USER MOD reduce.3.24.130724 H: found=0, std=0, add=1024, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1022 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 21 MET CE :methyl 175:sc= -3.3! (180deg=-3.61!) USER MOD Set 1.2: A 138 THR OG1 : rot 22:sc= 1.59 USER MOD Set 2.1: A 35 ASN : amide:sc= -4.3 K(o=-4.3,f=-5.4!) USER MOD Set 2.2: A 89 LYS NZ :NH3+ -173:sc= -0.0379 (180deg=-0.187) USER MOD Set 3.1: A 28 TYR OH : rot -78:sc= -0.766! USER MOD Set 3.2: A 47 SER OG : rot -77:sc= 2.12 USER MOD Single : A 12 SER OG : rot 60:sc= 0.167 USER MOD Single : A 19 SER OG : rot -111:sc= 0.378 USER MOD Single : A 20 HIS : no HD1:sc= -0.575 X(o=-0.57,f=-0.092) USER MOD Single : A 30 THR OG1 : rot 180:sc= 0.00941 USER MOD Single : A 31 SER OG : rot -170:sc= -0.0501 USER MOD Single : A 32 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 34 THR OG1 : rot 52:sc= 0.879 USER MOD Single : A 36 THR OG1 : rot 180:sc= 0 USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 TYR OH : rot 25:sc= 1.24 USER MOD Single : A 48 SER OG : rot 93:sc= 0.693 USER MOD Single : A 52 THR OG1 : rot 23:sc= 0.268 USER MOD Single : A 55 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 56 THR OG1 : rot 120:sc= -1.72 USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 ASN : amide:sc= -0.571 X(o=-0.57,f=-0.09) USER MOD Single : A 63 LYS NZ :NH3+ 179:sc= 0.354 (180deg=0.351) USER MOD Single : A 65 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 67 TYR OH : rot 180:sc= -0.97! USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 71 LYS NZ :NH3+ 173:sc= 0.0235 (180deg=0.0181) USER MOD Single : A 72 HIS : no HD1:sc= -0.0978 X(o=-0.098,f=-0.0004) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 GLN : amide:sc= -1.13 X(o=-1.1,f=-0.96) USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 LYS NZ :NH3+ -144:sc= 0.371 (180deg=-0.348) USER MOD Single : A 96 ASN : amide:sc= -0.624 X(o=-0.62,f=-0.31) USER MOD Single : A 100 MET CE :methyl -121:sc= -1.45 (180deg=-2.75!) USER MOD Single : A 102 TYR OH : rot 160:sc= 0.319 USER MOD Single : A 105 SER OG : rot 140:sc= -1.39 USER MOD Single : A 106 TYR OH : rot 180:sc= 0 USER MOD Single : A 108 MET CE :methyl -140:sc= -1.48 (180deg=-3.67!) USER MOD Single : A 112 THR OG1 : rot -59:sc= 0.368 USER MOD Single : A 113 MET CE :methyl 175:sc= -2.05 (180deg=-2.14) USER MOD Single : A 120 TYR OH : rot 180:sc= 0 USER MOD Single : A 121 ASN : amide:sc= 0.079 K(o=0.079,f=-0.77) USER MOD Single : A 122 THR OG1 : rot 180:sc= -0.235 USER MOD Single : A 123 THR OG1 : rot -57:sc= 0.879 USER MOD Single : A 127 LYS NZ :NH3+ -146:sc= 0.74 (180deg=-0.811) USER MOD Single : A 132 ASN : amide:sc= 0.368 K(o=0.37,f=-0.53) USER MOD Single : A 134 THR OG1 : rot 180:sc= 0 USER MOD Single : A 139 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 12 1.329 0.000 0.000 1.00 2.00 N ATOM 2 CA SER A 12 2.094 0.002 -1.242 1.00 34.22 C ATOM 3 C SER A 12 3.589 -0.107 -0.959 1.00 71.34 C ATOM 4 O SER A 12 4.372 0.751 -1.362 1.00 45.32 O ATOM 5 CB SER A 12 1.805 1.274 -2.041 1.00 5.21 C ATOM 6 OG SER A 12 2.120 2.432 -1.287 1.00 45.12 O ATOM 0 HA SER A 12 1.790 -0.864 -1.830 1.00 34.22 H new ATOM 0 HB2 SER A 12 2.386 1.268 -2.963 1.00 5.21 H new ATOM 0 HB3 SER A 12 0.753 1.297 -2.326 1.00 5.21 H new ATOM 0 HG SER A 12 3.071 2.420 -1.050 1.00 45.12 H new ATOM 12 N GLY A 13 3.977 -1.171 -0.263 1.00 23.40 N ATOM 13 CA GLY A 13 5.377 -1.375 0.062 1.00 10.54 C ATOM 14 C GLY A 13 5.668 -2.794 0.508 1.00 5.32 C ATOM 15 O GLY A 13 6.388 -3.010 1.484 1.00 33.54 O ATOM 0 H GLY A 13 3.347 -1.895 0.082 1.00 23.40 H new ATOM 0 HA2 GLY A 13 5.987 -1.139 -0.810 1.00 10.54 H new ATOM 0 HA3 GLY A 13 5.668 -0.682 0.852 1.00 10.54 H new ATOM 19 N LEU A 14 5.108 -3.763 -0.206 1.00 64.35 N ATOM 20 CA LEU A 14 5.311 -5.170 0.122 1.00 74.32 C ATOM 21 C LEU A 14 4.971 -6.061 -1.069 1.00 22.44 C ATOM 22 O LEU A 14 3.800 -6.297 -1.368 1.00 4.15 O ATOM 23 CB LEU A 14 4.454 -5.561 1.327 1.00 33.40 C ATOM 24 CG LEU A 14 5.212 -5.867 2.619 1.00 62.51 C ATOM 25 CD1 LEU A 14 4.281 -5.779 3.818 1.00 21.42 C ATOM 26 CD2 LEU A 14 5.860 -7.242 2.544 1.00 31.51 C ATOM 0 H LEU A 14 4.510 -3.601 -1.016 1.00 64.35 H new ATOM 0 HA LEU A 14 6.363 -5.312 0.370 1.00 74.32 H new ATOM 0 HB2 LEU A 14 3.751 -4.752 1.525 1.00 33.40 H new ATOM 0 HB3 LEU A 14 3.864 -6.438 1.059 1.00 33.40 H new ATOM 0 HG LEU A 14 5.999 -5.123 2.741 1.00 62.51 H new ATOM 0 HD11 LEU A 14 4.838 -6.000 4.728 1.00 21.42 H new ATOM 0 HD12 LEU A 14 3.865 -4.774 3.882 1.00 21.42 H new ATOM 0 HD13 LEU A 14 3.472 -6.500 3.704 1.00 21.42 H new ATOM 0 HD21 LEU A 14 6.395 -7.443 3.472 1.00 31.51 H new ATOM 0 HD22 LEU A 14 5.090 -8.000 2.398 1.00 31.51 H new ATOM 0 HD23 LEU A 14 6.560 -7.269 1.709 1.00 31.51 H new ATOM 38 N VAL A 15 6.004 -6.557 -1.744 1.00 55.51 N ATOM 39 CA VAL A 15 5.815 -7.425 -2.900 1.00 41.11 C ATOM 40 C VAL A 15 4.903 -8.599 -2.563 1.00 14.33 C ATOM 41 O VAL A 15 5.058 -9.263 -1.538 1.00 33.21 O ATOM 42 CB VAL A 15 7.160 -7.967 -3.420 1.00 32.11 C ATOM 43 CG1 VAL A 15 7.890 -8.726 -2.322 1.00 73.34 C ATOM 44 CG2 VAL A 15 6.942 -8.852 -4.638 1.00 31.23 C ATOM 0 H VAL A 15 6.979 -6.372 -1.510 1.00 55.51 H new ATOM 0 HA VAL A 15 5.350 -6.819 -3.678 1.00 41.11 H new ATOM 0 HB VAL A 15 7.781 -7.123 -3.719 1.00 32.11 H new ATOM 0 HG11 VAL A 15 8.838 -9.102 -2.708 1.00 73.34 H new ATOM 0 HG12 VAL A 15 8.079 -8.058 -1.482 1.00 73.34 H new ATOM 0 HG13 VAL A 15 7.277 -9.563 -1.989 1.00 73.34 H new ATOM 0 HG21 VAL A 15 7.902 -9.226 -4.992 1.00 31.23 H new ATOM 0 HG22 VAL A 15 6.303 -9.692 -4.367 1.00 31.23 H new ATOM 0 HG23 VAL A 15 6.465 -8.272 -5.428 1.00 31.23 H new ATOM 54 N PRO A 16 3.927 -8.862 -3.445 1.00 22.32 N ATOM 55 CA PRO A 16 2.970 -9.958 -3.263 1.00 3.11 C ATOM 56 C PRO A 16 3.620 -11.328 -3.424 1.00 3.12 C ATOM 57 O PRO A 16 3.497 -11.965 -4.470 1.00 14.00 O ATOM 58 CB PRO A 16 1.943 -9.720 -4.373 1.00 2.34 C ATOM 59 CG PRO A 16 2.686 -8.965 -5.421 1.00 20.43 C ATOM 60 CD PRO A 16 3.684 -8.112 -4.688 1.00 15.51 C ATOM 0 HA PRO A 16 2.542 -9.963 -2.261 1.00 3.11 H new ATOM 0 HB2 PRO A 16 1.556 -10.661 -4.763 1.00 2.34 H new ATOM 0 HB3 PRO A 16 1.088 -9.151 -4.006 1.00 2.34 H new ATOM 0 HG2 PRO A 16 3.186 -9.645 -6.111 1.00 20.43 H new ATOM 0 HG3 PRO A 16 2.008 -8.351 -6.014 1.00 20.43 H new ATOM 0 HD2 PRO A 16 4.600 -7.981 -5.264 1.00 15.51 H new ATOM 0 HD3 PRO A 16 3.290 -7.116 -4.486 1.00 15.51 H new ATOM 68 N ARG A 17 4.312 -11.776 -2.381 1.00 42.42 N ATOM 69 CA ARG A 17 4.982 -13.070 -2.408 1.00 22.21 C ATOM 70 C ARG A 17 4.679 -13.866 -1.141 1.00 52.55 C ATOM 71 O ARG A 17 3.916 -13.421 -0.285 1.00 34.20 O ATOM 72 CB ARG A 17 6.493 -12.883 -2.556 1.00 23.32 C ATOM 73 CG ARG A 17 6.915 -12.398 -3.933 1.00 0.20 C ATOM 74 CD ARG A 17 8.149 -13.134 -4.429 1.00 65.04 C ATOM 75 NE ARG A 17 8.209 -13.181 -5.888 1.00 5.41 N ATOM 76 CZ ARG A 17 9.027 -13.979 -6.565 1.00 23.23 C ATOM 77 NH1 ARG A 17 9.849 -14.794 -5.918 1.00 3.23 N ATOM 78 NH2 ARG A 17 9.023 -13.964 -7.891 1.00 65.25 N ATOM 0 H ARG A 17 4.423 -11.262 -1.507 1.00 42.42 H new ATOM 0 HA ARG A 17 4.606 -13.628 -3.266 1.00 22.21 H new ATOM 0 HB2 ARG A 17 6.837 -12.169 -1.808 1.00 23.32 H new ATOM 0 HB3 ARG A 17 6.990 -13.830 -2.346 1.00 23.32 H new ATOM 0 HG2 ARG A 17 6.096 -12.543 -4.638 1.00 0.20 H new ATOM 0 HG3 ARG A 17 7.119 -11.328 -3.896 1.00 0.20 H new ATOM 0 HD2 ARG A 17 9.043 -12.642 -4.045 1.00 65.04 H new ATOM 0 HD3 ARG A 17 8.149 -14.150 -4.033 1.00 65.04 H new ATOM 0 HE ARG A 17 7.589 -12.567 -6.416 1.00 5.41 H new ATOM 0 HH11 ARG A 17 9.854 -14.809 -4.898 1.00 3.23 H new ATOM 0 HH12 ARG A 17 10.476 -15.406 -6.440 1.00 3.23 H new ATOM 0 HH21 ARG A 17 8.391 -13.339 -8.392 1.00 65.25 H new ATOM 0 HH22 ARG A 17 9.652 -14.577 -8.410 1.00 65.25 H new ATOM 92 N GLY A 18 5.282 -15.045 -1.031 1.00 22.33 N ATOM 93 CA GLY A 18 5.063 -15.884 0.133 1.00 4.12 C ATOM 94 C GLY A 18 6.294 -15.988 1.013 1.00 53.44 C ATOM 95 O GLY A 18 7.418 -16.050 0.514 1.00 14.15 O ATOM 0 H GLY A 18 5.918 -15.435 -1.727 1.00 22.33 H new ATOM 0 HA2 GLY A 18 4.236 -15.481 0.717 1.00 4.12 H new ATOM 0 HA3 GLY A 18 4.767 -16.881 -0.192 1.00 4.12 H new ATOM 99 N SER A 19 6.082 -16.004 2.325 1.00 73.43 N ATOM 100 CA SER A 19 7.183 -16.095 3.276 1.00 62.41 C ATOM 101 C SER A 19 8.058 -14.847 3.215 1.00 11.23 C ATOM 102 O SER A 19 8.217 -14.237 2.157 1.00 11.14 O ATOM 103 CB SER A 19 8.029 -17.338 2.992 1.00 34.50 C ATOM 104 OG SER A 19 7.869 -18.308 4.013 1.00 74.10 O ATOM 0 H SER A 19 5.158 -15.955 2.753 1.00 73.43 H new ATOM 0 HA SER A 19 6.760 -16.173 4.277 1.00 62.41 H new ATOM 0 HB2 SER A 19 7.742 -17.766 2.031 1.00 34.50 H new ATOM 0 HB3 SER A 19 9.079 -17.057 2.914 1.00 34.50 H new ATOM 0 HG SER A 19 8.699 -18.380 4.529 1.00 74.10 H new ATOM 110 N HIS A 20 8.623 -14.472 4.358 1.00 23.05 N ATOM 111 CA HIS A 20 9.483 -13.296 4.437 1.00 70.33 C ATOM 112 C HIS A 20 10.740 -13.485 3.593 1.00 72.14 C ATOM 113 O HIS A 20 11.683 -14.157 4.009 1.00 42.21 O ATOM 114 CB HIS A 20 9.868 -13.015 5.890 1.00 73.54 C ATOM 115 CG HIS A 20 8.700 -12.676 6.764 1.00 73.43 C ATOM 116 ND1 HIS A 20 8.663 -11.559 7.571 1.00 23.32 N ATOM 117 CD2 HIS A 20 7.521 -13.314 6.953 1.00 53.04 C ATOM 118 CE1 HIS A 20 7.513 -11.525 8.220 1.00 22.34 C ATOM 119 NE2 HIS A 20 6.801 -12.579 7.862 1.00 4.24 N ATOM 0 H HIS A 20 8.501 -14.965 5.242 1.00 23.05 H new ATOM 0 HA HIS A 20 8.928 -12.444 4.045 1.00 70.33 H new ATOM 0 HB2 HIS A 20 10.375 -13.889 6.298 1.00 73.54 H new ATOM 0 HB3 HIS A 20 10.582 -12.191 5.915 1.00 73.54 H new ATOM 0 HD2 HIS A 20 7.205 -14.231 6.477 1.00 53.04 H new ATOM 0 HE1 HIS A 20 7.207 -10.765 8.924 1.00 22.34 H new ATOM 0 HE2 HIS A 20 5.868 -12.809 8.205 1.00 4.24 H new ATOM 127 N MET A 21 10.744 -12.889 2.405 1.00 43.30 N ATOM 128 CA MET A 21 11.886 -12.991 1.503 1.00 34.30 C ATOM 129 C MET A 21 12.272 -11.620 0.957 1.00 60.51 C ATOM 130 O MET A 21 13.433 -11.217 1.029 1.00 31.12 O ATOM 131 CB MET A 21 11.566 -13.942 0.348 1.00 50.13 C ATOM 132 CG MET A 21 10.753 -15.156 0.767 1.00 53.22 C ATOM 133 SD MET A 21 11.339 -16.681 0.005 1.00 22.44 S ATOM 134 CE MET A 21 10.210 -17.873 0.722 1.00 64.21 C ATOM 0 H MET A 21 9.970 -12.331 2.045 1.00 43.30 H new ATOM 0 HA MET A 21 12.730 -13.387 2.068 1.00 34.30 H new ATOM 0 HB2 MET A 21 11.018 -13.396 -0.420 1.00 50.13 H new ATOM 0 HB3 MET A 21 12.499 -14.278 -0.104 1.00 50.13 H new ATOM 0 HG2 MET A 21 10.792 -15.258 1.852 1.00 53.22 H new ATOM 0 HG3 MET A 21 9.708 -14.999 0.499 1.00 53.22 H new ATOM 0 HE1 MET A 21 10.387 -18.853 0.280 1.00 64.21 H new ATOM 0 HE2 MET A 21 10.372 -17.926 1.799 1.00 64.21 H new ATOM 0 HE3 MET A 21 9.183 -17.566 0.524 1.00 64.21 H new ATOM 144 N VAL A 22 11.292 -10.908 0.410 1.00 33.41 N ATOM 145 CA VAL A 22 11.529 -9.582 -0.148 1.00 24.44 C ATOM 146 C VAL A 22 10.353 -8.652 0.126 1.00 31.20 C ATOM 147 O VAL A 22 9.230 -9.104 0.352 1.00 64.41 O ATOM 148 CB VAL A 22 11.775 -9.648 -1.667 1.00 21.23 C ATOM 149 CG1 VAL A 22 12.399 -8.353 -2.163 1.00 41.04 C ATOM 150 CG2 VAL A 22 12.654 -10.840 -2.013 1.00 24.34 C ATOM 0 H VAL A 22 10.326 -11.228 0.341 1.00 33.41 H new ATOM 0 HA VAL A 22 12.421 -9.188 0.340 1.00 24.44 H new ATOM 0 HB VAL A 22 10.815 -9.776 -2.168 1.00 21.23 H new ATOM 0 HG11 VAL A 22 12.566 -8.418 -3.238 1.00 41.04 H new ATOM 0 HG12 VAL A 22 11.728 -7.521 -1.949 1.00 41.04 H new ATOM 0 HG13 VAL A 22 13.351 -8.191 -1.657 1.00 41.04 H new ATOM 0 HG21 VAL A 22 12.817 -10.871 -3.090 1.00 24.34 H new ATOM 0 HG22 VAL A 22 13.613 -10.745 -1.503 1.00 24.34 H new ATOM 0 HG23 VAL A 22 12.163 -11.759 -1.694 1.00 24.34 H new ATOM 160 N ARG A 23 10.618 -7.350 0.104 1.00 74.02 N ATOM 161 CA ARG A 23 9.581 -6.355 0.350 1.00 33.32 C ATOM 162 C ARG A 23 10.015 -4.982 -0.153 1.00 14.52 C ATOM 163 O ARG A 23 11.193 -4.630 -0.088 1.00 54.34 O ATOM 164 CB ARG A 23 9.257 -6.284 1.844 1.00 73.44 C ATOM 165 CG ARG A 23 10.252 -5.461 2.644 1.00 24.25 C ATOM 166 CD ARG A 23 9.901 -5.447 4.124 1.00 62.30 C ATOM 167 NE ARG A 23 11.084 -5.595 4.969 1.00 75.15 N ATOM 168 CZ ARG A 23 11.061 -5.480 6.292 1.00 74.03 C ATOM 169 NH1 ARG A 23 9.922 -5.218 6.918 1.00 52.41 N ATOM 170 NH2 ARG A 23 12.178 -5.628 6.991 1.00 23.02 N ATOM 0 H ARG A 23 11.542 -6.959 -0.082 1.00 74.02 H new ATOM 0 HA ARG A 23 8.686 -6.656 -0.195 1.00 33.32 H new ATOM 0 HB2 ARG A 23 8.261 -5.859 1.971 1.00 73.44 H new ATOM 0 HB3 ARG A 23 9.226 -7.296 2.249 1.00 73.44 H new ATOM 0 HG2 ARG A 23 11.254 -5.869 2.510 1.00 24.25 H new ATOM 0 HG3 ARG A 23 10.270 -4.440 2.264 1.00 24.25 H new ATOM 0 HD2 ARG A 23 9.396 -4.512 4.368 1.00 62.30 H new ATOM 0 HD3 ARG A 23 9.200 -6.254 4.338 1.00 62.30 H new ATOM 0 HE ARG A 23 11.976 -5.798 4.518 1.00 75.15 H new ATOM 0 HH11 ARG A 23 9.061 -5.104 6.383 1.00 52.41 H new ATOM 0 HH12 ARG A 23 9.907 -5.130 7.934 1.00 52.41 H new ATOM 0 HH21 ARG A 23 13.056 -5.830 6.513 1.00 23.02 H new ATOM 0 HH22 ARG A 23 12.159 -5.539 8.007 1.00 23.02 H new ATOM 184 N ARG A 24 9.055 -4.210 -0.654 1.00 22.34 N ATOM 185 CA ARG A 24 9.338 -2.876 -1.169 1.00 63.31 C ATOM 186 C ARG A 24 9.686 -1.917 -0.034 1.00 62.43 C ATOM 187 O ARG A 24 8.846 -1.135 0.410 1.00 24.42 O ATOM 188 CB ARG A 24 8.137 -2.343 -1.951 1.00 73.05 C ATOM 189 CG ARG A 24 8.248 -2.549 -3.453 1.00 74.13 C ATOM 190 CD ARG A 24 7.234 -3.567 -3.952 1.00 54.43 C ATOM 191 NE ARG A 24 6.089 -2.928 -4.596 1.00 14.13 N ATOM 192 CZ ARG A 24 5.268 -3.558 -5.429 1.00 42.22 C ATOM 193 NH1 ARG A 24 5.465 -4.837 -5.718 1.00 42.44 N ATOM 194 NH2 ARG A 24 4.248 -2.908 -5.975 1.00 32.41 N ATOM 0 H ARG A 24 8.075 -4.486 -0.714 1.00 22.34 H new ATOM 0 HA ARG A 24 10.196 -2.947 -1.838 1.00 63.31 H new ATOM 0 HB2 ARG A 24 7.233 -2.834 -1.591 1.00 73.05 H new ATOM 0 HB3 ARG A 24 8.024 -1.278 -1.746 1.00 73.05 H new ATOM 0 HG2 ARG A 24 8.093 -1.599 -3.964 1.00 74.13 H new ATOM 0 HG3 ARG A 24 9.255 -2.884 -3.702 1.00 74.13 H new ATOM 0 HD2 ARG A 24 7.716 -4.243 -4.658 1.00 54.43 H new ATOM 0 HD3 ARG A 24 6.887 -4.174 -3.115 1.00 54.43 H new ATOM 0 HE ARG A 24 5.910 -1.944 -4.395 1.00 14.13 H new ATOM 0 HH11 ARG A 24 6.248 -5.339 -5.300 1.00 42.44 H new ATOM 0 HH12 ARG A 24 4.833 -5.318 -6.358 1.00 42.44 H new ATOM 0 HH21 ARG A 24 4.094 -1.924 -5.755 1.00 32.41 H new ATOM 0 HH22 ARG A 24 3.618 -3.392 -6.614 1.00 32.41 H new ATOM 208 N ALA A 25 10.930 -1.984 0.430 1.00 73.51 N ATOM 209 CA ALA A 25 11.389 -1.122 1.511 1.00 11.24 C ATOM 210 C ALA A 25 12.145 0.086 0.967 1.00 32.41 C ATOM 211 O ALA A 25 12.189 0.308 -0.243 1.00 1.21 O ATOM 212 CB ALA A 25 12.267 -1.906 2.475 1.00 11.14 C ATOM 0 H ALA A 25 11.637 -2.627 0.074 1.00 73.51 H new ATOM 0 HA ALA A 25 10.513 -0.758 2.048 1.00 11.24 H new ATOM 0 HB1 ALA A 25 12.603 -1.249 3.278 1.00 11.14 H new ATOM 0 HB2 ALA A 25 11.696 -2.732 2.898 1.00 11.14 H new ATOM 0 HB3 ALA A 25 13.133 -2.299 1.941 1.00 11.14 H new ATOM 218 N ARG A 26 12.737 0.862 1.868 1.00 2.32 N ATOM 219 CA ARG A 26 13.490 2.049 1.478 1.00 74.52 C ATOM 220 C ARG A 26 14.885 1.671 0.990 1.00 62.12 C ATOM 221 O ARG A 26 15.291 0.511 1.073 1.00 50.33 O ATOM 222 CB ARG A 26 13.595 3.022 2.653 1.00 32.35 C ATOM 223 CG ARG A 26 13.371 4.474 2.264 1.00 33.31 C ATOM 224 CD ARG A 26 12.778 5.274 3.414 1.00 63.33 C ATOM 225 NE ARG A 26 11.948 6.378 2.941 1.00 3.51 N ATOM 226 CZ ARG A 26 11.098 7.042 3.716 1.00 53.30 C ATOM 227 NH1 ARG A 26 10.966 6.715 4.994 1.00 20.00 N ATOM 228 NH2 ARG A 26 10.377 8.036 3.213 1.00 50.33 N ATOM 0 H ARG A 26 12.710 0.691 2.873 1.00 2.32 H new ATOM 0 HA ARG A 26 12.957 2.535 0.661 1.00 74.52 H new ATOM 0 HB2 ARG A 26 12.865 2.741 3.412 1.00 32.35 H new ATOM 0 HB3 ARG A 26 14.581 2.924 3.107 1.00 32.35 H new ATOM 0 HG2 ARG A 26 14.318 4.920 1.959 1.00 33.31 H new ATOM 0 HG3 ARG A 26 12.704 4.522 1.403 1.00 33.31 H new ATOM 0 HD2 ARG A 26 12.180 4.615 4.044 1.00 63.33 H new ATOM 0 HD3 ARG A 26 13.583 5.666 4.036 1.00 63.33 H new ATOM 0 HE ARG A 26 12.025 6.654 1.962 1.00 3.51 H new ATOM 0 HH11 ARG A 26 11.518 5.952 5.385 1.00 20.00 H new ATOM 0 HH12 ARG A 26 10.312 7.227 5.587 1.00 20.00 H new ATOM 0 HH21 ARG A 26 10.475 8.291 2.230 1.00 50.33 H new ATOM 0 HH22 ARG A 26 9.725 8.545 3.809 1.00 50.33 H new ATOM 242 N CYS A 27 15.615 2.657 0.480 1.00 2.44 N ATOM 243 CA CYS A 27 16.965 2.430 -0.022 1.00 73.02 C ATOM 244 C CYS A 27 17.725 3.747 -0.155 1.00 32.51 C ATOM 245 O CYS A 27 17.286 4.662 -0.852 1.00 35.34 O ATOM 246 CB CYS A 27 16.914 1.719 -1.376 1.00 22.11 C ATOM 247 SG CYS A 27 18.013 0.271 -1.497 1.00 5.31 S ATOM 0 H CYS A 27 15.294 3.622 0.403 1.00 2.44 H new ATOM 0 HA CYS A 27 17.491 1.798 0.694 1.00 73.02 H new ATOM 0 HB2 CYS A 27 15.889 1.401 -1.569 1.00 22.11 H new ATOM 0 HB3 CYS A 27 17.180 2.430 -2.158 1.00 22.11 H new ATOM 252 N TYR A 28 18.867 3.834 0.518 1.00 72.01 N ATOM 253 CA TYR A 28 19.687 5.039 0.477 1.00 24.53 C ATOM 254 C TYR A 28 21.149 4.693 0.209 1.00 1.24 C ATOM 255 O TYR A 28 21.641 3.628 0.583 1.00 73.03 O ATOM 256 CB TYR A 28 19.567 5.808 1.794 1.00 74.21 C ATOM 257 CG TYR A 28 20.031 5.022 2.999 1.00 25.02 C ATOM 258 CD1 TYR A 28 21.377 4.969 3.342 1.00 13.44 C ATOM 259 CD2 TYR A 28 19.125 4.333 3.795 1.00 31.24 C ATOM 260 CE1 TYR A 28 21.806 4.252 4.442 1.00 13.12 C ATOM 261 CE2 TYR A 28 19.545 3.614 4.898 1.00 53.01 C ATOM 262 CZ TYR A 28 20.886 3.576 5.217 1.00 41.31 C ATOM 263 OH TYR A 28 21.309 2.862 6.314 1.00 24.21 O ATOM 0 H TYR A 28 19.246 3.085 1.098 1.00 72.01 H new ATOM 0 HA TYR A 28 19.325 5.667 -0.337 1.00 24.53 H new ATOM 0 HB2 TYR A 28 20.150 6.726 1.723 1.00 74.21 H new ATOM 0 HB3 TYR A 28 18.527 6.101 1.940 1.00 74.21 H new ATOM 0 HD1 TYR A 28 22.100 5.497 2.738 1.00 13.44 H new ATOM 0 HD2 TYR A 28 18.074 4.360 3.548 1.00 31.24 H new ATOM 0 HE1 TYR A 28 22.856 4.221 4.694 1.00 13.12 H new ATOM 0 HE2 TYR A 28 18.827 3.085 5.507 1.00 53.01 H new ATOM 0 HH TYR A 28 21.689 2.007 6.021 1.00 24.21 H new ATOM 273 N PRO A 29 21.862 5.616 -0.453 1.00 50.04 N ATOM 274 CA PRO A 29 23.278 5.434 -0.786 1.00 20.11 C ATOM 275 C PRO A 29 24.174 5.485 0.447 1.00 42.12 C ATOM 276 O PRO A 29 24.319 6.532 1.079 1.00 25.12 O ATOM 277 CB PRO A 29 23.579 6.613 -1.715 1.00 33.31 C ATOM 278 CG PRO A 29 22.580 7.653 -1.342 1.00 10.30 C ATOM 279 CD PRO A 29 21.341 6.909 -0.929 1.00 33.42 C ATOM 0 HA PRO A 29 23.469 4.460 -1.236 1.00 20.11 H new ATOM 0 HB2 PRO A 29 24.598 6.975 -1.578 1.00 33.31 H new ATOM 0 HB3 PRO A 29 23.481 6.327 -2.762 1.00 33.31 H new ATOM 0 HG2 PRO A 29 22.951 8.276 -0.528 1.00 10.30 H new ATOM 0 HG3 PRO A 29 22.375 8.316 -2.182 1.00 10.30 H new ATOM 0 HD2 PRO A 29 20.798 7.437 -0.145 1.00 33.42 H new ATOM 0 HD3 PRO A 29 20.652 6.782 -1.764 1.00 33.42 H new ATOM 287 N THR A 30 24.775 4.348 0.784 1.00 34.11 N ATOM 288 CA THR A 30 25.656 4.263 1.942 1.00 42.24 C ATOM 289 C THR A 30 26.976 4.980 1.681 1.00 21.11 C ATOM 290 O THR A 30 27.240 6.040 2.249 1.00 65.32 O ATOM 291 CB THR A 30 25.946 2.799 2.321 1.00 64.34 C ATOM 292 OG1 THR A 30 24.797 1.987 2.055 1.00 63.24 O ATOM 293 CG2 THR A 30 26.325 2.685 3.790 1.00 60.24 C ATOM 0 H THR A 30 24.667 3.473 0.271 1.00 34.11 H new ATOM 0 HA THR A 30 25.139 4.749 2.770 1.00 42.24 H new ATOM 0 HB THR A 30 26.784 2.450 1.718 1.00 64.34 H new ATOM 0 HG1 THR A 30 24.990 1.057 2.297 1.00 63.24 H new ATOM 0 HG21 THR A 30 26.525 1.642 4.034 1.00 60.24 H new ATOM 0 HG22 THR A 30 27.217 3.281 3.983 1.00 60.24 H new ATOM 0 HG23 THR A 30 25.504 3.051 4.407 1.00 60.24 H new ATOM 301 N SER A 31 27.801 4.395 0.819 1.00 44.44 N ATOM 302 CA SER A 31 29.096 4.977 0.485 1.00 2.42 C ATOM 303 C SER A 31 29.109 5.487 -0.953 1.00 33.21 C ATOM 304 O SER A 31 28.235 5.148 -1.750 1.00 44.23 O ATOM 305 CB SER A 31 30.209 3.946 0.683 1.00 72.15 C ATOM 306 OG SER A 31 30.290 3.536 2.037 1.00 41.33 O ATOM 0 H SER A 31 27.596 3.519 0.339 1.00 44.44 H new ATOM 0 HA SER A 31 29.270 5.821 1.152 1.00 2.42 H new ATOM 0 HB2 SER A 31 30.024 3.080 0.048 1.00 72.15 H new ATOM 0 HB3 SER A 31 31.163 4.372 0.371 1.00 72.15 H new ATOM 0 HG SER A 31 31.101 3.003 2.169 1.00 41.33 H new ATOM 312 N ASN A 32 30.106 6.303 -1.276 1.00 43.40 N ATOM 313 CA ASN A 32 30.234 6.861 -2.618 1.00 14.14 C ATOM 314 C ASN A 32 30.159 5.762 -3.673 1.00 22.21 C ATOM 315 O ASN A 32 29.398 5.861 -4.635 1.00 2.32 O ATOM 316 CB ASN A 32 31.553 7.624 -2.752 1.00 52.41 C ATOM 317 CG ASN A 32 31.342 9.112 -2.960 1.00 34.34 C ATOM 318 OD1 ASN A 32 31.600 9.642 -4.040 1.00 65.00 O ATOM 319 ND2 ASN A 32 30.869 9.792 -1.922 1.00 2.42 N ATOM 0 H ASN A 32 30.838 6.593 -0.627 1.00 43.40 H new ATOM 0 HA ASN A 32 29.406 7.551 -2.778 1.00 14.14 H new ATOM 0 HB2 ASN A 32 32.153 7.467 -1.856 1.00 52.41 H new ATOM 0 HB3 ASN A 32 32.120 7.220 -3.590 1.00 52.41 H new ATOM 0 HD21 ASN A 32 30.705 10.796 -2.002 1.00 2.42 H new ATOM 0 HD22 ASN A 32 30.669 9.311 -1.045 1.00 2.42 H new ATOM 326 N ALA A 33 30.955 4.714 -3.485 1.00 35.22 N ATOM 327 CA ALA A 33 30.977 3.595 -4.418 1.00 61.35 C ATOM 328 C ALA A 33 30.129 2.435 -3.906 1.00 44.33 C ATOM 329 O ALA A 33 29.222 1.965 -4.593 1.00 71.50 O ATOM 330 CB ALA A 33 32.408 3.138 -4.660 1.00 42.15 C ATOM 0 H ALA A 33 31.593 4.617 -2.695 1.00 35.22 H new ATOM 0 HA ALA A 33 30.550 3.933 -5.362 1.00 61.35 H new ATOM 0 HB1 ALA A 33 32.410 2.302 -5.359 1.00 42.15 H new ATOM 0 HB2 ALA A 33 32.987 3.961 -5.078 1.00 42.15 H new ATOM 0 HB3 ALA A 33 32.854 2.823 -3.716 1.00 42.15 H new ATOM 336 N THR A 34 30.431 1.977 -2.695 1.00 51.41 N ATOM 337 CA THR A 34 29.698 0.872 -2.092 1.00 31.43 C ATOM 338 C THR A 34 30.203 0.581 -0.683 1.00 15.21 C ATOM 339 O THR A 34 31.407 0.475 -0.455 1.00 34.44 O ATOM 340 CB THR A 34 29.814 -0.409 -2.940 1.00 54.44 C ATOM 341 OG1 THR A 34 29.292 -1.527 -2.214 1.00 2.13 O ATOM 342 CG2 THR A 34 31.262 -0.676 -3.322 1.00 12.12 C ATOM 0 H THR A 34 31.179 2.355 -2.113 1.00 51.41 H new ATOM 0 HA THR A 34 28.652 1.175 -2.046 1.00 31.43 H new ATOM 0 HB THR A 34 29.235 -0.268 -3.852 1.00 54.44 H new ATOM 0 HG1 THR A 34 28.389 -1.318 -1.896 1.00 2.13 H new ATOM 0 HG21 THR A 34 31.319 -1.585 -3.920 1.00 12.12 H new ATOM 0 HG22 THR A 34 31.646 0.164 -3.901 1.00 12.12 H new ATOM 0 HG23 THR A 34 31.860 -0.798 -2.419 1.00 12.12 H new ATOM 350 N ASN A 35 29.273 0.454 0.259 1.00 65.51 N ATOM 351 CA ASN A 35 29.625 0.175 1.647 1.00 61.14 C ATOM 352 C ASN A 35 30.555 -1.031 1.741 1.00 41.15 C ATOM 353 O ASN A 35 30.619 -1.853 0.826 1.00 44.13 O ATOM 354 CB ASN A 35 28.363 -0.075 2.474 1.00 14.11 C ATOM 355 CG ASN A 35 28.630 -0.024 3.966 1.00 13.30 C ATOM 356 OD1 ASN A 35 28.556 1.038 4.585 1.00 32.20 O ATOM 357 ND2 ASN A 35 28.943 -1.174 4.551 1.00 75.33 N ATOM 0 H ASN A 35 28.271 0.540 0.087 1.00 65.51 H new ATOM 0 HA ASN A 35 30.146 1.045 2.045 1.00 61.14 H new ATOM 0 HB2 ASN A 35 27.610 0.670 2.217 1.00 14.11 H new ATOM 0 HB3 ASN A 35 27.949 -1.049 2.215 1.00 14.11 H new ATOM 0 HD21 ASN A 35 29.134 -1.201 5.553 1.00 75.33 H new ATOM 0 HD22 ASN A 35 28.993 -2.030 3.999 1.00 75.33 H new ATOM 364 N THR A 36 31.275 -1.131 2.854 1.00 71.02 N ATOM 365 CA THR A 36 32.202 -2.235 3.068 1.00 73.20 C ATOM 366 C THR A 36 31.890 -2.970 4.366 1.00 23.55 C ATOM 367 O THR A 36 31.437 -2.368 5.340 1.00 51.21 O ATOM 368 CB THR A 36 33.661 -1.744 3.107 1.00 62.13 C ATOM 369 OG1 THR A 36 33.837 -0.659 2.189 1.00 25.02 O ATOM 370 CG2 THR A 36 34.621 -2.871 2.757 1.00 31.52 C ATOM 0 H THR A 36 31.234 -0.460 3.621 1.00 71.02 H new ATOM 0 HA THR A 36 32.079 -2.919 2.228 1.00 73.20 H new ATOM 0 HB THR A 36 33.879 -1.403 4.119 1.00 62.13 H new ATOM 0 HG1 THR A 36 34.767 -0.351 2.221 1.00 25.02 H new ATOM 0 HG21 THR A 36 35.645 -2.500 2.791 1.00 31.52 H new ATOM 0 HG22 THR A 36 34.505 -3.684 3.474 1.00 31.52 H new ATOM 0 HG23 THR A 36 34.401 -3.238 1.754 1.00 31.52 H new ATOM 378 N CYS A 37 32.137 -4.276 4.375 1.00 32.24 N ATOM 379 CA CYS A 37 31.883 -5.095 5.555 1.00 40.23 C ATOM 380 C CYS A 37 33.034 -6.067 5.800 1.00 14.30 C ATOM 381 O CYS A 37 33.335 -6.914 4.959 1.00 32.12 O ATOM 382 CB CYS A 37 30.573 -5.869 5.392 1.00 2.51 C ATOM 383 SG CYS A 37 30.210 -7.012 6.763 1.00 62.44 S ATOM 0 H CYS A 37 32.513 -4.790 3.578 1.00 32.24 H new ATOM 0 HA CYS A 37 31.801 -4.432 6.416 1.00 40.23 H new ATOM 0 HB2 CYS A 37 29.752 -5.158 5.299 1.00 2.51 H new ATOM 0 HB3 CYS A 37 30.611 -6.435 4.461 1.00 2.51 H new ATOM 388 N PHE A 38 33.673 -5.938 6.958 1.00 50.21 N ATOM 389 CA PHE A 38 34.791 -6.804 7.314 1.00 11.34 C ATOM 390 C PHE A 38 35.867 -6.776 6.233 1.00 51.21 C ATOM 391 O PHE A 38 36.369 -7.818 5.814 1.00 12.01 O ATOM 392 CB PHE A 38 34.304 -8.238 7.529 1.00 61.44 C ATOM 393 CG PHE A 38 33.777 -8.492 8.912 1.00 74.32 C ATOM 394 CD1 PHE A 38 33.231 -7.461 9.659 1.00 32.24 C ATOM 395 CD2 PHE A 38 33.826 -9.762 9.464 1.00 11.12 C ATOM 396 CE1 PHE A 38 32.745 -7.692 10.933 1.00 65.14 C ATOM 397 CE2 PHE A 38 33.342 -9.999 10.737 1.00 53.11 C ATOM 398 CZ PHE A 38 32.800 -8.963 11.472 1.00 52.44 C ATOM 0 H PHE A 38 33.436 -5.243 7.666 1.00 50.21 H new ATOM 0 HA PHE A 38 35.225 -6.432 8.242 1.00 11.34 H new ATOM 0 HB2 PHE A 38 33.521 -8.459 6.804 1.00 61.44 H new ATOM 0 HB3 PHE A 38 35.126 -8.926 7.330 1.00 61.44 H new ATOM 0 HD1 PHE A 38 33.184 -6.466 9.242 1.00 32.24 H new ATOM 0 HD2 PHE A 38 34.247 -10.576 8.893 1.00 11.12 H new ATOM 0 HE1 PHE A 38 32.323 -6.880 11.506 1.00 65.14 H new ATOM 0 HE2 PHE A 38 33.388 -10.993 11.156 1.00 53.11 H new ATOM 0 HZ PHE A 38 32.420 -9.146 12.466 1.00 52.44 H new ATOM 408 N GLY A 39 36.216 -5.574 5.784 1.00 11.44 N ATOM 409 CA GLY A 39 37.229 -5.431 4.755 1.00 22.33 C ATOM 410 C GLY A 39 36.668 -5.616 3.359 1.00 12.34 C ATOM 411 O GLY A 39 36.817 -4.744 2.503 1.00 71.31 O ATOM 0 H GLY A 39 35.815 -4.696 6.115 1.00 11.44 H new ATOM 0 HA2 GLY A 39 37.684 -4.444 4.832 1.00 22.33 H new ATOM 0 HA3 GLY A 39 38.020 -6.161 4.925 1.00 22.33 H new ATOM 415 N SER A 40 36.022 -6.754 3.129 1.00 74.13 N ATOM 416 CA SER A 40 35.441 -7.053 1.825 1.00 53.30 C ATOM 417 C SER A 40 34.247 -6.146 1.542 1.00 73.13 C ATOM 418 O SER A 40 33.285 -6.108 2.309 1.00 32.12 O ATOM 419 CB SER A 40 35.009 -8.519 1.759 1.00 20.02 C ATOM 420 OG SER A 40 35.969 -9.303 1.071 1.00 14.34 O ATOM 0 H SER A 40 35.887 -7.484 3.828 1.00 74.13 H new ATOM 0 HA SER A 40 36.202 -6.872 1.066 1.00 53.30 H new ATOM 0 HB2 SER A 40 34.874 -8.907 2.768 1.00 20.02 H new ATOM 0 HB3 SER A 40 34.045 -8.595 1.256 1.00 20.02 H new ATOM 0 HG SER A 40 35.671 -10.236 1.044 1.00 14.34 H new ATOM 426 N LYS A 41 34.316 -5.416 0.433 1.00 31.54 N ATOM 427 CA LYS A 41 33.242 -4.510 0.045 1.00 12.04 C ATOM 428 C LYS A 41 31.992 -5.287 -0.354 1.00 35.10 C ATOM 429 O LYS A 41 32.080 -6.367 -0.939 1.00 61.33 O ATOM 430 CB LYS A 41 33.693 -3.618 -1.114 1.00 31.33 C ATOM 431 CG LYS A 41 35.010 -2.907 -0.857 1.00 10.32 C ATOM 432 CD LYS A 41 35.517 -2.205 -2.105 1.00 43.42 C ATOM 433 CE LYS A 41 34.530 -1.156 -2.595 1.00 4.12 C ATOM 434 NZ LYS A 41 35.114 -0.302 -3.666 1.00 62.22 N ATOM 0 H LYS A 41 35.105 -5.435 -0.213 1.00 31.54 H new ATOM 0 HA LYS A 41 33.000 -3.884 0.904 1.00 12.04 H new ATOM 0 HB2 LYS A 41 33.787 -4.226 -2.014 1.00 31.33 H new ATOM 0 HB3 LYS A 41 32.921 -2.874 -1.311 1.00 31.33 H new ATOM 0 HG2 LYS A 41 34.881 -2.179 -0.056 1.00 10.32 H new ATOM 0 HG3 LYS A 41 35.753 -3.628 -0.516 1.00 10.32 H new ATOM 0 HD2 LYS A 41 36.476 -1.733 -1.894 1.00 43.42 H new ATOM 0 HD3 LYS A 41 35.690 -2.939 -2.892 1.00 43.42 H new ATOM 0 HE2 LYS A 41 33.634 -1.649 -2.972 1.00 4.12 H new ATOM 0 HE3 LYS A 41 34.221 -0.529 -1.758 1.00 4.12 H new ATOM 0 HZ1 LYS A 41 34.410 0.400 -3.973 1.00 62.22 H new ATOM 0 HZ2 LYS A 41 35.955 0.188 -3.299 1.00 62.22 H new ATOM 0 HZ3 LYS A 41 35.385 -0.897 -4.475 1.00 62.22 H new ATOM 448 N LEU A 42 30.828 -4.731 -0.036 1.00 10.14 N ATOM 449 CA LEU A 42 29.559 -5.371 -0.363 1.00 32.31 C ATOM 450 C LEU A 42 29.182 -5.121 -1.819 1.00 51.45 C ATOM 451 O LEU A 42 29.542 -4.104 -2.413 1.00 53.22 O ATOM 452 CB LEU A 42 28.452 -4.855 0.558 1.00 20.13 C ATOM 453 CG LEU A 42 28.657 -5.095 2.054 1.00 24.53 C ATOM 454 CD1 LEU A 42 29.218 -6.488 2.299 1.00 0.23 C ATOM 455 CD2 LEU A 42 29.578 -4.037 2.643 1.00 2.41 C ATOM 0 H LEU A 42 30.737 -3.838 0.448 1.00 10.14 H new ATOM 0 HA LEU A 42 29.674 -6.445 -0.216 1.00 32.31 H new ATOM 0 HB2 LEU A 42 28.341 -3.783 0.394 1.00 20.13 H new ATOM 0 HB3 LEU A 42 27.513 -5.322 0.261 1.00 20.13 H new ATOM 0 HG LEU A 42 27.689 -5.022 2.550 1.00 24.53 H new ATOM 0 HD11 LEU A 42 29.357 -6.641 3.369 1.00 0.23 H new ATOM 0 HD12 LEU A 42 28.522 -7.233 1.913 1.00 0.23 H new ATOM 0 HD13 LEU A 42 30.177 -6.589 1.790 1.00 0.23 H new ATOM 0 HD21 LEU A 42 29.712 -4.224 3.708 1.00 2.41 H new ATOM 0 HD22 LEU A 42 30.546 -4.078 2.143 1.00 2.41 H new ATOM 0 HD23 LEU A 42 29.137 -3.050 2.500 1.00 2.41 H new ATOM 467 N PRO A 43 28.438 -6.068 -2.410 1.00 12.41 N ATOM 468 CA PRO A 43 27.993 -5.971 -3.803 1.00 43.45 C ATOM 469 C PRO A 43 26.943 -4.883 -4.003 1.00 22.14 C ATOM 470 O PRO A 43 26.556 -4.580 -5.131 1.00 50.34 O ATOM 471 CB PRO A 43 27.393 -7.351 -4.081 1.00 71.01 C ATOM 472 CG PRO A 43 26.977 -7.859 -2.744 1.00 31.12 C ATOM 473 CD PRO A 43 27.973 -7.306 -1.762 1.00 53.44 C ATOM 0 HA PRO A 43 28.810 -5.703 -4.473 1.00 43.45 H new ATOM 0 HB2 PRO A 43 26.544 -7.284 -4.761 1.00 71.01 H new ATOM 0 HB3 PRO A 43 28.123 -8.013 -4.547 1.00 71.01 H new ATOM 0 HG2 PRO A 43 25.966 -7.533 -2.500 1.00 31.12 H new ATOM 0 HG3 PRO A 43 26.974 -8.949 -2.724 1.00 31.12 H new ATOM 0 HD2 PRO A 43 27.514 -7.105 -0.794 1.00 53.44 H new ATOM 0 HD3 PRO A 43 28.794 -8.001 -1.587 1.00 53.44 H new ATOM 481 N TYR A 44 26.486 -4.299 -2.900 1.00 64.53 N ATOM 482 CA TYR A 44 25.479 -3.247 -2.954 1.00 42.51 C ATOM 483 C TYR A 44 26.024 -1.941 -2.382 1.00 64.43 C ATOM 484 O TYR A 44 26.844 -1.948 -1.465 1.00 23.32 O ATOM 485 CB TYR A 44 24.227 -3.670 -2.184 1.00 50.24 C ATOM 486 CG TYR A 44 24.518 -4.555 -0.994 1.00 24.30 C ATOM 487 CD1 TYR A 44 24.882 -4.009 0.231 1.00 53.43 C ATOM 488 CD2 TYR A 44 24.431 -5.938 -1.094 1.00 25.31 C ATOM 489 CE1 TYR A 44 25.150 -4.814 1.321 1.00 14.41 C ATOM 490 CE2 TYR A 44 24.696 -6.751 -0.009 1.00 1.14 C ATOM 491 CZ TYR A 44 25.055 -6.184 1.197 1.00 51.05 C ATOM 492 OH TYR A 44 25.321 -6.990 2.280 1.00 73.14 O ATOM 0 H TYR A 44 26.797 -4.537 -1.958 1.00 64.53 H new ATOM 0 HA TYR A 44 25.217 -3.084 -3.999 1.00 42.51 H new ATOM 0 HB2 TYR A 44 23.702 -2.778 -1.843 1.00 50.24 H new ATOM 0 HB3 TYR A 44 23.555 -4.196 -2.862 1.00 50.24 H new ATOM 0 HD1 TYR A 44 24.957 -2.936 0.333 1.00 53.43 H new ATOM 0 HD2 TYR A 44 24.151 -6.385 -2.036 1.00 25.31 H new ATOM 0 HE1 TYR A 44 25.432 -4.373 2.265 1.00 14.41 H new ATOM 0 HE2 TYR A 44 24.623 -7.824 -0.104 1.00 1.14 H new ATOM 0 HH TYR A 44 25.168 -6.487 3.107 1.00 73.14 H new ATOM 502 N GLU A 45 25.561 -0.823 -2.932 1.00 24.00 N ATOM 503 CA GLU A 45 26.002 0.490 -2.477 1.00 44.31 C ATOM 504 C GLU A 45 24.869 1.232 -1.775 1.00 33.24 C ATOM 505 O GLU A 45 25.015 2.393 -1.391 1.00 11.11 O ATOM 506 CB GLU A 45 26.514 1.318 -3.658 1.00 13.52 C ATOM 507 CG GLU A 45 25.406 1.860 -4.546 1.00 63.12 C ATOM 508 CD GLU A 45 25.916 2.323 -5.897 1.00 42.11 C ATOM 509 OE1 GLU A 45 26.286 3.510 -6.016 1.00 13.22 O ATOM 510 OE2 GLU A 45 25.945 1.499 -6.835 1.00 45.51 O ATOM 0 H GLU A 45 24.881 -0.800 -3.692 1.00 24.00 H new ATOM 0 HA GLU A 45 26.814 0.345 -1.765 1.00 44.31 H new ATOM 0 HB2 GLU A 45 27.104 2.152 -3.278 1.00 13.52 H new ATOM 0 HB3 GLU A 45 27.183 0.703 -4.260 1.00 13.52 H new ATOM 0 HG2 GLU A 45 24.651 1.087 -4.692 1.00 63.12 H new ATOM 0 HG3 GLU A 45 24.916 2.693 -4.042 1.00 63.12 H new ATOM 517 N LEU A 46 23.739 0.553 -1.610 1.00 54.22 N ATOM 518 CA LEU A 46 22.578 1.147 -0.955 1.00 23.55 C ATOM 519 C LEU A 46 22.259 0.421 0.349 1.00 45.31 C ATOM 520 O LEU A 46 22.846 -0.617 0.653 1.00 61.34 O ATOM 521 CB LEU A 46 21.365 1.104 -1.885 1.00 51.20 C ATOM 522 CG LEU A 46 21.492 1.891 -3.190 1.00 13.53 C ATOM 523 CD1 LEU A 46 20.378 1.511 -4.153 1.00 64.12 C ATOM 524 CD2 LEU A 46 21.472 3.388 -2.914 1.00 23.14 C ATOM 0 H LEU A 46 23.602 -0.409 -1.920 1.00 54.22 H new ATOM 0 HA LEU A 46 22.814 2.186 -0.724 1.00 23.55 H new ATOM 0 HB2 LEU A 46 21.157 0.063 -2.131 1.00 51.20 H new ATOM 0 HB3 LEU A 46 20.500 1.481 -1.339 1.00 51.20 H new ATOM 0 HG LEU A 46 22.446 1.639 -3.652 1.00 13.53 H new ATOM 0 HD11 LEU A 46 20.485 2.081 -5.076 1.00 64.12 H new ATOM 0 HD12 LEU A 46 20.437 0.446 -4.376 1.00 64.12 H new ATOM 0 HD13 LEU A 46 19.413 1.734 -3.699 1.00 64.12 H new ATOM 0 HD21 LEU A 46 21.563 3.933 -3.854 1.00 23.14 H new ATOM 0 HD22 LEU A 46 20.533 3.656 -2.429 1.00 23.14 H new ATOM 0 HD23 LEU A 46 22.305 3.649 -2.261 1.00 23.14 H new ATOM 536 N SER A 47 21.325 0.975 1.115 1.00 74.12 N ATOM 537 CA SER A 47 20.928 0.382 2.387 1.00 65.34 C ATOM 538 C SER A 47 19.489 0.751 2.733 1.00 23.13 C ATOM 539 O SER A 47 19.012 1.830 2.382 1.00 74.40 O ATOM 540 CB SER A 47 21.868 0.842 3.503 1.00 40.02 C ATOM 541 OG SER A 47 21.243 0.739 4.770 1.00 11.14 O ATOM 0 H SER A 47 20.829 1.834 0.877 1.00 74.12 H new ATOM 0 HA SER A 47 20.993 -0.702 2.291 1.00 65.34 H new ATOM 0 HB2 SER A 47 22.775 0.238 3.491 1.00 40.02 H new ATOM 0 HB3 SER A 47 22.170 1.874 3.326 1.00 40.02 H new ATOM 0 HG SER A 47 20.616 1.483 4.887 1.00 11.14 H new ATOM 547 N SER A 48 18.803 -0.153 3.425 1.00 24.32 N ATOM 548 CA SER A 48 17.417 0.074 3.817 1.00 43.11 C ATOM 549 C SER A 48 17.277 0.084 5.336 1.00 33.10 C ATOM 550 O SER A 48 17.275 -0.967 5.978 1.00 73.51 O ATOM 551 CB SER A 48 16.512 -1.003 3.216 1.00 21.24 C ATOM 552 OG SER A 48 15.148 -0.736 3.494 1.00 63.04 O ATOM 0 H SER A 48 19.185 -1.050 3.726 1.00 24.32 H new ATOM 0 HA SER A 48 17.112 1.048 3.435 1.00 43.11 H new ATOM 0 HB2 SER A 48 16.664 -1.050 2.138 1.00 21.24 H new ATOM 0 HB3 SER A 48 16.785 -1.978 3.619 1.00 21.24 H new ATOM 0 HG SER A 48 14.758 -0.222 2.756 1.00 63.04 H new ATOM 558 N LEU A 49 17.159 1.278 5.905 1.00 2.41 N ATOM 559 CA LEU A 49 17.018 1.427 7.349 1.00 11.25 C ATOM 560 C LEU A 49 15.759 0.725 7.849 1.00 42.04 C ATOM 561 O LEU A 49 15.652 0.384 9.027 1.00 63.02 O ATOM 562 CB LEU A 49 16.973 2.909 7.727 1.00 21.24 C ATOM 563 CG LEU A 49 17.917 3.344 8.849 1.00 51.32 C ATOM 564 CD1 LEU A 49 17.444 2.798 10.187 1.00 52.11 C ATOM 565 CD2 LEU A 49 19.339 2.887 8.557 1.00 52.33 C ATOM 0 H LEU A 49 17.158 2.158 5.388 1.00 2.41 H new ATOM 0 HA LEU A 49 17.883 0.963 7.823 1.00 11.25 H new ATOM 0 HB2 LEU A 49 17.202 3.497 6.838 1.00 21.24 H new ATOM 0 HB3 LEU A 49 15.953 3.158 8.020 1.00 21.24 H new ATOM 0 HG LEU A 49 17.910 4.433 8.902 1.00 51.32 H new ATOM 0 HD11 LEU A 49 18.128 3.118 10.973 1.00 52.11 H new ATOM 0 HD12 LEU A 49 16.444 3.175 10.401 1.00 52.11 H new ATOM 0 HD13 LEU A 49 17.420 1.709 10.148 1.00 52.11 H new ATOM 0 HD21 LEU A 49 19.997 3.205 9.366 1.00 52.33 H new ATOM 0 HD22 LEU A 49 19.363 1.800 8.476 1.00 52.33 H new ATOM 0 HD23 LEU A 49 19.678 3.328 7.619 1.00 52.33 H new ATOM 577 N ASP A 50 14.810 0.510 6.945 1.00 51.45 N ATOM 578 CA ASP A 50 13.559 -0.154 7.292 1.00 63.50 C ATOM 579 C ASP A 50 13.819 -1.567 7.805 1.00 24.31 C ATOM 580 O ASP A 50 13.057 -2.095 8.617 1.00 44.25 O ATOM 581 CB ASP A 50 12.628 -0.202 6.079 1.00 23.25 C ATOM 582 CG ASP A 50 11.170 -0.331 6.474 1.00 41.51 C ATOM 583 OD1 ASP A 50 10.871 -0.233 7.683 1.00 42.12 O ATOM 584 OD2 ASP A 50 10.328 -0.528 5.574 1.00 54.32 O ATOM 0 H ASP A 50 14.883 0.786 5.966 1.00 51.45 H new ATOM 0 HA ASP A 50 13.080 0.420 8.085 1.00 63.50 H new ATOM 0 HB2 ASP A 50 12.762 0.702 5.486 1.00 23.25 H new ATOM 0 HB3 ASP A 50 12.906 -1.044 5.445 1.00 23.25 H new ATOM 589 N LEU A 51 14.899 -2.176 7.326 1.00 0.45 N ATOM 590 CA LEU A 51 15.260 -3.529 7.736 1.00 53.52 C ATOM 591 C LEU A 51 15.423 -3.614 9.250 1.00 42.00 C ATOM 592 O LEU A 51 15.302 -4.689 9.839 1.00 1.53 O ATOM 593 CB LEU A 51 16.554 -3.963 7.046 1.00 21.23 C ATOM 594 CG LEU A 51 16.702 -5.462 6.780 1.00 43.40 C ATOM 595 CD1 LEU A 51 16.621 -5.749 5.289 1.00 70.31 C ATOM 596 CD2 LEU A 51 18.014 -5.978 7.354 1.00 74.10 C ATOM 0 H LEU A 51 15.540 -1.754 6.654 1.00 0.45 H new ATOM 0 HA LEU A 51 14.454 -4.200 7.438 1.00 53.52 H new ATOM 0 HB2 LEU A 51 16.629 -3.436 6.095 1.00 21.23 H new ATOM 0 HB3 LEU A 51 17.395 -3.638 7.658 1.00 21.23 H new ATOM 0 HG LEU A 51 15.882 -5.983 7.275 1.00 43.40 H new ATOM 0 HD11 LEU A 51 16.728 -6.820 5.118 1.00 70.31 H new ATOM 0 HD12 LEU A 51 15.657 -5.415 4.906 1.00 70.31 H new ATOM 0 HD13 LEU A 51 17.420 -5.217 4.772 1.00 70.31 H new ATOM 0 HD21 LEU A 51 18.103 -7.046 7.156 1.00 74.10 H new ATOM 0 HD22 LEU A 51 18.847 -5.452 6.888 1.00 74.10 H new ATOM 0 HD23 LEU A 51 18.033 -5.806 8.430 1.00 74.10 H new ATOM 608 N THR A 52 15.697 -2.473 9.876 1.00 64.52 N ATOM 609 CA THR A 52 15.876 -2.419 11.321 1.00 4.32 C ATOM 610 C THR A 52 14.801 -1.560 11.976 1.00 12.22 C ATOM 611 O THR A 52 13.914 -1.037 11.301 1.00 33.21 O ATOM 612 CB THR A 52 17.262 -1.859 11.695 1.00 61.41 C ATOM 613 OG1 THR A 52 17.623 -0.804 10.797 1.00 14.31 O ATOM 614 CG2 THR A 52 18.318 -2.954 11.649 1.00 53.22 C ATOM 0 H THR A 52 15.800 -1.574 9.404 1.00 64.52 H new ATOM 0 HA THR A 52 15.794 -3.442 11.688 1.00 4.32 H new ATOM 0 HB THR A 52 17.209 -1.468 12.711 1.00 61.41 H new ATOM 0 HG1 THR A 52 16.813 -0.423 10.398 1.00 14.31 H new ATOM 0 HG21 THR A 52 19.288 -2.535 11.917 1.00 53.22 H new ATOM 0 HG22 THR A 52 18.056 -3.742 12.355 1.00 53.22 H new ATOM 0 HG23 THR A 52 18.367 -3.370 10.643 1.00 53.22 H new ATOM 622 N ASP A 53 14.886 -1.417 13.294 1.00 35.32 N ATOM 623 CA ASP A 53 13.920 -0.619 14.041 1.00 73.53 C ATOM 624 C ASP A 53 14.540 0.698 14.497 1.00 74.34 C ATOM 625 O ASP A 53 14.070 1.320 15.449 1.00 15.31 O ATOM 626 CB ASP A 53 13.406 -1.402 15.251 1.00 45.34 C ATOM 627 CG ASP A 53 12.100 -0.849 15.786 1.00 3.30 C ATOM 628 OD1 ASP A 53 11.173 -0.629 14.978 1.00 22.14 O ATOM 629 OD2 ASP A 53 12.005 -0.636 17.013 1.00 70.43 O ATOM 0 H ASP A 53 15.614 -1.843 13.867 1.00 35.32 H new ATOM 0 HA ASP A 53 13.082 -0.396 13.381 1.00 73.53 H new ATOM 0 HB2 ASP A 53 13.268 -2.447 14.972 1.00 45.34 H new ATOM 0 HB3 ASP A 53 14.157 -1.380 16.040 1.00 45.34 H new ATOM 634 N PHE A 54 15.598 1.116 13.811 1.00 43.11 N ATOM 635 CA PHE A 54 16.284 2.358 14.147 1.00 44.44 C ATOM 636 C PHE A 54 15.605 3.552 13.482 1.00 75.10 C ATOM 637 O PHE A 54 14.520 3.425 12.913 1.00 52.31 O ATOM 638 CB PHE A 54 17.751 2.288 13.717 1.00 61.04 C ATOM 639 CG PHE A 54 18.485 1.106 14.282 1.00 63.24 C ATOM 640 CD1 PHE A 54 18.637 0.957 15.651 1.00 51.32 C ATOM 641 CD2 PHE A 54 19.024 0.143 13.443 1.00 4.24 C ATOM 642 CE1 PHE A 54 19.312 -0.130 16.174 1.00 13.41 C ATOM 643 CE2 PHE A 54 19.700 -0.946 13.961 1.00 72.01 C ATOM 644 CZ PHE A 54 19.845 -1.082 15.328 1.00 53.13 C ATOM 0 H PHE A 54 15.999 0.613 13.019 1.00 43.11 H new ATOM 0 HA PHE A 54 16.235 2.489 15.228 1.00 44.44 H new ATOM 0 HB2 PHE A 54 17.801 2.250 12.629 1.00 61.04 H new ATOM 0 HB3 PHE A 54 18.257 3.202 14.028 1.00 61.04 H new ATOM 0 HD1 PHE A 54 18.223 1.699 16.318 1.00 51.32 H new ATOM 0 HD2 PHE A 54 18.915 0.245 12.373 1.00 4.24 H new ATOM 0 HE1 PHE A 54 19.422 -0.234 17.243 1.00 13.41 H new ATOM 0 HE2 PHE A 54 20.115 -1.690 13.297 1.00 72.01 H new ATOM 0 HZ PHE A 54 20.374 -1.931 15.734 1.00 53.13 H new ATOM 654 N HIS A 55 16.250 4.711 13.559 1.00 10.40 N ATOM 655 CA HIS A 55 15.709 5.929 12.965 1.00 35.32 C ATOM 656 C HIS A 55 16.809 6.738 12.285 1.00 21.53 C ATOM 657 O HIS A 55 16.632 7.919 11.986 1.00 1.02 O ATOM 658 CB HIS A 55 15.020 6.779 14.033 1.00 53.42 C ATOM 659 CG HIS A 55 13.626 6.331 14.349 1.00 62.21 C ATOM 660 ND1 HIS A 55 13.341 5.372 15.298 1.00 3.23 N ATOM 661 CD2 HIS A 55 12.434 6.717 13.837 1.00 62.35 C ATOM 662 CE1 HIS A 55 12.035 5.187 15.355 1.00 74.51 C ATOM 663 NE2 HIS A 55 11.461 5.991 14.478 1.00 20.21 N ATOM 0 H HIS A 55 17.148 4.833 14.027 1.00 10.40 H new ATOM 0 HA HIS A 55 14.976 5.642 12.211 1.00 35.32 H new ATOM 0 HB2 HIS A 55 15.616 6.754 14.945 1.00 53.42 H new ATOM 0 HB3 HIS A 55 14.992 7.816 13.698 1.00 53.42 H new ATOM 0 HD2 HIS A 55 12.277 7.458 13.067 1.00 62.35 H new ATOM 0 HE1 HIS A 55 11.523 4.496 16.008 1.00 74.51 H new ATOM 0 HE2 HIS A 55 10.458 6.061 14.305 1.00 20.21 H new ATOM 671 N THR A 56 17.947 6.094 12.044 1.00 21.10 N ATOM 672 CA THR A 56 19.077 6.753 11.402 1.00 52.34 C ATOM 673 C THR A 56 20.268 5.810 11.282 1.00 44.24 C ATOM 674 O THR A 56 20.370 4.828 12.016 1.00 72.13 O ATOM 675 CB THR A 56 19.509 8.012 12.178 1.00 33.42 C ATOM 676 OG1 THR A 56 20.831 8.398 11.788 1.00 0.30 O ATOM 677 CG2 THR A 56 19.470 7.762 13.678 1.00 33.43 C ATOM 0 H THR A 56 18.110 5.116 12.284 1.00 21.10 H new ATOM 0 HA THR A 56 18.747 7.045 10.405 1.00 52.34 H new ATOM 0 HB THR A 56 18.812 8.816 11.941 1.00 33.42 H new ATOM 0 HG1 THR A 56 20.810 9.303 11.412 1.00 0.30 H new ATOM 0 HG21 THR A 56 19.779 8.664 14.205 1.00 33.43 H new ATOM 0 HG22 THR A 56 18.456 7.496 13.976 1.00 33.43 H new ATOM 0 HG23 THR A 56 20.147 6.946 13.929 1.00 33.43 H new ATOM 685 N GLU A 57 21.168 6.116 10.352 1.00 2.11 N ATOM 686 CA GLU A 57 22.353 5.294 10.137 1.00 22.01 C ATOM 687 C GLU A 57 23.187 5.198 11.411 1.00 5.43 C ATOM 688 O GLU A 57 23.635 4.117 11.795 1.00 14.30 O ATOM 689 CB GLU A 57 23.201 5.870 9.001 1.00 24.32 C ATOM 690 CG GLU A 57 22.398 6.225 7.762 1.00 52.53 C ATOM 691 CD GLU A 57 22.439 7.708 7.445 1.00 21.13 C ATOM 692 OE1 GLU A 57 22.041 8.512 8.314 1.00 71.23 O ATOM 693 OE2 GLU A 57 22.870 8.064 6.328 1.00 22.34 O ATOM 0 H GLU A 57 21.099 6.926 9.736 1.00 2.11 H new ATOM 0 HA GLU A 57 22.024 4.292 9.863 1.00 22.01 H new ATOM 0 HB2 GLU A 57 23.715 6.762 9.359 1.00 24.32 H new ATOM 0 HB3 GLU A 57 23.970 5.147 8.730 1.00 24.32 H new ATOM 0 HG2 GLU A 57 22.784 5.664 6.911 1.00 52.53 H new ATOM 0 HG3 GLU A 57 21.362 5.916 7.904 1.00 52.53 H new ATOM 700 N LYS A 58 23.394 6.338 12.063 1.00 32.32 N ATOM 701 CA LYS A 58 24.173 6.385 13.295 1.00 62.15 C ATOM 702 C LYS A 58 23.636 5.388 14.317 1.00 44.31 C ATOM 703 O LYS A 58 24.402 4.770 15.055 1.00 4.11 O ATOM 704 CB LYS A 58 24.151 7.797 13.883 1.00 55.51 C ATOM 705 CG LYS A 58 22.751 8.323 14.150 1.00 74.30 C ATOM 706 CD LYS A 58 22.600 9.765 13.695 1.00 73.41 C ATOM 707 CE LYS A 58 22.883 10.739 14.828 1.00 43.13 C ATOM 708 NZ LYS A 58 22.254 12.067 14.588 1.00 53.15 N ATOM 0 H LYS A 58 23.033 7.242 11.758 1.00 32.32 H new ATOM 0 HA LYS A 58 25.201 6.114 13.056 1.00 62.15 H new ATOM 0 HB2 LYS A 58 24.716 7.802 14.815 1.00 55.51 H new ATOM 0 HB3 LYS A 58 24.660 8.475 13.198 1.00 55.51 H new ATOM 0 HG2 LYS A 58 22.022 7.699 13.632 1.00 74.30 H new ATOM 0 HG3 LYS A 58 22.532 8.252 15.215 1.00 74.30 H new ATOM 0 HD2 LYS A 58 23.282 9.960 12.867 1.00 73.41 H new ATOM 0 HD3 LYS A 58 21.589 9.925 13.320 1.00 73.41 H new ATOM 0 HE2 LYS A 58 22.510 10.325 15.765 1.00 43.13 H new ATOM 0 HE3 LYS A 58 23.960 10.862 14.940 1.00 43.13 H new ATOM 0 HZ1 LYS A 58 22.470 12.702 15.383 1.00 53.15 H new ATOM 0 HZ2 LYS A 58 22.628 12.474 13.707 1.00 53.15 H new ATOM 0 HZ3 LYS A 58 21.223 11.953 14.506 1.00 53.15 H new ATOM 722 N GLU A 59 22.316 5.237 14.353 1.00 41.14 N ATOM 723 CA GLU A 59 21.678 4.315 15.284 1.00 24.55 C ATOM 724 C GLU A 59 22.068 2.872 14.974 1.00 12.01 C ATOM 725 O GLU A 59 22.329 2.079 15.880 1.00 75.34 O ATOM 726 CB GLU A 59 20.157 4.467 15.227 1.00 0.23 C ATOM 727 CG GLU A 59 19.600 5.410 16.281 1.00 50.13 C ATOM 728 CD GLU A 59 18.133 5.160 16.570 1.00 33.11 C ATOM 729 OE1 GLU A 59 17.753 3.982 16.737 1.00 54.30 O ATOM 730 OE2 GLU A 59 17.364 6.143 16.630 1.00 25.20 O ATOM 0 H GLU A 59 21.668 5.741 13.748 1.00 41.14 H new ATOM 0 HA GLU A 59 22.022 4.559 16.289 1.00 24.55 H new ATOM 0 HB2 GLU A 59 19.873 4.831 14.239 1.00 0.23 H new ATOM 0 HB3 GLU A 59 19.697 3.486 15.349 1.00 0.23 H new ATOM 0 HG2 GLU A 59 20.172 5.298 17.202 1.00 50.13 H new ATOM 0 HG3 GLU A 59 19.731 6.440 15.948 1.00 50.13 H new ATOM 737 N LEU A 60 22.104 2.539 13.689 1.00 45.14 N ATOM 738 CA LEU A 60 22.461 1.192 13.257 1.00 4.01 C ATOM 739 C LEU A 60 23.912 0.875 13.605 1.00 2.13 C ATOM 740 O LEU A 60 24.212 -0.186 14.151 1.00 63.05 O ATOM 741 CB LEU A 60 22.242 1.043 11.751 1.00 43.15 C ATOM 742 CG LEU A 60 21.907 -0.365 11.257 1.00 14.30 C ATOM 743 CD1 LEU A 60 21.704 -0.368 9.750 1.00 42.23 C ATOM 744 CD2 LEU A 60 23.003 -1.344 11.652 1.00 54.22 C ATOM 0 H LEU A 60 21.890 3.183 12.928 1.00 45.14 H new ATOM 0 HA LEU A 60 21.818 0.486 13.783 1.00 4.01 H new ATOM 0 HB2 LEU A 60 21.435 1.712 11.454 1.00 43.15 H new ATOM 0 HB3 LEU A 60 23.142 1.382 11.238 1.00 43.15 H new ATOM 0 HG LEU A 60 20.977 -0.683 11.728 1.00 14.30 H new ATOM 0 HD11 LEU A 60 21.467 -1.378 9.417 1.00 42.23 H new ATOM 0 HD12 LEU A 60 20.883 0.301 9.492 1.00 42.23 H new ATOM 0 HD13 LEU A 60 22.616 -0.029 9.259 1.00 42.23 H new ATOM 0 HD21 LEU A 60 22.748 -2.341 11.292 1.00 54.22 H new ATOM 0 HD22 LEU A 60 23.948 -1.030 11.210 1.00 54.22 H new ATOM 0 HD23 LEU A 60 23.099 -1.364 12.738 1.00 54.22 H new ATOM 756 N ASN A 61 24.808 1.804 13.288 1.00 0.30 N ATOM 757 CA ASN A 61 26.228 1.625 13.569 1.00 72.41 C ATOM 758 C ASN A 61 26.503 1.723 15.066 1.00 12.53 C ATOM 759 O ASN A 61 27.493 1.186 15.563 1.00 73.41 O ATOM 760 CB ASN A 61 27.054 2.670 12.817 1.00 0.12 C ATOM 761 CG ASN A 61 28.361 2.107 12.294 1.00 62.13 C ATOM 762 OD1 ASN A 61 29.424 2.700 12.479 1.00 30.22 O ATOM 763 ND2 ASN A 61 28.288 0.956 11.635 1.00 12.12 N ATOM 0 H ASN A 61 24.576 2.689 12.836 1.00 0.30 H new ATOM 0 HA ASN A 61 26.517 0.631 13.229 1.00 72.41 H new ATOM 0 HB2 ASN A 61 26.470 3.059 11.983 1.00 0.12 H new ATOM 0 HB3 ASN A 61 27.263 3.510 13.480 1.00 0.12 H new ATOM 0 HD21 ASN A 61 29.135 0.529 11.259 1.00 12.12 H new ATOM 0 HD22 ASN A 61 27.385 0.499 11.505 1.00 12.12 H new ATOM 770 N ASP A 62 25.620 2.414 15.780 1.00 61.41 N ATOM 771 CA ASP A 62 25.766 2.582 17.221 1.00 21.11 C ATOM 772 C ASP A 62 25.415 1.292 17.957 1.00 4.51 C ATOM 773 O ASP A 62 26.105 0.893 18.896 1.00 53.31 O ATOM 774 CB ASP A 62 24.877 3.724 17.715 1.00 31.14 C ATOM 775 CG ASP A 62 25.572 5.069 17.649 1.00 4.45 C ATOM 776 OD1 ASP A 62 26.499 5.219 16.825 1.00 13.10 O ATOM 777 OD2 ASP A 62 25.190 5.973 18.422 1.00 70.13 O ATOM 0 H ASP A 62 24.796 2.866 15.384 1.00 61.41 H new ATOM 0 HA ASP A 62 26.808 2.826 17.430 1.00 21.11 H new ATOM 0 HB2 ASP A 62 23.968 3.758 17.115 1.00 31.14 H new ATOM 0 HB3 ASP A 62 24.573 3.525 18.743 1.00 31.14 H new ATOM 782 N LYS A 63 24.338 0.645 17.525 1.00 4.14 N ATOM 783 CA LYS A 63 23.895 -0.599 18.142 1.00 32.41 C ATOM 784 C LYS A 63 24.982 -1.666 18.057 1.00 34.33 C ATOM 785 O LYS A 63 25.088 -2.529 18.930 1.00 65.01 O ATOM 786 CB LYS A 63 22.618 -1.102 17.464 1.00 1.11 C ATOM 787 CG LYS A 63 22.193 -2.488 17.918 1.00 2.42 C ATOM 788 CD LYS A 63 22.180 -3.474 16.762 1.00 11.42 C ATOM 789 CE LYS A 63 23.454 -4.304 16.723 1.00 51.42 C ATOM 790 NZ LYS A 63 23.166 -5.764 16.755 1.00 35.24 N ATOM 0 H LYS A 63 23.756 0.962 16.750 1.00 4.14 H new ATOM 0 HA LYS A 63 23.687 -0.400 19.193 1.00 32.41 H new ATOM 0 HB2 LYS A 63 21.809 -0.399 17.665 1.00 1.11 H new ATOM 0 HB3 LYS A 63 22.770 -1.113 16.385 1.00 1.11 H new ATOM 0 HG2 LYS A 63 22.873 -2.843 18.692 1.00 2.42 H new ATOM 0 HG3 LYS A 63 21.200 -2.437 18.365 1.00 2.42 H new ATOM 0 HD2 LYS A 63 21.317 -4.134 16.855 1.00 11.42 H new ATOM 0 HD3 LYS A 63 22.068 -2.933 15.822 1.00 11.42 H new ATOM 0 HE2 LYS A 63 24.016 -4.064 15.820 1.00 51.42 H new ATOM 0 HE3 LYS A 63 24.086 -4.040 17.571 1.00 51.42 H new ATOM 0 HZ1 LYS A 63 24.059 -6.295 16.710 1.00 35.24 H new ATOM 0 HZ2 LYS A 63 22.667 -6.000 17.636 1.00 35.24 H new ATOM 0 HZ3 LYS A 63 22.570 -6.018 15.941 1.00 35.24 H new ATOM 804 N LEU A 64 25.787 -1.601 17.003 1.00 71.22 N ATOM 805 CA LEU A 64 26.868 -2.561 16.805 1.00 75.10 C ATOM 806 C LEU A 64 27.721 -2.687 18.063 1.00 43.23 C ATOM 807 O LEU A 64 28.166 -3.778 18.417 1.00 74.05 O ATOM 808 CB LEU A 64 27.741 -2.139 15.622 1.00 32.20 C ATOM 809 CG LEU A 64 27.509 -2.895 14.313 1.00 31.23 C ATOM 810 CD1 LEU A 64 26.839 -1.994 13.288 1.00 43.14 C ATOM 811 CD2 LEU A 64 28.823 -3.439 13.771 1.00 11.33 C ATOM 0 H LEU A 64 25.712 -0.894 16.272 1.00 71.22 H new ATOM 0 HA LEU A 64 26.423 -3.533 16.591 1.00 75.10 H new ATOM 0 HB2 LEU A 64 27.580 -1.077 15.438 1.00 32.20 H new ATOM 0 HB3 LEU A 64 28.786 -2.258 15.907 1.00 32.20 H new ATOM 0 HG LEU A 64 26.846 -3.737 14.514 1.00 31.23 H new ATOM 0 HD11 LEU A 64 26.682 -2.549 12.363 1.00 43.14 H new ATOM 0 HD12 LEU A 64 25.878 -1.654 13.675 1.00 43.14 H new ATOM 0 HD13 LEU A 64 27.476 -1.132 13.090 1.00 43.14 H new ATOM 0 HD21 LEU A 64 28.639 -3.974 12.839 1.00 11.33 H new ATOM 0 HD22 LEU A 64 29.510 -2.613 13.585 1.00 11.33 H new ATOM 0 HD23 LEU A 64 29.263 -4.120 14.499 1.00 11.33 H new ATOM 823 N ASN A 65 27.945 -1.562 18.735 1.00 73.22 N ATOM 824 CA ASN A 65 28.744 -1.547 19.955 1.00 51.33 C ATOM 825 C ASN A 65 28.210 -2.555 20.968 1.00 61.15 C ATOM 826 O ASN A 65 28.980 -3.218 21.664 1.00 55.24 O ATOM 827 CB ASN A 65 28.749 -0.145 20.568 1.00 22.00 C ATOM 828 CG ASN A 65 29.803 0.753 19.950 1.00 64.34 C ATOM 829 OD1 ASN A 65 30.852 0.998 20.545 1.00 4.53 O ATOM 830 ND2 ASN A 65 29.528 1.247 18.748 1.00 4.33 N ATOM 0 H ASN A 65 27.585 -0.650 18.455 1.00 73.22 H new ATOM 0 HA ASN A 65 29.765 -1.827 19.695 1.00 51.33 H new ATOM 0 HB2 ASN A 65 27.767 0.309 20.437 1.00 22.00 H new ATOM 0 HB3 ASN A 65 28.925 -0.221 21.641 1.00 22.00 H new ATOM 0 HD21 ASN A 65 30.200 1.856 18.281 1.00 4.33 H new ATOM 0 HD22 ASN A 65 28.645 1.017 18.292 1.00 4.33 H new ATOM 837 N ASP A 66 26.889 -2.666 21.043 1.00 15.15 N ATOM 838 CA ASP A 66 26.251 -3.595 21.970 1.00 40.43 C ATOM 839 C ASP A 66 26.664 -5.032 21.668 1.00 2.25 C ATOM 840 O ASP A 66 27.120 -5.756 22.554 1.00 73.01 O ATOM 841 CB ASP A 66 24.729 -3.461 21.892 1.00 23.33 C ATOM 842 CG ASP A 66 24.122 -2.995 23.201 1.00 73.32 C ATOM 843 OD1 ASP A 66 24.444 -3.591 24.250 1.00 44.04 O ATOM 844 OD2 ASP A 66 23.323 -2.035 23.176 1.00 71.52 O ATOM 0 H ASP A 66 26.238 -2.125 20.474 1.00 15.15 H new ATOM 0 HA ASP A 66 26.579 -3.346 22.979 1.00 40.43 H new ATOM 0 HB2 ASP A 66 24.469 -2.756 21.103 1.00 23.33 H new ATOM 0 HB3 ASP A 66 24.296 -4.422 21.616 1.00 23.33 H new ATOM 849 N TYR A 67 26.501 -5.438 20.414 1.00 21.24 N ATOM 850 CA TYR A 67 26.854 -6.790 19.997 1.00 33.11 C ATOM 851 C TYR A 67 28.363 -7.005 20.064 1.00 53.30 C ATOM 852 O TYR A 67 28.833 -8.117 20.304 1.00 61.12 O ATOM 853 CB TYR A 67 26.352 -7.055 18.577 1.00 61.04 C ATOM 854 CG TYR A 67 27.462 -7.231 17.565 1.00 24.14 C ATOM 855 CD1 TYR A 67 28.101 -8.455 17.411 1.00 31.31 C ATOM 856 CD2 TYR A 67 27.872 -6.173 16.763 1.00 1.14 C ATOM 857 CE1 TYR A 67 29.116 -8.620 16.489 1.00 21.20 C ATOM 858 CE2 TYR A 67 28.886 -6.329 15.838 1.00 74.05 C ATOM 859 CZ TYR A 67 29.505 -7.554 15.704 1.00 33.35 C ATOM 860 OH TYR A 67 30.515 -7.715 14.784 1.00 52.12 O ATOM 0 H TYR A 67 26.127 -4.851 19.669 1.00 21.24 H new ATOM 0 HA TYR A 67 26.375 -7.491 20.681 1.00 33.11 H new ATOM 0 HB2 TYR A 67 25.731 -7.951 18.582 1.00 61.04 H new ATOM 0 HB3 TYR A 67 25.715 -6.227 18.265 1.00 61.04 H new ATOM 0 HD1 TYR A 67 27.799 -9.292 18.023 1.00 31.31 H new ATOM 0 HD2 TYR A 67 27.390 -5.212 16.865 1.00 1.14 H new ATOM 0 HE1 TYR A 67 29.603 -9.578 16.383 1.00 21.20 H new ATOM 0 HE2 TYR A 67 29.192 -5.496 15.223 1.00 74.05 H new ATOM 0 HH TYR A 67 30.666 -6.869 14.313 1.00 52.12 H new ATOM 870 N TYR A 68 29.116 -5.932 19.851 1.00 41.32 N ATOM 871 CA TYR A 68 30.572 -6.001 19.885 1.00 61.13 C ATOM 872 C TYR A 68 31.055 -6.708 21.148 1.00 54.23 C ATOM 873 O TYR A 68 32.005 -7.488 21.111 1.00 23.20 O ATOM 874 CB TYR A 68 31.172 -4.596 19.812 1.00 23.02 C ATOM 875 CG TYR A 68 31.922 -4.323 18.528 1.00 72.34 C ATOM 876 CD1 TYR A 68 31.243 -3.985 17.363 1.00 23.01 C ATOM 877 CD2 TYR A 68 33.308 -4.405 18.478 1.00 52.21 C ATOM 878 CE1 TYR A 68 31.924 -3.736 16.187 1.00 54.42 C ATOM 879 CE2 TYR A 68 33.996 -4.156 17.307 1.00 44.45 C ATOM 880 CZ TYR A 68 33.300 -3.822 16.164 1.00 50.32 C ATOM 881 OH TYR A 68 33.982 -3.574 14.995 1.00 62.24 O ATOM 0 H TYR A 68 28.742 -5.004 19.653 1.00 41.32 H new ATOM 0 HA TYR A 68 30.903 -6.576 19.020 1.00 61.13 H new ATOM 0 HB2 TYR A 68 30.373 -3.863 19.919 1.00 23.02 H new ATOM 0 HB3 TYR A 68 31.848 -4.455 20.655 1.00 23.02 H new ATOM 0 HD1 TYR A 68 30.165 -3.916 17.377 1.00 23.01 H new ATOM 0 HD2 TYR A 68 33.857 -4.668 19.370 1.00 52.21 H new ATOM 0 HE1 TYR A 68 31.381 -3.475 15.290 1.00 54.42 H new ATOM 0 HE2 TYR A 68 35.074 -4.222 17.286 1.00 44.45 H new ATOM 0 HH TYR A 68 34.944 -3.676 15.150 1.00 62.24 H new ATOM 891 N ALA A 69 30.391 -6.428 22.265 1.00 73.24 N ATOM 892 CA ALA A 69 30.749 -7.038 23.539 1.00 34.11 C ATOM 893 C ALA A 69 30.783 -8.559 23.430 1.00 54.33 C ATOM 894 O ALA A 69 31.532 -9.226 24.144 1.00 31.30 O ATOM 895 CB ALA A 69 29.772 -6.607 24.623 1.00 3.34 C ATOM 0 H ALA A 69 29.603 -5.783 22.313 1.00 73.24 H new ATOM 0 HA ALA A 69 31.749 -6.697 23.809 1.00 34.11 H new ATOM 0 HB1 ALA A 69 30.051 -7.070 25.569 1.00 3.34 H new ATOM 0 HB2 ALA A 69 29.800 -5.522 24.727 1.00 3.34 H new ATOM 0 HB3 ALA A 69 28.764 -6.919 24.350 1.00 3.34 H new ATOM 901 N LEU A 70 29.967 -9.101 22.532 1.00 12.14 N ATOM 902 CA LEU A 70 29.903 -10.544 22.330 1.00 71.22 C ATOM 903 C LEU A 70 31.245 -11.086 21.848 1.00 74.33 C ATOM 904 O LEU A 70 31.489 -12.293 21.884 1.00 13.53 O ATOM 905 CB LEU A 70 28.808 -10.889 21.319 1.00 34.22 C ATOM 906 CG LEU A 70 28.584 -12.378 21.054 1.00 63.42 C ATOM 907 CD1 LEU A 70 27.136 -12.757 21.323 1.00 23.30 C ATOM 908 CD2 LEU A 70 28.973 -12.730 19.625 1.00 55.51 C ATOM 0 H LEU A 70 29.341 -8.563 21.933 1.00 12.14 H new ATOM 0 HA LEU A 70 29.666 -11.010 23.286 1.00 71.22 H new ATOM 0 HB2 LEU A 70 27.870 -10.458 21.668 1.00 34.22 H new ATOM 0 HB3 LEU A 70 29.049 -10.404 20.373 1.00 34.22 H new ATOM 0 HG LEU A 70 29.219 -12.947 21.733 1.00 63.42 H new ATOM 0 HD11 LEU A 70 26.996 -13.820 21.129 1.00 23.30 H new ATOM 0 HD12 LEU A 70 26.891 -12.543 22.363 1.00 23.30 H new ATOM 0 HD13 LEU A 70 26.481 -12.180 20.670 1.00 23.30 H new ATOM 0 HD21 LEU A 70 28.807 -13.794 19.454 1.00 55.51 H new ATOM 0 HD22 LEU A 70 28.365 -12.152 18.929 1.00 55.51 H new ATOM 0 HD23 LEU A 70 30.026 -12.497 19.467 1.00 55.51 H new ATOM 920 N LYS A 71 32.113 -10.187 21.398 1.00 50.13 N ATOM 921 CA LYS A 71 33.432 -10.573 20.911 1.00 22.03 C ATOM 922 C LYS A 71 34.109 -11.537 21.881 1.00 52.04 C ATOM 923 O LYS A 71 34.871 -12.413 21.470 1.00 1.22 O ATOM 924 CB LYS A 71 34.308 -9.334 20.713 1.00 1.21 C ATOM 925 CG LYS A 71 34.610 -8.590 22.002 1.00 24.14 C ATOM 926 CD LYS A 71 35.596 -7.457 21.774 1.00 5.34 C ATOM 927 CE LYS A 71 35.094 -6.485 20.717 1.00 24.41 C ATOM 928 NZ LYS A 71 35.905 -6.556 19.470 1.00 50.32 N ATOM 0 H LYS A 71 31.927 -9.185 21.360 1.00 50.13 H new ATOM 0 HA LYS A 71 33.305 -11.078 19.953 1.00 22.03 H new ATOM 0 HB2 LYS A 71 35.247 -9.634 20.248 1.00 1.21 H new ATOM 0 HB3 LYS A 71 33.811 -8.655 20.020 1.00 1.21 H new ATOM 0 HG2 LYS A 71 33.685 -8.190 22.418 1.00 24.14 H new ATOM 0 HG3 LYS A 71 35.016 -9.284 22.737 1.00 24.14 H new ATOM 0 HD2 LYS A 71 35.762 -6.924 22.710 1.00 5.34 H new ATOM 0 HD3 LYS A 71 36.558 -7.867 21.465 1.00 5.34 H new ATOM 0 HE2 LYS A 71 34.052 -6.706 20.486 1.00 24.41 H new ATOM 0 HE3 LYS A 71 35.124 -5.470 21.113 1.00 24.41 H new ATOM 0 HZ1 LYS A 71 35.463 -5.969 18.734 1.00 50.32 H new ATOM 0 HZ2 LYS A 71 36.866 -6.207 19.661 1.00 50.32 H new ATOM 0 HZ3 LYS A 71 35.953 -7.542 19.143 1.00 50.32 H new ATOM 942 N HIS A 72 33.824 -11.371 23.168 1.00 24.05 N ATOM 943 CA HIS A 72 34.404 -12.228 24.196 1.00 23.42 C ATOM 944 C HIS A 72 34.217 -13.701 23.844 1.00 34.24 C ATOM 945 O HIS A 72 35.107 -14.522 24.068 1.00 53.31 O ATOM 946 CB HIS A 72 33.770 -11.932 25.555 1.00 11.23 C ATOM 947 CG HIS A 72 34.713 -11.298 26.531 1.00 51.41 C ATOM 948 ND1 HIS A 72 34.394 -10.174 27.264 1.00 21.21 N ATOM 949 CD2 HIS A 72 35.972 -11.637 26.893 1.00 1.14 C ATOM 950 CE1 HIS A 72 35.417 -9.849 28.034 1.00 0.22 C ATOM 951 NE2 HIS A 72 36.387 -10.721 27.829 1.00 64.15 N ATOM 0 H HIS A 72 33.195 -10.651 23.524 1.00 24.05 H new ATOM 0 HA HIS A 72 35.472 -12.018 24.249 1.00 23.42 H new ATOM 0 HB2 HIS A 72 32.913 -11.274 25.411 1.00 11.23 H new ATOM 0 HB3 HIS A 72 33.391 -12.861 25.980 1.00 11.23 H new ATOM 0 HD2 HIS A 72 36.544 -12.472 26.516 1.00 1.14 H new ATOM 0 HE1 HIS A 72 35.454 -9.012 28.716 1.00 0.22 H new ATOM 0 HE2 HIS A 72 37.297 -10.715 28.291 1.00 64.15 H new ATOM 959 N VAL A 73 33.052 -14.029 23.294 1.00 62.44 N ATOM 960 CA VAL A 73 32.748 -15.403 22.911 1.00 53.13 C ATOM 961 C VAL A 73 33.026 -15.635 21.430 1.00 24.30 C ATOM 962 O VAL A 73 32.327 -15.126 20.554 1.00 62.12 O ATOM 963 CB VAL A 73 31.278 -15.755 23.207 1.00 71.43 C ATOM 964 CG1 VAL A 73 30.980 -17.190 22.799 1.00 22.32 C ATOM 965 CG2 VAL A 73 30.963 -15.534 24.679 1.00 64.35 C ATOM 0 H VAL A 73 32.304 -13.363 23.104 1.00 62.44 H new ATOM 0 HA VAL A 73 33.396 -16.048 23.505 1.00 53.13 H new ATOM 0 HB VAL A 73 30.639 -15.095 22.620 1.00 71.43 H new ATOM 0 HG11 VAL A 73 29.937 -17.421 23.016 1.00 22.32 H new ATOM 0 HG12 VAL A 73 31.164 -17.310 21.731 1.00 22.32 H new ATOM 0 HG13 VAL A 73 31.625 -17.868 23.357 1.00 22.32 H new ATOM 0 HG21 VAL A 73 29.920 -15.788 24.870 1.00 64.35 H new ATOM 0 HG22 VAL A 73 31.608 -16.167 25.288 1.00 64.35 H new ATOM 0 HG23 VAL A 73 31.135 -14.488 24.935 1.00 64.35 H new ATOM 975 N PRO A 74 34.073 -16.424 21.141 1.00 14.45 N ATOM 976 CA PRO A 74 34.468 -16.743 19.766 1.00 13.24 C ATOM 977 C PRO A 74 33.463 -17.656 19.072 1.00 41.23 C ATOM 978 O PRO A 74 33.295 -17.598 17.853 1.00 31.34 O ATOM 979 CB PRO A 74 35.810 -17.458 19.940 1.00 74.50 C ATOM 980 CG PRO A 74 35.759 -18.030 21.315 1.00 71.33 C ATOM 981 CD PRO A 74 34.950 -17.064 22.135 1.00 30.34 C ATOM 0 HA PRO A 74 34.522 -15.853 19.140 1.00 13.24 H new ATOM 0 HB2 PRO A 74 35.943 -18.239 19.191 1.00 74.50 H new ATOM 0 HB3 PRO A 74 36.645 -16.766 19.830 1.00 74.50 H new ATOM 0 HG2 PRO A 74 35.299 -19.018 21.310 1.00 71.33 H new ATOM 0 HG3 PRO A 74 36.762 -18.147 21.726 1.00 71.33 H new ATOM 0 HD2 PRO A 74 34.376 -17.575 22.908 1.00 30.34 H new ATOM 0 HD3 PRO A 74 35.585 -16.335 22.639 1.00 30.34 H new ATOM 989 N LYS A 75 32.796 -18.498 19.854 1.00 45.11 N ATOM 990 CA LYS A 75 31.806 -19.423 19.315 1.00 4.30 C ATOM 991 C LYS A 75 30.696 -18.669 18.589 1.00 24.22 C ATOM 992 O LYS A 75 30.374 -18.974 17.440 1.00 12.44 O ATOM 993 CB LYS A 75 31.209 -20.274 20.438 1.00 65.43 C ATOM 994 CG LYS A 75 32.121 -21.399 20.898 1.00 74.10 C ATOM 995 CD LYS A 75 32.312 -22.442 19.810 1.00 72.40 C ATOM 996 CE LYS A 75 33.717 -22.393 19.231 1.00 44.41 C ATOM 997 NZ LYS A 75 34.590 -23.456 19.801 1.00 61.33 N ATOM 0 H LYS A 75 32.923 -18.559 20.864 1.00 45.11 H new ATOM 0 HA LYS A 75 32.306 -20.076 18.599 1.00 4.30 H new ATOM 0 HB2 LYS A 75 30.981 -19.631 21.288 1.00 65.43 H new ATOM 0 HB3 LYS A 75 30.265 -20.699 20.098 1.00 65.43 H new ATOM 0 HG2 LYS A 75 33.090 -20.989 21.185 1.00 74.10 H new ATOM 0 HG3 LYS A 75 31.699 -21.871 21.786 1.00 74.10 H new ATOM 0 HD2 LYS A 75 32.120 -23.434 20.218 1.00 72.40 H new ATOM 0 HD3 LYS A 75 31.584 -22.278 19.015 1.00 72.40 H new ATOM 0 HE2 LYS A 75 33.667 -22.506 18.148 1.00 44.41 H new ATOM 0 HE3 LYS A 75 34.158 -21.416 19.430 1.00 44.41 H new ATOM 0 HZ1 LYS A 75 35.539 -23.388 19.381 1.00 61.33 H new ATOM 0 HZ2 LYS A 75 34.658 -23.334 20.832 1.00 61.33 H new ATOM 0 HZ3 LYS A 75 34.183 -24.390 19.590 1.00 61.33 H new ATOM 1011 N CYS A 76 30.116 -17.684 19.266 1.00 41.22 N ATOM 1012 CA CYS A 76 29.043 -16.886 18.686 1.00 50.53 C ATOM 1013 C CYS A 76 29.607 -15.765 17.817 1.00 62.24 C ATOM 1014 O CYS A 76 28.997 -15.370 16.823 1.00 44.20 O ATOM 1015 CB CYS A 76 28.164 -16.296 19.790 1.00 54.41 C ATOM 1016 SG CYS A 76 26.390 -16.672 19.609 1.00 24.13 S ATOM 0 H CYS A 76 30.371 -17.419 20.217 1.00 41.22 H new ATOM 0 HA CYS A 76 28.437 -17.539 18.058 1.00 50.53 H new ATOM 0 HB2 CYS A 76 28.508 -16.672 20.753 1.00 54.41 H new ATOM 0 HB3 CYS A 76 28.295 -15.214 19.805 1.00 54.41 H new ATOM 1021 N TRP A 77 30.774 -15.259 18.198 1.00 22.21 N ATOM 1022 CA TRP A 77 31.421 -14.185 17.454 1.00 41.43 C ATOM 1023 C TRP A 77 31.588 -14.563 15.986 1.00 14.30 C ATOM 1024 O TRP A 77 31.100 -13.866 15.097 1.00 53.40 O ATOM 1025 CB TRP A 77 32.784 -13.860 18.067 1.00 21.03 C ATOM 1026 CG TRP A 77 33.762 -13.300 17.079 1.00 23.52 C ATOM 1027 CD1 TRP A 77 35.004 -13.789 16.788 1.00 31.25 C ATOM 1028 CD2 TRP A 77 33.580 -12.145 16.254 1.00 63.04 C ATOM 1029 NE1 TRP A 77 35.605 -13.007 15.832 1.00 71.12 N ATOM 1030 CE2 TRP A 77 34.752 -11.992 15.486 1.00 31.54 C ATOM 1031 CE3 TRP A 77 32.541 -11.226 16.086 1.00 43.20 C ATOM 1032 CZ2 TRP A 77 34.911 -10.958 14.569 1.00 51.43 C ATOM 1033 CZ3 TRP A 77 32.701 -10.199 15.175 1.00 73.00 C ATOM 1034 CH2 TRP A 77 33.878 -10.072 14.425 1.00 14.12 C ATOM 0 H TRP A 77 31.292 -15.575 19.018 1.00 22.21 H new ATOM 0 HA TRP A 77 30.784 -13.302 17.513 1.00 41.43 H new ATOM 0 HB2 TRP A 77 32.648 -13.145 18.878 1.00 21.03 H new ATOM 0 HB3 TRP A 77 33.202 -14.766 18.507 1.00 21.03 H new ATOM 0 HD1 TRP A 77 35.448 -14.662 17.243 1.00 31.25 H new ATOM 0 HE1 TRP A 77 36.536 -13.157 15.443 1.00 71.12 H new ATOM 0 HE3 TRP A 77 31.629 -11.317 16.658 1.00 43.20 H new ATOM 0 HZ2 TRP A 77 35.818 -10.858 13.991 1.00 51.43 H new ATOM 0 HZ3 TRP A 77 31.905 -9.482 15.039 1.00 73.00 H new ATOM 0 HH2 TRP A 77 33.972 -9.259 13.720 1.00 14.12 H new ATOM 1045 N ALA A 78 32.279 -15.670 15.740 1.00 61.55 N ATOM 1046 CA ALA A 78 32.507 -16.142 14.379 1.00 4.32 C ATOM 1047 C ALA A 78 31.204 -16.592 13.728 1.00 21.23 C ATOM 1048 O ALA A 78 31.148 -16.818 12.520 1.00 43.52 O ATOM 1049 CB ALA A 78 33.521 -17.277 14.377 1.00 53.31 C ATOM 0 H ALA A 78 32.691 -16.258 16.465 1.00 61.55 H new ATOM 0 HA ALA A 78 32.906 -15.312 13.795 1.00 4.32 H new ATOM 0 HB1 ALA A 78 33.682 -17.620 13.355 1.00 53.31 H new ATOM 0 HB2 ALA A 78 34.464 -16.923 14.793 1.00 53.31 H new ATOM 0 HB3 ALA A 78 33.145 -18.102 14.981 1.00 53.31 H new ATOM 1055 N ALA A 79 30.158 -16.722 14.538 1.00 71.24 N ATOM 1056 CA ALA A 79 28.855 -17.145 14.040 1.00 52.33 C ATOM 1057 C ALA A 79 28.156 -16.010 13.299 1.00 13.32 C ATOM 1058 O ALA A 79 27.406 -16.244 12.350 1.00 4.15 O ATOM 1059 CB ALA A 79 27.988 -17.642 15.187 1.00 74.34 C ATOM 0 H ALA A 79 30.188 -16.541 15.541 1.00 71.24 H new ATOM 0 HA ALA A 79 29.010 -17.962 13.336 1.00 52.33 H new ATOM 0 HB1 ALA A 79 27.018 -17.955 14.801 1.00 74.34 H new ATOM 0 HB2 ALA A 79 28.475 -18.488 15.671 1.00 74.34 H new ATOM 0 HB3 ALA A 79 27.849 -16.840 15.912 1.00 74.34 H new ATOM 1065 N ILE A 80 28.405 -14.781 13.739 1.00 52.22 N ATOM 1066 CA ILE A 80 27.799 -13.610 13.117 1.00 61.03 C ATOM 1067 C ILE A 80 28.773 -12.929 12.161 1.00 22.41 C ATOM 1068 O ILE A 80 28.538 -11.807 11.716 1.00 53.43 O ATOM 1069 CB ILE A 80 27.335 -12.589 14.172 1.00 55.12 C ATOM 1070 CG1 ILE A 80 26.272 -11.660 13.581 1.00 35.32 C ATOM 1071 CG2 ILE A 80 28.519 -11.786 14.689 1.00 13.02 C ATOM 1072 CD1 ILE A 80 25.880 -10.526 14.503 1.00 63.32 C ATOM 0 H ILE A 80 29.022 -14.570 14.524 1.00 52.22 H new ATOM 0 HA ILE A 80 26.932 -13.963 12.558 1.00 61.03 H new ATOM 0 HB ILE A 80 26.894 -13.129 15.010 1.00 55.12 H new ATOM 0 HG12 ILE A 80 26.645 -11.244 12.645 1.00 35.32 H new ATOM 0 HG13 ILE A 80 25.384 -12.244 13.339 1.00 35.32 H new ATOM 0 HG21 ILE A 80 28.175 -11.069 15.434 1.00 13.02 H new ATOM 0 HG22 ILE A 80 29.245 -12.460 15.143 1.00 13.02 H new ATOM 0 HG23 ILE A 80 28.987 -11.253 13.861 1.00 13.02 H new ATOM 0 HD11 ILE A 80 25.123 -9.909 14.019 1.00 63.32 H new ATOM 0 HD12 ILE A 80 25.477 -10.934 15.430 1.00 63.32 H new ATOM 0 HD13 ILE A 80 26.757 -9.918 14.725 1.00 63.32 H new ATOM 1084 N GLN A 81 29.867 -13.618 11.850 1.00 54.13 N ATOM 1085 CA GLN A 81 30.876 -13.080 10.946 1.00 50.35 C ATOM 1086 C GLN A 81 30.269 -12.752 9.585 1.00 1.12 C ATOM 1087 O GLN A 81 30.268 -11.605 9.139 1.00 44.42 O ATOM 1088 CB GLN A 81 32.024 -14.076 10.778 1.00 25.02 C ATOM 1089 CG GLN A 81 33.361 -13.554 11.282 1.00 74.53 C ATOM 1090 CD GLN A 81 34.291 -14.666 11.727 1.00 53.24 C ATOM 1091 OE1 GLN A 81 34.389 -15.706 11.076 1.00 65.35 O ATOM 1092 NE2 GLN A 81 34.980 -14.451 12.841 1.00 14.03 N ATOM 0 H GLN A 81 30.076 -14.549 12.211 1.00 54.13 H new ATOM 0 HA GLN A 81 31.264 -12.159 11.382 1.00 50.35 H new ATOM 0 HB2 GLN A 81 31.778 -14.995 11.311 1.00 25.02 H new ATOM 0 HB3 GLN A 81 32.118 -14.334 9.723 1.00 25.02 H new ATOM 0 HG2 GLN A 81 33.842 -12.977 10.493 1.00 74.53 H new ATOM 0 HG3 GLN A 81 33.190 -12.873 12.116 1.00 74.53 H new ATOM 0 HE21 GLN A 81 34.867 -13.574 13.349 1.00 14.03 H new ATOM 0 HE22 GLN A 81 35.622 -15.163 13.189 1.00 14.03 H new ATOM 1101 N PRO A 82 29.740 -13.782 8.909 1.00 62.40 N ATOM 1102 CA PRO A 82 29.120 -13.629 7.590 1.00 41.35 C ATOM 1103 C PRO A 82 27.801 -12.867 7.654 1.00 12.13 C ATOM 1104 O PRO A 82 27.432 -12.164 6.713 1.00 14.35 O ATOM 1105 CB PRO A 82 28.883 -15.072 7.139 1.00 74.12 C ATOM 1106 CG PRO A 82 28.784 -15.853 8.404 1.00 54.51 C ATOM 1107 CD PRO A 82 29.706 -15.177 9.381 1.00 61.05 C ATOM 0 HA PRO A 82 29.747 -13.053 6.910 1.00 41.35 H new ATOM 0 HB2 PRO A 82 27.971 -15.157 6.549 1.00 74.12 H new ATOM 0 HB3 PRO A 82 29.701 -15.431 6.515 1.00 74.12 H new ATOM 0 HG2 PRO A 82 27.760 -15.864 8.777 1.00 54.51 H new ATOM 0 HG3 PRO A 82 29.076 -16.891 8.246 1.00 54.51 H new ATOM 0 HD2 PRO A 82 29.331 -15.247 10.402 1.00 61.05 H new ATOM 0 HD3 PRO A 82 30.698 -15.628 9.375 1.00 61.05 H new ATOM 1115 N PHE A 83 27.094 -13.011 8.770 1.00 11.23 N ATOM 1116 CA PHE A 83 25.815 -12.336 8.957 1.00 33.24 C ATOM 1117 C PHE A 83 26.022 -10.874 9.341 1.00 31.04 C ATOM 1118 O PHE A 83 25.101 -10.061 9.255 1.00 53.11 O ATOM 1119 CB PHE A 83 24.992 -13.046 10.034 1.00 21.55 C ATOM 1120 CG PHE A 83 23.635 -12.440 10.249 1.00 73.50 C ATOM 1121 CD1 PHE A 83 22.877 -12.007 9.173 1.00 43.41 C ATOM 1122 CD2 PHE A 83 23.116 -12.305 11.527 1.00 73.35 C ATOM 1123 CE1 PHE A 83 21.628 -11.448 9.368 1.00 43.13 C ATOM 1124 CE2 PHE A 83 21.867 -11.748 11.727 1.00 0.35 C ATOM 1125 CZ PHE A 83 21.122 -11.319 10.646 1.00 30.54 C ATOM 0 H PHE A 83 27.385 -13.589 9.558 1.00 11.23 H new ATOM 0 HA PHE A 83 25.273 -12.372 8.012 1.00 33.24 H new ATOM 0 HB2 PHE A 83 24.873 -14.094 9.757 1.00 21.55 H new ATOM 0 HB3 PHE A 83 25.543 -13.025 10.974 1.00 21.55 H new ATOM 0 HD1 PHE A 83 23.266 -12.107 8.171 1.00 43.41 H new ATOM 0 HD2 PHE A 83 23.694 -12.639 12.376 1.00 73.35 H new ATOM 0 HE1 PHE A 83 21.048 -11.112 8.521 1.00 43.13 H new ATOM 0 HE2 PHE A 83 21.474 -11.648 12.728 1.00 0.35 H new ATOM 0 HZ PHE A 83 20.146 -10.884 10.800 1.00 30.54 H new ATOM 1135 N LEU A 84 27.237 -10.547 9.766 1.00 2.14 N ATOM 1136 CA LEU A 84 27.567 -9.183 10.165 1.00 50.23 C ATOM 1137 C LEU A 84 27.242 -8.196 9.048 1.00 0.21 C ATOM 1138 O LEU A 84 27.066 -7.002 9.292 1.00 4.41 O ATOM 1139 CB LEU A 84 29.048 -9.082 10.535 1.00 71.53 C ATOM 1140 CG LEU A 84 29.367 -8.335 11.830 1.00 40.43 C ATOM 1141 CD1 LEU A 84 29.135 -6.842 11.655 1.00 42.21 C ATOM 1142 CD2 LEU A 84 28.528 -8.876 12.978 1.00 4.45 C ATOM 0 H LEU A 84 28.010 -11.208 9.843 1.00 2.14 H new ATOM 0 HA LEU A 84 26.963 -8.930 11.037 1.00 50.23 H new ATOM 0 HB2 LEU A 84 29.452 -10.091 10.612 1.00 71.53 H new ATOM 0 HB3 LEU A 84 29.574 -8.590 9.717 1.00 71.53 H new ATOM 0 HG LEU A 84 30.419 -8.493 12.069 1.00 40.43 H new ATOM 0 HD11 LEU A 84 29.367 -6.326 12.587 1.00 42.21 H new ATOM 0 HD12 LEU A 84 29.779 -6.464 10.861 1.00 42.21 H new ATOM 0 HD13 LEU A 84 28.092 -6.664 11.392 1.00 42.21 H new ATOM 0 HD21 LEU A 84 28.768 -8.333 13.892 1.00 4.45 H new ATOM 0 HD22 LEU A 84 27.470 -8.748 12.747 1.00 4.45 H new ATOM 0 HD23 LEU A 84 28.743 -9.935 13.118 1.00 4.45 H new ATOM 1154 N CYS A 85 27.161 -8.703 7.822 1.00 5.44 N ATOM 1155 CA CYS A 85 26.856 -7.867 6.668 1.00 73.15 C ATOM 1156 C CYS A 85 25.374 -7.953 6.311 1.00 4.42 C ATOM 1157 O CYS A 85 24.757 -6.956 5.939 1.00 54.35 O ATOM 1158 CB CYS A 85 27.705 -8.289 5.467 1.00 24.12 C ATOM 1159 SG CYS A 85 29.454 -8.606 5.869 1.00 71.04 S ATOM 0 H CYS A 85 27.302 -9.689 7.603 1.00 5.44 H new ATOM 0 HA CYS A 85 27.091 -6.835 6.927 1.00 73.15 H new ATOM 0 HB2 CYS A 85 27.275 -9.190 5.030 1.00 24.12 H new ATOM 0 HB3 CYS A 85 27.653 -7.509 4.707 1.00 24.12 H new ATOM 1164 N ALA A 86 24.811 -9.151 6.429 1.00 44.40 N ATOM 1165 CA ALA A 86 23.403 -9.366 6.122 1.00 71.31 C ATOM 1166 C ALA A 86 22.522 -9.026 7.319 1.00 33.52 C ATOM 1167 O ALA A 86 21.308 -9.229 7.287 1.00 71.31 O ATOM 1168 CB ALA A 86 23.172 -10.806 5.686 1.00 42.40 C ATOM 0 H ALA A 86 25.309 -9.987 6.735 1.00 44.40 H new ATOM 0 HA ALA A 86 23.130 -8.701 5.303 1.00 71.31 H new ATOM 0 HB1 ALA A 86 22.116 -10.953 5.460 1.00 42.40 H new ATOM 0 HB2 ALA A 86 23.766 -11.017 4.797 1.00 42.40 H new ATOM 0 HB3 ALA A 86 23.468 -11.481 6.489 1.00 42.40 H new ATOM 1174 N VAL A 87 23.141 -8.509 8.376 1.00 54.13 N ATOM 1175 CA VAL A 87 22.412 -8.141 9.584 1.00 41.52 C ATOM 1176 C VAL A 87 22.298 -6.626 9.716 1.00 21.15 C ATOM 1177 O VAL A 87 21.290 -6.108 10.198 1.00 61.31 O ATOM 1178 CB VAL A 87 23.094 -8.705 10.844 1.00 34.43 C ATOM 1179 CG1 VAL A 87 24.415 -7.997 11.100 1.00 62.00 C ATOM 1180 CG2 VAL A 87 22.172 -8.583 12.048 1.00 12.32 C ATOM 0 H VAL A 87 24.145 -8.336 8.420 1.00 54.13 H new ATOM 0 HA VAL A 87 21.415 -8.572 9.496 1.00 41.52 H new ATOM 0 HB VAL A 87 23.303 -9.762 10.680 1.00 34.43 H new ATOM 0 HG11 VAL A 87 24.882 -8.410 11.995 1.00 62.00 H new ATOM 0 HG12 VAL A 87 25.077 -8.142 10.246 1.00 62.00 H new ATOM 0 HG13 VAL A 87 24.235 -6.932 11.243 1.00 62.00 H new ATOM 0 HG21 VAL A 87 22.670 -8.986 12.930 1.00 12.32 H new ATOM 0 HG22 VAL A 87 21.930 -7.534 12.216 1.00 12.32 H new ATOM 0 HG23 VAL A 87 21.255 -9.142 11.862 1.00 12.32 H new ATOM 1190 N PHE A 88 23.338 -5.920 9.286 1.00 43.12 N ATOM 1191 CA PHE A 88 23.356 -4.464 9.357 1.00 54.53 C ATOM 1192 C PHE A 88 23.302 -3.850 7.960 1.00 24.44 C ATOM 1193 O PHE A 88 22.666 -2.819 7.746 1.00 13.44 O ATOM 1194 CB PHE A 88 24.609 -3.982 10.090 1.00 65.32 C ATOM 1195 CG PHE A 88 24.824 -4.655 11.416 1.00 51.04 C ATOM 1196 CD1 PHE A 88 23.802 -4.719 12.349 1.00 54.45 C ATOM 1197 CD2 PHE A 88 26.048 -5.223 11.729 1.00 62.21 C ATOM 1198 CE1 PHE A 88 23.996 -5.337 13.569 1.00 35.23 C ATOM 1199 CE2 PHE A 88 26.248 -5.843 12.948 1.00 72.42 C ATOM 1200 CZ PHE A 88 25.221 -5.899 13.870 1.00 73.44 C ATOM 0 H PHE A 88 24.180 -6.333 8.884 1.00 43.12 H new ATOM 0 HA PHE A 88 22.474 -4.142 9.911 1.00 54.53 H new ATOM 0 HB2 PHE A 88 25.480 -4.156 9.458 1.00 65.32 H new ATOM 0 HB3 PHE A 88 24.538 -2.905 10.245 1.00 65.32 H new ATOM 0 HD1 PHE A 88 22.842 -4.280 12.120 1.00 54.45 H new ATOM 0 HD2 PHE A 88 26.855 -5.181 11.013 1.00 62.21 H new ATOM 0 HE1 PHE A 88 23.190 -5.381 14.287 1.00 35.23 H new ATOM 0 HE2 PHE A 88 27.207 -6.283 13.179 1.00 72.42 H new ATOM 0 HZ PHE A 88 25.376 -6.381 14.824 1.00 73.44 H new ATOM 1210 N LYS A 89 23.977 -4.493 7.013 1.00 54.23 N ATOM 1211 CA LYS A 89 24.007 -4.013 5.636 1.00 22.30 C ATOM 1212 C LYS A 89 23.262 -4.970 4.710 1.00 2.42 C ATOM 1213 O LYS A 89 23.862 -5.768 3.990 1.00 10.01 O ATOM 1214 CB LYS A 89 25.453 -3.851 5.163 1.00 64.43 C ATOM 1215 CG LYS A 89 26.236 -2.810 5.944 1.00 50.25 C ATOM 1216 CD LYS A 89 26.912 -3.417 7.161 1.00 31.32 C ATOM 1217 CE LYS A 89 26.989 -2.423 8.310 1.00 72.40 C ATOM 1218 NZ LYS A 89 27.581 -1.126 7.882 1.00 3.11 N ATOM 0 H LYS A 89 24.510 -5.347 7.174 1.00 54.23 H new ATOM 0 HA LYS A 89 23.510 -3.044 5.604 1.00 22.30 H new ATOM 0 HB2 LYS A 89 25.962 -4.811 5.243 1.00 64.43 H new ATOM 0 HB3 LYS A 89 25.453 -3.577 4.108 1.00 64.43 H new ATOM 0 HG2 LYS A 89 26.988 -2.358 5.297 1.00 50.25 H new ATOM 0 HG3 LYS A 89 25.565 -2.011 6.260 1.00 50.25 H new ATOM 0 HD2 LYS A 89 26.362 -4.302 7.480 1.00 31.32 H new ATOM 0 HD3 LYS A 89 27.917 -3.745 6.895 1.00 31.32 H new ATOM 0 HE2 LYS A 89 25.989 -2.252 8.710 1.00 72.40 H new ATOM 0 HE3 LYS A 89 27.587 -2.846 9.117 1.00 72.40 H new ATOM 0 HZ1 LYS A 89 27.726 -0.519 8.714 1.00 3.11 H new ATOM 0 HZ2 LYS A 89 28.495 -1.298 7.416 1.00 3.11 H new ATOM 0 HZ3 LYS A 89 26.937 -0.653 7.217 1.00 3.11 H new ATOM 1232 N PRO A 90 21.923 -4.888 4.727 1.00 45.25 N ATOM 1233 CA PRO A 90 21.068 -5.737 3.892 1.00 22.34 C ATOM 1234 C PRO A 90 21.169 -5.386 2.412 1.00 4.00 C ATOM 1235 O PRO A 90 21.238 -4.213 2.045 1.00 43.22 O ATOM 1236 CB PRO A 90 19.660 -5.446 4.416 1.00 12.21 C ATOM 1237 CG PRO A 90 19.750 -4.080 5.004 1.00 34.05 C ATOM 1238 CD PRO A 90 21.142 -3.959 5.560 1.00 34.21 C ATOM 0 HA PRO A 90 21.352 -6.787 3.954 1.00 22.34 H new ATOM 0 HB2 PRO A 90 18.923 -5.484 3.614 1.00 12.21 H new ATOM 0 HB3 PRO A 90 19.356 -6.179 5.163 1.00 12.21 H new ATOM 0 HG2 PRO A 90 19.564 -3.317 4.248 1.00 34.05 H new ATOM 0 HG3 PRO A 90 19.004 -3.942 5.787 1.00 34.05 H new ATOM 0 HD2 PRO A 90 21.518 -2.939 5.485 1.00 34.21 H new ATOM 0 HD3 PRO A 90 21.179 -4.235 6.614 1.00 34.21 H new ATOM 1246 N LYS A 91 21.177 -6.410 1.565 1.00 44.30 N ATOM 1247 CA LYS A 91 21.268 -6.210 0.124 1.00 43.15 C ATOM 1248 C LYS A 91 19.981 -5.602 -0.424 1.00 33.42 C ATOM 1249 O LYS A 91 19.076 -6.320 -0.851 1.00 31.32 O ATOM 1250 CB LYS A 91 21.557 -7.539 -0.579 1.00 52.50 C ATOM 1251 CG LYS A 91 21.718 -7.409 -2.084 1.00 11.53 C ATOM 1252 CD LYS A 91 22.580 -8.524 -2.651 1.00 4.44 C ATOM 1253 CE LYS A 91 22.143 -8.907 -4.056 1.00 31.10 C ATOM 1254 NZ LYS A 91 22.931 -10.053 -4.589 1.00 35.12 N ATOM 0 H LYS A 91 21.122 -7.387 1.852 1.00 44.30 H new ATOM 0 HA LYS A 91 22.087 -5.517 -0.070 1.00 43.15 H new ATOM 0 HB2 LYS A 91 22.466 -7.971 -0.161 1.00 52.50 H new ATOM 0 HB3 LYS A 91 20.746 -8.236 -0.368 1.00 52.50 H new ATOM 0 HG2 LYS A 91 20.737 -7.429 -2.559 1.00 11.53 H new ATOM 0 HG3 LYS A 91 22.167 -6.444 -2.321 1.00 11.53 H new ATOM 0 HD2 LYS A 91 23.623 -8.207 -2.667 1.00 4.44 H new ATOM 0 HD3 LYS A 91 22.522 -9.397 -2.000 1.00 4.44 H new ATOM 0 HE2 LYS A 91 21.084 -9.166 -4.049 1.00 31.10 H new ATOM 0 HE3 LYS A 91 22.257 -8.049 -4.718 1.00 31.10 H new ATOM 0 HZ1 LYS A 91 22.603 -10.283 -5.549 1.00 35.12 H new ATOM 0 HZ2 LYS A 91 23.939 -9.797 -4.620 1.00 35.12 H new ATOM 0 HZ3 LYS A 91 22.803 -10.880 -3.971 1.00 35.12 H new ATOM 1268 N CYS A 92 19.905 -4.276 -0.410 1.00 1.22 N ATOM 1269 CA CYS A 92 18.729 -3.571 -0.906 1.00 21.15 C ATOM 1270 C CYS A 92 18.906 -3.181 -2.370 1.00 41.41 C ATOM 1271 O CYS A 92 19.637 -2.244 -2.688 1.00 44.43 O ATOM 1272 CB CYS A 92 18.464 -2.323 -0.062 1.00 14.40 C ATOM 1273 SG CYS A 92 17.094 -1.289 -0.674 1.00 60.11 S ATOM 0 H CYS A 92 20.645 -3.667 -0.060 1.00 1.22 H new ATOM 0 HA CYS A 92 17.874 -4.242 -0.829 1.00 21.15 H new ATOM 0 HB2 CYS A 92 18.245 -2.629 0.961 1.00 14.40 H new ATOM 0 HB3 CYS A 92 19.372 -1.721 -0.027 1.00 14.40 H new ATOM 1278 N GLU A 93 18.231 -3.906 -3.256 1.00 70.20 N ATOM 1279 CA GLU A 93 18.314 -3.636 -4.686 1.00 45.35 C ATOM 1280 C GLU A 93 16.945 -3.272 -5.252 1.00 53.12 C ATOM 1281 O GLU A 93 15.927 -3.389 -4.569 1.00 50.53 O ATOM 1282 CB GLU A 93 18.877 -4.851 -5.426 1.00 25.20 C ATOM 1283 CG GLU A 93 17.993 -6.083 -5.333 1.00 62.34 C ATOM 1284 CD GLU A 93 18.139 -6.998 -6.534 1.00 44.21 C ATOM 1285 OE1 GLU A 93 19.097 -6.808 -7.312 1.00 41.33 O ATOM 1286 OE2 GLU A 93 17.295 -7.904 -6.695 1.00 23.32 O ATOM 0 H GLU A 93 17.621 -4.685 -3.009 1.00 70.20 H new ATOM 0 HA GLU A 93 18.985 -2.789 -4.830 1.00 45.35 H new ATOM 0 HB2 GLU A 93 19.018 -4.593 -6.476 1.00 25.20 H new ATOM 0 HB3 GLU A 93 19.861 -5.089 -5.021 1.00 25.20 H new ATOM 0 HG2 GLU A 93 18.241 -6.636 -4.427 1.00 62.34 H new ATOM 0 HG3 GLU A 93 16.952 -5.773 -5.242 1.00 62.34 H new ATOM 1293 N LYS A 94 16.927 -2.830 -6.505 1.00 42.31 N ATOM 1294 CA LYS A 94 15.684 -2.449 -7.165 1.00 42.22 C ATOM 1295 C LYS A 94 15.252 -3.514 -8.168 1.00 31.13 C ATOM 1296 O LYS A 94 15.851 -3.655 -9.234 1.00 62.51 O ATOM 1297 CB LYS A 94 15.851 -1.103 -7.875 1.00 21.31 C ATOM 1298 CG LYS A 94 15.066 0.026 -7.230 1.00 60.12 C ATOM 1299 CD LYS A 94 15.140 1.299 -8.057 1.00 33.05 C ATOM 1300 CE LYS A 94 16.573 1.787 -8.201 1.00 51.33 C ATOM 1301 NZ LYS A 94 17.252 1.914 -6.882 1.00 33.01 N ATOM 0 H LYS A 94 17.760 -2.727 -7.084 1.00 42.31 H new ATOM 0 HA LYS A 94 14.910 -2.357 -6.403 1.00 42.22 H new ATOM 0 HB2 LYS A 94 16.908 -0.838 -7.889 1.00 21.31 H new ATOM 0 HB3 LYS A 94 15.535 -1.207 -8.913 1.00 21.31 H new ATOM 0 HG2 LYS A 94 14.024 -0.274 -7.114 1.00 60.12 H new ATOM 0 HG3 LYS A 94 15.456 0.217 -6.230 1.00 60.12 H new ATOM 0 HD2 LYS A 94 14.715 1.118 -9.044 1.00 33.05 H new ATOM 0 HD3 LYS A 94 14.536 2.075 -7.587 1.00 33.05 H new ATOM 0 HE2 LYS A 94 17.131 1.094 -8.831 1.00 51.33 H new ATOM 0 HE3 LYS A 94 16.578 2.753 -8.707 1.00 51.33 H new ATOM 0 HZ1 LYS A 94 17.889 2.736 -6.897 1.00 33.01 H new ATOM 0 HZ2 LYS A 94 16.539 2.042 -6.136 1.00 33.01 H new ATOM 0 HZ3 LYS A 94 17.803 1.053 -6.691 1.00 33.01 H new ATOM 1315 N ILE A 95 14.209 -4.259 -7.819 1.00 74.42 N ATOM 1316 CA ILE A 95 13.695 -5.309 -8.690 1.00 64.42 C ATOM 1317 C ILE A 95 12.612 -4.772 -9.619 1.00 72.51 C ATOM 1318 O ILE A 95 11.528 -4.398 -9.174 1.00 31.33 O ATOM 1319 CB ILE A 95 13.123 -6.485 -7.877 1.00 75.32 C ATOM 1320 CG1 ILE A 95 14.233 -7.171 -7.079 1.00 2.12 C ATOM 1321 CG2 ILE A 95 12.434 -7.481 -8.799 1.00 14.41 C ATOM 1322 CD1 ILE A 95 14.425 -6.595 -5.693 1.00 71.22 C ATOM 0 H ILE A 95 13.703 -4.155 -6.939 1.00 74.42 H new ATOM 0 HA ILE A 95 14.536 -5.665 -9.285 1.00 64.42 H new ATOM 0 HB ILE A 95 12.385 -6.096 -7.176 1.00 75.32 H new ATOM 0 HG12 ILE A 95 14.005 -8.233 -6.994 1.00 2.12 H new ATOM 0 HG13 ILE A 95 15.170 -7.089 -7.631 1.00 2.12 H new ATOM 0 HG21 ILE A 95 12.035 -8.307 -8.210 1.00 14.41 H new ATOM 0 HG22 ILE A 95 11.620 -6.985 -9.327 1.00 14.41 H new ATOM 0 HG23 ILE A 95 13.154 -7.866 -9.522 1.00 14.41 H new ATOM 0 HD11 ILE A 95 15.228 -7.129 -5.185 1.00 71.22 H new ATOM 0 HD12 ILE A 95 14.684 -5.539 -5.771 1.00 71.22 H new ATOM 0 HD13 ILE A 95 13.501 -6.701 -5.124 1.00 71.22 H new ATOM 1334 N ASN A 96 12.913 -4.739 -10.913 1.00 74.43 N ATOM 1335 CA ASN A 96 11.963 -4.249 -11.906 1.00 64.53 C ATOM 1336 C ASN A 96 11.649 -2.774 -11.677 1.00 32.34 C ATOM 1337 O ASN A 96 10.620 -2.271 -12.126 1.00 10.02 O ATOM 1338 CB ASN A 96 10.674 -5.071 -11.858 1.00 74.12 C ATOM 1339 CG ASN A 96 9.811 -4.866 -13.089 1.00 25.31 C ATOM 1340 OD1 ASN A 96 10.109 -5.390 -14.163 1.00 12.22 O ATOM 1341 ND2 ASN A 96 8.737 -4.101 -12.938 1.00 33.24 N ATOM 0 H ASN A 96 13.806 -5.045 -11.299 1.00 74.43 H new ATOM 0 HA ASN A 96 12.417 -4.356 -12.891 1.00 64.53 H new ATOM 0 HB2 ASN A 96 10.924 -6.128 -11.765 1.00 74.12 H new ATOM 0 HB3 ASN A 96 10.105 -4.798 -10.969 1.00 74.12 H new ATOM 0 HD21 ASN A 96 8.119 -3.927 -13.731 1.00 33.24 H new ATOM 0 HD22 ASN A 96 8.529 -3.687 -12.029 1.00 33.24 H new ATOM 1348 N GLY A 97 12.544 -2.086 -10.974 1.00 34.21 N ATOM 1349 CA GLY A 97 12.344 -0.676 -10.697 1.00 51.31 C ATOM 1350 C GLY A 97 11.686 -0.436 -9.353 1.00 33.22 C ATOM 1351 O GLY A 97 11.134 0.636 -9.108 1.00 35.22 O ATOM 0 H GLY A 97 13.404 -2.480 -10.592 1.00 34.21 H new ATOM 0 HA2 GLY A 97 13.306 -0.164 -10.724 1.00 51.31 H new ATOM 0 HA3 GLY A 97 11.728 -0.238 -11.483 1.00 51.31 H new ATOM 1355 N GLU A 98 11.743 -1.438 -8.481 1.00 10.13 N ATOM 1356 CA GLU A 98 11.145 -1.331 -7.155 1.00 51.31 C ATOM 1357 C GLU A 98 12.184 -1.588 -6.067 1.00 74.32 C ATOM 1358 O GLU A 98 12.710 -2.694 -5.946 1.00 64.54 O ATOM 1359 CB GLU A 98 9.986 -2.319 -7.013 1.00 34.11 C ATOM 1360 CG GLU A 98 8.901 -2.140 -8.062 1.00 61.30 C ATOM 1361 CD GLU A 98 7.803 -3.179 -7.948 1.00 75.35 C ATOM 1362 OE1 GLU A 98 8.073 -4.273 -7.409 1.00 55.42 O ATOM 1363 OE2 GLU A 98 6.672 -2.898 -8.399 1.00 61.11 O ATOM 0 H GLU A 98 12.197 -2.332 -8.669 1.00 10.13 H new ATOM 0 HA GLU A 98 10.764 -0.316 -7.037 1.00 51.31 H new ATOM 0 HB2 GLU A 98 10.376 -3.335 -7.076 1.00 34.11 H new ATOM 0 HB3 GLU A 98 9.544 -2.208 -6.023 1.00 34.11 H new ATOM 0 HG2 GLU A 98 8.466 -1.145 -7.964 1.00 61.30 H new ATOM 0 HG3 GLU A 98 9.348 -2.196 -9.055 1.00 61.30 H new ATOM 1370 N ASP A 99 12.473 -0.559 -5.279 1.00 21.24 N ATOM 1371 CA ASP A 99 13.448 -0.673 -4.200 1.00 41.01 C ATOM 1372 C ASP A 99 12.992 -1.692 -3.160 1.00 41.15 C ATOM 1373 O ASP A 99 12.098 -1.419 -2.360 1.00 40.21 O ATOM 1374 CB ASP A 99 13.668 0.688 -3.537 1.00 33.42 C ATOM 1375 CG ASP A 99 14.252 1.710 -4.492 1.00 32.21 C ATOM 1376 OD1 ASP A 99 13.488 2.259 -5.313 1.00 33.41 O ATOM 1377 OD2 ASP A 99 15.473 1.960 -4.419 1.00 43.31 O ATOM 0 H ASP A 99 12.047 0.363 -5.367 1.00 21.24 H new ATOM 0 HA ASP A 99 14.389 -1.016 -4.629 1.00 41.01 H new ATOM 0 HB2 ASP A 99 12.719 1.058 -3.150 1.00 33.42 H new ATOM 0 HB3 ASP A 99 14.336 0.569 -2.684 1.00 33.42 H new ATOM 1382 N MET A 100 13.612 -2.867 -3.180 1.00 20.33 N ATOM 1383 CA MET A 100 13.269 -3.927 -2.238 1.00 64.13 C ATOM 1384 C MET A 100 14.481 -4.322 -1.400 1.00 30.11 C ATOM 1385 O MET A 100 15.613 -3.956 -1.716 1.00 61.32 O ATOM 1386 CB MET A 100 12.732 -5.149 -2.986 1.00 52.31 C ATOM 1387 CG MET A 100 11.734 -4.802 -4.079 1.00 44.44 C ATOM 1388 SD MET A 100 10.201 -5.741 -3.945 1.00 2.25 S ATOM 1389 CE MET A 100 10.605 -7.190 -4.917 1.00 2.13 C ATOM 0 H MET A 100 14.354 -3.110 -3.837 1.00 20.33 H new ATOM 0 HA MET A 100 12.495 -3.549 -1.570 1.00 64.13 H new ATOM 0 HB2 MET A 100 13.568 -5.691 -3.428 1.00 52.31 H new ATOM 0 HB3 MET A 100 12.257 -5.822 -2.272 1.00 52.31 H new ATOM 0 HG2 MET A 100 11.508 -3.737 -4.034 1.00 44.44 H new ATOM 0 HG3 MET A 100 12.187 -4.991 -5.052 1.00 44.44 H new ATOM 0 HE1 MET A 100 9.898 -7.284 -5.742 1.00 2.13 H new ATOM 0 HE2 MET A 100 11.615 -7.092 -5.314 1.00 2.13 H new ATOM 0 HE3 MET A 100 10.548 -8.078 -4.287 1.00 2.13 H new ATOM 1399 N VAL A 101 14.236 -5.071 -0.329 1.00 54.32 N ATOM 1400 CA VAL A 101 15.307 -5.516 0.554 1.00 13.22 C ATOM 1401 C VAL A 101 15.434 -7.035 0.541 1.00 43.00 C ATOM 1402 O VAL A 101 14.462 -7.748 0.290 1.00 44.15 O ATOM 1403 CB VAL A 101 15.073 -5.044 2.002 1.00 41.24 C ATOM 1404 CG1 VAL A 101 14.990 -3.526 2.062 1.00 70.23 C ATOM 1405 CG2 VAL A 101 13.813 -5.678 2.572 1.00 44.04 C ATOM 0 H VAL A 101 13.305 -5.382 -0.052 1.00 54.32 H new ATOM 0 HA VAL A 101 16.230 -5.074 0.180 1.00 13.22 H new ATOM 0 HB VAL A 101 15.919 -5.362 2.611 1.00 41.24 H new ATOM 0 HG11 VAL A 101 14.824 -3.211 3.092 1.00 70.23 H new ATOM 0 HG12 VAL A 101 15.922 -3.096 1.696 1.00 70.23 H new ATOM 0 HG13 VAL A 101 14.163 -3.182 1.440 1.00 70.23 H new ATOM 0 HG21 VAL A 101 13.663 -5.334 3.595 1.00 44.04 H new ATOM 0 HG22 VAL A 101 12.955 -5.392 1.964 1.00 44.04 H new ATOM 0 HG23 VAL A 101 13.917 -6.763 2.566 1.00 44.04 H new ATOM 1415 N TYR A 102 16.639 -7.524 0.814 1.00 73.23 N ATOM 1416 CA TYR A 102 16.895 -8.959 0.832 1.00 74.55 C ATOM 1417 C TYR A 102 17.136 -9.452 2.255 1.00 25.20 C ATOM 1418 O TYR A 102 18.234 -9.311 2.796 1.00 63.35 O ATOM 1419 CB TYR A 102 18.100 -9.295 -0.048 1.00 4.31 C ATOM 1420 CG TYR A 102 17.733 -9.642 -1.473 1.00 33.43 C ATOM 1421 CD1 TYR A 102 16.901 -10.719 -1.754 1.00 32.04 C ATOM 1422 CD2 TYR A 102 18.217 -8.893 -2.538 1.00 72.22 C ATOM 1423 CE1 TYR A 102 16.563 -11.041 -3.054 1.00 0.41 C ATOM 1424 CE2 TYR A 102 17.883 -9.207 -3.842 1.00 1.43 C ATOM 1425 CZ TYR A 102 17.056 -10.281 -4.094 1.00 64.34 C ATOM 1426 OH TYR A 102 16.721 -10.598 -5.391 1.00 1.50 O ATOM 0 H TYR A 102 17.453 -6.948 1.026 1.00 73.23 H new ATOM 0 HA TYR A 102 16.014 -9.464 0.437 1.00 74.55 H new ATOM 0 HB2 TYR A 102 18.782 -8.445 -0.054 1.00 4.31 H new ATOM 0 HB3 TYR A 102 18.639 -10.133 0.394 1.00 4.31 H new ATOM 0 HD1 TYR A 102 16.512 -11.315 -0.942 1.00 32.04 H new ATOM 0 HD2 TYR A 102 18.865 -8.051 -2.344 1.00 72.22 H new ATOM 0 HE1 TYR A 102 15.917 -11.883 -3.255 1.00 0.41 H new ATOM 0 HE2 TYR A 102 18.268 -8.614 -4.659 1.00 1.43 H new ATOM 0 HH TYR A 102 16.867 -9.818 -5.966 1.00 1.50 H new ATOM 1436 N LEU A 103 16.104 -10.031 2.857 1.00 75.31 N ATOM 1437 CA LEU A 103 16.202 -10.547 4.218 1.00 12.21 C ATOM 1438 C LEU A 103 17.201 -11.697 4.294 1.00 13.00 C ATOM 1439 O LEU A 103 17.472 -12.382 3.308 1.00 44.24 O ATOM 1440 CB LEU A 103 14.830 -11.014 4.708 1.00 61.44 C ATOM 1441 CG LEU A 103 13.753 -9.935 4.818 1.00 11.22 C ATOM 1442 CD1 LEU A 103 12.831 -9.974 3.609 1.00 23.32 C ATOM 1443 CD2 LEU A 103 12.957 -10.105 6.104 1.00 72.52 C ATOM 0 H LEU A 103 15.189 -10.155 2.424 1.00 75.31 H new ATOM 0 HA LEU A 103 16.555 -9.741 4.861 1.00 12.21 H new ATOM 0 HB2 LEU A 103 14.470 -11.790 4.033 1.00 61.44 H new ATOM 0 HB3 LEU A 103 14.954 -11.476 5.687 1.00 61.44 H new ATOM 0 HG LEU A 103 14.243 -8.962 4.843 1.00 11.22 H new ATOM 0 HD11 LEU A 103 12.071 -9.199 3.706 1.00 23.32 H new ATOM 0 HD12 LEU A 103 13.412 -9.802 2.703 1.00 23.32 H new ATOM 0 HD13 LEU A 103 12.348 -10.950 3.551 1.00 23.32 H new ATOM 0 HD21 LEU A 103 12.195 -9.328 6.166 1.00 72.52 H new ATOM 0 HD22 LEU A 103 12.478 -11.084 6.109 1.00 72.52 H new ATOM 0 HD23 LEU A 103 13.627 -10.024 6.960 1.00 72.52 H new ATOM 1455 N PRO A 104 17.760 -11.917 5.493 1.00 21.11 N ATOM 1456 CA PRO A 104 18.736 -12.986 5.727 1.00 15.03 C ATOM 1457 C PRO A 104 18.104 -14.372 5.658 1.00 22.31 C ATOM 1458 O PRO A 104 16.999 -14.587 6.155 1.00 55.32 O ATOM 1459 CB PRO A 104 19.243 -12.699 7.143 1.00 73.41 C ATOM 1460 CG PRO A 104 18.134 -11.951 7.798 1.00 34.55 C ATOM 1461 CD PRO A 104 17.483 -11.140 6.713 1.00 51.23 C ATOM 0 HA PRO A 104 19.522 -12.994 4.972 1.00 15.03 H new ATOM 0 HB2 PRO A 104 19.468 -13.622 7.678 1.00 73.41 H new ATOM 0 HB3 PRO A 104 20.160 -12.110 7.123 1.00 73.41 H new ATOM 0 HG2 PRO A 104 17.419 -12.635 8.256 1.00 34.55 H new ATOM 0 HG3 PRO A 104 18.513 -11.307 8.592 1.00 34.55 H new ATOM 0 HD2 PRO A 104 16.412 -11.027 6.883 1.00 51.23 H new ATOM 0 HD3 PRO A 104 17.904 -10.136 6.654 1.00 51.23 H new ATOM 1469 N SER A 105 18.814 -15.311 5.040 1.00 40.54 N ATOM 1470 CA SER A 105 18.321 -16.676 4.903 1.00 61.13 C ATOM 1471 C SER A 105 18.421 -17.425 6.228 1.00 14.12 C ATOM 1472 O SER A 105 19.277 -17.125 7.061 1.00 72.23 O ATOM 1473 CB SER A 105 19.110 -17.420 3.823 1.00 0.23 C ATOM 1474 OG SER A 105 19.610 -16.522 2.847 1.00 33.23 O ATOM 0 H SER A 105 19.733 -15.151 4.626 1.00 40.54 H new ATOM 0 HA SER A 105 17.272 -16.629 4.610 1.00 61.13 H new ATOM 0 HB2 SER A 105 19.937 -17.962 4.281 1.00 0.23 H new ATOM 0 HB3 SER A 105 18.469 -18.161 3.345 1.00 0.23 H new ATOM 0 HG SER A 105 20.518 -16.788 2.593 1.00 33.23 H new ATOM 1480 N TYR A 106 17.539 -18.400 6.417 1.00 72.33 N ATOM 1481 CA TYR A 106 17.524 -19.191 7.641 1.00 25.45 C ATOM 1482 C TYR A 106 18.917 -19.728 7.960 1.00 73.12 C ATOM 1483 O TYR A 106 19.284 -19.877 9.125 1.00 63.25 O ATOM 1484 CB TYR A 106 16.536 -20.351 7.513 1.00 72.44 C ATOM 1485 CG TYR A 106 17.034 -21.477 6.635 1.00 22.30 C ATOM 1486 CD1 TYR A 106 17.322 -21.262 5.293 1.00 63.43 C ATOM 1487 CD2 TYR A 106 17.216 -22.756 7.147 1.00 2.24 C ATOM 1488 CE1 TYR A 106 17.777 -22.288 4.487 1.00 63.12 C ATOM 1489 CE2 TYR A 106 17.672 -23.787 6.349 1.00 1.03 C ATOM 1490 CZ TYR A 106 17.951 -23.548 5.020 1.00 61.32 C ATOM 1491 OH TYR A 106 18.404 -24.573 4.221 1.00 21.21 O ATOM 0 H TYR A 106 16.825 -18.661 5.737 1.00 72.33 H new ATOM 0 HA TYR A 106 17.208 -18.542 8.458 1.00 25.45 H new ATOM 0 HB2 TYR A 106 16.320 -20.744 8.506 1.00 72.44 H new ATOM 0 HB3 TYR A 106 15.597 -19.974 7.108 1.00 72.44 H new ATOM 0 HD1 TYR A 106 17.188 -20.276 4.873 1.00 63.43 H new ATOM 0 HD2 TYR A 106 16.997 -22.947 8.187 1.00 2.24 H new ATOM 0 HE1 TYR A 106 17.995 -22.104 3.445 1.00 63.12 H new ATOM 0 HE2 TYR A 106 17.809 -24.775 6.764 1.00 1.03 H new ATOM 0 HH TYR A 106 18.473 -25.395 4.751 1.00 21.21 H new ATOM 1501 N GLU A 107 19.686 -20.016 6.915 1.00 42.34 N ATOM 1502 CA GLU A 107 21.038 -20.536 7.082 1.00 0.02 C ATOM 1503 C GLU A 107 21.947 -19.492 7.725 1.00 50.04 C ATOM 1504 O GLU A 107 22.543 -19.734 8.773 1.00 25.23 O ATOM 1505 CB GLU A 107 21.613 -20.967 5.732 1.00 65.53 C ATOM 1506 CG GLU A 107 22.371 -22.283 5.785 1.00 21.44 C ATOM 1507 CD GLU A 107 23.714 -22.212 5.085 1.00 61.42 C ATOM 1508 OE1 GLU A 107 24.620 -21.530 5.608 1.00 61.30 O ATOM 1509 OE2 GLU A 107 23.859 -22.838 4.014 1.00 61.10 O ATOM 0 H GLU A 107 19.396 -19.898 5.944 1.00 42.34 H new ATOM 0 HA GLU A 107 20.987 -21.403 7.740 1.00 0.02 H new ATOM 0 HB2 GLU A 107 20.800 -21.055 5.012 1.00 65.53 H new ATOM 0 HB3 GLU A 107 22.281 -20.187 5.365 1.00 65.53 H new ATOM 0 HG2 GLU A 107 22.523 -22.569 6.826 1.00 21.44 H new ATOM 0 HG3 GLU A 107 21.767 -23.065 5.325 1.00 21.44 H new ATOM 1516 N MET A 108 22.047 -18.330 7.087 1.00 62.44 N ATOM 1517 CA MET A 108 22.883 -17.249 7.596 1.00 53.04 C ATOM 1518 C MET A 108 22.550 -16.945 9.053 1.00 22.10 C ATOM 1519 O MET A 108 23.443 -16.710 9.868 1.00 51.10 O ATOM 1520 CB MET A 108 22.699 -15.990 6.745 1.00 21.53 C ATOM 1521 CG MET A 108 23.706 -15.870 5.613 1.00 73.24 C ATOM 1522 SD MET A 108 22.986 -15.168 4.116 1.00 62.12 S ATOM 1523 CE MET A 108 23.721 -13.534 4.121 1.00 34.53 C ATOM 0 H MET A 108 21.560 -18.113 6.217 1.00 62.44 H new ATOM 0 HA MET A 108 23.923 -17.569 7.539 1.00 53.04 H new ATOM 0 HB2 MET A 108 21.692 -15.988 6.327 1.00 21.53 H new ATOM 0 HB3 MET A 108 22.779 -15.113 7.387 1.00 21.53 H new ATOM 0 HG2 MET A 108 24.539 -15.247 5.938 1.00 73.24 H new ATOM 0 HG3 MET A 108 24.113 -16.856 5.388 1.00 73.24 H new ATOM 0 HE1 MET A 108 22.978 -12.800 3.809 1.00 34.53 H new ATOM 0 HE2 MET A 108 24.068 -13.294 5.126 1.00 34.53 H new ATOM 0 HE3 MET A 108 24.565 -13.512 3.431 1.00 34.53 H new ATOM 1533 N CYS A 109 21.261 -16.951 9.375 1.00 60.22 N ATOM 1534 CA CYS A 109 20.810 -16.676 10.734 1.00 42.55 C ATOM 1535 C CYS A 109 21.012 -17.893 11.631 1.00 5.23 C ATOM 1536 O CYS A 109 21.133 -17.765 12.850 1.00 74.12 O ATOM 1537 CB CYS A 109 19.335 -16.269 10.731 1.00 21.33 C ATOM 1538 SG CYS A 109 19.057 -14.478 10.911 1.00 10.04 S ATOM 0 H CYS A 109 20.510 -17.143 8.713 1.00 60.22 H new ATOM 0 HA CYS A 109 21.406 -15.853 11.129 1.00 42.55 H new ATOM 0 HB2 CYS A 109 18.878 -16.605 9.800 1.00 21.33 H new ATOM 0 HB3 CYS A 109 18.824 -16.788 11.542 1.00 21.33 H new ATOM 1543 N ARG A 110 21.049 -19.072 11.020 1.00 62.30 N ATOM 1544 CA ARG A 110 21.236 -20.313 11.763 1.00 10.53 C ATOM 1545 C ARG A 110 22.673 -20.437 12.260 1.00 23.33 C ATOM 1546 O ARG A 110 22.939 -21.106 13.260 1.00 52.22 O ATOM 1547 CB ARG A 110 20.882 -21.515 10.887 1.00 32.40 C ATOM 1548 CG ARG A 110 21.208 -22.854 11.529 1.00 4.21 C ATOM 1549 CD ARG A 110 20.089 -23.861 11.318 1.00 71.13 C ATOM 1550 NE ARG A 110 20.157 -24.486 10.000 1.00 72.34 N ATOM 1551 CZ ARG A 110 19.477 -25.578 9.668 1.00 31.34 C ATOM 1552 NH1 ARG A 110 18.682 -26.163 10.554 1.00 10.52 N ATOM 1553 NH2 ARG A 110 19.591 -26.088 8.449 1.00 41.25 N ATOM 0 H ARG A 110 20.952 -19.195 10.012 1.00 62.30 H new ATOM 0 HA ARG A 110 20.571 -20.294 12.627 1.00 10.53 H new ATOM 0 HB2 ARG A 110 19.818 -21.483 10.654 1.00 32.40 H new ATOM 0 HB3 ARG A 110 21.418 -21.435 9.941 1.00 32.40 H new ATOM 0 HG2 ARG A 110 22.134 -23.245 11.108 1.00 4.21 H new ATOM 0 HG3 ARG A 110 21.377 -22.715 12.597 1.00 4.21 H new ATOM 0 HD2 ARG A 110 20.144 -24.631 12.088 1.00 71.13 H new ATOM 0 HD3 ARG A 110 19.126 -23.363 11.434 1.00 71.13 H new ATOM 0 HE ARG A 110 20.760 -24.061 9.296 1.00 72.34 H new ATOM 0 HH11 ARG A 110 18.592 -25.775 11.493 1.00 10.52 H new ATOM 0 HH12 ARG A 110 18.161 -27.001 10.297 1.00 10.52 H new ATOM 0 HH21 ARG A 110 20.202 -25.642 7.765 1.00 41.25 H new ATOM 0 HH22 ARG A 110 19.068 -26.926 8.196 1.00 41.25 H new ATOM 1567 N ILE A 111 23.596 -19.790 11.556 1.00 74.41 N ATOM 1568 CA ILE A 111 25.005 -19.829 11.926 1.00 11.20 C ATOM 1569 C ILE A 111 25.197 -19.473 13.396 1.00 20.14 C ATOM 1570 O ILE A 111 26.077 -20.012 14.068 1.00 63.41 O ATOM 1571 CB ILE A 111 25.840 -18.865 11.063 1.00 41.21 C ATOM 1572 CG1 ILE A 111 25.626 -19.160 9.577 1.00 22.30 C ATOM 1573 CG2 ILE A 111 27.314 -18.973 11.423 1.00 23.13 C ATOM 1574 CD1 ILE A 111 25.983 -20.577 9.185 1.00 33.33 C ATOM 0 H ILE A 111 23.393 -19.233 10.726 1.00 74.41 H new ATOM 0 HA ILE A 111 25.349 -20.849 11.754 1.00 11.20 H new ATOM 0 HB ILE A 111 25.511 -17.845 11.263 1.00 41.21 H new ATOM 0 HG12 ILE A 111 24.582 -18.974 9.325 1.00 22.30 H new ATOM 0 HG13 ILE A 111 26.225 -18.466 8.987 1.00 22.30 H new ATOM 0 HG21 ILE A 111 27.891 -18.286 10.804 1.00 23.13 H new ATOM 0 HG22 ILE A 111 27.452 -18.718 12.474 1.00 23.13 H new ATOM 0 HG23 ILE A 111 27.657 -19.993 11.249 1.00 23.13 H new ATOM 0 HD11 ILE A 111 25.807 -20.715 8.118 1.00 33.33 H new ATOM 0 HD12 ILE A 111 27.034 -20.762 9.406 1.00 33.33 H new ATOM 0 HD13 ILE A 111 25.366 -21.277 9.748 1.00 33.33 H new ATOM 1586 N THR A 112 24.366 -18.562 13.893 1.00 53.02 N ATOM 1587 CA THR A 112 24.443 -18.134 15.284 1.00 71.22 C ATOM 1588 C THR A 112 23.698 -19.100 16.198 1.00 15.42 C ATOM 1589 O THR A 112 23.990 -19.191 17.390 1.00 61.40 O ATOM 1590 CB THR A 112 23.864 -16.719 15.469 1.00 11.13 C ATOM 1591 OG1 THR A 112 22.435 -16.759 15.385 1.00 60.23 O ATOM 1592 CG2 THR A 112 24.413 -15.768 14.417 1.00 53.53 C ATOM 0 H THR A 112 23.631 -18.106 13.352 1.00 53.02 H new ATOM 0 HA THR A 112 25.499 -18.124 15.554 1.00 71.22 H new ATOM 0 HB THR A 112 24.159 -16.356 16.453 1.00 11.13 H new ATOM 0 HG1 THR A 112 22.168 -17.120 14.514 1.00 60.23 H new ATOM 0 HG21 THR A 112 23.990 -14.775 14.568 1.00 53.53 H new ATOM 0 HG22 THR A 112 25.498 -15.717 14.504 1.00 53.53 H new ATOM 0 HG23 THR A 112 24.145 -16.130 13.424 1.00 53.53 H new ATOM 1600 N MET A 113 22.734 -19.818 15.632 1.00 34.42 N ATOM 1601 CA MET A 113 21.947 -20.779 16.398 1.00 65.25 C ATOM 1602 C MET A 113 22.807 -21.963 16.830 1.00 73.12 C ATOM 1603 O MET A 113 22.606 -22.526 17.905 1.00 24.23 O ATOM 1604 CB MET A 113 20.759 -21.272 15.570 1.00 14.13 C ATOM 1605 CG MET A 113 19.523 -20.396 15.700 1.00 43.31 C ATOM 1606 SD MET A 113 18.025 -21.218 15.125 1.00 41.12 S ATOM 1607 CE MET A 113 18.460 -21.562 13.422 1.00 41.23 C ATOM 0 H MET A 113 22.479 -19.753 14.647 1.00 34.42 H new ATOM 0 HA MET A 113 21.575 -20.277 17.291 1.00 65.25 H new ATOM 0 HB2 MET A 113 21.052 -21.319 14.521 1.00 14.13 H new ATOM 0 HB3 MET A 113 20.509 -22.287 15.877 1.00 14.13 H new ATOM 0 HG2 MET A 113 19.396 -20.106 16.743 1.00 43.31 H new ATOM 0 HG3 MET A 113 19.671 -19.479 15.130 1.00 43.31 H new ATOM 0 HE1 MET A 113 17.668 -22.148 12.956 1.00 41.23 H new ATOM 0 HE2 MET A 113 18.583 -20.624 12.881 1.00 41.23 H new ATOM 0 HE3 MET A 113 19.394 -22.124 13.391 1.00 41.23 H new ATOM 1617 N GLU A 114 23.763 -22.335 15.984 1.00 11.22 N ATOM 1618 CA GLU A 114 24.651 -23.453 16.280 1.00 10.21 C ATOM 1619 C GLU A 114 25.324 -23.269 17.637 1.00 11.32 C ATOM 1620 O GLU A 114 25.147 -24.065 18.559 1.00 14.15 O ATOM 1621 CB GLU A 114 25.712 -23.593 15.187 1.00 45.10 C ATOM 1622 CG GLU A 114 25.476 -24.770 14.256 1.00 30.31 C ATOM 1623 CD GLU A 114 25.994 -26.077 14.825 1.00 10.00 C ATOM 1624 OE1 GLU A 114 26.195 -26.151 16.055 1.00 33.02 O ATOM 1625 OE2 GLU A 114 26.198 -27.026 14.039 1.00 3.20 O ATOM 0 H GLU A 114 23.942 -21.879 15.089 1.00 11.22 H new ATOM 0 HA GLU A 114 24.051 -24.362 16.312 1.00 10.21 H new ATOM 0 HB2 GLU A 114 25.739 -22.676 14.599 1.00 45.10 H new ATOM 0 HB3 GLU A 114 26.691 -23.701 15.654 1.00 45.10 H new ATOM 0 HG2 GLU A 114 24.408 -24.863 14.057 1.00 30.31 H new ATOM 0 HG3 GLU A 114 25.963 -24.576 13.300 1.00 30.31 H new ATOM 1632 N PRO A 115 26.116 -22.194 17.763 1.00 1.34 N ATOM 1633 CA PRO A 115 26.832 -21.879 19.003 1.00 30.13 C ATOM 1634 C PRO A 115 25.892 -21.439 20.120 1.00 55.10 C ATOM 1635 O PRO A 115 25.968 -21.938 21.243 1.00 4.22 O ATOM 1636 CB PRO A 115 27.756 -20.728 18.597 1.00 14.03 C ATOM 1637 CG PRO A 115 27.078 -20.091 17.433 1.00 20.14 C ATOM 1638 CD PRO A 115 26.373 -21.202 16.705 1.00 24.35 C ATOM 0 HA PRO A 115 27.359 -22.747 19.401 1.00 30.13 H new ATOM 0 HB2 PRO A 115 27.888 -20.019 19.415 1.00 14.03 H new ATOM 0 HB3 PRO A 115 28.747 -21.092 18.327 1.00 14.03 H new ATOM 0 HG2 PRO A 115 26.371 -19.330 17.762 1.00 20.14 H new ATOM 0 HG3 PRO A 115 27.800 -19.596 16.784 1.00 20.14 H new ATOM 0 HD2 PRO A 115 25.447 -20.857 16.244 1.00 24.35 H new ATOM 0 HD3 PRO A 115 26.991 -21.616 15.908 1.00 24.35 H new ATOM 1646 N CYS A 116 25.004 -20.502 19.805 1.00 53.15 N ATOM 1647 CA CYS A 116 24.048 -19.994 20.781 1.00 54.01 C ATOM 1648 C CYS A 116 22.638 -20.488 20.470 1.00 72.42 C ATOM 1649 O CYS A 116 21.842 -19.779 19.853 1.00 23.52 O ATOM 1650 CB CYS A 116 24.071 -18.464 20.800 1.00 33.33 C ATOM 1651 SG CYS A 116 25.716 -17.749 21.115 1.00 25.50 S ATOM 0 H CYS A 116 24.927 -20.079 18.880 1.00 53.15 H new ATOM 0 HA CYS A 116 24.337 -20.368 21.763 1.00 54.01 H new ATOM 0 HB2 CYS A 116 23.703 -18.094 19.843 1.00 33.33 H new ATOM 0 HB3 CYS A 116 23.380 -18.110 21.566 1.00 33.33 H new ATOM 1656 N ARG A 117 22.336 -21.709 20.901 1.00 2.31 N ATOM 1657 CA ARG A 117 21.023 -22.299 20.668 1.00 4.41 C ATOM 1658 C ARG A 117 20.015 -21.807 21.702 1.00 1.42 C ATOM 1659 O ARG A 117 18.809 -21.804 21.455 1.00 72.30 O ATOM 1660 CB ARG A 117 21.112 -23.825 20.712 1.00 34.22 C ATOM 1661 CG ARG A 117 19.764 -24.509 20.877 1.00 50.44 C ATOM 1662 CD ARG A 117 18.829 -24.181 19.723 1.00 14.54 C ATOM 1663 NE ARG A 117 19.238 -24.835 18.484 1.00 51.04 N ATOM 1664 CZ ARG A 117 18.568 -24.729 17.341 1.00 24.21 C ATOM 1665 NH1 ARG A 117 17.464 -23.999 17.281 1.00 13.44 N ATOM 1666 NH2 ARG A 117 19.004 -25.355 16.255 1.00 2.30 N ATOM 0 H ARG A 117 22.983 -22.309 21.413 1.00 2.31 H new ATOM 0 HA ARG A 117 20.683 -21.990 19.679 1.00 4.41 H new ATOM 0 HB2 ARG A 117 21.580 -24.180 19.794 1.00 34.22 H new ATOM 0 HB3 ARG A 117 21.762 -24.119 21.536 1.00 34.22 H new ATOM 0 HG2 ARG A 117 19.907 -25.588 20.936 1.00 50.44 H new ATOM 0 HG3 ARG A 117 19.308 -24.196 21.816 1.00 50.44 H new ATOM 0 HD2 ARG A 117 17.816 -24.490 19.979 1.00 14.54 H new ATOM 0 HD3 ARG A 117 18.804 -23.102 19.572 1.00 14.54 H new ATOM 0 HE ARG A 117 20.084 -25.404 18.496 1.00 51.04 H new ATOM 0 HH11 ARG A 117 17.126 -23.516 18.114 1.00 13.44 H new ATOM 0 HH12 ARG A 117 16.952 -23.920 16.402 1.00 13.44 H new ATOM 0 HH21 ARG A 117 19.854 -25.918 16.297 1.00 2.30 H new ATOM 0 HH22 ARG A 117 18.489 -25.273 15.378 1.00 2.30 H new ATOM 1680 N ILE A 118 20.518 -21.392 22.860 1.00 14.51 N ATOM 1681 CA ILE A 118 19.661 -20.897 23.931 1.00 71.13 C ATOM 1682 C ILE A 118 18.735 -19.795 23.429 1.00 53.42 C ATOM 1683 O ILE A 118 17.675 -19.548 24.006 1.00 31.13 O ATOM 1684 CB ILE A 118 20.490 -20.358 25.111 1.00 12.34 C ATOM 1685 CG1 ILE A 118 21.476 -21.422 25.599 1.00 55.41 C ATOM 1686 CG2 ILE A 118 19.574 -19.917 26.244 1.00 63.41 C ATOM 1687 CD1 ILE A 118 20.822 -22.746 25.928 1.00 51.53 C ATOM 0 H ILE A 118 21.514 -21.389 23.081 1.00 14.51 H new ATOM 0 HA ILE A 118 19.064 -21.742 24.273 1.00 71.13 H new ATOM 0 HB ILE A 118 21.058 -19.492 24.771 1.00 12.34 H new ATOM 0 HG12 ILE A 118 22.235 -21.581 24.833 1.00 55.41 H new ATOM 0 HG13 ILE A 118 21.991 -21.050 26.485 1.00 55.41 H new ATOM 0 HG21 ILE A 118 20.175 -19.538 27.071 1.00 63.41 H new ATOM 0 HG22 ILE A 118 18.909 -19.130 25.889 1.00 63.41 H new ATOM 0 HG23 ILE A 118 18.982 -20.766 26.585 1.00 63.41 H new ATOM 0 HD11 ILE A 118 21.580 -23.452 26.267 1.00 51.53 H new ATOM 0 HD12 ILE A 118 20.083 -22.601 26.716 1.00 51.53 H new ATOM 0 HD13 ILE A 118 20.331 -23.140 25.038 1.00 51.53 H new ATOM 1699 N LEU A 119 19.140 -19.135 22.349 1.00 0.14 N ATOM 1700 CA LEU A 119 18.346 -18.059 21.767 1.00 14.21 C ATOM 1701 C LEU A 119 17.454 -18.585 20.646 1.00 4.15 C ATOM 1702 O LEU A 119 17.162 -17.872 19.686 1.00 33.40 O ATOM 1703 CB LEU A 119 19.260 -16.956 21.232 1.00 51.53 C ATOM 1704 CG LEU A 119 20.332 -16.445 22.196 1.00 75.23 C ATOM 1705 CD1 LEU A 119 21.070 -15.260 21.594 1.00 63.13 C ATOM 1706 CD2 LEU A 119 19.710 -16.066 23.532 1.00 52.32 C ATOM 0 H LEU A 119 20.014 -19.326 21.859 1.00 0.14 H new ATOM 0 HA LEU A 119 17.709 -17.647 22.550 1.00 14.21 H new ATOM 0 HB2 LEU A 119 19.754 -17.326 20.334 1.00 51.53 H new ATOM 0 HB3 LEU A 119 18.639 -16.112 20.930 1.00 51.53 H new ATOM 0 HG LEU A 119 21.052 -17.246 22.367 1.00 75.23 H new ATOM 0 HD11 LEU A 119 21.829 -14.910 22.294 1.00 63.13 H new ATOM 0 HD12 LEU A 119 21.548 -15.564 20.663 1.00 63.13 H new ATOM 0 HD13 LEU A 119 20.363 -14.455 21.393 1.00 63.13 H new ATOM 0 HD21 LEU A 119 20.487 -15.705 24.206 1.00 52.32 H new ATOM 0 HD22 LEU A 119 18.969 -15.282 23.379 1.00 52.32 H new ATOM 0 HD23 LEU A 119 19.228 -16.940 23.970 1.00 52.32 H new ATOM 1718 N TYR A 120 17.025 -19.835 20.777 1.00 32.01 N ATOM 1719 CA TYR A 120 16.167 -20.457 19.775 1.00 12.15 C ATOM 1720 C TYR A 120 15.037 -19.517 19.367 1.00 34.00 C ATOM 1721 O TYR A 120 14.655 -19.458 18.199 1.00 61.00 O ATOM 1722 CB TYR A 120 15.587 -21.767 20.312 1.00 1.43 C ATOM 1723 CG TYR A 120 15.377 -21.767 21.810 1.00 52.14 C ATOM 1724 CD1 TYR A 120 14.321 -21.068 22.383 1.00 61.24 C ATOM 1725 CD2 TYR A 120 16.234 -22.465 22.651 1.00 12.34 C ATOM 1726 CE1 TYR A 120 14.125 -21.065 23.750 1.00 2.11 C ATOM 1727 CE2 TYR A 120 16.045 -22.468 24.020 1.00 72.32 C ATOM 1728 CZ TYR A 120 14.989 -21.767 24.564 1.00 4.24 C ATOM 1729 OH TYR A 120 14.799 -21.767 25.927 1.00 15.32 O ATOM 0 H TYR A 120 17.257 -20.438 21.567 1.00 32.01 H new ATOM 0 HA TYR A 120 16.774 -20.670 18.895 1.00 12.15 H new ATOM 0 HB2 TYR A 120 14.634 -21.961 19.820 1.00 1.43 H new ATOM 0 HB3 TYR A 120 16.255 -22.586 20.047 1.00 1.43 H new ATOM 0 HD1 TYR A 120 13.642 -20.518 21.748 1.00 61.24 H new ATOM 0 HD2 TYR A 120 17.062 -23.015 22.228 1.00 12.34 H new ATOM 0 HE1 TYR A 120 13.300 -20.516 24.179 1.00 2.11 H new ATOM 0 HE2 TYR A 120 16.720 -23.016 24.660 1.00 72.32 H new ATOM 0 HH TYR A 120 15.494 -22.310 26.354 1.00 15.32 H new ATOM 1739 N ASN A 121 14.506 -18.783 20.339 1.00 13.15 N ATOM 1740 CA ASN A 121 13.419 -17.845 20.083 1.00 51.13 C ATOM 1741 C ASN A 121 12.950 -17.188 21.377 1.00 2.33 C ATOM 1742 O ASN A 121 11.762 -17.202 21.700 1.00 72.40 O ATOM 1743 CB ASN A 121 12.247 -18.562 19.408 1.00 5.42 C ATOM 1744 CG ASN A 121 11.944 -19.902 20.049 1.00 71.33 C ATOM 1745 OD1 ASN A 121 12.215 -20.955 19.470 1.00 14.30 O ATOM 1746 ND2 ASN A 121 11.378 -19.870 21.250 1.00 43.53 N ATOM 0 H ASN A 121 14.811 -18.820 21.312 1.00 13.15 H new ATOM 0 HA ASN A 121 13.793 -17.067 19.417 1.00 51.13 H new ATOM 0 HB2 ASN A 121 11.360 -17.930 19.457 1.00 5.42 H new ATOM 0 HB3 ASN A 121 12.474 -18.710 18.352 1.00 5.42 H new ATOM 0 HD21 ASN A 121 11.150 -20.741 21.730 1.00 43.53 H new ATOM 0 HD22 ASN A 121 11.171 -18.975 21.693 1.00 43.53 H new ATOM 1753 N THR A 122 13.892 -16.610 22.117 1.00 65.35 N ATOM 1754 CA THR A 122 13.577 -15.948 23.376 1.00 62.11 C ATOM 1755 C THR A 122 14.144 -14.534 23.410 1.00 3.44 C ATOM 1756 O THR A 122 15.078 -14.209 22.675 1.00 33.05 O ATOM 1757 CB THR A 122 14.126 -16.738 24.579 1.00 72.51 C ATOM 1758 OG1 THR A 122 14.079 -15.929 25.759 1.00 34.33 O ATOM 1759 CG2 THR A 122 15.556 -17.189 24.324 1.00 42.24 C ATOM 0 H THR A 122 14.880 -16.588 21.865 1.00 65.35 H new ATOM 0 HA THR A 122 12.490 -15.903 23.446 1.00 62.11 H new ATOM 0 HB THR A 122 13.503 -17.621 24.720 1.00 72.51 H new ATOM 0 HG1 THR A 122 14.428 -16.439 26.519 1.00 34.33 H new ATOM 0 HG21 THR A 122 15.922 -17.745 25.187 1.00 42.24 H new ATOM 0 HG22 THR A 122 15.584 -17.829 23.442 1.00 42.24 H new ATOM 0 HG23 THR A 122 16.189 -16.317 24.159 1.00 42.24 H new ATOM 1767 N THR A 123 13.575 -13.694 24.270 1.00 43.55 N ATOM 1768 CA THR A 123 14.024 -12.313 24.400 1.00 60.04 C ATOM 1769 C THR A 123 15.161 -12.197 25.409 1.00 74.12 C ATOM 1770 O THR A 123 15.118 -11.363 26.313 1.00 22.15 O ATOM 1771 CB THR A 123 12.872 -11.386 24.832 1.00 21.30 C ATOM 1772 OG1 THR A 123 13.348 -10.042 24.962 1.00 14.14 O ATOM 1773 CG2 THR A 123 12.273 -11.848 26.152 1.00 54.22 C ATOM 0 H THR A 123 12.803 -13.946 24.887 1.00 43.55 H new ATOM 0 HA THR A 123 14.381 -12.003 23.418 1.00 60.04 H new ATOM 0 HB THR A 123 12.097 -11.424 24.067 1.00 21.30 H new ATOM 0 HG1 THR A 123 14.088 -10.018 25.604 1.00 14.14 H new ATOM 0 HG21 THR A 123 11.461 -11.179 26.437 1.00 54.22 H new ATOM 0 HG22 THR A 123 11.886 -12.861 26.041 1.00 54.22 H new ATOM 0 HG23 THR A 123 13.042 -11.836 26.924 1.00 54.22 H new ATOM 1781 N PHE A 124 16.177 -13.038 25.248 1.00 73.22 N ATOM 1782 CA PHE A 124 17.326 -13.030 26.146 1.00 54.02 C ATOM 1783 C PHE A 124 18.379 -12.033 25.672 1.00 10.32 C ATOM 1784 O PHE A 124 19.083 -11.425 26.480 1.00 74.34 O ATOM 1785 CB PHE A 124 17.937 -14.429 26.239 1.00 63.43 C ATOM 1786 CG PHE A 124 18.940 -14.573 27.348 1.00 71.02 C ATOM 1787 CD1 PHE A 124 18.655 -14.107 28.621 1.00 23.23 C ATOM 1788 CD2 PHE A 124 20.167 -15.174 27.117 1.00 34.31 C ATOM 1789 CE1 PHE A 124 19.576 -14.237 29.643 1.00 24.44 C ATOM 1790 CE2 PHE A 124 21.092 -15.308 28.135 1.00 13.25 C ATOM 1791 CZ PHE A 124 20.796 -14.840 29.401 1.00 54.55 C ATOM 0 H PHE A 124 16.228 -13.734 24.504 1.00 73.22 H new ATOM 0 HA PHE A 124 16.981 -12.726 27.134 1.00 54.02 H new ATOM 0 HB2 PHE A 124 17.139 -15.156 26.385 1.00 63.43 H new ATOM 0 HB3 PHE A 124 18.418 -14.670 25.291 1.00 63.43 H new ATOM 0 HD1 PHE A 124 17.703 -13.637 28.817 1.00 23.23 H new ATOM 0 HD2 PHE A 124 20.403 -15.542 26.130 1.00 34.31 H new ATOM 0 HE1 PHE A 124 19.343 -13.868 30.631 1.00 24.44 H new ATOM 0 HE2 PHE A 124 22.045 -15.778 27.941 1.00 13.25 H new ATOM 0 HZ PHE A 124 21.516 -14.945 30.199 1.00 54.55 H new ATOM 1801 N PHE A 125 18.482 -11.870 24.357 1.00 11.23 N ATOM 1802 CA PHE A 125 19.450 -10.948 23.775 1.00 51.23 C ATOM 1803 C PHE A 125 18.998 -10.487 22.392 1.00 0.11 C ATOM 1804 O PHE A 125 19.603 -10.816 21.372 1.00 44.44 O ATOM 1805 CB PHE A 125 20.825 -11.612 23.679 1.00 30.01 C ATOM 1806 CG PHE A 125 21.558 -11.665 24.989 1.00 15.12 C ATOM 1807 CD1 PHE A 125 21.782 -10.509 25.720 1.00 71.32 C ATOM 1808 CD2 PHE A 125 22.022 -12.870 25.490 1.00 63.51 C ATOM 1809 CE1 PHE A 125 22.455 -10.555 26.926 1.00 4.51 C ATOM 1810 CE2 PHE A 125 22.696 -12.922 26.696 1.00 51.14 C ATOM 1811 CZ PHE A 125 22.914 -11.762 27.414 1.00 72.50 C ATOM 0 H PHE A 125 17.907 -12.364 23.675 1.00 11.23 H new ATOM 0 HA PHE A 125 19.520 -10.076 24.425 1.00 51.23 H new ATOM 0 HB2 PHE A 125 20.704 -12.626 23.298 1.00 30.01 H new ATOM 0 HB3 PHE A 125 21.432 -11.070 22.954 1.00 30.01 H new ATOM 0 HD1 PHE A 125 21.427 -9.562 25.343 1.00 71.32 H new ATOM 0 HD2 PHE A 125 21.855 -13.780 24.932 1.00 63.51 H new ATOM 0 HE1 PHE A 125 22.622 -9.647 27.487 1.00 4.51 H new ATOM 0 HE2 PHE A 125 23.052 -13.868 27.076 1.00 51.14 H new ATOM 0 HZ PHE A 125 23.442 -11.799 28.355 1.00 72.50 H new ATOM 1821 N PRO A 126 17.907 -9.707 22.356 1.00 3.02 N ATOM 1822 CA PRO A 126 17.349 -9.184 21.106 1.00 41.22 C ATOM 1823 C PRO A 126 18.245 -8.128 20.468 1.00 43.30 C ATOM 1824 O PRO A 126 18.506 -8.164 19.265 1.00 10.42 O ATOM 1825 CB PRO A 126 16.020 -8.564 21.543 1.00 54.31 C ATOM 1826 CG PRO A 126 16.215 -8.223 22.980 1.00 32.20 C ATOM 1827 CD PRO A 126 17.135 -9.275 23.534 1.00 64.54 C ATOM 0 HA PRO A 126 17.244 -9.962 20.350 1.00 41.22 H new ATOM 0 HB2 PRO A 126 15.784 -7.677 20.954 1.00 54.31 H new ATOM 0 HB3 PRO A 126 15.194 -9.263 21.411 1.00 54.31 H new ATOM 0 HG2 PRO A 126 16.648 -7.229 23.090 1.00 32.20 H new ATOM 0 HG3 PRO A 126 15.264 -8.217 23.512 1.00 32.20 H new ATOM 0 HD2 PRO A 126 17.782 -8.873 24.313 1.00 64.54 H new ATOM 0 HD3 PRO A 126 16.580 -10.102 23.976 1.00 64.54 H new ATOM 1835 N LYS A 127 18.715 -7.188 21.281 1.00 0.31 N ATOM 1836 CA LYS A 127 19.584 -6.121 20.798 1.00 60.45 C ATOM 1837 C LYS A 127 20.759 -6.692 20.010 1.00 71.22 C ATOM 1838 O LYS A 127 21.183 -6.119 19.006 1.00 4.03 O ATOM 1839 CB LYS A 127 20.101 -5.285 21.970 1.00 32.24 C ATOM 1840 CG LYS A 127 20.581 -6.118 23.146 1.00 24.11 C ATOM 1841 CD LYS A 127 21.991 -5.733 23.563 1.00 12.03 C ATOM 1842 CE LYS A 127 23.007 -6.774 23.121 1.00 63.24 C ATOM 1843 NZ LYS A 127 24.380 -6.446 23.596 1.00 61.35 N ATOM 0 H LYS A 127 18.508 -7.143 22.279 1.00 0.31 H new ATOM 0 HA LYS A 127 19.000 -5.483 20.135 1.00 60.45 H new ATOM 0 HB2 LYS A 127 20.920 -4.656 21.623 1.00 32.24 H new ATOM 0 HB3 LYS A 127 19.308 -4.618 22.308 1.00 32.24 H new ATOM 0 HG2 LYS A 127 19.902 -5.985 23.988 1.00 24.11 H new ATOM 0 HG3 LYS A 127 20.555 -7.175 22.879 1.00 24.11 H new ATOM 0 HD2 LYS A 127 22.248 -4.766 23.131 1.00 12.03 H new ATOM 0 HD3 LYS A 127 22.033 -5.619 24.646 1.00 12.03 H new ATOM 0 HE2 LYS A 127 22.715 -7.752 23.503 1.00 63.24 H new ATOM 0 HE3 LYS A 127 23.006 -6.843 22.033 1.00 63.24 H new ATOM 0 HZ1 LYS A 127 25.076 -6.757 22.888 1.00 61.35 H new ATOM 0 HZ2 LYS A 127 24.463 -5.419 23.735 1.00 61.35 H new ATOM 0 HZ3 LYS A 127 24.561 -6.933 24.497 1.00 61.35 H new ATOM 1857 N PHE A 128 21.279 -7.825 20.470 1.00 64.10 N ATOM 1858 CA PHE A 128 22.405 -8.474 19.808 1.00 41.33 C ATOM 1859 C PHE A 128 21.924 -9.371 18.671 1.00 21.13 C ATOM 1860 O PHE A 128 22.519 -9.399 17.593 1.00 73.51 O ATOM 1861 CB PHE A 128 23.212 -9.295 20.815 1.00 62.50 C ATOM 1862 CG PHE A 128 23.678 -10.617 20.274 1.00 2.10 C ATOM 1863 CD1 PHE A 128 24.786 -10.689 19.446 1.00 64.35 C ATOM 1864 CD2 PHE A 128 23.008 -11.787 20.594 1.00 53.44 C ATOM 1865 CE1 PHE A 128 25.218 -11.904 18.946 1.00 2.23 C ATOM 1866 CE2 PHE A 128 23.435 -13.004 20.098 1.00 41.22 C ATOM 1867 CZ PHE A 128 24.541 -13.062 19.272 1.00 31.41 C ATOM 0 H PHE A 128 20.939 -8.313 21.299 1.00 64.10 H new ATOM 0 HA PHE A 128 23.044 -7.697 19.388 1.00 41.33 H new ATOM 0 HB2 PHE A 128 24.079 -8.715 21.133 1.00 62.50 H new ATOM 0 HB3 PHE A 128 22.602 -9.469 21.702 1.00 62.50 H new ATOM 0 HD1 PHE A 128 25.319 -9.786 19.188 1.00 64.35 H new ATOM 0 HD2 PHE A 128 22.142 -11.747 21.238 1.00 53.44 H new ATOM 0 HE1 PHE A 128 26.084 -11.947 18.302 1.00 2.23 H new ATOM 0 HE2 PHE A 128 22.905 -13.909 20.356 1.00 41.22 H new ATOM 0 HZ PHE A 128 24.875 -14.012 18.882 1.00 31.41 H new ATOM 1877 N LEU A 129 20.844 -10.103 18.921 1.00 62.53 N ATOM 1878 CA LEU A 129 20.282 -11.003 17.919 1.00 20.35 C ATOM 1879 C LEU A 129 19.770 -10.223 16.713 1.00 73.41 C ATOM 1880 O LEU A 129 20.357 -10.276 15.632 1.00 3.13 O ATOM 1881 CB LEU A 129 19.147 -11.829 18.527 1.00 14.22 C ATOM 1882 CG LEU A 129 19.568 -13.046 19.351 1.00 2.45 C ATOM 1883 CD1 LEU A 129 18.349 -13.749 19.928 1.00 52.44 C ATOM 1884 CD2 LEU A 129 20.389 -14.006 18.503 1.00 34.31 C ATOM 0 H LEU A 129 20.340 -10.091 19.808 1.00 62.53 H new ATOM 0 HA LEU A 129 21.073 -11.675 17.584 1.00 20.35 H new ATOM 0 HB2 LEU A 129 18.549 -11.175 19.162 1.00 14.22 H new ATOM 0 HB3 LEU A 129 18.499 -12.169 17.719 1.00 14.22 H new ATOM 0 HG LEU A 129 20.188 -12.703 20.179 1.00 2.45 H new ATOM 0 HD11 LEU A 129 18.669 -14.612 20.511 1.00 52.44 H new ATOM 0 HD12 LEU A 129 17.802 -13.060 20.571 1.00 52.44 H new ATOM 0 HD13 LEU A 129 17.701 -14.079 19.116 1.00 52.44 H new ATOM 0 HD21 LEU A 129 20.680 -14.866 19.106 1.00 34.31 H new ATOM 0 HD22 LEU A 129 19.793 -14.342 17.654 1.00 34.31 H new ATOM 0 HD23 LEU A 129 21.283 -13.498 18.140 1.00 34.31 H new ATOM 1896 N ARG A 130 18.672 -9.499 16.906 1.00 62.15 N ATOM 1897 CA ARG A 130 18.081 -8.707 15.833 1.00 24.34 C ATOM 1898 C ARG A 130 17.878 -9.554 14.581 1.00 61.35 C ATOM 1899 O ARG A 130 17.918 -9.045 13.460 1.00 14.43 O ATOM 1900 CB ARG A 130 18.969 -7.504 15.510 1.00 25.41 C ATOM 1901 CG ARG A 130 19.282 -6.636 16.718 1.00 50.03 C ATOM 1902 CD ARG A 130 18.015 -6.066 17.337 1.00 43.02 C ATOM 1903 NE ARG A 130 17.413 -5.033 16.498 1.00 4.23 N ATOM 1904 CZ ARG A 130 17.789 -3.759 16.518 1.00 2.11 C ATOM 1905 NH1 ARG A 130 18.761 -3.363 17.329 1.00 33.41 N ATOM 1906 NH2 ARG A 130 17.193 -2.878 15.725 1.00 3.30 N ATOM 0 H ARG A 130 18.174 -9.444 17.794 1.00 62.15 H new ATOM 0 HA ARG A 130 17.108 -8.351 16.171 1.00 24.34 H new ATOM 0 HB2 ARG A 130 19.904 -7.859 15.076 1.00 25.41 H new ATOM 0 HB3 ARG A 130 18.478 -6.894 14.752 1.00 25.41 H new ATOM 0 HG2 ARG A 130 19.818 -7.225 17.462 1.00 50.03 H new ATOM 0 HG3 ARG A 130 19.942 -5.821 16.421 1.00 50.03 H new ATOM 0 HD2 ARG A 130 17.296 -6.869 17.495 1.00 43.02 H new ATOM 0 HD3 ARG A 130 18.246 -5.648 18.317 1.00 43.02 H new ATOM 0 HE ARG A 130 16.663 -5.305 15.862 1.00 4.23 H new ATOM 0 HH11 ARG A 130 19.222 -4.037 17.940 1.00 33.41 H new ATOM 0 HH12 ARG A 130 19.047 -2.384 17.342 1.00 33.41 H new ATOM 0 HH21 ARG A 130 16.446 -3.179 15.099 1.00 3.30 H new ATOM 0 HH22 ARG A 130 17.482 -1.900 15.741 1.00 3.30 H new ATOM 1920 N CYS A 131 17.661 -10.850 14.778 1.00 70.43 N ATOM 1921 CA CYS A 131 17.452 -11.769 13.665 1.00 24.22 C ATOM 1922 C CYS A 131 16.170 -12.574 13.858 1.00 65.33 C ATOM 1923 O CYS A 131 15.869 -13.026 14.961 1.00 22.25 O ATOM 1924 CB CYS A 131 18.646 -12.716 13.528 1.00 44.14 C ATOM 1925 SG CYS A 131 18.270 -14.264 12.644 1.00 42.44 S ATOM 0 H CYS A 131 17.625 -11.288 15.699 1.00 70.43 H new ATOM 0 HA CYS A 131 17.357 -11.180 12.753 1.00 24.22 H new ATOM 0 HB2 CYS A 131 19.449 -12.197 13.005 1.00 44.14 H new ATOM 0 HB3 CYS A 131 19.019 -12.960 14.523 1.00 44.14 H new ATOM 1930 N ASN A 132 15.420 -12.749 12.775 1.00 60.32 N ATOM 1931 CA ASN A 132 14.170 -13.500 12.824 1.00 43.50 C ATOM 1932 C ASN A 132 14.436 -15.001 12.784 1.00 34.42 C ATOM 1933 O ASN A 132 15.187 -15.486 11.939 1.00 71.31 O ATOM 1934 CB ASN A 132 13.265 -13.099 11.658 1.00 73.24 C ATOM 1935 CG ASN A 132 14.048 -12.794 10.396 1.00 42.14 C ATOM 1936 OD1 ASN A 132 14.022 -11.671 9.892 1.00 42.21 O ATOM 1937 ND2 ASN A 132 14.750 -13.795 9.878 1.00 21.53 N ATOM 0 H ASN A 132 15.655 -12.381 11.853 1.00 60.32 H new ATOM 0 HA ASN A 132 13.668 -13.263 13.762 1.00 43.50 H new ATOM 0 HB2 ASN A 132 12.557 -13.904 11.458 1.00 73.24 H new ATOM 0 HB3 ASN A 132 12.680 -12.223 11.940 1.00 73.24 H new ATOM 0 HD21 ASN A 132 15.296 -13.649 9.029 1.00 21.53 H new ATOM 0 HD22 ASN A 132 14.743 -14.710 10.329 1.00 21.53 H new ATOM 1944 N GLU A 133 13.813 -15.732 13.704 1.00 14.50 N ATOM 1945 CA GLU A 133 13.982 -17.178 13.774 1.00 70.25 C ATOM 1946 C GLU A 133 12.629 -17.883 13.812 1.00 61.22 C ATOM 1947 O GLU A 133 12.447 -18.937 13.200 1.00 11.44 O ATOM 1948 CB GLU A 133 14.803 -17.559 15.007 1.00 30.13 C ATOM 1949 CG GLU A 133 14.406 -16.798 16.261 1.00 30.52 C ATOM 1950 CD GLU A 133 15.467 -15.811 16.705 1.00 44.30 C ATOM 1951 OE1 GLU A 133 16.664 -16.168 16.663 1.00 14.44 O ATOM 1952 OE2 GLU A 133 15.103 -14.682 17.094 1.00 54.42 O ATOM 0 H GLU A 133 13.187 -15.346 14.411 1.00 14.50 H new ATOM 0 HA GLU A 133 14.514 -17.499 12.879 1.00 70.25 H new ATOM 0 HB2 GLU A 133 14.693 -18.628 15.191 1.00 30.13 H new ATOM 0 HB3 GLU A 133 15.858 -17.378 14.801 1.00 30.13 H new ATOM 0 HG2 GLU A 133 13.473 -16.265 16.078 1.00 30.52 H new ATOM 0 HG3 GLU A 133 14.215 -17.507 17.067 1.00 30.52 H new ATOM 1959 N THR A 134 11.682 -17.295 14.535 1.00 12.45 N ATOM 1960 CA THR A 134 10.346 -17.866 14.656 1.00 44.41 C ATOM 1961 C THR A 134 9.728 -18.112 13.285 1.00 40.15 C ATOM 1962 O THR A 134 8.871 -18.982 13.126 1.00 55.11 O ATOM 1963 CB THR A 134 9.414 -16.948 15.469 1.00 3.05 C ATOM 1964 OG1 THR A 134 9.293 -15.676 14.823 1.00 3.24 O ATOM 1965 CG2 THR A 134 9.943 -16.756 16.883 1.00 35.41 C ATOM 0 H THR A 134 11.815 -16.423 15.046 1.00 12.45 H new ATOM 0 HA THR A 134 10.454 -18.816 15.179 1.00 44.41 H new ATOM 0 HB THR A 134 8.433 -17.421 15.525 1.00 3.05 H new ATOM 0 HG1 THR A 134 8.697 -15.099 15.345 1.00 3.24 H new ATOM 0 HG21 THR A 134 9.269 -16.104 17.438 1.00 35.41 H new ATOM 0 HG22 THR A 134 10.006 -17.723 17.382 1.00 35.41 H new ATOM 0 HG23 THR A 134 10.934 -16.303 16.842 1.00 35.41 H new ATOM 1973 N LEU A 135 10.168 -17.342 12.296 1.00 40.15 N ATOM 1974 CA LEU A 135 9.658 -17.477 10.936 1.00 72.35 C ATOM 1975 C LEU A 135 10.682 -18.160 10.035 1.00 44.30 C ATOM 1976 O LEU A 135 11.851 -18.295 10.398 1.00 21.20 O ATOM 1977 CB LEU A 135 9.296 -16.104 10.366 1.00 21.25 C ATOM 1978 CG LEU A 135 10.472 -15.216 9.958 1.00 72.13 C ATOM 1979 CD1 LEU A 135 10.704 -15.295 8.457 1.00 61.41 C ATOM 1980 CD2 LEU A 135 10.227 -13.777 10.386 1.00 11.40 C ATOM 0 H LEU A 135 10.877 -16.618 12.410 1.00 40.15 H new ATOM 0 HA LEU A 135 8.762 -18.096 10.971 1.00 72.35 H new ATOM 0 HB2 LEU A 135 8.658 -16.251 9.494 1.00 21.25 H new ATOM 0 HB3 LEU A 135 8.703 -15.569 11.108 1.00 21.25 H new ATOM 0 HG LEU A 135 11.368 -15.577 10.463 1.00 72.13 H new ATOM 0 HD11 LEU A 135 11.545 -14.657 8.185 1.00 61.41 H new ATOM 0 HD12 LEU A 135 10.925 -16.325 8.177 1.00 61.41 H new ATOM 0 HD13 LEU A 135 9.809 -14.960 7.932 1.00 61.41 H new ATOM 0 HD21 LEU A 135 11.074 -13.159 10.087 1.00 11.40 H new ATOM 0 HD22 LEU A 135 9.320 -13.405 9.909 1.00 11.40 H new ATOM 0 HD23 LEU A 135 10.111 -13.734 11.469 1.00 11.40 H new ATOM 1992 N PHE A 136 10.237 -18.586 8.858 1.00 71.12 N ATOM 1993 CA PHE A 136 11.115 -19.253 7.904 1.00 23.51 C ATOM 1994 C PHE A 136 11.199 -18.467 6.599 1.00 32.11 C ATOM 1995 O PHE A 136 10.379 -18.628 5.695 1.00 42.45 O ATOM 1996 CB PHE A 136 10.617 -20.673 7.626 1.00 33.11 C ATOM 1997 CG PHE A 136 11.195 -21.704 8.553 1.00 15.35 C ATOM 1998 CD1 PHE A 136 11.138 -21.529 9.927 1.00 53.42 C ATOM 1999 CD2 PHE A 136 11.794 -22.848 8.052 1.00 50.30 C ATOM 2000 CE1 PHE A 136 11.669 -22.475 10.782 1.00 24.11 C ATOM 2001 CE2 PHE A 136 12.327 -23.798 8.903 1.00 41.05 C ATOM 2002 CZ PHE A 136 12.264 -23.612 10.270 1.00 53.35 C ATOM 0 H PHE A 136 9.273 -18.481 8.542 1.00 71.12 H new ATOM 0 HA PHE A 136 12.112 -19.304 8.341 1.00 23.51 H new ATOM 0 HB2 PHE A 136 9.530 -20.691 7.708 1.00 33.11 H new ATOM 0 HB3 PHE A 136 10.863 -20.941 6.599 1.00 33.11 H new ATOM 0 HD1 PHE A 136 10.673 -20.643 10.334 1.00 53.42 H new ATOM 0 HD2 PHE A 136 11.845 -23.000 6.984 1.00 50.30 H new ATOM 0 HE1 PHE A 136 11.619 -22.326 11.850 1.00 24.11 H new ATOM 0 HE2 PHE A 136 12.792 -24.685 8.499 1.00 41.05 H new ATOM 0 HZ PHE A 136 12.679 -24.353 10.937 1.00 53.35 H new ATOM 2012 N PRO A 137 12.213 -17.595 6.498 1.00 30.03 N ATOM 2013 CA PRO A 137 12.429 -16.766 5.309 1.00 53.21 C ATOM 2014 C PRO A 137 12.884 -17.585 4.106 1.00 3.21 C ATOM 2015 O PRO A 137 12.311 -17.485 3.020 1.00 23.44 O ATOM 2016 CB PRO A 137 13.532 -15.799 5.746 1.00 13.31 C ATOM 2017 CG PRO A 137 14.259 -16.518 6.829 1.00 70.10 C ATOM 2018 CD PRO A 137 13.227 -17.352 7.538 1.00 45.15 C ATOM 0 HA PRO A 137 11.513 -16.271 4.986 1.00 53.21 H new ATOM 0 HB2 PRO A 137 14.197 -15.556 4.917 1.00 13.31 H new ATOM 0 HB3 PRO A 137 13.114 -14.859 6.106 1.00 13.31 H new ATOM 0 HG2 PRO A 137 15.051 -17.144 6.418 1.00 70.10 H new ATOM 0 HG3 PRO A 137 14.731 -15.815 7.515 1.00 70.10 H new ATOM 0 HD2 PRO A 137 13.651 -18.284 7.912 1.00 45.15 H new ATOM 0 HD3 PRO A 137 12.806 -16.827 8.395 1.00 45.15 H new ATOM 2026 N THR A 138 13.919 -18.396 4.305 1.00 11.44 N ATOM 2027 CA THR A 138 14.452 -19.232 3.237 1.00 12.51 C ATOM 2028 C THR A 138 14.607 -18.439 1.944 1.00 12.12 C ATOM 2029 O THR A 138 13.699 -18.403 1.113 1.00 2.11 O ATOM 2030 CB THR A 138 13.548 -20.450 2.973 1.00 32.44 C ATOM 2031 OG1 THR A 138 12.252 -20.016 2.546 1.00 31.04 O ATOM 2032 CG2 THR A 138 13.415 -21.306 4.224 1.00 34.12 C ATOM 0 H THR A 138 14.405 -18.491 5.197 1.00 11.44 H new ATOM 0 HA THR A 138 15.431 -19.580 3.567 1.00 12.51 H new ATOM 0 HB THR A 138 14.006 -21.051 2.187 1.00 32.44 H new ATOM 0 HG1 THR A 138 12.313 -19.106 2.188 1.00 31.04 H new ATOM 0 HG21 THR A 138 12.772 -22.161 4.013 1.00 34.12 H new ATOM 0 HG22 THR A 138 14.400 -21.660 4.529 1.00 34.12 H new ATOM 0 HG23 THR A 138 12.978 -20.712 5.027 1.00 34.12 H new ATOM 2040 N LYS A 139 15.763 -17.805 1.780 1.00 53.35 N ATOM 2041 CA LYS A 139 16.039 -17.013 0.586 1.00 35.43 C ATOM 2042 C LYS A 139 15.755 -17.819 -0.678 1.00 3.51 C ATOM 2043 O LYS A 139 15.461 -17.254 -1.732 1.00 63.30 O ATOM 2044 CB LYS A 139 17.494 -16.541 0.588 1.00 63.44 C ATOM 2045 CG LYS A 139 18.487 -17.631 0.222 1.00 43.11 C ATOM 2046 CD LYS A 139 18.793 -17.630 -1.267 1.00 3.25 C ATOM 2047 CE LYS A 139 18.609 -19.012 -1.874 1.00 42.24 C ATOM 2048 NZ LYS A 139 18.319 -18.942 -3.333 1.00 42.14 N ATOM 0 H LYS A 139 16.524 -17.824 2.459 1.00 53.35 H new ATOM 0 HA LYS A 139 15.382 -16.143 0.596 1.00 35.43 H new ATOM 0 HB2 LYS A 139 17.600 -15.714 -0.114 1.00 63.44 H new ATOM 0 HB3 LYS A 139 17.740 -16.154 1.577 1.00 63.44 H new ATOM 0 HG2 LYS A 139 19.410 -17.487 0.784 1.00 43.11 H new ATOM 0 HG3 LYS A 139 18.086 -18.602 0.511 1.00 43.11 H new ATOM 0 HD2 LYS A 139 18.140 -16.919 -1.773 1.00 3.25 H new ATOM 0 HD3 LYS A 139 19.817 -17.294 -1.429 1.00 3.25 H new ATOM 0 HE2 LYS A 139 19.510 -19.603 -1.711 1.00 42.24 H new ATOM 0 HE3 LYS A 139 17.793 -19.526 -1.366 1.00 42.24 H new ATOM 0 HZ1 LYS A 139 18.200 -19.904 -3.710 1.00 42.14 H new ATOM 0 HZ2 LYS A 139 17.446 -18.399 -3.488 1.00 42.14 H new ATOM 0 HZ3 LYS A 139 19.109 -18.474 -3.822 1.00 42.14 H new TER 2062 LYS A 139