.297 3.963 1.00 0.00 C ATOM 2228 CG LEU B 44 -1.162 3.446 3.085 1.00 0.00 C ATOM 2229 CD1 LEU B 44 -1.579 3.558 1.614 1.00 0.00 C ATOM 2230 CD2 LEU B 44 -0.403 4.713 3.484 1.00 0.00 C ATOM 0 H LEU B 44 -0.699 1.914 4.951 1.00 0.00 H new ATOM 0 HA LEU B 44 -1.758 4.515 5.651 1.00 0.00 H new ATOM 0 HB2 LEU B 44 -2.851 2.311 3.813 1.00 0.00 H new ATOM 0 HB3 LEU B 44 -3.161 4.029 3.664 1.00 0.00 H new ATOM 0 HG LEU B 44 -0.522 2.574 3.222 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -0.691 3.664 0.991 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -2.123 2.660 1.321 1.00 0.00 H new ATOM 0 HD13 LEU B 44 -2.220 4.430 1.483 1.00 0.00 H new ATOM 0 HD21 LEU B 44 0.484 4.818 2.859 1.00 0.00 H new ATOM 0 HD22 LEU B 44 -1.047 5.581 3.347 1.00 0.00 H new ATOM 0 HD23 LEU B 44 -0.104 4.644 4.530 1.00 0.00 H new ATOM 2242 N THR B 45 -3.619 4.040 7.235 1.00 0.00 N ATOM 2243 CA THR B 45 -4.793 3.792 8.150 1.00 0.00 C ATOM 2244 C THR B 45 -4.943 2.293 8.457 1.00 0.00 C ATOM 2245 O THR B 45 -4.379 1.793 9.411 1.00 0.00 O ATOM 2246 CB THR B 45 -6.043 4.347 7.436 1.00 0.00 C ATOM 2247 OG1 THR B 45 -7.192 3.632 7.868 1.00 0.00 O ATOM 2248 CG2 THR B 45 -5.910 4.219 5.916 1.00 0.00 C ATOM 0 H THR B 45 -3.136 4.924 7.394 1.00 0.00 H new ATOM 0 HA THR B 45 -4.650 4.289 9.109 1.00 0.00 H new ATOM 0 HB THR B 45 -6.141 5.403 7.688 1.00 0.00 H new ATOM 0 HG1 THR B 45 -7.986 3.985 7.416 1.00 0.00 H new ATOM 0 HG21 THR B 45 -6.805 4.618 5.438 1.00 0.00 H new ATOM 0 HG22 THR B 45 -5.038 4.779 5.579 1.00 0.00 H new ATOM 0 HG23 THR B 45 -5.793 3.169 5.648 1.00 0.00 H new ATOM 2256 N GLY B 46 -5.691 1.573 7.661 1.00 0.00 N ATOM 2257 CA GLY B 46 -5.855 0.121 7.919 1.00 0.00 C ATOM 2258 C GLY B 46 -5.985 -0.643 6.598 1.00 0.00 C ATOM 2259 O GLY B 46 -6.404 -1.784 6.589 1.00 0.00 O ATOM 0 H GLY B 46 -6.192 1.931 6.848 1.00 0.00 H new ATOM 0 HA2 GLY B 46 -5.000 -0.254 8.481 1.00 0.00 H new ATOM 0 HA3 GLY B 46 -6.739 -0.048 8.533 1.00 0.00 H new ATOM 2263 N PHE B 47 -5.632 -0.046 5.478 1.00 0.00 N ATOM 2264 CA PHE B 47 -5.760 -0.802 4.196 1.00 0.00 C ATOM 2265 C PHE B 47 -4.397 -1.145 3.591 1.00 0.00 C ATOM 2266 O PHE B 47 -4.218 -2.213 3.051 1.00 0.00 O ATOM 2267 CB PHE B 47 -6.626 0.046 3.247 1.00 0.00 C ATOM 2268 CG PHE B 47 -5.952 1.329 2.796 1.00 0.00 C ATOM 2269 CD1 PHE B 47 -4.947 1.307 1.815 1.00 0.00 C ATOM 2270 CD2 PHE B 47 -6.378 2.557 3.320 1.00 0.00 C ATOM 2271 CE1 PHE B 47 -4.372 2.505 1.377 1.00 0.00 C ATOM 2272 CE2 PHE B 47 -5.806 3.745 2.873 1.00 0.00 C ATOM 2273 CZ PHE B 47 -4.803 3.723 1.904 1.00 0.00 C ATOM 0 H PHE B 47 -5.271 0.905 5.401 1.00 0.00 H new ATOM 0 HA PHE B 47 -6.239 -1.765 4.374 1.00 0.00 H new ATOM 0 HB2 PHE B 47 -6.880 -0.549 2.370 1.00 0.00 H new ATOM 0 HB3 PHE B 47 -7.563 0.293 3.746 1.00 0.00 H new ATOM 0 HD1 PHE B 47 -4.618 0.366 1.399 1.00 0.00 H new ATOM 0 HD2 PHE B 47 -7.152 2.582 4.073 1.00 0.00 H new ATOM 0 HE1 PHE B 47 -3.593 2.487 0.629 1.00 0.00 H new ATOM 0 HE2 PHE B 47 -6.141 4.688 3.279 1.00 0.00 H new ATOM 0 HZ PHE B 47 -4.361 4.647 1.562 1.00 0.00 H new ATOM 2283 N LEU B 48 -3.430 -0.282 3.673 1.00 0.00 N ATOM 2284 CA LEU B 48 -2.101 -0.627 3.086 1.00 0.00 C ATOM 2285 C LEU B 48 -1.033 -0.752 4.169 1.00 0.00 C ATOM 2286 O LEU B 48 -0.727 0.189 4.867 1.00 0.00 O ATOM 2287 CB LEU B 48 -1.784 0.516 2.132 1.00 0.00 C ATOM 2288 CG LEU B 48 -1.987 0.098 0.660 1.00 0.00 C ATOM 2289 CD1 LEU B 48 -0.621 -0.052 -0.017 1.00 0.00 C ATOM 2290 CD2 LEU B 48 -2.753 -1.231 0.541 1.00 0.00 C ATOM 0 H LEU B 48 -3.494 0.636 4.113 1.00 0.00 H new ATOM 0 HA LEU B 48 -2.120 -1.590 2.576 1.00 0.00 H new ATOM 0 HB2 LEU B 48 -2.423 1.369 2.360 1.00 0.00 H new ATOM 0 HB3 LEU B 48 -0.754 0.840 2.280 1.00 0.00 H new ATOM 0 HG LEU B 48 -2.577 0.874 0.172 1.00 0.00 H new ATOM 0 HD11 LEU B 48 -0.761 -0.347 -1.057 1.00 0.00 H new ATOM 0 HD12 LEU B 48 -0.089 0.899 0.022 1.00 0.00 H new ATOM 0 HD13 LEU B 48 -0.040 -0.814 0.502 1.00 0.00 H new ATOM 0 HD21 LEU B 48 -2.874 -1.488 -0.511 1.00 0.00 H new ATOM 0 HD22 LEU B 48 -2.194 -2.019 1.045 1.00 0.00 H new ATOM 0 HD23 LEU B 48 -3.734 -1.128 1.005 1.00 0.00 H new ATOM 2302 N ASN B 49 -0.466 -1.922 4.306 1.00 0.00 N ATOM 2303 CA ASN B 49 0.589 -2.130 5.341 1.00 0.00 C ATOM 2304 C ASN B 49 1.949 -2.399 4.679 1.00 0.00 C ATOM 2305 O ASN B 49 2.436 -3.513 4.669 1.00 0.00 O ATOM 2306 CB ASN B 49 0.125 -3.355 6.130 1.00 0.00 C ATOM 2307 CG ASN B 49 -0.536 -2.904 7.434 1.00 0.00 C ATOM 2308 OD1 ASN B 49 -1.005 -1.787 7.538 1.00 0.00 O ATOM 2309 ND2 ASN B 49 -0.597 -3.731 8.441 1.00 0.00 N ATOM 0 H ASN B 49 -0.689 -2.744 3.745 1.00 0.00 H new ATOM 0 HA ASN B 49 0.720 -1.255 5.977 1.00 0.00 H new ATOM 0 HB2 ASN B 49 -0.579 -3.938 5.536 1.00 0.00 H new ATOM 0 HB3 ASN B 49 0.974 -4.004 6.346 1.00 0.00 H new ATOM 0 HD21 ASN B 49 -1.038 -3.440 9.314 1.00 0.00 H new ATOM 0 HD22 ASN B 49 -0.204 -4.668 8.356 1.00 0.00 H new ATOM 2316 N ILE B 50 2.563 -1.382 4.134 1.00 0.00 N ATOM 2317 CA ILE B 50 3.897 -1.560 3.476 1.00 0.00 C ATOM 2318 C ILE B 50 4.921 -2.089 4.491 1.00 0.00 C ATOM 2319 O ILE B 50 5.000 -1.599 5.600 1.00 0.00 O ATOM 2320 CB ILE B 50 4.279 -0.145 3.010 1.00 0.00 C ATOM 2321 CG1 ILE B 50 3.580 0.170 1.679 1.00 0.00 C ATOM 2322 CG2 ILE B 50 5.798 -0.030 2.841 1.00 0.00 C ATOM 2323 CD1 ILE B 50 4.334 -0.481 0.513 1.00 0.00 C ATOM 0 H ILE B 50 2.198 -0.430 4.115 1.00 0.00 H new ATOM 0 HA ILE B 50 3.872 -2.276 2.654 1.00 0.00 H new ATOM 0 HB ILE B 50 3.957 0.572 3.765 1.00 0.00 H new ATOM 0 HG12 ILE B 50 2.553 -0.194 1.705 1.00 0.00 H new ATOM 0 HG13 ILE B 50 3.532 1.249 1.532 1.00 0.00 H new ATOM 0 HG21 ILE B 50 6.052 0.977 2.511 1.00 0.00 H new ATOM 0 HG22 ILE B 50 6.287 -0.234 3.794 1.00 0.00 H new ATOM 0 HG23 ILE B 50 6.137 -0.752 2.098 1.00 0.00 H new ATOM 0 HD11 ILE B 50 3.827 -0.249 -0.423 1.00 0.00 H new ATOM 0 HD12 ILE B 50 5.353 -0.096 0.479 1.00 0.00 H new ATOM 0 HD13 ILE B 50 4.359 -1.562 0.654 1.00 0.00 H new ATOM 2335 N LYS B 51 5.715 -3.073 4.130 1.00 0.00 N ATOM 2336 CA LYS B 51 6.725 -3.583 5.109 1.00 0.00 C ATOM 2337 C LYS B 51 7.923 -4.214 4.384 1.00 0.00 C ATOM 2338 O LYS B 51 7.750 -5.092 3.564 1.00 0.00 O ATOM 2339 CB LYS B 51 5.980 -4.631 5.943 1.00 0.00 C ATOM 2340 CG LYS B 51 5.542 -5.797 5.052 1.00 0.00 C ATOM 2341 CD LYS B 51 6.547 -6.946 5.176 1.00 0.00 C ATOM 2342 CE LYS B 51 6.424 -7.600 6.553 1.00 0.00 C ATOM 2343 NZ LYS B 51 5.026 -8.114 6.622 1.00 0.00 N ATOM 0 H LYS B 51 5.708 -3.535 3.220 1.00 0.00 H new ATOM 0 HA LYS B 51 7.130 -2.782 5.728 1.00 0.00 H new ATOM 0 HB2 LYS B 51 6.624 -4.996 6.743 1.00 0.00 H new ATOM 0 HB3 LYS B 51 5.109 -4.178 6.417 1.00 0.00 H new ATOM 0 HG2 LYS B 51 4.548 -6.137 5.344 1.00 0.00 H new ATOM 0 HG3 LYS B 51 5.475 -5.470 4.014 1.00 0.00 H new ATOM 0 HD2 LYS B 51 6.366 -7.685 4.396 1.00 0.00 H new ATOM 0 HD3 LYS B 51 7.560 -6.571 5.031 1.00 0.00 H new ATOM 0 HE2 LYS B 51 7.146 -8.408 6.670 1.00 0.00 H new ATOM 0 HE3 LYS B 51 6.618 -6.881 7.349 1.00 0.00 H new ATOM 0 HZ1 LYS B 51 5.017 -9.029 7.116 1.00 0.00 H new ATOM 0 HZ2 LYS B 51 4.432 -7.435 7.139 1.00 0.00 H new ATOM 0 HZ3 LYS B 51 4.653 -8.237 5.659 1.00 0.00 H new ATOM 2357 N PRO B 52 9.109 -3.752 4.711 1.00 0.00 N ATOM 2358 CA PRO B 52 10.331 -4.296 4.079 1.00 0.00 C ATOM 2359 C PRO B 52 10.786 -5.566 4.792 1.00 0.00 C ATOM 2360 O PRO B 52 10.716 -5.672 6.002 1.00 0.00 O ATOM 2361 CB PRO B 52 11.361 -3.198 4.280 1.00 0.00 C ATOM 2362 CG PRO B 52 10.908 -2.446 5.491 1.00 0.00 C ATOM 2363 CD PRO B 52 9.426 -2.691 5.674 1.00 0.00 C ATOM 0 HA PRO B 52 10.178 -4.559 3.032 1.00 0.00 H new ATOM 0 HB2 PRO B 52 12.357 -3.616 4.427 1.00 0.00 H new ATOM 0 HB3 PRO B 52 11.414 -2.545 3.409 1.00 0.00 H new ATOM 0 HG2 PRO B 52 11.459 -2.776 6.371 1.00 0.00 H new ATOM 0 HG3 PRO B 52 11.105 -1.381 5.372 1.00 0.00 H new ATOM 0 HD2 PRO B 52 9.197 -2.999 6.694 1.00 0.00 H new ATOM 0 HD3 PRO B 52 8.847 -1.789 5.476 1.00 0.00 H new ATOM 2371 N VAL B 53 11.267 -6.521 4.051 1.00 0.00 N ATOM 2372 CA VAL B 53 11.747 -7.782 4.682 1.00 0.00 C ATOM 2373 C VAL B 53 13.053 -8.251 4.046 1.00 0.00 C ATOM 2374 O VAL B 53 13.108 -8.604 2.887 1.00 0.00 O ATOM 2375 CB VAL B 53 10.637 -8.805 4.467 1.00 0.00 C ATOM 2376 CG1 VAL B 53 9.339 -8.293 5.095 1.00 0.00 C ATOM 2377 CG2 VAL B 53 10.422 -9.022 2.969 1.00 0.00 C ATOM 0 H VAL B 53 11.349 -6.485 3.035 1.00 0.00 H new ATOM 0 HA VAL B 53 11.957 -7.640 5.742 1.00 0.00 H new ATOM 0 HB VAL B 53 10.922 -9.748 4.935 1.00 0.00 H new ATOM 0 HG11 VAL B 53 8.547 -9.025 4.941 1.00 0.00 H new ATOM 0 HG12 VAL B 53 9.488 -8.139 6.164 1.00 0.00 H new ATOM 0 HG13 VAL B 53 9.057 -7.349 4.629 1.00 0.00 H new ATOM 0 HG21 VAL B 53 9.628 -9.754 2.818 1.00 0.00 H new ATOM 0 HG22 VAL B 53 10.140 -8.079 2.501 1.00 0.00 H new ATOM 0 HG23 VAL B 53 11.344 -9.389 2.518 1.00 0.00 H new ATOM 2387 N ALA B 54 14.105 -8.253 4.808 1.00 0.00 N ATOM 2388 CA ALA B 54 15.428 -8.688 4.267 1.00 0.00 C ATOM 2389 C ALA B 54 15.331 -10.098 3.685 1.00 0.00 C ATOM 2390 O ALA B 54 15.280 -11.077 4.403 1.00 0.00 O ATOM 2391 CB ALA B 54 16.387 -8.666 5.457 1.00 0.00 C ATOM 0 H ALA B 54 14.111 -7.971 5.788 1.00 0.00 H new ATOM 0 HA ALA B 54 15.768 -8.035 3.463 1.00 0.00 H new ATOM 0 HB1 ALA B 54 17.380 -8.976 5.130 1.00 0.00 H new ATOM 0 HB2 ALA B 54 16.438 -7.656 5.865 1.00 0.00 H new ATOM 0 HB3 ALA B 54 16.028 -9.350 6.226 1.00 0.00 H new ATOM 2710 N VAL B 75 16.166 -6.551 0.232 1.00 0.00 N ATOM 2711 CA VAL B 75 15.018 -6.609 1.184 1.00 0.00 C ATOM 2712 C VAL B 75 13.732 -6.846 0.394 1.00 0.00 C ATOM 2713 O VAL B 75 13.725 -6.787 -0.821 1.00 0.00 O ATOM 2714 CB VAL B 75 15.011 -5.250 1.915 1.00 0.00 C ATOM 2715 CG1 VAL B 75 13.646 -4.561 1.784 1.00 0.00 C ATOM 2716 CG2 VAL B 75 15.312 -5.473 3.399 1.00 0.00 C ATOM 0 HA VAL B 75 15.100 -7.420 1.907 1.00 0.00 H new ATOM 0 HB VAL B 75 15.771 -4.613 1.462 1.00 0.00 H new ATOM 0 HG11 VAL B 75 13.669 -3.606 2.308 1.00 0.00 H new ATOM 0 HG12 VAL B 75 13.424 -4.392 0.730 1.00 0.00 H new ATOM 0 HG13 VAL B 75 12.875 -5.196 2.220 1.00 0.00 H new ATOM 0 HG21 VAL B 75 15.308 -4.515 3.919 1.00 0.00 H new ATOM 0 HG22 VAL B 75 14.551 -6.123 3.831 1.00 0.00 H new ATOM 0 HG23 VAL B 75 16.291 -5.940 3.506 1.00 0.00 H new ATOM 2726 N GLY B 76 12.651 -7.124 1.062 1.00 0.00 N ATOM 2727 CA GLY B 76 11.381 -7.372 0.328 1.00 0.00 C ATOM 2728 C GLY B 76 10.334 -6.356 0.762 1.00 0.00 C ATOM 2729 O GLY B 76 9.545 -6.606 1.651 1.00 0.00 O ATOM 0 H GLY B 76 12.590 -7.190 2.078 1.00 0.00 H new ATOM 0 HA2 GLY B 76 11.550 -7.299 -0.746 1.00 0.00 H new ATOM 0 HA3 GLY B 76 11.026 -8.383 0.527 1.00 0.00 H new ATOM 2733 N VAL B 77 10.320 -5.211 0.136 1.00 0.00 N ATOM 2734 CA VAL B 77 9.315 -4.169 0.499 1.00 0.00 C ATOM 2735 C VAL B 77 7.913 -4.709 0.255 1.00 0.00 C ATOM 2736 O VAL B 77 7.266 -4.372 -0.715 1.00 0.00 O ATOM 2737 CB VAL B 77 9.614 -2.979 -0.427 1.00 0.00 C ATOM 2738 CG1 VAL B 77 9.680 -3.452 -1.887 1.00 0.00 C ATOM 2739 CG2 VAL B 77 8.511 -1.919 -0.288 1.00 0.00 C ATOM 0 H VAL B 77 10.962 -4.951 -0.613 1.00 0.00 H new ATOM 0 HA VAL B 77 9.371 -3.878 1.548 1.00 0.00 H new ATOM 0 HB VAL B 77 10.573 -2.547 -0.143 1.00 0.00 H new ATOM 0 HG11 VAL B 77 9.892 -2.602 -2.536 1.00 0.00 H new ATOM 0 HG12 VAL B 77 10.470 -4.196 -1.993 1.00 0.00 H new ATOM 0 HG13 VAL B 77 8.725 -3.894 -2.170 1.00 0.00 H new ATOM 0 HG21 VAL B 77 8.729 -1.078 -0.947 1.00 0.00 H new ATOM 0 HG22 VAL B 77 7.550 -2.355 -0.562 1.00 0.00 H new ATOM 0 HG23 VAL B 77 8.470 -1.570 0.744 1.00 0.00 H new ATOM 2749 N SER B 78 7.441 -5.546 1.130 1.00 0.00 N ATOM 2750 CA SER B 78 6.083 -6.109 0.947 1.00 0.00 C ATOM 2751 C SER B 78 5.022 -5.080 1.343 1.00 0.00 C ATOM 2752 O SER B 78 5.320 -3.992 1.790 1.00 0.00 O ATOM 2753 CB SER B 78 6.026 -7.323 1.874 1.00 0.00 C ATOM 2754 OG SER B 78 5.453 -8.420 1.176 1.00 0.00 O ATOM 0 H SER B 78 7.937 -5.864 1.963 1.00 0.00 H new ATOM 0 HA SER B 78 5.888 -6.380 -0.091 1.00 0.00 H new ATOM 0 HB2 SER B 78 7.028 -7.579 2.218 1.00 0.00 H new ATOM 0 HB3 SER B 78 5.434 -7.091 2.760 1.00 0.00 H new ATOM 0 HG SER B 78 5.417 -9.201 1.767 1.00 0.00 H new ATOM 2760 N VAL B 79 3.788 -5.446 1.182 1.00 0.00 N ATOM 2761 CA VAL B 79 2.646 -4.556 1.535 1.00 0.00 C ATOM 2762 C VAL B 79 1.352 -5.280 1.165 1.00 0.00 C ATOM 2763 O VAL B 79 1.389 -6.325 0.544 1.00 0.00 O ATOM 2764 CB VAL B 79 2.827 -3.308 0.654 1.00 0.00 C ATOM 2765 CG1 VAL B 79 2.894 -3.718 -0.821 1.00 0.00 C ATOM 2766 CG2 VAL B 79 1.649 -2.350 0.858 1.00 0.00 C ATOM 0 H VAL B 79 3.511 -6.354 0.809 1.00 0.00 H new ATOM 0 HA VAL B 79 2.609 -4.295 2.593 1.00 0.00 H new ATOM 0 HB VAL B 79 3.754 -2.809 0.936 1.00 0.00 H new ATOM 0 HG11 VAL B 79 3.022 -2.830 -1.440 1.00 0.00 H new ATOM 0 HG12 VAL B 79 3.737 -4.391 -0.973 1.00 0.00 H new ATOM 0 HG13 VAL B 79 1.970 -4.225 -1.100 1.00 0.00 H new ATOM 0 HG21 VAL B 79 1.784 -1.469 0.231 1.00 0.00 H new ATOM 0 HG22 VAL B 79 0.721 -2.851 0.584 1.00 0.00 H new ATOM 0 HG23 VAL B 79 1.603 -2.047 1.904 1.00 0.00 H new ATOM 2776 N LYS B 80 0.209 -4.729 1.482 1.00 0.00 N ATOM 2777 CA LYS B 80 -1.062 -5.394 1.079 1.00 0.00 C ATOM 2778 C LYS B 80 -2.277 -4.627 1.605 1.00 0.00 C ATOM 2779 O LYS B 80 -2.155 -3.739 2.424 1.00 0.00 O ATOM 2780 CB LYS B 80 -1.015 -6.786 1.734 1.00 0.00 C ATOM 2781 CG LYS B 80 -0.584 -6.664 3.201 1.00 0.00 C ATOM 2782 CD LYS B 80 0.826 -7.238 3.374 1.00 0.00 C ATOM 2783 CE LYS B 80 0.916 -7.982 4.710 1.00 0.00 C ATOM 2784 NZ LYS B 80 1.660 -9.235 4.402 1.00 0.00 N ATOM 0 H LYS B 80 0.102 -3.855 1.998 1.00 0.00 H new ATOM 0 HA LYS B 80 -1.155 -5.439 -0.006 1.00 0.00 H new ATOM 0 HB2 LYS B 80 -1.995 -7.258 1.673 1.00 0.00 H new ATOM 0 HB3 LYS B 80 -0.318 -7.427 1.194 1.00 0.00 H new ATOM 0 HG2 LYS B 80 -0.602 -5.619 3.510 1.00 0.00 H new ATOM 0 HG3 LYS B 80 -1.286 -7.198 3.842 1.00 0.00 H new ATOM 0 HD2 LYS B 80 1.057 -7.916 2.552 1.00 0.00 H new ATOM 0 HD3 LYS B 80 1.563 -6.436 3.342 1.00 0.00 H new ATOM 0 HE2 LYS B 80 1.438 -7.387 5.459 1.00 0.00 H new ATOM 0 HE3 LYS B 80 -0.075 -8.199 5.109 1.00 0.00 H new ATOM 0 HZ1 LYS B 80 1.762 -9.800 5.269 1.00 0.00 H new ATOM 0 HZ2 LYS B 80 1.136 -9.784 3.691 1.00 0.00 H new ATOM 0 HZ3 LYS B 80 2.602 -8.997 4.031 1.00 0.00 H new ATOM 2798 N PRO B 81 -3.421 -5.056 1.149 1.00 0.00 N ATOM 2799 CA PRO B 81 -4.707 -4.482 1.603 1.00 0.00 C ATOM 2800 C PRO B 81 -5.042 -4.969 3.017 1.00 0.00 C ATOM 2801 O PRO B 81 -4.840 -6.119 3.354 1.00 0.00 O ATOM 2802 CB PRO B 81 -5.720 -5.044 0.610 1.00 0.00 C ATOM 2803 CG PRO B 81 -5.099 -6.306 0.111 1.00 0.00 C ATOM 2804 CD PRO B 81 -3.613 -6.086 0.131 1.00 0.00 C ATOM 0 HA PRO B 81 -4.693 -3.393 1.639 1.00 0.00 H new ATOM 0 HB2 PRO B 81 -6.680 -5.237 1.089 1.00 0.00 H new ATOM 0 HB3 PRO B 81 -5.906 -4.345 -0.205 1.00 0.00 H new ATOM 0 HG2 PRO B 81 -5.375 -7.150 0.743 1.00 0.00 H new ATOM 0 HG3 PRO B 81 -5.444 -6.536 -0.897 1.00 0.00 H new ATOM 0 HD2 PRO B 81 -3.078 -7.001 0.383 1.00 0.00 H new ATOM 0 HD3 PRO B 81 -3.245 -5.759 -0.842 1.00 0.00 H new ATOM 2812 N GLY B 82 -5.586 -4.109 3.824 1.00 0.00 N ATOM 2813 CA GLY B 82 -5.985 -4.507 5.206 1.00 0.00 C ATOM 2814 C GLY B 82 -7.502 -4.505 5.234 1.00 0.00 C ATOM 2815 O GLY B 82 -8.142 -5.535 5.147 1.00 0.00 O ATOM 0 H GLY B 82 -5.775 -3.135 3.587 1.00 0.00 H new ATOM 0 HA2 GLY B 82 -5.594 -5.494 5.454 1.00 0.00 H new ATOM 0 HA3 GLY B 82 -5.583 -3.811 5.942 1.00 0.00 H new ATOM 2819 N GLU B 83 -8.079 -3.341 5.282 1.00 0.00 N ATOM 2820 CA GLU B 83 -9.556 -3.238 5.230 1.00 0.00 C ATOM 2821 C GLU B 83 -9.952 -3.089 3.787 1.00 0.00 C ATOM 2822 O GLU B 83 -10.853 -2.346 3.468 1.00 0.00 O ATOM 2823 CB GLU B 83 -9.923 -1.989 6.021 1.00 0.00 C ATOM 2824 CG GLU B 83 -9.481 -0.730 5.266 1.00 0.00 C ATOM 2825 CD GLU B 83 -8.854 0.265 6.246 1.00 0.00 C ATOM 2826 OE1 GLU B 83 -9.221 0.234 7.410 1.00 0.00 O ATOM 2827 OE2 GLU B 83 -8.020 1.043 5.816 1.00 0.00 O ATOM 0 H GLU B 83 -7.586 -2.451 5.356 1.00 0.00 H new ATOM 0 HA GLU B 83 -10.062 -4.110 5.646 1.00 0.00 H new ATOM 0 HB2 GLU B 83 -11.000 -1.961 6.190 1.00 0.00 H new ATOM 0 HB3 GLU B 83 -9.448 -2.019 7.001 1.00 0.00 H new ATOM 0 HG2 GLU B 83 -8.762 -0.993 4.490 1.00 0.00 H new ATOM 0 HG3 GLU B 83 -10.336 -0.274 4.767 1.00 0.00 H new ATOM 2834 N SER B 84 -9.293 -3.833 2.926 1.00 0.00 N ATOM 2835 CA SER B 84 -9.585 -3.817 1.465 1.00 0.00 C ATOM 2836 C SER B 84 -10.510 -2.686 1.132 1.00 0.00 C ATOM 2837 O SER B 84 -11.552 -2.846 0.510 1.00 0.00 O ATOM 2838 CB SER B 84 -10.233 -5.177 1.195 1.00 0.00 C ATOM 2839 OG SER B 84 -11.079 -5.094 0.056 1.00 0.00 O ATOM 0 H SER B 84 -8.541 -4.469 3.192 1.00 0.00 H new ATOM 0 HA SER B 84 -8.696 -3.665 0.853 1.00 0.00 H new ATOM 0 HB2 SER B 84 -9.462 -5.930 1.032 1.00 0.00 H new ATOM 0 HB3 SER B 84 -10.809 -5.494 2.064 1.00 0.00 H new ATOM 0 HG SER B 84 -11.560 -4.240 0.067 1.00 0.00 H new ATOM 2845 N LEU B 85 -10.261 -1.539 1.683 1.00 0.00 N ATOM 2846 CA LEU B 85 -11.302 -0.509 1.509 1.00 0.00 C ATOM 2847 C LEU B 85 -12.525 -1.324 1.130 1.00 0.00 C ATOM 2848 O LEU B 85 -13.429 -0.863 0.517 1.00 0.00 O ATOM 2849 CB LEU B 85 -10.925 0.445 0.342 1.00 0.00 C ATOM 2850 CG LEU B 85 -9.543 0.166 -0.282 1.00 0.00 C ATOM 2851 CD1 LEU B 85 -8.439 0.209 0.774 1.00 0.00 C ATOM 2852 CD2 LEU B 85 -9.546 -1.187 -0.984 1.00 0.00 C ATOM 0 H LEU B 85 -9.431 -1.280 2.217 1.00 0.00 H new ATOM 0 HA LEU B 85 -11.445 0.113 2.393 1.00 0.00 H new ATOM 0 HB2 LEU B 85 -11.685 0.367 -0.436 1.00 0.00 H new ATOM 0 HB3 LEU B 85 -10.946 1.472 0.706 1.00 0.00 H new ATOM 0 HG LEU B 85 -9.340 0.948 -1.014 1.00 0.00 H new ATOM 0 HD11 LEU B 85 -7.477 0.008 0.303 1.00 0.00 H new ATOM 0 HD12 LEU B 85 -8.417 1.195 1.238 1.00 0.00 H new ATOM 0 HD13 LEU B 85 -8.634 -0.546 1.536 1.00 0.00 H new ATOM 0 HD21 LEU B 85 -8.565 -1.373 -1.421 1.00 0.00 H new ATOM 0 HD22 LEU B 85 -9.776 -1.971 -0.262 1.00 0.00 H new ATOM 0 HD23 LEU B 85 -10.299 -1.187 -1.772 1.00 0.00 H new ATOM 2864 N LYS B 86 -12.502 -2.583 1.587 1.00 0.00 N ATOM 2865 CA LYS B 86 -13.598 -3.569 1.396 1.00 0.00 C ATOM 2866 C LYS B 86 -14.825 -2.856 1.789 1.00 0.00 C ATOM 2867 O LYS B 86 -15.878 -2.935 1.187 1.00 0.00 O ATOM 2868 CB LYS B 86 -13.224 -4.642 2.435 1.00 0.00 C ATOM 2869 CG LYS B 86 -14.446 -5.374 2.999 1.00 0.00 C ATOM 2870 CD LYS B 86 -14.188 -5.666 4.481 1.00 0.00 C ATOM 2871 CE LYS B 86 -15.408 -6.361 5.089 1.00 0.00 C ATOM 2872 NZ LYS B 86 -16.201 -5.266 5.714 1.00 0.00 N ATOM 0 H LYS B 86 -11.712 -2.961 2.110 1.00 0.00 H new ATOM 0 HA LYS B 86 -13.735 -3.989 0.399 1.00 0.00 H new ATOM 0 HB2 LYS B 86 -12.552 -5.367 1.976 1.00 0.00 H new ATOM 0 HB3 LYS B 86 -12.677 -4.174 3.253 1.00 0.00 H new ATOM 0 HG2 LYS B 86 -15.342 -4.764 2.882 1.00 0.00 H new ATOM 0 HG3 LYS B 86 -14.619 -6.302 2.453 1.00 0.00 H new ATOM 0 HD2 LYS B 86 -13.306 -6.297 4.589 1.00 0.00 H new ATOM 0 HD3 LYS B 86 -13.983 -4.738 5.014 1.00 0.00 H new ATOM 0 HE2 LYS B 86 -15.987 -6.882 4.326 1.00 0.00 H new ATOM 0 HE3 LYS B 86 -15.111 -7.105 5.828 1.00 0.00 H new ATOM 0 HZ1 LYS B 86 -17.056 -5.664 6.153 1.00 0.00 H new ATOM 0 HZ2 LYS B 86 -15.627 -4.792 6.440 1.00 0.00 H new ATOM 0 HZ3 LYS B 86 -16.475 -4.576 4.985 1.00 0.00 H new ATOM 2886 N LYS B 87 -14.634 -2.103 2.800 1.00 0.00 N ATOM 2887 CA LYS B 87 -15.685 -1.281 3.303 1.00 0.00 C ATOM 2888 C LYS B 87 -16.032 -0.313 2.190 1.00 0.00 C ATOM 2889 O LYS B 87 -17.189 -0.049 1.874 1.00 0.00 O ATOM 2890 CB LYS B 87 -15.019 -0.588 4.489 1.00 0.00 C ATOM 2891 CG LYS B 87 -16.068 0.136 5.339 1.00 0.00 C ATOM 2892 CD LYS B 87 -15.719 1.623 5.434 1.00 0.00 C ATOM 2893 CE LYS B 87 -17.004 2.454 5.395 1.00 0.00 C ATOM 2894 NZ LYS B 87 -16.545 3.865 5.258 1.00 0.00 N ATOM 0 H LYS B 87 -13.752 -2.031 3.308 1.00 0.00 H new ATOM 0 HA LYS B 87 -16.604 -1.783 3.605 1.00 0.00 H new ATOM 0 HB2 LYS B 87 -14.491 -1.322 5.098 1.00 0.00 H new ATOM 0 HB3 LYS B 87 -14.275 0.125 4.132 1.00 0.00 H new ATOM 0 HG2 LYS B 87 -17.057 0.012 4.897 1.00 0.00 H new ATOM 0 HG3 LYS B 87 -16.108 -0.302 6.336 1.00 0.00 H new ATOM 0 HD2 LYS B 87 -15.174 1.821 6.357 1.00 0.00 H new ATOM 0 HD3 LYS B 87 -15.065 1.907 4.610 1.00 0.00 H new ATOM 0 HE2 LYS B 87 -17.638 2.162 4.558 1.00 0.00 H new ATOM 0 HE3 LYS B 87 -17.591 2.316 6.303 1.00 0.00 H new ATOM 0 HZ1 LYS B 87 -17.370 4.497 5.224 1.00 0.00 H new ATOM 0 HZ2 LYS B 87 -15.949 4.117 6.072 1.00 0.00 H new ATOM 0 HZ3 LYS B 87 -15.995 3.967 4.382 1.00 0.00 H new ATOM 2908 N ALA B 88 -15.017 0.173 1.537 1.00 0.00 N ATOM 2909 CA ALA B 88 -15.282 1.082 0.416 1.00 0.00 C ATOM 2910 C ALA B 88 -15.688 0.241 -0.785 1.00 0.00 C ATOM 2911 O ALA B 88 -16.504 0.634 -1.595 1.00 0.00 O ATOM 2912 CB ALA B 88 -13.955 1.802 0.172 1.00 0.00 C ATOM 0 H ALA B 88 -14.035 -0.021 1.733 1.00 0.00 H new ATOM 0 HA ALA B 88 -16.081 1.799 0.605 1.00 0.00 H new ATOM 0 HB1 ALA B 88 -14.068 2.503 -0.655 1.00 0.00 H new ATOM 0 HB2 ALA B 88 -13.665 2.345 1.071 1.00 0.00 H new ATOM 0 HB3 ALA B 88 -13.185 1.071 -0.075 1.00 0.00 H new ATOM 2918 N ALA B 89 -15.126 -0.931 -0.895 1.00 0.00 N ATOM 2919 CA ALA B 89 -15.456 -1.804 -2.046 1.00 0.00 C ATOM 2920 C ALA B 89 -16.920 -2.186 -1.948 1.00 0.00 C ATOM 2921 O ALA B 89 -17.605 -2.311 -2.945 1.00 0.00 O ATOM 2922 CB ALA B 89 -14.503 -3.002 -1.958 1.00 0.00 C ATOM 0 H ALA B 89 -14.452 -1.318 -0.234 1.00 0.00 H new ATOM 0 HA ALA B 89 -15.325 -1.325 -3.016 1.00 0.00 H new ATOM 0 HB1 ALA B 89 -14.699 -3.685 -2.785 1.00 0.00 H new ATOM 0 HB2 ALA B 89 -13.472 -2.652 -2.013 1.00 0.00 H new ATOM 0 HB3 ALA B 89 -14.659 -3.522 -1.013 1.00 0.00 H new ATOM 2928 N GLU B 90 -17.435 -2.276 -0.753 1.00 0.00 N ATOM 2929 CA GLU B 90 -18.885 -2.539 -0.616 1.00 0.00 C ATOM 2930 C GLU B 90 -19.579 -1.317 -1.214 1.00 0.00 C ATOM 2931 O GLU B 90 -20.622 -1.405 -1.833 1.00 0.00 O ATOM 2932 CB GLU B 90 -19.149 -2.650 0.887 1.00 0.00 C ATOM 2933 CG GLU B 90 -19.338 -4.120 1.266 1.00 0.00 C ATOM 2934 CD GLU B 90 -20.180 -4.214 2.539 1.00 0.00 C ATOM 2935 OE1 GLU B 90 -20.002 -3.377 3.407 1.00 0.00 O ATOM 2936 OE2 GLU B 90 -20.990 -5.123 2.624 1.00 0.00 O ATOM 0 H GLU B 90 -16.918 -2.180 0.121 1.00 0.00 H new ATOM 0 HA GLU B 90 -19.237 -3.443 -1.113 1.00 0.00 H new ATOM 0 HB2 GLU B 90 -18.316 -2.224 1.446 1.00 0.00 H new ATOM 0 HB3 GLU B 90 -20.037 -2.078 1.154 1.00 0.00 H new ATOM 0 HG2 GLU B 90 -19.828 -4.656 0.453 1.00 0.00 H new ATOM 0 HG3 GLU B 90 -18.369 -4.594 1.422 1.00 0.00 H new ATOM 2943 N GLY B 91 -18.962 -0.167 -1.047 1.00 0.00 N ATOM 2944 CA GLY B 91 -19.526 1.090 -1.619 1.00 0.00 C ATOM 2945 C GLY B 91 -19.546 1.024 -3.161 1.00 0.00 C ATOM 2946 O GLY B 91 -20.529 1.384 -3.779 1.00 0.00 O ATOM 0 H GLY B 91 -18.087 -0.051 -0.535 1.00 0.00 H new ATOM 0 HA2 GLY B 91 -20.537 1.245 -1.243 1.00 0.00 H new ATOM 0 HA3 GLY B 91 -18.931 1.943 -1.294 1.00 0.00 H new ATOM 2950 N LEU B 92 -18.477 0.580 -3.800 1.00 0.00 N ATOM 2951 CA LEU B 92 -18.470 0.515 -5.297 1.00 0.00 C ATOM 2952 C LEU B 92 -19.492 -0.504 -5.818 1.00 0.00 C ATOM 2953 O LEU B 92 -19.575 -0.749 -7.005 1.00 0.00 O ATOM 2954 CB LEU B 92 -17.037 0.079 -5.666 1.00 0.00 C ATOM 2955 CG LEU B 92 -16.939 -1.453 -5.769 1.00 0.00 C ATOM 2956 CD1 LEU B 92 -17.227 -1.894 -7.208 1.00 0.00 C ATOM 2957 CD2 LEU B 92 -15.529 -1.908 -5.374 1.00 0.00 C ATOM 0 H LEU B 92 -17.619 0.264 -3.348 1.00 0.00 H new ATOM 0 HA LEU B 92 -18.743 1.472 -5.742 1.00 0.00 H new ATOM 0 HB2 LEU B 92 -16.748 0.531 -6.615 1.00 0.00 H new ATOM 0 HB3 LEU B 92 -16.337 0.443 -4.914 1.00 0.00 H new ATOM 0 HG LEU B 92 -17.670 -1.903 -5.097 1.00 0.00 H new ATOM 0 HD11 LEU B 92 -17.157 -2.980 -7.277 1.00 0.00 H new ATOM 0 HD12 LEU B 92 -18.230 -1.577 -7.492 1.00 0.00 H new ATOM 0 HD13 LEU B 92 -16.499 -1.440 -7.880 1.00 0.00 H new ATOM 0 HD21 LEU B 92 -15.463 -2.993 -5.448 1.00 0.00 H new ATOM 0 HD22 LEU B 92 -14.799 -1.453 -6.044 1.00 0.00 H new ATOM 0 HD23 LEU B 92 -15.321 -1.601 -4.349 1.00 0.00 H new ATOM 2969 N LYS B 93 -20.243 -1.127 -4.943 1.00 0.00 N ATOM 2970 CA LYS B 93 -21.221 -2.164 -5.390 1.00 0.00 C ATOM 2971 C LYS B 93 -20.427 -3.402 -5.794 1.00 0.00 C ATOM 2972 O LYS B 93 -20.541 -3.910 -6.894 1.00 0.00 O ATOM 2973 CB LYS B 93 -21.980 -1.573 -6.585 1.00 0.00 C ATOM 2974 CG LYS B 93 -23.470 -1.897 -6.456 1.00 0.00 C ATOM 2975 CD LYS B 93 -24.064 -1.112 -5.285 1.00 0.00 C ATOM 2976 CE LYS B 93 -25.592 -1.183 -5.345 1.00 0.00 C ATOM 2977 NZ LYS B 93 -26.061 0.087 -4.724 1.00 0.00 N ATOM 0 H LYS B 93 -20.220 -0.961 -3.937 1.00 0.00 H new ATOM 0 HA LYS B 93 -21.932 -2.444 -4.612 1.00 0.00 H new ATOM 0 HB2 LYS B 93 -21.834 -0.494 -6.624 1.00 0.00 H new ATOM 0 HB3 LYS B 93 -21.588 -1.981 -7.516 1.00 0.00 H new ATOM 0 HG2 LYS B 93 -23.990 -1.642 -7.380 1.00 0.00 H new ATOM 0 HG3 LYS B 93 -23.608 -2.967 -6.298 1.00 0.00 H new ATOM 0 HD2 LYS B 93 -23.707 -1.522 -4.340 1.00 0.00 H new ATOM 0 HD3 LYS B 93 -23.736 -0.073 -5.326 1.00 0.00 H new ATOM 0 HE2 LYS B 93 -25.943 -1.273 -6.373 1.00 0.00 H new ATOM 0 HE3 LYS B 93 -25.969 -2.050 -4.803 1.00 0.00 H new ATOM 0 HZ1 LYS B 93 -27.101 0.112 -4.728 1.00 0.00 H new ATOM 0 HZ2 LYS B 93 -25.717 0.142 -3.744 1.00 0.00 H new ATOM 0 HZ3 LYS B 93 -25.693 0.895 -5.266 1.00 0.00 H new ATOM 2991 N TYR B 94 -19.598 -3.867 -4.894 1.00 0.00 N ATOM 2992 CA TYR B 94 -18.744 -5.061 -5.163 1.00 0.00 C ATOM 2993 C TYR B 94 -19.515 -6.120 -5.963 1.00 0.00 C ATOM 2994 O TYR B 94 -19.000 -6.699 -6.899 1.00 0.00 O ATOM 2995 CB TYR B 94 -18.378 -5.578 -3.769 1.00 0.00 C ATOM 2996 CG TYR B 94 -17.934 -7.012 -3.860 1.00 0.00 C ATOM 2997 CD1 TYR B 94 -16.911 -7.372 -4.741 1.00 0.00 C ATOM 2998 CD2 TYR B 94 -18.563 -7.981 -3.075 1.00 0.00 C ATOM 2999 CE1 TYR B 94 -16.511 -8.712 -4.833 1.00 0.00 C ATOM 3000 CE2 TYR B 94 -18.167 -9.321 -3.167 1.00 0.00 C ATOM 3001 CZ TYR B 94 -17.142 -9.685 -4.048 1.00 0.00 C ATOM 3002 OH TYR B 94 -16.749 -11.006 -4.140 1.00 0.00 O ATOM 0 H TYR B 94 -19.476 -3.460 -3.967 1.00 0.00 H new ATOM 0 HA TYR B 94 -17.865 -4.822 -5.762 1.00 0.00 H new ATOM 0 HB2 TYR B 94 -17.583 -4.968 -3.342 1.00 0.00 H new ATOM 0 HB3 TYR B 94 -19.237 -5.495 -3.103 1.00 0.00 H new ATOM 0 HD1 TYR B 94 -16.430 -6.620 -5.349 1.00 0.00 H new ATOM 0 HD2 TYR B 94 -19.354 -7.697 -2.397 1.00 0.00 H new ATOM 0 HE1 TYR B 94 -15.717 -8.994 -5.509 1.00 0.00 H new ATOM 0 HE2 TYR B 94 -18.651 -10.072 -2.560 1.00 0.00 H new ATOM 0 HH TYR B 94 -17.287 -11.551 -3.528 1.00 0.00 H new ATOM 3012 N GLU B 95 -20.744 -6.373 -5.602 1.00 0.00 N ATOM 3013 CA GLU B 95 -21.543 -7.392 -6.348 1.00 0.00 C ATOM 3014 C GLU B 95 -21.608 -7.012 -7.828 1.00 0.00 C ATOM 3015 O GLU B 95 -21.472 -7.849 -8.702 1.00 0.00 O ATOM 3016 CB GLU B 95 -22.936 -7.369 -5.715 1.00 0.00 C ATOM 3017 CG GLU B 95 -23.546 -5.971 -5.843 1.00 0.00 C ATOM 3018 CD GLU B 95 -24.708 -5.830 -4.857 1.00 0.00 C ATOM 3019 OE1 GLU B 95 -25.528 -6.732 -4.805 1.00 0.00 O ATOM 3020 OE2 GLU B 95 -24.758 -4.822 -4.171 1.00 0.00 O ATOM 0 H GLU B 95 -21.229 -5.921 -4.827 1.00 0.00 H new ATOM 0 HA GLU B 95 -21.103 -8.387 -6.290 1.00 0.00 H new ATOM 0 HB2 GLU B 95 -23.579 -8.101 -6.204 1.00 0.00 H new ATOM 0 HB3 GLU B 95 -22.872 -7.652 -4.664 1.00 0.00 H new ATOM 0 HG2 GLU B 95 -22.790 -5.213 -5.641 1.00 0.00 H new ATOM 0 HG3 GLU B 95 -23.897 -5.808 -6.862 1.00 0.00 H new ATOM 3027 N ASP B 96 -21.787 -5.751 -8.114 1.00 0.00 N ATOM 3028 CA ASP B 96 -21.829 -5.309 -9.537 1.00 0.00 C ATOM 3029 C ASP B 96 -20.493 -5.646 -10.194 1.00 0.00 C ATOM 3030 O ASP B 96 -20.422 -5.956 -11.368 1.00 0.00 O ATOM 3031 CB ASP B 96 -22.042 -3.795 -9.485 1.00 0.00 C ATOM 3032 CG ASP B 96 -22.861 -3.351 -10.699 1.00 0.00 C ATOM 3033 OD1 ASP B 96 -23.860 -3.992 -10.979 1.00 0.00 O ATOM 3034 OD2 ASP B 96 -22.474 -2.379 -11.326 1.00 0.00 O ATOM 0 H ASP B 96 -21.906 -5.009 -7.425 1.00 0.00 H new ATOM 0 HA ASP B 96 -22.617 -5.796 -10.112 1.00 0.00 H new ATOM 0 HB2 ASP B 96 -22.559 -3.521 -8.565 1.00 0.00 H new ATOM 0 HB3 ASP B 96 -21.080 -3.282 -9.475 1.00 0.00 H new ATOM 3039 N PHE B 97 -19.436 -5.607 -9.428 1.00 0.00 N ATOM 3040 CA PHE B 97 -18.095 -5.945 -9.981 1.00 0.00 C ATOM 3041 C PHE B 97 -17.918 -7.466 -9.984 1.00 0.00 C ATOM 3042 O PHE B 97 -17.157 -8.012 -10.759 1.00 0.00 O ATOM 3043 CB PHE B 97 -17.094 -5.286 -9.026 1.00 0.00 C ATOM 3044 CG PHE B 97 -16.252 -4.283 -9.781 1.00 0.00 C ATOM 3045 CD1 PHE B 97 -16.867 -3.300 -10.566 1.00 0.00 C ATOM 3046 CD2 PHE B 97 -14.856 -4.335 -9.692 1.00 0.00 C ATOM 3047 CE1 PHE B 97 -16.085 -2.372 -11.263 1.00 0.00 C ATOM 3048 CE2 PHE B 97 -14.075 -3.408 -10.388 1.00 0.00 C ATOM 3049 CZ PHE B 97 -14.689 -2.425 -11.175 1.00 0.00 C ATOM 0 H PHE B 97 -19.445 -5.355 -8.440 1.00 0.00 H new ATOM 0 HA PHE B 97 -17.959 -5.598 -11.005 1.00 0.00 H new ATOM 0 HB2 PHE B 97 -17.625 -4.791 -8.213 1.00 0.00 H new ATOM 0 HB3 PHE B 97 -16.455 -6.044 -8.574 1.00 0.00 H new ATOM 0 HD1 PHE B 97 -17.944 -3.258 -10.634 1.00 0.00 H new ATOM 0 HD2 PHE B 97 -14.382 -5.092 -9.085 1.00 0.00 H new ATOM 0 HE1 PHE B 97 -16.559 -1.614 -11.869 1.00 0.00 H new ATOM 0 HE2 PHE B 97 -12.998 -3.450 -10.319 1.00 0.00 H new ATOM 0 HZ PHE B 97 -14.086 -1.709 -11.713 1.00 0.00 H new