USER MOD reduce.3.24.130724 H: found=0, std=0, add=666, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 666 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: T 69 SER OG : rot 107:sc= 0.677 USER MOD Set 1.2: T 71 THR OG1 : rot 180:sc= 0.606 USER MOD Single : T 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : T 1 MET N :NH3+ -155:sc= -0.126 (180deg=-0.93) USER MOD Single : T 5 TYR OH : rot 180:sc= 0 USER MOD Single : T 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : T 11 GLN : amide:sc= -0.0268 K(o=-0.027,f=-0.74) USER MOD Single : T 13 THR OG1 : rot 180:sc= 0 USER MOD Single : T 16 GLN : amide:sc= -8.69! C(o=-8.7!,f=-17!) USER MOD Single : T 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : T 18 ASN : amide:sc= -4.41! K(o=-4.4!,f=-1.1) USER MOD Single : T 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : T 35 SER OG : rot 180:sc= 0 USER MOD Single : T 37 SER OG : rot 72:sc= -0.441 USER MOD Single : T 38 THR OG1 : rot 180:sc= 0 USER MOD Single : T 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : T 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : T 45 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : T 47 MET CE :methyl 155:sc= -0.112 (180deg=-0.378) USER MOD Single : T 50 GLN : amide:sc= -0.0623 K(o=-0.062,f=-1.3) USER MOD Single : T 51 ASN : amide:sc= 0.454 K(o=0.45,f=-0.85) USER MOD Single : T 53 THR OG1 : rot 180:sc= 0.0868 USER MOD Single : T 58 GLN : amide:sc= -2.32! C(o=-2.3!,f=-2.4!) USER MOD Single : T 60 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : T 80 MET CE :methyl -177:sc= -0.407 (180deg=-0.422) USER MOD Single : T 81 MET CE :methyl 172:sc= 0 (180deg=-0.124) USER MOD Single : T 84 SER OG : rot 88:sc= 0.113 USER MOD Single : T 85 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : T 86 LYS NZ :NH3+ -164:sc=-0.00189 (180deg=-0.298) USER MOD Single : T 89 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET T 1 77.282 -17.888 7.805 1.00 0.00 N ATOM 2 CA MET T 1 76.320 -18.425 6.802 1.00 0.00 C ATOM 3 C MET T 1 75.827 -17.287 5.914 1.00 0.00 C ATOM 4 O MET T 1 75.788 -17.413 4.690 1.00 0.00 O ATOM 5 CB MET T 1 75.139 -19.073 7.526 1.00 0.00 C ATOM 6 CG MET T 1 75.646 -20.210 8.415 1.00 0.00 C ATOM 7 SD MET T 1 74.259 -20.923 9.332 1.00 0.00 S ATOM 8 CE MET T 1 73.776 -22.153 8.095 1.00 0.00 C ATOM 0 H1 MET T 1 77.922 -18.648 8.114 1.00 0.00 H new ATOM 0 H2 MET T 1 77.838 -17.120 7.377 1.00 0.00 H new ATOM 0 H3 MET T 1 76.759 -17.521 8.626 1.00 0.00 H new ATOM 0 HA MET T 1 76.813 -19.174 6.183 1.00 0.00 H new ATOM 0 HB2 MET T 1 74.617 -18.330 8.130 1.00 0.00 H new ATOM 0 HB3 MET T 1 74.421 -19.457 6.801 1.00 0.00 H new ATOM 0 HG2 MET T 1 76.125 -20.976 7.806 1.00 0.00 H new ATOM 0 HG3 MET T 1 76.400 -19.836 9.108 1.00 0.00 H new ATOM 0 HE1 MET T 1 72.920 -22.720 8.461 1.00 0.00 H new ATOM 0 HE2 MET T 1 73.508 -21.649 7.166 1.00 0.00 H new ATOM 0 HE3 MET T 1 74.609 -22.832 7.912 1.00 0.00 H new ATOM 20 N ASP T 2 75.448 -16.177 6.539 1.00 0.00 N ATOM 21 CA ASP T 2 74.958 -15.022 5.795 1.00 0.00 C ATOM 22 C ASP T 2 73.930 -15.453 4.754 1.00 0.00 C ATOM 23 O ASP T 2 74.126 -15.254 3.555 1.00 0.00 O ATOM 24 CB ASP T 2 76.124 -14.315 5.102 1.00 0.00 C ATOM 25 CG ASP T 2 77.178 -13.917 6.130 1.00 0.00 C ATOM 26 OD1 ASP T 2 77.934 -14.783 6.539 1.00 0.00 O ATOM 27 OD2 ASP T 2 77.213 -12.753 6.493 1.00 0.00 O ATOM 0 H ASP T 2 75.470 -16.053 7.551 1.00 0.00 H new ATOM 0 HA ASP T 2 74.483 -14.336 6.496 1.00 0.00 H new ATOM 0 HB2 ASP T 2 76.565 -14.972 4.353 1.00 0.00 H new ATOM 0 HB3 ASP T 2 75.764 -13.430 4.577 1.00 0.00 H new ATOM 32 N ASP T 3 72.836 -16.046 5.220 1.00 0.00 N ATOM 33 CA ASP T 3 71.782 -16.504 4.321 1.00 0.00 C ATOM 34 C ASP T 3 70.884 -15.342 3.907 1.00 0.00 C ATOM 35 O ASP T 3 70.785 -15.011 2.726 1.00 0.00 O ATOM 36 CB ASP T 3 70.940 -17.580 5.009 1.00 0.00 C ATOM 37 CG ASP T 3 71.841 -18.697 5.523 1.00 0.00 C ATOM 38 OD1 ASP T 3 72.479 -19.341 4.706 1.00 0.00 O ATOM 39 OD2 ASP T 3 71.881 -18.893 6.727 1.00 0.00 O ATOM 0 H ASP T 3 72.656 -16.220 6.209 1.00 0.00 H new ATOM 0 HA ASP T 3 72.250 -16.922 3.429 1.00 0.00 H new ATOM 0 HB2 ASP T 3 70.381 -17.143 5.836 1.00 0.00 H new ATOM 0 HB3 ASP T 3 70.209 -17.984 4.309 1.00 0.00 H new ATOM 44 N ILE T 4 70.228 -14.729 4.889 1.00 0.00 N ATOM 45 CA ILE T 4 69.335 -13.607 4.616 1.00 0.00 C ATOM 46 C ILE T 4 69.964 -12.628 3.625 1.00 0.00 C ATOM 47 O ILE T 4 69.273 -11.786 3.052 1.00 0.00 O ATOM 48 CB ILE T 4 68.975 -12.878 5.918 1.00 0.00 C ATOM 49 CG1 ILE T 4 70.190 -12.110 6.473 1.00 0.00 C ATOM 50 CG2 ILE T 4 68.494 -13.894 6.957 1.00 0.00 C ATOM 51 CD1 ILE T 4 71.394 -13.046 6.650 1.00 0.00 C ATOM 0 H ILE T 4 70.297 -14.988 5.873 1.00 0.00 H new ATOM 0 HA ILE T 4 68.425 -14.007 4.170 1.00 0.00 H new ATOM 0 HB ILE T 4 68.182 -12.162 5.705 1.00 0.00 H new ATOM 0 HG12 ILE T 4 70.452 -11.297 5.796 1.00 0.00 H new ATOM 0 HG13 ILE T 4 69.933 -11.657 7.430 1.00 0.00 H new ATOM 0 HG21 ILE T 4 68.239 -13.376 7.881 1.00 0.00 H new ATOM 0 HG22 ILE T 4 67.614 -14.414 6.577 1.00 0.00 H new ATOM 0 HG23 ILE T 4 69.286 -14.617 7.153 1.00 0.00 H new ATOM 0 HD11 ILE T 4 72.239 -12.481 7.043 1.00 0.00 H new ATOM 0 HD12 ILE T 4 71.135 -13.844 7.346 1.00 0.00 H new ATOM 0 HD13 ILE T 4 71.663 -13.479 5.686 1.00 0.00 H new ATOM 63 N TYR T 5 71.275 -12.743 3.425 1.00 0.00 N ATOM 64 CA TYR T 5 71.986 -11.864 2.499 1.00 0.00 C ATOM 65 C TYR T 5 72.036 -12.483 1.106 1.00 0.00 C ATOM 66 O TYR T 5 71.587 -11.880 0.131 1.00 0.00 O ATOM 67 CB TYR T 5 73.413 -11.621 3.001 1.00 0.00 C ATOM 68 CG TYR T 5 73.376 -10.701 4.202 1.00 0.00 C ATOM 69 CD1 TYR T 5 73.001 -9.361 4.043 1.00 0.00 C ATOM 70 CD2 TYR T 5 73.718 -11.185 5.472 1.00 0.00 C ATOM 71 CE1 TYR T 5 72.966 -8.508 5.152 1.00 0.00 C ATOM 72 CE2 TYR T 5 73.683 -10.331 6.580 1.00 0.00 C ATOM 73 CZ TYR T 5 73.307 -8.992 6.420 1.00 0.00 C ATOM 74 OH TYR T 5 73.273 -8.151 7.513 1.00 0.00 O ATOM 0 H TYR T 5 71.865 -13.433 3.890 1.00 0.00 H new ATOM 0 HA TYR T 5 71.452 -10.915 2.445 1.00 0.00 H new ATOM 0 HB2 TYR T 5 73.882 -12.568 3.269 1.00 0.00 H new ATOM 0 HB3 TYR T 5 74.018 -11.179 2.209 1.00 0.00 H new ATOM 0 HD1 TYR T 5 72.739 -8.986 3.065 1.00 0.00 H new ATOM 0 HD2 TYR T 5 74.009 -12.218 5.596 1.00 0.00 H new ATOM 0 HE1 TYR T 5 72.676 -7.475 5.029 1.00 0.00 H new ATOM 0 HE2 TYR T 5 73.946 -10.705 7.558 1.00 0.00 H new ATOM 0 HH TYR T 5 73.537 -8.647 8.316 1.00 0.00 H new ATOM 84 N LYS T 6 72.586 -13.691 1.020 1.00 0.00 N ATOM 85 CA LYS T 6 72.689 -14.383 -0.260 1.00 0.00 C ATOM 86 C LYS T 6 71.333 -14.422 -0.957 1.00 0.00 C ATOM 87 O LYS T 6 71.254 -14.626 -2.169 1.00 0.00 O ATOM 88 CB LYS T 6 73.195 -15.814 -0.040 1.00 0.00 C ATOM 89 CG LYS T 6 74.693 -15.799 0.332 1.00 0.00 C ATOM 90 CD LYS T 6 75.566 -15.800 -0.940 1.00 0.00 C ATOM 91 CE LYS T 6 75.785 -17.237 -1.430 1.00 0.00 C ATOM 92 NZ LYS T 6 76.200 -17.214 -2.862 1.00 0.00 N ATOM 0 H LYS T 6 72.964 -14.207 1.814 1.00 0.00 H new ATOM 0 HA LYS T 6 73.394 -13.841 -0.891 1.00 0.00 H new ATOM 0 HB2 LYS T 6 72.621 -16.293 0.753 1.00 0.00 H new ATOM 0 HB3 LYS T 6 73.043 -16.404 -0.944 1.00 0.00 H new ATOM 0 HG2 LYS T 6 74.916 -14.917 0.932 1.00 0.00 H new ATOM 0 HG3 LYS T 6 74.931 -16.669 0.944 1.00 0.00 H new ATOM 0 HD2 LYS T 6 75.085 -15.211 -1.721 1.00 0.00 H new ATOM 0 HD3 LYS T 6 76.526 -15.329 -0.731 1.00 0.00 H new ATOM 0 HE2 LYS T 6 76.549 -17.726 -0.826 1.00 0.00 H new ATOM 0 HE3 LYS T 6 74.869 -17.816 -1.315 1.00 0.00 H new ATOM 0 HZ1 LYS T 6 76.349 -18.188 -3.196 1.00 0.00 H new ATOM 0 HZ2 LYS T 6 75.456 -16.762 -3.432 1.00 0.00 H new ATOM 0 HZ3 LYS T 6 77.085 -16.676 -2.958 1.00 0.00 H new ATOM 106 N ALA T 7 70.270 -14.223 -0.186 1.00 0.00 N ATOM 107 CA ALA T 7 68.921 -14.237 -0.741 1.00 0.00 C ATOM 108 C ALA T 7 68.674 -12.986 -1.579 1.00 0.00 C ATOM 109 O ALA T 7 68.036 -13.048 -2.630 1.00 0.00 O ATOM 110 CB ALA T 7 67.892 -14.310 0.388 1.00 0.00 C ATOM 0 H ALA T 7 70.315 -14.051 0.818 1.00 0.00 H new ATOM 0 HA ALA T 7 68.820 -15.114 -1.380 1.00 0.00 H new ATOM 0 HB1 ALA T 7 66.888 -14.320 -0.035 1.00 0.00 H new ATOM 0 HB2 ALA T 7 68.051 -15.220 0.967 1.00 0.00 H new ATOM 0 HB3 ALA T 7 68.003 -13.442 1.038 1.00 0.00 H new ATOM 116 N ALA T 8 69.182 -11.854 -1.106 1.00 0.00 N ATOM 117 CA ALA T 8 69.010 -10.594 -1.820 1.00 0.00 C ATOM 118 C ALA T 8 69.900 -10.555 -3.059 1.00 0.00 C ATOM 119 O ALA T 8 69.487 -10.080 -4.116 1.00 0.00 O ATOM 120 CB ALA T 8 69.358 -9.421 -0.902 1.00 0.00 C ATOM 0 H ALA T 8 69.713 -11.782 -0.238 1.00 0.00 H new ATOM 0 HA ALA T 8 67.969 -10.514 -2.132 1.00 0.00 H new ATOM 0 HB1 ALA T 8 69.227 -8.484 -1.443 1.00 0.00 H new ATOM 0 HB2 ALA T 8 68.701 -9.433 -0.032 1.00 0.00 H new ATOM 0 HB3 ALA T 8 70.394 -9.509 -0.576 1.00 0.00 H new ATOM 126 N VAL T 9 71.122 -11.057 -2.920 1.00 0.00 N ATOM 127 CA VAL T 9 72.063 -11.073 -4.035 1.00 0.00 C ATOM 128 C VAL T 9 71.422 -11.705 -5.265 1.00 0.00 C ATOM 129 O VAL T 9 71.764 -11.366 -6.398 1.00 0.00 O ATOM 130 CB VAL T 9 73.316 -11.860 -3.648 1.00 0.00 C ATOM 131 CG1 VAL T 9 74.308 -11.842 -4.812 1.00 0.00 C ATOM 132 CG2 VAL T 9 73.962 -11.216 -2.419 1.00 0.00 C ATOM 0 H VAL T 9 71.483 -11.456 -2.053 1.00 0.00 H new ATOM 0 HA VAL T 9 72.339 -10.045 -4.270 1.00 0.00 H new ATOM 0 HB VAL T 9 73.043 -12.890 -3.418 1.00 0.00 H new ATOM 0 HG11 VAL T 9 75.201 -12.403 -4.537 1.00 0.00 H new ATOM 0 HG12 VAL T 9 73.849 -12.298 -5.689 1.00 0.00 H new ATOM 0 HG13 VAL T 9 74.582 -10.812 -5.041 1.00 0.00 H new ATOM 0 HG21 VAL T 9 74.855 -11.776 -2.142 1.00 0.00 H new ATOM 0 HG22 VAL T 9 74.236 -10.186 -2.649 1.00 0.00 H new ATOM 0 HG23 VAL T 9 73.255 -11.226 -1.589 1.00 0.00 H new ATOM 142 N GLU T 10 70.493 -12.627 -5.037 1.00 0.00 N ATOM 143 CA GLU T 10 69.812 -13.301 -6.137 1.00 0.00 C ATOM 144 C GLU T 10 68.806 -12.365 -6.798 1.00 0.00 C ATOM 145 O GLU T 10 68.450 -12.544 -7.963 1.00 0.00 O ATOM 146 CB GLU T 10 69.090 -14.546 -5.618 1.00 0.00 C ATOM 147 CG GLU T 10 70.118 -15.614 -5.241 1.00 0.00 C ATOM 148 CD GLU T 10 70.747 -16.201 -6.501 1.00 0.00 C ATOM 149 OE1 GLU T 10 70.076 -16.967 -7.172 1.00 0.00 O ATOM 150 OE2 GLU T 10 71.890 -15.875 -6.775 1.00 0.00 O ATOM 0 H GLU T 10 70.196 -12.923 -4.107 1.00 0.00 H new ATOM 0 HA GLU T 10 70.557 -13.595 -6.876 1.00 0.00 H new ATOM 0 HB2 GLU T 10 68.481 -14.291 -4.751 1.00 0.00 H new ATOM 0 HB3 GLU T 10 68.413 -14.931 -6.381 1.00 0.00 H new ATOM 0 HG2 GLU T 10 70.891 -15.179 -4.608 1.00 0.00 H new ATOM 0 HG3 GLU T 10 69.639 -16.404 -4.662 1.00 0.00 H new ATOM 157 N GLN T 11 68.351 -11.368 -6.047 1.00 0.00 N ATOM 158 CA GLN T 11 67.385 -10.409 -6.572 1.00 0.00 C ATOM 159 C GLN T 11 68.078 -9.384 -7.464 1.00 0.00 C ATOM 160 O GLN T 11 67.446 -8.762 -8.318 1.00 0.00 O ATOM 161 CB GLN T 11 66.681 -9.693 -5.418 1.00 0.00 C ATOM 162 CG GLN T 11 66.003 -10.724 -4.513 1.00 0.00 C ATOM 163 CD GLN T 11 65.350 -10.027 -3.326 1.00 0.00 C ATOM 164 OE1 GLN T 11 64.869 -8.902 -3.453 1.00 0.00 O ATOM 165 NE2 GLN T 11 65.302 -10.634 -2.171 1.00 0.00 N ATOM 0 H GLN T 11 68.632 -11.203 -5.081 1.00 0.00 H new ATOM 0 HA GLN T 11 66.649 -10.951 -7.166 1.00 0.00 H new ATOM 0 HB2 GLN T 11 67.401 -9.109 -4.845 1.00 0.00 H new ATOM 0 HB3 GLN T 11 65.941 -8.994 -5.808 1.00 0.00 H new ATOM 0 HG2 GLN T 11 65.253 -11.278 -5.077 1.00 0.00 H new ATOM 0 HG3 GLN T 11 66.737 -11.449 -4.161 1.00 0.00 H new ATOM 0 HE21 GLN T 11 65.702 -11.567 -2.068 1.00 0.00 H new ATOM 0 HE22 GLN T 11 64.865 -10.175 -1.372 1.00 0.00 H new ATOM 174 N LEU T 12 69.380 -9.212 -7.258 1.00 0.00 N ATOM 175 CA LEU T 12 70.149 -8.258 -8.050 1.00 0.00 C ATOM 176 C LEU T 12 70.473 -8.839 -9.423 1.00 0.00 C ATOM 177 O LEU T 12 71.269 -9.770 -9.543 1.00 0.00 O ATOM 178 CB LEU T 12 71.448 -7.903 -7.322 1.00 0.00 C ATOM 179 CG LEU T 12 71.166 -7.704 -5.832 1.00 0.00 C ATOM 180 CD1 LEU T 12 72.438 -7.222 -5.131 1.00 0.00 C ATOM 181 CD2 LEU T 12 70.059 -6.661 -5.654 1.00 0.00 C ATOM 0 H LEU T 12 69.921 -9.716 -6.556 1.00 0.00 H new ATOM 0 HA LEU T 12 69.550 -7.357 -8.183 1.00 0.00 H new ATOM 0 HB2 LEU T 12 72.182 -8.697 -7.460 1.00 0.00 H new ATOM 0 HB3 LEU T 12 71.877 -6.995 -7.745 1.00 0.00 H new ATOM 0 HG LEU T 12 70.846 -8.650 -5.395 1.00 0.00 H new ATOM 0 HD11 LEU T 12 72.237 -7.080 -4.069 1.00 0.00 H new ATOM 0 HD12 LEU T 12 73.226 -7.965 -5.255 1.00 0.00 H new ATOM 0 HD13 LEU T 12 72.759 -6.277 -5.569 1.00 0.00 H new ATOM 0 HD21 LEU T 12 69.859 -6.520 -4.592 1.00 0.00 H new ATOM 0 HD22 LEU T 12 70.377 -5.715 -6.092 1.00 0.00 H new ATOM 0 HD23 LEU T 12 69.152 -7.005 -6.151 1.00 0.00 H new ATOM 193 N THR T 13 69.850 -8.281 -10.457 1.00 0.00 N ATOM 194 CA THR T 13 70.081 -8.750 -11.818 1.00 0.00 C ATOM 195 C THR T 13 71.474 -8.345 -12.292 1.00 0.00 C ATOM 196 O THR T 13 72.081 -7.424 -11.747 1.00 0.00 O ATOM 197 CB THR T 13 69.025 -8.160 -12.759 1.00 0.00 C ATOM 198 OG1 THR T 13 67.749 -8.243 -12.143 1.00 0.00 O ATOM 199 CG2 THR T 13 69.010 -8.939 -14.076 1.00 0.00 C ATOM 0 H THR T 13 69.187 -7.510 -10.379 1.00 0.00 H new ATOM 0 HA THR T 13 70.008 -9.838 -11.828 1.00 0.00 H new ATOM 0 HB THR T 13 69.266 -7.117 -12.964 1.00 0.00 H new ATOM 0 HG1 THR T 13 67.072 -7.865 -12.742 1.00 0.00 H new ATOM 0 HG21 THR T 13 68.257 -8.515 -14.741 1.00 0.00 H new ATOM 0 HG22 THR T 13 69.990 -8.874 -14.549 1.00 0.00 H new ATOM 0 HG23 THR T 13 68.772 -9.984 -13.878 1.00 0.00 H new ATOM 207 N GLU T 14 71.976 -9.039 -13.308 1.00 0.00 N ATOM 208 CA GLU T 14 73.299 -8.741 -13.843 1.00 0.00 C ATOM 209 C GLU T 14 73.311 -7.376 -14.523 1.00 0.00 C ATOM 210 O GLU T 14 74.291 -7.001 -15.167 1.00 0.00 O ATOM 211 CB GLU T 14 73.709 -9.818 -14.851 1.00 0.00 C ATOM 212 CG GLU T 14 73.900 -11.151 -14.124 1.00 0.00 C ATOM 213 CD GLU T 14 74.120 -12.269 -15.137 1.00 0.00 C ATOM 214 OE1 GLU T 14 73.206 -12.542 -15.897 1.00 0.00 O ATOM 215 OE2 GLU T 14 75.200 -12.837 -15.137 1.00 0.00 O ATOM 0 H GLU T 14 71.491 -9.806 -13.774 1.00 0.00 H new ATOM 0 HA GLU T 14 74.008 -8.727 -13.015 1.00 0.00 H new ATOM 0 HB2 GLU T 14 72.946 -9.918 -15.623 1.00 0.00 H new ATOM 0 HB3 GLU T 14 74.633 -9.529 -15.352 1.00 0.00 H new ATOM 0 HG2 GLU T 14 74.753 -11.088 -13.449 1.00 0.00 H new ATOM 0 HG3 GLU T 14 73.025 -11.370 -13.512 1.00 0.00 H new ATOM 222 N GLU T 15 72.214 -6.636 -14.377 1.00 0.00 N ATOM 223 CA GLU T 15 72.105 -5.311 -14.983 1.00 0.00 C ATOM 224 C GLU T 15 72.684 -4.242 -14.059 1.00 0.00 C ATOM 225 O GLU T 15 73.477 -3.404 -14.486 1.00 0.00 O ATOM 226 CB GLU T 15 70.636 -4.993 -15.271 1.00 0.00 C ATOM 227 CG GLU T 15 70.150 -5.844 -16.445 1.00 0.00 C ATOM 228 CD GLU T 15 68.707 -5.489 -16.786 1.00 0.00 C ATOM 229 OE1 GLU T 15 68.460 -4.336 -17.098 1.00 0.00 O ATOM 230 OE2 GLU T 15 67.870 -6.375 -16.728 1.00 0.00 O ATOM 0 H GLU T 15 71.393 -6.929 -13.848 1.00 0.00 H new ATOM 0 HA GLU T 15 72.672 -5.312 -15.914 1.00 0.00 H new ATOM 0 HB2 GLU T 15 70.030 -5.193 -14.388 1.00 0.00 H new ATOM 0 HB3 GLU T 15 70.521 -3.934 -15.503 1.00 0.00 H new ATOM 0 HG2 GLU T 15 70.788 -5.679 -17.313 1.00 0.00 H new ATOM 0 HG3 GLU T 15 70.223 -6.902 -16.192 1.00 0.00 H new ATOM 237 N GLN T 16 72.276 -4.274 -12.794 1.00 0.00 N ATOM 238 CA GLN T 16 72.757 -3.295 -11.821 1.00 0.00 C ATOM 239 C GLN T 16 74.150 -3.665 -11.318 1.00 0.00 C ATOM 240 O GLN T 16 74.836 -2.841 -10.714 1.00 0.00 O ATOM 241 CB GLN T 16 71.784 -3.209 -10.641 1.00 0.00 C ATOM 242 CG GLN T 16 71.669 -4.575 -9.953 1.00 0.00 C ATOM 243 CD GLN T 16 72.850 -4.796 -9.013 1.00 0.00 C ATOM 244 OE1 GLN T 16 73.792 -5.508 -9.355 1.00 0.00 O ATOM 245 NE2 GLN T 16 72.855 -4.221 -7.842 1.00 0.00 N ATOM 0 H GLN T 16 71.620 -4.959 -12.420 1.00 0.00 H new ATOM 0 HA GLN T 16 72.816 -2.324 -12.313 1.00 0.00 H new ATOM 0 HB2 GLN T 16 72.131 -2.462 -9.927 1.00 0.00 H new ATOM 0 HB3 GLN T 16 70.804 -2.885 -10.991 1.00 0.00 H new ATOM 0 HG2 GLN T 16 70.735 -4.631 -9.394 1.00 0.00 H new ATOM 0 HG3 GLN T 16 71.639 -5.366 -10.703 1.00 0.00 H new ATOM 0 HE21 GLN T 16 72.072 -3.631 -7.560 1.00 0.00 H new ATOM 0 HE22 GLN T 16 73.642 -4.362 -7.208 1.00 0.00 H new ATOM 254 N LYS T 17 74.566 -4.902 -11.574 1.00 0.00 N ATOM 255 CA LYS T 17 75.885 -5.353 -11.141 1.00 0.00 C ATOM 256 C LYS T 17 76.975 -4.616 -11.911 1.00 0.00 C ATOM 257 O LYS T 17 78.004 -4.243 -11.349 1.00 0.00 O ATOM 258 CB LYS T 17 76.031 -6.861 -11.365 1.00 0.00 C ATOM 259 CG LYS T 17 75.175 -7.626 -10.350 1.00 0.00 C ATOM 260 CD LYS T 17 75.519 -9.117 -10.412 1.00 0.00 C ATOM 261 CE LYS T 17 74.433 -9.923 -9.697 1.00 0.00 C ATOM 262 NZ LYS T 17 74.864 -11.346 -9.583 1.00 0.00 N ATOM 0 H LYS T 17 74.017 -5.602 -12.073 1.00 0.00 H new ATOM 0 HA LYS T 17 75.990 -5.137 -10.078 1.00 0.00 H new ATOM 0 HB2 LYS T 17 75.724 -7.118 -12.379 1.00 0.00 H new ATOM 0 HB3 LYS T 17 77.076 -7.153 -11.265 1.00 0.00 H new ATOM 0 HG2 LYS T 17 75.353 -7.242 -9.345 1.00 0.00 H new ATOM 0 HG3 LYS T 17 74.117 -7.477 -10.565 1.00 0.00 H new ATOM 0 HD2 LYS T 17 75.601 -9.439 -11.450 1.00 0.00 H new ATOM 0 HD3 LYS T 17 76.487 -9.297 -9.945 1.00 0.00 H new ATOM 0 HE2 LYS T 17 74.249 -9.507 -8.706 1.00 0.00 H new ATOM 0 HE3 LYS T 17 73.495 -9.859 -10.249 1.00 0.00 H new ATOM 0 HZ1 LYS T 17 74.126 -11.894 -9.097 1.00 0.00 H new ATOM 0 HZ2 LYS T 17 75.018 -11.739 -10.533 1.00 0.00 H new ATOM 0 HZ3 LYS T 17 75.749 -11.398 -9.039 1.00 0.00 H new ATOM 276 N ASN T 18 76.741 -4.407 -13.203 1.00 0.00 N ATOM 277 CA ASN T 18 77.709 -3.712 -14.043 1.00 0.00 C ATOM 278 C ASN T 18 78.043 -2.344 -13.454 1.00 0.00 C ATOM 279 O ASN T 18 79.138 -1.821 -13.655 1.00 0.00 O ATOM 280 CB ASN T 18 77.146 -3.537 -15.454 1.00 0.00 C ATOM 281 CG ASN T 18 77.097 -4.884 -16.168 1.00 0.00 C ATOM 282 OD1 ASN T 18 77.658 -5.033 -17.253 1.00 0.00 O ATOM 283 ND2 ASN T 18 76.454 -5.878 -15.620 1.00 0.00 N ATOM 0 H ASN T 18 75.895 -4.707 -13.688 1.00 0.00 H new ATOM 0 HA ASN T 18 78.619 -4.310 -14.087 1.00 0.00 H new ATOM 0 HB2 ASN T 18 76.146 -3.106 -15.404 1.00 0.00 H new ATOM 0 HB3 ASN T 18 77.766 -2.840 -16.018 1.00 0.00 H new ATOM 0 HD21 ASN T 18 76.415 -6.782 -16.091 1.00 0.00 H new ATOM 0 HD22 ASN T 18 75.990 -5.751 -14.721 1.00 0.00 H new ATOM 290 N GLU T 19 77.089 -1.773 -12.726 1.00 0.00 N ATOM 291 CA GLU T 19 77.291 -0.466 -12.112 1.00 0.00 C ATOM 292 C GLU T 19 78.368 -0.541 -11.034 1.00 0.00 C ATOM 293 O GLU T 19 79.276 0.290 -10.990 1.00 0.00 O ATOM 294 CB GLU T 19 75.982 0.029 -11.492 1.00 0.00 C ATOM 295 CG GLU T 19 74.886 0.056 -12.561 1.00 0.00 C ATOM 296 CD GLU T 19 75.145 1.191 -13.545 1.00 0.00 C ATOM 297 OE1 GLU T 19 74.803 2.317 -13.223 1.00 0.00 O ATOM 298 OE2 GLU T 19 75.680 0.918 -14.606 1.00 0.00 O ATOM 0 H GLU T 19 76.176 -2.191 -12.548 1.00 0.00 H new ATOM 0 HA GLU T 19 77.613 0.231 -12.886 1.00 0.00 H new ATOM 0 HB2 GLU T 19 75.687 -0.624 -10.671 1.00 0.00 H new ATOM 0 HB3 GLU T 19 76.120 1.026 -11.073 1.00 0.00 H new ATOM 0 HG2 GLU T 19 74.860 -0.896 -13.091 1.00 0.00 H new ATOM 0 HG3 GLU T 19 73.911 0.187 -12.091 1.00 0.00 H new ATOM 305 N PHE T 20 78.261 -1.542 -10.167 1.00 0.00 N ATOM 306 CA PHE T 20 79.232 -1.716 -9.091 1.00 0.00 C ATOM 307 C PHE T 20 80.578 -2.163 -9.652 1.00 0.00 C ATOM 308 O PHE T 20 81.590 -1.485 -9.472 1.00 0.00 O ATOM 309 CB PHE T 20 78.722 -2.753 -8.088 1.00 0.00 C ATOM 310 CG PHE T 20 77.577 -2.164 -7.293 1.00 0.00 C ATOM 311 CD1 PHE T 20 77.812 -1.100 -6.414 1.00 0.00 C ATOM 312 CD2 PHE T 20 76.281 -2.680 -7.435 1.00 0.00 C ATOM 313 CE1 PHE T 20 76.756 -0.552 -5.678 1.00 0.00 C ATOM 314 CE2 PHE T 20 75.225 -2.131 -6.697 1.00 0.00 C ATOM 315 CZ PHE T 20 75.462 -1.068 -5.820 1.00 0.00 C ATOM 0 H PHE T 20 77.518 -2.241 -10.187 1.00 0.00 H new ATOM 0 HA PHE T 20 79.362 -0.759 -8.586 1.00 0.00 H new ATOM 0 HB2 PHE T 20 78.392 -3.650 -8.612 1.00 0.00 H new ATOM 0 HB3 PHE T 20 79.527 -3.054 -7.418 1.00 0.00 H new ATOM 0 HD1 PHE T 20 78.810 -0.702 -6.304 1.00 0.00 H new ATOM 0 HD2 PHE T 20 76.097 -3.500 -8.113 1.00 0.00 H new ATOM 0 HE1 PHE T 20 76.939 0.269 -5.000 1.00 0.00 H new ATOM 0 HE2 PHE T 20 74.227 -2.529 -6.805 1.00 0.00 H new ATOM 0 HZ PHE T 20 74.647 -0.645 -5.252 1.00 0.00 H new ATOM 325 N LYS T 21 80.585 -3.308 -10.331 1.00 0.00 N ATOM 326 CA LYS T 21 81.817 -3.836 -10.915 1.00 0.00 C ATOM 327 C LYS T 21 82.640 -2.717 -11.547 1.00 0.00 C ATOM 328 O LYS T 21 83.848 -2.854 -11.739 1.00 0.00 O ATOM 329 CB LYS T 21 81.481 -4.888 -11.974 1.00 0.00 C ATOM 330 CG LYS T 21 80.773 -6.073 -11.313 1.00 0.00 C ATOM 331 CD LYS T 21 80.756 -7.263 -12.276 1.00 0.00 C ATOM 332 CE LYS T 21 79.908 -6.923 -13.504 1.00 0.00 C ATOM 333 NZ LYS T 21 79.567 -8.177 -14.235 1.00 0.00 N ATOM 0 H LYS T 21 79.759 -3.885 -10.490 1.00 0.00 H new ATOM 0 HA LYS T 21 82.405 -4.294 -10.120 1.00 0.00 H new ATOM 0 HB2 LYS T 21 80.843 -4.453 -12.744 1.00 0.00 H new ATOM 0 HB3 LYS T 21 82.392 -5.225 -12.468 1.00 0.00 H new ATOM 0 HG2 LYS T 21 81.284 -6.346 -10.390 1.00 0.00 H new ATOM 0 HG3 LYS T 21 79.754 -5.796 -11.043 1.00 0.00 H new ATOM 0 HD2 LYS T 21 81.773 -7.510 -12.582 1.00 0.00 H new ATOM 0 HD3 LYS T 21 80.351 -8.142 -11.775 1.00 0.00 H new ATOM 0 HE2 LYS T 21 78.997 -6.408 -13.199 1.00 0.00 H new ATOM 0 HE3 LYS T 21 80.454 -6.244 -14.159 1.00 0.00 H new ATOM 0 HZ1 LYS T 21 78.991 -7.947 -15.070 1.00 0.00 H new ATOM 0 HZ2 LYS T 21 80.442 -8.651 -14.538 1.00 0.00 H new ATOM 0 HZ3 LYS T 21 79.030 -8.810 -13.608 1.00 0.00 H new ATOM 347 N ALA T 22 81.977 -1.609 -11.864 1.00 0.00 N ATOM 348 CA ALA T 22 82.657 -0.469 -12.467 1.00 0.00 C ATOM 349 C ALA T 22 83.392 0.336 -11.401 1.00 0.00 C ATOM 350 O ALA T 22 84.512 0.797 -11.620 1.00 0.00 O ATOM 351 CB ALA T 22 81.642 0.428 -13.178 1.00 0.00 C ATOM 0 H ALA T 22 80.977 -1.477 -11.715 1.00 0.00 H new ATOM 0 HA ALA T 22 83.381 -0.841 -13.192 1.00 0.00 H new ATOM 0 HB1 ALA T 22 82.158 1.277 -13.626 1.00 0.00 H new ATOM 0 HB2 ALA T 22 81.136 -0.142 -13.958 1.00 0.00 H new ATOM 0 HB3 ALA T 22 80.907 0.788 -12.458 1.00 0.00 H new ATOM 357 N ALA T 23 82.755 0.498 -10.245 1.00 0.00 N ATOM 358 CA ALA T 23 83.359 1.248 -9.149 1.00 0.00 C ATOM 359 C ALA T 23 84.736 0.685 -8.814 1.00 0.00 C ATOM 360 O ALA T 23 85.688 1.436 -8.599 1.00 0.00 O ATOM 361 CB ALA T 23 82.461 1.183 -7.911 1.00 0.00 C ATOM 0 H ALA T 23 81.828 0.123 -10.044 1.00 0.00 H new ATOM 0 HA ALA T 23 83.469 2.287 -9.460 1.00 0.00 H new ATOM 0 HB1 ALA T 23 82.920 1.746 -7.098 1.00 0.00 H new ATOM 0 HB2 ALA T 23 81.487 1.613 -8.145 1.00 0.00 H new ATOM 0 HB3 ALA T 23 82.335 0.144 -7.607 1.00 0.00 H new ATOM 367 N PHE T 24 84.836 -0.641 -8.775 1.00 0.00 N ATOM 368 CA PHE T 24 86.106 -1.293 -8.468 1.00 0.00 C ATOM 369 C PHE T 24 87.240 -0.645 -9.256 1.00 0.00 C ATOM 370 O PHE T 24 88.213 -0.158 -8.680 1.00 0.00 O ATOM 371 CB PHE T 24 86.028 -2.783 -8.819 1.00 0.00 C ATOM 372 CG PHE T 24 85.196 -3.510 -7.788 1.00 0.00 C ATOM 373 CD1 PHE T 24 83.800 -3.410 -7.821 1.00 0.00 C ATOM 374 CD2 PHE T 24 85.818 -4.289 -6.804 1.00 0.00 C ATOM 375 CE1 PHE T 24 83.027 -4.088 -6.870 1.00 0.00 C ATOM 376 CE2 PHE T 24 85.045 -4.967 -5.855 1.00 0.00 C ATOM 377 CZ PHE T 24 83.650 -4.866 -5.887 1.00 0.00 C ATOM 0 H PHE T 24 84.061 -1.280 -8.950 1.00 0.00 H new ATOM 0 HA PHE T 24 86.304 -1.181 -7.402 1.00 0.00 H new ATOM 0 HB2 PHE T 24 85.589 -2.910 -9.809 1.00 0.00 H new ATOM 0 HB3 PHE T 24 87.030 -3.210 -8.857 1.00 0.00 H new ATOM 0 HD1 PHE T 24 83.319 -2.810 -8.580 1.00 0.00 H new ATOM 0 HD2 PHE T 24 86.895 -4.366 -6.778 1.00 0.00 H new ATOM 0 HE1 PHE T 24 81.950 -4.011 -6.895 1.00 0.00 H new ATOM 0 HE2 PHE T 24 85.525 -5.569 -5.098 1.00 0.00 H new ATOM 0 HZ PHE T 24 83.054 -5.388 -5.153 1.00 0.00 H new ATOM 387 N ASP T 25 87.107 -0.647 -10.578 1.00 0.00 N ATOM 388 CA ASP T 25 88.126 -0.060 -11.442 1.00 0.00 C ATOM 389 C ASP T 25 88.535 1.319 -10.933 1.00 0.00 C ATOM 390 O ASP T 25 89.721 1.600 -10.763 1.00 0.00 O ATOM 391 CB ASP T 25 87.593 0.057 -12.871 1.00 0.00 C ATOM 392 CG ASP T 25 86.939 -1.253 -13.294 1.00 0.00 C ATOM 393 OD1 ASP T 25 87.293 -2.277 -12.733 1.00 0.00 O ATOM 394 OD2 ASP T 25 86.094 -1.214 -14.173 1.00 0.00 O ATOM 0 H ASP T 25 86.309 -1.046 -11.073 1.00 0.00 H new ATOM 0 HA ASP T 25 89.001 -0.710 -11.432 1.00 0.00 H new ATOM 0 HB2 ASP T 25 86.870 0.870 -12.932 1.00 0.00 H new ATOM 0 HB3 ASP T 25 88.407 0.303 -13.552 1.00 0.00 H new ATOM 399 N ILE T 26 87.547 2.176 -10.697 1.00 0.00 N ATOM 400 CA ILE T 26 87.821 3.523 -10.210 1.00 0.00 C ATOM 401 C ILE T 26 88.724 3.476 -8.982 1.00 0.00 C ATOM 402 O ILE T 26 89.719 4.196 -8.904 1.00 0.00 O ATOM 403 CB ILE T 26 86.511 4.237 -9.859 1.00 0.00 C ATOM 404 CG1 ILE T 26 85.470 3.984 -10.957 1.00 0.00 C ATOM 405 CG2 ILE T 26 86.762 5.742 -9.730 1.00 0.00 C ATOM 406 CD1 ILE T 26 86.070 4.295 -12.331 1.00 0.00 C ATOM 0 H ILE T 26 86.558 1.965 -10.833 1.00 0.00 H new ATOM 0 HA ILE T 26 88.330 4.075 -11.001 1.00 0.00 H new ATOM 0 HB ILE T 26 86.137 3.849 -8.912 1.00 0.00 H new ATOM 0 HG12 ILE T 26 85.138 2.946 -10.923 1.00 0.00 H new ATOM 0 HG13 ILE T 26 84.591 4.605 -10.786 1.00 0.00 H new ATOM 0 HG21 ILE T 26 85.829 6.246 -9.480 1.00 0.00 H new ATOM 0 HG22 ILE T 26 87.494 5.923 -8.943 1.00 0.00 H new ATOM 0 HG23 ILE T 26 87.143 6.130 -10.675 1.00 0.00 H new ATOM 0 HD11 ILE T 26 85.323 4.112 -13.104 1.00 0.00 H new ATOM 0 HD12 ILE T 26 86.379 5.340 -12.365 1.00 0.00 H new ATOM 0 HD13 ILE T 26 86.935 3.655 -12.504 1.00 0.00 H new ATOM 418 N PHE T 27 88.373 2.621 -8.026 1.00 0.00 N ATOM 419 CA PHE T 27 89.165 2.488 -6.808 1.00 0.00 C ATOM 420 C PHE T 27 90.529 1.885 -7.130 1.00 0.00 C ATOM 421 O PHE T 27 91.555 2.561 -7.045 1.00 0.00 O ATOM 422 CB PHE T 27 88.432 1.594 -5.802 1.00 0.00 C ATOM 423 CG PHE T 27 87.278 2.356 -5.190 1.00 0.00 C ATOM 424 CD1 PHE T 27 87.531 3.393 -4.283 1.00 0.00 C ATOM 425 CD2 PHE T 27 85.959 2.028 -5.528 1.00 0.00 C ATOM 426 CE1 PHE T 27 86.465 4.100 -3.715 1.00 0.00 C ATOM 427 CE2 PHE T 27 84.893 2.737 -4.959 1.00 0.00 C ATOM 428 CZ PHE T 27 85.147 3.773 -4.052 1.00 0.00 C ATOM 0 H PHE T 27 87.553 2.015 -8.070 1.00 0.00 H new ATOM 0 HA PHE T 27 89.307 3.478 -6.374 1.00 0.00 H new ATOM 0 HB2 PHE T 27 88.065 0.696 -6.299 1.00 0.00 H new ATOM 0 HB3 PHE T 27 89.120 1.268 -5.022 1.00 0.00 H new ATOM 0 HD1 PHE T 27 88.548 3.647 -4.022 1.00 0.00 H new ATOM 0 HD2 PHE T 27 85.764 1.228 -6.227 1.00 0.00 H new ATOM 0 HE1 PHE T 27 86.660 4.899 -3.015 1.00 0.00 H new ATOM 0 HE2 PHE T 27 83.876 2.485 -5.220 1.00 0.00 H new ATOM 0 HZ PHE T 27 84.326 4.320 -3.613 1.00 0.00 H new ATOM 438 N VAL T 28 90.531 0.607 -7.502 1.00 0.00 N ATOM 439 CA VAL T 28 91.770 -0.089 -7.840 1.00 0.00 C ATOM 440 C VAL T 28 92.096 0.090 -9.321 1.00 0.00 C ATOM 441 O VAL T 28 92.115 -0.876 -10.084 1.00 0.00 O ATOM 442 CB VAL T 28 91.626 -1.579 -7.522 1.00 0.00 C ATOM 443 CG1 VAL T 28 91.654 -1.784 -6.006 1.00 0.00 C ATOM 444 CG2 VAL T 28 90.296 -2.093 -8.079 1.00 0.00 C ATOM 0 H VAL T 28 89.691 0.034 -7.577 1.00 0.00 H new ATOM 0 HA VAL T 28 92.582 0.334 -7.249 1.00 0.00 H new ATOM 0 HB VAL T 28 92.450 -2.128 -7.978 1.00 0.00 H new ATOM 0 HG11 VAL T 28 91.551 -2.845 -5.780 1.00 0.00 H new ATOM 0 HG12 VAL T 28 92.600 -1.418 -5.607 1.00 0.00 H new ATOM 0 HG13 VAL T 28 90.831 -1.235 -5.549 1.00 0.00 H new ATOM 0 HG21 VAL T 28 90.193 -3.154 -7.853 1.00 0.00 H new ATOM 0 HG22 VAL T 28 89.473 -1.543 -7.622 1.00 0.00 H new ATOM 0 HG23 VAL T 28 90.274 -1.948 -9.159 1.00 0.00 H new ATOM 454 N LEU T 29 92.346 1.334 -9.719 1.00 0.00 N ATOM 455 CA LEU T 29 92.665 1.634 -11.114 1.00 0.00 C ATOM 456 C LEU T 29 94.141 1.366 -11.409 1.00 0.00 C ATOM 457 O LEU T 29 94.735 2.001 -12.280 1.00 0.00 O ATOM 458 CB LEU T 29 92.318 3.103 -11.430 1.00 0.00 C ATOM 459 CG LEU T 29 92.643 3.998 -10.228 1.00 0.00 C ATOM 460 CD1 LEU T 29 94.092 3.781 -9.784 1.00 0.00 C ATOM 461 CD2 LEU T 29 92.453 5.464 -10.628 1.00 0.00 C ATOM 0 H LEU T 29 92.335 2.146 -9.102 1.00 0.00 H new ATOM 0 HA LEU T 29 92.068 0.980 -11.750 1.00 0.00 H new ATOM 0 HB2 LEU T 29 92.880 3.437 -12.303 1.00 0.00 H new ATOM 0 HB3 LEU T 29 91.260 3.188 -11.680 1.00 0.00 H new ATOM 0 HG LEU T 29 91.976 3.745 -9.404 1.00 0.00 H new ATOM 0 HD11 LEU T 29 94.311 4.422 -8.930 1.00 0.00 H new ATOM 0 HD12 LEU T 29 94.233 2.738 -9.501 1.00 0.00 H new ATOM 0 HD13 LEU T 29 94.765 4.028 -10.605 1.00 0.00 H new ATOM 0 HD21 LEU T 29 92.683 6.106 -9.777 1.00 0.00 H new ATOM 0 HD22 LEU T 29 93.121 5.705 -11.455 1.00 0.00 H new ATOM 0 HD23 LEU T 29 91.420 5.626 -10.937 1.00 0.00 H new ATOM 473 N GLY T 30 94.730 0.419 -10.685 1.00 0.00 N ATOM 474 CA GLY T 30 96.136 0.084 -10.894 1.00 0.00 C ATOM 475 C GLY T 30 96.700 -0.704 -9.717 1.00 0.00 C ATOM 476 O GLY T 30 97.905 -0.682 -9.467 1.00 0.00 O ATOM 0 H GLY T 30 94.264 -0.124 -9.958 1.00 0.00 H new ATOM 0 HA2 GLY T 30 96.241 -0.500 -11.808 1.00 0.00 H new ATOM 0 HA3 GLY T 30 96.713 0.998 -11.032 1.00 0.00 H new ATOM 480 N ALA T 31 95.827 -1.404 -8.998 1.00 0.00 N ATOM 481 CA ALA T 31 96.256 -2.198 -7.850 1.00 0.00 C ATOM 482 C ALA T 31 96.737 -3.574 -8.301 1.00 0.00 C ATOM 483 O ALA T 31 96.688 -3.902 -9.487 1.00 0.00 O ATOM 484 CB ALA T 31 95.099 -2.355 -6.862 1.00 0.00 C ATOM 0 H ALA T 31 94.825 -1.438 -9.188 1.00 0.00 H new ATOM 0 HA ALA T 31 97.081 -1.681 -7.361 1.00 0.00 H new ATOM 0 HB1 ALA T 31 95.427 -2.948 -6.009 1.00 0.00 H new ATOM 0 HB2 ALA T 31 94.778 -1.372 -6.518 1.00 0.00 H new ATOM 0 HB3 ALA T 31 94.266 -2.857 -7.354 1.00 0.00 H new ATOM 490 N GLU T 32 97.198 -4.377 -7.347 1.00 0.00 N ATOM 491 CA GLU T 32 97.683 -5.717 -7.656 1.00 0.00 C ATOM 492 C GLU T 32 96.515 -6.681 -7.831 1.00 0.00 C ATOM 493 O GLU T 32 96.135 -7.015 -8.953 1.00 0.00 O ATOM 494 CB GLU T 32 98.594 -6.215 -6.532 1.00 0.00 C ATOM 495 CG GLU T 32 99.820 -5.305 -6.427 1.00 0.00 C ATOM 496 CD GLU T 32 100.606 -5.632 -5.163 1.00 0.00 C ATOM 497 OE1 GLU T 32 100.827 -6.805 -4.913 1.00 0.00 O ATOM 498 OE2 GLU T 32 100.974 -4.703 -4.462 1.00 0.00 O ATOM 0 H GLU T 32 97.246 -4.125 -6.360 1.00 0.00 H new ATOM 0 HA GLU T 32 98.247 -5.673 -8.588 1.00 0.00 H new ATOM 0 HB2 GLU T 32 98.052 -6.223 -5.587 1.00 0.00 H new ATOM 0 HB3 GLU T 32 98.905 -7.241 -6.729 1.00 0.00 H new ATOM 0 HG2 GLU T 32 100.455 -5.434 -7.303 1.00 0.00 H new ATOM 0 HG3 GLU T 32 99.508 -4.261 -6.411 1.00 0.00 H new ATOM 505 N ASP T 33 95.947 -7.124 -6.713 1.00 0.00 N ATOM 506 CA ASP T 33 94.819 -8.050 -6.752 1.00 0.00 C ATOM 507 C ASP T 33 93.520 -7.302 -7.033 1.00 0.00 C ATOM 508 O ASP T 33 92.937 -7.434 -8.109 1.00 0.00 O ATOM 509 CB ASP T 33 94.706 -8.795 -5.420 1.00 0.00 C ATOM 510 CG ASP T 33 94.807 -7.812 -4.256 1.00 0.00 C ATOM 511 OD1 ASP T 33 95.085 -6.651 -4.507 1.00 0.00 O ATOM 512 OD2 ASP T 33 94.605 -8.236 -3.130 1.00 0.00 O ATOM 0 H ASP T 33 96.247 -6.859 -5.775 1.00 0.00 H new ATOM 0 HA ASP T 33 94.991 -8.768 -7.554 1.00 0.00 H new ATOM 0 HB2 ASP T 33 93.757 -9.329 -5.373 1.00 0.00 H new ATOM 0 HB3 ASP T 33 95.496 -9.542 -5.344 1.00 0.00 H new ATOM 517 N GLY T 34 93.072 -6.515 -6.060 1.00 0.00 N ATOM 518 CA GLY T 34 91.840 -5.750 -6.216 1.00 0.00 C ATOM 519 C GLY T 34 91.326 -5.264 -4.865 1.00 0.00 C ATOM 520 O GLY T 34 90.122 -5.100 -4.670 1.00 0.00 O ATOM 0 H GLY T 34 93.539 -6.391 -5.162 1.00 0.00 H new ATOM 0 HA2 GLY T 34 92.018 -4.897 -6.870 1.00 0.00 H new ATOM 0 HA3 GLY T 34 91.082 -6.368 -6.697 1.00 0.00 H new ATOM 524 N SER T 35 92.249 -5.036 -3.934 1.00 0.00 N ATOM 525 CA SER T 35 91.882 -4.568 -2.599 1.00 0.00 C ATOM 526 C SER T 35 91.758 -3.047 -2.580 1.00 0.00 C ATOM 527 O SER T 35 92.204 -2.367 -3.503 1.00 0.00 O ATOM 528 CB SER T 35 92.940 -5.004 -1.586 1.00 0.00 C ATOM 529 OG SER T 35 94.163 -4.337 -1.867 1.00 0.00 O ATOM 0 H SER T 35 93.250 -5.166 -4.077 1.00 0.00 H new ATOM 0 HA SER T 35 90.919 -5.005 -2.333 1.00 0.00 H new ATOM 0 HB2 SER T 35 92.609 -4.770 -0.574 1.00 0.00 H new ATOM 0 HB3 SER T 35 93.082 -6.084 -1.633 1.00 0.00 H new ATOM 0 HG SER T 35 94.843 -4.613 -1.218 1.00 0.00 H new ATOM 535 N ILE T 36 91.147 -2.520 -1.518 1.00 0.00 N ATOM 536 CA ILE T 36 90.961 -1.072 -1.375 1.00 0.00 C ATOM 537 C ILE T 36 91.400 -0.617 0.013 1.00 0.00 C ATOM 538 O ILE T 36 91.489 -1.421 0.941 1.00 0.00 O ATOM 539 CB ILE T 36 89.489 -0.713 -1.587 1.00 0.00 C ATOM 540 CG1 ILE T 36 89.029 -1.224 -2.956 1.00 0.00 C ATOM 541 CG2 ILE T 36 89.320 0.807 -1.528 1.00 0.00 C ATOM 542 CD1 ILE T 36 87.508 -1.111 -3.059 1.00 0.00 C ATOM 0 H ILE T 36 90.773 -3.071 -0.745 1.00 0.00 H new ATOM 0 HA ILE T 36 91.570 -0.567 -2.125 1.00 0.00 H new ATOM 0 HB ILE T 36 88.887 -1.177 -0.805 1.00 0.00 H new ATOM 0 HG12 ILE T 36 89.502 -0.645 -3.749 1.00 0.00 H new ATOM 0 HG13 ILE T 36 89.337 -2.261 -3.091 1.00 0.00 H new ATOM 0 HG21 ILE T 36 88.271 1.063 -1.679 1.00 0.00 H new ATOM 0 HG22 ILE T 36 89.646 1.172 -0.554 1.00 0.00 H new ATOM 0 HG23 ILE T 36 89.923 1.271 -2.309 1.00 0.00 H new ATOM 0 HD11 ILE T 36 87.181 -1.475 -4.033 1.00 0.00 H new ATOM 0 HD12 ILE T 36 87.045 -1.709 -2.274 1.00 0.00 H new ATOM 0 HD13 ILE T 36 87.212 -0.068 -2.943 1.00 0.00 H new ATOM 554 N SER T 37 91.674 0.677 0.148 1.00 0.00 N ATOM 555 CA SER T 37 92.104 1.229 1.429 1.00 0.00 C ATOM 556 C SER T 37 91.871 2.735 1.470 1.00 0.00 C ATOM 557 O SER T 37 91.438 3.334 0.486 1.00 0.00 O ATOM 558 CB SER T 37 93.587 0.932 1.653 1.00 0.00 C ATOM 559 OG SER T 37 94.044 1.660 2.785 1.00 0.00 O ATOM 0 H SER T 37 91.607 1.359 -0.608 1.00 0.00 H new ATOM 0 HA SER T 37 91.517 0.762 2.220 1.00 0.00 H new ATOM 0 HB2 SER T 37 93.737 -0.136 1.808 1.00 0.00 H new ATOM 0 HB3 SER T 37 94.163 1.210 0.770 1.00 0.00 H new ATOM 0 HG SER T 37 93.673 1.263 3.601 1.00 0.00 H new ATOM 565 N THR T 38 92.161 3.341 2.617 1.00 0.00 N ATOM 566 CA THR T 38 91.979 4.779 2.783 1.00 0.00 C ATOM 567 C THR T 38 92.829 5.553 1.779 1.00 0.00 C ATOM 568 O THR T 38 92.804 6.782 1.751 1.00 0.00 O ATOM 569 CB THR T 38 92.366 5.191 4.205 1.00 0.00 C ATOM 570 OG1 THR T 38 93.780 5.283 4.301 1.00 0.00 O ATOM 571 CG2 THR T 38 91.852 4.149 5.198 1.00 0.00 C ATOM 0 H THR T 38 92.521 2.861 3.442 1.00 0.00 H new ATOM 0 HA THR T 38 90.929 5.014 2.606 1.00 0.00 H new ATOM 0 HB THR T 38 91.922 6.159 4.437 1.00 0.00 H new ATOM 0 HG1 THR T 38 94.030 5.548 5.211 1.00 0.00 H new ATOM 0 HG21 THR T 38 92.128 4.444 6.210 1.00 0.00 H new ATOM 0 HG22 THR T 38 90.767 4.080 5.124 1.00 0.00 H new ATOM 0 HG23 THR T 38 92.294 3.179 4.969 1.00 0.00 H new ATOM 579 N LYS T 39 93.583 4.824 0.959 1.00 0.00 N ATOM 580 CA LYS T 39 94.442 5.455 -0.040 1.00 0.00 C ATOM 581 C LYS T 39 93.654 5.785 -1.305 1.00 0.00 C ATOM 582 O LYS T 39 93.558 6.946 -1.702 1.00 0.00 O ATOM 583 CB LYS T 39 95.601 4.520 -0.391 1.00 0.00 C ATOM 584 CG LYS T 39 96.572 4.445 0.789 1.00 0.00 C ATOM 585 CD LYS T 39 97.794 3.613 0.393 1.00 0.00 C ATOM 586 CE LYS T 39 98.887 3.777 1.449 1.00 0.00 C ATOM 587 NZ LYS T 39 100.128 3.090 0.992 1.00 0.00 N ATOM 0 H LYS T 39 93.617 3.805 0.966 1.00 0.00 H new ATOM 0 HA LYS T 39 94.831 6.383 0.380 1.00 0.00 H new ATOM 0 HB2 LYS T 39 95.221 3.526 -0.627 1.00 0.00 H new ATOM 0 HB3 LYS T 39 96.119 4.883 -1.279 1.00 0.00 H new ATOM 0 HG2 LYS T 39 96.882 5.448 1.083 1.00 0.00 H new ATOM 0 HG3 LYS T 39 96.078 3.998 1.652 1.00 0.00 H new ATOM 0 HD2 LYS T 39 97.518 2.563 0.301 1.00 0.00 H new ATOM 0 HD3 LYS T 39 98.164 3.932 -0.581 1.00 0.00 H new ATOM 0 HE2 LYS T 39 99.086 4.835 1.620 1.00 0.00 H new ATOM 0 HE3 LYS T 39 98.555 3.358 2.399 1.00 0.00 H new ATOM 0 HZ1 LYS T 39 100.871 3.202 1.711 1.00 0.00 H new ATOM 0 HZ2 LYS T 39 99.933 2.078 0.850 1.00 0.00 H new ATOM 0 HZ3 LYS T 39 100.447 3.510 0.096 1.00 0.00 H new ATOM 601 N GLU T 40 93.099 4.756 -1.939 1.00 0.00 N ATOM 602 CA GLU T 40 92.329 4.946 -3.166 1.00 0.00 C ATOM 603 C GLU T 40 90.890 5.347 -2.854 1.00 0.00 C ATOM 604 O GLU T 40 90.053 5.434 -3.752 1.00 0.00 O ATOM 605 CB GLU T 40 92.329 3.653 -3.985 1.00 0.00 C ATOM 606 CG GLU T 40 93.743 3.072 -4.024 1.00 0.00 C ATOM 607 CD GLU T 40 94.725 4.120 -4.536 1.00 0.00 C ATOM 608 OE1 GLU T 40 94.636 4.467 -5.702 1.00 0.00 O ATOM 609 OE2 GLU T 40 95.553 4.559 -3.754 1.00 0.00 O ATOM 0 H GLU T 40 93.167 3.787 -1.627 1.00 0.00 H new ATOM 0 HA GLU T 40 92.797 5.747 -3.739 1.00 0.00 H new ATOM 0 HB2 GLU T 40 91.640 2.932 -3.545 1.00 0.00 H new ATOM 0 HB3 GLU T 40 91.978 3.852 -4.998 1.00 0.00 H new ATOM 0 HG2 GLU T 40 94.037 2.743 -3.027 1.00 0.00 H new ATOM 0 HG3 GLU T 40 93.766 2.194 -4.670 1.00 0.00 H new ATOM 616 N LEU T 41 90.606 5.586 -1.578 1.00 0.00 N ATOM 617 CA LEU T 41 89.260 5.972 -1.166 1.00 0.00 C ATOM 618 C LEU T 41 88.991 7.434 -1.526 1.00 0.00 C ATOM 619 O LEU T 41 88.215 7.727 -2.437 1.00 0.00 O ATOM 620 CB LEU T 41 89.104 5.758 0.351 1.00 0.00 C ATOM 621 CG LEU T 41 87.628 5.512 0.730 1.00 0.00 C ATOM 622 CD1 LEU T 41 86.744 6.615 0.136 1.00 0.00 C ATOM 623 CD2 LEU T 41 87.155 4.133 0.222 1.00 0.00 C ATOM 0 H LEU T 41 91.282 5.520 -0.817 1.00 0.00 H new ATOM 0 HA LEU T 41 88.535 5.351 -1.692 1.00 0.00 H new ATOM 0 HB2 LEU T 41 89.710 4.908 0.665 1.00 0.00 H new ATOM 0 HB3 LEU T 41 89.479 6.631 0.885 1.00 0.00 H new ATOM 0 HG LEU T 41 87.545 5.528 1.817 1.00 0.00 H new ATOM 0 HD11 LEU T 41 85.704 6.434 0.408 1.00 0.00 H new ATOM 0 HD12 LEU T 41 87.058 7.583 0.527 1.00 0.00 H new ATOM 0 HD13 LEU T 41 86.840 6.613 -0.950 1.00 0.00 H new ATOM 0 HD21 LEU T 41 86.112 3.981 0.500 1.00 0.00 H new ATOM 0 HD22 LEU T 41 87.251 4.093 -0.863 1.00 0.00 H new ATOM 0 HD23 LEU T 41 87.768 3.351 0.670 1.00 0.00 H new ATOM 635 N GLY T 42 89.630 8.345 -0.801 1.00 0.00 N ATOM 636 CA GLY T 42 89.450 9.773 -1.043 1.00 0.00 C ATOM 637 C GLY T 42 89.477 10.091 -2.535 1.00 0.00 C ATOM 638 O GLY T 42 88.650 10.856 -3.030 1.00 0.00 O ATOM 0 H GLY T 42 90.275 8.122 -0.043 1.00 0.00 H new ATOM 0 HA2 GLY T 42 88.501 10.099 -0.617 1.00 0.00 H new ATOM 0 HA3 GLY T 42 90.236 10.332 -0.536 1.00 0.00 H new ATOM 642 N LYS T 43 90.435 9.504 -3.245 1.00 0.00 N ATOM 643 CA LYS T 43 90.562 9.738 -4.680 1.00 0.00 C ATOM 644 C LYS T 43 89.198 9.696 -5.364 1.00 0.00 C ATOM 645 O LYS T 43 88.917 10.497 -6.255 1.00 0.00 O ATOM 646 CB LYS T 43 91.478 8.682 -5.303 1.00 0.00 C ATOM 647 CG LYS T 43 92.881 8.799 -4.700 1.00 0.00 C ATOM 648 CD LYS T 43 93.876 8.020 -5.561 1.00 0.00 C ATOM 649 CE LYS T 43 95.285 8.178 -4.985 1.00 0.00 C ATOM 650 NZ LYS T 43 96.278 7.600 -5.933 1.00 0.00 N ATOM 0 H LYS T 43 91.130 8.868 -2.855 1.00 0.00 H new ATOM 0 HA LYS T 43 90.993 10.729 -4.825 1.00 0.00 H new ATOM 0 HB2 LYS T 43 91.076 7.685 -5.123 1.00 0.00 H new ATOM 0 HB3 LYS T 43 91.523 8.817 -6.384 1.00 0.00 H new ATOM 0 HG2 LYS T 43 93.177 9.847 -4.642 1.00 0.00 H new ATOM 0 HG3 LYS T 43 92.884 8.410 -3.682 1.00 0.00 H new ATOM 0 HD2 LYS T 43 93.600 6.966 -5.590 1.00 0.00 H new ATOM 0 HD3 LYS T 43 93.848 8.385 -6.588 1.00 0.00 H new ATOM 0 HE2 LYS T 43 95.502 9.232 -4.812 1.00 0.00 H new ATOM 0 HE3 LYS T 43 95.353 7.676 -4.020 1.00 0.00 H new ATOM 0 HZ1 LYS T 43 97.235 7.708 -5.541 1.00 0.00 H new ATOM 0 HZ2 LYS T 43 96.074 6.590 -6.077 1.00 0.00 H new ATOM 0 HZ3 LYS T 43 96.219 8.098 -6.844 1.00 0.00 H new ATOM 664 N VAL T 44 88.356 8.758 -4.943 1.00 0.00 N ATOM 665 CA VAL T 44 87.024 8.623 -5.526 1.00 0.00 C ATOM 666 C VAL T 44 86.068 9.654 -4.933 1.00 0.00 C ATOM 667 O VAL T 44 85.505 10.478 -5.655 1.00 0.00 O ATOM 668 CB VAL T 44 86.483 7.215 -5.271 1.00 0.00 C ATOM 669 CG1 VAL T 44 85.077 7.095 -5.862 1.00 0.00 C ATOM 670 CG2 VAL T 44 87.408 6.186 -5.933 1.00 0.00 C ATOM 0 H VAL T 44 88.569 8.085 -4.207 1.00 0.00 H new ATOM 0 HA VAL T 44 87.100 8.794 -6.600 1.00 0.00 H new ATOM 0 HB VAL T 44 86.442 7.029 -4.198 1.00 0.00 H new ATOM 0 HG11 VAL T 44 84.691 6.092 -5.681 1.00 0.00 H new ATOM 0 HG12 VAL T 44 84.421 7.827 -5.391 1.00 0.00 H new ATOM 0 HG13 VAL T 44 85.116 7.280 -6.935 1.00 0.00 H new ATOM 0 HG21 VAL T 44 87.024 5.182 -5.752 1.00 0.00 H new ATOM 0 HG22 VAL T 44 87.449 6.371 -7.006 1.00 0.00 H new ATOM 0 HG23 VAL T 44 88.409 6.273 -5.511 1.00 0.00 H new ATOM 680 N MET T 45 85.888 9.603 -3.618 1.00 0.00 N ATOM 681 CA MET T 45 84.996 10.539 -2.943 1.00 0.00 C ATOM 682 C MET T 45 85.396 11.979 -3.249 1.00 0.00 C ATOM 683 O MET T 45 84.705 12.921 -2.860 1.00 0.00 O ATOM 684 CB MET T 45 85.039 10.305 -1.432 1.00 0.00 C ATOM 685 CG MET T 45 84.437 8.935 -1.108 1.00 0.00 C ATOM 686 SD MET T 45 84.226 8.778 0.682 1.00 0.00 S ATOM 687 CE MET T 45 82.544 9.442 0.771 1.00 0.00 C ATOM 0 H MET T 45 86.344 8.929 -3.002 1.00 0.00 H new ATOM 0 HA MET T 45 83.983 10.371 -3.308 1.00 0.00 H new ATOM 0 HB2 MET T 45 86.068 10.355 -1.075 1.00 0.00 H new ATOM 0 HB3 MET T 45 84.484 11.089 -0.916 1.00 0.00 H new ATOM 0 HG2 MET T 45 83.476 8.820 -1.610 1.00 0.00 H new ATOM 0 HG3 MET T 45 85.087 8.143 -1.479 1.00 0.00 H new ATOM 0 HE1 MET T 45 82.206 9.438 1.807 1.00 0.00 H new ATOM 0 HE2 MET T 45 82.535 10.463 0.390 1.00 0.00 H new ATOM 0 HE3 MET T 45 81.877 8.825 0.169 1.00 0.00 H new ATOM 697 N ARG T 46 86.515 12.142 -3.947 1.00 0.00 N ATOM 698 CA ARG T 46 86.999 13.474 -4.299 1.00 0.00 C ATOM 699 C ARG T 46 86.245 14.017 -5.509 1.00 0.00 C ATOM 700 O ARG T 46 85.714 15.127 -5.474 1.00 0.00 O ATOM 701 CB ARG T 46 88.495 13.419 -4.611 1.00 0.00 C ATOM 702 CG ARG T 46 88.987 14.817 -4.996 1.00 0.00 C ATOM 703 CD ARG T 46 90.517 14.829 -5.024 1.00 0.00 C ATOM 704 NE ARG T 46 91.003 16.153 -5.396 1.00 0.00 N ATOM 705 CZ ARG T 46 92.273 16.347 -5.737 1.00 0.00 C ATOM 706 NH1 ARG T 46 93.108 15.344 -5.743 1.00 0.00 N ATOM 707 NH2 ARG T 46 92.685 17.542 -6.065 1.00 0.00 N ATOM 0 H ARG T 46 87.101 11.375 -4.278 1.00 0.00 H new ATOM 0 HA ARG T 46 86.828 14.138 -3.452 1.00 0.00 H new ATOM 0 HB2 ARG T 46 89.045 13.054 -3.744 1.00 0.00 H new ATOM 0 HB3 ARG T 46 88.682 12.719 -5.425 1.00 0.00 H new ATOM 0 HG2 ARG T 46 88.592 15.097 -5.973 1.00 0.00 H new ATOM 0 HG3 ARG T 46 88.620 15.553 -4.281 1.00 0.00 H new ATOM 0 HD2 ARG T 46 90.908 14.552 -4.045 1.00 0.00 H new ATOM 0 HD3 ARG T 46 90.881 14.087 -5.735 1.00 0.00 H new ATOM 0 HE ARG T 46 90.358 16.943 -5.394 1.00 0.00 H new ATOM 0 HH11 ARG T 46 92.786 14.411 -5.486 1.00 0.00 H new ATOM 0 HH12 ARG T 46 94.082 15.493 -6.005 1.00 0.00 H new ATOM 0 HH21 ARG T 46 92.032 18.326 -6.059 1.00 0.00 H new ATOM 0 HH22 ARG T 46 93.659 17.692 -6.327 1.00 0.00 H new ATOM 721 N MET T 47 86.203 13.228 -6.579 1.00 0.00 N ATOM 722 CA MET T 47 85.512 13.641 -7.796 1.00 0.00 C ATOM 723 C MET T 47 84.151 14.248 -7.463 1.00 0.00 C ATOM 724 O MET T 47 83.646 15.100 -8.193 1.00 0.00 O ATOM 725 CB MET T 47 85.323 12.438 -8.723 1.00 0.00 C ATOM 726 CG MET T 47 86.675 12.023 -9.305 1.00 0.00 C ATOM 727 SD MET T 47 86.426 10.725 -10.543 1.00 0.00 S ATOM 728 CE MET T 47 86.518 9.314 -9.415 1.00 0.00 C ATOM 0 H MET T 47 86.636 12.306 -6.628 1.00 0.00 H new ATOM 0 HA MET T 47 86.119 14.395 -8.297 1.00 0.00 H new ATOM 0 HB2 MET T 47 84.882 11.607 -8.172 1.00 0.00 H new ATOM 0 HB3 MET T 47 84.631 12.690 -9.527 1.00 0.00 H new ATOM 0 HG2 MET T 47 87.167 12.883 -9.758 1.00 0.00 H new ATOM 0 HG3 MET T 47 87.330 11.663 -8.511 1.00 0.00 H new ATOM 0 HE1 MET T 47 85.972 8.472 -9.841 1.00 0.00 H new ATOM 0 HE2 MET T 47 87.561 9.033 -9.268 1.00 0.00 H new ATOM 0 HE3 MET T 47 86.076 9.585 -8.456 1.00 0.00 H new ATOM 738 N LEU T 48 83.567 13.804 -6.355 1.00 0.00 N ATOM 739 CA LEU T 48 82.266 14.312 -5.934 1.00 0.00 C ATOM 740 C LEU T 48 82.394 15.753 -5.448 1.00 0.00 C ATOM 741 O LEU T 48 81.771 16.661 -5.997 1.00 0.00 O ATOM 742 CB LEU T 48 81.701 13.433 -4.810 1.00 0.00 C ATOM 743 CG LEU T 48 81.142 12.132 -5.396 1.00 0.00 C ATOM 744 CD1 LEU T 48 82.203 11.459 -6.272 1.00 0.00 C ATOM 745 CD2 LEU T 48 80.751 11.191 -4.253 1.00 0.00 C ATOM 0 H LEU T 48 83.970 13.100 -5.737 1.00 0.00 H new ATOM 0 HA LEU T 48 81.587 14.286 -6.786 1.00 0.00 H new ATOM 0 HB2 LEU T 48 82.483 13.209 -4.084 1.00 0.00 H new ATOM 0 HB3 LEU T 48 80.916 13.969 -4.277 1.00 0.00 H new ATOM 0 HG LEU T 48 80.266 12.356 -6.004 1.00 0.00 H new ATOM 0 HD11 LEU T 48 81.800 10.535 -6.686 1.00 0.00 H new ATOM 0 HD12 LEU T 48 82.482 12.129 -7.085 1.00 0.00 H new ATOM 0 HD13 LEU T 48 83.083 11.234 -5.669 1.00 0.00 H new ATOM 0 HD21 LEU T 48 80.353 10.264 -4.665 1.00 0.00 H new ATOM 0 HD22 LEU T 48 81.629 10.971 -3.646 1.00 0.00 H new ATOM 0 HD23 LEU T 48 79.992 11.668 -3.633 1.00 0.00 H new ATOM 757 N GLY T 49 83.205 15.954 -4.413 1.00 0.00 N ATOM 758 CA GLY T 49 83.408 17.289 -3.859 1.00 0.00 C ATOM 759 C GLY T 49 83.917 17.210 -2.424 1.00 0.00 C ATOM 760 O GLY T 49 84.370 18.207 -1.860 1.00 0.00 O ATOM 0 H GLY T 49 83.729 15.215 -3.944 1.00 0.00 H new ATOM 0 HA2 GLY T 49 84.122 17.837 -4.473 1.00 0.00 H new ATOM 0 HA3 GLY T 49 82.471 17.845 -3.887 1.00 0.00 H new ATOM 764 N GLN T 50 83.839 16.019 -1.837 1.00 0.00 N ATOM 765 CA GLN T 50 84.294 15.818 -0.464 1.00 0.00 C ATOM 766 C GLN T 50 85.800 15.576 -0.428 1.00 0.00 C ATOM 767 O GLN T 50 86.421 15.308 -1.458 1.00 0.00 O ATOM 768 CB GLN T 50 83.570 14.620 0.155 1.00 0.00 C ATOM 769 CG GLN T 50 82.081 14.691 -0.190 1.00 0.00 C ATOM 770 CD GLN T 50 81.497 16.016 0.285 1.00 0.00 C ATOM 771 OE1 GLN T 50 81.406 16.969 -0.489 1.00 0.00 O ATOM 772 NE2 GLN T 50 81.092 16.134 1.521 1.00 0.00 N ATOM 0 H GLN T 50 83.467 15.183 -2.287 1.00 0.00 H new ATOM 0 HA GLN T 50 84.068 16.717 0.109 1.00 0.00 H new ATOM 0 HB2 GLN T 50 83.997 13.690 -0.220 1.00 0.00 H new ATOM 0 HB3 GLN T 50 83.704 14.619 1.237 1.00 0.00 H new ATOM 0 HG2 GLN T 50 81.944 14.589 -1.267 1.00 0.00 H new ATOM 0 HG3 GLN T 50 81.551 13.862 0.279 1.00 0.00 H new ATOM 0 HE21 GLN T 50 81.168 15.343 2.160 1.00 0.00 H new ATOM 0 HE22 GLN T 50 80.699 17.017 1.847 1.00 0.00 H new ATOM 781 N ASN T 51 86.380 15.668 0.763 1.00 0.00 N ATOM 782 CA ASN T 51 87.814 15.456 0.924 1.00 0.00 C ATOM 783 C ASN T 51 88.174 15.321 2.401 1.00 0.00 C ATOM 784 O ASN T 51 88.977 16.093 2.925 1.00 0.00 O ATOM 785 CB ASN T 51 88.587 16.626 0.312 1.00 0.00 C ATOM 786 CG ASN T 51 90.058 16.255 0.159 1.00 0.00 C ATOM 787 OD1 ASN T 51 90.531 16.037 -0.956 1.00 0.00 O ATOM 788 ND2 ASN T 51 90.813 16.169 1.220 1.00 0.00 N ATOM 0 H ASN T 51 85.883 15.887 1.627 1.00 0.00 H new ATOM 0 HA ASN T 51 88.086 14.534 0.411 1.00 0.00 H new ATOM 0 HB2 ASN T 51 88.165 16.883 -0.660 1.00 0.00 H new ATOM 0 HB3 ASN T 51 88.490 17.508 0.945 1.00 0.00 H new ATOM 0 HD21 ASN T 51 91.798 15.921 1.126 1.00 0.00 H new ATOM 0 HD22 ASN T 51 90.418 16.350 2.143 1.00 0.00 H new ATOM 795 N PRO T 52 87.597 14.359 3.074 1.00 0.00 N ATOM 796 CA PRO T 52 87.860 14.117 4.523 1.00 0.00 C ATOM 797 C PRO T 52 89.221 13.461 4.756 1.00 0.00 C ATOM 798 O PRO T 52 89.897 13.055 3.809 1.00 0.00 O ATOM 799 CB PRO T 52 86.713 13.187 4.935 1.00 0.00 C ATOM 800 CG PRO T 52 86.376 12.429 3.690 1.00 0.00 C ATOM 801 CD PRO T 52 86.627 13.393 2.526 1.00 0.00 C ATOM 0 HA PRO T 52 87.896 15.039 5.103 1.00 0.00 H new ATOM 0 HB2 PRO T 52 87.016 12.515 5.738 1.00 0.00 H new ATOM 0 HB3 PRO T 52 85.855 13.753 5.299 1.00 0.00 H new ATOM 0 HG2 PRO T 52 86.995 11.536 3.597 1.00 0.00 H new ATOM 0 HG3 PRO T 52 85.338 12.097 3.705 1.00 0.00 H new ATOM 0 HD2 PRO T 52 87.028 12.874 1.655 1.00 0.00 H new ATOM 0 HD3 PRO T 52 85.708 13.885 2.209 1.00 0.00 H new ATOM 809 N THR T 53 89.612 13.358 6.021 1.00 0.00 N ATOM 810 CA THR T 53 90.892 12.747 6.371 1.00 0.00 C ATOM 811 C THR T 53 90.787 11.221 6.291 1.00 0.00 C ATOM 812 O THR T 53 89.703 10.664 6.460 1.00 0.00 O ATOM 813 CB THR T 53 91.299 13.164 7.797 1.00 0.00 C ATOM 814 OG1 THR T 53 92.038 12.114 8.405 1.00 0.00 O ATOM 815 CG2 THR T 53 90.049 13.448 8.632 1.00 0.00 C ATOM 0 H THR T 53 89.066 13.687 6.818 1.00 0.00 H new ATOM 0 HA THR T 53 91.649 13.089 5.666 1.00 0.00 H new ATOM 0 HB THR T 53 91.912 14.064 7.744 1.00 0.00 H new ATOM 0 HG1 THR T 53 92.298 12.380 9.312 1.00 0.00 H new ATOM 0 HG21 THR T 53 90.343 13.742 9.639 1.00 0.00 H new ATOM 0 HG22 THR T 53 89.479 14.254 8.171 1.00 0.00 H new ATOM 0 HG23 THR T 53 89.433 12.550 8.682 1.00 0.00 H new ATOM 823 N PRO T 54 91.879 10.538 6.044 1.00 0.00 N ATOM 824 CA PRO T 54 91.884 9.046 5.950 1.00 0.00 C ATOM 825 C PRO T 54 91.518 8.395 7.285 1.00 0.00 C ATOM 826 O PRO T 54 91.294 7.188 7.357 1.00 0.00 O ATOM 827 CB PRO T 54 93.327 8.707 5.531 1.00 0.00 C ATOM 828 CG PRO T 54 94.143 9.885 5.961 1.00 0.00 C ATOM 829 CD PRO T 54 93.225 11.100 5.826 1.00 0.00 C ATOM 0 HA PRO T 54 91.144 8.671 5.243 1.00 0.00 H new ATOM 0 HB2 PRO T 54 93.672 7.791 6.011 1.00 0.00 H new ATOM 0 HB3 PRO T 54 93.399 8.549 4.455 1.00 0.00 H new ATOM 0 HG2 PRO T 54 94.488 9.768 6.988 1.00 0.00 H new ATOM 0 HG3 PRO T 54 95.030 9.994 5.338 1.00 0.00 H new ATOM 0 HD2 PRO T 54 93.464 11.868 6.562 1.00 0.00 H new ATOM 0 HD3 PRO T 54 93.313 11.563 4.843 1.00 0.00 H new ATOM 837 N GLU T 55 91.459 9.209 8.336 1.00 0.00 N ATOM 838 CA GLU T 55 91.117 8.707 9.663 1.00 0.00 C ATOM 839 C GLU T 55 89.604 8.604 9.823 1.00 0.00 C ATOM 840 O GLU T 55 89.101 7.715 10.509 1.00 0.00 O ATOM 841 CB GLU T 55 91.681 9.644 10.734 1.00 0.00 C ATOM 842 CG GLU T 55 91.495 9.012 12.115 1.00 0.00 C ATOM 843 CD GLU T 55 92.051 9.939 13.190 1.00 0.00 C ATOM 844 OE1 GLU T 55 92.653 10.938 12.831 1.00 0.00 O ATOM 845 OE2 GLU T 55 91.868 9.636 14.358 1.00 0.00 O ATOM 0 H GLU T 55 91.642 10.212 8.295 1.00 0.00 H new ATOM 0 HA GLU T 55 91.552 7.714 9.780 1.00 0.00 H new ATOM 0 HB2 GLU T 55 92.738 9.832 10.548 1.00 0.00 H new ATOM 0 HB3 GLU T 55 91.174 10.608 10.692 1.00 0.00 H new ATOM 0 HG2 GLU T 55 90.437 8.822 12.298 1.00 0.00 H new ATOM 0 HG3 GLU T 55 92.003 8.049 12.155 1.00 0.00 H new ATOM 852 N GLU T 56 88.883 9.524 9.187 1.00 0.00 N ATOM 853 CA GLU T 56 87.425 9.531 9.264 1.00 0.00 C ATOM 854 C GLU T 56 86.828 8.531 8.280 1.00 0.00 C ATOM 855 O GLU T 56 85.756 7.975 8.520 1.00 0.00 O ATOM 856 CB GLU T 56 86.895 10.933 8.953 1.00 0.00 C ATOM 857 CG GLU T 56 87.212 11.869 10.121 1.00 0.00 C ATOM 858 CD GLU T 56 86.899 13.311 9.733 1.00 0.00 C ATOM 859 OE1 GLU T 56 86.761 13.568 8.549 1.00 0.00 O ATOM 860 OE2 GLU T 56 86.802 14.136 10.627 1.00 0.00 O ATOM 0 H GLU T 56 89.281 10.270 8.616 1.00 0.00 H new ATOM 0 HA GLU T 56 87.133 9.245 10.274 1.00 0.00 H new ATOM 0 HB2 GLU T 56 87.350 11.310 8.037 1.00 0.00 H new ATOM 0 HB3 GLU T 56 85.819 10.897 8.783 1.00 0.00 H new ATOM 0 HG2 GLU T 56 86.627 11.584 10.996 1.00 0.00 H new ATOM 0 HG3 GLU T 56 88.263 11.778 10.396 1.00 0.00 H new ATOM 867 N LEU T 57 87.526 8.308 7.172 1.00 0.00 N ATOM 868 CA LEU T 57 87.053 7.373 6.158 1.00 0.00 C ATOM 869 C LEU T 57 87.109 5.940 6.681 1.00 0.00 C ATOM 870 O LEU T 57 86.156 5.175 6.526 1.00 0.00 O ATOM 871 CB LEU T 57 87.910 7.497 4.891 1.00 0.00 C ATOM 872 CG LEU T 57 87.533 8.779 4.116 1.00 0.00 C ATOM 873 CD1 LEU T 57 88.718 9.231 3.255 1.00 0.00 C ATOM 874 CD2 LEU T 57 86.326 8.514 3.200 1.00 0.00 C ATOM 0 H LEU T 57 88.415 8.758 6.954 1.00 0.00 H new ATOM 0 HA LEU T 57 86.018 7.617 5.919 1.00 0.00 H new ATOM 0 HB2 LEU T 57 88.966 7.522 5.159 1.00 0.00 H new ATOM 0 HB3 LEU T 57 87.763 6.623 4.256 1.00 0.00 H new ATOM 0 HG LEU T 57 87.278 9.556 4.836 1.00 0.00 H new ATOM 0 HD11 LEU T 57 88.448 10.135 2.710 1.00 0.00 H new ATOM 0 HD12 LEU T 57 89.576 9.436 3.895 1.00 0.00 H new ATOM 0 HD13 LEU T 57 88.974 8.443 2.546 1.00 0.00 H new ATOM 0 HD21 LEU T 57 86.072 9.426 2.660 1.00 0.00 H new ATOM 0 HD22 LEU T 57 86.576 7.728 2.487 1.00 0.00 H new ATOM 0 HD23 LEU T 57 85.474 8.200 3.803 1.00 0.00 H new ATOM 886 N GLN T 58 88.230 5.582 7.300 1.00 0.00 N ATOM 887 CA GLN T 58 88.396 4.237 7.840 1.00 0.00 C ATOM 888 C GLN T 58 87.155 3.825 8.629 1.00 0.00 C ATOM 889 O GLN T 58 86.910 2.637 8.843 1.00 0.00 O ATOM 890 CB GLN T 58 89.636 4.188 8.743 1.00 0.00 C ATOM 891 CG GLN T 58 89.703 2.849 9.494 1.00 0.00 C ATOM 892 CD GLN T 58 89.518 1.683 8.526 1.00 0.00 C ATOM 893 OE1 GLN T 58 88.544 0.938 8.629 1.00 0.00 O ATOM 894 NE2 GLN T 58 90.402 1.479 7.587 1.00 0.00 N ATOM 0 H GLN T 58 89.031 6.199 7.439 1.00 0.00 H new ATOM 0 HA GLN T 58 88.529 3.539 7.013 1.00 0.00 H new ATOM 0 HB2 GLN T 58 90.536 4.320 8.142 1.00 0.00 H new ATOM 0 HB3 GLN T 58 89.606 5.011 9.457 1.00 0.00 H new ATOM 0 HG2 GLN T 58 90.663 2.758 10.003 1.00 0.00 H new ATOM 0 HG3 GLN T 58 88.931 2.817 10.263 1.00 0.00 H new ATOM 0 HE21 GLN T 58 91.209 2.097 7.503 1.00 0.00 H new ATOM 0 HE22 GLN T 58 90.286 0.701 6.937 1.00 0.00 H new ATOM 903 N GLU T 59 86.376 4.813 9.055 1.00 0.00 N ATOM 904 CA GLU T 59 85.163 4.540 9.817 1.00 0.00 C ATOM 905 C GLU T 59 84.139 3.815 8.949 1.00 0.00 C ATOM 906 O GLU T 59 83.426 2.931 9.421 1.00 0.00 O ATOM 907 CB GLU T 59 84.562 5.850 10.331 1.00 0.00 C ATOM 908 CG GLU T 59 85.615 6.614 11.135 1.00 0.00 C ATOM 909 CD GLU T 59 85.009 7.890 11.709 1.00 0.00 C ATOM 910 OE1 GLU T 59 83.797 8.019 11.664 1.00 0.00 O ATOM 911 OE2 GLU T 59 85.766 8.720 12.186 1.00 0.00 O ATOM 0 H GLU T 59 86.560 5.802 8.888 1.00 0.00 H new ATOM 0 HA GLU T 59 85.423 3.904 10.663 1.00 0.00 H new ATOM 0 HB2 GLU T 59 84.217 6.457 9.494 1.00 0.00 H new ATOM 0 HB3 GLU T 59 83.692 5.643 10.955 1.00 0.00 H new ATOM 0 HG2 GLU T 59 85.994 5.987 11.942 1.00 0.00 H new ATOM 0 HG3 GLU T 59 86.464 6.860 10.497 1.00 0.00 H new ATOM 918 N MET T 60 84.076 4.195 7.676 1.00 0.00 N ATOM 919 CA MET T 60 83.139 3.573 6.748 1.00 0.00 C ATOM 920 C MET T 60 83.563 2.142 6.435 1.00 0.00 C ATOM 921 O MET T 60 82.724 1.259 6.262 1.00 0.00 O ATOM 922 CB MET T 60 83.078 4.384 5.449 1.00 0.00 C ATOM 923 CG MET T 60 82.309 5.688 5.689 1.00 0.00 C ATOM 924 SD MET T 60 80.533 5.343 5.718 1.00 0.00 S ATOM 925 CE MET T 60 80.237 5.537 3.942 1.00 0.00 C ATOM 0 H MET T 60 84.658 4.925 7.266 1.00 0.00 H new ATOM 0 HA MET T 60 82.154 3.554 7.214 1.00 0.00 H new ATOM 0 HB2 MET T 60 84.086 4.605 5.099 1.00 0.00 H new ATOM 0 HB3 MET T 60 82.590 3.801 4.668 1.00 0.00 H new ATOM 0 HG2 MET T 60 82.619 6.137 6.633 1.00 0.00 H new ATOM 0 HG3 MET T 60 82.538 6.408 4.903 1.00 0.00 H new ATOM 0 HE1 MET T 60 79.182 5.365 3.728 1.00 0.00 H new ATOM 0 HE2 MET T 60 80.509 6.547 3.636 1.00 0.00 H new ATOM 0 HE3 MET T 60 80.841 4.816 3.392 1.00 0.00 H new ATOM 935 N ILE T 61 84.872 1.920 6.365 1.00 0.00 N ATOM 936 CA ILE T 61 85.400 0.594 6.072 1.00 0.00 C ATOM 937 C ILE T 61 85.335 -0.291 7.316 1.00 0.00 C ATOM 938 O ILE T 61 85.499 -1.509 7.233 1.00 0.00 O ATOM 939 CB ILE T 61 86.851 0.706 5.584 1.00 0.00 C ATOM 940 CG1 ILE T 61 86.880 1.373 4.202 1.00 0.00 C ATOM 941 CG2 ILE T 61 87.476 -0.689 5.479 1.00 0.00 C ATOM 942 CD1 ILE T 61 86.381 2.821 4.294 1.00 0.00 C ATOM 0 H ILE T 61 85.583 2.638 6.507 1.00 0.00 H new ATOM 0 HA ILE T 61 84.793 0.140 5.289 1.00 0.00 H new ATOM 0 HB ILE T 61 87.418 1.306 6.296 1.00 0.00 H new ATOM 0 HG12 ILE T 61 87.895 1.356 3.805 1.00 0.00 H new ATOM 0 HG13 ILE T 61 86.256 0.811 3.507 1.00 0.00 H new ATOM 0 HG21 ILE T 61 88.506 -0.601 5.132 1.00 0.00 H new ATOM 0 HG22 ILE T 61 87.462 -1.168 6.458 1.00 0.00 H new ATOM 0 HG23 ILE T 61 86.905 -1.291 4.772 1.00 0.00 H new ATOM 0 HD11 ILE T 61 86.408 3.279 3.305 1.00 0.00 H new ATOM 0 HD12 ILE T 61 85.358 2.830 4.670 1.00 0.00 H new ATOM 0 HD13 ILE T 61 87.022 3.384 4.972 1.00 0.00 H new ATOM 954 N ASP T 62 85.100 0.330 8.469 1.00 0.00 N ATOM 955 CA ASP T 62 85.020 -0.410 9.724 1.00 0.00 C ATOM 956 C ASP T 62 83.641 -1.042 9.895 1.00 0.00 C ATOM 957 O ASP T 62 83.524 -2.187 10.331 1.00 0.00 O ATOM 958 CB ASP T 62 85.301 0.528 10.900 1.00 0.00 C ATOM 959 CG ASP T 62 85.331 -0.264 12.203 1.00 0.00 C ATOM 960 OD1 ASP T 62 84.274 -0.690 12.638 1.00 0.00 O ATOM 961 OD2 ASP T 62 86.410 -0.433 12.746 1.00 0.00 O ATOM 0 H ASP T 62 84.963 1.337 8.560 1.00 0.00 H new ATOM 0 HA ASP T 62 85.767 -1.203 9.701 1.00 0.00 H new ATOM 0 HB2 ASP T 62 86.254 1.036 10.751 1.00 0.00 H new ATOM 0 HB3 ASP T 62 84.533 1.300 10.952 1.00 0.00 H new ATOM 966 N GLU T 63 82.601 -0.287 9.556 1.00 0.00 N ATOM 967 CA GLU T 63 81.236 -0.785 9.684 1.00 0.00 C ATOM 968 C GLU T 63 80.919 -1.791 8.581 1.00 0.00 C ATOM 969 O GLU T 63 79.769 -1.923 8.163 1.00 0.00 O ATOM 970 CB GLU T 63 80.244 0.379 9.615 1.00 0.00 C ATOM 971 CG GLU T 63 80.591 1.279 8.427 1.00 0.00 C ATOM 972 CD GLU T 63 79.424 2.211 8.120 1.00 0.00 C ATOM 973 OE1 GLU T 63 78.620 2.435 9.011 1.00 0.00 O ATOM 974 OE2 GLU T 63 79.350 2.687 6.999 1.00 0.00 O ATOM 0 H GLU T 63 82.676 0.664 9.194 1.00 0.00 H new ATOM 0 HA GLU T 63 81.146 -1.284 10.649 1.00 0.00 H new ATOM 0 HB2 GLU T 63 79.228 -0.002 9.511 1.00 0.00 H new ATOM 0 HB3 GLU T 63 80.276 0.953 10.541 1.00 0.00 H new ATOM 0 HG2 GLU T 63 81.484 1.863 8.651 1.00 0.00 H new ATOM 0 HG3 GLU T 63 80.820 0.669 7.553 1.00 0.00 H new ATOM 981 N VAL T 64 81.944 -2.503 8.117 1.00 0.00 N ATOM 982 CA VAL T 64 81.759 -3.499 7.063 1.00 0.00 C ATOM 983 C VAL T 64 82.839 -4.575 7.150 1.00 0.00 C ATOM 984 O VAL T 64 82.585 -5.744 6.858 1.00 0.00 O ATOM 985 CB VAL T 64 81.816 -2.830 5.685 1.00 0.00 C ATOM 986 CG1 VAL T 64 80.545 -2.008 5.450 1.00 0.00 C ATOM 987 CG2 VAL T 64 83.035 -1.907 5.619 1.00 0.00 C ATOM 0 H VAL T 64 82.903 -2.411 8.451 1.00 0.00 H new ATOM 0 HA VAL T 64 80.782 -3.962 7.199 1.00 0.00 H new ATOM 0 HB VAL T 64 81.893 -3.599 4.917 1.00 0.00 H new ATOM 0 HG11 VAL T 64 80.593 -1.536 4.469 1.00 0.00 H new ATOM 0 HG12 VAL T 64 79.675 -2.663 5.495 1.00 0.00 H new ATOM 0 HG13 VAL T 64 80.461 -1.240 6.219 1.00 0.00 H new ATOM 0 HG21 VAL T 64 83.078 -1.430 4.640 1.00 0.00 H new ATOM 0 HG22 VAL T 64 82.955 -1.143 6.392 1.00 0.00 H new ATOM 0 HG23 VAL T 64 83.942 -2.490 5.778 1.00 0.00 H new ATOM 997 N ASP T 65 84.039 -4.175 7.553 1.00 0.00 N ATOM 998 CA ASP T 65 85.145 -5.119 7.674 1.00 0.00 C ATOM 999 C ASP T 65 84.819 -6.191 8.710 1.00 0.00 C ATOM 1000 O ASP T 65 85.367 -6.189 9.812 1.00 0.00 O ATOM 1001 CB ASP T 65 86.427 -4.380 8.079 1.00 0.00 C ATOM 1002 CG ASP T 65 87.023 -3.660 6.873 1.00 0.00 C ATOM 1003 OD1 ASP T 65 86.301 -3.463 5.909 1.00 0.00 O ATOM 1004 OD2 ASP T 65 88.193 -3.321 6.930 1.00 0.00 O ATOM 0 H ASP T 65 84.271 -3.213 7.800 1.00 0.00 H new ATOM 0 HA ASP T 65 85.298 -5.598 6.707 1.00 0.00 H new ATOM 0 HB2 ASP T 65 86.207 -3.662 8.869 1.00 0.00 H new ATOM 0 HB3 ASP T 65 87.151 -5.087 8.484 1.00 0.00 H new ATOM 1009 N GLU T 66 83.926 -7.105 8.347 1.00 0.00 N ATOM 1010 CA GLU T 66 83.538 -8.178 9.253 1.00 0.00 C ATOM 1011 C GLU T 66 84.713 -9.120 9.495 1.00 0.00 C ATOM 1012 O GLU T 66 84.842 -9.706 10.570 1.00 0.00 O ATOM 1013 CB GLU T 66 82.364 -8.963 8.664 1.00 0.00 C ATOM 1014 CG GLU T 66 81.091 -8.118 8.748 1.00 0.00 C ATOM 1015 CD GLU T 66 80.622 -8.025 10.197 1.00 0.00 C ATOM 1016 OE1 GLU T 66 80.133 -9.020 10.705 1.00 0.00 O ATOM 1017 OE2 GLU T 66 80.762 -6.961 10.777 1.00 0.00 O ATOM 0 H GLU T 66 83.461 -7.125 7.439 1.00 0.00 H new ATOM 0 HA GLU T 66 83.236 -7.737 10.203 1.00 0.00 H new ATOM 0 HB2 GLU T 66 82.572 -9.224 7.626 1.00 0.00 H new ATOM 0 HB3 GLU T 66 82.229 -9.898 9.207 1.00 0.00 H new ATOM 0 HG2 GLU T 66 81.280 -7.120 8.354 1.00 0.00 H new ATOM 0 HG3 GLU T 66 80.309 -8.561 8.132 1.00 0.00 H new ATOM 1024 N ASP T 67 85.569 -9.259 8.485 1.00 0.00 N ATOM 1025 CA ASP T 67 86.735 -10.130 8.592 1.00 0.00 C ATOM 1026 C ASP T 67 87.892 -9.395 9.259 1.00 0.00 C ATOM 1027 O ASP T 67 88.989 -9.939 9.396 1.00 0.00 O ATOM 1028 CB ASP T 67 87.163 -10.602 7.200 1.00 0.00 C ATOM 1029 CG ASP T 67 87.699 -9.424 6.391 1.00 0.00 C ATOM 1030 OD1 ASP T 67 87.148 -8.342 6.519 1.00 0.00 O ATOM 1031 OD2 ASP T 67 88.651 -9.622 5.655 1.00 0.00 O ATOM 0 H ASP T 67 85.477 -8.782 7.588 1.00 0.00 H new ATOM 0 HA ASP T 67 86.467 -10.993 9.202 1.00 0.00 H new ATOM 0 HB2 ASP T 67 87.929 -11.372 7.288 1.00 0.00 H new ATOM 0 HB3 ASP T 67 86.316 -11.053 6.683 1.00 0.00 H new ATOM 1036 N GLY T 68 87.643 -8.157 9.673 1.00 0.00 N ATOM 1037 CA GLY T 68 88.675 -7.358 10.323 1.00 0.00 C ATOM 1038 C GLY T 68 89.992 -7.453 9.561 1.00 0.00 C ATOM 1039 O GLY T 68 90.862 -8.254 9.904 1.00 0.00 O ATOM 0 H GLY T 68 86.743 -7.688 9.571 1.00 0.00 H new ATOM 0 HA2 GLY T 68 88.355 -6.317 10.378 1.00 0.00 H new ATOM 0 HA3 GLY T 68 88.817 -7.702 11.348 1.00 0.00 H new ATOM 1043 N SER T 69 90.132 -6.631 8.522 1.00 0.00 N ATOM 1044 CA SER T 69 91.347 -6.629 7.706 1.00 0.00 C ATOM 1045 C SER T 69 91.704 -5.209 7.274 1.00 0.00 C ATOM 1046 O SER T 69 92.802 -4.960 6.779 1.00 0.00 O ATOM 1047 CB SER T 69 91.141 -7.499 6.467 1.00 0.00 C ATOM 1048 OG SER T 69 89.929 -7.121 5.825 1.00 0.00 O ATOM 0 H SER T 69 89.423 -5.960 8.226 1.00 0.00 H new ATOM 0 HA SER T 69 92.164 -7.031 8.305 1.00 0.00 H new ATOM 0 HB2 SER T 69 91.981 -7.382 5.782 1.00 0.00 H new ATOM 0 HB3 SER T 69 91.104 -8.551 6.749 1.00 0.00 H new ATOM 0 HG SER T 69 90.134 -6.637 4.998 1.00 0.00 H new ATOM 1054 N GLY T 70 90.770 -4.283 7.464 1.00 0.00 N ATOM 1055 CA GLY T 70 91.003 -2.893 7.085 1.00 0.00 C ATOM 1056 C GLY T 70 90.999 -2.738 5.569 1.00 0.00 C ATOM 1057 O GLY T 70 91.856 -2.061 5.002 1.00 0.00 O ATOM 0 H GLY T 70 89.854 -4.466 7.874 1.00 0.00 H new ATOM 0 HA2 GLY T 70 90.232 -2.258 7.522 1.00 0.00 H new ATOM 0 HA3 GLY T 70 91.959 -2.557 7.487 1.00 0.00 H new ATOM 1061 N THR T 71 90.029 -3.374 4.918 1.00 0.00 N ATOM 1062 CA THR T 71 89.915 -3.307 3.463 1.00 0.00 C ATOM 1063 C THR T 71 88.462 -3.481 3.034 1.00 0.00 C ATOM 1064 O THR T 71 87.552 -3.436 3.863 1.00 0.00 O ATOM 1065 CB THR T 71 90.772 -4.400 2.820 1.00 0.00 C ATOM 1066 OG1 THR T 71 90.380 -5.667 3.330 1.00 0.00 O ATOM 1067 CG2 THR T 71 92.246 -4.153 3.142 1.00 0.00 C ATOM 0 H THR T 71 89.312 -3.940 5.373 1.00 0.00 H new ATOM 0 HA THR T 71 90.267 -2.329 3.134 1.00 0.00 H new ATOM 0 HB THR T 71 90.632 -4.383 1.739 1.00 0.00 H new ATOM 0 HG1 THR T 71 90.927 -6.369 2.918 1.00 0.00 H new ATOM 0 HG21 THR T 71 92.854 -4.932 2.683 1.00 0.00 H new ATOM 0 HG22 THR T 71 92.546 -3.181 2.750 1.00 0.00 H new ATOM 0 HG23 THR T 71 92.390 -4.169 4.222 1.00 0.00 H new ATOM 1075 N VAL T 72 88.249 -3.678 1.735 1.00 0.00 N ATOM 1076 CA VAL T 72 86.900 -3.856 1.201 1.00 0.00 C ATOM 1077 C VAL T 72 86.919 -4.799 0.002 1.00 0.00 C ATOM 1078 O VAL T 72 86.776 -4.367 -1.142 1.00 0.00 O ATOM 1079 CB VAL T 72 86.324 -2.505 0.775 1.00 0.00 C ATOM 1080 CG1 VAL T 72 84.856 -2.675 0.377 1.00 0.00 C ATOM 1081 CG2 VAL T 72 86.422 -1.517 1.940 1.00 0.00 C ATOM 0 H VAL T 72 88.990 -3.718 1.035 1.00 0.00 H new ATOM 0 HA VAL T 72 86.276 -4.289 1.983 1.00 0.00 H new ATOM 0 HB VAL T 72 86.890 -2.124 -0.075 1.00 0.00 H new ATOM 0 HG11 VAL T 72 84.447 -1.711 0.074 1.00 0.00 H new ATOM 0 HG12 VAL T 72 84.783 -3.377 -0.453 1.00 0.00 H new ATOM 0 HG13 VAL T 72 84.291 -3.058 1.227 1.00 0.00 H new ATOM 0 HG21 VAL T 72 86.011 -0.554 1.636 1.00 0.00 H new ATOM 0 HG22 VAL T 72 85.858 -1.900 2.790 1.00 0.00 H new ATOM 0 HG23 VAL T 72 87.467 -1.392 2.224 1.00 0.00 H new ATOM 1091 N ASP T 73 87.093 -6.089 0.271 1.00 0.00 N ATOM 1092 CA ASP T 73 87.123 -7.083 -0.795 1.00 0.00 C ATOM 1093 C ASP T 73 85.806 -7.075 -1.564 1.00 0.00 C ATOM 1094 O ASP T 73 85.039 -6.117 -1.482 1.00 0.00 O ATOM 1095 CB ASP T 73 87.371 -8.475 -0.209 1.00 0.00 C ATOM 1096 CG ASP T 73 86.270 -8.825 0.786 1.00 0.00 C ATOM 1097 OD1 ASP T 73 85.233 -8.184 0.741 1.00 0.00 O ATOM 1098 OD2 ASP T 73 86.481 -9.729 1.578 1.00 0.00 O ATOM 0 H ASP T 73 87.214 -6.468 1.210 1.00 0.00 H new ATOM 0 HA ASP T 73 87.934 -6.833 -1.480 1.00 0.00 H new ATOM 0 HB2 ASP T 73 87.399 -9.215 -1.008 1.00 0.00 H new ATOM 0 HB3 ASP T 73 88.342 -8.503 0.286 1.00 0.00 H new ATOM 1103 N PHE T 74 85.549 -8.146 -2.311 1.00 0.00 N ATOM 1104 CA PHE T 74 84.318 -8.250 -3.092 1.00 0.00 C ATOM 1105 C PHE T 74 83.189 -8.829 -2.243 1.00 0.00 C ATOM 1106 O PHE T 74 82.048 -8.927 -2.696 1.00 0.00 O ATOM 1107 CB PHE T 74 84.549 -9.146 -4.311 1.00 0.00 C ATOM 1108 CG PHE T 74 83.368 -9.039 -5.247 1.00 0.00 C ATOM 1109 CD1 PHE T 74 83.355 -8.059 -6.247 1.00 0.00 C ATOM 1110 CD2 PHE T 74 82.287 -9.917 -5.114 1.00 0.00 C ATOM 1111 CE1 PHE T 74 82.261 -7.959 -7.115 1.00 0.00 C ATOM 1112 CE2 PHE T 74 81.193 -9.817 -5.981 1.00 0.00 C ATOM 1113 CZ PHE T 74 81.179 -8.838 -6.981 1.00 0.00 C ATOM 0 H PHE T 74 86.172 -8.950 -2.392 1.00 0.00 H new ATOM 0 HA PHE T 74 84.034 -7.250 -3.421 1.00 0.00 H new ATOM 0 HB2 PHE T 74 85.463 -8.849 -4.826 1.00 0.00 H new ATOM 0 HB3 PHE T 74 84.683 -10.180 -3.995 1.00 0.00 H new ATOM 0 HD1 PHE T 74 84.189 -7.380 -6.349 1.00 0.00 H new ATOM 0 HD2 PHE T 74 82.297 -10.672 -4.342 1.00 0.00 H new ATOM 0 HE1 PHE T 74 82.252 -7.204 -7.888 1.00 0.00 H new ATOM 0 HE2 PHE T 74 80.359 -10.496 -5.878 1.00 0.00 H new ATOM 0 HZ PHE T 74 80.334 -8.760 -7.649 1.00 0.00 H new ATOM 1123 N ASP T 75 83.514 -9.214 -1.013 1.00 0.00 N ATOM 1124 CA ASP T 75 82.517 -9.785 -0.110 1.00 0.00 C ATOM 1125 C ASP T 75 81.693 -8.687 0.555 1.00 0.00 C ATOM 1126 O ASP T 75 80.638 -8.300 0.052 1.00 0.00 O ATOM 1127 CB ASP T 75 83.207 -10.627 0.965 1.00 0.00 C ATOM 1128 CG ASP T 75 83.875 -11.841 0.329 1.00 0.00 C ATOM 1129 OD1 ASP T 75 84.954 -11.679 -0.219 1.00 0.00 O ATOM 1130 OD2 ASP T 75 83.299 -12.913 0.398 1.00 0.00 O ATOM 0 H ASP T 75 84.452 -9.142 -0.619 1.00 0.00 H new ATOM 0 HA ASP T 75 81.849 -10.416 -0.696 1.00 0.00 H new ATOM 0 HB2 ASP T 75 83.950 -10.025 1.488 1.00 0.00 H new ATOM 0 HB3 ASP T 75 82.478 -10.951 1.708 1.00 0.00 H new ATOM 1135 N GLU T 76 82.178 -8.191 1.689 1.00 0.00 N ATOM 1136 CA GLU T 76 81.473 -7.140 2.417 1.00 0.00 C ATOM 1137 C GLU T 76 81.024 -6.032 1.467 1.00 0.00 C ATOM 1138 O GLU T 76 80.192 -5.198 1.822 1.00 0.00 O ATOM 1139 CB GLU T 76 82.378 -6.556 3.505 1.00 0.00 C ATOM 1140 CG GLU T 76 83.666 -6.019 2.876 1.00 0.00 C ATOM 1141 CD GLU T 76 84.723 -5.804 3.956 1.00 0.00 C ATOM 1142 OE1 GLU T 76 85.004 -6.746 4.678 1.00 0.00 O ATOM 1143 OE2 GLU T 76 85.236 -4.701 4.044 1.00 0.00 O ATOM 0 H GLU T 76 83.050 -8.497 2.122 1.00 0.00 H new ATOM 0 HA GLU T 76 80.590 -7.578 2.881 1.00 0.00 H new ATOM 0 HB2 GLU T 76 81.859 -5.755 4.032 1.00 0.00 H new ATOM 0 HB3 GLU T 76 82.615 -7.322 4.243 1.00 0.00 H new ATOM 0 HG2 GLU T 76 84.036 -6.721 2.128 1.00 0.00 H new ATOM 0 HG3 GLU T 76 83.465 -5.080 2.360 1.00 0.00 H new ATOM 1150 N PHE T 77 81.575 -6.034 0.257 1.00 0.00 N ATOM 1151 CA PHE T 77 81.217 -5.027 -0.736 1.00 0.00 C ATOM 1152 C PHE T 77 79.703 -4.863 -0.808 1.00 0.00 C ATOM 1153 O PHE T 77 79.181 -3.756 -0.680 1.00 0.00 O ATOM 1154 CB PHE T 77 81.750 -5.440 -2.110 1.00 0.00 C ATOM 1155 CG PHE T 77 81.572 -4.301 -3.086 1.00 0.00 C ATOM 1156 CD1 PHE T 77 80.318 -4.062 -3.661 1.00 0.00 C ATOM 1157 CD2 PHE T 77 82.662 -3.486 -3.420 1.00 0.00 C ATOM 1158 CE1 PHE T 77 80.153 -3.009 -4.568 1.00 0.00 C ATOM 1159 CE2 PHE T 77 82.496 -2.433 -4.328 1.00 0.00 C ATOM 1160 CZ PHE T 77 81.242 -2.194 -4.902 1.00 0.00 C ATOM 0 H PHE T 77 82.265 -6.716 -0.058 1.00 0.00 H new ATOM 0 HA PHE T 77 81.662 -4.077 -0.441 1.00 0.00 H new ATOM 0 HB2 PHE T 77 82.804 -5.708 -2.037 1.00 0.00 H new ATOM 0 HB3 PHE T 77 81.220 -6.324 -2.466 1.00 0.00 H new ATOM 0 HD1 PHE T 77 79.478 -4.690 -3.405 1.00 0.00 H new ATOM 0 HD2 PHE T 77 83.630 -3.670 -2.977 1.00 0.00 H new ATOM 0 HE1 PHE T 77 79.185 -2.825 -5.011 1.00 0.00 H new ATOM 0 HE2 PHE T 77 83.336 -1.805 -4.586 1.00 0.00 H new ATOM 0 HZ PHE T 77 81.114 -1.382 -5.602 1.00 0.00 H new ATOM 1170 N LEU T 78 79.005 -5.975 -1.015 1.00 0.00 N ATOM 1171 CA LEU T 78 77.550 -5.949 -1.104 1.00 0.00 C ATOM 1172 C LEU T 78 76.937 -5.641 0.258 1.00 0.00 C ATOM 1173 O LEU T 78 76.073 -4.771 0.379 1.00 0.00 O ATOM 1174 CB LEU T 78 77.032 -7.301 -1.605 1.00 0.00 C ATOM 1175 CG LEU T 78 77.702 -7.663 -2.939 1.00 0.00 C ATOM 1176 CD1 LEU T 78 77.463 -9.144 -3.240 1.00 0.00 C ATOM 1177 CD2 LEU T 78 77.115 -6.815 -4.078 1.00 0.00 C ATOM 0 H LEU T 78 79.421 -6.900 -1.124 1.00 0.00 H new ATOM 0 HA LEU T 78 77.261 -5.167 -1.806 1.00 0.00 H new ATOM 0 HB2 LEU T 78 77.237 -8.074 -0.865 1.00 0.00 H new ATOM 0 HB3 LEU T 78 75.950 -7.260 -1.732 1.00 0.00 H new ATOM 0 HG LEU T 78 78.771 -7.465 -2.863 1.00 0.00 H new ATOM 0 HD11 LEU T 78 77.937 -9.404 -4.186 1.00 0.00 H new ATOM 0 HD12 LEU T 78 77.889 -9.751 -2.441 1.00 0.00 H new ATOM 0 HD13 LEU T 78 76.392 -9.333 -3.307 1.00 0.00 H new ATOM 0 HD21 LEU T 78 77.599 -7.082 -5.017 1.00 0.00 H new ATOM 0 HD22 LEU T 78 76.044 -7.002 -4.156 1.00 0.00 H new ATOM 0 HD23 LEU T 78 77.285 -5.759 -3.870 1.00 0.00 H new ATOM 1189 N VAL T 79 77.388 -6.359 1.281 1.00 0.00 N ATOM 1190 CA VAL T 79 76.875 -6.155 2.630 1.00 0.00 C ATOM 1191 C VAL T 79 76.824 -4.668 2.968 1.00 0.00 C ATOM 1192 O VAL T 79 76.082 -4.248 3.856 1.00 0.00 O ATOM 1193 CB VAL T 79 77.765 -6.878 3.641 1.00 0.00 C ATOM 1194 CG1 VAL T 79 77.114 -6.828 5.025 1.00 0.00 C ATOM 1195 CG2 VAL T 79 77.938 -8.338 3.213 1.00 0.00 C ATOM 0 H VAL T 79 78.103 -7.082 1.203 1.00 0.00 H new ATOM 0 HA VAL T 79 75.864 -6.561 2.678 1.00 0.00 H new ATOM 0 HB VAL T 79 78.739 -6.390 3.681 1.00 0.00 H new ATOM 0 HG11 VAL T 79 77.749 -7.344 5.745 1.00 0.00 H new ATOM 0 HG12 VAL T 79 76.988 -5.789 5.331 1.00 0.00 H new ATOM 0 HG13 VAL T 79 76.140 -7.315 4.987 1.00 0.00 H new ATOM 0 HG21 VAL T 79 78.572 -8.855 3.933 1.00 0.00 H new ATOM 0 HG22 VAL T 79 76.963 -8.824 3.174 1.00 0.00 H new ATOM 0 HG23 VAL T 79 78.402 -8.376 2.227 1.00 0.00 H new ATOM 1205 N MET T 80 77.618 -3.876 2.255 1.00 0.00 N ATOM 1206 CA MET T 80 77.655 -2.437 2.492 1.00 0.00 C ATOM 1207 C MET T 80 76.362 -1.781 2.014 1.00 0.00 C ATOM 1208 O MET T 80 75.617 -1.208 2.809 1.00 0.00 O ATOM 1209 CB MET T 80 78.848 -1.817 1.760 1.00 0.00 C ATOM 1210 CG MET T 80 78.970 -0.339 2.139 1.00 0.00 C ATOM 1211 SD MET T 80 80.389 0.388 1.279 1.00 0.00 S ATOM 1212 CE MET T 80 81.658 -0.102 2.473 1.00 0.00 C ATOM 0 H MET T 80 78.239 -4.202 1.515 1.00 0.00 H new ATOM 0 HA MET T 80 77.759 -2.267 3.564 1.00 0.00 H new ATOM 0 HB2 MET T 80 79.764 -2.347 2.022 1.00 0.00 H new ATOM 0 HB3 MET T 80 78.719 -1.917 0.682 1.00 0.00 H new ATOM 0 HG2 MET T 80 78.057 0.193 1.871 1.00 0.00 H new ATOM 0 HG3 MET T 80 79.093 -0.238 3.217 1.00 0.00 H new ATOM 0 HE1 MET T 80 82.624 0.296 2.162 1.00 0.00 H new ATOM 0 HE2 MET T 80 81.403 0.292 3.457 1.00 0.00 H new ATOM 0 HE3 MET T 80 81.713 -1.190 2.520 1.00 0.00 H new ATOM 1222 N MET T 81 76.102 -1.867 0.713 1.00 0.00 N ATOM 1223 CA MET T 81 74.895 -1.274 0.147 1.00 0.00 C ATOM 1224 C MET T 81 73.658 -2.057 0.579 1.00 0.00 C ATOM 1225 O MET T 81 72.664 -1.475 1.012 1.00 0.00 O ATOM 1226 CB MET T 81 74.981 -1.261 -1.383 1.00 0.00 C ATOM 1227 CG MET T 81 76.255 -0.535 -1.832 1.00 0.00 C ATOM 1228 SD MET T 81 77.655 -1.681 -1.769 1.00 0.00 S ATOM 1229 CE MET T 81 78.966 -0.453 -1.984 1.00 0.00 C ATOM 0 H MET T 81 76.704 -2.337 0.037 1.00 0.00 H new ATOM 0 HA MET T 81 74.813 -0.251 0.515 1.00 0.00 H new ATOM 0 HB2 MET T 81 74.981 -2.282 -1.764 1.00 0.00 H new ATOM 0 HB3 MET T 81 74.104 -0.766 -1.800 1.00 0.00 H new ATOM 0 HG2 MET T 81 76.130 -0.151 -2.845 1.00 0.00 H new ATOM 0 HG3 MET T 81 76.444 0.323 -1.187 1.00 0.00 H new ATOM 0 HE1 MET T 81 79.936 -0.927 -1.834 1.00 0.00 H new ATOM 0 HE2 MET T 81 78.916 -0.039 -2.991 1.00 0.00 H new ATOM 0 HE3 MET T 81 78.837 0.348 -1.256 1.00 0.00 H new ATOM 1239 N VAL T 82 73.726 -3.379 0.456 1.00 0.00 N ATOM 1240 CA VAL T 82 72.605 -4.233 0.835 1.00 0.00 C ATOM 1241 C VAL T 82 72.018 -3.793 2.173 1.00 0.00 C ATOM 1242 O VAL T 82 70.806 -3.626 2.304 1.00 0.00 O ATOM 1243 CB VAL T 82 73.068 -5.687 0.932 1.00 0.00 C ATOM 1244 CG1 VAL T 82 71.904 -6.563 1.400 1.00 0.00 C ATOM 1245 CG2 VAL T 82 73.541 -6.163 -0.442 1.00 0.00 C ATOM 0 H VAL T 82 74.540 -3.880 0.099 1.00 0.00 H new ATOM 0 HA VAL T 82 71.834 -4.146 0.070 1.00 0.00 H new ATOM 0 HB VAL T 82 73.888 -5.760 1.646 1.00 0.00 H new ATOM 0 HG11 VAL T 82 72.234 -7.600 1.469 1.00 0.00 H new ATOM 0 HG12 VAL T 82 71.564 -6.224 2.379 1.00 0.00 H new ATOM 0 HG13 VAL T 82 71.084 -6.490 0.686 1.00 0.00 H new ATOM 0 HG21 VAL T 82 73.871 -7.200 -0.374 1.00 0.00 H new ATOM 0 HG22 VAL T 82 72.720 -6.090 -1.155 1.00 0.00 H new ATOM 0 HG23 VAL T 82 74.370 -5.539 -0.778 1.00 0.00 H new ATOM 1255 N ARG T 83 72.885 -3.607 3.162 1.00 0.00 N ATOM 1256 CA ARG T 83 72.439 -3.186 4.487 1.00 0.00 C ATOM 1257 C ARG T 83 71.910 -1.757 4.445 1.00 0.00 C ATOM 1258 O ARG T 83 70.732 -1.513 4.710 1.00 0.00 O ATOM 1259 CB ARG T 83 73.599 -3.275 5.481 1.00 0.00 C ATOM 1260 CG ARG T 83 73.892 -4.743 5.797 1.00 0.00 C ATOM 1261 CD ARG T 83 74.995 -4.828 6.854 1.00 0.00 C ATOM 1262 NE ARG T 83 74.500 -4.343 8.138 1.00 0.00 N ATOM 1263 CZ ARG T 83 75.334 -4.076 9.139 1.00 0.00 C ATOM 1264 NH1 ARG T 83 76.618 -4.248 8.982 1.00 0.00 N ATOM 1265 NH2 ARG T 83 74.867 -3.643 10.278 1.00 0.00 N ATOM 0 H ARG T 83 73.893 -3.739 3.074 1.00 0.00 H new ATOM 0 HA ARG T 83 71.635 -3.849 4.807 1.00 0.00 H new ATOM 0 HB2 ARG T 83 74.486 -2.798 5.064 1.00 0.00 H new ATOM 0 HB3 ARG T 83 73.349 -2.738 6.396 1.00 0.00 H new ATOM 0 HG2 ARG T 83 72.989 -5.235 6.158 1.00 0.00 H new ATOM 0 HG3 ARG T 83 74.200 -5.266 4.892 1.00 0.00 H new ATOM 0 HD2 ARG T 83 75.335 -5.859 6.953 1.00 0.00 H new ATOM 0 HD3 ARG T 83 75.855 -4.237 6.541 1.00 0.00 H new ATOM 0 HE ARG T 83 73.498 -4.206 8.270 1.00 0.00 H new ATOM 0 HH11 ARG T 83 76.982 -4.587 8.092 1.00 0.00 H new ATOM 0 HH12 ARG T 83 77.258 -4.043 9.750 1.00 0.00 H new ATOM 0 HH21 ARG T 83 73.863 -3.510 10.400 1.00 0.00 H new ATOM 0 HH22 ARG T 83 75.506 -3.438 11.046 1.00 0.00 H new ATOM 1279 N SER T 84 72.787 -0.816 4.109 1.00 0.00 N ATOM 1280 CA SER T 84 72.395 0.588 4.037 1.00 0.00 C ATOM 1281 C SER T 84 71.088 0.741 3.267 1.00 0.00 C ATOM 1282 O SER T 84 70.295 1.641 3.545 1.00 0.00 O ATOM 1283 CB SER T 84 73.492 1.400 3.348 1.00 0.00 C ATOM 1284 OG SER T 84 74.650 1.418 4.172 1.00 0.00 O ATOM 0 H SER T 84 73.765 -0.997 3.884 1.00 0.00 H new ATOM 0 HA SER T 84 72.251 0.958 5.052 1.00 0.00 H new ATOM 0 HB2 SER T 84 73.729 0.963 2.378 1.00 0.00 H new ATOM 0 HB3 SER T 84 73.146 2.417 3.164 1.00 0.00 H new ATOM 0 HG SER T 84 75.203 0.633 3.976 1.00 0.00 H new ATOM 1290 N MET T 85 70.869 -0.143 2.298 1.00 0.00 N ATOM 1291 CA MET T 85 69.654 -0.095 1.494 1.00 0.00 C ATOM 1292 C MET T 85 68.476 -0.682 2.265 1.00 0.00 C ATOM 1293 O MET T 85 67.557 0.039 2.657 1.00 0.00 O ATOM 1294 CB MET T 85 69.857 -0.879 0.195 1.00 0.00 C ATOM 1295 CG MET T 85 70.789 -0.099 -0.734 1.00 0.00 C ATOM 1296 SD MET T 85 69.884 1.279 -1.480 1.00 0.00 S ATOM 1297 CE MET T 85 70.832 1.366 -3.019 1.00 0.00 C ATOM 0 H MET T 85 71.512 -0.896 2.052 1.00 0.00 H new ATOM 0 HA MET T 85 69.437 0.947 1.260 1.00 0.00 H new ATOM 0 HB2 MET T 85 70.281 -1.859 0.412 1.00 0.00 H new ATOM 0 HB3 MET T 85 68.897 -1.048 -0.294 1.00 0.00 H new ATOM 0 HG2 MET T 85 71.647 0.276 -0.175 1.00 0.00 H new ATOM 0 HG3 MET T 85 71.178 -0.756 -1.512 1.00 0.00 H new ATOM 0 HE1 MET T 85 70.437 2.166 -3.645 1.00 0.00 H new ATOM 0 HE2 MET T 85 71.879 1.567 -2.791 1.00 0.00 H new ATOM 0 HE3 MET T 85 70.752 0.417 -3.549 1.00 0.00 H new ATOM 1307 N LYS T 86 68.509 -1.993 2.479 1.00 0.00 N ATOM 1308 CA LYS T 86 67.438 -2.667 3.204 1.00 0.00 C ATOM 1309 C LYS T 86 67.153 -1.957 4.524 1.00 0.00 C ATOM 1310 O LYS T 86 66.062 -2.078 5.081 1.00 0.00 O ATOM 1311 CB LYS T 86 67.828 -4.121 3.479 1.00 0.00 C ATOM 1312 CG LYS T 86 66.594 -4.902 3.937 1.00 0.00 C ATOM 1313 CD LYS T 86 66.996 -6.340 4.273 1.00 0.00 C ATOM 1314 CE LYS T 86 65.741 -7.206 4.395 1.00 0.00 C ATOM 1315 NZ LYS T 86 64.853 -6.647 5.454 1.00 0.00 N ATOM 0 H LYS T 86 69.260 -2.607 2.163 1.00 0.00 H new ATOM 0 HA LYS T 86 66.538 -2.642 2.590 1.00 0.00 H new ATOM 0 HB2 LYS T 86 68.245 -4.573 2.579 1.00 0.00 H new ATOM 0 HB3 LYS T 86 68.603 -4.162 4.245 1.00 0.00 H new ATOM 0 HG2 LYS T 86 66.151 -4.423 4.810 1.00 0.00 H new ATOM 0 HG3 LYS T 86 65.837 -4.899 3.153 1.00 0.00 H new ATOM 0 HD2 LYS T 86 67.650 -6.737 3.497 1.00 0.00 H new ATOM 0 HD3 LYS T 86 67.559 -6.363 5.206 1.00 0.00 H new ATOM 0 HE2 LYS T 86 65.213 -7.237 3.442 1.00 0.00 H new ATOM 0 HE3 LYS T 86 66.016 -8.232 4.640 1.00 0.00 H new ATOM 0 HZ1 LYS T 86 64.148 -7.361 5.729 1.00 0.00 H new ATOM 0 HZ2 LYS T 86 65.424 -6.386 6.284 1.00 0.00 H new ATOM 0 HZ3 LYS T 86 64.367 -5.803 5.089 1.00 0.00 H new ATOM 1329 N ASP T 87 68.141 -1.217 5.019 1.00 0.00 N ATOM 1330 CA ASP T 87 67.986 -0.490 6.276 1.00 0.00 C ATOM 1331 C ASP T 87 68.983 0.661 6.355 1.00 0.00 C ATOM 1332 O ASP T 87 70.157 0.457 6.663 1.00 0.00 O ATOM 1333 CB ASP T 87 68.203 -1.439 7.457 1.00 0.00 C ATOM 1334 CG ASP T 87 67.253 -2.627 7.354 1.00 0.00 C ATOM 1335 OD1 ASP T 87 66.133 -2.507 7.819 1.00 0.00 O ATOM 1336 OD2 ASP T 87 67.662 -3.641 6.811 1.00 0.00 O ATOM 0 H ASP T 87 69.051 -1.105 4.573 1.00 0.00 H new ATOM 0 HA ASP T 87 66.976 -0.083 6.318 1.00 0.00 H new ATOM 0 HB2 ASP T 87 69.235 -1.789 7.468 1.00 0.00 H new ATOM 0 HB3 ASP T 87 68.036 -0.909 8.395 1.00 0.00 H new ATOM 1341 N ASP T 88 68.505 1.870 6.077 1.00 0.00 N ATOM 1342 CA ASP T 88 69.365 3.048 6.121 1.00 0.00 C ATOM 1343 C ASP T 88 69.583 3.498 7.562 1.00 0.00 C ATOM 1344 O ASP T 88 68.627 3.731 8.302 1.00 0.00 O ATOM 1345 CB ASP T 88 68.730 4.186 5.320 1.00 0.00 C ATOM 1346 CG ASP T 88 67.280 4.381 5.749 1.00 0.00 C ATOM 1347 OD1 ASP T 88 67.067 4.812 6.870 1.00 0.00 O ATOM 1348 OD2 ASP T 88 66.403 4.095 4.950 1.00 0.00 O ATOM 0 H ASP T 88 67.536 2.059 5.821 1.00 0.00 H new ATOM 0 HA ASP T 88 70.329 2.789 5.684 1.00 0.00 H new ATOM 0 HB2 ASP T 88 69.291 5.108 5.475 1.00 0.00 H new ATOM 0 HB3 ASP T 88 68.775 3.961 4.254 1.00 0.00 H new ATOM 1353 N SER T 89 70.847 3.617 7.954 1.00 0.00 N ATOM 1354 CA SER T 89 71.180 4.041 9.310 1.00 0.00 C ATOM 1355 C SER T 89 72.662 4.382 9.416 1.00 0.00 C ATOM 1356 O SER T 89 73.313 4.435 8.386 1.00 0.00 O ATOM 1357 CB SER T 89 70.838 2.928 10.301 1.00 0.00 C ATOM 1358 OG SER T 89 71.874 1.955 10.291 1.00 0.00 O ATOM 1359 OXT SER T 89 73.125 4.584 10.527 1.00 0.00 O ATOM 0 H SER T 89 71.653 3.428 7.358 1.00 0.00 H new ATOM 0 HA SER T 89 70.597 4.931 9.547 1.00 0.00 H new ATOM 0 HB2 SER T 89 70.721 3.341 11.303 1.00 0.00 H new ATOM 0 HB3 SER T 89 69.887 2.467 10.033 1.00 0.00 H new ATOM 0 HG SER T 89 71.658 1.241 10.927 1.00 0.00 H new