USER MOD reduce.3.24.130724 H: found=0, std=0, add=1258, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 1259 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 Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -136:sc= 0.0504 (180deg=-0.191) USER MOD Single : A 4 TYR OH : rot 180:sc= 0 USER MOD Single : A 5 LYS NZ :NH3+ 169:sc= 0.504 (180deg=0.367) USER MOD Single : A 9 THR OG1 : rot 39:sc= 0.615 USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 15 SER OG : rot 24:sc= 0.22 USER MOD Single : A 17 SER OG : rot -37:sc= 0.613 USER MOD Single : A 20 MET CE :methyl -130:sc= -0.0133 (180deg=-2.07) USER MOD Single : A 21 LYS NZ :NH3+ -158:sc= -0.107 (180deg=-0.592) USER MOD Single : A 28 TYR OH : rot -98:sc= 0.827 USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 LYS NZ :NH3+ -141:sc= 0 (180deg=-1.2) USER MOD Single : A 34 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 73 ASN : amide:sc= -0.58 K(o=-0.58,f=-2.4!) USER MOD Single : A 74 HIS : no HD1:sc= 0.192 K(o=0.19,f=-0.79) USER MOD Single : A 75 LYS NZ :NH3+ -160:sc= -0.0997 (180deg=-0.557) USER MOD Single : A 79 MET CE :methyl -171:sc= 0 (180deg=-0.0713) USER MOD Single : A 80 ASN : amide:sc=-0.00414 K(o=-0.0041,f=-0.87) USER MOD Single : A 81 CYS SG : rot 180:sc= 0 USER MOD Single : A 82 TYR OH : rot 180:sc= 0 USER MOD Single : A 86 SER OG : rot 180:sc= 0 USER MOD Single : A 87 MET CE :methyl -161:sc= -0.0768 (180deg=-0.515) USER MOD Single : A 89 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0468) USER MOD Single : A 91 TYR OH : rot 180:sc= 0 USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 LYS NZ :NH3+ -166:sc= -0.0282 (180deg=-0.24) USER MOD Single : A 96 MET CE :methyl -162:sc= -0.125 (180deg=-0.555) USER MOD Single : A 97 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.0898) USER MOD Single : A 98 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 102 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 103 MET CE :methyl -151:sc= 0 (180deg=-0.868) USER MOD Single : A 105 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0534) USER MOD Single : A 106 ASN :FLIP amide:sc= -1.82! C(o=-4.8!,f=-1.8!) USER MOD Single : A 107 ASN : amide:sc= -0.362 X(o=-0.36,f=-0.63) USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 LYS NZ :NH3+ 170:sc= 1.04 (180deg=0.909) USER MOD Single : A 118 LYS NZ :NH3+ 172:sc= 0.345 (180deg=0.0917) USER MOD Single : A 119 LYS NZ :NH3+ 170:sc= 1.01 (180deg=0.801) USER MOD Single : A 121 GLN : amide:sc= -1.53 X(o=-1.5,f=-2!) USER MOD Single : A 126 SER OG : rot -72:sc= 1.13 USER MOD Single : A 130 LYS NZ :NH3+ -143:sc= -2.14! (180deg=-4.85!) USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 135 ASN :FLIP amide:sc= 0 F(o=-0.82,f=0) USER MOD Single : A 150 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 152 GLN : amide:sc= -0.201 X(o=-0.2,f=-0.51) USER MOD Single : A 158 TYR OH : rot 180:sc= 0 USER MOD Single : A 164 THR OG1 : rot 180:sc= 0 USER MOD Single : A 168 THR OG1 : rot 175:sc= 0.393 USER MOD Single : A 170 MET CE :methyl -177:sc= -0.283 (180deg=-0.313) USER MOD Single : A 173 LYS NZ :NH3+ -172:sc= -3.02! (180deg=-3.24!) USER MOD Single : A 180 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -3.383 6.822 21.145 1.00 52.13 N ATOM 2 CA MET A 1 -3.129 6.982 19.684 1.00 10.45 C ATOM 3 C MET A 1 -3.951 5.970 18.872 1.00 43.31 C ATOM 4 O MET A 1 -4.820 5.284 19.414 1.00 5.20 O ATOM 5 CB MET A 1 -1.635 6.772 19.379 1.00 74.14 C ATOM 6 CG MET A 1 -0.697 7.707 20.132 1.00 72.13 C ATOM 7 SD MET A 1 1.036 7.399 19.733 1.00 74.34 S ATOM 8 CE MET A 1 1.859 8.595 20.786 1.00 22.54 C ATOM 0 H1 MET A 1 -3.504 7.758 21.581 1.00 52.13 H new ATOM 0 H2 MET A 1 -4.246 6.259 21.288 1.00 52.13 H new ATOM 0 H3 MET A 1 -2.576 6.337 21.587 1.00 52.13 H new ATOM 0 HA MET A 1 -3.426 7.992 19.401 1.00 10.45 H new ATOM 0 HB2 MET A 1 -1.370 5.742 19.619 1.00 74.14 H new ATOM 0 HB3 MET A 1 -1.474 6.902 18.309 1.00 74.14 H new ATOM 0 HG2 MET A 1 -0.946 8.740 19.891 1.00 72.13 H new ATOM 0 HG3 MET A 1 -0.849 7.585 21.204 1.00 72.13 H new ATOM 0 HE1 MET A 1 2.938 8.521 20.647 1.00 22.54 H new ATOM 0 HE2 MET A 1 1.527 9.600 20.524 1.00 22.54 H new ATOM 0 HE3 MET A 1 1.613 8.392 21.828 1.00 22.54 H new ATOM 20 N LEU A 2 -3.678 5.885 17.569 1.00 1.13 N ATOM 21 CA LEU A 2 -4.295 4.865 16.714 1.00 61.32 C ATOM 22 C LEU A 2 -3.310 3.709 16.475 1.00 4.30 C ATOM 23 O LEU A 2 -2.157 3.940 16.110 1.00 74.14 O ATOM 24 CB LEU A 2 -4.713 5.471 15.366 1.00 15.15 C ATOM 25 CG LEU A 2 -5.506 4.524 14.448 1.00 13.21 C ATOM 26 CD1 LEU A 2 -6.889 4.240 15.029 1.00 71.42 C ATOM 27 CD2 LEU A 2 -5.621 5.096 13.038 1.00 51.15 C ATOM 0 H LEU A 2 -3.035 6.509 17.081 1.00 1.13 H new ATOM 0 HA LEU A 2 -5.182 4.485 17.220 1.00 61.32 H new ATOM 0 HB2 LEU A 2 -5.316 6.359 15.555 1.00 15.15 H new ATOM 0 HB3 LEU A 2 -3.817 5.799 14.838 1.00 15.15 H new ATOM 0 HG LEU A 2 -4.960 3.582 14.386 1.00 13.21 H new ATOM 0 HD11 LEU A 2 -7.432 3.569 14.364 1.00 71.42 H new ATOM 0 HD12 LEU A 2 -6.783 3.773 16.008 1.00 71.42 H new ATOM 0 HD13 LEU A 2 -7.440 5.175 15.130 1.00 71.42 H new ATOM 0 HD21 LEU A 2 -6.186 4.407 12.411 1.00 51.15 H new ATOM 0 HD22 LEU A 2 -6.135 6.056 13.076 1.00 51.15 H new ATOM 0 HD23 LEU A 2 -4.624 5.234 12.619 1.00 51.15 H new ATOM 39 N ILE A 3 -3.761 2.473 16.668 1.00 61.51 N ATOM 40 CA ILE A 3 -2.883 1.303 16.545 1.00 54.34 C ATOM 41 C ILE A 3 -3.293 0.410 15.359 1.00 75.14 C ATOM 42 O ILE A 3 -4.432 -0.046 15.268 1.00 21.10 O ATOM 43 CB ILE A 3 -2.864 0.478 17.861 1.00 52.50 C ATOM 44 CG1 ILE A 3 -4.294 0.112 18.304 1.00 50.13 C ATOM 45 CG2 ILE A 3 -2.142 1.252 18.966 1.00 42.52 C ATOM 46 CD1 ILE A 3 -4.357 -0.707 19.579 1.00 25.53 C ATOM 0 H ILE A 3 -4.727 2.251 16.910 1.00 61.51 H new ATOM 0 HA ILE A 3 -1.876 1.674 16.355 1.00 54.34 H new ATOM 0 HB ILE A 3 -2.321 -0.448 17.673 1.00 52.50 H new ATOM 0 HG12 ILE A 3 -4.865 1.030 18.446 1.00 50.13 H new ATOM 0 HG13 ILE A 3 -4.780 -0.445 17.503 1.00 50.13 H new ATOM 0 HG21 ILE A 3 -2.137 0.660 19.881 1.00 42.52 H new ATOM 0 HG22 ILE A 3 -1.116 1.453 18.659 1.00 42.52 H new ATOM 0 HG23 ILE A 3 -2.658 2.195 19.146 1.00 42.52 H new ATOM 0 HD11 ILE A 3 -5.397 -0.923 19.822 1.00 25.53 H new ATOM 0 HD12 ILE A 3 -3.816 -1.643 19.438 1.00 25.53 H new ATOM 0 HD13 ILE A 3 -3.903 -0.145 20.395 1.00 25.53 H new ATOM 58 N TYR A 4 -2.358 0.176 14.439 1.00 3.02 N ATOM 59 CA TYR A 4 -2.639 -0.618 13.236 1.00 75.31 C ATOM 60 C TYR A 4 -1.698 -1.829 13.107 1.00 44.14 C ATOM 61 O TYR A 4 -0.509 -1.757 13.445 1.00 22.52 O ATOM 62 CB TYR A 4 -2.549 0.269 11.982 1.00 31.34 C ATOM 63 CG TYR A 4 -1.242 1.036 11.847 1.00 24.01 C ATOM 64 CD1 TYR A 4 -1.073 2.268 12.469 1.00 32.33 C ATOM 65 CD2 TYR A 4 -0.181 0.532 11.097 1.00 2.52 C ATOM 66 CE1 TYR A 4 0.109 2.973 12.350 1.00 41.03 C ATOM 67 CE2 TYR A 4 1.005 1.233 10.976 1.00 54.44 C ATOM 68 CZ TYR A 4 1.145 2.453 11.604 1.00 14.21 C ATOM 69 OH TYR A 4 2.325 3.156 11.487 1.00 32.54 O ATOM 0 H TYR A 4 -1.401 0.522 14.500 1.00 3.02 H new ATOM 0 HA TYR A 4 -3.653 -1.007 13.330 1.00 75.31 H new ATOM 0 HB2 TYR A 4 -2.682 -0.356 11.099 1.00 31.34 H new ATOM 0 HB3 TYR A 4 -3.374 0.981 11.995 1.00 31.34 H new ATOM 0 HD1 TYR A 4 -1.880 2.681 13.056 1.00 32.33 H new ATOM 0 HD2 TYR A 4 -0.287 -0.422 10.602 1.00 2.52 H new ATOM 0 HE1 TYR A 4 0.221 3.929 12.840 1.00 41.03 H new ATOM 0 HE2 TYR A 4 1.818 0.827 10.392 1.00 54.44 H new ATOM 0 HH TYR A 4 2.953 2.651 10.929 1.00 32.54 H new ATOM 79 N LYS A 5 -2.249 -2.940 12.612 1.00 74.11 N ATOM 80 CA LYS A 5 -1.475 -4.168 12.380 1.00 63.15 C ATOM 81 C LYS A 5 -1.710 -4.715 10.963 1.00 71.24 C ATOM 82 O LYS A 5 -2.780 -4.532 10.388 1.00 72.11 O ATOM 83 CB LYS A 5 -1.846 -5.244 13.416 1.00 30.42 C ATOM 84 CG LYS A 5 -3.349 -5.507 13.538 1.00 74.02 C ATOM 85 CD LYS A 5 -3.642 -6.867 14.177 1.00 72.21 C ATOM 86 CE LYS A 5 -3.396 -8.015 13.199 1.00 53.34 C ATOM 87 NZ LYS A 5 -3.401 -9.344 13.871 1.00 75.03 N ATOM 0 H LYS A 5 -3.235 -3.017 12.362 1.00 74.11 H new ATOM 0 HA LYS A 5 -0.420 -3.916 12.484 1.00 63.15 H new ATOM 0 HB2 LYS A 5 -1.346 -6.175 13.150 1.00 30.42 H new ATOM 0 HB3 LYS A 5 -1.461 -4.942 14.390 1.00 30.42 H new ATOM 0 HG2 LYS A 5 -3.808 -4.719 14.135 1.00 74.02 H new ATOM 0 HG3 LYS A 5 -3.806 -5.465 12.549 1.00 74.02 H new ATOM 0 HD2 LYS A 5 -3.014 -6.998 15.058 1.00 72.21 H new ATOM 0 HD3 LYS A 5 -4.677 -6.894 14.517 1.00 72.21 H new ATOM 0 HE2 LYS A 5 -4.163 -8.000 12.425 1.00 53.34 H new ATOM 0 HE3 LYS A 5 -2.438 -7.866 12.702 1.00 53.34 H new ATOM 0 HZ1 LYS A 5 -3.417 -10.096 13.153 1.00 75.03 H new ATOM 0 HZ2 LYS A 5 -2.546 -9.441 14.455 1.00 75.03 H new ATOM 0 HZ3 LYS A 5 -4.243 -9.424 14.476 1.00 75.03 H new ATOM 101 N ASP A 6 -0.703 -5.382 10.408 1.00 51.11 N ATOM 102 CA ASP A 6 -0.806 -5.996 9.078 1.00 30.25 C ATOM 103 C ASP A 6 -1.133 -7.499 9.180 1.00 62.30 C ATOM 104 O ASP A 6 -1.342 -8.034 10.269 1.00 31.11 O ATOM 105 CB ASP A 6 0.495 -5.787 8.304 1.00 1.15 C ATOM 106 CG ASP A 6 1.624 -6.606 8.883 1.00 12.33 C ATOM 107 OD1 ASP A 6 2.090 -6.274 9.990 1.00 2.41 O ATOM 108 OD2 ASP A 6 2.026 -7.601 8.244 1.00 11.01 O ATOM 0 H ASP A 6 0.202 -5.515 10.859 1.00 51.11 H new ATOM 0 HA ASP A 6 -1.623 -5.512 8.542 1.00 30.25 H new ATOM 0 HB2 ASP A 6 0.345 -6.060 7.259 1.00 1.15 H new ATOM 0 HB3 ASP A 6 0.764 -4.731 8.322 1.00 1.15 H new ATOM 113 N ILE A 7 -1.216 -8.165 8.035 1.00 44.23 N ATOM 114 CA ILE A 7 -1.534 -9.598 7.988 1.00 64.14 C ATOM 115 C ILE A 7 -0.452 -10.487 8.654 1.00 63.34 C ATOM 116 O ILE A 7 -0.783 -11.410 9.404 1.00 43.51 O ATOM 117 CB ILE A 7 -1.742 -10.069 6.522 1.00 42.24 C ATOM 118 CG1 ILE A 7 -2.855 -9.247 5.844 1.00 55.34 C ATOM 119 CG2 ILE A 7 -2.072 -11.563 6.475 1.00 72.20 C ATOM 120 CD1 ILE A 7 -3.079 -9.600 4.386 1.00 2.32 C ATOM 0 H ILE A 7 -1.068 -7.739 7.120 1.00 44.23 H new ATOM 0 HA ILE A 7 -2.456 -9.715 8.557 1.00 64.14 H new ATOM 0 HB ILE A 7 -0.813 -9.908 5.976 1.00 42.24 H new ATOM 0 HG12 ILE A 7 -3.786 -9.395 6.391 1.00 55.34 H new ATOM 0 HG13 ILE A 7 -2.607 -8.188 5.917 1.00 55.34 H new ATOM 0 HG21 ILE A 7 -2.214 -11.872 5.439 1.00 72.20 H new ATOM 0 HG22 ILE A 7 -1.252 -12.131 6.914 1.00 72.20 H new ATOM 0 HG23 ILE A 7 -2.986 -11.752 7.038 1.00 72.20 H new ATOM 0 HD11 ILE A 7 -3.877 -8.979 3.980 1.00 2.32 H new ATOM 0 HD12 ILE A 7 -2.162 -9.425 3.824 1.00 2.32 H new ATOM 0 HD13 ILE A 7 -3.359 -10.650 4.305 1.00 2.32 H new ATOM 132 N PHE A 8 0.831 -10.210 8.390 1.00 61.12 N ATOM 133 CA PHE A 8 1.920 -11.145 8.761 1.00 23.15 C ATOM 134 C PHE A 8 2.810 -10.667 9.938 1.00 2.31 C ATOM 135 O PHE A 8 3.015 -11.410 10.899 1.00 2.04 O ATOM 136 CB PHE A 8 2.779 -11.472 7.521 1.00 10.01 C ATOM 137 CG PHE A 8 3.123 -10.277 6.662 1.00 71.32 C ATOM 138 CD1 PHE A 8 2.234 -9.825 5.693 1.00 33.31 C ATOM 139 CD2 PHE A 8 4.331 -9.611 6.813 1.00 5.43 C ATOM 140 CE1 PHE A 8 2.544 -8.738 4.900 1.00 64.35 C ATOM 141 CE2 PHE A 8 4.644 -8.524 6.020 1.00 65.31 C ATOM 142 CZ PHE A 8 3.750 -8.087 5.063 1.00 24.41 C ATOM 0 H PHE A 8 1.146 -9.358 7.926 1.00 61.12 H new ATOM 0 HA PHE A 8 1.429 -12.047 9.127 1.00 23.15 H new ATOM 0 HB2 PHE A 8 3.704 -11.945 7.850 1.00 10.01 H new ATOM 0 HB3 PHE A 8 2.248 -12.202 6.910 1.00 10.01 H new ATOM 0 HD1 PHE A 8 1.289 -10.331 5.559 1.00 33.31 H new ATOM 0 HD2 PHE A 8 5.035 -9.947 7.560 1.00 5.43 H new ATOM 0 HE1 PHE A 8 1.843 -8.397 4.152 1.00 64.35 H new ATOM 0 HE2 PHE A 8 5.588 -8.016 6.149 1.00 65.31 H new ATOM 0 HZ PHE A 8 3.994 -7.237 4.443 1.00 24.41 H new ATOM 152 N THR A 9 3.353 -9.455 9.864 1.00 73.14 N ATOM 153 CA THR A 9 4.268 -8.936 10.910 1.00 21.34 C ATOM 154 C THR A 9 3.523 -8.201 12.035 1.00 53.44 C ATOM 155 O THR A 9 4.123 -7.443 12.793 1.00 22.13 O ATOM 156 CB THR A 9 5.360 -7.996 10.321 1.00 12.42 C ATOM 157 OG1 THR A 9 4.786 -7.028 9.427 1.00 12.44 O ATOM 158 CG2 THR A 9 6.430 -8.794 9.584 1.00 4.21 C ATOM 0 H THR A 9 3.184 -8.805 9.097 1.00 73.14 H new ATOM 0 HA THR A 9 4.750 -9.818 11.333 1.00 21.34 H new ATOM 0 HB THR A 9 5.820 -7.473 11.159 1.00 12.42 H new ATOM 0 HG1 THR A 9 3.929 -6.717 9.787 1.00 12.44 H new ATOM 0 HG21 THR A 9 7.180 -8.113 9.183 1.00 4.21 H new ATOM 0 HG22 THR A 9 6.905 -9.490 10.275 1.00 4.21 H new ATOM 0 HG23 THR A 9 5.971 -9.350 8.767 1.00 4.21 H new ATOM 166 N ASP A 10 2.219 -8.444 12.143 1.00 21.14 N ATOM 167 CA ASP A 10 1.334 -7.704 13.060 1.00 33.54 C ATOM 168 C ASP A 10 1.835 -7.624 14.522 1.00 20.14 C ATOM 169 O ASP A 10 1.391 -6.757 15.280 1.00 10.25 O ATOM 170 CB ASP A 10 -0.059 -8.326 13.037 1.00 64.23 C ATOM 171 CG ASP A 10 -0.133 -9.648 13.780 1.00 71.54 C ATOM 172 OD1 ASP A 10 0.276 -10.682 13.218 1.00 23.12 O ATOM 173 OD2 ASP A 10 -0.632 -9.659 14.925 1.00 61.50 O ATOM 0 H ASP A 10 1.738 -9.160 11.599 1.00 21.14 H new ATOM 0 HA ASP A 10 1.321 -6.678 12.692 1.00 33.54 H new ATOM 0 HB2 ASP A 10 -0.770 -7.627 13.479 1.00 64.23 H new ATOM 0 HB3 ASP A 10 -0.365 -8.480 12.002 1.00 64.23 H new ATOM 178 N ASP A 11 2.730 -8.522 14.932 1.00 34.32 N ATOM 179 CA ASP A 11 3.272 -8.493 16.298 1.00 51.21 C ATOM 180 C ASP A 11 4.135 -7.239 16.517 1.00 54.13 C ATOM 181 O ASP A 11 4.390 -6.826 17.649 1.00 54.44 O ATOM 182 CB ASP A 11 4.085 -9.761 16.572 1.00 24.33 C ATOM 183 CG ASP A 11 5.326 -9.855 15.704 1.00 0.41 C ATOM 184 OD1 ASP A 11 5.190 -10.127 14.495 1.00 51.05 O ATOM 185 OD2 ASP A 11 6.440 -9.663 16.234 1.00 53.13 O ATOM 0 H ASP A 11 3.095 -9.274 14.347 1.00 34.32 H new ATOM 0 HA ASP A 11 2.438 -8.455 16.999 1.00 51.21 H new ATOM 0 HB2 ASP A 11 4.378 -9.781 17.622 1.00 24.33 H new ATOM 0 HB3 ASP A 11 3.458 -10.635 16.399 1.00 24.33 H new ATOM 190 N GLU A 12 4.579 -6.651 15.413 1.00 34.32 N ATOM 191 CA GLU A 12 5.331 -5.395 15.423 1.00 4.42 C ATOM 192 C GLU A 12 4.392 -4.192 15.217 1.00 12.11 C ATOM 193 O GLU A 12 4.812 -3.133 14.738 1.00 22.42 O ATOM 194 CB GLU A 12 6.406 -5.434 14.328 1.00 5.41 C ATOM 195 CG GLU A 12 7.374 -6.604 14.475 1.00 65.44 C ATOM 196 CD GLU A 12 8.441 -6.635 13.394 1.00 70.44 C ATOM 197 OE1 GLU A 12 9.498 -5.994 13.578 1.00 32.11 O ATOM 198 OE2 GLU A 12 8.233 -7.305 12.361 1.00 11.43 O ATOM 0 H GLU A 12 4.428 -7.031 14.479 1.00 34.32 H new ATOM 0 HA GLU A 12 5.812 -5.279 16.394 1.00 4.42 H new ATOM 0 HB2 GLU A 12 5.921 -5.493 13.354 1.00 5.41 H new ATOM 0 HB3 GLU A 12 6.969 -4.501 14.348 1.00 5.41 H new ATOM 0 HG2 GLU A 12 7.856 -6.548 15.451 1.00 65.44 H new ATOM 0 HG3 GLU A 12 6.812 -7.538 14.449 1.00 65.44 H new ATOM 205 N LEU A 13 3.118 -4.383 15.579 1.00 43.22 N ATOM 206 CA LEU A 13 2.075 -3.346 15.487 1.00 42.34 C ATOM 207 C LEU A 13 2.600 -1.946 15.864 1.00 25.14 C ATOM 208 O LEU A 13 3.354 -1.785 16.825 1.00 71.42 O ATOM 209 CB LEU A 13 0.888 -3.760 16.384 1.00 65.13 C ATOM 210 CG LEU A 13 -0.279 -2.752 16.512 1.00 32.21 C ATOM 211 CD1 LEU A 13 -1.587 -3.479 16.824 1.00 1.13 C ATOM 212 CD2 LEU A 13 0.003 -1.708 17.597 1.00 43.30 C ATOM 0 H LEU A 13 2.775 -5.270 15.948 1.00 43.22 H new ATOM 0 HA LEU A 13 1.748 -3.271 14.450 1.00 42.34 H new ATOM 0 HB2 LEU A 13 0.485 -4.698 16.002 1.00 65.13 H new ATOM 0 HB3 LEU A 13 1.273 -3.962 17.384 1.00 65.13 H new ATOM 0 HG LEU A 13 -0.374 -2.238 15.555 1.00 32.21 H new ATOM 0 HD11 LEU A 13 -2.395 -2.753 16.910 1.00 1.13 H new ATOM 0 HD12 LEU A 13 -1.814 -4.181 16.021 1.00 1.13 H new ATOM 0 HD13 LEU A 13 -1.486 -4.023 17.763 1.00 1.13 H new ATOM 0 HD21 LEU A 13 -0.836 -1.015 17.662 1.00 43.30 H new ATOM 0 HD22 LEU A 13 0.136 -2.207 18.557 1.00 43.30 H new ATOM 0 HD23 LEU A 13 0.910 -1.158 17.346 1.00 43.30 H new ATOM 224 N SER A 14 2.183 -0.934 15.102 1.00 12.15 N ATOM 225 CA SER A 14 2.665 0.444 15.307 1.00 10.14 C ATOM 226 C SER A 14 1.521 1.405 15.662 1.00 55.53 C ATOM 227 O SER A 14 0.381 1.222 15.230 1.00 62.24 O ATOM 228 CB SER A 14 3.388 0.955 14.050 1.00 44.10 C ATOM 229 OG SER A 14 4.588 0.233 13.798 1.00 13.42 O ATOM 0 H SER A 14 1.515 -1.036 14.338 1.00 12.15 H new ATOM 0 HA SER A 14 3.361 0.417 16.146 1.00 10.14 H new ATOM 0 HB2 SER A 14 2.725 0.869 13.189 1.00 44.10 H new ATOM 0 HB3 SER A 14 3.619 2.013 14.169 1.00 44.10 H new ATOM 0 HG SER A 14 5.018 0.585 12.991 1.00 13.42 H new ATOM 235 N SER A 15 1.839 2.436 16.444 1.00 74.32 N ATOM 236 CA SER A 15 0.863 3.473 16.810 1.00 44.31 C ATOM 237 C SER A 15 1.199 4.797 16.116 1.00 22.53 C ATOM 238 O SER A 15 2.339 5.263 16.173 1.00 13.33 O ATOM 239 CB SER A 15 0.841 3.680 18.332 1.00 14.55 C ATOM 240 OG SER A 15 2.117 4.068 18.820 1.00 23.02 O ATOM 0 H SER A 15 2.768 2.579 16.840 1.00 74.32 H new ATOM 0 HA SER A 15 -0.122 3.140 16.482 1.00 44.31 H new ATOM 0 HB2 SER A 15 0.105 4.443 18.587 1.00 14.55 H new ATOM 0 HB3 SER A 15 0.527 2.758 18.822 1.00 14.55 H new ATOM 0 HG SER A 15 2.630 4.487 18.098 1.00 23.02 H new ATOM 246 N ASP A 16 0.212 5.408 15.466 1.00 24.43 N ATOM 247 CA ASP A 16 0.436 6.656 14.724 1.00 43.24 C ATOM 248 C ASP A 16 -0.710 7.661 14.964 1.00 2.33 C ATOM 249 O ASP A 16 -1.664 7.367 15.694 1.00 74.11 O ATOM 250 CB ASP A 16 0.585 6.342 13.226 1.00 33.53 C ATOM 251 CG ASP A 16 1.492 7.327 12.511 1.00 60.21 C ATOM 252 OD1 ASP A 16 1.043 8.446 12.215 1.00 13.41 O ATOM 253 OD2 ASP A 16 2.669 6.983 12.257 1.00 33.44 O ATOM 0 H ASP A 16 -0.748 5.065 15.435 1.00 24.43 H new ATOM 0 HA ASP A 16 1.354 7.119 15.085 1.00 43.24 H new ATOM 0 HB2 ASP A 16 0.984 5.334 13.108 1.00 33.53 H new ATOM 0 HB3 ASP A 16 -0.399 6.353 12.757 1.00 33.53 H new ATOM 258 N SER A 17 -0.610 8.846 14.356 1.00 51.23 N ATOM 259 CA SER A 17 -1.615 9.908 14.535 1.00 52.54 C ATOM 260 C SER A 17 -2.052 10.532 13.193 1.00 21.33 C ATOM 261 O SER A 17 -2.819 11.502 13.172 1.00 3.31 O ATOM 262 CB SER A 17 -1.059 11.003 15.461 1.00 4.42 C ATOM 263 OG SER A 17 -2.038 11.992 15.752 1.00 2.53 O ATOM 0 H SER A 17 0.157 9.099 13.733 1.00 51.23 H new ATOM 0 HA SER A 17 -2.496 9.450 14.986 1.00 52.54 H new ATOM 0 HB2 SER A 17 -0.710 10.552 16.390 1.00 4.42 H new ATOM 0 HB3 SER A 17 -0.195 11.473 14.991 1.00 4.42 H new ATOM 0 HG SER A 17 -2.585 12.155 14.955 1.00 2.53 H new ATOM 269 N PHE A 18 -1.568 9.987 12.075 1.00 34.20 N ATOM 270 CA PHE A 18 -1.961 10.479 10.743 1.00 3.40 C ATOM 271 C PHE A 18 -3.356 9.962 10.328 1.00 24.23 C ATOM 272 O PHE A 18 -3.743 8.845 10.673 1.00 41.35 O ATOM 273 CB PHE A 18 -0.914 10.084 9.684 1.00 24.13 C ATOM 274 CG PHE A 18 0.406 10.804 9.830 1.00 54.31 C ATOM 275 CD1 PHE A 18 0.442 12.167 10.094 1.00 2.04 C ATOM 276 CD2 PHE A 18 1.609 10.122 9.703 1.00 52.21 C ATOM 277 CE1 PHE A 18 1.646 12.830 10.227 1.00 52.23 C ATOM 278 CE2 PHE A 18 2.815 10.782 9.836 1.00 73.05 C ATOM 279 CZ PHE A 18 2.834 12.137 10.099 1.00 12.13 C ATOM 0 H PHE A 18 -0.907 9.210 12.060 1.00 34.20 H new ATOM 0 HA PHE A 18 -2.012 11.566 10.804 1.00 3.40 H new ATOM 0 HB2 PHE A 18 -0.739 9.010 9.743 1.00 24.13 H new ATOM 0 HB3 PHE A 18 -1.320 10.287 8.693 1.00 24.13 H new ATOM 0 HD1 PHE A 18 -0.483 12.715 10.197 1.00 2.04 H new ATOM 0 HD2 PHE A 18 1.601 9.062 9.498 1.00 52.21 H new ATOM 0 HE1 PHE A 18 1.659 13.890 10.431 1.00 52.23 H new ATOM 0 HE2 PHE A 18 3.743 10.238 9.734 1.00 73.05 H new ATOM 0 HZ PHE A 18 3.776 12.654 10.205 1.00 12.13 H new ATOM 289 N PRO A 19 -4.133 10.779 9.579 1.00 13.21 N ATOM 290 CA PRO A 19 -5.491 10.414 9.141 1.00 64.40 C ATOM 291 C PRO A 19 -5.514 9.602 7.826 1.00 32.33 C ATOM 292 O PRO A 19 -4.963 10.022 6.807 1.00 1.32 O ATOM 293 CB PRO A 19 -6.139 11.787 8.943 1.00 15.41 C ATOM 294 CG PRO A 19 -5.023 12.665 8.474 1.00 62.14 C ATOM 295 CD PRO A 19 -3.755 12.126 9.103 1.00 54.01 C ATOM 0 HA PRO A 19 -5.998 9.766 9.856 1.00 64.40 H new ATOM 0 HB2 PRO A 19 -6.944 11.744 8.210 1.00 15.41 H new ATOM 0 HB3 PRO A 19 -6.573 12.159 9.871 1.00 15.41 H new ATOM 0 HG2 PRO A 19 -4.951 12.653 7.386 1.00 62.14 H new ATOM 0 HG3 PRO A 19 -5.193 13.700 8.771 1.00 62.14 H new ATOM 0 HD2 PRO A 19 -2.940 12.079 8.380 1.00 54.01 H new ATOM 0 HD3 PRO A 19 -3.417 12.759 9.924 1.00 54.01 H new ATOM 303 N MET A 20 -6.172 8.443 7.854 1.00 31.32 N ATOM 304 CA MET A 20 -6.260 7.560 6.679 1.00 14.41 C ATOM 305 C MET A 20 -7.493 7.903 5.815 1.00 50.54 C ATOM 306 O MET A 20 -8.622 7.929 6.311 1.00 12.11 O ATOM 307 CB MET A 20 -6.333 6.098 7.141 1.00 70.11 C ATOM 308 CG MET A 20 -5.203 5.696 8.086 1.00 42.24 C ATOM 309 SD MET A 20 -3.577 5.747 7.304 1.00 74.31 S ATOM 310 CE MET A 20 -3.695 4.358 6.179 1.00 15.00 C ATOM 0 H MET A 20 -6.656 8.088 8.679 1.00 31.32 H new ATOM 0 HA MET A 20 -5.370 7.708 6.068 1.00 14.41 H new ATOM 0 HB2 MET A 20 -7.288 5.931 7.639 1.00 70.11 H new ATOM 0 HB3 MET A 20 -6.312 5.448 6.266 1.00 70.11 H new ATOM 0 HG2 MET A 20 -5.206 6.361 8.950 1.00 42.24 H new ATOM 0 HG3 MET A 20 -5.389 4.689 8.458 1.00 42.24 H new ATOM 0 HE1 MET A 20 -2.821 3.718 6.298 1.00 15.00 H new ATOM 0 HE2 MET A 20 -4.596 3.786 6.400 1.00 15.00 H new ATOM 0 HE3 MET A 20 -3.740 4.723 5.153 1.00 15.00 H new ATOM 320 N LYS A 21 -7.271 8.178 4.528 1.00 11.03 N ATOM 321 CA LYS A 21 -8.363 8.513 3.592 1.00 24.43 C ATOM 322 C LYS A 21 -8.705 7.326 2.673 1.00 23.03 C ATOM 323 O LYS A 21 -7.917 6.958 1.810 1.00 0.41 O ATOM 324 CB LYS A 21 -7.955 9.718 2.736 1.00 2.52 C ATOM 325 CG LYS A 21 -7.664 10.982 3.536 1.00 41.34 C ATOM 326 CD LYS A 21 -7.045 12.075 2.662 1.00 4.43 C ATOM 327 CE LYS A 21 -6.973 13.408 3.397 1.00 73.52 C ATOM 328 NZ LYS A 21 -8.319 13.873 3.822 1.00 21.54 N ATOM 0 H LYS A 21 -6.344 8.177 4.103 1.00 11.03 H new ATOM 0 HA LYS A 21 -9.248 8.753 4.181 1.00 24.43 H new ATOM 0 HB2 LYS A 21 -7.069 9.455 2.158 1.00 2.52 H new ATOM 0 HB3 LYS A 21 -8.751 9.929 2.022 1.00 2.52 H new ATOM 0 HG2 LYS A 21 -8.588 11.352 3.981 1.00 41.34 H new ATOM 0 HG3 LYS A 21 -6.987 10.745 4.357 1.00 41.34 H new ATOM 0 HD2 LYS A 21 -6.043 11.773 2.356 1.00 4.43 H new ATOM 0 HD3 LYS A 21 -7.634 12.192 1.753 1.00 4.43 H new ATOM 0 HE2 LYS A 21 -6.330 13.308 4.271 1.00 73.52 H new ATOM 0 HE3 LYS A 21 -6.517 14.157 2.750 1.00 73.52 H new ATOM 0 HZ1 LYS A 21 -8.300 14.902 3.971 1.00 21.54 H new ATOM 0 HZ2 LYS A 21 -9.015 13.643 3.084 1.00 21.54 H new ATOM 0 HZ3 LYS A 21 -8.586 13.400 4.709 1.00 21.54 H new ATOM 342 N LEU A 22 -9.891 6.743 2.835 1.00 4.21 N ATOM 343 CA LEU A 22 -10.268 5.548 2.063 1.00 52.32 C ATOM 344 C LEU A 22 -10.842 5.907 0.681 1.00 54.04 C ATOM 345 O LEU A 22 -11.970 6.388 0.567 1.00 63.33 O ATOM 346 CB LEU A 22 -11.280 4.703 2.848 1.00 12.24 C ATOM 347 CG LEU A 22 -11.635 3.343 2.218 1.00 43.12 C ATOM 348 CD1 LEU A 22 -10.382 2.495 2.003 1.00 21.44 C ATOM 349 CD2 LEU A 22 -12.645 2.595 3.085 1.00 40.51 C ATOM 0 H LEU A 22 -10.605 7.070 3.486 1.00 4.21 H new ATOM 0 HA LEU A 22 -9.359 4.969 1.901 1.00 52.32 H new ATOM 0 HB2 LEU A 22 -10.884 4.529 3.848 1.00 12.24 H new ATOM 0 HB3 LEU A 22 -12.197 5.281 2.965 1.00 12.24 H new ATOM 0 HG LEU A 22 -12.088 3.531 1.245 1.00 43.12 H new ATOM 0 HD11 LEU A 22 -10.661 1.540 1.557 1.00 21.44 H new ATOM 0 HD12 LEU A 22 -9.697 3.020 1.337 1.00 21.44 H new ATOM 0 HD13 LEU A 22 -9.893 2.319 2.961 1.00 21.44 H new ATOM 0 HD21 LEU A 22 -12.883 1.637 2.623 1.00 40.51 H new ATOM 0 HD22 LEU A 22 -12.220 2.425 4.074 1.00 40.51 H new ATOM 0 HD23 LEU A 22 -13.555 3.188 3.178 1.00 40.51 H new ATOM 361 N VAL A 23 -10.054 5.670 -0.363 1.00 34.22 N ATOM 362 CA VAL A 23 -10.499 5.898 -1.740 1.00 62.32 C ATOM 363 C VAL A 23 -10.976 4.585 -2.395 1.00 21.31 C ATOM 364 O VAL A 23 -10.390 3.514 -2.182 1.00 11.14 O ATOM 365 CB VAL A 23 -9.374 6.548 -2.592 1.00 62.01 C ATOM 366 CG1 VAL A 23 -8.144 5.646 -2.671 1.00 74.15 C ATOM 367 CG2 VAL A 23 -9.882 6.901 -3.988 1.00 73.24 C ATOM 0 H VAL A 23 -9.100 5.319 -0.284 1.00 34.22 H new ATOM 0 HA VAL A 23 -11.342 6.588 -1.701 1.00 62.32 H new ATOM 0 HB VAL A 23 -9.075 7.472 -2.096 1.00 62.01 H new ATOM 0 HG11 VAL A 23 -7.376 6.130 -3.274 1.00 74.15 H new ATOM 0 HG12 VAL A 23 -7.758 5.468 -1.667 1.00 74.15 H new ATOM 0 HG13 VAL A 23 -8.419 4.695 -3.128 1.00 74.15 H new ATOM 0 HG21 VAL A 23 -9.076 7.355 -4.565 1.00 73.24 H new ATOM 0 HG22 VAL A 23 -10.223 5.996 -4.491 1.00 73.24 H new ATOM 0 HG23 VAL A 23 -10.710 7.605 -3.907 1.00 73.24 H new ATOM 377 N ASP A 24 -12.074 4.672 -3.156 1.00 40.45 N ATOM 378 CA ASP A 24 -12.665 3.509 -3.843 1.00 41.40 C ATOM 379 C ASP A 24 -13.056 2.381 -2.867 1.00 75.34 C ATOM 380 O ASP A 24 -13.307 1.249 -3.290 1.00 33.03 O ATOM 381 CB ASP A 24 -11.707 2.975 -4.921 1.00 32.40 C ATOM 382 CG ASP A 24 -11.768 3.788 -6.202 1.00 73.41 C ATOM 383 OD1 ASP A 24 -11.024 4.778 -6.331 1.00 45.01 O ATOM 384 OD2 ASP A 24 -12.573 3.434 -7.089 1.00 4.15 O ATOM 0 H ASP A 24 -12.578 5.544 -3.315 1.00 40.45 H new ATOM 0 HA ASP A 24 -13.583 3.855 -4.317 1.00 41.40 H new ATOM 0 HB2 ASP A 24 -10.688 2.986 -4.535 1.00 32.40 H new ATOM 0 HB3 ASP A 24 -11.954 1.936 -5.141 1.00 32.40 H new ATOM 389 N ASP A 25 -13.121 2.705 -1.573 1.00 13.01 N ATOM 390 CA ASP A 25 -13.452 1.728 -0.520 1.00 54.32 C ATOM 391 C ASP A 25 -12.448 0.561 -0.468 1.00 61.40 C ATOM 392 O ASP A 25 -12.674 -0.434 0.224 1.00 11.04 O ATOM 393 CB ASP A 25 -14.874 1.184 -0.713 1.00 51.31 C ATOM 394 CG ASP A 25 -15.915 2.287 -0.734 1.00 3.53 C ATOM 395 OD1 ASP A 25 -16.114 2.937 0.312 1.00 15.44 O ATOM 396 OD2 ASP A 25 -16.528 2.516 -1.797 1.00 51.12 O ATOM 0 H ASP A 25 -12.947 3.647 -1.222 1.00 13.01 H new ATOM 0 HA ASP A 25 -13.393 2.258 0.431 1.00 54.32 H new ATOM 0 HB2 ASP A 25 -14.923 0.624 -1.647 1.00 51.31 H new ATOM 0 HB3 ASP A 25 -15.105 0.485 0.091 1.00 51.31 H new ATOM 401 N LEU A 26 -11.327 0.692 -1.175 1.00 43.25 N ATOM 402 CA LEU A 26 -10.355 -0.404 -1.285 1.00 11.32 C ATOM 403 C LEU A 26 -9.004 -0.045 -0.643 1.00 25.51 C ATOM 404 O LEU A 26 -8.433 -0.840 0.102 1.00 43.44 O ATOM 405 CB LEU A 26 -10.157 -0.772 -2.763 1.00 10.01 C ATOM 406 CG LEU A 26 -9.344 -2.054 -3.024 1.00 75.32 C ATOM 407 CD1 LEU A 26 -10.054 -3.281 -2.446 1.00 42.43 C ATOM 408 CD2 LEU A 26 -9.088 -2.234 -4.520 1.00 73.22 C ATOM 0 H LEU A 26 -11.066 1.540 -1.679 1.00 43.25 H new ATOM 0 HA LEU A 26 -10.755 -1.260 -0.741 1.00 11.32 H new ATOM 0 HB2 LEU A 26 -11.137 -0.884 -3.226 1.00 10.01 H new ATOM 0 HB3 LEU A 26 -9.661 0.060 -3.263 1.00 10.01 H new ATOM 0 HG LEU A 26 -8.383 -1.953 -2.520 1.00 75.32 H new ATOM 0 HD11 LEU A 26 -9.459 -4.173 -2.644 1.00 42.43 H new ATOM 0 HD12 LEU A 26 -10.176 -3.158 -1.370 1.00 42.43 H new ATOM 0 HD13 LEU A 26 -11.034 -3.388 -2.912 1.00 42.43 H new ATOM 0 HD21 LEU A 26 -8.512 -3.145 -4.684 1.00 73.22 H new ATOM 0 HD22 LEU A 26 -10.040 -2.307 -5.046 1.00 73.22 H new ATOM 0 HD23 LEU A 26 -8.529 -1.379 -4.899 1.00 73.22 H new ATOM 420 N VAL A 27 -8.499 1.156 -0.921 1.00 1.42 N ATOM 421 CA VAL A 27 -7.182 1.574 -0.416 1.00 0.00 C ATOM 422 C VAL A 27 -7.228 2.945 0.278 1.00 3.34 C ATOM 423 O VAL A 27 -7.979 3.834 -0.118 1.00 64.35 O ATOM 424 CB VAL A 27 -6.115 1.608 -1.550 1.00 43.44 C ATOM 425 CG1 VAL A 27 -5.652 0.199 -1.907 1.00 34.34 C ATOM 426 CG2 VAL A 27 -6.647 2.322 -2.793 1.00 72.30 C ATOM 0 H VAL A 27 -8.975 1.857 -1.489 1.00 1.42 H new ATOM 0 HA VAL A 27 -6.896 0.825 0.322 1.00 0.00 H new ATOM 0 HB VAL A 27 -5.259 2.169 -1.176 1.00 43.44 H new ATOM 0 HG11 VAL A 27 -4.907 0.251 -2.701 1.00 34.34 H new ATOM 0 HG12 VAL A 27 -5.213 -0.273 -1.028 1.00 34.34 H new ATOM 0 HG13 VAL A 27 -6.505 -0.389 -2.247 1.00 34.34 H new ATOM 0 HG21 VAL A 27 -5.878 2.329 -3.566 1.00 72.30 H new ATOM 0 HG22 VAL A 27 -7.529 1.800 -3.163 1.00 72.30 H new ATOM 0 HG23 VAL A 27 -6.913 3.348 -2.537 1.00 72.30 H new ATOM 436 N TYR A 28 -6.436 3.091 1.339 1.00 21.12 N ATOM 437 CA TYR A 28 -6.292 4.370 2.044 1.00 44.04 C ATOM 438 C TYR A 28 -5.115 5.179 1.476 1.00 34.53 C ATOM 439 O TYR A 28 -4.082 4.611 1.140 1.00 22.23 O ATOM 440 CB TYR A 28 -6.046 4.136 3.541 1.00 12.53 C ATOM 441 CG TYR A 28 -7.199 3.489 4.284 1.00 31.43 C ATOM 442 CD1 TYR A 28 -8.251 4.256 4.775 1.00 35.41 C ATOM 443 CD2 TYR A 28 -7.229 2.117 4.512 1.00 74.45 C ATOM 444 CE1 TYR A 28 -9.296 3.677 5.466 1.00 35.12 C ATOM 445 CE2 TYR A 28 -8.274 1.532 5.200 1.00 13.33 C ATOM 446 CZ TYR A 28 -9.305 2.317 5.676 1.00 31.45 C ATOM 447 OH TYR A 28 -10.346 1.739 6.368 1.00 73.25 O ATOM 0 H TYR A 28 -5.878 2.334 1.734 1.00 21.12 H new ATOM 0 HA TYR A 28 -7.218 4.927 1.904 1.00 44.04 H new ATOM 0 HB2 TYR A 28 -5.162 3.509 3.655 1.00 12.53 H new ATOM 0 HB3 TYR A 28 -5.821 5.093 4.011 1.00 12.53 H new ATOM 0 HD1 TYR A 28 -8.250 5.324 4.612 1.00 35.41 H new ATOM 0 HD2 TYR A 28 -6.422 1.500 4.145 1.00 74.45 H new ATOM 0 HE1 TYR A 28 -10.103 4.289 5.840 1.00 35.12 H new ATOM 0 HE2 TYR A 28 -8.285 0.465 5.365 1.00 13.33 H new ATOM 0 HH TYR A 28 -10.082 1.602 7.302 1.00 73.25 H new ATOM 457 N GLU A 29 -5.278 6.498 1.385 1.00 31.04 N ATOM 458 CA GLU A 29 -4.195 7.398 0.962 1.00 1.42 C ATOM 459 C GLU A 29 -4.034 8.548 1.971 1.00 32.33 C ATOM 460 O GLU A 29 -5.011 8.973 2.593 1.00 31.24 O ATOM 461 CB GLU A 29 -4.474 7.986 -0.435 1.00 15.20 C ATOM 462 CG GLU A 29 -5.630 8.985 -0.459 1.00 1.20 C ATOM 463 CD GLU A 29 -5.808 9.695 -1.796 1.00 23.14 C ATOM 464 OE1 GLU A 29 -4.842 9.763 -2.592 1.00 64.12 O ATOM 465 OE2 GLU A 29 -6.916 10.215 -2.043 1.00 71.41 O ATOM 0 H GLU A 29 -6.154 6.974 1.599 1.00 31.04 H new ATOM 0 HA GLU A 29 -3.276 6.814 0.920 1.00 1.42 H new ATOM 0 HB2 GLU A 29 -3.572 8.478 -0.800 1.00 15.20 H new ATOM 0 HB3 GLU A 29 -4.694 7.172 -1.125 1.00 15.20 H new ATOM 0 HG2 GLU A 29 -6.554 8.462 -0.211 1.00 1.20 H new ATOM 0 HG3 GLU A 29 -5.468 9.732 0.318 1.00 1.20 H new ATOM 472 N PHE A 30 -2.806 9.031 2.167 1.00 1.11 N ATOM 473 CA PHE A 30 -2.592 10.233 2.991 1.00 51.51 C ATOM 474 C PHE A 30 -1.337 11.028 2.605 1.00 30.21 C ATOM 475 O PHE A 30 -0.314 10.467 2.215 1.00 62.45 O ATOM 476 CB PHE A 30 -2.577 9.883 4.481 1.00 31.43 C ATOM 477 CG PHE A 30 -1.560 8.857 4.908 1.00 33.22 C ATOM 478 CD1 PHE A 30 -1.847 7.502 4.817 1.00 65.23 C ATOM 479 CD2 PHE A 30 -0.338 9.244 5.439 1.00 23.14 C ATOM 480 CE1 PHE A 30 -0.938 6.556 5.246 1.00 10.44 C ATOM 481 CE2 PHE A 30 0.576 8.299 5.865 1.00 30.24 C ATOM 482 CZ PHE A 30 0.274 6.955 5.772 1.00 22.11 C ATOM 0 H PHE A 30 -1.957 8.622 1.777 1.00 1.11 H new ATOM 0 HA PHE A 30 -3.440 10.888 2.789 1.00 51.51 H new ATOM 0 HB2 PHE A 30 -2.401 10.798 5.047 1.00 31.43 H new ATOM 0 HB3 PHE A 30 -3.567 9.522 4.759 1.00 31.43 H new ATOM 0 HD1 PHE A 30 -2.793 7.184 4.405 1.00 65.23 H new ATOM 0 HD2 PHE A 30 -0.099 10.294 5.520 1.00 23.14 H new ATOM 0 HE1 PHE A 30 -1.175 5.505 5.170 1.00 10.44 H new ATOM 0 HE2 PHE A 30 1.527 8.612 6.271 1.00 30.24 H new ATOM 0 HZ PHE A 30 0.986 6.216 6.111 1.00 22.11 H new ATOM 492 N LYS A 31 -1.435 12.349 2.739 1.00 30.52 N ATOM 493 CA LYS A 31 -0.354 13.268 2.366 1.00 73.11 C ATOM 494 C LYS A 31 0.529 13.623 3.577 1.00 70.43 C ATOM 495 O LYS A 31 0.026 13.994 4.638 1.00 64.25 O ATOM 496 CB LYS A 31 -0.968 14.540 1.763 1.00 5.41 C ATOM 497 CG LYS A 31 0.047 15.604 1.352 1.00 62.43 C ATOM 498 CD LYS A 31 -0.642 16.831 0.759 1.00 55.13 C ATOM 499 CE LYS A 31 -1.591 17.492 1.757 1.00 21.11 C ATOM 500 NZ LYS A 31 -2.350 18.615 1.144 1.00 14.10 N ATOM 0 H LYS A 31 -2.264 12.815 3.108 1.00 30.52 H new ATOM 0 HA LYS A 31 0.285 12.778 1.631 1.00 73.11 H new ATOM 0 HB2 LYS A 31 -1.558 14.263 0.889 1.00 5.41 H new ATOM 0 HB3 LYS A 31 -1.656 14.974 2.488 1.00 5.41 H new ATOM 0 HG2 LYS A 31 0.638 15.900 2.219 1.00 62.43 H new ATOM 0 HG3 LYS A 31 0.740 15.185 0.622 1.00 62.43 H new ATOM 0 HD2 LYS A 31 0.111 17.552 0.443 1.00 55.13 H new ATOM 0 HD3 LYS A 31 -1.198 16.539 -0.132 1.00 55.13 H new ATOM 0 HE2 LYS A 31 -2.290 16.748 2.140 1.00 21.11 H new ATOM 0 HE3 LYS A 31 -1.021 17.862 2.609 1.00 21.11 H new ATOM 0 HZ1 LYS A 31 -2.982 19.036 1.855 1.00 14.10 H new ATOM 0 HZ2 LYS A 31 -1.685 19.337 0.801 1.00 14.10 H new ATOM 0 HZ3 LYS A 31 -2.915 18.258 0.347 1.00 14.10 H new ATOM 514 N GLY A 32 1.847 13.504 3.407 1.00 54.32 N ATOM 515 CA GLY A 32 2.784 13.802 4.491 1.00 75.25 C ATOM 516 C GLY A 32 3.365 15.219 4.456 1.00 35.22 C ATOM 517 O GLY A 32 2.642 16.197 4.268 1.00 25.24 O ATOM 0 H GLY A 32 2.287 13.206 2.536 1.00 54.32 H new ATOM 0 HA2 GLY A 32 2.276 13.654 5.444 1.00 75.25 H new ATOM 0 HA3 GLY A 32 3.604 13.085 4.453 1.00 75.25 H new ATOM 521 N LYS A 33 4.685 15.323 4.640 1.00 62.32 N ATOM 522 CA LYS A 33 5.363 16.622 4.752 1.00 23.12 C ATOM 523 C LYS A 33 6.690 16.626 3.976 1.00 22.40 C ATOM 524 O LYS A 33 7.556 15.777 4.207 1.00 0.42 O ATOM 525 CB LYS A 33 5.591 16.937 6.241 1.00 14.44 C ATOM 526 CG LYS A 33 6.374 18.220 6.527 1.00 13.14 C ATOM 527 CD LYS A 33 6.291 18.590 8.009 1.00 4.33 C ATOM 528 CE LYS A 33 7.185 19.774 8.377 1.00 11.24 C ATOM 529 NZ LYS A 33 8.625 19.404 8.416 1.00 20.14 N ATOM 0 H LYS A 33 5.309 14.520 4.715 1.00 62.32 H new ATOM 0 HA LYS A 33 4.734 17.395 4.310 1.00 23.12 H new ATOM 0 HB2 LYS A 33 4.621 17.006 6.733 1.00 14.44 H new ATOM 0 HB3 LYS A 33 6.120 16.099 6.695 1.00 14.44 H new ATOM 0 HG2 LYS A 33 7.417 18.086 6.239 1.00 13.14 H new ATOM 0 HG3 LYS A 33 5.978 19.035 5.922 1.00 13.14 H new ATOM 0 HD2 LYS A 33 5.258 18.829 8.261 1.00 4.33 H new ATOM 0 HD3 LYS A 33 6.574 17.726 8.610 1.00 4.33 H new ATOM 0 HE2 LYS A 33 7.038 20.576 7.654 1.00 11.24 H new ATOM 0 HE3 LYS A 33 6.886 20.164 9.350 1.00 11.24 H new ATOM 0 HZ1 LYS A 33 9.086 19.888 9.212 1.00 20.14 H new ATOM 0 HZ2 LYS A 33 8.716 18.375 8.537 1.00 20.14 H new ATOM 0 HZ3 LYS A 33 9.081 19.690 7.526 1.00 20.14 H new ATOM 543 N HIS A 34 6.832 17.577 3.048 1.00 61.43 N ATOM 544 CA HIS A 34 8.036 17.685 2.209 1.00 11.32 C ATOM 545 C HIS A 34 9.278 18.054 3.036 1.00 52.35 C ATOM 546 O HIS A 34 9.428 19.194 3.479 1.00 3.34 O ATOM 547 CB HIS A 34 7.813 18.727 1.101 1.00 24.30 C ATOM 548 CG HIS A 34 9.024 18.986 0.245 1.00 64.44 C ATOM 549 ND1 HIS A 34 9.813 20.110 0.379 1.00 13.30 N ATOM 550 CD2 HIS A 34 9.579 18.264 -0.762 1.00 14.41 C ATOM 551 CE1 HIS A 34 10.794 20.071 -0.500 1.00 53.01 C ATOM 552 NE2 HIS A 34 10.678 18.964 -1.205 1.00 74.10 N ATOM 0 H HIS A 34 6.126 18.288 2.856 1.00 61.43 H new ATOM 0 HA HIS A 34 8.216 16.708 1.761 1.00 11.32 H new ATOM 0 HB2 HIS A 34 6.995 18.393 0.462 1.00 24.30 H new ATOM 0 HB3 HIS A 34 7.498 19.665 1.558 1.00 24.30 H new ATOM 0 HD2 HIS A 34 9.225 17.318 -1.144 1.00 14.41 H new ATOM 0 HE1 HIS A 34 11.563 20.820 -0.622 1.00 53.01 H new ATOM 0 HE2 HIS A 34 11.302 18.673 -1.958 1.00 74.10 H new ATOM 561 N VAL A 35 10.166 17.081 3.232 1.00 52.35 N ATOM 562 CA VAL A 35 11.403 17.286 4.001 1.00 4.44 C ATOM 563 C VAL A 35 12.603 16.584 3.337 1.00 14.41 C ATOM 564 O VAL A 35 12.438 15.780 2.416 1.00 50.22 O ATOM 565 CB VAL A 35 11.253 16.766 5.457 1.00 61.55 C ATOM 566 CG1 VAL A 35 10.162 17.529 6.204 1.00 34.11 C ATOM 567 CG2 VAL A 35 10.961 15.270 5.468 1.00 13.10 C ATOM 0 H VAL A 35 10.055 16.135 2.868 1.00 52.35 H new ATOM 0 HA VAL A 35 11.586 18.360 4.020 1.00 4.44 H new ATOM 0 HB VAL A 35 12.198 16.938 5.972 1.00 61.55 H new ATOM 0 HG11 VAL A 35 10.079 17.144 7.220 1.00 34.11 H new ATOM 0 HG12 VAL A 35 10.416 18.588 6.237 1.00 34.11 H new ATOM 0 HG13 VAL A 35 9.210 17.400 5.689 1.00 34.11 H new ATOM 0 HG21 VAL A 35 10.860 14.927 6.498 1.00 13.10 H new ATOM 0 HG22 VAL A 35 10.034 15.076 4.928 1.00 13.10 H new ATOM 0 HG23 VAL A 35 11.780 14.736 4.986 1.00 13.10 H new ATOM 577 N VAL A 36 13.811 16.900 3.806 1.00 22.42 N ATOM 578 CA VAL A 36 15.041 16.268 3.305 1.00 45.33 C ATOM 579 C VAL A 36 15.941 15.823 4.466 1.00 70.50 C ATOM 580 O VAL A 36 15.999 16.485 5.504 1.00 42.12 O ATOM 581 CB VAL A 36 15.848 17.219 2.379 1.00 43.35 C ATOM 582 CG1 VAL A 36 15.041 17.590 1.136 1.00 21.01 C ATOM 583 CG2 VAL A 36 16.293 18.474 3.134 1.00 72.22 C ATOM 0 H VAL A 36 13.968 17.594 4.537 1.00 22.42 H new ATOM 0 HA VAL A 36 14.729 15.399 2.726 1.00 45.33 H new ATOM 0 HB VAL A 36 16.742 16.687 2.053 1.00 43.35 H new ATOM 0 HG11 VAL A 36 15.630 18.256 0.505 1.00 21.01 H new ATOM 0 HG12 VAL A 36 14.795 16.686 0.579 1.00 21.01 H new ATOM 0 HG13 VAL A 36 14.121 18.093 1.436 1.00 21.01 H new ATOM 0 HG21 VAL A 36 16.856 19.122 2.462 1.00 72.22 H new ATOM 0 HG22 VAL A 36 15.416 19.007 3.503 1.00 72.22 H new ATOM 0 HG23 VAL A 36 16.924 18.188 3.975 1.00 72.22 H new ATOM 593 N ARG A 37 16.634 14.699 4.295 1.00 73.01 N ATOM 594 CA ARG A 37 17.540 14.185 5.330 1.00 21.22 C ATOM 595 C ARG A 37 18.870 13.680 4.734 1.00 41.11 C ATOM 596 O ARG A 37 18.928 12.656 4.043 1.00 51.44 O ATOM 597 CB ARG A 37 16.822 13.072 6.120 1.00 11.01 C ATOM 598 CG ARG A 37 17.702 12.255 7.069 1.00 33.14 C ATOM 599 CD ARG A 37 18.409 13.111 8.117 1.00 52.52 C ATOM 600 NE ARG A 37 18.994 12.291 9.177 1.00 50.51 N ATOM 601 CZ ARG A 37 20.008 11.480 9.021 1.00 71.42 C ATOM 602 NH1 ARG A 37 20.604 11.357 7.877 1.00 30.13 N ATOM 603 NH2 ARG A 37 20.424 10.781 10.026 1.00 34.15 N ATOM 0 H ARG A 37 16.588 14.125 3.453 1.00 73.01 H new ATOM 0 HA ARG A 37 17.797 15.001 6.006 1.00 21.22 H new ATOM 0 HB2 ARG A 37 16.018 13.525 6.700 1.00 11.01 H new ATOM 0 HB3 ARG A 37 16.357 12.390 5.409 1.00 11.01 H new ATOM 0 HG2 ARG A 37 17.087 11.509 7.573 1.00 33.14 H new ATOM 0 HG3 ARG A 37 18.448 11.714 6.487 1.00 33.14 H new ATOM 0 HD2 ARG A 37 19.191 13.700 7.639 1.00 52.52 H new ATOM 0 HD3 ARG A 37 17.699 13.816 8.551 1.00 52.52 H new ATOM 0 HE ARG A 37 18.580 12.356 10.107 1.00 50.51 H new ATOM 0 HH11 ARG A 37 20.284 11.899 7.074 1.00 30.13 H new ATOM 0 HH12 ARG A 37 21.393 10.718 7.779 1.00 30.13 H new ATOM 0 HH21 ARG A 37 19.962 10.865 10.932 1.00 34.15 H new ATOM 0 HH22 ARG A 37 21.214 10.146 9.913 1.00 34.15 H new ATOM 972 N GLU A 65 17.925 10.677 1.921 1.00 52.44 N ATOM 973 CA GLU A 65 16.676 10.448 2.645 1.00 72.45 C ATOM 974 C GLU A 65 15.747 11.666 2.494 1.00 24.12 C ATOM 975 O GLU A 65 15.440 12.367 3.457 1.00 35.33 O ATOM 976 CB GLU A 65 16.989 10.144 4.120 1.00 41.42 C ATOM 977 CG GLU A 65 17.935 8.956 4.297 1.00 54.50 C ATOM 978 CD GLU A 65 18.452 8.793 5.721 1.00 41.41 C ATOM 979 OE1 GLU A 65 19.370 9.547 6.113 1.00 25.43 O ATOM 980 OE2 GLU A 65 17.978 7.886 6.439 1.00 71.35 O ATOM 0 HA GLU A 65 16.155 9.587 2.226 1.00 72.45 H new ATOM 0 HB2 GLU A 65 17.433 11.027 4.581 1.00 41.42 H new ATOM 0 HB3 GLU A 65 16.058 9.942 4.649 1.00 41.42 H new ATOM 0 HG2 GLU A 65 17.418 8.043 4.001 1.00 54.50 H new ATOM 0 HG3 GLU A 65 18.783 9.075 3.623 1.00 54.50 H new ATOM 987 N ARG A 66 15.326 11.928 1.256 1.00 22.21 N ATOM 988 CA ARG A 66 14.478 13.083 0.945 1.00 62.30 C ATOM 989 C ARG A 66 13.083 12.652 0.461 1.00 64.15 C ATOM 990 O ARG A 66 12.924 11.597 -0.155 1.00 1.03 O ATOM 991 CB ARG A 66 15.169 13.984 -0.105 1.00 30.32 C ATOM 992 CG ARG A 66 15.691 13.246 -1.346 1.00 3.25 C ATOM 993 CD ARG A 66 14.587 12.884 -2.339 1.00 54.13 C ATOM 994 NE ARG A 66 15.062 11.978 -3.380 1.00 12.23 N ATOM 995 CZ ARG A 66 14.833 10.691 -3.396 1.00 44.24 C ATOM 996 NH1 ARG A 66 14.154 10.131 -2.446 1.00 3.25 N ATOM 997 NH2 ARG A 66 15.287 9.962 -4.364 1.00 63.22 N ATOM 0 H ARG A 66 15.559 11.353 0.447 1.00 22.21 H new ATOM 0 HA ARG A 66 14.339 13.653 1.863 1.00 62.30 H new ATOM 0 HB2 ARG A 66 14.463 14.750 -0.426 1.00 30.32 H new ATOM 0 HB3 ARG A 66 16.003 14.499 0.372 1.00 30.32 H new ATOM 0 HG2 ARG A 66 16.431 13.870 -1.847 1.00 3.25 H new ATOM 0 HG3 ARG A 66 16.201 12.335 -1.032 1.00 3.25 H new ATOM 0 HD2 ARG A 66 13.758 12.420 -1.805 1.00 54.13 H new ATOM 0 HD3 ARG A 66 14.201 13.794 -2.799 1.00 54.13 H new ATOM 0 HE ARG A 66 15.608 12.375 -4.145 1.00 12.23 H new ATOM 0 HH11 ARG A 66 13.793 10.695 -1.677 1.00 3.25 H new ATOM 0 HH12 ARG A 66 13.980 9.126 -2.467 1.00 3.25 H new ATOM 0 HH21 ARG A 66 15.825 10.391 -5.117 1.00 63.22 H new ATOM 0 HH22 ARG A 66 15.107 8.958 -4.374 1.00 63.22 H new ATOM 1011 N GLY A 67 12.080 13.479 0.739 1.00 11.02 N ATOM 1012 CA GLY A 67 10.722 13.195 0.294 1.00 42.20 C ATOM 1013 C GLY A 67 9.670 13.578 1.327 1.00 12.12 C ATOM 1014 O GLY A 67 9.480 14.761 1.625 1.00 63.22 O ATOM 0 H GLY A 67 12.182 14.346 1.267 1.00 11.02 H new ATOM 0 HA2 GLY A 67 10.528 13.735 -0.633 1.00 42.20 H new ATOM 0 HA3 GLY A 67 10.633 12.132 0.069 1.00 42.20 H new ATOM 1018 N ILE A 68 8.981 12.578 1.872 1.00 43.20 N ATOM 1019 CA ILE A 68 7.925 12.811 2.863 1.00 2.33 C ATOM 1020 C ILE A 68 8.325 12.301 4.255 1.00 23.22 C ATOM 1021 O ILE A 68 8.837 11.189 4.400 1.00 22.13 O ATOM 1022 CB ILE A 68 6.589 12.150 2.432 1.00 1.34 C ATOM 1023 CG1 ILE A 68 6.803 10.660 2.118 1.00 42.14 C ATOM 1024 CG2 ILE A 68 5.992 12.882 1.229 1.00 4.12 C ATOM 1025 CD1 ILE A 68 5.555 9.943 1.653 1.00 21.12 C ATOM 0 H ILE A 68 9.133 11.595 1.645 1.00 43.20 H new ATOM 0 HA ILE A 68 7.784 13.890 2.918 1.00 2.33 H new ATOM 0 HB ILE A 68 5.882 12.225 3.258 1.00 1.34 H new ATOM 0 HG12 ILE A 68 7.570 10.568 1.349 1.00 42.14 H new ATOM 0 HG13 ILE A 68 7.184 10.163 3.010 1.00 42.14 H new ATOM 0 HG21 ILE A 68 5.055 12.405 0.941 1.00 4.12 H new ATOM 0 HG22 ILE A 68 5.803 13.922 1.493 1.00 4.12 H new ATOM 0 HG23 ILE A 68 6.692 12.841 0.394 1.00 4.12 H new ATOM 0 HD11 ILE A 68 5.789 8.898 1.452 1.00 21.12 H new ATOM 0 HD12 ILE A 68 4.792 10.001 2.429 1.00 21.12 H new ATOM 0 HD13 ILE A 68 5.183 10.413 0.742 1.00 21.12 H new ATOM 1037 N ASP A 69 8.076 13.126 5.268 1.00 5.11 N ATOM 1038 CA ASP A 69 8.376 12.789 6.670 1.00 54.33 C ATOM 1039 C ASP A 69 7.904 11.364 7.043 1.00 51.54 C ATOM 1040 O ASP A 69 8.576 10.656 7.794 1.00 21.35 O ATOM 1041 CB ASP A 69 7.714 13.830 7.583 1.00 35.24 C ATOM 1042 CG ASP A 69 8.113 13.684 9.041 1.00 72.21 C ATOM 1043 OD1 ASP A 69 9.133 14.276 9.446 1.00 53.03 O ATOM 1044 OD2 ASP A 69 7.399 12.986 9.791 1.00 4.13 O ATOM 0 H ASP A 69 7.660 14.050 5.147 1.00 5.11 H new ATOM 0 HA ASP A 69 9.458 12.805 6.803 1.00 54.33 H new ATOM 0 HB2 ASP A 69 7.981 14.829 7.238 1.00 35.24 H new ATOM 0 HB3 ASP A 69 6.631 13.742 7.498 1.00 35.24 H new ATOM 1049 N ILE A 70 6.761 10.951 6.487 1.00 23.21 N ATOM 1050 CA ILE A 70 6.171 9.626 6.753 1.00 33.31 C ATOM 1051 C ILE A 70 7.200 8.490 6.613 1.00 22.02 C ATOM 1052 O ILE A 70 7.532 7.802 7.583 1.00 75.32 O ATOM 1053 CB ILE A 70 5.009 9.334 5.769 1.00 3.44 C ATOM 1054 CG1 ILE A 70 3.988 10.484 5.760 1.00 53.42 C ATOM 1055 CG2 ILE A 70 4.328 8.010 6.120 1.00 42.20 C ATOM 1056 CD1 ILE A 70 2.948 10.362 4.663 1.00 5.33 C ATOM 0 H ILE A 70 6.216 11.521 5.840 1.00 23.21 H new ATOM 0 HA ILE A 70 5.809 9.658 7.781 1.00 33.31 H new ATOM 0 HB ILE A 70 5.429 9.252 4.767 1.00 3.44 H new ATOM 0 HG12 ILE A 70 3.483 10.519 6.726 1.00 53.42 H new ATOM 0 HG13 ILE A 70 4.518 11.429 5.643 1.00 53.42 H new ATOM 0 HG21 ILE A 70 3.515 7.822 5.419 1.00 42.20 H new ATOM 0 HG22 ILE A 70 5.055 7.200 6.059 1.00 42.20 H new ATOM 0 HG23 ILE A 70 3.928 8.064 7.133 1.00 42.20 H new ATOM 0 HD11 ILE A 70 2.261 11.207 4.717 1.00 5.33 H new ATOM 0 HD12 ILE A 70 3.443 10.358 3.692 1.00 5.33 H new ATOM 0 HD13 ILE A 70 2.392 9.433 4.791 1.00 5.33 H new ATOM 1068 N VAL A 71 7.700 8.305 5.393 1.00 35.41 N ATOM 1069 CA VAL A 71 8.611 7.201 5.081 1.00 72.34 C ATOM 1070 C VAL A 71 9.958 7.337 5.808 1.00 72.03 C ATOM 1071 O VAL A 71 10.540 6.345 6.248 1.00 62.21 O ATOM 1072 CB VAL A 71 8.854 7.087 3.555 1.00 72.10 C ATOM 1073 CG1 VAL A 71 7.541 6.821 2.819 1.00 2.01 C ATOM 1074 CG2 VAL A 71 9.539 8.340 3.006 1.00 42.24 C ATOM 0 H VAL A 71 7.489 8.909 4.598 1.00 35.41 H new ATOM 0 HA VAL A 71 8.124 6.292 5.434 1.00 72.34 H new ATOM 0 HB VAL A 71 9.522 6.242 3.385 1.00 72.10 H new ATOM 0 HG11 VAL A 71 7.733 6.744 1.749 1.00 2.01 H new ATOM 0 HG12 VAL A 71 7.105 5.888 3.177 1.00 2.01 H new ATOM 0 HG13 VAL A 71 6.847 7.641 3.005 1.00 2.01 H new ATOM 0 HG21 VAL A 71 9.695 8.229 1.933 1.00 42.24 H new ATOM 0 HG22 VAL A 71 8.910 9.210 3.193 1.00 42.24 H new ATOM 0 HG23 VAL A 71 10.501 8.475 3.501 1.00 42.24 H new ATOM 1084 N LEU A 72 10.439 8.570 5.942 1.00 21.24 N ATOM 1085 CA LEU A 72 11.726 8.834 6.598 1.00 34.44 C ATOM 1086 C LEU A 72 11.664 8.510 8.102 1.00 12.52 C ATOM 1087 O LEU A 72 12.616 7.977 8.679 1.00 64.34 O ATOM 1088 CB LEU A 72 12.125 10.303 6.385 1.00 14.31 C ATOM 1089 CG LEU A 72 12.067 10.789 4.924 1.00 1.33 C ATOM 1090 CD1 LEU A 72 12.496 12.247 4.816 1.00 4.25 C ATOM 1091 CD2 LEU A 72 12.919 9.905 4.018 1.00 55.15 C ATOM 0 H LEU A 72 9.960 9.406 5.606 1.00 21.24 H new ATOM 0 HA LEU A 72 12.479 8.186 6.149 1.00 34.44 H new ATOM 0 HB2 LEU A 72 11.470 10.933 6.988 1.00 14.31 H new ATOM 0 HB3 LEU A 72 13.138 10.446 6.760 1.00 14.31 H new ATOM 0 HG LEU A 72 11.032 10.716 4.590 1.00 1.33 H new ATOM 0 HD11 LEU A 72 12.446 12.565 3.775 1.00 4.25 H new ATOM 0 HD12 LEU A 72 11.831 12.867 5.417 1.00 4.25 H new ATOM 0 HD13 LEU A 72 13.518 12.353 5.179 1.00 4.25 H new ATOM 0 HD21 LEU A 72 12.860 10.271 2.993 1.00 55.15 H new ATOM 0 HD22 LEU A 72 13.956 9.932 4.354 1.00 55.15 H new ATOM 0 HD23 LEU A 72 12.551 8.880 4.059 1.00 55.15 H new ATOM 1103 N ASN A 73 10.527 8.825 8.723 1.00 74.34 N ATOM 1104 CA ASN A 73 10.311 8.559 10.151 1.00 45.33 C ATOM 1105 C ASN A 73 10.266 7.043 10.437 1.00 21.03 C ATOM 1106 O ASN A 73 10.892 6.562 11.382 1.00 52.24 O ATOM 1107 CB ASN A 73 9.007 9.238 10.611 1.00 5.40 C ATOM 1108 CG ASN A 73 8.776 9.162 12.116 1.00 50.41 C ATOM 1109 OD1 ASN A 73 9.175 8.213 12.782 1.00 23.45 O ATOM 1110 ND2 ASN A 73 8.126 10.167 12.668 1.00 15.43 N ATOM 0 H ASN A 73 9.734 9.268 8.258 1.00 74.34 H new ATOM 0 HA ASN A 73 11.148 8.973 10.712 1.00 45.33 H new ATOM 0 HB2 ASN A 73 9.026 10.285 10.307 1.00 5.40 H new ATOM 0 HB3 ASN A 73 8.165 8.773 10.099 1.00 5.40 H new ATOM 0 HD21 ASN A 73 7.944 10.167 13.672 1.00 15.43 H new ATOM 0 HD22 ASN A 73 7.805 10.945 12.091 1.00 15.43 H new ATOM 1117 N HIS A 74 9.536 6.293 9.608 1.00 15.30 N ATOM 1118 CA HIS A 74 9.382 4.843 9.813 1.00 1.31 C ATOM 1119 C HIS A 74 10.469 4.028 9.083 1.00 60.52 C ATOM 1120 O HIS A 74 10.404 2.801 9.039 1.00 1.22 O ATOM 1121 CB HIS A 74 7.986 4.392 9.357 1.00 50.35 C ATOM 1122 CG HIS A 74 6.865 4.995 10.154 1.00 50.32 C ATOM 1123 ND1 HIS A 74 6.492 4.533 11.398 1.00 14.30 N ATOM 1124 CD2 HIS A 74 6.029 6.026 9.877 1.00 73.54 C ATOM 1125 CE1 HIS A 74 5.482 5.249 11.848 1.00 72.32 C ATOM 1126 NE2 HIS A 74 5.180 6.161 10.950 1.00 64.14 N ATOM 0 H HIS A 74 9.044 6.658 8.793 1.00 15.30 H new ATOM 0 HA HIS A 74 9.499 4.652 10.880 1.00 1.31 H new ATOM 0 HB2 HIS A 74 7.855 4.653 8.307 1.00 50.35 H new ATOM 0 HB3 HIS A 74 7.925 3.306 9.425 1.00 50.35 H new ATOM 0 HD2 HIS A 74 6.030 6.629 8.981 1.00 73.54 H new ATOM 0 HE1 HIS A 74 4.985 5.110 12.797 1.00 72.32 H new ATOM 0 HE2 HIS A 74 4.437 6.855 11.036 1.00 64.14 H new ATOM 1135 N LYS A 75 11.467 4.722 8.523 1.00 75.34 N ATOM 1136 CA LYS A 75 12.591 4.082 7.814 1.00 11.24 C ATOM 1137 C LYS A 75 12.129 3.192 6.646 1.00 0.51 C ATOM 1138 O LYS A 75 12.241 1.962 6.688 1.00 33.04 O ATOM 1139 CB LYS A 75 13.473 3.276 8.783 1.00 30.22 C ATOM 1140 CG LYS A 75 14.271 4.145 9.747 1.00 64.41 C ATOM 1141 CD LYS A 75 15.220 3.317 10.606 1.00 73.51 C ATOM 1142 CE LYS A 75 16.158 4.203 11.418 1.00 14.20 C ATOM 1143 NZ LYS A 75 16.985 5.081 10.544 1.00 64.11 N ATOM 0 H LYS A 75 11.522 5.740 8.546 1.00 75.34 H new ATOM 0 HA LYS A 75 13.183 4.892 7.388 1.00 11.24 H new ATOM 0 HB2 LYS A 75 12.842 2.597 9.356 1.00 30.22 H new ATOM 0 HB3 LYS A 75 14.163 2.660 8.206 1.00 30.22 H new ATOM 0 HG2 LYS A 75 14.842 4.883 9.183 1.00 64.41 H new ATOM 0 HG3 LYS A 75 13.586 4.696 10.391 1.00 64.41 H new ATOM 0 HD2 LYS A 75 14.643 2.683 11.279 1.00 73.51 H new ATOM 0 HD3 LYS A 75 15.805 2.655 9.968 1.00 73.51 H new ATOM 0 HE2 LYS A 75 15.575 4.818 12.103 1.00 14.20 H new ATOM 0 HE3 LYS A 75 16.811 3.578 12.028 1.00 14.20 H new ATOM 0 HZ1 LYS A 75 17.820 5.408 11.071 1.00 64.11 H new ATOM 0 HZ2 LYS A 75 17.291 4.547 9.706 1.00 64.11 H new ATOM 0 HZ3 LYS A 75 16.422 5.902 10.244 1.00 64.11 H new ATOM 1157 N LEU A 76 11.611 3.827 5.602 1.00 31.15 N ATOM 1158 CA LEU A 76 11.182 3.121 4.395 1.00 33.43 C ATOM 1159 C LEU A 76 12.053 3.525 3.196 1.00 71.24 C ATOM 1160 O LEU A 76 12.125 4.701 2.840 1.00 34.41 O ATOM 1161 CB LEU A 76 9.709 3.432 4.107 1.00 21.23 C ATOM 1162 CG LEU A 76 8.734 3.112 5.255 1.00 21.12 C ATOM 1163 CD1 LEU A 76 7.319 3.543 4.895 1.00 24.51 C ATOM 1164 CD2 LEU A 76 8.770 1.627 5.612 1.00 21.23 C ATOM 0 H LEU A 76 11.476 4.837 5.565 1.00 31.15 H new ATOM 0 HA LEU A 76 11.296 2.049 4.557 1.00 33.43 H new ATOM 0 HB2 LEU A 76 9.619 4.490 3.860 1.00 21.23 H new ATOM 0 HB3 LEU A 76 9.402 2.871 3.224 1.00 21.23 H new ATOM 0 HG LEU A 76 9.053 3.676 6.132 1.00 21.12 H new ATOM 0 HD11 LEU A 76 6.646 3.308 5.720 1.00 24.51 H new ATOM 0 HD12 LEU A 76 7.302 4.617 4.708 1.00 24.51 H new ATOM 0 HD13 LEU A 76 6.994 3.013 3.999 1.00 24.51 H new ATOM 0 HD21 LEU A 76 8.071 1.431 6.426 1.00 21.23 H new ATOM 0 HD22 LEU A 76 8.487 1.036 4.741 1.00 21.23 H new ATOM 0 HD23 LEU A 76 9.777 1.352 5.925 1.00 21.23 H new ATOM 1176 N VAL A 77 12.718 2.549 2.585 1.00 3.13 N ATOM 1177 CA VAL A 77 13.615 2.812 1.452 1.00 71.43 C ATOM 1178 C VAL A 77 12.852 2.819 0.114 1.00 12.11 C ATOM 1179 O VAL A 77 11.906 2.054 -0.079 1.00 75.44 O ATOM 1180 CB VAL A 77 14.771 1.775 1.389 1.00 33.30 C ATOM 1181 CG1 VAL A 77 14.242 0.365 1.119 1.00 3.44 C ATOM 1182 CG2 VAL A 77 15.814 2.179 0.343 1.00 71.25 C ATOM 0 H VAL A 77 12.656 1.566 2.852 1.00 3.13 H new ATOM 0 HA VAL A 77 14.041 3.802 1.614 1.00 71.43 H new ATOM 0 HB VAL A 77 15.257 1.764 2.364 1.00 33.30 H new ATOM 0 HG11 VAL A 77 15.076 -0.336 1.081 1.00 3.44 H new ATOM 0 HG12 VAL A 77 13.559 0.073 1.917 1.00 3.44 H new ATOM 0 HG13 VAL A 77 13.713 0.351 0.166 1.00 3.44 H new ATOM 0 HG21 VAL A 77 16.612 1.437 0.319 1.00 71.25 H new ATOM 0 HG22 VAL A 77 15.342 2.236 -0.638 1.00 71.25 H new ATOM 0 HG23 VAL A 77 16.231 3.152 0.602 1.00 71.25 H new ATOM 1192 N GLU A 78 13.274 3.693 -0.796 1.00 50.21 N ATOM 1193 CA GLU A 78 12.632 3.843 -2.108 1.00 33.02 C ATOM 1194 C GLU A 78 13.012 2.704 -3.077 1.00 13.31 C ATOM 1195 O GLU A 78 14.191 2.426 -3.300 1.00 63.13 O ATOM 1196 CB GLU A 78 13.016 5.204 -2.711 1.00 71.23 C ATOM 1197 CG GLU A 78 14.521 5.416 -2.831 1.00 31.12 C ATOM 1198 CD GLU A 78 14.890 6.832 -3.235 1.00 52.54 C ATOM 1199 OE1 GLU A 78 14.953 7.119 -4.448 1.00 44.02 O ATOM 1200 OE2 GLU A 78 15.127 7.666 -2.342 1.00 50.25 O ATOM 0 H GLU A 78 14.067 4.317 -0.650 1.00 50.21 H new ATOM 0 HA GLU A 78 11.553 3.791 -1.962 1.00 33.02 H new ATOM 0 HB2 GLU A 78 12.565 5.294 -3.699 1.00 71.23 H new ATOM 0 HB3 GLU A 78 12.594 5.997 -2.094 1.00 71.23 H new ATOM 0 HG2 GLU A 78 14.993 5.182 -1.877 1.00 31.12 H new ATOM 0 HG3 GLU A 78 14.923 4.718 -3.565 1.00 31.12 H new ATOM 1207 N MET A 79 11.999 2.047 -3.638 1.00 21.51 N ATOM 1208 CA MET A 79 12.199 0.987 -4.636 1.00 30.32 C ATOM 1209 C MET A 79 11.278 1.189 -5.852 1.00 0.52 C ATOM 1210 O MET A 79 10.258 1.881 -5.769 1.00 13.31 O ATOM 1211 CB MET A 79 11.940 -0.394 -4.012 1.00 50.12 C ATOM 1212 CG MET A 79 12.974 -0.811 -2.972 1.00 3.33 C ATOM 1213 SD MET A 79 14.640 -0.938 -3.662 1.00 71.21 S ATOM 1214 CE MET A 79 15.564 -1.488 -2.230 1.00 21.10 C ATOM 0 H MET A 79 11.020 2.230 -3.418 1.00 21.51 H new ATOM 0 HA MET A 79 13.234 1.039 -4.974 1.00 30.32 H new ATOM 0 HB2 MET A 79 10.954 -0.392 -3.548 1.00 50.12 H new ATOM 0 HB3 MET A 79 11.917 -1.141 -4.806 1.00 50.12 H new ATOM 0 HG2 MET A 79 12.976 -0.088 -2.157 1.00 3.33 H new ATOM 0 HG3 MET A 79 12.687 -1.772 -2.545 1.00 3.33 H new ATOM 0 HE1 MET A 79 16.631 -1.458 -2.452 1.00 21.10 H new ATOM 0 HE2 MET A 79 15.351 -0.833 -1.386 1.00 21.10 H new ATOM 0 HE3 MET A 79 15.274 -2.508 -1.980 1.00 21.10 H new ATOM 1224 N ASN A 80 11.638 0.578 -6.980 1.00 23.11 N ATOM 1225 CA ASN A 80 10.853 0.695 -8.215 1.00 45.43 C ATOM 1226 C ASN A 80 10.515 -0.694 -8.794 1.00 52.03 C ATOM 1227 O ASN A 80 11.311 -1.629 -8.711 1.00 34.34 O ATOM 1228 CB ASN A 80 11.601 1.545 -9.254 1.00 53.44 C ATOM 1229 CG ASN A 80 11.735 3.002 -8.838 1.00 22.43 C ATOM 1230 OD1 ASN A 80 10.875 3.548 -8.159 1.00 65.31 O ATOM 1231 ND2 ASN A 80 12.806 3.651 -9.254 1.00 5.32 N ATOM 0 H ASN A 80 12.470 -0.005 -7.067 1.00 23.11 H new ATOM 0 HA ASN A 80 9.916 1.194 -7.969 1.00 45.43 H new ATOM 0 HB2 ASN A 80 12.594 1.125 -9.413 1.00 53.44 H new ATOM 0 HB3 ASN A 80 11.075 1.491 -10.207 1.00 53.44 H new ATOM 0 HD21 ASN A 80 12.933 4.633 -9.011 1.00 5.32 H new ATOM 0 HD22 ASN A 80 13.506 3.170 -9.819 1.00 5.32 H new ATOM 1238 N CYS A 81 9.346 -0.791 -9.430 1.00 52.31 N ATOM 1239 CA CYS A 81 8.756 -2.077 -9.856 1.00 44.12 C ATOM 1240 C CYS A 81 9.695 -2.978 -10.689 1.00 43.30 C ATOM 1241 O CYS A 81 9.424 -4.169 -10.837 1.00 43.41 O ATOM 1242 CB CYS A 81 7.483 -1.811 -10.667 1.00 33.30 C ATOM 1243 SG CYS A 81 7.750 -0.786 -12.138 1.00 50.23 S ATOM 0 H CYS A 81 8.774 0.019 -9.668 1.00 52.31 H new ATOM 0 HA CYS A 81 8.548 -2.621 -8.935 1.00 44.12 H new ATOM 0 HB2 CYS A 81 7.054 -2.765 -10.974 1.00 33.30 H new ATOM 0 HB3 CYS A 81 6.750 -1.323 -10.025 1.00 33.30 H new ATOM 0 HG CYS A 81 6.621 -0.617 -12.760 1.00 50.23 H new ATOM 1249 N TYR A 82 10.782 -2.427 -11.232 1.00 33.43 N ATOM 1250 CA TYR A 82 11.667 -3.198 -12.120 1.00 52.40 C ATOM 1251 C TYR A 82 12.250 -4.451 -11.428 1.00 71.55 C ATOM 1252 O TYR A 82 12.317 -5.524 -12.031 1.00 43.50 O ATOM 1253 CB TYR A 82 12.802 -2.313 -12.677 1.00 73.43 C ATOM 1254 CG TYR A 82 13.817 -1.844 -11.643 1.00 1.20 C ATOM 1255 CD1 TYR A 82 13.617 -0.680 -10.914 1.00 45.21 C ATOM 1256 CD2 TYR A 82 14.979 -2.570 -11.404 1.00 50.11 C ATOM 1257 CE1 TYR A 82 14.542 -0.255 -9.977 1.00 71.52 C ATOM 1258 CE2 TYR A 82 15.907 -2.153 -10.469 1.00 12.41 C ATOM 1259 CZ TYR A 82 15.685 -0.996 -9.758 1.00 73.14 C ATOM 1260 OH TYR A 82 16.608 -0.580 -8.825 1.00 21.21 O ATOM 0 H TYR A 82 11.072 -1.461 -11.078 1.00 33.43 H new ATOM 0 HA TYR A 82 11.051 -3.543 -12.951 1.00 52.40 H new ATOM 0 HB2 TYR A 82 13.327 -2.868 -13.454 1.00 73.43 H new ATOM 0 HB3 TYR A 82 12.360 -1.438 -13.153 1.00 73.43 H new ATOM 0 HD1 TYR A 82 12.724 -0.096 -11.081 1.00 45.21 H new ATOM 0 HD2 TYR A 82 15.160 -3.478 -11.960 1.00 50.11 H new ATOM 0 HE1 TYR A 82 14.370 0.654 -9.419 1.00 71.52 H new ATOM 0 HE2 TYR A 82 16.802 -2.732 -10.297 1.00 12.41 H new ATOM 0 HH TYR A 82 17.353 -1.216 -8.795 1.00 21.21 H new ATOM 1270 N GLU A 83 12.660 -4.320 -10.163 1.00 31.14 N ATOM 1271 CA GLU A 83 13.266 -5.445 -9.430 1.00 14.33 C ATOM 1272 C GLU A 83 12.264 -6.107 -8.468 1.00 41.03 C ATOM 1273 O GLU A 83 12.240 -7.330 -8.327 1.00 22.11 O ATOM 1274 CB GLU A 83 14.511 -4.977 -8.657 1.00 44.52 C ATOM 1275 CG GLU A 83 15.278 -6.111 -7.979 1.00 64.13 C ATOM 1276 CD GLU A 83 16.587 -5.657 -7.348 1.00 3.52 C ATOM 1277 OE1 GLU A 83 17.572 -5.451 -8.093 1.00 14.12 O ATOM 1278 OE2 GLU A 83 16.646 -5.513 -6.112 1.00 62.31 O ATOM 0 H GLU A 83 12.586 -3.456 -9.626 1.00 31.14 H new ATOM 0 HA GLU A 83 13.562 -6.191 -10.167 1.00 14.33 H new ATOM 0 HB2 GLU A 83 15.180 -4.458 -9.344 1.00 44.52 H new ATOM 0 HB3 GLU A 83 14.207 -4.253 -7.901 1.00 44.52 H new ATOM 0 HG2 GLU A 83 14.648 -6.558 -7.210 1.00 64.13 H new ATOM 0 HG3 GLU A 83 15.487 -6.889 -8.713 1.00 64.13 H new ATOM 1285 N ASP A 84 11.421 -5.295 -7.831 1.00 31.41 N ATOM 1286 CA ASP A 84 10.440 -5.784 -6.847 1.00 50.31 C ATOM 1287 C ASP A 84 9.305 -6.612 -7.492 1.00 35.14 C ATOM 1288 O ASP A 84 8.345 -6.995 -6.817 1.00 43.54 O ATOM 1289 CB ASP A 84 9.855 -4.593 -6.083 1.00 64.12 C ATOM 1290 CG ASP A 84 10.940 -3.752 -5.431 1.00 22.12 C ATOM 1291 OD1 ASP A 84 11.599 -2.974 -6.157 1.00 64.22 O ATOM 1292 OD2 ASP A 84 11.141 -3.875 -4.206 1.00 0.41 O ATOM 0 H ASP A 84 11.394 -4.286 -7.977 1.00 31.41 H new ATOM 0 HA ASP A 84 10.964 -6.453 -6.164 1.00 50.31 H new ATOM 0 HB2 ASP A 84 9.275 -3.972 -6.766 1.00 64.12 H new ATOM 0 HB3 ASP A 84 9.167 -4.954 -5.319 1.00 64.12 H new ATOM 1297 N ALA A 85 9.426 -6.896 -8.792 1.00 10.42 N ATOM 1298 CA ALA A 85 8.431 -7.689 -9.528 1.00 73.43 C ATOM 1299 C ALA A 85 8.068 -8.996 -8.799 1.00 35.05 C ATOM 1300 O ALA A 85 6.890 -9.295 -8.595 1.00 72.32 O ATOM 1301 CB ALA A 85 8.943 -7.995 -10.935 1.00 61.42 C ATOM 0 H ALA A 85 10.212 -6.585 -9.364 1.00 10.42 H new ATOM 0 HA ALA A 85 7.521 -7.092 -9.591 1.00 73.43 H new ATOM 0 HB1 ALA A 85 8.199 -8.583 -11.473 1.00 61.42 H new ATOM 0 HB2 ALA A 85 9.122 -7.061 -11.468 1.00 61.42 H new ATOM 0 HB3 ALA A 85 9.873 -8.559 -10.869 1.00 61.42 H new ATOM 1307 N SER A 86 9.083 -9.769 -8.401 1.00 23.24 N ATOM 1308 CA SER A 86 8.859 -11.045 -7.701 1.00 3.04 C ATOM 1309 C SER A 86 8.294 -10.825 -6.293 1.00 13.20 C ATOM 1310 O SER A 86 7.482 -11.618 -5.811 1.00 2.04 O ATOM 1311 CB SER A 86 10.153 -11.863 -7.611 1.00 54.11 C ATOM 1312 OG SER A 86 10.619 -12.238 -8.899 1.00 51.43 O ATOM 0 H SER A 86 10.065 -9.538 -8.549 1.00 23.24 H new ATOM 0 HA SER A 86 8.127 -11.601 -8.287 1.00 3.04 H new ATOM 0 HB2 SER A 86 10.919 -11.280 -7.101 1.00 54.11 H new ATOM 0 HB3 SER A 86 9.980 -12.756 -7.011 1.00 54.11 H new ATOM 0 HG SER A 86 11.446 -12.757 -8.810 1.00 51.43 H new ATOM 1318 N MET A 87 8.730 -9.750 -5.633 1.00 11.01 N ATOM 1319 CA MET A 87 8.185 -9.378 -4.321 1.00 45.24 C ATOM 1320 C MET A 87 6.661 -9.199 -4.397 1.00 62.44 C ATOM 1321 O MET A 87 5.921 -9.778 -3.604 1.00 52.24 O ATOM 1322 CB MET A 87 8.844 -8.089 -3.805 1.00 23.53 C ATOM 1323 CG MET A 87 10.327 -8.241 -3.485 1.00 24.21 C ATOM 1324 SD MET A 87 10.635 -9.424 -2.155 1.00 53.10 S ATOM 1325 CE MET A 87 9.806 -8.626 -0.776 1.00 22.22 C ATOM 0 H MET A 87 9.455 -9.123 -5.981 1.00 11.01 H new ATOM 0 HA MET A 87 8.406 -10.185 -3.623 1.00 45.24 H new ATOM 0 HB2 MET A 87 8.722 -7.305 -4.553 1.00 23.53 H new ATOM 0 HB3 MET A 87 8.320 -7.758 -2.908 1.00 23.53 H new ATOM 0 HG2 MET A 87 10.857 -8.562 -4.382 1.00 24.21 H new ATOM 0 HG3 MET A 87 10.735 -7.270 -3.204 1.00 24.21 H new ATOM 0 HE1 MET A 87 10.180 -9.039 0.161 1.00 22.22 H new ATOM 0 HE2 MET A 87 10.002 -7.554 -0.804 1.00 22.22 H new ATOM 0 HE3 MET A 87 8.732 -8.800 -0.847 1.00 22.22 H new ATOM 1335 N PHE A 88 6.196 -8.405 -5.366 1.00 2.43 N ATOM 1336 CA PHE A 88 4.755 -8.215 -5.587 1.00 72.53 C ATOM 1337 C PHE A 88 4.084 -9.493 -6.110 1.00 53.44 C ATOM 1338 O PHE A 88 2.929 -9.763 -5.798 1.00 44.23 O ATOM 1339 CB PHE A 88 4.504 -7.056 -6.561 1.00 2.22 C ATOM 1340 CG PHE A 88 4.839 -5.704 -5.982 1.00 34.12 C ATOM 1341 CD1 PHE A 88 3.989 -5.102 -5.066 1.00 65.14 C ATOM 1342 CD2 PHE A 88 6.000 -5.039 -6.350 1.00 32.23 C ATOM 1343 CE1 PHE A 88 4.291 -3.866 -4.529 1.00 14.03 C ATOM 1344 CE2 PHE A 88 6.305 -3.804 -5.814 1.00 25.12 C ATOM 1345 CZ PHE A 88 5.449 -3.218 -4.904 1.00 34.23 C ATOM 0 H PHE A 88 6.792 -7.884 -6.009 1.00 2.43 H new ATOM 0 HA PHE A 88 4.311 -7.973 -4.621 1.00 72.53 H new ATOM 0 HB2 PHE A 88 5.096 -7.214 -7.462 1.00 2.22 H new ATOM 0 HB3 PHE A 88 3.456 -7.065 -6.862 1.00 2.22 H new ATOM 0 HD1 PHE A 88 3.081 -5.606 -4.769 1.00 65.14 H new ATOM 0 HD2 PHE A 88 6.672 -5.493 -7.063 1.00 32.23 H new ATOM 0 HE1 PHE A 88 3.621 -3.408 -3.816 1.00 14.03 H new ATOM 0 HE2 PHE A 88 7.213 -3.297 -6.107 1.00 25.12 H new ATOM 0 HZ PHE A 88 5.686 -2.251 -4.485 1.00 34.23 H new ATOM 1355 N LYS A 89 4.810 -10.270 -6.909 1.00 64.51 N ATOM 1356 CA LYS A 89 4.294 -11.541 -7.435 1.00 51.31 C ATOM 1357 C LYS A 89 3.834 -12.465 -6.291 1.00 52.45 C ATOM 1358 O LYS A 89 2.687 -12.922 -6.262 1.00 60.54 O ATOM 1359 CB LYS A 89 5.382 -12.233 -8.273 1.00 61.53 C ATOM 1360 CG LYS A 89 4.912 -13.472 -9.035 1.00 41.43 C ATOM 1361 CD LYS A 89 3.877 -13.126 -10.106 1.00 13.21 C ATOM 1362 CE LYS A 89 3.567 -14.317 -11.010 1.00 43.12 C ATOM 1363 NZ LYS A 89 3.085 -15.498 -10.245 1.00 44.24 N ATOM 0 H LYS A 89 5.759 -10.046 -7.210 1.00 64.51 H new ATOM 0 HA LYS A 89 3.430 -11.331 -8.066 1.00 51.31 H new ATOM 0 HB2 LYS A 89 5.783 -11.514 -8.988 1.00 61.53 H new ATOM 0 HB3 LYS A 89 6.202 -12.518 -7.614 1.00 61.53 H new ATOM 0 HG2 LYS A 89 5.769 -13.957 -9.502 1.00 41.43 H new ATOM 0 HG3 LYS A 89 4.483 -14.188 -8.334 1.00 41.43 H new ATOM 0 HD2 LYS A 89 2.959 -12.787 -9.626 1.00 13.21 H new ATOM 0 HD3 LYS A 89 4.245 -12.298 -10.711 1.00 13.21 H new ATOM 0 HE2 LYS A 89 2.812 -14.028 -11.741 1.00 43.12 H new ATOM 0 HE3 LYS A 89 4.463 -14.590 -11.568 1.00 43.12 H new ATOM 0 HZ1 LYS A 89 2.776 -16.238 -10.907 1.00 44.24 H new ATOM 0 HZ2 LYS A 89 3.856 -15.865 -9.651 1.00 44.24 H new ATOM 0 HZ3 LYS A 89 2.286 -15.218 -9.641 1.00 44.24 H new ATOM 1377 N ALA A 90 4.735 -12.721 -5.343 1.00 21.24 N ATOM 1378 CA ALA A 90 4.423 -13.558 -4.180 1.00 43.21 C ATOM 1379 C ALA A 90 3.492 -12.834 -3.187 1.00 52.24 C ATOM 1380 O ALA A 90 2.600 -13.449 -2.597 1.00 71.12 O ATOM 1381 CB ALA A 90 5.708 -13.990 -3.484 1.00 33.51 C ATOM 0 H ALA A 90 5.689 -12.361 -5.356 1.00 21.24 H new ATOM 0 HA ALA A 90 3.895 -14.441 -4.539 1.00 43.21 H new ATOM 0 HB1 ALA A 90 5.464 -14.611 -2.622 1.00 33.51 H new ATOM 0 HB2 ALA A 90 6.324 -14.560 -4.179 1.00 33.51 H new ATOM 0 HB3 ALA A 90 6.256 -13.108 -3.152 1.00 33.51 H new ATOM 1387 N TYR A 91 3.708 -11.526 -3.007 1.00 24.53 N ATOM 1388 CA TYR A 91 2.883 -10.712 -2.098 1.00 41.55 C ATOM 1389 C TYR A 91 1.403 -10.745 -2.508 1.00 1.50 C ATOM 1390 O TYR A 91 0.538 -11.089 -1.705 1.00 75.03 O ATOM 1391 CB TYR A 91 3.390 -9.260 -2.071 1.00 30.11 C ATOM 1392 CG TYR A 91 2.674 -8.365 -1.069 1.00 12.23 C ATOM 1393 CD1 TYR A 91 3.085 -8.308 0.262 1.00 22.22 C ATOM 1394 CD2 TYR A 91 1.594 -7.573 -1.452 1.00 21.32 C ATOM 1395 CE1 TYR A 91 2.439 -7.492 1.176 1.00 42.31 C ATOM 1396 CE2 TYR A 91 0.946 -6.757 -0.544 1.00 0.12 C ATOM 1397 CZ TYR A 91 1.372 -6.719 0.767 1.00 42.21 C ATOM 1398 OH TYR A 91 0.724 -5.905 1.672 1.00 23.25 O ATOM 0 H TYR A 91 4.448 -11.005 -3.478 1.00 24.53 H new ATOM 0 HA TYR A 91 2.968 -11.139 -1.099 1.00 41.55 H new ATOM 0 HB2 TYR A 91 4.455 -9.264 -1.841 1.00 30.11 H new ATOM 0 HB3 TYR A 91 3.281 -8.831 -3.067 1.00 30.11 H new ATOM 0 HD1 TYR A 91 3.921 -8.910 0.586 1.00 22.22 H new ATOM 0 HD2 TYR A 91 1.257 -7.597 -2.478 1.00 21.32 H new ATOM 0 HE1 TYR A 91 2.769 -7.461 2.204 1.00 42.31 H new ATOM 0 HE2 TYR A 91 0.109 -6.152 -0.860 1.00 0.12 H new ATOM 0 HH TYR A 91 -0.003 -5.428 1.221 1.00 23.25 H new ATOM 1408 N ILE A 92 1.121 -10.393 -3.763 1.00 65.12 N ATOM 1409 CA ILE A 92 -0.254 -10.400 -4.284 1.00 42.55 C ATOM 1410 C ILE A 92 -0.851 -11.816 -4.263 1.00 63.14 C ATOM 1411 O ILE A 92 -2.045 -11.986 -4.020 1.00 24.21 O ATOM 1412 CB ILE A 92 -0.324 -9.823 -5.725 1.00 40.31 C ATOM 1413 CG1 ILE A 92 0.159 -8.361 -5.740 1.00 33.44 C ATOM 1414 CG2 ILE A 92 -1.744 -9.929 -6.294 1.00 61.00 C ATOM 1415 CD1 ILE A 92 -0.659 -7.429 -4.863 1.00 73.10 C ATOM 0 H ILE A 92 1.824 -10.099 -4.441 1.00 65.12 H new ATOM 0 HA ILE A 92 -0.843 -9.760 -3.627 1.00 42.55 H new ATOM 0 HB ILE A 92 0.335 -10.415 -6.360 1.00 40.31 H new ATOM 0 HG12 ILE A 92 1.199 -8.330 -5.414 1.00 33.44 H new ATOM 0 HG13 ILE A 92 0.135 -7.992 -6.765 1.00 33.44 H new ATOM 0 HG21 ILE A 92 -1.763 -9.518 -7.303 1.00 61.00 H new ATOM 0 HG22 ILE A 92 -2.047 -10.976 -6.323 1.00 61.00 H new ATOM 0 HG23 ILE A 92 -2.432 -9.369 -5.661 1.00 61.00 H new ATOM 0 HD11 ILE A 92 -0.255 -6.419 -4.929 1.00 73.10 H new ATOM 0 HD12 ILE A 92 -1.695 -7.428 -5.201 1.00 73.10 H new ATOM 0 HD13 ILE A 92 -0.615 -7.771 -3.829 1.00 73.10 H new ATOM 1427 N LYS A 93 -0.015 -12.828 -4.518 1.00 14.52 N ATOM 1428 CA LYS A 93 -0.448 -14.231 -4.427 1.00 40.42 C ATOM 1429 C LYS A 93 -0.997 -14.552 -3.025 1.00 13.43 C ATOM 1430 O LYS A 93 -2.163 -14.919 -2.875 1.00 13.22 O ATOM 1431 CB LYS A 93 0.724 -15.169 -4.761 1.00 24.33 C ATOM 1432 CG LYS A 93 0.385 -16.657 -4.668 1.00 62.13 C ATOM 1433 CD LYS A 93 -0.707 -17.058 -5.657 1.00 60.04 C ATOM 1434 CE LYS A 93 -1.038 -18.542 -5.558 1.00 3.04 C ATOM 1435 NZ LYS A 93 -2.084 -18.947 -6.532 1.00 73.43 N ATOM 0 H LYS A 93 0.961 -12.705 -4.788 1.00 14.52 H new ATOM 0 HA LYS A 93 -1.249 -14.386 -5.150 1.00 40.42 H new ATOM 0 HB2 LYS A 93 1.073 -14.950 -5.770 1.00 24.33 H new ATOM 0 HB3 LYS A 93 1.551 -14.954 -4.084 1.00 24.33 H new ATOM 0 HG2 LYS A 93 1.282 -17.246 -4.860 1.00 62.13 H new ATOM 0 HG3 LYS A 93 0.060 -16.892 -3.654 1.00 62.13 H new ATOM 0 HD2 LYS A 93 -1.605 -16.471 -5.465 1.00 60.04 H new ATOM 0 HD3 LYS A 93 -0.384 -16.824 -6.671 1.00 60.04 H new ATOM 0 HE2 LYS A 93 -0.135 -19.127 -5.732 1.00 3.04 H new ATOM 0 HE3 LYS A 93 -1.376 -18.771 -4.547 1.00 3.04 H new ATOM 0 HZ1 LYS A 93 -2.278 -19.964 -6.430 1.00 73.43 H new ATOM 0 HZ2 LYS A 93 -2.955 -18.408 -6.350 1.00 73.43 H new ATOM 0 HZ3 LYS A 93 -1.752 -18.753 -7.498 1.00 73.43 H new ATOM 1449 N LYS A 94 -0.153 -14.398 -2.007 1.00 54.22 N ATOM 1450 CA LYS A 94 -0.550 -14.663 -0.617 1.00 40.44 C ATOM 1451 C LYS A 94 -1.693 -13.728 -0.179 1.00 72.35 C ATOM 1452 O LYS A 94 -2.625 -14.141 0.516 1.00 32.50 O ATOM 1453 CB LYS A 94 0.662 -14.490 0.311 1.00 24.14 C ATOM 1454 CG LYS A 94 0.416 -14.921 1.756 1.00 34.41 C ATOM 1455 CD LYS A 94 0.090 -16.412 1.856 1.00 12.42 C ATOM 1456 CE LYS A 94 -0.061 -16.864 3.305 1.00 14.44 C ATOM 1457 NZ LYS A 94 1.204 -16.712 4.072 1.00 71.21 N ATOM 0 H LYS A 94 0.814 -14.090 -2.114 1.00 54.22 H new ATOM 0 HA LYS A 94 -0.911 -15.689 -0.552 1.00 40.44 H new ATOM 0 HB2 LYS A 94 1.497 -15.065 -0.090 1.00 24.14 H new ATOM 0 HB3 LYS A 94 0.964 -13.443 0.303 1.00 24.14 H new ATOM 0 HG2 LYS A 94 1.299 -14.701 2.356 1.00 34.41 H new ATOM 0 HG3 LYS A 94 -0.406 -14.340 2.174 1.00 34.41 H new ATOM 0 HD2 LYS A 94 -0.832 -16.619 1.313 1.00 12.42 H new ATOM 0 HD3 LYS A 94 0.880 -16.990 1.376 1.00 12.42 H new ATOM 0 HE2 LYS A 94 -0.848 -16.283 3.786 1.00 14.44 H new ATOM 0 HE3 LYS A 94 -0.376 -17.907 3.328 1.00 14.44 H new ATOM 0 HZ1 LYS A 94 1.134 -17.240 4.965 1.00 71.21 H new ATOM 0 HZ2 LYS A 94 1.997 -17.084 3.511 1.00 71.21 H new ATOM 0 HZ3 LYS A 94 1.367 -15.705 4.277 1.00 71.21 H new ATOM 1471 N PHE A 95 -1.610 -12.468 -0.607 1.00 74.21 N ATOM 1472 CA PHE A 95 -2.634 -11.457 -0.315 1.00 1.43 C ATOM 1473 C PHE A 95 -4.021 -11.897 -0.816 1.00 44.34 C ATOM 1474 O PHE A 95 -4.974 -11.971 -0.040 1.00 71.13 O ATOM 1475 CB PHE A 95 -2.233 -10.121 -0.959 1.00 70.54 C ATOM 1476 CG PHE A 95 -3.290 -9.048 -0.889 1.00 25.11 C ATOM 1477 CD1 PHE A 95 -3.459 -8.292 0.262 1.00 74.42 C ATOM 1478 CD2 PHE A 95 -4.110 -8.792 -1.979 1.00 4.22 C ATOM 1479 CE1 PHE A 95 -4.425 -7.305 0.322 1.00 72.42 C ATOM 1480 CE2 PHE A 95 -5.076 -7.809 -1.922 1.00 24.20 C ATOM 1481 CZ PHE A 95 -5.234 -7.064 -0.772 1.00 3.04 C ATOM 0 H PHE A 95 -0.832 -12.117 -1.166 1.00 74.21 H new ATOM 0 HA PHE A 95 -2.699 -11.337 0.766 1.00 1.43 H new ATOM 0 HB2 PHE A 95 -1.329 -9.755 -0.472 1.00 70.54 H new ATOM 0 HB3 PHE A 95 -1.982 -10.298 -2.005 1.00 70.54 H new ATOM 0 HD1 PHE A 95 -2.829 -8.477 1.120 1.00 74.42 H new ATOM 0 HD2 PHE A 95 -3.990 -9.370 -2.884 1.00 4.22 H new ATOM 0 HE1 PHE A 95 -4.547 -6.723 1.223 1.00 72.42 H new ATOM 0 HE2 PHE A 95 -5.708 -7.623 -2.777 1.00 24.20 H new ATOM 0 HZ PHE A 95 -5.989 -6.293 -0.727 1.00 3.04 H new ATOM 1491 N MET A 96 -4.120 -12.191 -2.114 1.00 62.32 N ATOM 1492 CA MET A 96 -5.384 -12.620 -2.730 1.00 43.13 C ATOM 1493 C MET A 96 -5.990 -13.821 -1.985 1.00 55.01 C ATOM 1494 O MET A 96 -7.192 -13.862 -1.715 1.00 23.35 O ATOM 1495 CB MET A 96 -5.158 -12.980 -4.207 1.00 44.13 C ATOM 1496 CG MET A 96 -6.420 -13.420 -4.940 1.00 21.14 C ATOM 1497 SD MET A 96 -6.098 -13.905 -6.648 1.00 41.54 S ATOM 1498 CE MET A 96 -5.486 -12.366 -7.338 1.00 20.43 C ATOM 0 H MET A 96 -3.336 -12.140 -2.765 1.00 62.32 H new ATOM 0 HA MET A 96 -6.087 -11.790 -2.664 1.00 43.13 H new ATOM 0 HB2 MET A 96 -4.735 -12.116 -4.720 1.00 44.13 H new ATOM 0 HB3 MET A 96 -4.419 -13.779 -4.266 1.00 44.13 H new ATOM 0 HG2 MET A 96 -6.872 -14.257 -4.408 1.00 21.14 H new ATOM 0 HG3 MET A 96 -7.145 -12.606 -4.928 1.00 21.14 H new ATOM 0 HE1 MET A 96 -5.547 -12.405 -8.426 1.00 20.43 H new ATOM 0 HE2 MET A 96 -6.091 -11.537 -6.971 1.00 20.43 H new ATOM 0 HE3 MET A 96 -4.449 -12.220 -7.037 1.00 20.43 H new ATOM 1508 N LYS A 97 -5.140 -14.784 -1.644 1.00 13.24 N ATOM 1509 CA LYS A 97 -5.569 -15.988 -0.925 1.00 42.13 C ATOM 1510 C LYS A 97 -6.157 -15.650 0.453 1.00 30.34 C ATOM 1511 O LYS A 97 -7.194 -16.191 0.848 1.00 71.32 O ATOM 1512 CB LYS A 97 -4.381 -16.943 -0.761 1.00 55.22 C ATOM 1513 CG LYS A 97 -3.788 -17.421 -2.084 1.00 21.11 C ATOM 1514 CD LYS A 97 -2.533 -18.259 -1.872 1.00 12.35 C ATOM 1515 CE LYS A 97 -2.808 -19.492 -1.021 1.00 41.43 C ATOM 1516 NZ LYS A 97 -3.791 -20.405 -1.663 1.00 31.01 N ATOM 0 H LYS A 97 -4.142 -14.757 -1.854 1.00 13.24 H new ATOM 0 HA LYS A 97 -6.352 -16.466 -1.513 1.00 42.13 H new ATOM 0 HB2 LYS A 97 -3.603 -16.444 -0.184 1.00 55.22 H new ATOM 0 HB3 LYS A 97 -4.701 -17.810 -0.183 1.00 55.22 H new ATOM 0 HG2 LYS A 97 -4.531 -18.009 -2.624 1.00 21.11 H new ATOM 0 HG3 LYS A 97 -3.549 -16.559 -2.707 1.00 21.11 H new ATOM 0 HD2 LYS A 97 -2.135 -18.567 -2.839 1.00 12.35 H new ATOM 0 HD3 LYS A 97 -1.767 -17.650 -1.391 1.00 12.35 H new ATOM 0 HE2 LYS A 97 -1.875 -20.028 -0.848 1.00 41.43 H new ATOM 0 HE3 LYS A 97 -3.184 -19.183 -0.046 1.00 41.43 H new ATOM 0 HZ1 LYS A 97 -3.836 -21.297 -1.130 1.00 31.01 H new ATOM 0 HZ2 LYS A 97 -4.730 -19.957 -1.667 1.00 31.01 H new ATOM 0 HZ3 LYS A 97 -3.496 -20.600 -2.641 1.00 31.01 H new ATOM 1530 N ASN A 98 -5.496 -14.751 1.178 1.00 35.12 N ATOM 1531 CA ASN A 98 -5.915 -14.398 2.537 1.00 55.44 C ATOM 1532 C ASN A 98 -7.187 -13.530 2.540 1.00 64.14 C ATOM 1533 O ASN A 98 -8.107 -13.776 3.318 1.00 52.32 O ATOM 1534 CB ASN A 98 -4.775 -13.677 3.268 1.00 55.40 C ATOM 1535 CG ASN A 98 -5.067 -13.475 4.745 1.00 35.33 C ATOM 1536 OD1 ASN A 98 -5.617 -12.459 5.155 1.00 63.43 O ATOM 1537 ND2 ASN A 98 -4.714 -14.451 5.558 1.00 42.42 N ATOM 0 H ASN A 98 -4.669 -14.253 0.850 1.00 35.12 H new ATOM 0 HA ASN A 98 -6.152 -15.324 3.061 1.00 55.44 H new ATOM 0 HB2 ASN A 98 -3.856 -14.253 3.158 1.00 55.40 H new ATOM 0 HB3 ASN A 98 -4.602 -12.708 2.799 1.00 55.40 H new ATOM 0 HD21 ASN A 98 -4.897 -14.373 6.558 1.00 42.42 H new ATOM 0 HD22 ASN A 98 -4.258 -15.284 5.187 1.00 42.42 H new ATOM 1544 N VAL A 99 -7.245 -12.526 1.660 1.00 0.31 N ATOM 1545 CA VAL A 99 -8.393 -11.607 1.621 1.00 24.34 C ATOM 1546 C VAL A 99 -9.692 -12.309 1.183 1.00 21.14 C ATOM 1547 O VAL A 99 -10.764 -12.026 1.721 1.00 62.15 O ATOM 1548 CB VAL A 99 -8.129 -10.378 0.712 1.00 11.32 C ATOM 1549 CG1 VAL A 99 -6.962 -9.555 1.254 1.00 73.35 C ATOM 1550 CG2 VAL A 99 -7.869 -10.801 -0.733 1.00 21.30 C ATOM 0 H VAL A 99 -6.520 -12.328 0.971 1.00 0.31 H new ATOM 0 HA VAL A 99 -8.523 -11.257 2.645 1.00 24.34 H new ATOM 0 HB VAL A 99 -9.024 -9.757 0.718 1.00 11.32 H new ATOM 0 HG11 VAL A 99 -6.790 -8.696 0.605 1.00 73.35 H new ATOM 0 HG12 VAL A 99 -7.198 -9.208 2.260 1.00 73.35 H new ATOM 0 HG13 VAL A 99 -6.064 -10.173 1.285 1.00 73.35 H new ATOM 0 HG21 VAL A 99 -7.688 -9.917 -1.344 1.00 21.30 H new ATOM 0 HG22 VAL A 99 -6.996 -11.453 -0.770 1.00 21.30 H new ATOM 0 HG23 VAL A 99 -8.738 -11.336 -1.117 1.00 21.30 H new ATOM 1560 N ILE A 100 -9.599 -13.227 0.219 1.00 32.24 N ATOM 1561 CA ILE A 100 -10.769 -14.010 -0.205 1.00 51.03 C ATOM 1562 C ILE A 100 -11.254 -14.924 0.932 1.00 41.13 C ATOM 1563 O ILE A 100 -12.448 -14.975 1.237 1.00 25.11 O ATOM 1564 CB ILE A 100 -10.468 -14.853 -1.474 1.00 23.25 C ATOM 1565 CG1 ILE A 100 -10.226 -13.934 -2.684 1.00 34.33 C ATOM 1566 CG2 ILE A 100 -11.605 -15.835 -1.765 1.00 44.04 C ATOM 1567 CD1 ILE A 100 -11.427 -13.088 -3.066 1.00 54.25 C ATOM 0 H ILE A 100 -8.737 -13.448 -0.280 1.00 32.24 H new ATOM 0 HA ILE A 100 -11.559 -13.301 -0.452 1.00 51.03 H new ATOM 0 HB ILE A 100 -9.563 -15.432 -1.289 1.00 23.25 H new ATOM 0 HG12 ILE A 100 -9.385 -13.276 -2.465 1.00 34.33 H new ATOM 0 HG13 ILE A 100 -9.938 -14.545 -3.539 1.00 34.33 H new ATOM 0 HG21 ILE A 100 -11.368 -16.412 -2.659 1.00 44.04 H new ATOM 0 HG22 ILE A 100 -11.728 -16.511 -0.919 1.00 44.04 H new ATOM 0 HG23 ILE A 100 -12.531 -15.283 -1.925 1.00 44.04 H new ATOM 0 HD11 ILE A 100 -11.176 -12.468 -3.927 1.00 54.25 H new ATOM 0 HD12 ILE A 100 -12.265 -13.738 -3.318 1.00 54.25 H new ATOM 0 HD13 ILE A 100 -11.704 -12.449 -2.227 1.00 54.25 H new ATOM 1579 N ASP A 101 -10.316 -15.631 1.565 1.00 32.02 N ATOM 1580 CA ASP A 101 -10.627 -16.457 2.736 1.00 71.23 C ATOM 1581 C ASP A 101 -11.252 -15.598 3.852 1.00 64.01 C ATOM 1582 O ASP A 101 -12.237 -15.988 4.488 1.00 0.04 O ATOM 1583 CB ASP A 101 -9.345 -17.141 3.233 1.00 24.23 C ATOM 1584 CG ASP A 101 -9.584 -18.059 4.419 1.00 72.54 C ATOM 1585 OD1 ASP A 101 -9.899 -19.251 4.204 1.00 23.14 O ATOM 1586 OD2 ASP A 101 -9.450 -17.598 5.570 1.00 54.25 O ATOM 0 H ASP A 101 -9.335 -15.649 1.287 1.00 32.02 H new ATOM 0 HA ASP A 101 -11.352 -17.221 2.454 1.00 71.23 H new ATOM 0 HB2 ASP A 101 -8.907 -17.717 2.417 1.00 24.23 H new ATOM 0 HB3 ASP A 101 -8.617 -16.379 3.511 1.00 24.23 H new ATOM 1591 N HIS A 102 -10.678 -14.418 4.061 1.00 44.55 N ATOM 1592 CA HIS A 102 -11.168 -13.469 5.064 1.00 43.34 C ATOM 1593 C HIS A 102 -12.577 -12.961 4.711 1.00 34.20 C ATOM 1594 O HIS A 102 -13.405 -12.727 5.594 1.00 2.52 O ATOM 1595 CB HIS A 102 -10.193 -12.290 5.184 1.00 44.43 C ATOM 1596 CG HIS A 102 -10.429 -11.424 6.384 1.00 63.44 C ATOM 1597 ND1 HIS A 102 -9.940 -11.735 7.634 1.00 11.43 N ATOM 1598 CD2 HIS A 102 -11.093 -10.252 6.525 1.00 22.13 C ATOM 1599 CE1 HIS A 102 -10.288 -10.796 8.488 1.00 1.30 C ATOM 1600 NE2 HIS A 102 -10.987 -9.886 7.842 1.00 34.40 N ATOM 0 H HIS A 102 -9.862 -14.090 3.544 1.00 44.55 H new ATOM 0 HA HIS A 102 -11.230 -13.986 6.022 1.00 43.34 H new ATOM 0 HB2 HIS A 102 -9.175 -12.676 5.222 1.00 44.43 H new ATOM 0 HB3 HIS A 102 -10.268 -11.677 4.286 1.00 44.43 H new ATOM 0 HD2 HIS A 102 -11.609 -9.708 5.747 1.00 22.13 H new ATOM 0 HE1 HIS A 102 -10.042 -10.775 9.539 1.00 1.30 H new ATOM 0 HE2 HIS A 102 -11.386 -9.043 8.255 1.00 34.40 H new ATOM 1609 N MET A 103 -12.846 -12.789 3.417 1.00 75.43 N ATOM 1610 CA MET A 103 -14.175 -12.368 2.960 1.00 22.43 C ATOM 1611 C MET A 103 -15.226 -13.458 3.197 1.00 12.03 C ATOM 1612 O MET A 103 -16.351 -13.159 3.592 1.00 54.41 O ATOM 1613 CB MET A 103 -14.144 -11.944 1.487 1.00 43.50 C ATOM 1614 CG MET A 103 -13.587 -10.543 1.297 1.00 70.25 C ATOM 1615 SD MET A 103 -14.467 -9.341 2.318 1.00 23.21 S ATOM 1616 CE MET A 103 -13.538 -7.849 1.976 1.00 13.10 C ATOM 0 H MET A 103 -12.168 -12.933 2.669 1.00 75.43 H new ATOM 0 HA MET A 103 -14.464 -11.501 3.554 1.00 22.43 H new ATOM 0 HB2 MET A 103 -13.539 -12.652 0.921 1.00 43.50 H new ATOM 0 HB3 MET A 103 -15.153 -11.989 1.078 1.00 43.50 H new ATOM 0 HG2 MET A 103 -12.527 -10.533 1.552 1.00 70.25 H new ATOM 0 HG3 MET A 103 -13.665 -10.258 0.248 1.00 70.25 H new ATOM 0 HE1 MET A 103 -13.584 -7.186 2.840 1.00 13.10 H new ATOM 0 HE2 MET A 103 -12.499 -8.106 1.771 1.00 13.10 H new ATOM 0 HE3 MET A 103 -13.965 -7.345 1.109 1.00 13.10 H new ATOM 1626 N GLU A 104 -14.857 -14.717 2.969 1.00 43.20 N ATOM 1627 CA GLU A 104 -15.722 -15.850 3.330 1.00 13.33 C ATOM 1628 C GLU A 104 -16.029 -15.836 4.841 1.00 12.23 C ATOM 1629 O GLU A 104 -17.128 -16.173 5.276 1.00 45.21 O ATOM 1630 CB GLU A 104 -15.039 -17.175 2.943 1.00 2.42 C ATOM 1631 CG GLU A 104 -15.812 -18.424 3.369 1.00 74.43 C ATOM 1632 CD GLU A 104 -15.041 -19.712 3.120 1.00 41.41 C ATOM 1633 OE1 GLU A 104 -14.071 -19.980 3.861 1.00 61.11 O ATOM 1634 OE2 GLU A 104 -15.392 -20.457 2.181 1.00 71.53 O ATOM 0 H GLU A 104 -13.971 -14.983 2.539 1.00 43.20 H new ATOM 0 HA GLU A 104 -16.661 -15.759 2.785 1.00 13.33 H new ATOM 0 HB2 GLU A 104 -14.900 -17.198 1.862 1.00 2.42 H new ATOM 0 HB3 GLU A 104 -14.046 -17.204 3.392 1.00 2.42 H new ATOM 0 HG2 GLU A 104 -16.054 -18.351 4.429 1.00 74.43 H new ATOM 0 HG3 GLU A 104 -16.757 -18.462 2.828 1.00 74.43 H new ATOM 1641 N LYS A 105 -15.034 -15.419 5.619 1.00 63.22 N ATOM 1642 CA LYS A 105 -15.134 -15.352 7.080 1.00 64.01 C ATOM 1643 C LYS A 105 -16.087 -14.235 7.562 1.00 53.11 C ATOM 1644 O LYS A 105 -16.912 -14.460 8.449 1.00 52.32 O ATOM 1645 CB LYS A 105 -13.709 -15.173 7.654 1.00 42.12 C ATOM 1646 CG LYS A 105 -13.609 -14.912 9.164 1.00 23.41 C ATOM 1647 CD LYS A 105 -13.722 -13.425 9.508 1.00 61.41 C ATOM 1648 CE LYS A 105 -13.281 -13.128 10.942 1.00 4.51 C ATOM 1649 NZ LYS A 105 -13.996 -13.961 11.944 1.00 2.52 N ATOM 0 H LYS A 105 -14.130 -15.116 5.255 1.00 63.22 H new ATOM 0 HA LYS A 105 -15.571 -16.281 7.447 1.00 64.01 H new ATOM 0 HB2 LYS A 105 -13.133 -16.069 7.423 1.00 42.12 H new ATOM 0 HB3 LYS A 105 -13.232 -14.344 7.132 1.00 42.12 H new ATOM 0 HG2 LYS A 105 -14.397 -15.462 9.678 1.00 23.41 H new ATOM 0 HG3 LYS A 105 -12.659 -15.297 9.534 1.00 23.41 H new ATOM 0 HD2 LYS A 105 -13.112 -12.846 8.815 1.00 61.41 H new ATOM 0 HD3 LYS A 105 -14.754 -13.100 9.372 1.00 61.41 H new ATOM 0 HE2 LYS A 105 -12.208 -13.300 11.031 1.00 4.51 H new ATOM 0 HE3 LYS A 105 -13.454 -12.074 11.161 1.00 4.51 H new ATOM 0 HZ1 LYS A 105 -13.749 -13.640 12.902 1.00 2.52 H new ATOM 0 HZ2 LYS A 105 -15.022 -13.870 11.802 1.00 2.52 H new ATOM 0 HZ3 LYS A 105 -13.718 -14.957 11.830 1.00 2.52 H new ATOM 1663 N ASN A 106 -15.964 -13.027 6.998 1.00 50.13 N ATOM 1664 CA ASN A 106 -16.753 -11.873 7.489 1.00 4.42 C ATOM 1665 C ASN A 106 -18.035 -11.589 6.670 1.00 63.50 C ATOM 1666 O ASN A 106 -18.998 -11.037 7.205 1.00 73.32 O ATOM 1667 CB ASN A 106 -15.873 -10.607 7.572 1.00 61.02 C ATOM 1668 CG ASN A 106 -15.612 -9.904 6.238 1.00 32.10 C ATOM 1669 OD1 ASN A 106 -15.605 -10.627 5.134 1.00 34.05 O flip ATOM 1670 ND2 ASN A 106 -15.413 -8.696 6.203 1.00 42.24 N flip ATOM 0 H ASN A 106 -15.342 -12.818 6.217 1.00 50.13 H new ATOM 0 HA ASN A 106 -17.092 -12.151 8.487 1.00 4.42 H new ATOM 0 HB2 ASN A 106 -16.348 -9.898 8.251 1.00 61.02 H new ATOM 0 HB3 ASN A 106 -14.915 -10.879 8.014 1.00 61.02 H new ATOM 0 HD21 ASN A 106 -15.422 -8.152 7.066 1.00 42.24 H new ATOM 0 HD22 ASN A 106 -15.238 -8.234 5.311 1.00 42.24 H new ATOM 1677 N ASN A 107 -18.063 -11.973 5.389 1.00 23.32 N ATOM 1678 CA ASN A 107 -19.205 -11.651 4.509 1.00 63.24 C ATOM 1679 C ASN A 107 -19.820 -12.912 3.872 1.00 1.54 C ATOM 1680 O ASN A 107 -20.991 -13.205 4.088 1.00 35.12 O ATOM 1681 CB ASN A 107 -18.775 -10.673 3.405 1.00 42.25 C ATOM 1682 CG ASN A 107 -18.329 -9.327 3.947 1.00 32.01 C ATOM 1683 OD1 ASN A 107 -18.809 -8.861 4.974 1.00 21.20 O ATOM 1684 ND2 ASN A 107 -17.416 -8.684 3.253 1.00 41.14 N ATOM 0 H ASN A 107 -17.318 -12.503 4.936 1.00 23.32 H new ATOM 0 HA ASN A 107 -19.967 -11.185 5.134 1.00 63.24 H new ATOM 0 HB2 ASN A 107 -17.960 -11.116 2.832 1.00 42.25 H new ATOM 0 HB3 ASN A 107 -19.606 -10.524 2.715 1.00 42.25 H new ATOM 0 HD21 ASN A 107 -17.088 -7.770 3.565 1.00 41.14 H new ATOM 0 HD22 ASN A 107 -17.036 -9.099 2.402 1.00 41.14 H new ATOM 1691 N ARG A 108 -19.025 -13.612 3.050 1.00 43.12 N ATOM 1692 CA ARG A 108 -19.428 -14.867 2.362 1.00 13.12 C ATOM 1693 C ARG A 108 -20.516 -14.654 1.283 1.00 74.20 C ATOM 1694 O ARG A 108 -20.738 -15.533 0.449 1.00 14.41 O ATOM 1695 CB ARG A 108 -19.884 -15.954 3.369 1.00 25.42 C ATOM 1696 CG ARG A 108 -21.397 -16.007 3.613 1.00 31.51 C ATOM 1697 CD ARG A 108 -21.779 -17.070 4.634 1.00 63.51 C ATOM 1698 NE ARG A 108 -23.217 -17.078 4.890 1.00 51.35 N ATOM 1699 CZ ARG A 108 -23.757 -17.017 6.079 1.00 60.20 C ATOM 1700 NH1 ARG A 108 -23.014 -16.977 7.142 1.00 44.32 N ATOM 1701 NH2 ARG A 108 -25.043 -17.012 6.196 1.00 14.02 N ATOM 0 H ARG A 108 -18.070 -13.326 2.835 1.00 43.12 H new ATOM 0 HA ARG A 108 -18.531 -15.214 1.850 1.00 13.12 H new ATOM 0 HB2 ARG A 108 -19.554 -16.927 3.006 1.00 25.42 H new ATOM 0 HB3 ARG A 108 -19.382 -15.782 4.321 1.00 25.42 H new ATOM 0 HG2 ARG A 108 -21.742 -15.033 3.959 1.00 31.51 H new ATOM 0 HG3 ARG A 108 -21.908 -16.210 2.672 1.00 31.51 H new ATOM 0 HD2 ARG A 108 -21.468 -18.050 4.273 1.00 63.51 H new ATOM 0 HD3 ARG A 108 -21.244 -16.889 5.566 1.00 63.51 H new ATOM 0 HE ARG A 108 -23.842 -17.135 4.086 1.00 51.35 H new ATOM 0 HH11 ARG A 108 -21.998 -16.993 7.055 1.00 44.32 H new ATOM 0 HH12 ARG A 108 -23.446 -16.929 8.065 1.00 44.32 H new ATOM 0 HH21 ARG A 108 -25.631 -17.056 5.364 1.00 14.02 H new ATOM 0 HH22 ARG A 108 -25.471 -16.965 7.121 1.00 14.02 H new ATOM 1715 N ASP A 109 -21.175 -13.497 1.287 1.00 4.40 N ATOM 1716 CA ASP A 109 -22.274 -13.226 0.354 1.00 64.34 C ATOM 1717 C ASP A 109 -21.801 -13.268 -1.108 1.00 54.40 C ATOM 1718 O ASP A 109 -20.846 -12.584 -1.479 1.00 65.34 O ATOM 1719 CB ASP A 109 -22.908 -11.866 0.668 1.00 54.53 C ATOM 1720 CG ASP A 109 -23.970 -11.474 -0.345 1.00 13.42 C ATOM 1721 OD1 ASP A 109 -25.090 -12.022 -0.289 1.00 71.23 O ATOM 1722 OD2 ASP A 109 -23.682 -10.630 -1.215 1.00 11.33 O ATOM 0 H ASP A 109 -20.969 -12.729 1.926 1.00 4.40 H new ATOM 0 HA ASP A 109 -23.021 -14.010 0.482 1.00 64.34 H new ATOM 0 HB2 ASP A 109 -23.352 -11.896 1.663 1.00 54.53 H new ATOM 0 HB3 ASP A 109 -22.131 -11.102 0.689 1.00 54.53 H new ATOM 1727 N LYS A 110 -22.497 -14.059 -1.930 1.00 1.11 N ATOM 1728 CA LYS A 110 -22.121 -14.271 -3.340 1.00 75.13 C ATOM 1729 C LYS A 110 -21.887 -12.950 -4.099 1.00 71.53 C ATOM 1730 O LYS A 110 -20.958 -12.846 -4.902 1.00 75.21 O ATOM 1731 CB LYS A 110 -23.197 -15.105 -4.059 1.00 74.21 C ATOM 1732 CG LYS A 110 -24.595 -14.490 -4.013 1.00 64.02 C ATOM 1733 CD LYS A 110 -25.624 -15.331 -4.771 1.00 51.10 C ATOM 1734 CE LYS A 110 -25.341 -15.377 -6.272 1.00 21.34 C ATOM 1735 NZ LYS A 110 -26.394 -16.124 -7.011 1.00 64.12 N ATOM 0 H LYS A 110 -23.332 -14.570 -1.644 1.00 1.11 H new ATOM 0 HA LYS A 110 -21.175 -14.812 -3.336 1.00 75.13 H new ATOM 0 HB2 LYS A 110 -22.904 -15.237 -5.100 1.00 74.21 H new ATOM 0 HB3 LYS A 110 -23.233 -16.097 -3.610 1.00 74.21 H new ATOM 0 HG2 LYS A 110 -24.909 -14.384 -2.975 1.00 64.02 H new ATOM 0 HG3 LYS A 110 -24.563 -13.488 -4.440 1.00 64.02 H new ATOM 0 HD2 LYS A 110 -25.626 -16.345 -4.372 1.00 51.10 H new ATOM 0 HD3 LYS A 110 -26.620 -14.921 -4.603 1.00 51.10 H new ATOM 0 HE2 LYS A 110 -25.276 -14.361 -6.661 1.00 21.34 H new ATOM 0 HE3 LYS A 110 -24.373 -15.847 -6.445 1.00 21.34 H new ATOM 0 HZ1 LYS A 110 -26.166 -16.133 -8.026 1.00 64.12 H new ATOM 0 HZ2 LYS A 110 -26.439 -17.101 -6.658 1.00 64.12 H new ATOM 0 HZ3 LYS A 110 -27.314 -15.661 -6.867 1.00 64.12 H new ATOM 1749 N ALA A 111 -22.718 -11.943 -3.838 1.00 52.40 N ATOM 1750 CA ALA A 111 -22.602 -10.652 -4.523 1.00 2.43 C ATOM 1751 C ALA A 111 -21.460 -9.804 -3.941 1.00 63.42 C ATOM 1752 O ALA A 111 -20.774 -9.088 -4.672 1.00 33.34 O ATOM 1753 CB ALA A 111 -23.922 -9.891 -4.448 1.00 32.12 C ATOM 0 H ALA A 111 -23.478 -11.993 -3.159 1.00 52.40 H new ATOM 0 HA ALA A 111 -22.367 -10.851 -5.569 1.00 2.43 H new ATOM 0 HB1 ALA A 111 -23.820 -8.935 -4.961 1.00 32.12 H new ATOM 0 HB2 ALA A 111 -24.707 -10.477 -4.925 1.00 32.12 H new ATOM 0 HB3 ALA A 111 -24.183 -9.717 -3.404 1.00 32.12 H new ATOM 1759 N ASP A 112 -21.253 -9.897 -2.626 1.00 31.14 N ATOM 1760 CA ASP A 112 -20.194 -9.138 -1.955 1.00 64.02 C ATOM 1761 C ASP A 112 -18.804 -9.633 -2.382 1.00 44.42 C ATOM 1762 O ASP A 112 -17.954 -8.845 -2.792 1.00 1.33 O ATOM 1763 CB ASP A 112 -20.348 -9.237 -0.433 1.00 43.30 C ATOM 1764 CG ASP A 112 -19.402 -8.301 0.303 1.00 41.24 C ATOM 1765 OD1 ASP A 112 -18.267 -8.713 0.616 1.00 55.22 O ATOM 1766 OD2 ASP A 112 -19.793 -7.143 0.569 1.00 60.15 O ATOM 0 H ASP A 112 -21.804 -10.489 -2.005 1.00 31.14 H new ATOM 0 HA ASP A 112 -20.289 -8.093 -2.252 1.00 64.02 H new ATOM 0 HB2 ASP A 112 -21.376 -9.002 -0.158 1.00 43.30 H new ATOM 0 HB3 ASP A 112 -20.160 -10.263 -0.117 1.00 43.30 H new ATOM 1771 N VAL A 113 -18.578 -10.945 -2.295 1.00 24.43 N ATOM 1772 CA VAL A 113 -17.296 -11.534 -2.712 1.00 54.41 C ATOM 1773 C VAL A 113 -17.078 -11.412 -4.227 1.00 3.31 C ATOM 1774 O VAL A 113 -15.941 -11.468 -4.707 1.00 12.41 O ATOM 1775 CB VAL A 113 -17.168 -13.018 -2.286 1.00 61.23 C ATOM 1776 CG1 VAL A 113 -17.024 -13.132 -0.770 1.00 63.53 C ATOM 1777 CG2 VAL A 113 -18.356 -13.837 -2.783 1.00 60.51 C ATOM 0 H VAL A 113 -19.258 -11.619 -1.943 1.00 24.43 H new ATOM 0 HA VAL A 113 -16.522 -10.962 -2.200 1.00 54.41 H new ATOM 0 HB VAL A 113 -16.268 -13.425 -2.746 1.00 61.23 H new ATOM 0 HG11 VAL A 113 -16.935 -14.182 -0.491 1.00 63.53 H new ATOM 0 HG12 VAL A 113 -16.132 -12.594 -0.448 1.00 63.53 H new ATOM 0 HG13 VAL A 113 -17.901 -12.701 -0.288 1.00 63.53 H new ATOM 0 HG21 VAL A 113 -18.239 -14.874 -2.469 1.00 60.51 H new ATOM 0 HG22 VAL A 113 -19.277 -13.433 -2.364 1.00 60.51 H new ATOM 0 HG23 VAL A 113 -18.401 -13.790 -3.871 1.00 60.51 H new ATOM 1787 N ASP A 114 -18.166 -11.269 -4.983 1.00 74.33 N ATOM 1788 CA ASP A 114 -18.063 -10.956 -6.410 1.00 21.20 C ATOM 1789 C ASP A 114 -17.560 -9.519 -6.598 1.00 50.33 C ATOM 1790 O ASP A 114 -16.487 -9.298 -7.156 1.00 22.04 O ATOM 1791 CB ASP A 114 -19.414 -11.142 -7.108 1.00 12.31 C ATOM 1792 CG ASP A 114 -19.352 -10.779 -8.584 1.00 74.33 C ATOM 1793 OD1 ASP A 114 -18.826 -11.583 -9.377 1.00 61.21 O ATOM 1794 OD2 ASP A 114 -19.808 -9.677 -8.956 1.00 51.44 O ATOM 0 H ASP A 114 -19.121 -11.364 -4.637 1.00 74.33 H new ATOM 0 HA ASP A 114 -17.349 -11.644 -6.863 1.00 21.20 H new ATOM 0 HB2 ASP A 114 -19.736 -12.178 -7.003 1.00 12.31 H new ATOM 0 HB3 ASP A 114 -20.164 -10.524 -6.615 1.00 12.31 H new ATOM 1799 N ALA A 115 -18.330 -8.551 -6.099 1.00 51.12 N ATOM 1800 CA ALA A 115 -17.958 -7.135 -6.181 1.00 13.54 C ATOM 1801 C ALA A 115 -16.548 -6.888 -5.627 1.00 52.23 C ATOM 1802 O ALA A 115 -15.774 -6.116 -6.192 1.00 70.15 O ATOM 1803 CB ALA A 115 -18.981 -6.284 -5.438 1.00 35.24 C ATOM 0 H ALA A 115 -19.220 -8.722 -5.631 1.00 51.12 H new ATOM 0 HA ALA A 115 -17.951 -6.849 -7.233 1.00 13.54 H new ATOM 0 HB1 ALA A 115 -18.697 -5.234 -5.504 1.00 35.24 H new ATOM 0 HB2 ALA A 115 -19.965 -6.423 -5.887 1.00 35.24 H new ATOM 0 HB3 ALA A 115 -19.014 -6.586 -4.391 1.00 35.24 H new ATOM 1809 N PHE A 116 -16.217 -7.564 -4.527 1.00 54.03 N ATOM 1810 CA PHE A 116 -14.883 -7.469 -3.932 1.00 52.40 C ATOM 1811 C PHE A 116 -13.797 -7.900 -4.929 1.00 12.22 C ATOM 1812 O PHE A 116 -12.908 -7.113 -5.262 1.00 30.44 O ATOM 1813 CB PHE A 116 -14.790 -8.321 -2.657 1.00 44.11 C ATOM 1814 CG PHE A 116 -13.394 -8.389 -2.089 1.00 5.52 C ATOM 1815 CD1 PHE A 116 -12.788 -7.254 -1.567 1.00 61.03 C ATOM 1816 CD2 PHE A 116 -12.680 -9.581 -2.093 1.00 73.31 C ATOM 1817 CE1 PHE A 116 -11.505 -7.309 -1.058 1.00 51.25 C ATOM 1818 CE2 PHE A 116 -11.396 -9.638 -1.587 1.00 5.53 C ATOM 1819 CZ PHE A 116 -10.809 -8.501 -1.068 1.00 53.14 C ATOM 0 H PHE A 116 -16.855 -8.184 -4.029 1.00 54.03 H new ATOM 0 HA PHE A 116 -14.716 -6.424 -3.670 1.00 52.40 H new ATOM 0 HB2 PHE A 116 -15.462 -7.911 -1.904 1.00 44.11 H new ATOM 0 HB3 PHE A 116 -15.136 -9.331 -2.877 1.00 44.11 H new ATOM 0 HD1 PHE A 116 -13.326 -6.317 -1.559 1.00 61.03 H new ATOM 0 HD2 PHE A 116 -13.134 -10.474 -2.497 1.00 73.31 H new ATOM 0 HE1 PHE A 116 -11.046 -6.419 -0.652 1.00 51.25 H new ATOM 0 HE2 PHE A 116 -10.852 -10.571 -1.597 1.00 5.53 H new ATOM 0 HZ PHE A 116 -9.806 -8.544 -0.670 1.00 53.14 H new ATOM 1829 N LYS A 117 -13.873 -9.147 -5.411 1.00 70.23 N ATOM 1830 CA LYS A 117 -12.870 -9.654 -6.355 1.00 23.25 C ATOM 1831 C LYS A 117 -12.828 -8.797 -7.629 1.00 60.30 C ATOM 1832 O LYS A 117 -11.777 -8.650 -8.244 1.00 52.52 O ATOM 1833 CB LYS A 117 -13.110 -11.132 -6.720 1.00 74.02 C ATOM 1834 CG LYS A 117 -14.326 -11.379 -7.609 1.00 33.10 C ATOM 1835 CD LYS A 117 -14.332 -12.794 -8.184 1.00 71.41 C ATOM 1836 CE LYS A 117 -14.437 -13.863 -7.100 1.00 21.24 C ATOM 1837 NZ LYS A 117 -15.729 -13.795 -6.367 1.00 32.15 N ATOM 0 H LYS A 117 -14.606 -9.814 -5.168 1.00 70.23 H new ATOM 0 HA LYS A 117 -11.905 -9.588 -5.852 1.00 23.25 H new ATOM 0 HB2 LYS A 117 -12.224 -11.516 -7.225 1.00 74.02 H new ATOM 0 HB3 LYS A 117 -13.227 -11.705 -5.800 1.00 74.02 H new ATOM 0 HG2 LYS A 117 -15.237 -11.218 -7.032 1.00 33.10 H new ATOM 0 HG3 LYS A 117 -14.333 -10.656 -8.424 1.00 33.10 H new ATOM 0 HD2 LYS A 117 -15.168 -12.899 -8.875 1.00 71.41 H new ATOM 0 HD3 LYS A 117 -13.420 -12.953 -8.760 1.00 71.41 H new ATOM 0 HE2 LYS A 117 -14.330 -14.849 -7.553 1.00 21.24 H new ATOM 0 HE3 LYS A 117 -13.614 -13.745 -6.395 1.00 21.24 H new ATOM 0 HZ1 LYS A 117 -15.829 -14.635 -5.762 1.00 32.15 H new ATOM 0 HZ2 LYS A 117 -15.749 -12.939 -5.777 1.00 32.15 H new ATOM 0 HZ3 LYS A 117 -16.514 -13.764 -7.049 1.00 32.15 H new ATOM 1851 N LYS A 118 -13.973 -8.235 -8.023 1.00 72.22 N ATOM 1852 CA LYS A 118 -14.027 -7.321 -9.172 1.00 14.53 C ATOM 1853 C LYS A 118 -13.174 -6.069 -8.914 1.00 24.31 C ATOM 1854 O LYS A 118 -12.385 -5.655 -9.766 1.00 42.32 O ATOM 1855 CB LYS A 118 -15.478 -6.907 -9.470 1.00 13.03 C ATOM 1856 CG LYS A 118 -16.389 -8.069 -9.856 1.00 72.04 C ATOM 1857 CD LYS A 118 -15.976 -8.714 -11.175 1.00 2.33 C ATOM 1858 CE LYS A 118 -16.849 -9.917 -11.511 1.00 74.51 C ATOM 1859 NZ LYS A 118 -18.301 -9.584 -11.494 1.00 74.51 N ATOM 0 H LYS A 118 -14.872 -8.394 -7.568 1.00 72.22 H new ATOM 0 HA LYS A 118 -13.625 -7.849 -10.037 1.00 14.53 H new ATOM 0 HB2 LYS A 118 -15.891 -6.411 -8.591 1.00 13.03 H new ATOM 0 HB3 LYS A 118 -15.477 -6.175 -10.278 1.00 13.03 H new ATOM 0 HG2 LYS A 118 -16.372 -8.820 -9.066 1.00 72.04 H new ATOM 0 HG3 LYS A 118 -17.416 -7.712 -9.934 1.00 72.04 H new ATOM 0 HD2 LYS A 118 -16.045 -7.979 -11.977 1.00 2.33 H new ATOM 0 HD3 LYS A 118 -14.933 -9.026 -11.117 1.00 2.33 H new ATOM 0 HE2 LYS A 118 -16.577 -10.297 -12.496 1.00 74.51 H new ATOM 0 HE3 LYS A 118 -16.653 -10.716 -10.796 1.00 74.51 H new ATOM 0 HZ1 LYS A 118 -18.847 -10.391 -11.858 1.00 74.51 H new ATOM 0 HZ2 LYS A 118 -18.598 -9.377 -10.519 1.00 74.51 H new ATOM 0 HZ3 LYS A 118 -18.473 -8.751 -12.093 1.00 74.51 H new ATOM 1873 N LYS A 119 -13.334 -5.486 -7.727 1.00 31.41 N ATOM 1874 CA LYS A 119 -12.589 -4.284 -7.339 1.00 60.44 C ATOM 1875 C LYS A 119 -11.087 -4.566 -7.174 1.00 52.21 C ATOM 1876 O LYS A 119 -10.258 -3.927 -7.815 1.00 33.10 O ATOM 1877 CB LYS A 119 -13.154 -3.704 -6.034 1.00 30.15 C ATOM 1878 CG LYS A 119 -14.594 -3.213 -6.153 1.00 52.22 C ATOM 1879 CD LYS A 119 -15.145 -2.708 -4.821 1.00 2.20 C ATOM 1880 CE LYS A 119 -14.388 -1.488 -4.303 1.00 54.01 C ATOM 1881 NZ LYS A 119 -14.464 -0.340 -5.245 1.00 22.43 N ATOM 0 H LYS A 119 -13.976 -5.827 -7.012 1.00 31.41 H new ATOM 0 HA LYS A 119 -12.707 -3.558 -8.143 1.00 60.44 H new ATOM 0 HB2 LYS A 119 -13.102 -4.466 -5.256 1.00 30.15 H new ATOM 0 HB3 LYS A 119 -12.523 -2.876 -5.712 1.00 30.15 H new ATOM 0 HG2 LYS A 119 -14.643 -2.412 -6.891 1.00 52.22 H new ATOM 0 HG3 LYS A 119 -15.223 -4.024 -6.520 1.00 52.22 H new ATOM 0 HD2 LYS A 119 -16.199 -2.455 -4.939 1.00 2.20 H new ATOM 0 HD3 LYS A 119 -15.090 -3.507 -4.082 1.00 2.20 H new ATOM 0 HE2 LYS A 119 -14.797 -1.191 -3.337 1.00 54.01 H new ATOM 0 HE3 LYS A 119 -13.344 -1.753 -4.139 1.00 54.01 H new ATOM 0 HZ1 LYS A 119 -14.086 0.512 -4.785 1.00 22.43 H new ATOM 0 HZ2 LYS A 119 -13.904 -0.551 -6.096 1.00 22.43 H new ATOM 0 HZ3 LYS A 119 -15.455 -0.177 -5.515 1.00 22.43 H new ATOM 1895 N ILE A 120 -10.741 -5.527 -6.316 1.00 3.20 N ATOM 1896 CA ILE A 120 -9.332 -5.806 -6.006 1.00 55.51 C ATOM 1897 C ILE A 120 -8.562 -6.386 -7.214 1.00 34.32 C ATOM 1898 O ILE A 120 -7.415 -6.009 -7.459 1.00 52.42 O ATOM 1899 CB ILE A 120 -9.187 -6.751 -4.778 1.00 61.12 C ATOM 1900 CG1 ILE A 120 -7.710 -6.865 -4.356 1.00 10.14 C ATOM 1901 CG2 ILE A 120 -9.778 -8.128 -5.066 1.00 11.11 C ATOM 1902 CD1 ILE A 120 -7.083 -5.543 -3.948 1.00 34.54 C ATOM 0 H ILE A 120 -11.408 -6.122 -5.825 1.00 3.20 H new ATOM 0 HA ILE A 120 -8.885 -4.843 -5.759 1.00 55.51 H new ATOM 0 HB ILE A 120 -9.749 -6.317 -3.951 1.00 61.12 H new ATOM 0 HG12 ILE A 120 -7.633 -7.565 -3.524 1.00 10.14 H new ATOM 0 HG13 ILE A 120 -7.138 -7.288 -5.182 1.00 10.14 H new ATOM 0 HG21 ILE A 120 -9.661 -8.765 -4.189 1.00 11.11 H new ATOM 0 HG22 ILE A 120 -10.837 -8.027 -5.303 1.00 11.11 H new ATOM 0 HG23 ILE A 120 -9.258 -8.577 -5.912 1.00 11.11 H new ATOM 0 HD11 ILE A 120 -6.043 -5.706 -3.665 1.00 34.54 H new ATOM 0 HD12 ILE A 120 -7.126 -4.846 -4.785 1.00 34.54 H new ATOM 0 HD13 ILE A 120 -7.629 -5.127 -3.101 1.00 34.54 H new ATOM 1914 N GLN A 121 -9.190 -7.288 -7.976 1.00 15.15 N ATOM 1915 CA GLN A 121 -8.551 -7.851 -9.175 1.00 54.32 C ATOM 1916 C GLN A 121 -8.397 -6.779 -10.263 1.00 61.04 C ATOM 1917 O GLN A 121 -7.335 -6.650 -10.867 1.00 71.20 O ATOM 1918 CB GLN A 121 -9.340 -9.071 -9.692 1.00 55.31 C ATOM 1919 CG GLN A 121 -8.876 -9.618 -11.047 1.00 32.30 C ATOM 1920 CD GLN A 121 -9.591 -8.972 -12.228 1.00 2.02 C ATOM 1921 OE1 GLN A 121 -10.747 -8.570 -12.125 1.00 4.33 O ATOM 1922 NE2 GLN A 121 -8.914 -8.866 -13.351 1.00 52.00 N ATOM 0 H GLN A 121 -10.128 -7.642 -7.789 1.00 15.15 H new ATOM 0 HA GLN A 121 -7.552 -8.194 -8.905 1.00 54.32 H new ATOM 0 HB2 GLN A 121 -9.271 -9.869 -8.953 1.00 55.31 H new ATOM 0 HB3 GLN A 121 -10.392 -8.798 -9.769 1.00 55.31 H new ATOM 0 HG2 GLN A 121 -7.802 -9.459 -11.148 1.00 32.30 H new ATOM 0 HG3 GLN A 121 -9.042 -10.695 -11.074 1.00 32.30 H new ATOM 0 HE21 GLN A 121 -7.955 -9.210 -13.403 1.00 52.00 H new ATOM 0 HE22 GLN A 121 -9.348 -8.440 -14.170 1.00 52.00 H new ATOM 1931 N GLY A 122 -9.455 -6.004 -10.502 1.00 71.11 N ATOM 1932 CA GLY A 122 -9.358 -4.875 -11.424 1.00 52.31 C ATOM 1933 C GLY A 122 -8.287 -3.875 -10.995 1.00 24.23 C ATOM 1934 O GLY A 122 -7.519 -3.374 -11.822 1.00 24.31 O ATOM 0 H GLY A 122 -10.373 -6.134 -10.078 1.00 71.11 H new ATOM 0 HA2 GLY A 122 -9.130 -5.243 -12.424 1.00 52.31 H new ATOM 0 HA3 GLY A 122 -10.322 -4.370 -11.482 1.00 52.31 H new ATOM 1938 N TRP A 123 -8.230 -3.607 -9.689 1.00 61.23 N ATOM 1939 CA TRP A 123 -7.229 -2.704 -9.116 1.00 62.01 C ATOM 1940 C TRP A 123 -5.800 -3.191 -9.393 1.00 43.43 C ATOM 1941 O TRP A 123 -4.994 -2.450 -9.936 1.00 21.22 O ATOM 1942 CB TRP A 123 -7.451 -2.550 -7.604 1.00 3.40 C ATOM 1943 CG TRP A 123 -6.399 -1.728 -6.908 1.00 44.01 C ATOM 1944 CD1 TRP A 123 -5.451 -2.179 -6.032 1.00 55.31 C ATOM 1945 CD2 TRP A 123 -6.185 -0.315 -7.032 1.00 2.34 C ATOM 1946 NE1 TRP A 123 -4.669 -1.136 -5.603 1.00 31.33 N ATOM 1947 CE2 TRP A 123 -5.093 0.016 -6.206 1.00 43.43 C ATOM 1948 CE3 TRP A 123 -6.802 0.703 -7.768 1.00 14.22 C ATOM 1949 CZ2 TRP A 123 -4.615 1.320 -6.087 1.00 52.04 C ATOM 1950 CZ3 TRP A 123 -6.326 1.996 -7.647 1.00 51.41 C ATOM 1951 CH2 TRP A 123 -5.239 2.293 -6.817 1.00 62.21 C ATOM 0 H TRP A 123 -8.871 -4.006 -9.003 1.00 61.23 H new ATOM 0 HA TRP A 123 -7.349 -1.733 -9.597 1.00 62.01 H new ATOM 0 HB2 TRP A 123 -8.425 -2.091 -7.436 1.00 3.40 H new ATOM 0 HB3 TRP A 123 -7.482 -3.540 -7.150 1.00 3.40 H new ATOM 0 HD1 TRP A 123 -5.334 -3.207 -5.722 1.00 55.31 H new ATOM 0 HE1 TRP A 123 -3.896 -1.208 -4.941 1.00 31.33 H new ATOM 0 HE3 TRP A 123 -7.635 0.483 -8.419 1.00 14.22 H new ATOM 0 HZ2 TRP A 123 -3.781 1.553 -5.441 1.00 52.04 H new ATOM 0 HZ3 TRP A 123 -6.802 2.791 -8.203 1.00 51.41 H new ATOM 0 HH2 TRP A 123 -4.886 3.312 -6.752 1.00 62.21 H new ATOM 1962 N VAL A 124 -5.491 -4.440 -9.030 1.00 11.34 N ATOM 1963 CA VAL A 124 -4.131 -4.974 -9.210 1.00 40.25 C ATOM 1964 C VAL A 124 -3.731 -5.080 -10.695 1.00 62.35 C ATOM 1965 O VAL A 124 -2.579 -4.833 -11.046 1.00 63.42 O ATOM 1966 CB VAL A 124 -3.939 -6.352 -8.517 1.00 62.32 C ATOM 1967 CG1 VAL A 124 -4.097 -6.220 -7.003 1.00 75.54 C ATOM 1968 CG2 VAL A 124 -4.902 -7.393 -9.078 1.00 71.12 C ATOM 0 H VAL A 124 -6.153 -5.096 -8.615 1.00 11.34 H new ATOM 0 HA VAL A 124 -3.472 -4.252 -8.728 1.00 40.25 H new ATOM 0 HB VAL A 124 -2.926 -6.695 -8.726 1.00 62.32 H new ATOM 0 HG11 VAL A 124 -3.959 -7.195 -6.536 1.00 75.54 H new ATOM 0 HG12 VAL A 124 -3.351 -5.525 -6.619 1.00 75.54 H new ATOM 0 HG13 VAL A 124 -5.094 -5.845 -6.773 1.00 75.54 H new ATOM 0 HG21 VAL A 124 -4.743 -8.346 -8.573 1.00 71.12 H new ATOM 0 HG22 VAL A 124 -5.928 -7.064 -8.916 1.00 71.12 H new ATOM 0 HG23 VAL A 124 -4.724 -7.515 -10.146 1.00 71.12 H new ATOM 1978 N VAL A 125 -4.677 -5.434 -11.570 1.00 23.21 N ATOM 1979 CA VAL A 125 -4.395 -5.499 -13.013 1.00 1.45 C ATOM 1980 C VAL A 125 -3.932 -4.134 -13.550 1.00 12.51 C ATOM 1981 O VAL A 125 -2.974 -4.047 -14.322 1.00 1.23 O ATOM 1982 CB VAL A 125 -5.625 -5.990 -13.823 1.00 1.53 C ATOM 1983 CG1 VAL A 125 -5.376 -5.880 -15.329 1.00 64.40 C ATOM 1984 CG2 VAL A 125 -5.974 -7.429 -13.444 1.00 22.54 C ATOM 0 H VAL A 125 -5.633 -5.678 -11.313 1.00 23.21 H new ATOM 0 HA VAL A 125 -3.591 -6.223 -13.142 1.00 1.45 H new ATOM 0 HB VAL A 125 -6.469 -5.347 -13.574 1.00 1.53 H new ATOM 0 HG11 VAL A 125 -6.255 -6.231 -15.870 1.00 64.40 H new ATOM 0 HG12 VAL A 125 -5.181 -4.840 -15.590 1.00 64.40 H new ATOM 0 HG13 VAL A 125 -4.515 -6.490 -15.601 1.00 64.40 H new ATOM 0 HG21 VAL A 125 -6.838 -7.758 -14.021 1.00 22.54 H new ATOM 0 HG22 VAL A 125 -5.125 -8.078 -13.660 1.00 22.54 H new ATOM 0 HG23 VAL A 125 -6.207 -7.479 -12.380 1.00 22.54 H new ATOM 1994 N SER A 126 -4.610 -3.070 -13.126 1.00 35.43 N ATOM 1995 CA SER A 126 -4.221 -1.703 -13.504 1.00 34.01 C ATOM 1996 C SER A 126 -2.990 -1.238 -12.710 1.00 22.34 C ATOM 1997 O SER A 126 -2.106 -0.577 -13.242 1.00 74.10 O ATOM 1998 CB SER A 126 -5.390 -0.729 -13.276 1.00 71.43 C ATOM 1999 OG SER A 126 -5.064 0.588 -13.698 1.00 71.53 O ATOM 0 H SER A 126 -5.430 -3.122 -12.522 1.00 35.43 H new ATOM 0 HA SER A 126 -3.964 -1.710 -14.563 1.00 34.01 H new ATOM 0 HB2 SER A 126 -6.267 -1.079 -13.820 1.00 71.43 H new ATOM 0 HB3 SER A 126 -5.654 -0.718 -12.219 1.00 71.43 H new ATOM 0 HG SER A 126 -4.417 0.981 -13.075 1.00 71.53 H new ATOM 2005 N LEU A 127 -2.931 -1.624 -11.438 1.00 25.34 N ATOM 2006 CA LEU A 127 -1.837 -1.238 -10.534 1.00 33.43 C ATOM 2007 C LEU A 127 -0.478 -1.755 -11.033 1.00 52.12 C ATOM 2008 O LEU A 127 0.555 -1.111 -10.845 1.00 0.45 O ATOM 2009 CB LEU A 127 -2.117 -1.782 -9.124 1.00 42.24 C ATOM 2010 CG LEU A 127 -1.101 -1.398 -8.033 1.00 75.52 C ATOM 2011 CD1 LEU A 127 -1.108 0.108 -7.784 1.00 22.20 C ATOM 2012 CD2 LEU A 127 -1.384 -2.163 -6.740 1.00 21.31 C ATOM 0 H LEU A 127 -3.638 -2.214 -10.999 1.00 25.34 H new ATOM 0 HA LEU A 127 -1.789 -0.149 -10.509 1.00 33.43 H new ATOM 0 HB2 LEU A 127 -3.102 -1.435 -8.812 1.00 42.24 H new ATOM 0 HB3 LEU A 127 -2.165 -2.870 -9.180 1.00 42.24 H new ATOM 0 HG LEU A 127 -0.107 -1.675 -8.384 1.00 75.52 H new ATOM 0 HD11 LEU A 127 -0.381 0.352 -7.009 1.00 22.20 H new ATOM 0 HD12 LEU A 127 -0.846 0.630 -8.704 1.00 22.20 H new ATOM 0 HD13 LEU A 127 -2.101 0.419 -7.461 1.00 22.20 H new ATOM 0 HD21 LEU A 127 -0.655 -1.878 -5.981 1.00 21.31 H new ATOM 0 HD22 LEU A 127 -2.387 -1.923 -6.388 1.00 21.31 H new ATOM 0 HD23 LEU A 127 -1.312 -3.234 -6.928 1.00 21.31 H new ATOM 2024 N LEU A 128 -0.488 -2.923 -11.668 1.00 41.32 N ATOM 2025 CA LEU A 128 0.739 -3.530 -12.193 1.00 13.33 C ATOM 2026 C LEU A 128 1.044 -3.061 -13.629 1.00 2.21 C ATOM 2027 O LEU A 128 2.003 -3.529 -14.246 1.00 12.34 O ATOM 2028 CB LEU A 128 0.638 -5.063 -12.140 1.00 31.52 C ATOM 2029 CG LEU A 128 0.340 -5.660 -10.749 1.00 4.23 C ATOM 2030 CD1 LEU A 128 0.340 -7.185 -10.804 1.00 13.44 C ATOM 2031 CD2 LEU A 128 1.333 -5.148 -9.702 1.00 50.44 C ATOM 0 H LEU A 128 -1.332 -3.472 -11.834 1.00 41.32 H new ATOM 0 HA LEU A 128 1.565 -3.203 -11.561 1.00 13.33 H new ATOM 0 HB2 LEU A 128 -0.144 -5.382 -12.829 1.00 31.52 H new ATOM 0 HB3 LEU A 128 1.575 -5.484 -12.504 1.00 31.52 H new ATOM 0 HG LEU A 128 -0.655 -5.331 -10.449 1.00 4.23 H new ATOM 0 HD11 LEU A 128 0.128 -7.585 -9.812 1.00 13.44 H new ATOM 0 HD12 LEU A 128 -0.424 -7.524 -11.503 1.00 13.44 H new ATOM 0 HD13 LEU A 128 1.317 -7.537 -11.136 1.00 13.44 H new ATOM 0 HD21 LEU A 128 1.097 -5.586 -8.732 1.00 50.44 H new ATOM 0 HD22 LEU A 128 2.345 -5.431 -9.992 1.00 50.44 H new ATOM 0 HD23 LEU A 128 1.264 -4.062 -9.636 1.00 50.44 H new ATOM 2043 N ALA A 129 0.220 -2.151 -14.162 1.00 62.30 N ATOM 2044 CA ALA A 129 0.424 -1.614 -15.518 1.00 44.53 C ATOM 2045 C ALA A 129 1.814 -0.968 -15.670 1.00 43.52 C ATOM 2046 O ALA A 129 2.045 0.164 -15.229 1.00 41.11 O ATOM 2047 CB ALA A 129 -0.668 -0.607 -15.866 1.00 71.55 C ATOM 0 H ALA A 129 -0.593 -1.770 -13.678 1.00 62.30 H new ATOM 0 HA ALA A 129 0.368 -2.451 -16.214 1.00 44.53 H new ATOM 0 HB1 ALA A 129 -0.500 -0.221 -16.872 1.00 71.55 H new ATOM 0 HB2 ALA A 129 -1.641 -1.096 -15.823 1.00 71.55 H new ATOM 0 HB3 ALA A 129 -0.644 0.217 -15.153 1.00 71.55 H new ATOM 2053 N LYS A 130 2.721 -1.693 -16.322 1.00 25.44 N ATOM 2054 CA LYS A 130 4.136 -1.297 -16.428 1.00 5.55 C ATOM 2055 C LYS A 130 4.355 0.036 -17.172 1.00 72.30 C ATOM 2056 O LYS A 130 5.463 0.572 -17.161 1.00 34.13 O ATOM 2057 CB LYS A 130 4.939 -2.405 -17.123 1.00 71.35 C ATOM 2058 CG LYS A 130 4.441 -2.752 -18.525 1.00 63.33 C ATOM 2059 CD LYS A 130 5.316 -3.805 -19.217 1.00 22.21 C ATOM 2060 CE LYS A 130 5.228 -5.187 -18.563 1.00 24.33 C ATOM 2061 NZ LYS A 130 5.868 -5.235 -17.218 1.00 13.34 N ATOM 0 H LYS A 130 2.503 -2.571 -16.793 1.00 25.44 H new ATOM 0 HA LYS A 130 4.485 -1.147 -15.406 1.00 5.55 H new ATOM 0 HB2 LYS A 130 5.983 -2.097 -17.186 1.00 71.35 H new ATOM 0 HB3 LYS A 130 4.908 -3.303 -16.506 1.00 71.35 H new ATOM 0 HG2 LYS A 130 3.417 -3.120 -18.462 1.00 63.33 H new ATOM 0 HG3 LYS A 130 4.418 -1.847 -19.133 1.00 63.33 H new ATOM 0 HD2 LYS A 130 5.018 -3.885 -20.262 1.00 22.21 H new ATOM 0 HD3 LYS A 130 6.353 -3.470 -19.206 1.00 22.21 H new ATOM 0 HE2 LYS A 130 4.180 -5.474 -18.472 1.00 24.33 H new ATOM 0 HE3 LYS A 130 5.704 -5.922 -19.213 1.00 24.33 H new ATOM 0 HZ1 LYS A 130 6.339 -6.153 -17.090 1.00 13.34 H new ATOM 0 HZ2 LYS A 130 6.570 -4.472 -17.140 1.00 13.34 H new ATOM 0 HZ3 LYS A 130 5.142 -5.113 -16.483 1.00 13.34 H new ATOM 2075 N ASP A 131 3.322 0.556 -17.827 1.00 74.32 N ATOM 2076 CA ASP A 131 3.439 1.821 -18.565 1.00 24.23 C ATOM 2077 C ASP A 131 2.989 3.038 -17.732 1.00 33.20 C ATOM 2078 O ASP A 131 3.704 4.037 -17.649 1.00 23.45 O ATOM 2079 CB ASP A 131 2.620 1.728 -19.860 1.00 4.24 C ATOM 2080 CG ASP A 131 2.308 3.085 -20.462 1.00 64.04 C ATOM 2081 OD1 ASP A 131 3.189 3.662 -21.129 1.00 32.23 O ATOM 2082 OD2 ASP A 131 1.177 3.581 -20.263 1.00 34.33 O ATOM 0 H ASP A 131 2.397 0.128 -17.866 1.00 74.32 H new ATOM 0 HA ASP A 131 4.493 1.975 -18.797 1.00 24.23 H new ATOM 0 HB2 ASP A 131 3.169 1.131 -20.588 1.00 4.24 H new ATOM 0 HB3 ASP A 131 1.686 1.204 -19.656 1.00 4.24 H new ATOM 2087 N ARG A 132 1.823 2.947 -17.098 1.00 15.04 N ATOM 2088 CA ARG A 132 1.233 4.105 -16.410 1.00 22.45 C ATOM 2089 C ARG A 132 1.631 4.147 -14.928 1.00 74.31 C ATOM 2090 O ARG A 132 2.195 5.130 -14.447 1.00 60.10 O ATOM 2091 CB ARG A 132 -0.298 4.070 -16.559 1.00 61.31 C ATOM 2092 CG ARG A 132 -0.969 5.440 -16.480 1.00 51.33 C ATOM 2093 CD ARG A 132 -0.408 6.403 -17.529 1.00 51.21 C ATOM 2094 NE ARG A 132 -0.245 5.765 -18.838 1.00 14.15 N ATOM 2095 CZ ARG A 132 -0.869 6.124 -19.926 1.00 65.00 C ATOM 2096 NH1 ARG A 132 -1.735 7.087 -19.914 1.00 51.23 N ATOM 2097 NH2 ARG A 132 -0.619 5.506 -21.030 1.00 62.12 N ATOM 0 H ARG A 132 1.267 2.093 -17.043 1.00 15.04 H new ATOM 0 HA ARG A 132 1.621 5.012 -16.874 1.00 22.45 H new ATOM 0 HB2 ARG A 132 -0.548 3.611 -17.515 1.00 61.31 H new ATOM 0 HB3 ARG A 132 -0.713 3.430 -15.780 1.00 61.31 H new ATOM 0 HG2 ARG A 132 -2.044 5.328 -16.625 1.00 51.33 H new ATOM 0 HG3 ARG A 132 -0.824 5.860 -15.485 1.00 51.33 H new ATOM 0 HD2 ARG A 132 -1.074 7.260 -17.625 1.00 51.21 H new ATOM 0 HD3 ARG A 132 0.555 6.785 -17.191 1.00 51.21 H new ATOM 0 HE ARG A 132 0.405 4.982 -18.903 1.00 14.15 H new ATOM 0 HH11 ARG A 132 -1.939 7.579 -19.044 1.00 51.23 H new ATOM 0 HH12 ARG A 132 -2.213 7.354 -20.775 1.00 51.23 H new ATOM 0 HH21 ARG A 132 0.060 4.745 -21.046 1.00 62.12 H new ATOM 0 HH22 ARG A 132 -1.101 5.778 -21.887 1.00 62.12 H new ATOM 2111 N PHE A 133 1.346 3.067 -14.211 1.00 70.31 N ATOM 2112 CA PHE A 133 1.667 2.975 -12.781 1.00 51.30 C ATOM 2113 C PHE A 133 3.181 2.841 -12.538 1.00 54.40 C ATOM 2114 O PHE A 133 3.645 2.855 -11.401 1.00 55.54 O ATOM 2115 CB PHE A 133 0.892 1.819 -12.146 1.00 65.42 C ATOM 2116 CG PHE A 133 -0.592 2.095 -12.053 1.00 63.00 C ATOM 2117 CD1 PHE A 133 -1.349 2.290 -13.199 1.00 32.11 C ATOM 2118 CD2 PHE A 133 -1.227 2.164 -10.822 1.00 22.31 C ATOM 2119 CE1 PHE A 133 -2.702 2.550 -13.119 1.00 44.23 C ATOM 2120 CE2 PHE A 133 -2.581 2.421 -10.737 1.00 74.34 C ATOM 2121 CZ PHE A 133 -3.319 2.614 -11.886 1.00 21.44 C ATOM 0 H PHE A 133 0.892 2.237 -14.592 1.00 70.31 H new ATOM 0 HA PHE A 133 1.359 3.905 -12.303 1.00 51.30 H new ATOM 0 HB2 PHE A 133 1.053 0.914 -12.731 1.00 65.42 H new ATOM 0 HB3 PHE A 133 1.285 1.628 -11.148 1.00 65.42 H new ATOM 0 HD1 PHE A 133 -0.873 2.238 -14.167 1.00 32.11 H new ATOM 0 HD2 PHE A 133 -0.655 2.015 -9.918 1.00 22.31 H new ATOM 0 HE1 PHE A 133 -3.277 2.703 -14.020 1.00 44.23 H new ATOM 0 HE2 PHE A 133 -3.062 2.471 -9.771 1.00 74.34 H new ATOM 0 HZ PHE A 133 -4.378 2.815 -11.821 1.00 21.44 H new ATOM 2131 N LYS A 134 3.940 2.707 -13.624 1.00 33.31 N ATOM 2132 CA LYS A 134 5.409 2.734 -13.578 1.00 34.42 C ATOM 2133 C LYS A 134 5.943 3.950 -12.789 1.00 51.51 C ATOM 2134 O LYS A 134 7.070 3.936 -12.295 1.00 11.43 O ATOM 2135 CB LYS A 134 5.949 2.754 -15.019 1.00 12.12 C ATOM 2136 CG LYS A 134 7.472 2.817 -15.136 1.00 25.20 C ATOM 2137 CD LYS A 134 7.937 2.630 -16.582 1.00 31.04 C ATOM 2138 CE LYS A 134 7.390 3.707 -17.519 1.00 40.14 C ATOM 2139 NZ LYS A 134 8.041 5.028 -17.303 1.00 33.40 N ATOM 0 H LYS A 134 3.559 2.577 -14.561 1.00 33.31 H new ATOM 0 HA LYS A 134 5.755 1.841 -13.056 1.00 34.42 H new ATOM 0 HB2 LYS A 134 5.596 1.862 -15.536 1.00 12.12 H new ATOM 0 HB3 LYS A 134 5.524 3.612 -15.539 1.00 12.12 H new ATOM 0 HG2 LYS A 134 7.826 3.777 -14.761 1.00 25.20 H new ATOM 0 HG3 LYS A 134 7.917 2.046 -14.508 1.00 25.20 H new ATOM 0 HD2 LYS A 134 9.026 2.645 -16.614 1.00 31.04 H new ATOM 0 HD3 LYS A 134 7.621 1.649 -16.938 1.00 31.04 H new ATOM 0 HE2 LYS A 134 7.539 3.396 -18.553 1.00 40.14 H new ATOM 0 HE3 LYS A 134 6.315 3.805 -17.368 1.00 40.14 H new ATOM 0 HZ1 LYS A 134 7.638 5.725 -17.961 1.00 33.40 H new ATOM 0 HZ2 LYS A 134 7.877 5.340 -16.324 1.00 33.40 H new ATOM 0 HZ3 LYS A 134 9.064 4.943 -17.473 1.00 33.40 H new ATOM 2153 N ASN A 135 5.123 4.992 -12.663 1.00 32.51 N ATOM 2154 CA ASN A 135 5.512 6.216 -11.949 1.00 64.20 C ATOM 2155 C ASN A 135 5.342 6.099 -10.417 1.00 55.31 C ATOM 2156 O ASN A 135 5.487 7.089 -9.697 1.00 13.21 O ATOM 2157 CB ASN A 135 4.691 7.400 -12.473 1.00 21.04 C ATOM 2158 CG ASN A 135 4.900 7.651 -13.958 1.00 74.41 C ATOM 2159 OD1 ASN A 135 6.092 7.375 -14.453 1.00 61.43 O flip ATOM 2160 ND2 ASN A 135 3.999 8.100 -14.659 1.00 21.02 N flip ATOM 0 H ASN A 135 4.178 5.017 -13.047 1.00 32.51 H new ATOM 0 HA ASN A 135 6.573 6.375 -12.140 1.00 64.20 H new ATOM 0 HB2 ASN A 135 3.633 7.214 -12.286 1.00 21.04 H new ATOM 0 HB3 ASN A 135 4.960 8.298 -11.916 1.00 21.04 H new ATOM 0 HD21 ASN A 135 3.087 8.304 -14.249 1.00 21.02 H new ATOM 0 HD22 ASN A 135 4.161 8.269 -15.652 1.00 21.02 H new ATOM 2167 N LEU A 136 5.064 4.893 -9.915 1.00 32.01 N ATOM 2168 CA LEU A 136 4.861 4.687 -8.474 1.00 43.42 C ATOM 2169 C LEU A 136 6.182 4.395 -7.749 1.00 72.30 C ATOM 2170 O LEU A 136 7.008 3.613 -8.223 1.00 31.13 O ATOM 2171 CB LEU A 136 3.890 3.521 -8.224 1.00 71.22 C ATOM 2172 CG LEU A 136 2.454 3.724 -8.731 1.00 71.00 C ATOM 2173 CD1 LEU A 136 1.607 2.489 -8.442 1.00 75.25 C ATOM 2174 CD2 LEU A 136 1.829 4.966 -8.109 1.00 60.41 C ATOM 0 H LEU A 136 4.974 4.048 -10.479 1.00 32.01 H new ATOM 0 HA LEU A 136 4.441 5.612 -8.079 1.00 43.42 H new ATOM 0 HB2 LEU A 136 4.298 2.626 -8.695 1.00 71.22 H new ATOM 0 HB3 LEU A 136 3.852 3.328 -7.152 1.00 71.22 H new ATOM 0 HG LEU A 136 2.490 3.871 -9.810 1.00 71.00 H new ATOM 0 HD11 LEU A 136 0.593 2.650 -8.808 1.00 75.25 H new ATOM 0 HD12 LEU A 136 2.041 1.624 -8.944 1.00 75.25 H new ATOM 0 HD13 LEU A 136 1.581 2.309 -7.367 1.00 75.25 H new ATOM 0 HD21 LEU A 136 0.813 5.088 -8.483 1.00 60.41 H new ATOM 0 HD22 LEU A 136 1.806 4.857 -7.025 1.00 60.41 H new ATOM 0 HD23 LEU A 136 2.421 5.842 -8.373 1.00 60.41 H new ATOM 2186 N ALA A 137 6.370 5.029 -6.595 1.00 12.43 N ATOM 2187 CA ALA A 137 7.544 4.786 -5.756 1.00 62.42 C ATOM 2188 C ALA A 137 7.182 3.859 -4.591 1.00 23.22 C ATOM 2189 O ALA A 137 6.329 4.188 -3.764 1.00 14.21 O ATOM 2190 CB ALA A 137 8.102 6.105 -5.234 1.00 61.44 C ATOM 0 H ALA A 137 5.721 5.719 -6.216 1.00 12.43 H new ATOM 0 HA ALA A 137 8.311 4.300 -6.360 1.00 62.42 H new ATOM 0 HB1 ALA A 137 8.975 5.910 -4.611 1.00 61.44 H new ATOM 0 HB2 ALA A 137 8.390 6.736 -6.075 1.00 61.44 H new ATOM 0 HB3 ALA A 137 7.341 6.613 -4.642 1.00 61.44 H new ATOM 2196 N PHE A 138 7.817 2.696 -4.532 1.00 64.44 N ATOM 2197 CA PHE A 138 7.497 1.693 -3.518 1.00 13.41 C ATOM 2198 C PHE A 138 8.461 1.775 -2.332 1.00 73.14 C ATOM 2199 O PHE A 138 9.633 1.425 -2.444 1.00 23.34 O ATOM 2200 CB PHE A 138 7.537 0.301 -4.151 1.00 23.20 C ATOM 2201 CG PHE A 138 6.609 0.166 -5.334 1.00 24.35 C ATOM 2202 CD1 PHE A 138 5.232 0.167 -5.152 1.00 32.51 C ATOM 2203 CD2 PHE A 138 7.109 0.050 -6.623 1.00 14.43 C ATOM 2204 CE1 PHE A 138 4.378 0.051 -6.232 1.00 51.14 C ATOM 2205 CE2 PHE A 138 6.256 -0.065 -7.704 1.00 51.33 C ATOM 2206 CZ PHE A 138 4.889 -0.064 -7.507 1.00 41.22 C ATOM 0 H PHE A 138 8.559 2.421 -5.175 1.00 64.44 H new ATOM 0 HA PHE A 138 6.495 1.888 -3.137 1.00 13.41 H new ATOM 0 HB2 PHE A 138 8.556 0.081 -4.468 1.00 23.20 H new ATOM 0 HB3 PHE A 138 7.270 -0.442 -3.400 1.00 23.20 H new ATOM 0 HD1 PHE A 138 4.825 0.259 -4.156 1.00 32.51 H new ATOM 0 HD2 PHE A 138 8.177 0.050 -6.783 1.00 14.43 H new ATOM 0 HE1 PHE A 138 3.309 0.050 -6.077 1.00 51.14 H new ATOM 0 HE2 PHE A 138 6.658 -0.156 -8.702 1.00 51.33 H new ATOM 0 HZ PHE A 138 4.221 -0.153 -8.351 1.00 41.22 H new ATOM 2216 N PHE A 139 7.965 2.258 -1.200 1.00 10.35 N ATOM 2217 CA PHE A 139 8.786 2.383 0.007 1.00 11.21 C ATOM 2218 C PHE A 139 8.556 1.207 0.968 1.00 40.33 C ATOM 2219 O PHE A 139 7.430 0.935 1.381 1.00 73.33 O ATOM 2220 CB PHE A 139 8.495 3.711 0.718 1.00 12.23 C ATOM 2221 CG PHE A 139 9.040 4.925 0.003 1.00 64.12 C ATOM 2222 CD1 PHE A 139 8.426 5.413 -1.139 1.00 61.45 C ATOM 2223 CD2 PHE A 139 10.162 5.584 0.486 1.00 71.23 C ATOM 2224 CE1 PHE A 139 8.915 6.533 -1.782 1.00 73.10 C ATOM 2225 CE2 PHE A 139 10.658 6.703 -0.156 1.00 22.41 C ATOM 2226 CZ PHE A 139 10.033 7.178 -1.291 1.00 24.33 C ATOM 0 H PHE A 139 7.000 2.570 -1.088 1.00 10.35 H new ATOM 0 HA PHE A 139 9.831 2.366 -0.301 1.00 11.21 H new ATOM 0 HB2 PHE A 139 7.416 3.822 0.830 1.00 12.23 H new ATOM 0 HB3 PHE A 139 8.918 3.674 1.722 1.00 12.23 H new ATOM 0 HD1 PHE A 139 7.554 4.911 -1.531 1.00 61.45 H new ATOM 0 HD2 PHE A 139 10.654 5.218 1.375 1.00 71.23 H new ATOM 0 HE1 PHE A 139 8.423 6.904 -2.669 1.00 73.10 H new ATOM 0 HE2 PHE A 139 11.533 7.205 0.230 1.00 22.41 H new ATOM 0 HZ PHE A 139 10.418 8.053 -1.794 1.00 24.33 H new ATOM 2236 N ILE A 140 9.634 0.522 1.328 1.00 73.44 N ATOM 2237 CA ILE A 140 9.566 -0.621 2.243 1.00 52.32 C ATOM 2238 C ILE A 140 10.686 -0.552 3.291 1.00 3.11 C ATOM 2239 O ILE A 140 11.761 -0.019 3.020 1.00 15.10 O ATOM 2240 CB ILE A 140 9.649 -1.964 1.465 1.00 55.55 C ATOM 2241 CG1 ILE A 140 9.617 -3.169 2.429 1.00 24.43 C ATOM 2242 CG2 ILE A 140 10.896 -2.002 0.580 1.00 72.30 C ATOM 2243 CD1 ILE A 140 9.654 -4.515 1.733 1.00 62.11 C ATOM 0 H ILE A 140 10.575 0.737 0.999 1.00 73.44 H new ATOM 0 HA ILE A 140 8.605 -0.575 2.755 1.00 52.32 H new ATOM 0 HB ILE A 140 8.774 -2.033 0.819 1.00 55.55 H new ATOM 0 HG12 ILE A 140 10.466 -3.100 3.110 1.00 24.43 H new ATOM 0 HG13 ILE A 140 8.715 -3.111 3.038 1.00 24.43 H new ATOM 0 HG21 ILE A 140 10.934 -2.951 0.045 1.00 72.30 H new ATOM 0 HG22 ILE A 140 10.858 -1.182 -0.137 1.00 72.30 H new ATOM 0 HG23 ILE A 140 11.786 -1.900 1.201 1.00 72.30 H new ATOM 0 HD11 ILE A 140 9.628 -5.311 2.478 1.00 62.11 H new ATOM 0 HD12 ILE A 140 8.791 -4.607 1.074 1.00 62.11 H new ATOM 0 HD13 ILE A 140 10.569 -4.596 1.147 1.00 62.11 H new ATOM 2255 N GLY A 141 10.422 -1.070 4.493 1.00 3.51 N ATOM 2256 CA GLY A 141 11.428 -1.076 5.555 1.00 23.40 C ATOM 2257 C GLY A 141 12.784 -1.595 5.083 1.00 21.11 C ATOM 2258 O GLY A 141 12.887 -2.726 4.600 1.00 45.54 O ATOM 0 H GLY A 141 9.528 -1.487 4.753 1.00 3.51 H new ATOM 0 HA2 GLY A 141 11.546 -0.064 5.943 1.00 23.40 H new ATOM 0 HA3 GLY A 141 11.075 -1.694 6.380 1.00 23.40 H new ATOM 2262 N GLU A 142 13.824 -0.772 5.223 1.00 73.30 N ATOM 2263 CA GLU A 142 15.167 -1.108 4.718 1.00 24.43 C ATOM 2264 C GLU A 142 15.690 -2.460 5.252 1.00 53.24 C ATOM 2265 O GLU A 142 16.417 -3.171 4.552 1.00 45.22 O ATOM 2266 CB GLU A 142 16.160 0.046 5.005 1.00 41.40 C ATOM 2267 CG GLU A 142 15.979 0.747 6.357 1.00 32.21 C ATOM 2268 CD GLU A 142 16.555 -0.026 7.534 1.00 44.21 C ATOM 2269 OE1 GLU A 142 17.762 0.138 7.827 1.00 23.33 O ATOM 2270 OE2 GLU A 142 15.805 -0.792 8.174 1.00 43.22 O ATOM 0 H GLU A 142 13.767 0.137 5.683 1.00 73.30 H new ATOM 0 HA GLU A 142 15.083 -1.229 3.638 1.00 24.43 H new ATOM 0 HB2 GLU A 142 17.175 -0.349 4.952 1.00 41.40 H new ATOM 0 HB3 GLU A 142 16.066 0.790 4.214 1.00 41.40 H new ATOM 0 HG2 GLU A 142 16.452 1.728 6.313 1.00 32.21 H new ATOM 0 HG3 GLU A 142 14.916 0.913 6.530 1.00 32.21 H new ATOM 2277 N ARG A 143 15.306 -2.814 6.477 1.00 14.33 N ATOM 2278 CA ARG A 143 15.621 -4.136 7.044 1.00 74.25 C ATOM 2279 C ARG A 143 15.000 -5.282 6.221 1.00 62.54 C ATOM 2280 O ARG A 143 15.624 -6.327 6.023 1.00 24.15 O ATOM 2281 CB ARG A 143 15.134 -4.222 8.500 1.00 72.01 C ATOM 2282 CG ARG A 143 13.706 -3.718 8.701 1.00 0.11 C ATOM 2283 CD ARG A 143 13.176 -4.034 10.097 1.00 3.22 C ATOM 2284 NE ARG A 143 12.910 -5.461 10.276 1.00 12.12 N ATOM 2285 CZ ARG A 143 12.179 -5.957 11.237 1.00 45.54 C ATOM 2286 NH1 ARG A 143 11.657 -5.191 12.140 1.00 51.13 N ATOM 2287 NH2 ARG A 143 11.969 -7.226 11.287 1.00 12.44 N ATOM 0 H ARG A 143 14.775 -2.207 7.102 1.00 14.33 H new ATOM 0 HA ARG A 143 16.705 -4.250 7.012 1.00 74.25 H new ATOM 0 HB2 ARG A 143 15.194 -5.258 8.833 1.00 72.01 H new ATOM 0 HB3 ARG A 143 15.807 -3.644 9.133 1.00 72.01 H new ATOM 0 HG2 ARG A 143 13.676 -2.641 8.538 1.00 0.11 H new ATOM 0 HG3 ARG A 143 13.054 -4.172 7.955 1.00 0.11 H new ATOM 0 HD2 ARG A 143 13.900 -3.705 10.842 1.00 3.22 H new ATOM 0 HD3 ARG A 143 12.260 -3.470 10.272 1.00 3.22 H new ATOM 0 HE ARG A 143 13.322 -6.111 9.607 1.00 12.12 H new ATOM 0 HH11 ARG A 143 11.814 -4.184 12.107 1.00 51.13 H new ATOM 0 HH12 ARG A 143 11.088 -5.595 12.884 1.00 51.13 H new ATOM 0 HH21 ARG A 143 12.373 -7.838 10.578 1.00 12.44 H new ATOM 0 HH22 ARG A 143 11.399 -7.619 12.036 1.00 12.44 H new ATOM 2301 N ALA A 144 13.772 -5.078 5.744 1.00 13.23 N ATOM 2302 CA ALA A 144 13.058 -6.100 4.970 1.00 62.45 C ATOM 2303 C ALA A 144 13.516 -6.120 3.503 1.00 1.12 C ATOM 2304 O ALA A 144 13.694 -7.184 2.910 1.00 52.25 O ATOM 2305 CB ALA A 144 11.554 -5.862 5.058 1.00 13.24 C ATOM 0 H ALA A 144 13.248 -4.213 5.879 1.00 13.23 H new ATOM 0 HA ALA A 144 13.292 -7.074 5.399 1.00 62.45 H new ATOM 0 HB1 ALA A 144 11.031 -6.624 4.481 1.00 13.24 H new ATOM 0 HB2 ALA A 144 11.238 -5.914 6.100 1.00 13.24 H new ATOM 0 HB3 ALA A 144 11.317 -4.877 4.656 1.00 13.24 H new ATOM 2311 N ALA A 145 13.724 -4.930 2.936 1.00 23.13 N ATOM 2312 CA ALA A 145 14.171 -4.784 1.541 1.00 4.41 C ATOM 2313 C ALA A 145 15.511 -5.493 1.287 1.00 34.21 C ATOM 2314 O ALA A 145 15.855 -5.806 0.146 1.00 5.01 O ATOM 2315 CB ALA A 145 14.280 -3.306 1.184 1.00 23.21 C ATOM 0 H ALA A 145 13.590 -4.044 3.423 1.00 23.13 H new ATOM 0 HA ALA A 145 13.427 -5.260 0.903 1.00 4.41 H new ATOM 0 HB1 ALA A 145 14.611 -3.205 0.150 1.00 23.21 H new ATOM 0 HB2 ALA A 145 13.306 -2.831 1.301 1.00 23.21 H new ATOM 0 HB3 ALA A 145 15.001 -2.824 1.845 1.00 23.21 H new ATOM 2321 N GLU A 146 16.256 -5.738 2.362 1.00 23.34 N ATOM 2322 CA GLU A 146 17.523 -6.478 2.299 1.00 73.30 C ATOM 2323 C GLU A 146 17.315 -7.928 1.815 1.00 75.12 C ATOM 2324 O GLU A 146 18.259 -8.598 1.392 1.00 23.41 O ATOM 2325 CB GLU A 146 18.168 -6.477 3.695 1.00 23.40 C ATOM 2326 CG GLU A 146 19.492 -7.231 3.783 1.00 74.42 C ATOM 2327 CD GLU A 146 20.085 -7.209 5.184 1.00 10.51 C ATOM 2328 OE1 GLU A 146 19.644 -8.013 6.034 1.00 33.05 O ATOM 2329 OE2 GLU A 146 20.991 -6.387 5.439 1.00 54.53 O ATOM 0 H GLU A 146 16.003 -5.432 3.301 1.00 23.34 H new ATOM 0 HA GLU A 146 18.177 -5.986 1.579 1.00 73.30 H new ATOM 0 HB2 GLU A 146 18.331 -5.445 4.005 1.00 23.40 H new ATOM 0 HB3 GLU A 146 17.467 -6.916 4.405 1.00 23.40 H new ATOM 0 HG2 GLU A 146 19.339 -8.265 3.473 1.00 74.42 H new ATOM 0 HG3 GLU A 146 20.204 -6.791 3.084 1.00 74.42 H new ATOM 2336 N GLY A 147 16.070 -8.402 1.865 1.00 5.34 N ATOM 2337 CA GLY A 147 15.771 -9.785 1.505 1.00 2.11 C ATOM 2338 C GLY A 147 15.899 -10.737 2.690 1.00 21.23 C ATOM 2339 O GLY A 147 16.263 -11.903 2.532 1.00 41.32 O ATOM 0 H GLY A 147 15.259 -7.852 2.149 1.00 5.34 H new ATOM 0 HA2 GLY A 147 14.759 -9.842 1.105 1.00 2.11 H new ATOM 0 HA3 GLY A 147 16.446 -10.105 0.711 1.00 2.11 H new ATOM 2343 N ALA A 148 15.611 -10.229 3.887 1.00 65.34 N ATOM 2344 CA ALA A 148 15.697 -11.027 5.116 1.00 52.44 C ATOM 2345 C ALA A 148 14.340 -11.626 5.515 1.00 55.21 C ATOM 2346 O ALA A 148 14.278 -12.595 6.274 1.00 54.24 O ATOM 2347 CB ALA A 148 16.250 -10.170 6.251 1.00 14.54 C ATOM 0 H ALA A 148 15.314 -9.264 4.036 1.00 65.34 H new ATOM 0 HA ALA A 148 16.372 -11.860 4.922 1.00 52.44 H new ATOM 0 HB1 ALA A 148 16.312 -10.767 7.161 1.00 14.54 H new ATOM 0 HB2 ALA A 148 17.244 -9.811 5.985 1.00 14.54 H new ATOM 0 HB3 ALA A 148 15.590 -9.319 6.419 1.00 14.54 H new ATOM 2353 N GLU A 149 13.258 -11.050 4.997 1.00 75.11 N ATOM 2354 CA GLU A 149 11.902 -11.468 5.363 1.00 75.32 C ATOM 2355 C GLU A 149 10.874 -10.983 4.325 1.00 23.03 C ATOM 2356 O GLU A 149 11.247 -10.488 3.259 1.00 54.12 O ATOM 2357 CB GLU A 149 11.560 -10.921 6.755 1.00 71.02 C ATOM 2358 CG GLU A 149 11.677 -9.402 6.866 1.00 0.40 C ATOM 2359 CD GLU A 149 11.499 -8.906 8.291 1.00 32.14 C ATOM 2360 OE1 GLU A 149 10.377 -9.031 8.831 1.00 32.42 O ATOM 2361 OE2 GLU A 149 12.483 -8.414 8.888 1.00 51.43 O ATOM 0 H GLU A 149 13.292 -10.289 4.319 1.00 75.11 H new ATOM 0 HA GLU A 149 11.863 -12.557 5.382 1.00 75.32 H new ATOM 0 HB2 GLU A 149 10.543 -11.218 7.012 1.00 71.02 H new ATOM 0 HB3 GLU A 149 12.221 -11.382 7.489 1.00 71.02 H new ATOM 0 HG2 GLU A 149 12.653 -9.088 6.495 1.00 0.40 H new ATOM 0 HG3 GLU A 149 10.928 -8.936 6.226 1.00 0.40 H new ATOM 2368 N ASN A 150 9.586 -11.135 4.636 1.00 65.40 N ATOM 2369 CA ASN A 150 8.512 -10.675 3.743 1.00 23.44 C ATOM 2370 C ASN A 150 8.503 -9.145 3.603 1.00 13.41 C ATOM 2371 O ASN A 150 8.777 -8.608 2.527 1.00 65.14 O ATOM 2372 CB ASN A 150 7.146 -11.153 4.256 1.00 32.14 C ATOM 2373 CG ASN A 150 6.935 -12.640 4.058 1.00 1.14 C ATOM 2374 OD1 ASN A 150 7.285 -13.455 4.904 1.00 61.35 O ATOM 2375 ND2 ASN A 150 6.357 -13.006 2.933 1.00 40.33 N ATOM 0 H ASN A 150 9.258 -11.572 5.497 1.00 65.40 H new ATOM 0 HA ASN A 150 8.703 -11.105 2.760 1.00 23.44 H new ATOM 0 HB2 ASN A 150 7.057 -10.916 5.316 1.00 32.14 H new ATOM 0 HB3 ASN A 150 6.357 -10.606 3.740 1.00 32.14 H new ATOM 0 HD21 ASN A 150 6.188 -13.994 2.744 1.00 40.33 H new ATOM 0 HD22 ASN A 150 6.078 -12.301 2.250 1.00 40.33 H new ATOM 2382 N GLY A 151 8.194 -8.453 4.699 1.00 51.34 N ATOM 2383 CA GLY A 151 8.087 -6.996 4.673 1.00 24.52 C ATOM 2384 C GLY A 151 6.880 -6.482 3.882 1.00 4.34 C ATOM 2385 O GLY A 151 6.472 -7.079 2.886 1.00 32.51 O ATOM 0 H GLY A 151 8.015 -8.875 5.610 1.00 51.34 H new ATOM 0 HA2 GLY A 151 8.024 -6.627 5.697 1.00 24.52 H new ATOM 0 HA3 GLY A 151 8.997 -6.581 4.240 1.00 24.52 H new ATOM 2389 N GLN A 152 6.305 -5.368 4.329 1.00 62.13 N ATOM 2390 CA GLN A 152 5.170 -4.753 3.630 1.00 61.53 C ATOM 2391 C GLN A 152 5.617 -3.534 2.805 1.00 33.34 C ATOM 2392 O GLN A 152 6.405 -2.708 3.274 1.00 24.51 O ATOM 2393 CB GLN A 152 4.090 -4.332 4.638 1.00 53.30 C ATOM 2394 CG GLN A 152 2.806 -3.831 3.983 1.00 51.21 C ATOM 2395 CD GLN A 152 1.760 -3.385 4.991 1.00 62.33 C ATOM 2396 OE1 GLN A 152 2.079 -2.894 6.064 1.00 60.00 O ATOM 2397 NE2 GLN A 152 0.496 -3.553 4.650 1.00 50.44 N ATOM 0 H GLN A 152 6.602 -4.871 5.169 1.00 62.13 H new ATOM 0 HA GLN A 152 4.757 -5.495 2.947 1.00 61.53 H new ATOM 0 HB2 GLN A 152 3.853 -5.180 5.280 1.00 53.30 H new ATOM 0 HB3 GLN A 152 4.490 -3.548 5.281 1.00 53.30 H new ATOM 0 HG2 GLN A 152 3.043 -2.998 3.321 1.00 51.21 H new ATOM 0 HG3 GLN A 152 2.389 -4.623 3.361 1.00 51.21 H new ATOM 0 HE21 GLN A 152 0.262 -3.966 3.747 1.00 50.44 H new ATOM 0 HE22 GLN A 152 -0.247 -3.270 5.289 1.00 50.44 H new ATOM 2406 N VAL A 153 5.118 -3.431 1.573 1.00 62.30 N ATOM 2407 CA VAL A 153 5.436 -2.297 0.697 1.00 53.13 C ATOM 2408 C VAL A 153 4.375 -1.188 0.782 1.00 31.52 C ATOM 2409 O VAL A 153 3.178 -1.437 0.629 1.00 41.13 O ATOM 2410 CB VAL A 153 5.587 -2.738 -0.786 1.00 71.40 C ATOM 2411 CG1 VAL A 153 5.659 -1.521 -1.710 1.00 42.53 C ATOM 2412 CG2 VAL A 153 6.825 -3.617 -0.967 1.00 1.31 C ATOM 0 H VAL A 153 4.491 -4.119 1.156 1.00 62.30 H new ATOM 0 HA VAL A 153 6.388 -1.903 1.052 1.00 53.13 H new ATOM 0 HB VAL A 153 4.707 -3.322 -1.054 1.00 71.40 H new ATOM 0 HG11 VAL A 153 5.765 -1.854 -2.743 1.00 42.53 H new ATOM 0 HG12 VAL A 153 4.746 -0.933 -1.610 1.00 42.53 H new ATOM 0 HG13 VAL A 153 6.517 -0.907 -1.437 1.00 42.53 H new ATOM 0 HG21 VAL A 153 6.911 -3.914 -2.012 1.00 1.31 H new ATOM 0 HG22 VAL A 153 7.714 -3.058 -0.674 1.00 1.31 H new ATOM 0 HG23 VAL A 153 6.734 -4.506 -0.344 1.00 1.31 H new ATOM 2422 N ALA A 154 4.836 0.031 1.027 1.00 10.44 N ATOM 2423 CA ALA A 154 3.980 1.218 1.033 1.00 64.12 C ATOM 2424 C ALA A 154 4.036 1.929 -0.335 1.00 31.32 C ATOM 2425 O ALA A 154 5.114 2.302 -0.805 1.00 55.23 O ATOM 2426 CB ALA A 154 4.423 2.151 2.156 1.00 25.43 C ATOM 0 H ALA A 154 5.816 0.229 1.228 1.00 10.44 H new ATOM 0 HA ALA A 154 2.946 0.922 1.209 1.00 64.12 H new ATOM 0 HB1 ALA A 154 3.788 3.037 2.165 1.00 25.43 H new ATOM 0 HB2 ALA A 154 4.339 1.635 3.112 1.00 25.43 H new ATOM 0 HB3 ALA A 154 5.459 2.449 1.994 1.00 25.43 H new ATOM 2432 N ILE A 155 2.877 2.114 -0.977 1.00 71.10 N ATOM 2433 CA ILE A 155 2.835 2.650 -2.348 1.00 14.22 C ATOM 2434 C ILE A 155 2.660 4.179 -2.369 1.00 33.41 C ATOM 2435 O ILE A 155 1.662 4.707 -1.887 1.00 64.23 O ATOM 2436 CB ILE A 155 1.693 1.993 -3.168 1.00 13.33 C ATOM 2437 CG1 ILE A 155 1.879 0.465 -3.213 1.00 50.12 C ATOM 2438 CG2 ILE A 155 1.642 2.579 -4.583 1.00 3.02 C ATOM 2439 CD1 ILE A 155 0.824 -0.263 -4.024 1.00 25.12 C ATOM 0 H ILE A 155 1.963 1.904 -0.577 1.00 71.10 H new ATOM 0 HA ILE A 155 3.796 2.409 -2.803 1.00 14.22 H new ATOM 0 HB ILE A 155 0.743 2.208 -2.679 1.00 13.33 H new ATOM 0 HG12 ILE A 155 2.861 0.241 -3.630 1.00 50.12 H new ATOM 0 HG13 ILE A 155 1.870 0.078 -2.194 1.00 50.12 H new ATOM 0 HG21 ILE A 155 0.835 2.107 -5.144 1.00 3.02 H new ATOM 0 HG22 ILE A 155 1.464 3.653 -4.526 1.00 3.02 H new ATOM 0 HG23 ILE A 155 2.591 2.395 -5.087 1.00 3.02 H new ATOM 0 HD11 ILE A 155 1.026 -1.334 -4.006 1.00 25.12 H new ATOM 0 HD12 ILE A 155 -0.160 -0.072 -3.596 1.00 25.12 H new ATOM 0 HD13 ILE A 155 0.847 0.093 -5.054 1.00 25.12 H new ATOM 2451 N ILE A 156 3.637 4.886 -2.940 1.00 25.12 N ATOM 2452 CA ILE A 156 3.577 6.351 -3.059 1.00 1.30 C ATOM 2453 C ILE A 156 3.208 6.778 -4.487 1.00 11.34 C ATOM 2454 O ILE A 156 3.948 6.501 -5.436 1.00 44.21 O ATOM 2455 CB ILE A 156 4.937 7.000 -2.681 1.00 31.13 C ATOM 2456 CG1 ILE A 156 5.324 6.646 -1.235 1.00 34.33 C ATOM 2457 CG2 ILE A 156 4.891 8.520 -2.875 1.00 11.32 C ATOM 2458 CD1 ILE A 156 4.361 7.174 -0.196 1.00 63.32 C ATOM 0 H ILE A 156 4.483 4.470 -3.329 1.00 25.12 H new ATOM 0 HA ILE A 156 2.806 6.693 -2.368 1.00 1.30 H new ATOM 0 HB ILE A 156 5.701 6.599 -3.347 1.00 31.13 H new ATOM 0 HG12 ILE A 156 5.386 5.562 -1.141 1.00 34.33 H new ATOM 0 HG13 ILE A 156 6.319 7.041 -1.028 1.00 34.33 H new ATOM 0 HG21 ILE A 156 5.855 8.951 -2.604 1.00 11.32 H new ATOM 0 HG22 ILE A 156 4.673 8.747 -3.919 1.00 11.32 H new ATOM 0 HG23 ILE A 156 4.113 8.944 -2.241 1.00 11.32 H new ATOM 0 HD11 ILE A 156 4.702 6.883 0.798 1.00 63.32 H new ATOM 0 HD12 ILE A 156 4.316 8.261 -0.261 1.00 63.32 H new ATOM 0 HD13 ILE A 156 3.369 6.759 -0.375 1.00 63.32 H new ATOM 2470 N GLU A 157 2.069 7.454 -4.643 1.00 24.55 N ATOM 2471 CA GLU A 157 1.655 7.971 -5.954 1.00 42.04 C ATOM 2472 C GLU A 157 1.744 9.501 -6.011 1.00 10.11 C ATOM 2473 O GLU A 157 1.165 10.205 -5.181 1.00 34.11 O ATOM 2474 CB GLU A 157 0.230 7.517 -6.314 1.00 24.21 C ATOM 2475 CG GLU A 157 -0.254 8.073 -7.658 1.00 61.40 C ATOM 2476 CD GLU A 157 -1.489 7.368 -8.205 1.00 65.43 C ATOM 2477 OE1 GLU A 157 -2.611 7.656 -7.743 1.00 2.15 O ATOM 2478 OE2 GLU A 157 -1.342 6.540 -9.128 1.00 74.32 O ATOM 0 H GLU A 157 1.418 7.657 -3.884 1.00 24.55 H new ATOM 0 HA GLU A 157 2.347 7.557 -6.687 1.00 42.04 H new ATOM 0 HB2 GLU A 157 0.199 6.428 -6.345 1.00 24.21 H new ATOM 0 HB3 GLU A 157 -0.456 7.833 -5.528 1.00 24.21 H new ATOM 0 HG2 GLU A 157 -0.474 9.135 -7.544 1.00 61.40 H new ATOM 0 HG3 GLU A 157 0.553 7.991 -8.387 1.00 61.40 H new ATOM 2485 N TYR A 158 2.476 10.007 -7.000 1.00 54.51 N ATOM 2486 CA TYR A 158 2.581 11.450 -7.233 1.00 11.15 C ATOM 2487 C TYR A 158 1.436 11.915 -8.144 1.00 13.12 C ATOM 2488 O TYR A 158 1.569 11.915 -9.371 1.00 22.23 O ATOM 2489 CB TYR A 158 3.934 11.792 -7.881 1.00 41.14 C ATOM 2490 CG TYR A 158 5.135 11.229 -7.142 1.00 1.41 C ATOM 2491 CD1 TYR A 158 5.558 9.922 -7.364 1.00 50.42 C ATOM 2492 CD2 TYR A 158 5.847 12.002 -6.232 1.00 53.51 C ATOM 2493 CE1 TYR A 158 6.653 9.404 -6.702 1.00 25.22 C ATOM 2494 CE2 TYR A 158 6.945 11.488 -5.564 1.00 23.33 C ATOM 2495 CZ TYR A 158 7.344 10.190 -5.804 1.00 65.54 C ATOM 2496 OH TYR A 158 8.441 9.675 -5.147 1.00 14.30 O ATOM 0 H TYR A 158 3.009 9.438 -7.658 1.00 54.51 H new ATOM 0 HA TYR A 158 2.512 11.965 -6.275 1.00 11.15 H new ATOM 0 HB2 TYR A 158 3.941 11.415 -8.904 1.00 41.14 H new ATOM 0 HB3 TYR A 158 4.033 12.876 -7.940 1.00 41.14 H new ATOM 0 HD1 TYR A 158 5.020 9.302 -8.066 1.00 50.42 H new ATOM 0 HD2 TYR A 158 5.539 13.020 -6.043 1.00 53.51 H new ATOM 0 HE1 TYR A 158 6.967 8.387 -6.887 1.00 25.22 H new ATOM 0 HE2 TYR A 158 7.487 12.101 -4.858 1.00 23.33 H new ATOM 0 HH TYR A 158 8.815 10.357 -4.551 1.00 14.30 H new ATOM 2506 N ARG A 159 0.300 12.280 -7.554 1.00 15.24 N ATOM 2507 CA ARG A 159 -0.882 12.641 -8.348 1.00 44.12 C ATOM 2508 C ARG A 159 -1.417 14.036 -7.996 1.00 43.34 C ATOM 2509 O ARG A 159 -0.966 14.670 -7.042 1.00 51.01 O ATOM 2510 CB ARG A 159 -1.988 11.583 -8.194 1.00 61.10 C ATOM 2511 CG ARG A 159 -2.652 11.533 -6.817 1.00 70.34 C ATOM 2512 CD ARG A 159 -3.753 10.472 -6.782 1.00 71.32 C ATOM 2513 NE ARG A 159 -4.631 10.586 -5.615 1.00 32.31 N ATOM 2514 CZ ARG A 159 -5.911 10.843 -5.689 1.00 32.31 C ATOM 2515 NH1 ARG A 159 -6.477 11.074 -6.835 1.00 24.21 N ATOM 2516 NH2 ARG A 159 -6.624 10.860 -4.615 1.00 10.22 N ATOM 0 H ARG A 159 0.169 12.335 -6.544 1.00 15.24 H new ATOM 0 HA ARG A 159 -0.567 12.671 -9.391 1.00 44.12 H new ATOM 0 HB2 ARG A 159 -2.756 11.771 -8.944 1.00 61.10 H new ATOM 0 HB3 ARG A 159 -1.564 10.603 -8.411 1.00 61.10 H new ATOM 0 HG2 ARG A 159 -1.904 11.312 -6.056 1.00 70.34 H new ATOM 0 HG3 ARG A 159 -3.074 12.509 -6.576 1.00 70.34 H new ATOM 0 HD2 ARG A 159 -4.353 10.551 -7.689 1.00 71.32 H new ATOM 0 HD3 ARG A 159 -3.295 9.483 -6.788 1.00 71.32 H new ATOM 0 HE ARG A 159 -4.220 10.457 -4.690 1.00 32.31 H new ATOM 0 HH11 ARG A 159 -5.922 11.056 -7.691 1.00 24.21 H new ATOM 0 HH12 ARG A 159 -7.476 11.273 -6.879 1.00 24.21 H new ATOM 0 HH21 ARG A 159 -6.189 10.673 -3.711 1.00 10.22 H new ATOM 0 HH22 ARG A 159 -7.623 11.060 -4.669 1.00 10.22 H new ATOM 2530 N ASP A 160 -2.388 14.502 -8.774 1.00 63.25 N ATOM 2531 CA ASP A 160 -2.916 15.857 -8.631 1.00 3.10 C ATOM 2532 C ASP A 160 -4.084 15.923 -7.636 1.00 63.44 C ATOM 2533 O ASP A 160 -4.977 15.073 -7.639 1.00 54.51 O ATOM 2534 CB ASP A 160 -3.376 16.375 -9.999 1.00 22.24 C ATOM 2535 CG ASP A 160 -4.509 15.544 -10.580 1.00 43.33 C ATOM 2536 OD1 ASP A 160 -4.265 14.378 -10.954 1.00 11.43 O ATOM 2537 OD2 ASP A 160 -5.655 16.040 -10.642 1.00 31.21 O ATOM 0 H ASP A 160 -2.829 13.958 -9.516 1.00 63.25 H new ATOM 0 HA ASP A 160 -2.115 16.483 -8.239 1.00 3.10 H new ATOM 0 HB2 ASP A 160 -3.701 17.411 -9.902 1.00 22.24 H new ATOM 0 HB3 ASP A 160 -2.533 16.369 -10.690 1.00 22.24 H new ATOM 2542 N VAL A 161 -4.064 16.932 -6.776 1.00 52.21 N ATOM 2543 CA VAL A 161 -5.205 17.250 -5.923 1.00 73.03 C ATOM 2544 C VAL A 161 -5.845 18.548 -6.416 1.00 61.14 C ATOM 2545 O VAL A 161 -5.366 19.643 -6.108 1.00 53.23 O ATOM 2546 CB VAL A 161 -4.796 17.379 -4.434 1.00 63.34 C ATOM 2547 CG1 VAL A 161 -5.971 17.848 -3.575 1.00 4.43 C ATOM 2548 CG2 VAL A 161 -4.254 16.048 -3.918 1.00 1.31 C ATOM 0 H VAL A 161 -3.263 17.551 -6.649 1.00 52.21 H new ATOM 0 HA VAL A 161 -5.923 16.432 -5.985 1.00 73.03 H new ATOM 0 HB VAL A 161 -4.010 18.131 -4.363 1.00 63.34 H new ATOM 0 HG11 VAL A 161 -5.652 17.929 -2.536 1.00 4.43 H new ATOM 0 HG12 VAL A 161 -6.313 18.821 -3.926 1.00 4.43 H new ATOM 0 HG13 VAL A 161 -6.786 17.128 -3.650 1.00 4.43 H new ATOM 0 HG21 VAL A 161 -3.970 16.152 -2.871 1.00 1.31 H new ATOM 0 HG22 VAL A 161 -5.023 15.281 -4.011 1.00 1.31 H new ATOM 0 HG23 VAL A 161 -3.381 15.759 -4.503 1.00 1.31 H new ATOM 2558 N ASP A 162 -6.883 18.400 -7.244 1.00 2.01 N ATOM 2559 CA ASP A 162 -7.572 19.525 -7.890 1.00 35.10 C ATOM 2560 C ASP A 162 -6.683 20.196 -8.961 1.00 2.15 C ATOM 2561 O ASP A 162 -7.072 20.291 -10.129 1.00 62.13 O ATOM 2562 CB ASP A 162 -8.056 20.549 -6.852 1.00 52.41 C ATOM 2563 CG ASP A 162 -9.055 21.531 -7.440 1.00 73.51 C ATOM 2564 OD1 ASP A 162 -10.133 21.086 -7.888 1.00 5.34 O ATOM 2565 OD2 ASP A 162 -8.777 22.749 -7.453 1.00 3.22 O ATOM 0 H ASP A 162 -7.273 17.490 -7.488 1.00 2.01 H new ATOM 0 HA ASP A 162 -8.449 19.122 -8.398 1.00 35.10 H new ATOM 0 HB2 ASP A 162 -8.514 20.025 -6.013 1.00 52.41 H new ATOM 0 HB3 ASP A 162 -7.200 21.096 -6.457 1.00 52.41 H new ATOM 2570 N GLY A 163 -5.495 20.657 -8.564 1.00 1.12 N ATOM 2571 CA GLY A 163 -4.567 21.268 -9.513 1.00 25.14 C ATOM 2572 C GLY A 163 -3.107 21.280 -9.046 1.00 60.12 C ATOM 2573 O GLY A 163 -2.253 21.875 -9.703 1.00 41.53 O ATOM 0 H GLY A 163 -5.157 20.619 -7.602 1.00 1.12 H new ATOM 0 HA2 GLY A 163 -4.629 20.733 -10.460 1.00 25.14 H new ATOM 0 HA3 GLY A 163 -4.884 22.293 -9.705 1.00 25.14 H new ATOM 2577 N THR A 164 -2.809 20.628 -7.917 1.00 11.50 N ATOM 2578 CA THR A 164 -1.430 20.589 -7.383 1.00 62.34 C ATOM 2579 C THR A 164 -0.905 19.148 -7.269 1.00 11.40 C ATOM 2580 O THR A 164 -1.603 18.264 -6.777 1.00 1.11 O ATOM 2581 CB THR A 164 -1.342 21.270 -5.991 1.00 40.21 C ATOM 2582 OG1 THR A 164 -1.730 22.652 -6.089 1.00 64.11 O ATOM 2583 CG2 THR A 164 0.071 21.184 -5.416 1.00 21.00 C ATOM 0 H THR A 164 -3.493 20.122 -7.354 1.00 11.50 H new ATOM 0 HA THR A 164 -0.809 21.137 -8.092 1.00 62.34 H new ATOM 0 HB THR A 164 -2.022 20.741 -5.323 1.00 40.21 H new ATOM 0 HG1 THR A 164 -1.672 23.071 -5.205 1.00 64.11 H new ATOM 0 HG21 THR A 164 0.097 21.670 -4.441 1.00 21.00 H new ATOM 0 HG22 THR A 164 0.357 20.138 -5.307 1.00 21.00 H new ATOM 0 HG23 THR A 164 0.769 21.682 -6.089 1.00 21.00 H new ATOM 2591 N GLU A 165 0.336 18.927 -7.712 1.00 44.42 N ATOM 2592 CA GLU A 165 0.937 17.584 -7.726 1.00 62.45 C ATOM 2593 C GLU A 165 1.533 17.220 -6.352 1.00 15.13 C ATOM 2594 O GLU A 165 2.566 17.762 -5.952 1.00 1.32 O ATOM 2595 CB GLU A 165 2.047 17.507 -8.793 1.00 43.23 C ATOM 2596 CG GLU A 165 1.705 18.179 -10.122 1.00 21.14 C ATOM 2597 CD GLU A 165 0.426 17.653 -10.752 1.00 34.04 C ATOM 2598 OE1 GLU A 165 0.472 16.575 -11.381 1.00 5.30 O ATOM 2599 OE2 GLU A 165 -0.622 18.325 -10.637 1.00 41.21 O ATOM 0 H GLU A 165 0.948 19.661 -8.067 1.00 44.42 H new ATOM 0 HA GLU A 165 0.145 16.873 -7.963 1.00 62.45 H new ATOM 0 HB2 GLU A 165 2.950 17.966 -8.391 1.00 43.23 H new ATOM 0 HB3 GLU A 165 2.279 16.459 -8.981 1.00 43.23 H new ATOM 0 HG2 GLU A 165 1.608 19.253 -9.963 1.00 21.14 H new ATOM 0 HG3 GLU A 165 2.531 18.033 -10.818 1.00 21.14 H new ATOM 2606 N VAL A 166 0.884 16.305 -5.628 1.00 64.35 N ATOM 2607 CA VAL A 166 1.373 15.868 -4.308 1.00 4.25 C ATOM 2608 C VAL A 166 1.462 14.332 -4.204 1.00 71.41 C ATOM 2609 O VAL A 166 0.673 13.606 -4.813 1.00 63.52 O ATOM 2610 CB VAL A 166 0.479 16.405 -3.156 1.00 71.45 C ATOM 2611 CG1 VAL A 166 0.430 17.933 -3.169 1.00 62.42 C ATOM 2612 CG2 VAL A 166 -0.924 15.812 -3.236 1.00 53.10 C ATOM 0 H VAL A 166 0.021 15.851 -5.928 1.00 64.35 H new ATOM 0 HA VAL A 166 2.375 16.285 -4.206 1.00 4.25 H new ATOM 0 HB VAL A 166 0.923 16.093 -2.211 1.00 71.45 H new ATOM 0 HG11 VAL A 166 -0.202 18.284 -2.353 1.00 62.42 H new ATOM 0 HG12 VAL A 166 1.437 18.330 -3.044 1.00 62.42 H new ATOM 0 HG13 VAL A 166 0.020 18.276 -4.119 1.00 62.42 H new ATOM 0 HG21 VAL A 166 -1.531 16.203 -2.419 1.00 53.10 H new ATOM 0 HG22 VAL A 166 -1.380 16.082 -4.189 1.00 53.10 H new ATOM 0 HG23 VAL A 166 -0.865 14.726 -3.157 1.00 53.10 H new ATOM 2622 N PRO A 167 2.441 13.815 -3.436 1.00 2.22 N ATOM 2623 CA PRO A 167 2.589 12.377 -3.195 1.00 60.03 C ATOM 2624 C PRO A 167 1.832 11.885 -1.943 1.00 32.14 C ATOM 2625 O PRO A 167 2.152 12.270 -0.812 1.00 31.25 O ATOM 2626 CB PRO A 167 4.104 12.245 -3.007 1.00 42.54 C ATOM 2627 CG PRO A 167 4.536 13.542 -2.386 1.00 52.54 C ATOM 2628 CD PRO A 167 3.505 14.587 -2.763 1.00 23.34 C ATOM 0 HA PRO A 167 2.173 11.773 -4.001 1.00 60.03 H new ATOM 0 HB2 PRO A 167 4.349 11.399 -2.364 1.00 42.54 H new ATOM 0 HB3 PRO A 167 4.606 12.078 -3.960 1.00 42.54 H new ATOM 0 HG2 PRO A 167 4.606 13.445 -1.303 1.00 52.54 H new ATOM 0 HG3 PRO A 167 5.524 13.830 -2.745 1.00 52.54 H new ATOM 0 HD2 PRO A 167 3.125 15.108 -1.884 1.00 23.34 H new ATOM 0 HD3 PRO A 167 3.927 15.344 -3.424 1.00 23.34 H new ATOM 2636 N THR A 168 0.823 11.039 -2.149 1.00 53.44 N ATOM 2637 CA THR A 168 0.062 10.444 -1.037 1.00 23.51 C ATOM 2638 C THR A 168 0.483 8.987 -0.812 1.00 3.42 C ATOM 2639 O THR A 168 0.974 8.329 -1.733 1.00 55.10 O ATOM 2640 CB THR A 168 -1.469 10.492 -1.288 1.00 32.22 C ATOM 2641 OG1 THR A 168 -1.809 9.738 -2.462 1.00 32.45 O ATOM 2642 CG2 THR A 168 -1.953 11.932 -1.447 1.00 51.41 C ATOM 0 H THR A 168 0.509 10.747 -3.074 1.00 53.44 H new ATOM 0 HA THR A 168 0.287 11.037 -0.151 1.00 23.51 H new ATOM 0 HB THR A 168 -1.962 10.051 -0.422 1.00 32.22 H new ATOM 0 HG1 THR A 168 -2.784 9.707 -2.560 1.00 32.45 H new ATOM 0 HG21 THR A 168 -3.029 11.937 -1.622 1.00 51.41 H new ATOM 0 HG22 THR A 168 -1.730 12.493 -0.539 1.00 51.41 H new ATOM 0 HG23 THR A 168 -1.446 12.395 -2.293 1.00 51.41 H new ATOM 2650 N LEU A 169 0.301 8.476 0.413 1.00 73.40 N ATOM 2651 CA LEU A 169 0.694 7.095 0.725 1.00 65.52 C ATOM 2652 C LEU A 169 -0.514 6.155 0.706 1.00 4.44 C ATOM 2653 O LEU A 169 -1.460 6.338 1.469 1.00 14.14 O ATOM 2654 CB LEU A 169 1.406 7.019 2.085 1.00 34.42 C ATOM 2655 CG LEU A 169 1.774 5.595 2.551 1.00 32.54 C ATOM 2656 CD1 LEU A 169 2.431 4.806 1.423 1.00 30.41 C ATOM 2657 CD2 LEU A 169 2.699 5.640 3.766 1.00 4.02 C ATOM 0 H LEU A 169 -0.109 8.989 1.194 1.00 73.40 H new ATOM 0 HA LEU A 169 1.390 6.771 -0.049 1.00 65.52 H new ATOM 0 HB2 LEU A 169 2.317 7.615 2.035 1.00 34.42 H new ATOM 0 HB3 LEU A 169 0.766 7.478 2.839 1.00 34.42 H new ATOM 0 HG LEU A 169 0.850 5.091 2.836 1.00 32.54 H new ATOM 0 HD11 LEU A 169 2.681 3.806 1.776 1.00 30.41 H new ATOM 0 HD12 LEU A 169 1.742 4.732 0.582 1.00 30.41 H new ATOM 0 HD13 LEU A 169 3.340 5.316 1.104 1.00 30.41 H new ATOM 0 HD21 LEU A 169 2.944 4.624 4.075 1.00 4.02 H new ATOM 0 HD22 LEU A 169 3.615 6.171 3.506 1.00 4.02 H new ATOM 0 HD23 LEU A 169 2.199 6.158 4.585 1.00 4.02 H new ATOM 2669 N MET A 170 -0.456 5.140 -0.157 1.00 64.45 N ATOM 2670 CA MET A 170 -1.572 4.212 -0.358 1.00 41.41 C ATOM 2671 C MET A 170 -1.303 2.819 0.246 1.00 3.43 C ATOM 2672 O MET A 170 -0.220 2.241 0.075 1.00 43.13 O ATOM 2673 CB MET A 170 -1.884 4.083 -1.853 1.00 31.22 C ATOM 2674 CG MET A 170 -2.302 5.396 -2.500 1.00 1.12 C ATOM 2675 SD MET A 170 -2.790 5.202 -4.224 1.00 4.42 S ATOM 2676 CE MET A 170 -3.267 6.884 -4.625 1.00 40.31 C ATOM 0 H MET A 170 0.361 4.938 -0.734 1.00 64.45 H new ATOM 0 HA MET A 170 -2.432 4.628 0.166 1.00 41.41 H new ATOM 0 HB2 MET A 170 -1.004 3.697 -2.368 1.00 31.22 H new ATOM 0 HB3 MET A 170 -2.680 3.351 -1.988 1.00 31.22 H new ATOM 0 HG2 MET A 170 -3.132 5.824 -1.938 1.00 1.12 H new ATOM 0 HG3 MET A 170 -1.476 6.105 -2.439 1.00 1.12 H new ATOM 0 HE1 MET A 170 -3.646 6.921 -5.646 1.00 40.31 H new ATOM 0 HE2 MET A 170 -4.045 7.215 -3.937 1.00 40.31 H new ATOM 0 HE3 MET A 170 -2.400 7.539 -4.535 1.00 40.31 H new ATOM 2686 N LEU A 171 -2.316 2.294 0.945 1.00 3.33 N ATOM 2687 CA LEU A 171 -2.276 0.955 1.558 1.00 12.52 C ATOM 2688 C LEU A 171 -3.662 0.287 1.462 1.00 3.31 C ATOM 2689 O LEU A 171 -4.684 0.964 1.543 1.00 43.02 O ATOM 2690 CB LEU A 171 -1.854 1.045 3.036 1.00 32.15 C ATOM 2691 CG LEU A 171 -0.401 1.487 3.294 1.00 23.10 C ATOM 2692 CD1 LEU A 171 -0.146 1.661 4.790 1.00 70.31 C ATOM 2693 CD2 LEU A 171 0.586 0.480 2.698 1.00 32.51 C ATOM 0 H LEU A 171 -3.194 2.788 1.104 1.00 3.33 H new ATOM 0 HA LEU A 171 -1.544 0.355 1.017 1.00 12.52 H new ATOM 0 HB2 LEU A 171 -2.521 1.742 3.543 1.00 32.15 H new ATOM 0 HB3 LEU A 171 -2.004 0.069 3.497 1.00 32.15 H new ATOM 0 HG LEU A 171 -0.249 2.449 2.805 1.00 23.10 H new ATOM 0 HD11 LEU A 171 0.886 1.973 4.949 1.00 70.31 H new ATOM 0 HD12 LEU A 171 -0.820 2.419 5.188 1.00 70.31 H new ATOM 0 HD13 LEU A 171 -0.322 0.715 5.302 1.00 70.31 H new ATOM 0 HD21 LEU A 171 1.606 0.812 2.892 1.00 32.51 H new ATOM 0 HD22 LEU A 171 0.429 -0.497 3.155 1.00 32.51 H new ATOM 0 HD23 LEU A 171 0.426 0.407 1.622 1.00 32.51 H new ATOM 2705 N VAL A 172 -3.699 -1.036 1.305 1.00 14.03 N ATOM 2706 CA VAL A 172 -4.973 -1.754 1.130 1.00 42.02 C ATOM 2707 C VAL A 172 -5.734 -1.926 2.459 1.00 64.24 C ATOM 2708 O VAL A 172 -5.155 -2.317 3.472 1.00 73.53 O ATOM 2709 CB VAL A 172 -4.759 -3.144 0.484 1.00 73.15 C ATOM 2710 CG1 VAL A 172 -6.100 -3.831 0.225 1.00 24.45 C ATOM 2711 CG2 VAL A 172 -3.948 -3.025 -0.807 1.00 0.22 C ATOM 0 H VAL A 172 -2.872 -1.633 1.295 1.00 14.03 H new ATOM 0 HA VAL A 172 -5.575 -1.137 0.464 1.00 42.02 H new ATOM 0 HB VAL A 172 -4.192 -3.760 1.182 1.00 73.15 H new ATOM 0 HG11 VAL A 172 -5.927 -4.807 -0.229 1.00 24.45 H new ATOM 0 HG12 VAL A 172 -6.631 -3.959 1.168 1.00 24.45 H new ATOM 0 HG13 VAL A 172 -6.699 -3.218 -0.449 1.00 24.45 H new ATOM 0 HG21 VAL A 172 -3.810 -4.015 -1.243 1.00 0.22 H new ATOM 0 HG22 VAL A 172 -4.480 -2.388 -1.514 1.00 0.22 H new ATOM 0 HG23 VAL A 172 -2.974 -2.587 -0.586 1.00 0.22 H new ATOM 2721 N LYS A 173 -7.041 -1.655 2.424 1.00 2.02 N ATOM 2722 CA LYS A 173 -7.903 -1.722 3.615 1.00 52.51 C ATOM 2723 C LYS A 173 -7.913 -3.129 4.245 1.00 54.10 C ATOM 2724 O LYS A 173 -7.750 -3.283 5.452 1.00 43.52 O ATOM 2725 CB LYS A 173 -9.335 -1.312 3.234 1.00 71.34 C ATOM 2726 CG LYS A 173 -10.329 -1.340 4.392 1.00 3.13 C ATOM 2727 CD LYS A 173 -11.764 -1.062 3.935 1.00 42.52 C ATOM 2728 CE LYS A 173 -12.377 -2.234 3.163 1.00 64.20 C ATOM 2729 NZ LYS A 173 -11.775 -2.429 1.814 1.00 73.31 N ATOM 0 H LYS A 173 -7.534 -1.383 1.573 1.00 2.02 H new ATOM 0 HA LYS A 173 -7.499 -1.034 4.358 1.00 52.51 H new ATOM 0 HB2 LYS A 173 -9.312 -0.306 2.815 1.00 71.34 H new ATOM 0 HB3 LYS A 173 -9.693 -1.977 2.448 1.00 71.34 H new ATOM 0 HG2 LYS A 173 -10.288 -2.314 4.879 1.00 3.13 H new ATOM 0 HG3 LYS A 173 -10.037 -0.599 5.136 1.00 3.13 H new ATOM 0 HD2 LYS A 173 -12.382 -0.843 4.806 1.00 42.52 H new ATOM 0 HD3 LYS A 173 -11.774 -0.173 3.305 1.00 42.52 H new ATOM 0 HE2 LYS A 173 -12.253 -3.148 3.744 1.00 64.20 H new ATOM 0 HE3 LYS A 173 -13.449 -2.068 3.055 1.00 64.20 H new ATOM 0 HZ1 LYS A 173 -12.319 -3.144 1.291 1.00 73.31 H new ATOM 0 HZ2 LYS A 173 -11.794 -1.530 1.292 1.00 73.31 H new ATOM 0 HZ3 LYS A 173 -10.791 -2.749 1.916 1.00 73.31 H new ATOM 2743 N GLU A 174 -8.096 -4.149 3.413 1.00 32.00 N ATOM 2744 CA GLU A 174 -8.157 -5.541 3.886 1.00 4.44 C ATOM 2745 C GLU A 174 -6.756 -6.166 4.019 1.00 25.21 C ATOM 2746 O GLU A 174 -6.618 -7.374 4.212 1.00 65.42 O ATOM 2747 CB GLU A 174 -9.061 -6.404 2.973 1.00 71.33 C ATOM 2748 CG GLU A 174 -9.067 -6.007 1.494 1.00 35.13 C ATOM 2749 CD GLU A 174 -9.968 -4.809 1.208 1.00 33.22 C ATOM 2750 OE1 GLU A 174 -11.205 -4.982 1.175 1.00 24.13 O ATOM 2751 OE2 GLU A 174 -9.451 -3.683 1.045 1.00 41.23 O ATOM 0 H GLU A 174 -8.206 -4.045 2.404 1.00 32.00 H new ATOM 0 HA GLU A 174 -8.600 -5.520 4.882 1.00 4.44 H new ATOM 0 HB2 GLU A 174 -8.742 -7.443 3.052 1.00 71.33 H new ATOM 0 HB3 GLU A 174 -10.083 -6.354 3.350 1.00 71.33 H new ATOM 0 HG2 GLU A 174 -8.049 -5.774 1.181 1.00 35.13 H new ATOM 0 HG3 GLU A 174 -9.398 -6.856 0.896 1.00 35.13 H new ATOM 2758 N ALA A 175 -5.721 -5.333 3.931 1.00 13.24 N ATOM 2759 CA ALA A 175 -4.344 -5.775 4.175 1.00 35.35 C ATOM 2760 C ALA A 175 -3.854 -5.322 5.558 1.00 4.01 C ATOM 2761 O ALA A 175 -2.817 -5.783 6.042 1.00 71.25 O ATOM 2762 CB ALA A 175 -3.416 -5.248 3.088 1.00 64.13 C ATOM 0 H ALA A 175 -5.807 -4.345 3.692 1.00 13.24 H new ATOM 0 HA ALA A 175 -4.332 -6.865 4.151 1.00 35.35 H new ATOM 0 HB1 ALA A 175 -2.398 -5.585 3.284 1.00 64.13 H new ATOM 0 HB2 ALA A 175 -3.742 -5.623 2.118 1.00 64.13 H new ATOM 0 HB3 ALA A 175 -3.443 -4.158 3.083 1.00 64.13 H new ATOM 2768 N ILE A 176 -4.602 -4.408 6.180 1.00 2.14 N ATOM 2769 CA ILE A 176 -4.257 -3.880 7.506 1.00 45.31 C ATOM 2770 C ILE A 176 -5.496 -3.781 8.413 1.00 44.31 C ATOM 2771 O ILE A 176 -6.550 -3.298 8.002 1.00 1.20 O ATOM 2772 CB ILE A 176 -3.589 -2.478 7.413 1.00 42.21 C ATOM 2773 CG1 ILE A 176 -4.494 -1.491 6.648 1.00 12.52 C ATOM 2774 CG2 ILE A 176 -2.210 -2.574 6.761 1.00 44.14 C ATOM 2775 CD1 ILE A 176 -3.942 -0.080 6.567 1.00 15.11 C ATOM 0 H ILE A 176 -5.456 -4.015 5.785 1.00 2.14 H new ATOM 0 HA ILE A 176 -3.547 -4.584 7.940 1.00 45.31 H new ATOM 0 HB ILE A 176 -3.455 -2.098 8.426 1.00 42.21 H new ATOM 0 HG12 ILE A 176 -4.650 -1.867 5.637 1.00 12.52 H new ATOM 0 HG13 ILE A 176 -5.470 -1.461 7.131 1.00 12.52 H new ATOM 0 HG21 ILE A 176 -1.763 -1.581 6.707 1.00 44.14 H new ATOM 0 HG22 ILE A 176 -1.571 -3.228 7.355 1.00 44.14 H new ATOM 0 HG23 ILE A 176 -2.311 -2.982 5.755 1.00 44.14 H new ATOM 0 HD11 ILE A 176 -4.637 0.551 6.014 1.00 15.11 H new ATOM 0 HD12 ILE A 176 -3.812 0.318 7.573 1.00 15.11 H new ATOM 0 HD13 ILE A 176 -2.980 -0.095 6.056 1.00 15.11 H new ATOM 2787 N ILE A 177 -5.364 -4.248 9.649 1.00 61.34 N ATOM 2788 CA ILE A 177 -6.439 -4.135 10.629 1.00 53.33 C ATOM 2789 C ILE A 177 -6.244 -2.877 11.488 1.00 53.24 C ATOM 2790 O ILE A 177 -5.307 -2.793 12.288 1.00 32.15 O ATOM 2791 CB ILE A 177 -6.500 -5.386 11.547 1.00 62.51 C ATOM 2792 CG1 ILE A 177 -6.687 -6.668 10.711 1.00 53.02 C ATOM 2793 CG2 ILE A 177 -7.621 -5.250 12.578 1.00 70.52 C ATOM 2794 CD1 ILE A 177 -7.978 -6.710 9.915 1.00 52.12 C ATOM 0 H ILE A 177 -4.523 -4.709 9.997 1.00 61.34 H new ATOM 0 HA ILE A 177 -7.379 -4.062 10.083 1.00 53.33 H new ATOM 0 HB ILE A 177 -5.552 -5.459 12.081 1.00 62.51 H new ATOM 0 HG12 ILE A 177 -5.847 -6.766 10.024 1.00 53.02 H new ATOM 0 HG13 ILE A 177 -6.656 -7.530 11.377 1.00 53.02 H new ATOM 0 HG21 ILE A 177 -7.644 -6.138 13.210 1.00 70.52 H new ATOM 0 HG22 ILE A 177 -7.442 -4.370 13.196 1.00 70.52 H new ATOM 0 HG23 ILE A 177 -8.577 -5.145 12.065 1.00 70.52 H new ATOM 0 HD11 ILE A 177 -8.030 -7.644 9.356 1.00 52.12 H new ATOM 0 HD12 ILE A 177 -8.827 -6.646 10.595 1.00 52.12 H new ATOM 0 HD13 ILE A 177 -8.005 -5.870 9.221 1.00 52.12 H new ATOM 2806 N GLU A 178 -7.123 -1.896 11.305 1.00 35.14 N ATOM 2807 CA GLU A 178 -7.059 -0.643 12.062 1.00 72.21 C ATOM 2808 C GLU A 178 -7.811 -0.771 13.393 1.00 22.21 C ATOM 2809 O GLU A 178 -9.003 -1.083 13.418 1.00 31.21 O ATOM 2810 CB GLU A 178 -7.659 0.506 11.241 1.00 61.33 C ATOM 2811 CG GLU A 178 -7.025 0.685 9.863 1.00 50.12 C ATOM 2812 CD GLU A 178 -7.690 1.793 9.063 1.00 70.11 C ATOM 2813 OE1 GLU A 178 -8.906 1.679 8.786 1.00 61.54 O ATOM 2814 OE2 GLU A 178 -7.012 2.786 8.719 1.00 5.01 O ATOM 0 H GLU A 178 -7.892 -1.942 10.637 1.00 35.14 H new ATOM 0 HA GLU A 178 -6.011 -0.428 12.271 1.00 72.21 H new ATOM 0 HB2 GLU A 178 -8.728 0.331 11.117 1.00 61.33 H new ATOM 0 HB3 GLU A 178 -7.551 1.434 11.802 1.00 61.33 H new ATOM 0 HG2 GLU A 178 -5.965 0.910 9.979 1.00 50.12 H new ATOM 0 HG3 GLU A 178 -7.093 -0.251 9.309 1.00 50.12 H new ATOM 2821 N GLU A 179 -7.118 -0.516 14.497 1.00 71.43 N ATOM 2822 CA GLU A 179 -7.723 -0.613 15.827 1.00 55.31 C ATOM 2823 C GLU A 179 -7.627 0.729 16.566 1.00 72.24 C ATOM 2824 O GLU A 179 -6.606 1.420 16.506 1.00 64.21 O ATOM 2825 CB GLU A 179 -7.050 -1.734 16.633 1.00 31.11 C ATOM 2826 CG GLU A 179 -7.651 -1.960 18.019 1.00 32.04 C ATOM 2827 CD GLU A 179 -9.155 -2.202 17.989 1.00 1.15 C ATOM 2828 OE1 GLU A 179 -9.582 -3.322 17.637 1.00 34.20 O ATOM 2829 OE2 GLU A 179 -9.915 -1.274 18.338 1.00 22.44 O ATOM 0 H GLU A 179 -6.136 -0.240 14.501 1.00 71.43 H new ATOM 0 HA GLU A 179 -8.779 -0.857 15.714 1.00 55.31 H new ATOM 0 HB2 GLU A 179 -7.115 -2.663 16.066 1.00 31.11 H new ATOM 0 HB3 GLU A 179 -5.991 -1.501 16.743 1.00 31.11 H new ATOM 0 HG2 GLU A 179 -7.161 -2.815 18.485 1.00 32.04 H new ATOM 0 HG3 GLU A 179 -7.442 -1.092 18.645 1.00 32.04 H new ATOM 2836 N LYS A 180 -8.694 1.092 17.266 1.00 10.22 N ATOM 2837 CA LYS A 180 -8.797 2.413 17.891 1.00 33.44 C ATOM 2838 C LYS A 180 -9.131 2.338 19.388 1.00 10.12 C ATOM 2839 O LYS A 180 -10.032 1.615 19.809 1.00 41.24 O ATOM 2840 CB LYS A 180 -9.840 3.275 17.140 1.00 11.14 C ATOM 2841 CG LYS A 180 -10.961 2.483 16.449 1.00 4.25 C ATOM 2842 CD LYS A 180 -11.878 1.752 17.431 1.00 11.30 C ATOM 2843 CE LYS A 180 -12.677 2.714 18.304 1.00 14.32 C ATOM 2844 NZ LYS A 180 -13.583 1.993 19.240 1.00 43.14 N ATOM 0 H LYS A 180 -9.504 0.492 17.418 1.00 10.22 H new ATOM 0 HA LYS A 180 -7.816 2.883 17.816 1.00 33.44 H new ATOM 0 HB2 LYS A 180 -10.291 3.971 17.847 1.00 11.14 H new ATOM 0 HB3 LYS A 180 -9.322 3.873 16.390 1.00 11.14 H new ATOM 0 HG2 LYS A 180 -11.558 3.165 15.843 1.00 4.25 H new ATOM 0 HG3 LYS A 180 -10.517 1.757 15.768 1.00 4.25 H new ATOM 0 HD2 LYS A 180 -12.565 1.113 16.876 1.00 11.30 H new ATOM 0 HD3 LYS A 180 -11.279 1.100 18.067 1.00 11.30 H new ATOM 0 HE2 LYS A 180 -11.992 3.342 18.874 1.00 14.32 H new ATOM 0 HE3 LYS A 180 -13.264 3.378 17.669 1.00 14.32 H new ATOM 0 HZ1 LYS A 180 -14.108 2.682 19.815 1.00 43.14 H new ATOM 0 HZ2 LYS A 180 -14.254 1.413 18.696 1.00 43.14 H new ATOM 0 HZ3 LYS A 180 -13.021 1.379 19.863 1.00 43.14 H new