USER MOD reduce.3.24.130724 H: found=0, std=0, add=986, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 985 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 96 THR OG1 : rot 81:sc= 0.928 USER MOD Set 1.2: A 97 ASN :FLIP amide:sc= 0.878 F(o=0.48,f=1.8) USER MOD Set 2.1: A 65 LYS NZ :NH3+ 154:sc= 0 (180deg=-0.456) USER MOD Set 2.2: A 68 SER OG : rot 180:sc= 0 USER MOD Set 3.1: A 23 TYR OH : rot 90:sc= -0.364 USER MOD Set 3.2: A 109 MET CE :methyl 178:sc= -0.757 (180deg=-0.856) USER MOD Set 3.3: A 112 HIS :FLIP no HE2:sc= -14.7! C(o=-19!,f=-16!) USER MOD Set 4.1: A 18 TYR OH : rot 130:sc= -0.0145 USER MOD Set 4.2: A 92 ASN : amide:sc= 0.195 K(o=0.18,f=-5.3!) USER MOD Single : A 1 PHE N :NH3+ -143:sc= 0.544 (180deg=-0.00987) USER MOD Single : A 3 LYS NZ :NH3+ 164:sc=-0.00519 (180deg=-0.152) USER MOD Single : A 10 GLN : amide:sc=-0.000828 X(o=-0.00083,f=-0.16) USER MOD Single : A 12 TYR OH : rot 30:sc= 0 USER MOD Single : A 20 THR OG1 : rot 72:sc= 0.453 USER MOD Single : A 24 SER OG : rot -106:sc= 0.451 USER MOD Single : A 27 SER OG : rot 180:sc= -0.0559 USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 GLN : amide:sc= 0 X(o=0,f=-0.022) USER MOD Single : A 30 ASN :FLIP amide:sc= -1.55! F(o=-2.6,f=-1.5!) USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 GLN : amide:sc= -1.91 K(o=-1.9,f=-3.6!) USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 GLN : amide:sc= -0.0172 X(o=-0.017,f=-0.3) USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 MET CE :methyl 133:sc= -9.81! (180deg=-12.7!) USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 57 ASN : amide:sc= -1.38 K(o=-1.4,f=-2.3!) USER MOD Single : A 59 TYR OH : rot 180:sc= 0 USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 SER OG : rot 180:sc= -0.0407 USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 SER OG : rot 180:sc= 0 USER MOD Single : A 72 MET CE :methyl -121:sc= -4.98! (180deg=-14.1!) USER MOD Single : A 73 THR OG1 : rot 56:sc= -5.26! USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 LYS NZ :NH3+ 154:sc= 0 (180deg=-0.912) USER MOD Single : A 79 SER OG : rot 180:sc= 0 USER MOD Single : A 82 THR OG1 : rot -70:sc= -2.47! USER MOD Single : A 83 SER OG : rot -53:sc= 1.13 USER MOD Single : A 84 ASN : amide:sc= -0.0426 X(o=-0.043,f=0) USER MOD Single : A 87 ASN : amide:sc= -4.1! C(o=-4.1!,f=-7.7!) USER MOD Single : A 98 THR OG1 : rot -130:sc= -0.121 USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD Single : A 107 THR OG1 : rot -154:sc= 1.31 USER MOD Single : A 108 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 110 SER OG : rot 180:sc= 0 USER MOD Single : A 118 CYS SG : rot 180:sc= 0 USER MOD Single : A 119 THR OG1 : rot 180:sc= -0.172 USER MOD ----------------------------------------------------------------- ATOM 1 N PHE A 1 17.031 4.450 31.271 1.00 0.00 N ATOM 2 CA PHE A 1 17.936 4.711 30.121 1.00 0.00 C ATOM 3 C PHE A 1 17.218 5.482 29.019 1.00 0.00 C ATOM 4 O PHE A 1 17.785 6.393 28.415 1.00 0.00 O ATOM 5 CB PHE A 1 18.441 3.370 29.585 1.00 0.00 C ATOM 6 CG PHE A 1 17.352 2.489 29.046 1.00 0.00 C ATOM 7 CD1 PHE A 1 16.914 2.627 27.738 1.00 0.00 C ATOM 8 CD2 PHE A 1 16.765 1.523 29.847 1.00 0.00 C ATOM 9 CE1 PHE A 1 15.911 1.817 27.240 1.00 0.00 C ATOM 10 CE2 PHE A 1 15.762 0.710 29.353 1.00 0.00 C ATOM 11 CZ PHE A 1 15.334 0.858 28.049 1.00 0.00 C ATOM 0 H1 PHE A 1 17.567 4.527 32.159 1.00 0.00 H new ATOM 0 H2 PHE A 1 16.260 5.147 31.271 1.00 0.00 H new ATOM 0 H3 PHE A 1 16.632 3.493 31.189 1.00 0.00 H new ATOM 0 HA PHE A 1 18.774 5.322 30.456 1.00 0.00 H new ATOM 0 HB2 PHE A 1 19.171 3.555 28.797 1.00 0.00 H new ATOM 0 HB3 PHE A 1 18.962 2.842 30.384 1.00 0.00 H new ATOM 0 HD1 PHE A 1 17.361 3.376 27.101 1.00 0.00 H new ATOM 0 HD2 PHE A 1 17.095 1.404 30.869 1.00 0.00 H new ATOM 0 HE1 PHE A 1 15.579 1.934 26.219 1.00 0.00 H new ATOM 0 HE2 PHE A 1 15.313 -0.041 29.987 1.00 0.00 H new ATOM 0 HZ PHE A 1 14.549 0.225 27.662 1.00 0.00 H new ATOM 22 N ALA A 2 15.968 5.112 28.762 1.00 0.00 N ATOM 23 CA ALA A 2 15.172 5.769 27.732 1.00 0.00 C ATOM 24 C ALA A 2 13.681 5.641 28.024 1.00 0.00 C ATOM 25 O ALA A 2 12.967 6.640 28.111 1.00 0.00 O ATOM 26 CB ALA A 2 15.497 5.188 26.364 1.00 0.00 C ATOM 0 H ALA A 2 15.484 4.360 29.253 1.00 0.00 H new ATOM 0 HA ALA A 2 15.425 6.829 27.733 1.00 0.00 H new ATOM 0 HB1 ALA A 2 14.896 5.687 25.604 1.00 0.00 H new ATOM 0 HB2 ALA A 2 16.554 5.339 26.147 1.00 0.00 H new ATOM 0 HB3 ALA A 2 15.274 4.121 26.360 1.00 0.00 H new ATOM 32 N LYS A 3 13.217 4.405 28.173 1.00 0.00 N ATOM 33 CA LYS A 3 11.811 4.145 28.455 1.00 0.00 C ATOM 34 C LYS A 3 10.924 4.671 27.331 1.00 0.00 C ATOM 35 O LYS A 3 10.804 5.880 27.136 1.00 0.00 O ATOM 36 CB LYS A 3 11.408 4.789 29.783 1.00 0.00 C ATOM 37 CG LYS A 3 11.614 3.884 30.987 1.00 0.00 C ATOM 38 CD LYS A 3 11.868 4.687 32.252 1.00 0.00 C ATOM 39 CE LYS A 3 12.460 3.821 33.352 1.00 0.00 C ATOM 40 NZ LYS A 3 13.877 3.456 33.070 1.00 0.00 N ATOM 0 H LYS A 3 13.795 3.567 28.103 1.00 0.00 H new ATOM 0 HA LYS A 3 11.674 3.066 28.526 1.00 0.00 H new ATOM 0 HB2 LYS A 3 11.985 5.703 29.923 1.00 0.00 H new ATOM 0 HB3 LYS A 3 10.358 5.079 29.733 1.00 0.00 H new ATOM 0 HG2 LYS A 3 10.735 3.255 31.125 1.00 0.00 H new ATOM 0 HG3 LYS A 3 12.457 3.218 30.803 1.00 0.00 H new ATOM 0 HD2 LYS A 3 12.547 5.511 32.031 1.00 0.00 H new ATOM 0 HD3 LYS A 3 10.933 5.128 32.598 1.00 0.00 H new ATOM 0 HE2 LYS A 3 12.404 4.352 34.302 1.00 0.00 H new ATOM 0 HE3 LYS A 3 11.866 2.914 33.459 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 14.326 3.107 33.941 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 13.906 2.712 32.344 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 14.390 4.294 32.728 1.00 0.00 H new ATOM 54 N LEU A 4 10.304 3.754 26.596 1.00 0.00 N ATOM 55 CA LEU A 4 9.428 4.126 25.490 1.00 0.00 C ATOM 56 C LEU A 4 8.076 3.429 25.610 1.00 0.00 C ATOM 57 O LEU A 4 7.987 2.205 25.515 1.00 0.00 O ATOM 58 CB LEU A 4 10.081 3.772 24.153 1.00 0.00 C ATOM 59 CG LEU A 4 11.389 4.507 23.856 1.00 0.00 C ATOM 60 CD1 LEU A 4 12.239 3.710 22.879 1.00 0.00 C ATOM 61 CD2 LEU A 4 11.104 5.897 23.307 1.00 0.00 C ATOM 0 H LEU A 4 10.391 2.749 26.746 1.00 0.00 H new ATOM 0 HA LEU A 4 9.267 5.203 25.533 1.00 0.00 H new ATOM 0 HB2 LEU A 4 10.272 2.699 24.132 1.00 0.00 H new ATOM 0 HB3 LEU A 4 9.373 3.985 23.352 1.00 0.00 H new ATOM 0 HG LEU A 4 11.946 4.612 24.787 1.00 0.00 H new ATOM 0 HD11 LEU A 4 13.166 4.248 22.680 1.00 0.00 H new ATOM 0 HD12 LEU A 4 12.471 2.736 23.309 1.00 0.00 H new ATOM 0 HD13 LEU A 4 11.691 3.574 21.947 1.00 0.00 H new ATOM 0 HD21 LEU A 4 12.045 6.407 23.101 1.00 0.00 H new ATOM 0 HD22 LEU A 4 10.527 5.813 22.386 1.00 0.00 H new ATOM 0 HD23 LEU A 4 10.535 6.468 24.040 1.00 0.00 H new ATOM 73 N VAL A 5 7.027 4.217 25.820 1.00 0.00 N ATOM 74 CA VAL A 5 5.680 3.676 25.952 1.00 0.00 C ATOM 75 C VAL A 5 4.908 3.797 24.641 1.00 0.00 C ATOM 76 O VAL A 5 4.965 4.827 23.969 1.00 0.00 O ATOM 77 CB VAL A 5 4.895 4.391 27.070 1.00 0.00 C ATOM 78 CG1 VAL A 5 4.742 5.872 26.758 1.00 0.00 C ATOM 79 CG2 VAL A 5 3.536 3.738 27.274 1.00 0.00 C ATOM 0 H VAL A 5 7.084 5.232 25.902 1.00 0.00 H new ATOM 0 HA VAL A 5 5.785 2.622 26.211 1.00 0.00 H new ATOM 0 HB VAL A 5 5.460 4.297 27.998 1.00 0.00 H new ATOM 0 HG11 VAL A 5 4.185 6.357 27.560 1.00 0.00 H new ATOM 0 HG12 VAL A 5 5.728 6.330 26.672 1.00 0.00 H new ATOM 0 HG13 VAL A 5 4.203 5.992 25.818 1.00 0.00 H new ATOM 0 HG21 VAL A 5 2.998 4.257 28.067 1.00 0.00 H new ATOM 0 HG22 VAL A 5 2.962 3.795 26.349 1.00 0.00 H new ATOM 0 HG23 VAL A 5 3.673 2.693 27.552 1.00 0.00 H new ATOM 89 N ARG A 6 4.187 2.739 24.284 1.00 0.00 N ATOM 90 CA ARG A 6 3.405 2.728 23.054 1.00 0.00 C ATOM 91 C ARG A 6 2.302 1.674 23.121 1.00 0.00 C ATOM 92 O ARG A 6 2.483 0.543 22.668 1.00 0.00 O ATOM 93 CB ARG A 6 4.310 2.459 21.851 1.00 0.00 C ATOM 94 CG ARG A 6 4.942 3.715 21.272 1.00 0.00 C ATOM 95 CD ARG A 6 5.612 3.436 19.937 1.00 0.00 C ATOM 96 NE ARG A 6 5.513 4.575 19.027 1.00 0.00 N ATOM 97 CZ ARG A 6 4.413 4.884 18.343 1.00 0.00 C ATOM 98 NH1 ARG A 6 3.319 4.144 18.464 1.00 0.00 N ATOM 99 NH2 ARG A 6 4.409 5.937 17.537 1.00 0.00 N ATOM 0 H ARG A 6 4.128 1.879 24.829 1.00 0.00 H new ATOM 0 HA ARG A 6 2.942 3.708 22.939 1.00 0.00 H new ATOM 0 HB2 ARG A 6 5.100 1.769 22.148 1.00 0.00 H new ATOM 0 HB3 ARG A 6 3.729 1.963 21.073 1.00 0.00 H new ATOM 0 HG2 ARG A 6 4.178 4.482 21.144 1.00 0.00 H new ATOM 0 HG3 ARG A 6 5.677 4.111 21.973 1.00 0.00 H new ATOM 0 HD2 ARG A 6 6.662 3.194 20.102 1.00 0.00 H new ATOM 0 HD3 ARG A 6 5.152 2.562 19.476 1.00 0.00 H new ATOM 0 HE ARG A 6 6.334 5.168 18.909 1.00 0.00 H new ATOM 0 HH11 ARG A 6 3.317 3.334 19.083 1.00 0.00 H new ATOM 0 HH12 ARG A 6 2.479 4.385 17.938 1.00 0.00 H new ATOM 0 HH21 ARG A 6 5.248 6.509 17.441 1.00 0.00 H new ATOM 0 HH22 ARG A 6 3.567 6.175 17.013 1.00 0.00 H new ATOM 113 N PRO A 7 1.137 2.032 23.688 1.00 0.00 N ATOM 114 CA PRO A 7 0.002 1.111 23.812 1.00 0.00 C ATOM 115 C PRO A 7 -0.364 0.461 22.480 1.00 0.00 C ATOM 116 O PRO A 7 -0.094 1.015 21.415 1.00 0.00 O ATOM 117 CB PRO A 7 -1.135 2.012 24.298 1.00 0.00 C ATOM 118 CG PRO A 7 -0.456 3.142 24.990 1.00 0.00 C ATOM 119 CD PRO A 7 0.836 3.362 24.253 1.00 0.00 C ATOM 0 HA PRO A 7 0.222 0.281 24.483 1.00 0.00 H new ATOM 0 HB2 PRO A 7 -1.743 2.366 23.465 1.00 0.00 H new ATOM 0 HB3 PRO A 7 -1.802 1.477 24.974 1.00 0.00 H new ATOM 0 HG2 PRO A 7 -1.074 4.040 24.971 1.00 0.00 H new ATOM 0 HG3 PRO A 7 -0.272 2.904 26.038 1.00 0.00 H new ATOM 0 HD2 PRO A 7 0.730 4.116 23.473 1.00 0.00 H new ATOM 0 HD3 PRO A 7 1.627 3.703 24.921 1.00 0.00 H new ATOM 127 N PRO A 8 -0.988 -0.729 22.525 1.00 0.00 N ATOM 128 CA PRO A 8 -1.392 -1.454 21.315 1.00 0.00 C ATOM 129 C PRO A 8 -2.214 -0.588 20.367 1.00 0.00 C ATOM 130 O PRO A 8 -1.812 -0.340 19.230 1.00 0.00 O ATOM 131 CB PRO A 8 -2.241 -2.606 21.857 1.00 0.00 C ATOM 132 CG PRO A 8 -1.751 -2.816 23.247 1.00 0.00 C ATOM 133 CD PRO A 8 -1.349 -1.459 23.754 1.00 0.00 C ATOM 0 HA PRO A 8 -0.532 -1.779 20.730 1.00 0.00 H new ATOM 0 HB2 PRO A 8 -3.302 -2.356 21.845 1.00 0.00 H new ATOM 0 HB3 PRO A 8 -2.119 -3.506 21.254 1.00 0.00 H new ATOM 0 HG2 PRO A 8 -2.529 -3.252 23.873 1.00 0.00 H new ATOM 0 HG3 PRO A 8 -0.906 -3.505 23.263 1.00 0.00 H new ATOM 0 HD2 PRO A 8 -2.165 -0.971 24.286 1.00 0.00 H new ATOM 0 HD3 PRO A 8 -0.509 -1.521 24.446 1.00 0.00 H new ATOM 141 N VAL A 9 -3.366 -0.128 20.843 1.00 0.00 N ATOM 142 CA VAL A 9 -4.246 0.711 20.037 1.00 0.00 C ATOM 143 C VAL A 9 -4.740 -0.035 18.804 1.00 0.00 C ATOM 144 O VAL A 9 -4.059 -0.921 18.288 1.00 0.00 O ATOM 145 CB VAL A 9 -3.535 2.003 19.590 1.00 0.00 C ATOM 146 CG1 VAL A 9 -4.519 2.953 18.927 1.00 0.00 C ATOM 147 CG2 VAL A 9 -2.850 2.672 20.772 1.00 0.00 C ATOM 0 H VAL A 9 -3.712 -0.322 21.783 1.00 0.00 H new ATOM 0 HA VAL A 9 -5.097 0.971 20.666 1.00 0.00 H new ATOM 0 HB VAL A 9 -2.771 1.740 18.858 1.00 0.00 H new ATOM 0 HG11 VAL A 9 -3.998 3.859 18.618 1.00 0.00 H new ATOM 0 HG12 VAL A 9 -4.958 2.471 18.053 1.00 0.00 H new ATOM 0 HG13 VAL A 9 -5.308 3.211 19.633 1.00 0.00 H new ATOM 0 HG21 VAL A 9 -2.353 3.583 20.437 1.00 0.00 H new ATOM 0 HG22 VAL A 9 -3.593 2.922 21.530 1.00 0.00 H new ATOM 0 HG23 VAL A 9 -2.112 1.992 21.198 1.00 0.00 H new ATOM 157 N GLN A 10 -5.930 0.327 18.338 1.00 0.00 N ATOM 158 CA GLN A 10 -6.517 -0.310 17.163 1.00 0.00 C ATOM 159 C GLN A 10 -5.900 0.240 15.881 1.00 0.00 C ATOM 160 O GLN A 10 -5.345 -0.508 15.077 1.00 0.00 O ATOM 161 CB GLN A 10 -8.032 -0.096 17.146 1.00 0.00 C ATOM 162 CG GLN A 10 -8.808 -1.290 16.612 1.00 0.00 C ATOM 163 CD GLN A 10 -10.099 -1.533 17.368 1.00 0.00 C ATOM 164 OE1 GLN A 10 -10.764 -0.592 17.803 1.00 0.00 O ATOM 165 NE2 GLN A 10 -10.459 -2.801 17.532 1.00 0.00 N ATOM 0 H GLN A 10 -6.507 1.057 18.755 1.00 0.00 H new ATOM 0 HA GLN A 10 -6.308 -1.378 17.216 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -8.371 0.124 18.158 1.00 0.00 H new ATOM 0 HB3 GLN A 10 -8.261 0.778 16.536 1.00 0.00 H new ATOM 0 HG2 GLN A 10 -9.034 -1.130 15.558 1.00 0.00 H new ATOM 0 HG3 GLN A 10 -8.183 -2.181 16.672 1.00 0.00 H new ATOM 0 HE21 GLN A 10 -9.877 -3.549 17.155 1.00 0.00 H new ATOM 0 HE22 GLN A 10 -11.317 -3.027 18.035 1.00 0.00 H new ATOM 174 N ILE A 11 -6.000 1.553 15.698 1.00 0.00 N ATOM 175 CA ILE A 11 -5.453 2.203 14.514 1.00 0.00 C ATOM 176 C ILE A 11 -4.505 3.332 14.905 1.00 0.00 C ATOM 177 O ILE A 11 -4.728 4.030 15.894 1.00 0.00 O ATOM 178 CB ILE A 11 -6.570 2.731 13.611 1.00 0.00 C ATOM 179 CG1 ILE A 11 -6.006 3.163 12.255 1.00 0.00 C ATOM 180 CG2 ILE A 11 -7.311 3.877 14.286 1.00 0.00 C ATOM 181 CD1 ILE A 11 -6.310 2.184 11.141 1.00 0.00 C ATOM 0 H ILE A 11 -6.455 2.187 16.355 1.00 0.00 H new ATOM 0 HA ILE A 11 -4.888 1.457 13.955 1.00 0.00 H new ATOM 0 HB ILE A 11 -7.284 1.926 13.439 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -6.415 4.139 11.993 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -4.926 3.282 12.340 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -8.101 4.238 13.627 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -7.750 3.526 15.220 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -6.614 4.688 14.495 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -5.882 2.550 10.208 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -5.877 1.213 11.382 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -7.390 2.083 11.030 1.00 0.00 H new ATOM 193 N TYR A 12 -3.414 3.460 14.158 1.00 0.00 N ATOM 194 CA TYR A 12 -2.389 4.453 14.462 1.00 0.00 C ATOM 195 C TYR A 12 -1.761 5.011 13.188 1.00 0.00 C ATOM 196 O TYR A 12 -0.705 4.552 12.755 1.00 0.00 O ATOM 197 CB TYR A 12 -1.308 3.794 15.337 1.00 0.00 C ATOM 198 CG TYR A 12 -1.380 2.278 15.303 1.00 0.00 C ATOM 199 CD1 TYR A 12 -2.462 1.610 15.863 1.00 0.00 C ATOM 200 CD2 TYR A 12 -0.403 1.522 14.669 1.00 0.00 C ATOM 201 CE1 TYR A 12 -2.572 0.241 15.798 1.00 0.00 C ATOM 202 CE2 TYR A 12 -0.499 0.143 14.607 1.00 0.00 C ATOM 203 CZ TYR A 12 -1.587 -0.493 15.171 1.00 0.00 C ATOM 204 OH TYR A 12 -1.691 -1.863 15.103 1.00 0.00 O ATOM 0 H TYR A 12 -3.216 2.888 13.337 1.00 0.00 H new ATOM 0 HA TYR A 12 -2.850 5.285 14.994 1.00 0.00 H new ATOM 0 HB2 TYR A 12 -0.324 4.116 14.997 1.00 0.00 H new ATOM 0 HB3 TYR A 12 -1.418 4.137 16.366 1.00 0.00 H new ATOM 0 HD1 TYR A 12 -3.234 2.179 16.360 1.00 0.00 H new ATOM 0 HD2 TYR A 12 0.444 2.017 14.218 1.00 0.00 H new ATOM 0 HE1 TYR A 12 -3.425 -0.257 16.235 1.00 0.00 H new ATOM 0 HE2 TYR A 12 0.274 -0.433 14.120 1.00 0.00 H new ATOM 0 HH TYR A 12 -2.637 -2.119 15.084 1.00 0.00 H new ATOM 214 N GLY A 13 -2.414 6.004 12.595 1.00 0.00 N ATOM 215 CA GLY A 13 -1.896 6.606 11.381 1.00 0.00 C ATOM 216 C GLY A 13 -2.963 6.796 10.324 1.00 0.00 C ATOM 217 O GLY A 13 -3.494 5.825 9.784 1.00 0.00 O ATOM 0 H GLY A 13 -3.291 6.402 12.932 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -1.451 7.572 11.620 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -1.100 5.979 10.980 1.00 0.00 H new ATOM 221 N ILE A 14 -3.278 8.053 10.024 1.00 0.00 N ATOM 222 CA ILE A 14 -4.289 8.375 9.021 1.00 0.00 C ATOM 223 C ILE A 14 -4.073 7.564 7.745 1.00 0.00 C ATOM 224 O ILE A 14 -5.025 7.052 7.157 1.00 0.00 O ATOM 225 CB ILE A 14 -4.283 9.883 8.684 1.00 0.00 C ATOM 226 CG1 ILE A 14 -5.517 10.254 7.849 1.00 0.00 C ATOM 227 CG2 ILE A 14 -2.998 10.273 7.965 1.00 0.00 C ATOM 228 CD1 ILE A 14 -5.450 9.797 6.405 1.00 0.00 C ATOM 0 H ILE A 14 -2.847 8.867 10.462 1.00 0.00 H new ATOM 0 HA ILE A 14 -5.259 8.115 9.445 1.00 0.00 H new ATOM 0 HB ILE A 14 -4.325 10.443 9.618 1.00 0.00 H new ATOM 0 HG12 ILE A 14 -6.401 9.820 8.315 1.00 0.00 H new ATOM 0 HG13 ILE A 14 -5.644 11.336 7.870 1.00 0.00 H new ATOM 0 HG21 ILE A 14 -3.017 11.339 7.738 1.00 0.00 H new ATOM 0 HG22 ILE A 14 -2.143 10.053 8.604 1.00 0.00 H new ATOM 0 HG23 ILE A 14 -2.914 9.706 7.038 1.00 0.00 H new ATOM 0 HD11 ILE A 14 -6.359 10.099 5.885 1.00 0.00 H new ATOM 0 HD12 ILE A 14 -4.587 10.252 5.919 1.00 0.00 H new ATOM 0 HD13 ILE A 14 -5.356 8.712 6.371 1.00 0.00 H new ATOM 240 N GLU A 15 -2.815 7.443 7.331 1.00 0.00 N ATOM 241 CA GLU A 15 -2.478 6.683 6.132 1.00 0.00 C ATOM 242 C GLU A 15 -2.994 5.254 6.248 1.00 0.00 C ATOM 243 O GLU A 15 -3.519 4.695 5.288 1.00 0.00 O ATOM 244 CB GLU A 15 -0.965 6.679 5.907 1.00 0.00 C ATOM 245 CG GLU A 15 -0.159 6.444 7.176 1.00 0.00 C ATOM 246 CD GLU A 15 0.705 5.200 7.099 1.00 0.00 C ATOM 247 OE1 GLU A 15 1.558 5.125 6.189 1.00 0.00 O ATOM 248 OE2 GLU A 15 0.527 4.300 7.947 1.00 0.00 O ATOM 0 H GLU A 15 -2.015 7.860 7.806 1.00 0.00 H new ATOM 0 HA GLU A 15 -2.956 7.161 5.277 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -0.717 5.905 5.181 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -0.669 7.633 5.470 1.00 0.00 H new ATOM 0 HG2 GLU A 15 0.475 7.310 7.365 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -0.840 6.357 8.023 1.00 0.00 H new ATOM 255 N GLY A 16 -2.855 4.673 7.437 1.00 0.00 N ATOM 256 CA GLY A 16 -3.328 3.318 7.654 1.00 0.00 C ATOM 257 C GLY A 16 -4.762 3.144 7.206 1.00 0.00 C ATOM 258 O GLY A 16 -5.121 2.118 6.628 1.00 0.00 O ATOM 0 H GLY A 16 -2.425 5.114 8.250 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -2.691 2.620 7.112 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -3.245 3.069 8.712 1.00 0.00 H new ATOM 262 N ARG A 17 -5.581 4.158 7.461 1.00 0.00 N ATOM 263 CA ARG A 17 -6.983 4.123 7.069 1.00 0.00 C ATOM 264 C ARG A 17 -7.116 4.002 5.555 1.00 0.00 C ATOM 265 O ARG A 17 -8.150 3.573 5.052 1.00 0.00 O ATOM 266 CB ARG A 17 -7.707 5.378 7.560 1.00 0.00 C ATOM 267 CG ARG A 17 -9.205 5.354 7.308 1.00 0.00 C ATOM 268 CD ARG A 17 -9.880 6.609 7.836 1.00 0.00 C ATOM 269 NE ARG A 17 -10.471 6.400 9.154 1.00 0.00 N ATOM 270 CZ ARG A 17 -11.636 5.788 9.356 1.00 0.00 C ATOM 271 NH1 ARG A 17 -12.336 5.324 8.328 1.00 0.00 N ATOM 272 NH2 ARG A 17 -12.102 5.639 10.589 1.00 0.00 N ATOM 0 H ARG A 17 -5.297 5.014 7.938 1.00 0.00 H new ATOM 0 HA ARG A 17 -7.443 3.249 7.529 1.00 0.00 H new ATOM 0 HB2 ARG A 17 -7.529 5.495 8.629 1.00 0.00 H new ATOM 0 HB3 ARG A 17 -7.278 6.251 7.068 1.00 0.00 H new ATOM 0 HG2 ARG A 17 -9.393 5.261 6.238 1.00 0.00 H new ATOM 0 HG3 ARG A 17 -9.641 4.477 7.786 1.00 0.00 H new ATOM 0 HD2 ARG A 17 -9.151 7.417 7.890 1.00 0.00 H new ATOM 0 HD3 ARG A 17 -10.655 6.925 7.137 1.00 0.00 H new ATOM 0 HE ARG A 17 -9.961 6.743 9.968 1.00 0.00 H new ATOM 0 HH11 ARG A 17 -11.982 5.436 7.378 1.00 0.00 H new ATOM 0 HH12 ARG A 17 -13.228 4.856 8.488 1.00 0.00 H new ATOM 0 HH21 ARG A 17 -11.568 5.993 11.382 1.00 0.00 H new ATOM 0 HH22 ARG A 17 -12.995 5.170 10.744 1.00 0.00 H new ATOM 286 N TYR A 18 -6.061 4.370 4.830 1.00 0.00 N ATOM 287 CA TYR A 18 -6.078 4.281 3.375 1.00 0.00 C ATOM 288 C TYR A 18 -6.263 2.835 2.943 1.00 0.00 C ATOM 289 O TYR A 18 -7.210 2.499 2.231 1.00 0.00 O ATOM 290 CB TYR A 18 -4.773 4.821 2.780 1.00 0.00 C ATOM 291 CG TYR A 18 -4.542 6.304 2.978 1.00 0.00 C ATOM 292 CD1 TYR A 18 -5.529 7.131 3.504 1.00 0.00 C ATOM 293 CD2 TYR A 18 -3.325 6.874 2.631 1.00 0.00 C ATOM 294 CE1 TYR A 18 -5.304 8.484 3.678 1.00 0.00 C ATOM 295 CE2 TYR A 18 -3.093 8.222 2.801 1.00 0.00 C ATOM 296 CZ TYR A 18 -4.085 9.025 3.325 1.00 0.00 C ATOM 297 OH TYR A 18 -3.858 10.371 3.496 1.00 0.00 O ATOM 0 H TYR A 18 -5.192 4.729 5.224 1.00 0.00 H new ATOM 0 HA TYR A 18 -6.909 4.884 3.010 1.00 0.00 H new ATOM 0 HB2 TYR A 18 -3.938 4.277 3.222 1.00 0.00 H new ATOM 0 HB3 TYR A 18 -4.763 4.607 1.711 1.00 0.00 H new ATOM 0 HD1 TYR A 18 -6.485 6.710 3.780 1.00 0.00 H new ATOM 0 HD2 TYR A 18 -2.545 6.250 2.220 1.00 0.00 H new ATOM 0 HE1 TYR A 18 -6.079 9.114 4.088 1.00 0.00 H new ATOM 0 HE2 TYR A 18 -2.139 8.648 2.525 1.00 0.00 H new ATOM 0 HH TYR A 18 -3.012 10.502 3.973 1.00 0.00 H new ATOM 307 N ALA A 19 -5.345 1.984 3.384 1.00 0.00 N ATOM 308 CA ALA A 19 -5.391 0.569 3.055 1.00 0.00 C ATOM 309 C ALA A 19 -6.605 -0.097 3.679 1.00 0.00 C ATOM 310 O ALA A 19 -7.161 -1.039 3.119 1.00 0.00 O ATOM 311 CB ALA A 19 -4.114 -0.121 3.515 1.00 0.00 C ATOM 0 H ALA A 19 -4.557 2.253 3.973 1.00 0.00 H new ATOM 0 HA ALA A 19 -5.473 0.475 1.972 1.00 0.00 H new ATOM 0 HB1 ALA A 19 -4.162 -1.180 3.262 1.00 0.00 H new ATOM 0 HB2 ALA A 19 -3.256 0.332 3.018 1.00 0.00 H new ATOM 0 HB3 ALA A 19 -4.009 -0.010 4.594 1.00 0.00 H new ATOM 317 N THR A 20 -7.013 0.394 4.842 1.00 0.00 N ATOM 318 CA THR A 20 -8.161 -0.169 5.529 1.00 0.00 C ATOM 319 C THR A 20 -9.468 0.350 4.935 1.00 0.00 C ATOM 320 O THR A 20 -10.499 -0.319 5.005 1.00 0.00 O ATOM 321 CB THR A 20 -8.100 0.132 7.025 1.00 0.00 C ATOM 322 OG1 THR A 20 -6.799 0.540 7.405 1.00 0.00 O ATOM 323 CG2 THR A 20 -8.473 -1.060 7.876 1.00 0.00 C ATOM 0 H THR A 20 -6.568 1.175 5.324 1.00 0.00 H new ATOM 0 HA THR A 20 -8.131 -1.250 5.392 1.00 0.00 H new ATOM 0 HB THR A 20 -8.823 0.930 7.194 1.00 0.00 H new ATOM 0 HG1 THR A 20 -6.628 1.444 7.067 1.00 0.00 H new ATOM 0 HG21 THR A 20 -8.412 -0.788 8.930 1.00 0.00 H new ATOM 0 HG22 THR A 20 -9.490 -1.372 7.640 1.00 0.00 H new ATOM 0 HG23 THR A 20 -7.786 -1.881 7.673 1.00 0.00 H new ATOM 331 N ALA A 21 -9.420 1.540 4.341 1.00 0.00 N ATOM 332 CA ALA A 21 -10.604 2.130 3.728 1.00 0.00 C ATOM 333 C ALA A 21 -10.763 1.664 2.286 1.00 0.00 C ATOM 334 O ALA A 21 -11.774 1.945 1.640 1.00 0.00 O ATOM 335 CB ALA A 21 -10.543 3.648 3.794 1.00 0.00 C ATOM 0 H ALA A 21 -8.578 2.111 4.272 1.00 0.00 H new ATOM 0 HA ALA A 21 -11.475 1.795 4.290 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -11.436 4.068 3.331 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -10.491 3.965 4.836 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -9.659 4.000 3.263 1.00 0.00 H new ATOM 341 N LEU A 22 -9.773 0.928 1.792 1.00 0.00 N ATOM 342 CA LEU A 22 -9.819 0.399 0.435 1.00 0.00 C ATOM 343 C LEU A 22 -10.131 -1.077 0.496 1.00 0.00 C ATOM 344 O LEU A 22 -10.830 -1.617 -0.361 1.00 0.00 O ATOM 345 CB LEU A 22 -8.493 0.650 -0.289 1.00 0.00 C ATOM 346 CG LEU A 22 -8.270 -0.183 -1.553 1.00 0.00 C ATOM 347 CD1 LEU A 22 -7.457 0.600 -2.573 1.00 0.00 C ATOM 348 CD2 LEU A 22 -7.578 -1.490 -1.205 1.00 0.00 C ATOM 0 H LEU A 22 -8.930 0.685 2.311 1.00 0.00 H new ATOM 0 HA LEU A 22 -10.600 0.909 -0.129 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -8.437 1.706 -0.555 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -7.676 0.453 0.405 1.00 0.00 H new ATOM 0 HG LEU A 22 -9.240 -0.411 -1.995 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -7.309 -0.009 -3.465 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -7.990 1.512 -2.841 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -6.488 0.859 -2.145 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -7.425 -2.074 -2.113 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -6.614 -1.279 -0.742 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -8.198 -2.056 -0.510 1.00 0.00 H new ATOM 360 N TYR A 23 -9.640 -1.718 1.541 1.00 0.00 N ATOM 361 CA TYR A 23 -9.895 -3.112 1.745 1.00 0.00 C ATOM 362 C TYR A 23 -11.350 -3.303 2.163 1.00 0.00 C ATOM 363 O TYR A 23 -11.889 -4.397 2.056 1.00 0.00 O ATOM 364 CB TYR A 23 -8.936 -3.662 2.793 1.00 0.00 C ATOM 365 CG TYR A 23 -9.609 -4.146 4.047 1.00 0.00 C ATOM 366 CD1 TYR A 23 -10.063 -5.444 4.133 1.00 0.00 C ATOM 367 CD2 TYR A 23 -9.794 -3.307 5.131 1.00 0.00 C ATOM 368 CE1 TYR A 23 -10.688 -5.909 5.266 1.00 0.00 C ATOM 369 CE2 TYR A 23 -10.416 -3.754 6.273 1.00 0.00 C ATOM 370 CZ TYR A 23 -10.865 -5.061 6.341 1.00 0.00 C ATOM 371 OH TYR A 23 -11.490 -5.517 7.479 1.00 0.00 O ATOM 0 H TYR A 23 -9.061 -1.283 2.259 1.00 0.00 H new ATOM 0 HA TYR A 23 -9.730 -3.663 0.819 1.00 0.00 H new ATOM 0 HB2 TYR A 23 -8.370 -4.485 2.356 1.00 0.00 H new ATOM 0 HB3 TYR A 23 -8.217 -2.886 3.056 1.00 0.00 H new ATOM 0 HD1 TYR A 23 -9.925 -6.110 3.294 1.00 0.00 H new ATOM 0 HD2 TYR A 23 -9.445 -2.286 5.080 1.00 0.00 H new ATOM 0 HE1 TYR A 23 -11.038 -6.930 5.315 1.00 0.00 H new ATOM 0 HE2 TYR A 23 -10.553 -3.088 7.112 1.00 0.00 H new ATOM 0 HH TYR A 23 -10.822 -5.889 8.092 1.00 0.00 H new ATOM 381 N SER A 24 -11.993 -2.221 2.626 1.00 0.00 N ATOM 382 CA SER A 24 -13.393 -2.293 3.027 1.00 0.00 C ATOM 383 C SER A 24 -14.188 -2.985 1.931 1.00 0.00 C ATOM 384 O SER A 24 -15.048 -3.825 2.200 1.00 0.00 O ATOM 385 CB SER A 24 -13.954 -0.895 3.290 1.00 0.00 C ATOM 386 OG SER A 24 -13.865 -0.082 2.133 1.00 0.00 O ATOM 0 H SER A 24 -11.567 -1.300 2.729 1.00 0.00 H new ATOM 0 HA SER A 24 -13.472 -2.864 3.952 1.00 0.00 H new ATOM 0 HB2 SER A 24 -14.995 -0.971 3.605 1.00 0.00 H new ATOM 0 HB3 SER A 24 -13.406 -0.428 4.109 1.00 0.00 H new ATOM 0 HG SER A 24 -13.146 0.574 2.249 1.00 0.00 H new ATOM 392 N ALA A 25 -13.848 -2.658 0.688 1.00 0.00 N ATOM 393 CA ALA A 25 -14.481 -3.279 -0.460 1.00 0.00 C ATOM 394 C ALA A 25 -13.941 -4.691 -0.600 1.00 0.00 C ATOM 395 O ALA A 25 -14.671 -5.625 -0.930 1.00 0.00 O ATOM 396 CB ALA A 25 -14.220 -2.471 -1.723 1.00 0.00 C ATOM 0 H ALA A 25 -13.137 -1.965 0.455 1.00 0.00 H new ATOM 0 HA ALA A 25 -15.561 -3.311 -0.314 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -14.704 -2.955 -2.571 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -14.622 -1.465 -1.601 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -13.146 -2.413 -1.902 1.00 0.00 H new ATOM 402 N ALA A 26 -12.649 -4.833 -0.314 1.00 0.00 N ATOM 403 CA ALA A 26 -11.990 -6.133 -0.375 1.00 0.00 C ATOM 404 C ALA A 26 -12.620 -7.107 0.617 1.00 0.00 C ATOM 405 O ALA A 26 -12.951 -8.239 0.264 1.00 0.00 O ATOM 406 CB ALA A 26 -10.502 -5.984 -0.090 1.00 0.00 C ATOM 0 H ALA A 26 -12.039 -4.064 -0.038 1.00 0.00 H new ATOM 0 HA ALA A 26 -12.119 -6.534 -1.380 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -10.023 -6.962 -0.139 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -10.054 -5.323 -0.832 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -10.363 -5.561 0.905 1.00 0.00 H new ATOM 412 N SER A 27 -12.790 -6.657 1.861 1.00 0.00 N ATOM 413 CA SER A 27 -13.387 -7.485 2.903 1.00 0.00 C ATOM 414 C SER A 27 -14.759 -7.978 2.462 1.00 0.00 C ATOM 415 O SER A 27 -15.095 -9.149 2.634 1.00 0.00 O ATOM 416 CB SER A 27 -13.500 -6.692 4.210 1.00 0.00 C ATOM 417 OG SER A 27 -14.838 -6.294 4.464 1.00 0.00 O ATOM 0 H SER A 27 -12.522 -5.722 2.169 1.00 0.00 H new ATOM 0 HA SER A 27 -12.745 -8.349 3.075 1.00 0.00 H new ATOM 0 HB2 SER A 27 -13.137 -7.301 5.038 1.00 0.00 H new ATOM 0 HB3 SER A 27 -12.861 -5.811 4.158 1.00 0.00 H new ATOM 0 HG SER A 27 -14.876 -5.792 5.305 1.00 0.00 H new ATOM 423 N LYS A 28 -15.545 -7.076 1.874 1.00 0.00 N ATOM 424 CA LYS A 28 -16.874 -7.427 1.389 1.00 0.00 C ATOM 425 C LYS A 28 -16.795 -8.672 0.516 1.00 0.00 C ATOM 426 O LYS A 28 -17.723 -9.480 0.475 1.00 0.00 O ATOM 427 CB LYS A 28 -17.479 -6.265 0.597 1.00 0.00 C ATOM 428 CG LYS A 28 -18.310 -5.316 1.445 1.00 0.00 C ATOM 429 CD LYS A 28 -19.317 -4.552 0.602 1.00 0.00 C ATOM 430 CE LYS A 28 -20.432 -5.460 0.108 1.00 0.00 C ATOM 431 NZ LYS A 28 -21.649 -5.359 0.959 1.00 0.00 N ATOM 0 H LYS A 28 -15.283 -6.102 1.724 1.00 0.00 H new ATOM 0 HA LYS A 28 -17.516 -7.633 2.245 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -16.675 -5.704 0.121 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -18.103 -6.667 -0.201 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -18.834 -5.880 2.217 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -17.653 -4.612 1.955 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -19.742 -3.738 1.190 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -18.811 -4.099 -0.250 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -20.685 -5.198 -0.919 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -20.082 -6.492 0.097 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -22.385 -5.993 0.589 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -21.414 -5.633 1.934 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -21.999 -4.380 0.949 1.00 0.00 H new ATOM 445 N GLN A 29 -15.664 -8.823 -0.166 1.00 0.00 N ATOM 446 CA GLN A 29 -15.436 -9.974 -1.024 1.00 0.00 C ATOM 447 C GLN A 29 -14.621 -11.025 -0.283 1.00 0.00 C ATOM 448 O GLN A 29 -15.162 -12.032 0.171 1.00 0.00 O ATOM 449 CB GLN A 29 -14.711 -9.551 -2.304 1.00 0.00 C ATOM 450 CG GLN A 29 -15.647 -9.086 -3.408 1.00 0.00 C ATOM 451 CD GLN A 29 -14.963 -9.013 -4.759 1.00 0.00 C ATOM 452 OE1 GLN A 29 -14.425 -10.006 -5.250 1.00 0.00 O ATOM 453 NE2 GLN A 29 -14.981 -7.833 -5.368 1.00 0.00 N ATOM 0 H GLN A 29 -14.890 -8.159 -0.139 1.00 0.00 H new ATOM 0 HA GLN A 29 -16.401 -10.402 -1.297 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -14.014 -8.747 -2.068 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -14.119 -10.390 -2.670 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -16.496 -9.767 -3.471 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -16.045 -8.104 -3.153 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -15.439 -7.037 -4.924 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -14.537 -7.723 -6.280 1.00 0.00 H new ATOM 462 N ASN A 30 -13.320 -10.765 -0.162 1.00 0.00 N ATOM 463 CA ASN A 30 -12.384 -11.659 0.527 1.00 0.00 C ATOM 464 C ASN A 30 -10.987 -11.495 -0.057 1.00 0.00 C ATOM 465 O ASN A 30 -10.169 -12.413 -0.005 1.00 0.00 O ATOM 466 CB ASN A 30 -12.810 -13.127 0.418 1.00 0.00 C ATOM 467 CG ASN A 30 -13.146 -13.535 -1.005 1.00 0.00 C ATOM 468 OD1 ASN A 30 -12.122 -13.664 -1.842 1.00 0.00 O flip ATOM 469 ND2 ASN A 30 -14.310 -13.735 -1.348 1.00 0.00 N flip ATOM 0 H ASN A 30 -12.881 -9.925 -0.540 1.00 0.00 H new ATOM 0 HA ASN A 30 -12.385 -11.384 1.582 1.00 0.00 H new ATOM 0 HB2 ASN A 30 -12.008 -13.763 0.794 1.00 0.00 H new ATOM 0 HB3 ASN A 30 -13.678 -13.298 1.055 1.00 0.00 H new ATOM 0 HD21 ASN A 30 -15.067 -13.625 -0.673 1.00 0.00 H new ATOM 0 HD22 ASN A 30 -14.519 -14.011 -2.307 1.00 0.00 H new ATOM 476 N LYS A 31 -10.728 -10.324 -0.626 1.00 0.00 N ATOM 477 CA LYS A 31 -9.440 -10.040 -1.236 1.00 0.00 C ATOM 478 C LYS A 31 -8.371 -9.732 -0.190 1.00 0.00 C ATOM 479 O LYS A 31 -7.225 -9.473 -0.544 1.00 0.00 O ATOM 480 CB LYS A 31 -9.569 -8.875 -2.216 1.00 0.00 C ATOM 481 CG LYS A 31 -10.419 -9.199 -3.434 1.00 0.00 C ATOM 482 CD LYS A 31 -9.614 -9.925 -4.499 1.00 0.00 C ATOM 483 CE LYS A 31 -9.746 -11.434 -4.366 1.00 0.00 C ATOM 484 NZ LYS A 31 -9.457 -12.132 -5.649 1.00 0.00 N ATOM 0 H LYS A 31 -11.397 -9.555 -0.676 1.00 0.00 H new ATOM 0 HA LYS A 31 -9.125 -10.934 -1.775 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -10.003 -8.020 -1.697 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -8.574 -8.576 -2.546 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -11.266 -9.815 -3.134 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -10.827 -8.278 -3.850 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -9.953 -9.615 -5.487 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -8.564 -9.642 -4.419 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -9.062 -11.792 -3.596 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -10.755 -11.683 -4.037 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -9.558 -13.159 -5.516 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -10.125 -11.810 -6.378 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -8.485 -11.916 -5.951 1.00 0.00 H new ATOM 498 N LEU A 32 -8.737 -9.769 1.096 1.00 0.00 N ATOM 499 CA LEU A 32 -7.785 -9.502 2.169 1.00 0.00 C ATOM 500 C LEU A 32 -6.452 -10.191 1.906 1.00 0.00 C ATOM 501 O LEU A 32 -5.400 -9.703 2.308 1.00 0.00 O ATOM 502 CB LEU A 32 -8.377 -9.964 3.496 1.00 0.00 C ATOM 503 CG LEU A 32 -9.312 -8.950 4.148 1.00 0.00 C ATOM 504 CD1 LEU A 32 -8.493 -7.857 4.816 1.00 0.00 C ATOM 505 CD2 LEU A 32 -10.262 -8.362 3.112 1.00 0.00 C ATOM 0 H LEU A 32 -9.683 -9.981 1.414 1.00 0.00 H new ATOM 0 HA LEU A 32 -7.596 -8.429 2.212 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -8.923 -10.894 3.334 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -7.564 -10.188 4.186 1.00 0.00 H new ATOM 0 HG LEU A 32 -9.912 -9.451 4.908 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -9.163 -7.134 5.281 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -7.850 -8.298 5.577 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -7.879 -7.355 4.069 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -10.923 -7.640 3.592 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -9.686 -7.864 2.332 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -10.857 -9.161 2.670 1.00 0.00 H new ATOM 517 N GLU A 33 -6.504 -11.319 1.209 1.00 0.00 N ATOM 518 CA GLU A 33 -5.293 -12.058 0.874 1.00 0.00 C ATOM 519 C GLU A 33 -4.556 -11.368 -0.270 1.00 0.00 C ATOM 520 O GLU A 33 -3.326 -11.322 -0.295 1.00 0.00 O ATOM 521 CB GLU A 33 -5.633 -13.500 0.488 1.00 0.00 C ATOM 522 CG GLU A 33 -5.604 -14.466 1.661 1.00 0.00 C ATOM 523 CD GLU A 33 -5.608 -15.917 1.221 1.00 0.00 C ATOM 524 OE1 GLU A 33 -4.753 -16.286 0.388 1.00 0.00 O ATOM 525 OE2 GLU A 33 -6.465 -16.683 1.710 1.00 0.00 O ATOM 0 H GLU A 33 -7.367 -11.741 0.866 1.00 0.00 H new ATOM 0 HA GLU A 33 -4.646 -12.078 1.751 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -6.624 -13.522 0.034 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -4.928 -13.840 -0.270 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -4.715 -14.275 2.262 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -6.467 -14.282 2.300 1.00 0.00 H new ATOM 532 N GLN A 34 -5.323 -10.819 -1.206 1.00 0.00 N ATOM 533 CA GLN A 34 -4.761 -10.111 -2.350 1.00 0.00 C ATOM 534 C GLN A 34 -4.456 -8.654 -1.998 1.00 0.00 C ATOM 535 O GLN A 34 -3.849 -7.932 -2.789 1.00 0.00 O ATOM 536 CB GLN A 34 -5.725 -10.171 -3.537 1.00 0.00 C ATOM 537 CG GLN A 34 -5.270 -11.113 -4.641 1.00 0.00 C ATOM 538 CD GLN A 34 -4.780 -10.376 -5.873 1.00 0.00 C ATOM 539 OE1 GLN A 34 -5.311 -10.554 -6.970 1.00 0.00 O ATOM 540 NE2 GLN A 34 -3.761 -9.543 -5.698 1.00 0.00 N ATOM 0 H GLN A 34 -6.342 -10.852 -1.194 1.00 0.00 H new ATOM 0 HA GLN A 34 -3.827 -10.601 -2.624 1.00 0.00 H new ATOM 0 HB2 GLN A 34 -6.706 -10.487 -3.182 1.00 0.00 H new ATOM 0 HB3 GLN A 34 -5.843 -9.169 -3.950 1.00 0.00 H new ATOM 0 HG2 GLN A 34 -4.471 -11.751 -4.263 1.00 0.00 H new ATOM 0 HG3 GLN A 34 -6.096 -11.767 -4.919 1.00 0.00 H new ATOM 0 HE21 GLN A 34 -3.351 -9.426 -4.771 1.00 0.00 H new ATOM 0 HE22 GLN A 34 -3.388 -9.020 -6.490 1.00 0.00 H new ATOM 549 N VAL A 35 -4.878 -8.228 -0.808 1.00 0.00 N ATOM 550 CA VAL A 35 -4.642 -6.858 -0.360 1.00 0.00 C ATOM 551 C VAL A 35 -3.655 -6.832 0.806 1.00 0.00 C ATOM 552 O VAL A 35 -2.844 -5.914 0.925 1.00 0.00 O ATOM 553 CB VAL A 35 -5.946 -6.156 0.087 1.00 0.00 C ATOM 554 CG1 VAL A 35 -5.875 -4.669 -0.225 1.00 0.00 C ATOM 555 CG2 VAL A 35 -7.181 -6.782 -0.559 1.00 0.00 C ATOM 0 H VAL A 35 -5.383 -8.810 -0.140 1.00 0.00 H new ATOM 0 HA VAL A 35 -4.231 -6.322 -1.215 1.00 0.00 H new ATOM 0 HB VAL A 35 -6.042 -6.290 1.164 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -6.798 -4.186 0.094 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -5.032 -4.226 0.305 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -5.744 -4.528 -1.298 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -8.075 -6.259 -0.218 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -7.105 -6.701 -1.643 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -7.246 -7.833 -0.277 1.00 0.00 H new ATOM 565 N GLU A 36 -3.728 -7.848 1.660 1.00 0.00 N ATOM 566 CA GLU A 36 -2.838 -7.945 2.813 1.00 0.00 C ATOM 567 C GLU A 36 -1.432 -8.282 2.353 1.00 0.00 C ATOM 568 O GLU A 36 -0.461 -7.640 2.754 1.00 0.00 O ATOM 569 CB GLU A 36 -3.334 -9.004 3.799 1.00 0.00 C ATOM 570 CG GLU A 36 -2.457 -9.148 5.032 1.00 0.00 C ATOM 571 CD GLU A 36 -1.245 -10.025 4.786 1.00 0.00 C ATOM 572 OE1 GLU A 36 -1.424 -11.248 4.605 1.00 0.00 O ATOM 573 OE2 GLU A 36 -0.116 -9.489 4.775 1.00 0.00 O ATOM 0 H GLU A 36 -4.394 -8.616 1.576 1.00 0.00 H new ATOM 0 HA GLU A 36 -2.830 -6.981 3.323 1.00 0.00 H new ATOM 0 HB2 GLU A 36 -4.347 -8.751 4.112 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -3.389 -9.966 3.289 1.00 0.00 H new ATOM 0 HG2 GLU A 36 -2.127 -8.161 5.356 1.00 0.00 H new ATOM 0 HG3 GLU A 36 -3.047 -9.570 5.846 1.00 0.00 H new ATOM 580 N LYS A 37 -1.334 -9.275 1.478 1.00 0.00 N ATOM 581 CA LYS A 37 -0.048 -9.671 0.929 1.00 0.00 C ATOM 582 C LYS A 37 0.460 -8.556 0.033 1.00 0.00 C ATOM 583 O LYS A 37 1.664 -8.388 -0.159 1.00 0.00 O ATOM 584 CB LYS A 37 -0.173 -10.978 0.143 1.00 0.00 C ATOM 585 CG LYS A 37 0.982 -11.939 0.372 1.00 0.00 C ATOM 586 CD LYS A 37 2.193 -11.566 -0.468 1.00 0.00 C ATOM 587 CE LYS A 37 3.491 -11.852 0.267 1.00 0.00 C ATOM 588 NZ LYS A 37 3.740 -13.313 0.408 1.00 0.00 N ATOM 0 H LYS A 37 -2.127 -9.817 1.136 1.00 0.00 H new ATOM 0 HA LYS A 37 0.659 -9.842 1.741 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -1.105 -11.471 0.420 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -0.238 -10.748 -0.920 1.00 0.00 H new ATOM 0 HG2 LYS A 37 1.255 -11.936 1.427 1.00 0.00 H new ATOM 0 HG3 LYS A 37 0.667 -12.953 0.127 1.00 0.00 H new ATOM 0 HD2 LYS A 37 2.173 -12.124 -1.404 1.00 0.00 H new ATOM 0 HD3 LYS A 37 2.146 -10.508 -0.726 1.00 0.00 H new ATOM 0 HE2 LYS A 37 4.321 -11.393 -0.270 1.00 0.00 H new ATOM 0 HE3 LYS A 37 3.457 -11.393 1.255 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 4.635 -13.465 0.915 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 2.961 -13.748 0.943 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 3.798 -13.748 -0.535 1.00 0.00 H new ATOM 602 N GLU A 38 -0.484 -7.780 -0.495 1.00 0.00 N ATOM 603 CA GLU A 38 -0.165 -6.659 -1.351 1.00 0.00 C ATOM 604 C GLU A 38 0.004 -5.384 -0.522 1.00 0.00 C ATOM 605 O GLU A 38 0.001 -4.277 -1.054 1.00 0.00 O ATOM 606 CB GLU A 38 -1.270 -6.477 -2.388 1.00 0.00 C ATOM 607 CG GLU A 38 -1.099 -7.352 -3.619 1.00 0.00 C ATOM 608 CD GLU A 38 -1.145 -8.831 -3.294 1.00 0.00 C ATOM 609 OE1 GLU A 38 -0.196 -9.327 -2.649 1.00 0.00 O ATOM 610 OE2 GLU A 38 -2.129 -9.495 -3.681 1.00 0.00 O ATOM 0 H GLU A 38 -1.483 -7.916 -0.338 1.00 0.00 H new ATOM 0 HA GLU A 38 0.776 -6.859 -1.863 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -2.231 -6.699 -1.925 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -1.299 -5.432 -2.696 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -1.883 -7.117 -4.339 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -0.148 -7.118 -4.097 1.00 0.00 H new ATOM 617 N LEU A 39 0.167 -5.550 0.786 1.00 0.00 N ATOM 618 CA LEU A 39 0.362 -4.422 1.683 1.00 0.00 C ATOM 619 C LEU A 39 1.764 -4.481 2.276 1.00 0.00 C ATOM 620 O LEU A 39 2.381 -3.451 2.548 1.00 0.00 O ATOM 621 CB LEU A 39 -0.693 -4.424 2.794 1.00 0.00 C ATOM 622 CG LEU A 39 -1.591 -3.185 2.831 1.00 0.00 C ATOM 623 CD1 LEU A 39 -2.849 -3.412 2.008 1.00 0.00 C ATOM 624 CD2 LEU A 39 -1.947 -2.823 4.266 1.00 0.00 C ATOM 0 H LEU A 39 0.168 -6.459 1.248 1.00 0.00 H new ATOM 0 HA LEU A 39 0.251 -3.496 1.118 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -1.321 -5.307 2.677 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -0.187 -4.517 3.755 1.00 0.00 H new ATOM 0 HG LEU A 39 -1.042 -2.351 2.394 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -3.475 -2.520 2.046 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -2.575 -3.618 0.973 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -3.401 -4.260 2.413 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -2.586 -1.940 4.271 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -2.475 -3.655 4.731 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -1.035 -2.614 4.826 1.00 0.00 H new ATOM 636 N LEU A 40 2.269 -5.700 2.451 1.00 0.00 N ATOM 637 CA LEU A 40 3.606 -5.901 2.984 1.00 0.00 C ATOM 638 C LEU A 40 4.649 -5.605 1.912 1.00 0.00 C ATOM 639 O LEU A 40 5.783 -5.237 2.220 1.00 0.00 O ATOM 640 CB LEU A 40 3.769 -7.335 3.492 1.00 0.00 C ATOM 641 CG LEU A 40 4.714 -7.498 4.684 1.00 0.00 C ATOM 642 CD1 LEU A 40 4.118 -6.858 5.928 1.00 0.00 C ATOM 643 CD2 LEU A 40 5.012 -8.969 4.929 1.00 0.00 C ATOM 0 H LEU A 40 1.769 -6.561 2.230 1.00 0.00 H new ATOM 0 HA LEU A 40 3.752 -5.216 3.819 1.00 0.00 H new ATOM 0 HB2 LEU A 40 2.788 -7.719 3.771 1.00 0.00 H new ATOM 0 HB3 LEU A 40 4.133 -7.955 2.673 1.00 0.00 H new ATOM 0 HG LEU A 40 5.651 -6.991 4.454 1.00 0.00 H new ATOM 0 HD11 LEU A 40 4.804 -6.984 6.766 1.00 0.00 H new ATOM 0 HD12 LEU A 40 3.956 -5.795 5.748 1.00 0.00 H new ATOM 0 HD13 LEU A 40 3.167 -7.336 6.163 1.00 0.00 H new ATOM 0 HD21 LEU A 40 5.686 -9.067 5.780 1.00 0.00 H new ATOM 0 HD22 LEU A 40 4.083 -9.498 5.139 1.00 0.00 H new ATOM 0 HD23 LEU A 40 5.482 -9.397 4.044 1.00 0.00 H new ATOM 655 N ARG A 41 4.255 -5.760 0.647 1.00 0.00 N ATOM 656 CA ARG A 41 5.156 -5.501 -0.468 1.00 0.00 C ATOM 657 C ARG A 41 5.459 -4.010 -0.576 1.00 0.00 C ATOM 658 O ARG A 41 6.568 -3.616 -0.935 1.00 0.00 O ATOM 659 CB ARG A 41 4.546 -6.008 -1.776 1.00 0.00 C ATOM 660 CG ARG A 41 4.442 -7.522 -1.852 1.00 0.00 C ATOM 661 CD ARG A 41 5.759 -8.149 -2.280 1.00 0.00 C ATOM 662 NE ARG A 41 5.845 -9.557 -1.898 1.00 0.00 N ATOM 663 CZ ARG A 41 6.921 -10.314 -2.096 1.00 0.00 C ATOM 664 NH1 ARG A 41 8.004 -9.804 -2.670 1.00 0.00 N ATOM 665 NH2 ARG A 41 6.916 -11.585 -1.719 1.00 0.00 N ATOM 0 H ARG A 41 3.320 -6.063 0.373 1.00 0.00 H new ATOM 0 HA ARG A 41 6.089 -6.035 -0.285 1.00 0.00 H new ATOM 0 HB2 ARG A 41 3.552 -5.577 -1.894 1.00 0.00 H new ATOM 0 HB3 ARG A 41 5.149 -5.651 -2.611 1.00 0.00 H new ATOM 0 HG2 ARG A 41 4.149 -7.917 -0.879 1.00 0.00 H new ATOM 0 HG3 ARG A 41 3.659 -7.799 -2.558 1.00 0.00 H new ATOM 0 HD2 ARG A 41 5.869 -8.059 -3.361 1.00 0.00 H new ATOM 0 HD3 ARG A 41 6.585 -7.600 -1.829 1.00 0.00 H new ATOM 0 HE ARG A 41 5.032 -9.984 -1.454 1.00 0.00 H new ATOM 0 HH11 ARG A 41 8.014 -8.827 -2.962 1.00 0.00 H new ATOM 0 HH12 ARG A 41 8.826 -10.389 -2.819 1.00 0.00 H new ATOM 0 HH21 ARG A 41 6.087 -11.983 -1.277 1.00 0.00 H new ATOM 0 HH22 ARG A 41 7.741 -12.165 -1.871 1.00 0.00 H new ATOM 679 N VAL A 42 4.466 -3.185 -0.256 1.00 0.00 N ATOM 680 CA VAL A 42 4.630 -1.738 -0.312 1.00 0.00 C ATOM 681 C VAL A 42 5.710 -1.281 0.661 1.00 0.00 C ATOM 682 O VAL A 42 6.399 -0.289 0.419 1.00 0.00 O ATOM 683 CB VAL A 42 3.304 -1.012 0.005 1.00 0.00 C ATOM 684 CG1 VAL A 42 3.488 0.499 -0.045 1.00 0.00 C ATOM 685 CG2 VAL A 42 2.214 -1.454 -0.961 1.00 0.00 C ATOM 0 H VAL A 42 3.541 -3.494 0.044 1.00 0.00 H new ATOM 0 HA VAL A 42 4.932 -1.481 -1.327 1.00 0.00 H new ATOM 0 HB VAL A 42 2.999 -1.281 1.016 1.00 0.00 H new ATOM 0 HG11 VAL A 42 2.541 0.989 0.182 1.00 0.00 H new ATOM 0 HG12 VAL A 42 4.236 0.799 0.689 1.00 0.00 H new ATOM 0 HG13 VAL A 42 3.819 0.792 -1.041 1.00 0.00 H new ATOM 0 HG21 VAL A 42 1.286 -0.934 -0.725 1.00 0.00 H new ATOM 0 HG22 VAL A 42 2.514 -1.216 -1.982 1.00 0.00 H new ATOM 0 HG23 VAL A 42 2.061 -2.529 -0.869 1.00 0.00 H new ATOM 695 N GLY A 43 5.863 -2.018 1.754 1.00 0.00 N ATOM 696 CA GLY A 43 6.873 -1.681 2.737 1.00 0.00 C ATOM 697 C GLY A 43 8.255 -2.096 2.284 1.00 0.00 C ATOM 698 O GLY A 43 9.245 -1.430 2.586 1.00 0.00 O ATOM 0 H GLY A 43 5.306 -2.843 1.977 1.00 0.00 H new ATOM 0 HA2 GLY A 43 6.858 -0.607 2.921 1.00 0.00 H new ATOM 0 HA3 GLY A 43 6.638 -2.170 3.683 1.00 0.00 H new ATOM 702 N GLN A 44 8.318 -3.196 1.540 1.00 0.00 N ATOM 703 CA GLN A 44 9.583 -3.697 1.025 1.00 0.00 C ATOM 704 C GLN A 44 10.157 -2.726 -0.001 1.00 0.00 C ATOM 705 O GLN A 44 11.372 -2.632 -0.169 1.00 0.00 O ATOM 706 CB GLN A 44 9.393 -5.077 0.391 1.00 0.00 C ATOM 707 CG GLN A 44 9.150 -6.183 1.404 1.00 0.00 C ATOM 708 CD GLN A 44 9.875 -7.467 1.049 1.00 0.00 C ATOM 709 OE1 GLN A 44 10.047 -7.792 -0.125 1.00 0.00 O ATOM 710 NE2 GLN A 44 10.303 -8.205 2.067 1.00 0.00 N ATOM 0 H GLN A 44 7.506 -3.756 1.281 1.00 0.00 H new ATOM 0 HA GLN A 44 10.283 -3.787 1.856 1.00 0.00 H new ATOM 0 HB2 GLN A 44 8.551 -5.037 -0.300 1.00 0.00 H new ATOM 0 HB3 GLN A 44 10.277 -5.322 -0.197 1.00 0.00 H new ATOM 0 HG2 GLN A 44 9.475 -5.847 2.389 1.00 0.00 H new ATOM 0 HG3 GLN A 44 8.080 -6.381 1.471 1.00 0.00 H new ATOM 0 HE21 GLN A 44 10.138 -7.897 3.025 1.00 0.00 H new ATOM 0 HE22 GLN A 44 10.796 -9.080 1.891 1.00 0.00 H new ATOM 719 N ILE A 45 9.272 -1.999 -0.679 1.00 0.00 N ATOM 720 CA ILE A 45 9.690 -1.028 -1.681 1.00 0.00 C ATOM 721 C ILE A 45 10.551 0.062 -1.055 1.00 0.00 C ATOM 722 O ILE A 45 11.331 0.721 -1.741 1.00 0.00 O ATOM 723 CB ILE A 45 8.465 -0.394 -2.385 1.00 0.00 C ATOM 724 CG1 ILE A 45 7.855 -1.382 -3.382 1.00 0.00 C ATOM 725 CG2 ILE A 45 8.841 0.906 -3.090 1.00 0.00 C ATOM 726 CD1 ILE A 45 6.346 -1.457 -3.311 1.00 0.00 C ATOM 0 H ILE A 45 8.262 -2.065 -0.551 1.00 0.00 H new ATOM 0 HA ILE A 45 10.283 -1.558 -2.426 1.00 0.00 H new ATOM 0 HB ILE A 45 7.724 -0.159 -1.621 1.00 0.00 H new ATOM 0 HG12 ILE A 45 8.149 -1.095 -4.392 1.00 0.00 H new ATOM 0 HG13 ILE A 45 8.269 -2.373 -3.198 1.00 0.00 H new ATOM 0 HG21 ILE A 45 7.959 1.326 -3.574 1.00 0.00 H new ATOM 0 HG22 ILE A 45 9.227 1.617 -2.360 1.00 0.00 H new ATOM 0 HG23 ILE A 45 9.606 0.705 -3.840 1.00 0.00 H new ATOM 0 HD11 ILE A 45 5.983 -2.176 -4.045 1.00 0.00 H new ATOM 0 HD12 ILE A 45 6.044 -1.773 -2.313 1.00 0.00 H new ATOM 0 HD13 ILE A 45 5.922 -0.476 -3.524 1.00 0.00 H new ATOM 738 N LEU A 46 10.417 0.247 0.250 1.00 0.00 N ATOM 739 CA LEU A 46 11.202 1.253 0.942 1.00 0.00 C ATOM 740 C LEU A 46 12.490 0.643 1.467 1.00 0.00 C ATOM 741 O LEU A 46 13.554 1.261 1.418 1.00 0.00 O ATOM 742 CB LEU A 46 10.395 1.869 2.083 1.00 0.00 C ATOM 743 CG LEU A 46 9.878 3.278 1.808 1.00 0.00 C ATOM 744 CD1 LEU A 46 9.128 3.320 0.484 1.00 0.00 C ATOM 745 CD2 LEU A 46 8.990 3.754 2.950 1.00 0.00 C ATOM 0 H LEU A 46 9.778 -0.281 0.844 1.00 0.00 H new ATOM 0 HA LEU A 46 11.455 2.045 0.237 1.00 0.00 H new ATOM 0 HB2 LEU A 46 9.546 1.221 2.301 1.00 0.00 H new ATOM 0 HB3 LEU A 46 11.016 1.893 2.978 1.00 0.00 H new ATOM 0 HG LEU A 46 10.731 3.953 1.738 1.00 0.00 H new ATOM 0 HD11 LEU A 46 8.766 4.332 0.303 1.00 0.00 H new ATOM 0 HD12 LEU A 46 9.798 3.025 -0.323 1.00 0.00 H new ATOM 0 HD13 LEU A 46 8.282 2.634 0.523 1.00 0.00 H new ATOM 0 HD21 LEU A 46 8.631 4.761 2.736 1.00 0.00 H new ATOM 0 HD22 LEU A 46 8.140 3.080 3.055 1.00 0.00 H new ATOM 0 HD23 LEU A 46 9.563 3.763 3.877 1.00 0.00 H new ATOM 757 N LYS A 47 12.387 -0.584 1.952 1.00 0.00 N ATOM 758 CA LYS A 47 13.540 -1.301 2.470 1.00 0.00 C ATOM 759 C LYS A 47 14.413 -1.796 1.321 1.00 0.00 C ATOM 760 O LYS A 47 15.597 -2.076 1.504 1.00 0.00 O ATOM 761 CB LYS A 47 13.094 -2.481 3.335 1.00 0.00 C ATOM 762 CG LYS A 47 14.005 -2.745 4.522 1.00 0.00 C ATOM 763 CD LYS A 47 15.042 -3.809 4.201 1.00 0.00 C ATOM 764 CE LYS A 47 14.627 -5.171 4.732 1.00 0.00 C ATOM 765 NZ LYS A 47 15.559 -6.247 4.296 1.00 0.00 N ATOM 0 H LYS A 47 11.512 -1.106 1.998 1.00 0.00 H new ATOM 0 HA LYS A 47 14.122 -0.617 3.088 1.00 0.00 H new ATOM 0 HB2 LYS A 47 12.084 -2.293 3.698 1.00 0.00 H new ATOM 0 HB3 LYS A 47 13.049 -3.377 2.716 1.00 0.00 H new ATOM 0 HG2 LYS A 47 14.507 -1.821 4.810 1.00 0.00 H new ATOM 0 HG3 LYS A 47 13.408 -3.063 5.377 1.00 0.00 H new ATOM 0 HD2 LYS A 47 15.184 -3.866 3.122 1.00 0.00 H new ATOM 0 HD3 LYS A 47 16.001 -3.526 4.634 1.00 0.00 H new ATOM 0 HE2 LYS A 47 14.593 -5.140 5.821 1.00 0.00 H new ATOM 0 HE3 LYS A 47 13.619 -5.403 4.388 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 15.240 -7.159 4.680 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 15.573 -6.294 3.257 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 16.516 -6.040 4.646 1.00 0.00 H new ATOM 779 N GLU A 48 13.820 -1.900 0.131 1.00 0.00 N ATOM 780 CA GLU A 48 14.544 -2.356 -1.045 1.00 0.00 C ATOM 781 C GLU A 48 15.498 -1.271 -1.547 1.00 0.00 C ATOM 782 O GLU A 48 15.061 -0.193 -1.952 1.00 0.00 O ATOM 783 CB GLU A 48 13.556 -2.741 -2.146 1.00 0.00 C ATOM 784 CG GLU A 48 13.214 -4.222 -2.167 1.00 0.00 C ATOM 785 CD GLU A 48 14.303 -5.063 -2.802 1.00 0.00 C ATOM 786 OE1 GLU A 48 15.490 -4.696 -2.671 1.00 0.00 O ATOM 787 OE2 GLU A 48 13.970 -6.089 -3.432 1.00 0.00 O ATOM 0 H GLU A 48 12.840 -1.673 -0.039 1.00 0.00 H new ATOM 0 HA GLU A 48 15.134 -3.231 -0.773 1.00 0.00 H new ATOM 0 HB2 GLU A 48 12.639 -2.167 -2.016 1.00 0.00 H new ATOM 0 HB3 GLU A 48 13.974 -2.460 -3.112 1.00 0.00 H new ATOM 0 HG2 GLU A 48 13.043 -4.566 -1.147 1.00 0.00 H new ATOM 0 HG3 GLU A 48 12.282 -4.368 -2.713 1.00 0.00 H new ATOM 794 N PRO A 49 16.819 -1.533 -1.519 1.00 0.00 N ATOM 795 CA PRO A 49 17.829 -0.564 -1.966 1.00 0.00 C ATOM 796 C PRO A 49 17.642 -0.132 -3.420 1.00 0.00 C ATOM 797 O PRO A 49 18.200 0.876 -3.851 1.00 0.00 O ATOM 798 CB PRO A 49 19.155 -1.316 -1.804 1.00 0.00 C ATOM 799 CG PRO A 49 18.867 -2.395 -0.819 1.00 0.00 C ATOM 800 CD PRO A 49 17.435 -2.784 -1.043 1.00 0.00 C ATOM 0 HA PRO A 49 17.770 0.359 -1.390 1.00 0.00 H new ATOM 0 HB2 PRO A 49 19.493 -1.729 -2.754 1.00 0.00 H new ATOM 0 HB3 PRO A 49 19.943 -0.654 -1.445 1.00 0.00 H new ATOM 0 HG2 PRO A 49 19.531 -3.247 -0.967 1.00 0.00 H new ATOM 0 HG3 PRO A 49 19.022 -2.044 0.201 1.00 0.00 H new ATOM 0 HD2 PRO A 49 17.345 -3.583 -1.779 1.00 0.00 H new ATOM 0 HD3 PRO A 49 16.966 -3.141 -0.126 1.00 0.00 H new ATOM 808 N LYS A 50 16.853 -0.894 -4.171 1.00 0.00 N ATOM 809 CA LYS A 50 16.596 -0.577 -5.573 1.00 0.00 C ATOM 810 C LYS A 50 15.294 0.201 -5.717 1.00 0.00 C ATOM 811 O LYS A 50 14.608 0.102 -6.735 1.00 0.00 O ATOM 812 CB LYS A 50 16.536 -1.859 -6.405 1.00 0.00 C ATOM 813 CG LYS A 50 17.903 -2.422 -6.757 1.00 0.00 C ATOM 814 CD LYS A 50 18.510 -1.702 -7.950 1.00 0.00 C ATOM 815 CE LYS A 50 19.855 -2.301 -8.336 1.00 0.00 C ATOM 816 NZ LYS A 50 20.991 -1.526 -7.765 1.00 0.00 N ATOM 0 H LYS A 50 16.381 -1.733 -3.834 1.00 0.00 H new ATOM 0 HA LYS A 50 17.414 0.043 -5.939 1.00 0.00 H new ATOM 0 HB2 LYS A 50 15.973 -2.613 -5.855 1.00 0.00 H new ATOM 0 HB3 LYS A 50 15.987 -1.659 -7.325 1.00 0.00 H new ATOM 0 HG2 LYS A 50 18.568 -2.330 -5.898 1.00 0.00 H new ATOM 0 HG3 LYS A 50 17.814 -3.485 -6.979 1.00 0.00 H new ATOM 0 HD2 LYS A 50 17.827 -1.760 -8.798 1.00 0.00 H new ATOM 0 HD3 LYS A 50 18.635 -0.645 -7.714 1.00 0.00 H new ATOM 0 HE2 LYS A 50 19.907 -3.332 -7.987 1.00 0.00 H new ATOM 0 HE3 LYS A 50 19.943 -2.327 -9.422 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 21.889 -1.965 -8.050 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 20.956 -0.548 -8.118 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 20.922 -1.522 -6.727 1.00 0.00 H new ATOM 830 N MET A 51 14.958 0.971 -4.688 1.00 0.00 N ATOM 831 CA MET A 51 13.734 1.765 -4.690 1.00 0.00 C ATOM 832 C MET A 51 13.765 2.828 -3.595 1.00 0.00 C ATOM 833 O MET A 51 13.282 3.943 -3.791 1.00 0.00 O ATOM 834 CB MET A 51 12.498 0.870 -4.516 1.00 0.00 C ATOM 835 CG MET A 51 12.797 -0.525 -3.986 1.00 0.00 C ATOM 836 SD MET A 51 12.211 -1.826 -5.085 1.00 0.00 S ATOM 837 CE MET A 51 10.444 -1.651 -4.873 1.00 0.00 C ATOM 0 H MET A 51 15.517 1.063 -3.840 1.00 0.00 H new ATOM 0 HA MET A 51 13.671 2.265 -5.656 1.00 0.00 H new ATOM 0 HB2 MET A 51 11.802 1.362 -3.836 1.00 0.00 H new ATOM 0 HB3 MET A 51 11.993 0.779 -5.478 1.00 0.00 H new ATOM 0 HG2 MET A 51 13.872 -0.632 -3.843 1.00 0.00 H new ATOM 0 HG3 MET A 51 12.332 -0.645 -3.007 1.00 0.00 H new ATOM 0 HE1 MET A 51 9.959 -1.652 -5.849 1.00 0.00 H new ATOM 0 HE2 MET A 51 10.065 -2.482 -4.278 1.00 0.00 H new ATOM 0 HE3 MET A 51 10.230 -0.712 -4.363 1.00 0.00 H new ATOM 847 N ALA A 52 14.338 2.483 -2.443 1.00 0.00 N ATOM 848 CA ALA A 52 14.427 3.419 -1.328 1.00 0.00 C ATOM 849 C ALA A 52 15.096 4.718 -1.758 1.00 0.00 C ATOM 850 O ALA A 52 14.629 5.809 -1.429 1.00 0.00 O ATOM 851 CB ALA A 52 15.185 2.789 -0.169 1.00 0.00 C ATOM 0 H ALA A 52 14.745 1.566 -2.260 1.00 0.00 H new ATOM 0 HA ALA A 52 13.415 3.653 -0.999 1.00 0.00 H new ATOM 0 HB1 ALA A 52 15.244 3.499 0.656 1.00 0.00 H new ATOM 0 HB2 ALA A 52 14.663 1.891 0.162 1.00 0.00 H new ATOM 0 HB3 ALA A 52 16.192 2.525 -0.493 1.00 0.00 H new ATOM 857 N ALA A 53 16.189 4.594 -2.503 1.00 0.00 N ATOM 858 CA ALA A 53 16.918 5.759 -2.987 1.00 0.00 C ATOM 859 C ALA A 53 16.149 6.453 -4.107 1.00 0.00 C ATOM 860 O ALA A 53 16.326 7.648 -4.346 1.00 0.00 O ATOM 861 CB ALA A 53 18.303 5.353 -3.467 1.00 0.00 C ATOM 0 H ALA A 53 16.589 3.699 -2.784 1.00 0.00 H new ATOM 0 HA ALA A 53 17.026 6.463 -2.162 1.00 0.00 H new ATOM 0 HB1 ALA A 53 18.836 6.233 -3.826 1.00 0.00 H new ATOM 0 HB2 ALA A 53 18.857 4.904 -2.642 1.00 0.00 H new ATOM 0 HB3 ALA A 53 18.210 4.630 -4.277 1.00 0.00 H new ATOM 867 N SER A 54 15.294 5.697 -4.788 1.00 0.00 N ATOM 868 CA SER A 54 14.496 6.236 -5.881 1.00 0.00 C ATOM 869 C SER A 54 13.263 6.961 -5.351 1.00 0.00 C ATOM 870 O SER A 54 12.840 7.974 -5.907 1.00 0.00 O ATOM 871 CB SER A 54 14.071 5.115 -6.831 1.00 0.00 C ATOM 872 OG SER A 54 15.196 4.501 -7.434 1.00 0.00 O ATOM 0 H SER A 54 15.136 4.707 -4.601 1.00 0.00 H new ATOM 0 HA SER A 54 15.111 6.953 -6.425 1.00 0.00 H new ATOM 0 HB2 SER A 54 13.496 4.369 -6.283 1.00 0.00 H new ATOM 0 HB3 SER A 54 13.416 5.518 -7.603 1.00 0.00 H new ATOM 0 HG SER A 54 14.896 3.787 -8.035 1.00 0.00 H new ATOM 878 N LEU A 55 12.689 6.435 -4.272 1.00 0.00 N ATOM 879 CA LEU A 55 11.503 7.034 -3.670 1.00 0.00 C ATOM 880 C LEU A 55 11.868 8.284 -2.873 1.00 0.00 C ATOM 881 O LEU A 55 11.065 9.209 -2.749 1.00 0.00 O ATOM 882 CB LEU A 55 10.801 6.023 -2.763 1.00 0.00 C ATOM 883 CG LEU A 55 9.844 5.067 -3.480 1.00 0.00 C ATOM 884 CD1 LEU A 55 10.543 3.755 -3.800 1.00 0.00 C ATOM 885 CD2 LEU A 55 8.603 4.821 -2.636 1.00 0.00 C ATOM 0 H LEU A 55 13.026 5.597 -3.798 1.00 0.00 H new ATOM 0 HA LEU A 55 10.825 7.323 -4.473 1.00 0.00 H new ATOM 0 HB2 LEU A 55 11.558 5.435 -2.245 1.00 0.00 H new ATOM 0 HB3 LEU A 55 10.244 6.567 -2.000 1.00 0.00 H new ATOM 0 HG LEU A 55 9.534 5.528 -4.418 1.00 0.00 H new ATOM 0 HD11 LEU A 55 9.848 3.087 -4.309 1.00 0.00 H new ATOM 0 HD12 LEU A 55 11.400 3.947 -4.445 1.00 0.00 H new ATOM 0 HD13 LEU A 55 10.882 3.288 -2.875 1.00 0.00 H new ATOM 0 HD21 LEU A 55 7.935 4.139 -3.162 1.00 0.00 H new ATOM 0 HD22 LEU A 55 8.893 4.381 -1.682 1.00 0.00 H new ATOM 0 HD23 LEU A 55 8.091 5.766 -2.458 1.00 0.00 H new ATOM 897 N LEU A 56 13.082 8.303 -2.335 1.00 0.00 N ATOM 898 CA LEU A 56 13.552 9.439 -1.550 1.00 0.00 C ATOM 899 C LEU A 56 13.995 10.584 -2.456 1.00 0.00 C ATOM 900 O LEU A 56 13.940 11.751 -2.069 1.00 0.00 O ATOM 901 CB LEU A 56 14.710 9.013 -0.644 1.00 0.00 C ATOM 902 CG LEU A 56 14.985 9.942 0.540 1.00 0.00 C ATOM 903 CD1 LEU A 56 15.578 11.257 0.061 1.00 0.00 C ATOM 904 CD2 LEU A 56 13.710 10.186 1.334 1.00 0.00 C ATOM 0 H LEU A 56 13.759 7.545 -2.428 1.00 0.00 H new ATOM 0 HA LEU A 56 12.724 9.789 -0.933 1.00 0.00 H new ATOM 0 HB2 LEU A 56 14.502 8.014 -0.261 1.00 0.00 H new ATOM 0 HB3 LEU A 56 15.615 8.941 -1.247 1.00 0.00 H new ATOM 0 HG LEU A 56 15.710 9.459 1.195 1.00 0.00 H new ATOM 0 HD11 LEU A 56 15.767 11.904 0.917 1.00 0.00 H new ATOM 0 HD12 LEU A 56 16.515 11.065 -0.462 1.00 0.00 H new ATOM 0 HD13 LEU A 56 14.878 11.746 -0.617 1.00 0.00 H new ATOM 0 HD21 LEU A 56 13.925 10.849 2.172 1.00 0.00 H new ATOM 0 HD22 LEU A 56 12.962 10.647 0.689 1.00 0.00 H new ATOM 0 HD23 LEU A 56 13.329 9.237 1.710 1.00 0.00 H new ATOM 916 N ASN A 57 14.435 10.243 -3.664 1.00 0.00 N ATOM 917 CA ASN A 57 14.889 11.244 -4.623 1.00 0.00 C ATOM 918 C ASN A 57 13.777 12.246 -4.936 1.00 0.00 C ATOM 919 O ASN A 57 12.659 11.854 -5.272 1.00 0.00 O ATOM 920 CB ASN A 57 15.357 10.565 -5.911 1.00 0.00 C ATOM 921 CG ASN A 57 16.661 11.139 -6.427 1.00 0.00 C ATOM 922 OD1 ASN A 57 17.481 11.639 -5.657 1.00 0.00 O ATOM 923 ND2 ASN A 57 16.860 11.070 -7.738 1.00 0.00 N ATOM 0 H ASN A 57 14.487 9.282 -4.001 1.00 0.00 H new ATOM 0 HA ASN A 57 15.724 11.786 -4.179 1.00 0.00 H new ATOM 0 HB2 ASN A 57 15.479 9.497 -5.731 1.00 0.00 H new ATOM 0 HB3 ASN A 57 14.588 10.674 -6.676 1.00 0.00 H new ATOM 0 HD21 ASN A 57 17.720 11.440 -8.144 1.00 0.00 H new ATOM 0 HD22 ASN A 57 16.153 10.647 -8.340 1.00 0.00 H new ATOM 930 N PRO A 58 14.066 13.559 -4.835 1.00 0.00 N ATOM 931 CA PRO A 58 13.078 14.609 -5.117 1.00 0.00 C ATOM 932 C PRO A 58 12.548 14.545 -6.548 1.00 0.00 C ATOM 933 O PRO A 58 11.533 15.161 -6.872 1.00 0.00 O ATOM 934 CB PRO A 58 13.856 15.913 -4.900 1.00 0.00 C ATOM 935 CG PRO A 58 15.026 15.533 -4.060 1.00 0.00 C ATOM 936 CD PRO A 58 15.370 14.124 -4.444 1.00 0.00 C ATOM 0 HA PRO A 58 12.199 14.510 -4.480 1.00 0.00 H new ATOM 0 HB2 PRO A 58 14.176 16.344 -5.849 1.00 0.00 H new ATOM 0 HB3 PRO A 58 13.240 16.661 -4.402 1.00 0.00 H new ATOM 0 HG2 PRO A 58 15.868 16.202 -4.238 1.00 0.00 H new ATOM 0 HG3 PRO A 58 14.783 15.600 -2.999 1.00 0.00 H new ATOM 0 HD2 PRO A 58 16.086 14.093 -5.265 1.00 0.00 H new ATOM 0 HD3 PRO A 58 15.814 13.576 -3.613 1.00 0.00 H new ATOM 944 N TYR A 59 13.243 13.799 -7.400 1.00 0.00 N ATOM 945 CA TYR A 59 12.850 13.656 -8.798 1.00 0.00 C ATOM 946 C TYR A 59 11.744 12.616 -8.961 1.00 0.00 C ATOM 947 O TYR A 59 11.082 12.561 -9.997 1.00 0.00 O ATOM 948 CB TYR A 59 14.065 13.267 -9.642 1.00 0.00 C ATOM 949 CG TYR A 59 15.265 14.157 -9.409 1.00 0.00 C ATOM 950 CD1 TYR A 59 16.082 13.976 -8.300 1.00 0.00 C ATOM 951 CD2 TYR A 59 15.578 15.182 -10.293 1.00 0.00 C ATOM 952 CE1 TYR A 59 17.176 14.790 -8.079 1.00 0.00 C ATOM 953 CE2 TYR A 59 16.672 15.999 -10.080 1.00 0.00 C ATOM 954 CZ TYR A 59 17.466 15.800 -8.971 1.00 0.00 C ATOM 955 OH TYR A 59 18.555 16.613 -8.754 1.00 0.00 O ATOM 0 H TYR A 59 14.085 13.282 -7.146 1.00 0.00 H new ATOM 0 HA TYR A 59 12.462 14.615 -9.141 1.00 0.00 H new ATOM 0 HB2 TYR A 59 14.338 12.235 -9.420 1.00 0.00 H new ATOM 0 HB3 TYR A 59 13.793 13.304 -10.697 1.00 0.00 H new ATOM 0 HD1 TYR A 59 15.858 13.186 -7.599 1.00 0.00 H new ATOM 0 HD2 TYR A 59 14.956 15.343 -11.161 1.00 0.00 H new ATOM 0 HE1 TYR A 59 17.801 14.636 -7.212 1.00 0.00 H new ATOM 0 HE2 TYR A 59 16.904 16.789 -10.779 1.00 0.00 H new ATOM 0 HH TYR A 59 18.620 17.273 -9.476 1.00 0.00 H new ATOM 965 N VAL A 60 11.547 11.791 -7.935 1.00 0.00 N ATOM 966 CA VAL A 60 10.520 10.756 -7.971 1.00 0.00 C ATOM 967 C VAL A 60 9.154 11.342 -8.320 1.00 0.00 C ATOM 968 O VAL A 60 8.306 10.662 -8.898 1.00 0.00 O ATOM 969 CB VAL A 60 10.426 10.019 -6.621 1.00 0.00 C ATOM 970 CG1 VAL A 60 10.067 10.988 -5.505 1.00 0.00 C ATOM 971 CG2 VAL A 60 9.417 8.883 -6.697 1.00 0.00 C ATOM 0 H VAL A 60 12.086 11.820 -7.069 1.00 0.00 H new ATOM 0 HA VAL A 60 10.810 10.047 -8.746 1.00 0.00 H new ATOM 0 HB VAL A 60 11.402 9.590 -6.397 1.00 0.00 H new ATOM 0 HG11 VAL A 60 10.005 10.448 -4.560 1.00 0.00 H new ATOM 0 HG12 VAL A 60 10.833 11.760 -5.433 1.00 0.00 H new ATOM 0 HG13 VAL A 60 9.105 11.452 -5.721 1.00 0.00 H new ATOM 0 HG21 VAL A 60 9.366 8.376 -5.733 1.00 0.00 H new ATOM 0 HG22 VAL A 60 8.435 9.285 -6.948 1.00 0.00 H new ATOM 0 HG23 VAL A 60 9.725 8.173 -7.465 1.00 0.00 H new ATOM 981 N LYS A 61 8.949 12.607 -7.966 1.00 0.00 N ATOM 982 CA LYS A 61 7.686 13.282 -8.243 1.00 0.00 C ATOM 983 C LYS A 61 6.523 12.564 -7.566 1.00 0.00 C ATOM 984 O LYS A 61 6.715 11.554 -6.888 1.00 0.00 O ATOM 985 CB LYS A 61 7.444 13.358 -9.751 1.00 0.00 C ATOM 986 CG LYS A 61 8.669 13.785 -10.545 1.00 0.00 C ATOM 987 CD LYS A 61 8.310 14.782 -11.634 1.00 0.00 C ATOM 988 CE LYS A 61 8.397 16.213 -11.130 1.00 0.00 C ATOM 989 NZ LYS A 61 7.899 17.189 -12.138 1.00 0.00 N ATOM 0 H LYS A 61 9.640 13.184 -7.487 1.00 0.00 H new ATOM 0 HA LYS A 61 7.749 14.293 -7.840 1.00 0.00 H new ATOM 0 HB2 LYS A 61 7.113 12.382 -10.107 1.00 0.00 H new ATOM 0 HB3 LYS A 61 6.633 14.060 -9.945 1.00 0.00 H new ATOM 0 HG2 LYS A 61 9.403 14.229 -9.872 1.00 0.00 H new ATOM 0 HG3 LYS A 61 9.137 12.908 -10.993 1.00 0.00 H new ATOM 0 HD2 LYS A 61 8.982 14.653 -12.483 1.00 0.00 H new ATOM 0 HD3 LYS A 61 7.300 14.582 -11.993 1.00 0.00 H new ATOM 0 HE2 LYS A 61 7.816 16.311 -10.213 1.00 0.00 H new ATOM 0 HE3 LYS A 61 9.432 16.447 -10.879 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 7.975 18.153 -11.755 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 8.469 17.114 -13.005 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 6.904 16.982 -12.359 1.00 0.00 H new ATOM 1003 N ARG A 62 5.319 13.092 -7.755 1.00 0.00 N ATOM 1004 CA ARG A 62 4.125 12.501 -7.164 1.00 0.00 C ATOM 1005 C ARG A 62 3.300 11.771 -8.219 1.00 0.00 C ATOM 1006 O ARG A 62 2.637 10.777 -7.925 1.00 0.00 O ATOM 1007 CB ARG A 62 3.274 13.582 -6.493 1.00 0.00 C ATOM 1008 CG ARG A 62 2.027 13.039 -5.812 1.00 0.00 C ATOM 1009 CD ARG A 62 0.903 14.063 -5.814 1.00 0.00 C ATOM 1010 NE ARG A 62 1.034 15.023 -4.720 1.00 0.00 N ATOM 1011 CZ ARG A 62 0.145 15.979 -4.462 1.00 0.00 C ATOM 1012 NH1 ARG A 62 -0.939 16.107 -5.216 1.00 0.00 N ATOM 1013 NH2 ARG A 62 0.342 16.809 -3.447 1.00 0.00 N ATOM 0 H ARG A 62 5.144 13.928 -8.313 1.00 0.00 H new ATOM 0 HA ARG A 62 4.442 11.778 -6.412 1.00 0.00 H new ATOM 0 HB2 ARG A 62 3.882 14.106 -5.755 1.00 0.00 H new ATOM 0 HB3 ARG A 62 2.978 14.317 -7.242 1.00 0.00 H new ATOM 0 HG2 ARG A 62 1.697 12.134 -6.322 1.00 0.00 H new ATOM 0 HG3 ARG A 62 2.264 12.759 -4.786 1.00 0.00 H new ATOM 0 HD2 ARG A 62 0.900 14.596 -6.765 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -0.055 13.550 -5.733 1.00 0.00 H new ATOM 0 HE ARG A 62 1.855 14.956 -4.119 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -1.094 15.471 -5.998 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -1.617 16.842 -5.014 1.00 0.00 H new ATOM 0 HH21 ARG A 62 1.174 16.714 -2.865 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -0.339 17.542 -3.248 1.00 0.00 H new ATOM 1027 N SER A 63 3.346 12.272 -9.449 1.00 0.00 N ATOM 1028 CA SER A 63 2.605 11.668 -10.549 1.00 0.00 C ATOM 1029 C SER A 63 3.433 10.585 -11.233 1.00 0.00 C ATOM 1030 O SER A 63 2.913 9.532 -11.602 1.00 0.00 O ATOM 1031 CB SER A 63 2.200 12.735 -11.567 1.00 0.00 C ATOM 1032 OG SER A 63 3.307 13.135 -12.356 1.00 0.00 O ATOM 0 H SER A 63 3.889 13.095 -9.709 1.00 0.00 H new ATOM 0 HA SER A 63 1.706 11.208 -10.138 1.00 0.00 H new ATOM 0 HB2 SER A 63 1.412 12.346 -12.212 1.00 0.00 H new ATOM 0 HB3 SER A 63 1.789 13.600 -11.047 1.00 0.00 H new ATOM 0 HG SER A 63 3.021 13.816 -13.000 1.00 0.00 H new ATOM 1038 N VAL A 64 4.725 10.851 -11.398 1.00 0.00 N ATOM 1039 CA VAL A 64 5.625 9.898 -12.036 1.00 0.00 C ATOM 1040 C VAL A 64 5.656 8.579 -11.273 1.00 0.00 C ATOM 1041 O VAL A 64 5.548 7.505 -11.866 1.00 0.00 O ATOM 1042 CB VAL A 64 7.057 10.457 -12.134 1.00 0.00 C ATOM 1043 CG1 VAL A 64 7.943 9.524 -12.947 1.00 0.00 C ATOM 1044 CG2 VAL A 64 7.045 11.853 -12.740 1.00 0.00 C ATOM 0 H VAL A 64 5.171 11.718 -11.099 1.00 0.00 H new ATOM 0 HA VAL A 64 5.242 9.724 -13.042 1.00 0.00 H new ATOM 0 HB VAL A 64 7.469 10.525 -11.127 1.00 0.00 H new ATOM 0 HG11 VAL A 64 8.950 9.937 -13.004 1.00 0.00 H new ATOM 0 HG12 VAL A 64 7.979 8.546 -12.467 1.00 0.00 H new ATOM 0 HG13 VAL A 64 7.536 9.420 -13.953 1.00 0.00 H new ATOM 0 HG21 VAL A 64 8.065 12.232 -12.801 1.00 0.00 H new ATOM 0 HG22 VAL A 64 6.612 11.812 -13.740 1.00 0.00 H new ATOM 0 HG23 VAL A 64 6.449 12.516 -12.114 1.00 0.00 H new ATOM 1054 N LYS A 65 5.802 8.665 -9.954 1.00 0.00 N ATOM 1055 CA LYS A 65 5.844 7.477 -9.110 1.00 0.00 C ATOM 1056 C LYS A 65 4.602 6.615 -9.323 1.00 0.00 C ATOM 1057 O LYS A 65 4.652 5.392 -9.185 1.00 0.00 O ATOM 1058 CB LYS A 65 5.958 7.876 -7.637 1.00 0.00 C ATOM 1059 CG LYS A 65 7.023 7.103 -6.877 1.00 0.00 C ATOM 1060 CD LYS A 65 6.560 5.692 -6.550 1.00 0.00 C ATOM 1061 CE LYS A 65 7.715 4.705 -6.589 1.00 0.00 C ATOM 1062 NZ LYS A 65 7.768 3.963 -7.880 1.00 0.00 N ATOM 0 H LYS A 65 5.893 9.546 -9.447 1.00 0.00 H new ATOM 0 HA LYS A 65 6.721 6.893 -9.389 1.00 0.00 H new ATOM 0 HB2 LYS A 65 6.180 8.941 -7.574 1.00 0.00 H new ATOM 0 HB3 LYS A 65 4.994 7.722 -7.152 1.00 0.00 H new ATOM 0 HG2 LYS A 65 7.936 7.059 -7.471 1.00 0.00 H new ATOM 0 HG3 LYS A 65 7.268 7.630 -5.955 1.00 0.00 H new ATOM 0 HD2 LYS A 65 6.101 5.678 -5.561 1.00 0.00 H new ATOM 0 HD3 LYS A 65 5.793 5.385 -7.261 1.00 0.00 H new ATOM 0 HE2 LYS A 65 8.654 5.238 -6.438 1.00 0.00 H new ATOM 0 HE3 LYS A 65 7.615 3.996 -5.767 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 8.744 3.654 -8.063 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 7.146 3.131 -7.828 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 7.451 4.585 -8.651 1.00 0.00 H new ATOM 1076 N VAL A 66 3.491 7.261 -9.662 1.00 0.00 N ATOM 1077 CA VAL A 66 2.239 6.553 -9.896 1.00 0.00 C ATOM 1078 C VAL A 66 2.362 5.600 -11.079 1.00 0.00 C ATOM 1079 O VAL A 66 2.019 4.421 -10.976 1.00 0.00 O ATOM 1080 CB VAL A 66 1.078 7.533 -10.159 1.00 0.00 C ATOM 1081 CG1 VAL A 66 -0.244 6.785 -10.255 1.00 0.00 C ATOM 1082 CG2 VAL A 66 1.018 8.595 -9.071 1.00 0.00 C ATOM 0 H VAL A 66 3.433 8.272 -9.781 1.00 0.00 H new ATOM 0 HA VAL A 66 2.024 5.983 -8.992 1.00 0.00 H new ATOM 0 HB VAL A 66 1.258 8.030 -11.112 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -1.051 7.494 -10.441 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -0.197 6.066 -11.073 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -0.433 6.258 -9.320 1.00 0.00 H new ATOM 0 HG21 VAL A 66 0.193 9.277 -9.274 1.00 0.00 H new ATOM 0 HG22 VAL A 66 0.864 8.117 -8.104 1.00 0.00 H new ATOM 0 HG23 VAL A 66 1.954 9.153 -9.055 1.00 0.00 H new ATOM 1092 N LYS A 67 2.859 6.112 -12.200 1.00 0.00 N ATOM 1093 CA LYS A 67 3.030 5.301 -13.398 1.00 0.00 C ATOM 1094 C LYS A 67 4.043 4.189 -13.153 1.00 0.00 C ATOM 1095 O LYS A 67 3.819 3.037 -13.526 1.00 0.00 O ATOM 1096 CB LYS A 67 3.481 6.171 -14.572 1.00 0.00 C ATOM 1097 CG LYS A 67 2.914 5.728 -15.911 1.00 0.00 C ATOM 1098 CD LYS A 67 3.873 6.030 -17.050 1.00 0.00 C ATOM 1099 CE LYS A 67 3.167 6.004 -18.396 1.00 0.00 C ATOM 1100 NZ LYS A 67 4.089 6.342 -19.514 1.00 0.00 N ATOM 0 H LYS A 67 3.150 7.084 -12.303 1.00 0.00 H new ATOM 0 HA LYS A 67 2.069 4.849 -13.644 1.00 0.00 H new ATOM 0 HB2 LYS A 67 3.183 7.203 -14.384 1.00 0.00 H new ATOM 0 HB3 LYS A 67 4.570 6.158 -14.626 1.00 0.00 H new ATOM 0 HG2 LYS A 67 2.706 4.658 -15.883 1.00 0.00 H new ATOM 0 HG3 LYS A 67 1.965 6.233 -16.090 1.00 0.00 H new ATOM 0 HD2 LYS A 67 4.327 7.009 -16.895 1.00 0.00 H new ATOM 0 HD3 LYS A 67 4.682 5.300 -17.049 1.00 0.00 H new ATOM 0 HE2 LYS A 67 2.741 5.015 -18.563 1.00 0.00 H new ATOM 0 HE3 LYS A 67 2.337 6.710 -18.384 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 3.569 6.313 -20.414 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 4.476 7.296 -19.368 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 4.868 5.653 -19.542 1.00 0.00 H new ATOM 1114 N SER A 68 5.155 4.540 -12.515 1.00 0.00 N ATOM 1115 CA SER A 68 6.200 3.570 -12.213 1.00 0.00 C ATOM 1116 C SER A 68 5.702 2.540 -11.204 1.00 0.00 C ATOM 1117 O SER A 68 6.190 1.411 -11.163 1.00 0.00 O ATOM 1118 CB SER A 68 7.441 4.278 -11.668 1.00 0.00 C ATOM 1119 OG SER A 68 8.316 3.361 -11.034 1.00 0.00 O ATOM 0 H SER A 68 5.355 5.488 -12.198 1.00 0.00 H new ATOM 0 HA SER A 68 6.464 3.054 -13.136 1.00 0.00 H new ATOM 0 HB2 SER A 68 7.964 4.780 -12.482 1.00 0.00 H new ATOM 0 HB3 SER A 68 7.141 5.049 -10.958 1.00 0.00 H new ATOM 0 HG SER A 68 9.102 3.839 -10.696 1.00 0.00 H new ATOM 1125 N LEU A 69 4.726 2.937 -10.391 1.00 0.00 N ATOM 1126 CA LEU A 69 4.163 2.048 -9.383 1.00 0.00 C ATOM 1127 C LEU A 69 3.334 0.943 -10.033 1.00 0.00 C ATOM 1128 O LEU A 69 3.394 -0.214 -9.621 1.00 0.00 O ATOM 1129 CB LEU A 69 3.297 2.841 -8.401 1.00 0.00 C ATOM 1130 CG LEU A 69 4.023 3.328 -7.146 1.00 0.00 C ATOM 1131 CD1 LEU A 69 3.379 4.600 -6.616 1.00 0.00 C ATOM 1132 CD2 LEU A 69 4.024 2.244 -6.079 1.00 0.00 C ATOM 0 H LEU A 69 4.310 3.868 -10.412 1.00 0.00 H new ATOM 0 HA LEU A 69 4.988 1.586 -8.840 1.00 0.00 H new ATOM 0 HB2 LEU A 69 2.883 3.705 -8.921 1.00 0.00 H new ATOM 0 HB3 LEU A 69 2.456 2.218 -8.097 1.00 0.00 H new ATOM 0 HG LEU A 69 5.056 3.552 -7.410 1.00 0.00 H new ATOM 0 HD11 LEU A 69 3.909 4.931 -5.723 1.00 0.00 H new ATOM 0 HD12 LEU A 69 3.430 5.378 -7.378 1.00 0.00 H new ATOM 0 HD13 LEU A 69 2.336 4.403 -6.367 1.00 0.00 H new ATOM 0 HD21 LEU A 69 4.544 2.607 -5.193 1.00 0.00 H new ATOM 0 HD22 LEU A 69 2.997 1.989 -5.818 1.00 0.00 H new ATOM 0 HD23 LEU A 69 4.532 1.358 -6.461 1.00 0.00 H new ATOM 1144 N SER A 70 2.559 1.312 -11.047 1.00 0.00 N ATOM 1145 CA SER A 70 1.713 0.354 -11.751 1.00 0.00 C ATOM 1146 C SER A 70 2.546 -0.616 -12.579 1.00 0.00 C ATOM 1147 O SER A 70 2.109 -1.730 -12.871 1.00 0.00 O ATOM 1148 CB SER A 70 0.712 1.083 -12.649 1.00 0.00 C ATOM 1149 OG SER A 70 -0.292 0.201 -13.117 1.00 0.00 O ATOM 0 H SER A 70 2.499 2.267 -11.400 1.00 0.00 H new ATOM 0 HA SER A 70 1.167 -0.220 -11.002 1.00 0.00 H new ATOM 0 HB2 SER A 70 0.252 1.902 -12.096 1.00 0.00 H new ATOM 0 HB3 SER A 70 1.235 1.526 -13.497 1.00 0.00 H new ATOM 0 HG SER A 70 -0.919 0.693 -13.687 1.00 0.00 H new ATOM 1155 N ASP A 71 3.751 -0.200 -12.949 1.00 0.00 N ATOM 1156 CA ASP A 71 4.637 -1.051 -13.728 1.00 0.00 C ATOM 1157 C ASP A 71 5.565 -1.815 -12.799 1.00 0.00 C ATOM 1158 O ASP A 71 5.912 -2.967 -13.059 1.00 0.00 O ATOM 1159 CB ASP A 71 5.447 -0.221 -14.726 1.00 0.00 C ATOM 1160 CG ASP A 71 4.680 0.059 -16.002 1.00 0.00 C ATOM 1161 OD1 ASP A 71 3.456 0.296 -15.919 1.00 0.00 O ATOM 1162 OD2 ASP A 71 5.301 0.040 -17.086 1.00 0.00 O ATOM 0 H ASP A 71 4.134 0.718 -12.723 1.00 0.00 H new ATOM 0 HA ASP A 71 4.032 -1.762 -14.291 1.00 0.00 H new ATOM 0 HB2 ASP A 71 5.732 0.723 -14.262 1.00 0.00 H new ATOM 0 HB3 ASP A 71 6.370 -0.748 -14.968 1.00 0.00 H new ATOM 1167 N MET A 72 5.942 -1.175 -11.701 1.00 0.00 N ATOM 1168 CA MET A 72 6.806 -1.805 -10.720 1.00 0.00 C ATOM 1169 C MET A 72 5.990 -2.735 -9.840 1.00 0.00 C ATOM 1170 O MET A 72 6.517 -3.712 -9.305 1.00 0.00 O ATOM 1171 CB MET A 72 7.531 -0.752 -9.872 1.00 0.00 C ATOM 1172 CG MET A 72 6.676 -0.151 -8.768 1.00 0.00 C ATOM 1173 SD MET A 72 6.957 -0.935 -7.168 1.00 0.00 S ATOM 1174 CE MET A 72 5.293 -1.446 -6.746 1.00 0.00 C ATOM 0 H MET A 72 5.662 -0.222 -11.470 1.00 0.00 H new ATOM 0 HA MET A 72 7.564 -2.388 -11.244 1.00 0.00 H new ATOM 0 HB2 MET A 72 8.416 -1.206 -9.426 1.00 0.00 H new ATOM 0 HB3 MET A 72 7.879 0.049 -10.525 1.00 0.00 H new ATOM 0 HG2 MET A 72 6.889 0.915 -8.688 1.00 0.00 H new ATOM 0 HG3 MET A 72 5.624 -0.247 -9.036 1.00 0.00 H new ATOM 0 HE1 MET A 72 4.998 -0.983 -5.804 1.00 0.00 H new ATOM 0 HE2 MET A 72 4.606 -1.136 -7.534 1.00 0.00 H new ATOM 0 HE3 MET A 72 5.261 -2.531 -6.643 1.00 0.00 H new ATOM 1184 N THR A 73 4.695 -2.451 -9.705 1.00 0.00 N ATOM 1185 CA THR A 73 3.841 -3.304 -8.905 1.00 0.00 C ATOM 1186 C THR A 73 3.746 -4.673 -9.548 1.00 0.00 C ATOM 1187 O THR A 73 3.599 -5.684 -8.860 1.00 0.00 O ATOM 1188 CB THR A 73 2.445 -2.722 -8.729 1.00 0.00 C ATOM 1189 OG1 THR A 73 1.685 -3.571 -7.903 1.00 0.00 O ATOM 1190 CG2 THR A 73 1.677 -2.565 -10.014 1.00 0.00 C ATOM 0 H THR A 73 4.229 -1.651 -10.133 1.00 0.00 H new ATOM 0 HA THR A 73 4.289 -3.382 -7.915 1.00 0.00 H new ATOM 0 HB THR A 73 2.595 -1.732 -8.299 1.00 0.00 H new ATOM 0 HG1 THR A 73 2.150 -3.700 -7.050 1.00 0.00 H new ATOM 0 HG21 THR A 73 0.694 -2.145 -9.801 1.00 0.00 H new ATOM 0 HG22 THR A 73 2.220 -1.898 -10.683 1.00 0.00 H new ATOM 0 HG23 THR A 73 1.560 -3.539 -10.489 1.00 0.00 H new ATOM 1198 N ALA A 74 3.852 -4.707 -10.876 1.00 0.00 N ATOM 1199 CA ALA A 74 3.802 -5.967 -11.600 1.00 0.00 C ATOM 1200 C ALA A 74 4.764 -6.967 -10.972 1.00 0.00 C ATOM 1201 O ALA A 74 4.559 -8.178 -11.053 1.00 0.00 O ATOM 1202 CB ALA A 74 4.139 -5.750 -13.069 1.00 0.00 C ATOM 0 H ALA A 74 3.972 -3.882 -11.464 1.00 0.00 H new ATOM 0 HA ALA A 74 2.791 -6.369 -11.538 1.00 0.00 H new ATOM 0 HB1 ALA A 74 4.097 -6.703 -13.597 1.00 0.00 H new ATOM 0 HB2 ALA A 74 3.420 -5.060 -13.509 1.00 0.00 H new ATOM 0 HB3 ALA A 74 5.142 -5.332 -13.154 1.00 0.00 H new ATOM 1208 N LYS A 75 5.817 -6.448 -10.338 1.00 0.00 N ATOM 1209 CA LYS A 75 6.808 -7.296 -9.693 1.00 0.00 C ATOM 1210 C LYS A 75 6.552 -7.426 -8.190 1.00 0.00 C ATOM 1211 O LYS A 75 7.038 -8.362 -7.557 1.00 0.00 O ATOM 1212 CB LYS A 75 8.216 -6.751 -9.936 1.00 0.00 C ATOM 1213 CG LYS A 75 8.869 -7.295 -11.196 1.00 0.00 C ATOM 1214 CD LYS A 75 9.763 -8.486 -10.890 1.00 0.00 C ATOM 1215 CE LYS A 75 9.710 -9.522 -11.999 1.00 0.00 C ATOM 1216 NZ LYS A 75 10.063 -10.882 -11.507 1.00 0.00 N ATOM 0 H LYS A 75 6.001 -5.448 -10.260 1.00 0.00 H new ATOM 0 HA LYS A 75 6.724 -8.289 -10.135 1.00 0.00 H new ATOM 0 HB2 LYS A 75 8.170 -5.664 -10.001 1.00 0.00 H new ATOM 0 HB3 LYS A 75 8.843 -6.993 -9.078 1.00 0.00 H new ATOM 0 HG2 LYS A 75 8.098 -7.590 -11.908 1.00 0.00 H new ATOM 0 HG3 LYS A 75 9.457 -6.510 -11.671 1.00 0.00 H new ATOM 0 HD2 LYS A 75 10.790 -8.146 -10.757 1.00 0.00 H new ATOM 0 HD3 LYS A 75 9.454 -8.942 -9.950 1.00 0.00 H new ATOM 0 HE2 LYS A 75 8.709 -9.541 -12.430 1.00 0.00 H new ATOM 0 HE3 LYS A 75 10.396 -9.235 -12.796 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 10.015 -11.559 -12.295 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 11.028 -10.871 -11.118 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 9.394 -11.167 -10.764 1.00 0.00 H new ATOM 1230 N GLU A 76 5.790 -6.494 -7.618 1.00 0.00 N ATOM 1231 CA GLU A 76 5.494 -6.543 -6.192 1.00 0.00 C ATOM 1232 C GLU A 76 4.398 -7.561 -5.900 1.00 0.00 C ATOM 1233 O GLU A 76 4.621 -8.531 -5.177 1.00 0.00 O ATOM 1234 CB GLU A 76 5.075 -5.162 -5.685 1.00 0.00 C ATOM 1235 CG GLU A 76 6.196 -4.400 -4.998 1.00 0.00 C ATOM 1236 CD GLU A 76 7.443 -4.298 -5.855 1.00 0.00 C ATOM 1237 OE1 GLU A 76 7.336 -4.482 -7.086 1.00 0.00 O ATOM 1238 OE2 GLU A 76 8.528 -4.035 -5.295 1.00 0.00 O ATOM 0 H GLU A 76 5.373 -5.707 -8.115 1.00 0.00 H new ATOM 0 HA GLU A 76 6.400 -6.851 -5.670 1.00 0.00 H new ATOM 0 HB2 GLU A 76 4.707 -4.572 -6.525 1.00 0.00 H new ATOM 0 HB3 GLU A 76 4.245 -5.277 -4.988 1.00 0.00 H new ATOM 0 HG2 GLU A 76 5.849 -3.398 -4.748 1.00 0.00 H new ATOM 0 HG3 GLU A 76 6.444 -4.895 -4.059 1.00 0.00 H new ATOM 1245 N LYS A 77 3.215 -7.329 -6.475 1.00 0.00 N ATOM 1246 CA LYS A 77 2.062 -8.219 -6.294 1.00 0.00 C ATOM 1247 C LYS A 77 0.751 -7.473 -6.543 1.00 0.00 C ATOM 1248 O LYS A 77 -0.221 -8.055 -7.023 1.00 0.00 O ATOM 1249 CB LYS A 77 2.040 -8.821 -4.882 1.00 0.00 C ATOM 1250 CG LYS A 77 2.547 -10.252 -4.823 1.00 0.00 C ATOM 1251 CD LYS A 77 3.306 -10.522 -3.533 1.00 0.00 C ATOM 1252 CE LYS A 77 4.051 -11.844 -3.591 1.00 0.00 C ATOM 1253 NZ LYS A 77 5.239 -11.775 -4.487 1.00 0.00 N ATOM 0 H LYS A 77 3.029 -6.526 -7.075 1.00 0.00 H new ATOM 0 HA LYS A 77 2.161 -9.025 -7.021 1.00 0.00 H new ATOM 0 HB2 LYS A 77 2.648 -8.202 -4.222 1.00 0.00 H new ATOM 0 HB3 LYS A 77 1.020 -8.790 -4.499 1.00 0.00 H new ATOM 0 HG2 LYS A 77 1.706 -10.941 -4.902 1.00 0.00 H new ATOM 0 HG3 LYS A 77 3.198 -10.444 -5.676 1.00 0.00 H new ATOM 0 HD2 LYS A 77 4.013 -9.713 -3.349 1.00 0.00 H new ATOM 0 HD3 LYS A 77 2.609 -10.533 -2.695 1.00 0.00 H new ATOM 0 HE2 LYS A 77 4.370 -12.125 -2.587 1.00 0.00 H new ATOM 0 HE3 LYS A 77 3.377 -12.625 -3.942 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 5.942 -12.480 -4.186 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 4.948 -11.972 -5.466 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 5.658 -10.824 -4.436 1.00 0.00 H new ATOM 1267 N PHE A 78 0.728 -6.187 -6.193 1.00 0.00 N ATOM 1268 CA PHE A 78 -0.467 -5.360 -6.360 1.00 0.00 C ATOM 1269 C PHE A 78 -1.063 -5.486 -7.740 1.00 0.00 C ATOM 1270 O PHE A 78 -0.582 -6.241 -8.584 1.00 0.00 O ATOM 1271 CB PHE A 78 -0.160 -3.884 -6.117 1.00 0.00 C ATOM 1272 CG PHE A 78 0.901 -3.654 -5.099 1.00 0.00 C ATOM 1273 CD1 PHE A 78 0.857 -4.312 -3.887 1.00 0.00 C ATOM 1274 CD2 PHE A 78 1.953 -2.802 -5.366 1.00 0.00 C ATOM 1275 CE1 PHE A 78 1.853 -4.120 -2.952 1.00 0.00 C ATOM 1276 CE2 PHE A 78 2.948 -2.600 -4.439 1.00 0.00 C ATOM 1277 CZ PHE A 78 2.901 -3.260 -3.227 1.00 0.00 C ATOM 0 H PHE A 78 1.526 -5.694 -5.791 1.00 0.00 H new ATOM 0 HA PHE A 78 -1.182 -5.725 -5.623 1.00 0.00 H new ATOM 0 HB2 PHE A 78 0.146 -3.426 -7.058 1.00 0.00 H new ATOM 0 HB3 PHE A 78 -1.072 -3.380 -5.799 1.00 0.00 H new ATOM 0 HD1 PHE A 78 0.038 -4.981 -3.669 1.00 0.00 H new ATOM 0 HD2 PHE A 78 1.995 -2.288 -6.315 1.00 0.00 H new ATOM 0 HE1 PHE A 78 1.815 -4.640 -2.006 1.00 0.00 H new ATOM 0 HE2 PHE A 78 3.764 -1.927 -4.658 1.00 0.00 H new ATOM 0 HZ PHE A 78 3.680 -3.105 -2.496 1.00 0.00 H new ATOM 1287 N SER A 79 -2.109 -4.696 -7.948 1.00 0.00 N ATOM 1288 CA SER A 79 -2.823 -4.634 -9.216 1.00 0.00 C ATOM 1289 C SER A 79 -4.331 -4.571 -9.003 1.00 0.00 C ATOM 1290 O SER A 79 -5.027 -3.836 -9.703 1.00 0.00 O ATOM 1291 CB SER A 79 -2.488 -5.821 -10.128 1.00 0.00 C ATOM 1292 OG SER A 79 -3.410 -5.918 -11.200 1.00 0.00 O ATOM 0 H SER A 79 -2.489 -4.075 -7.234 1.00 0.00 H new ATOM 0 HA SER A 79 -2.492 -3.719 -9.707 1.00 0.00 H new ATOM 0 HB2 SER A 79 -1.478 -5.707 -10.522 1.00 0.00 H new ATOM 0 HB3 SER A 79 -2.501 -6.744 -9.548 1.00 0.00 H new ATOM 0 HG SER A 79 -3.173 -6.681 -11.767 1.00 0.00 H new ATOM 1298 N PRO A 80 -4.879 -5.378 -8.080 1.00 0.00 N ATOM 1299 CA PRO A 80 -6.304 -5.428 -7.844 1.00 0.00 C ATOM 1300 C PRO A 80 -6.790 -4.641 -6.633 1.00 0.00 C ATOM 1301 O PRO A 80 -7.453 -3.616 -6.789 1.00 0.00 O ATOM 1302 CB PRO A 80 -6.532 -6.924 -7.646 1.00 0.00 C ATOM 1303 CG PRO A 80 -5.231 -7.454 -7.094 1.00 0.00 C ATOM 1304 CD PRO A 80 -4.191 -6.361 -7.245 1.00 0.00 C ATOM 0 HA PRO A 80 -6.860 -4.967 -8.661 1.00 0.00 H new ATOM 0 HB2 PRO A 80 -7.356 -7.109 -6.957 1.00 0.00 H new ATOM 0 HB3 PRO A 80 -6.788 -7.411 -8.587 1.00 0.00 H new ATOM 0 HG2 PRO A 80 -5.345 -7.733 -6.046 1.00 0.00 H new ATOM 0 HG3 PRO A 80 -4.924 -8.352 -7.631 1.00 0.00 H new ATOM 0 HD2 PRO A 80 -3.901 -5.942 -6.282 1.00 0.00 H new ATOM 0 HD3 PRO A 80 -3.281 -6.730 -7.719 1.00 0.00 H new ATOM 1312 N LEU A 81 -6.476 -5.108 -5.430 1.00 0.00 N ATOM 1313 CA LEU A 81 -6.918 -4.405 -4.237 1.00 0.00 C ATOM 1314 C LEU A 81 -5.810 -3.513 -3.729 1.00 0.00 C ATOM 1315 O LEU A 81 -5.866 -2.986 -2.619 1.00 0.00 O ATOM 1316 CB LEU A 81 -7.350 -5.385 -3.153 1.00 0.00 C ATOM 1317 CG LEU A 81 -8.820 -5.805 -3.215 1.00 0.00 C ATOM 1318 CD1 LEU A 81 -9.730 -4.586 -3.132 1.00 0.00 C ATOM 1319 CD2 LEU A 81 -9.096 -6.588 -4.489 1.00 0.00 C ATOM 0 H LEU A 81 -5.929 -5.952 -5.258 1.00 0.00 H new ATOM 0 HA LEU A 81 -7.781 -3.792 -4.497 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -6.729 -6.278 -3.222 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -7.156 -4.936 -2.179 1.00 0.00 H new ATOM 0 HG LEU A 81 -9.029 -6.449 -2.361 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -10.771 -4.905 -3.178 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -9.552 -4.062 -2.193 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -9.519 -3.917 -3.966 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -10.146 -6.879 -4.517 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -8.869 -5.966 -5.355 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -8.471 -7.481 -4.510 1.00 0.00 H new ATOM 1331 N THR A 82 -4.800 -3.353 -4.560 1.00 0.00 N ATOM 1332 CA THR A 82 -3.665 -2.535 -4.229 1.00 0.00 C ATOM 1333 C THR A 82 -3.335 -1.587 -5.376 1.00 0.00 C ATOM 1334 O THR A 82 -2.403 -0.792 -5.276 1.00 0.00 O ATOM 1335 CB THR A 82 -2.476 -3.421 -3.899 1.00 0.00 C ATOM 1336 OG1 THR A 82 -2.854 -4.787 -3.903 1.00 0.00 O ATOM 1337 CG2 THR A 82 -1.865 -3.111 -2.551 1.00 0.00 C ATOM 0 H THR A 82 -4.749 -3.788 -5.481 1.00 0.00 H new ATOM 0 HA THR A 82 -3.905 -1.930 -3.355 1.00 0.00 H new ATOM 0 HB THR A 82 -1.734 -3.219 -4.671 1.00 0.00 H new ATOM 0 HG1 THR A 82 -3.432 -4.969 -3.132 1.00 0.00 H new ATOM 0 HG21 THR A 82 -1.021 -3.777 -2.373 1.00 0.00 H new ATOM 0 HG22 THR A 82 -1.521 -2.077 -2.537 1.00 0.00 H new ATOM 0 HG23 THR A 82 -2.612 -3.256 -1.771 1.00 0.00 H new ATOM 1345 N SER A 83 -4.112 -1.654 -6.464 1.00 0.00 N ATOM 1346 CA SER A 83 -3.880 -0.770 -7.595 1.00 0.00 C ATOM 1347 C SER A 83 -4.706 0.503 -7.453 1.00 0.00 C ATOM 1348 O SER A 83 -5.094 1.131 -8.437 1.00 0.00 O ATOM 1349 CB SER A 83 -4.214 -1.459 -8.913 1.00 0.00 C ATOM 1350 OG SER A 83 -4.136 -0.551 -9.998 1.00 0.00 O ATOM 0 H SER A 83 -4.892 -2.302 -6.578 1.00 0.00 H new ATOM 0 HA SER A 83 -2.821 -0.512 -7.602 1.00 0.00 H new ATOM 0 HB2 SER A 83 -3.526 -2.288 -9.078 1.00 0.00 H new ATOM 0 HB3 SER A 83 -5.217 -1.883 -8.861 1.00 0.00 H new ATOM 0 HG SER A 83 -4.693 0.233 -9.809 1.00 0.00 H new ATOM 1356 N ASN A 84 -4.946 0.869 -6.209 1.00 0.00 N ATOM 1357 CA ASN A 84 -5.698 2.062 -5.861 1.00 0.00 C ATOM 1358 C ASN A 84 -5.089 2.611 -4.592 1.00 0.00 C ATOM 1359 O ASN A 84 -4.806 3.803 -4.476 1.00 0.00 O ATOM 1360 CB ASN A 84 -7.179 1.736 -5.653 1.00 0.00 C ATOM 1361 CG ASN A 84 -7.991 1.903 -6.921 1.00 0.00 C ATOM 1362 OD1 ASN A 84 -8.679 2.907 -7.105 1.00 0.00 O ATOM 1363 ND2 ASN A 84 -7.915 0.915 -7.807 1.00 0.00 N ATOM 0 H ASN A 84 -4.620 0.340 -5.400 1.00 0.00 H new ATOM 0 HA ASN A 84 -5.647 2.795 -6.666 1.00 0.00 H new ATOM 0 HB2 ASN A 84 -7.276 0.711 -5.295 1.00 0.00 H new ATOM 0 HB3 ASN A 84 -7.585 2.384 -4.877 1.00 0.00 H new ATOM 0 HD21 ASN A 84 -8.440 0.971 -8.680 1.00 0.00 H new ATOM 0 HD22 ASN A 84 -7.332 0.101 -7.614 1.00 0.00 H new ATOM 1370 N LEU A 85 -4.832 1.698 -3.663 1.00 0.00 N ATOM 1371 CA LEU A 85 -4.188 2.040 -2.420 1.00 0.00 C ATOM 1372 C LEU A 85 -2.739 2.420 -2.715 1.00 0.00 C ATOM 1373 O LEU A 85 -2.089 3.090 -1.913 1.00 0.00 O ATOM 1374 CB LEU A 85 -4.246 0.857 -1.444 1.00 0.00 C ATOM 1375 CG LEU A 85 -3.357 0.988 -0.205 1.00 0.00 C ATOM 1376 CD1 LEU A 85 -3.930 2.018 0.757 1.00 0.00 C ATOM 1377 CD2 LEU A 85 -3.201 -0.360 0.485 1.00 0.00 C ATOM 0 H LEU A 85 -5.066 0.710 -3.757 1.00 0.00 H new ATOM 0 HA LEU A 85 -4.702 2.881 -1.955 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -5.278 0.726 -1.118 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -3.963 -0.049 -1.980 1.00 0.00 H new ATOM 0 HG LEU A 85 -2.371 1.327 -0.523 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -3.285 2.097 1.632 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -3.989 2.986 0.260 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -4.928 1.709 1.069 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -2.566 -0.248 1.364 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -4.181 -0.728 0.790 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -2.745 -1.071 -0.204 1.00 0.00 H new ATOM 1389 N ILE A 86 -2.237 1.993 -3.886 1.00 0.00 N ATOM 1390 CA ILE A 86 -0.872 2.306 -4.275 1.00 0.00 C ATOM 1391 C ILE A 86 -0.719 3.803 -4.525 1.00 0.00 C ATOM 1392 O ILE A 86 0.231 4.429 -4.054 1.00 0.00 O ATOM 1393 CB ILE A 86 -0.437 1.503 -5.532 1.00 0.00 C ATOM 1394 CG1 ILE A 86 0.646 0.487 -5.160 1.00 0.00 C ATOM 1395 CG2 ILE A 86 0.063 2.420 -6.644 1.00 0.00 C ATOM 1396 CD1 ILE A 86 0.131 -0.669 -4.332 1.00 0.00 C ATOM 0 H ILE A 86 -2.757 1.437 -4.565 1.00 0.00 H new ATOM 0 HA ILE A 86 -0.220 2.015 -3.452 1.00 0.00 H new ATOM 0 HB ILE A 86 -1.314 0.976 -5.907 1.00 0.00 H new ATOM 0 HG12 ILE A 86 1.096 0.097 -6.073 1.00 0.00 H new ATOM 0 HG13 ILE A 86 1.436 0.996 -4.607 1.00 0.00 H new ATOM 0 HG21 ILE A 86 0.358 1.820 -7.505 1.00 0.00 H new ATOM 0 HG22 ILE A 86 -0.732 3.106 -6.935 1.00 0.00 H new ATOM 0 HG23 ILE A 86 0.921 2.989 -6.288 1.00 0.00 H new ATOM 0 HD11 ILE A 86 0.952 -1.349 -4.106 1.00 0.00 H new ATOM 0 HD12 ILE A 86 -0.293 -0.290 -3.402 1.00 0.00 H new ATOM 0 HD13 ILE A 86 -0.638 -1.203 -4.891 1.00 0.00 H new ATOM 1408 N ASN A 87 -1.666 4.371 -5.266 1.00 0.00 N ATOM 1409 CA ASN A 87 -1.642 5.795 -5.575 1.00 0.00 C ATOM 1410 C ASN A 87 -1.878 6.623 -4.316 1.00 0.00 C ATOM 1411 O ASN A 87 -1.356 7.730 -4.183 1.00 0.00 O ATOM 1412 CB ASN A 87 -2.702 6.129 -6.626 1.00 0.00 C ATOM 1413 CG ASN A 87 -2.388 5.520 -7.978 1.00 0.00 C ATOM 1414 OD1 ASN A 87 -1.298 4.991 -8.195 1.00 0.00 O ATOM 1415 ND2 ASN A 87 -3.344 5.595 -8.897 1.00 0.00 N ATOM 0 H ASN A 87 -2.459 3.866 -5.663 1.00 0.00 H new ATOM 0 HA ASN A 87 -0.658 6.041 -5.974 1.00 0.00 H new ATOM 0 HB2 ASN A 87 -3.673 5.770 -6.285 1.00 0.00 H new ATOM 0 HB3 ASN A 87 -2.780 7.211 -6.728 1.00 0.00 H new ATOM 0 HD21 ASN A 87 -3.189 5.205 -9.827 1.00 0.00 H new ATOM 0 HD22 ASN A 87 -4.233 6.043 -8.673 1.00 0.00 H new ATOM 1422 N LEU A 88 -2.663 6.074 -3.394 1.00 0.00 N ATOM 1423 CA LEU A 88 -2.968 6.758 -2.144 1.00 0.00 C ATOM 1424 C LEU A 88 -1.728 6.857 -1.264 1.00 0.00 C ATOM 1425 O LEU A 88 -1.502 7.875 -0.610 1.00 0.00 O ATOM 1426 CB LEU A 88 -4.082 6.026 -1.395 1.00 0.00 C ATOM 1427 CG LEU A 88 -5.503 6.443 -1.778 1.00 0.00 C ATOM 1428 CD1 LEU A 88 -6.503 5.374 -1.365 1.00 0.00 C ATOM 1429 CD2 LEU A 88 -5.854 7.780 -1.141 1.00 0.00 C ATOM 0 H LEU A 88 -3.099 5.157 -3.490 1.00 0.00 H new ATOM 0 HA LEU A 88 -3.304 7.767 -2.383 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -3.974 4.956 -1.570 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -3.948 6.189 -0.326 1.00 0.00 H new ATOM 0 HG LEU A 88 -5.550 6.555 -2.861 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -7.508 5.688 -1.646 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -6.262 4.437 -1.867 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -6.456 5.229 -0.286 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -6.868 8.062 -1.423 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -5.790 7.694 -0.056 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -5.156 8.542 -1.487 1.00 0.00 H new ATOM 1441 N LEU A 89 -0.922 5.800 -1.257 1.00 0.00 N ATOM 1442 CA LEU A 89 0.294 5.788 -0.457 1.00 0.00 C ATOM 1443 C LEU A 89 1.324 6.748 -1.038 1.00 0.00 C ATOM 1444 O LEU A 89 2.106 7.358 -0.309 1.00 0.00 O ATOM 1445 CB LEU A 89 0.869 4.373 -0.382 1.00 0.00 C ATOM 1446 CG LEU A 89 1.053 3.837 1.035 1.00 0.00 C ATOM 1447 CD1 LEU A 89 0.862 2.328 1.067 1.00 0.00 C ATOM 1448 CD2 LEU A 89 2.425 4.216 1.571 1.00 0.00 C ATOM 0 H LEU A 89 -1.088 4.948 -1.792 1.00 0.00 H new ATOM 0 HA LEU A 89 0.046 6.116 0.552 1.00 0.00 H new ATOM 0 HB2 LEU A 89 0.211 3.698 -0.929 1.00 0.00 H new ATOM 0 HB3 LEU A 89 1.833 4.359 -0.890 1.00 0.00 H new ATOM 0 HG LEU A 89 0.296 4.289 1.676 1.00 0.00 H new ATOM 0 HD11 LEU A 89 0.997 1.966 2.086 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -0.143 2.081 0.725 1.00 0.00 H new ATOM 0 HD13 LEU A 89 1.595 1.855 0.413 1.00 0.00 H new ATOM 0 HD21 LEU A 89 2.541 3.827 2.582 1.00 0.00 H new ATOM 0 HD22 LEU A 89 3.197 3.792 0.928 1.00 0.00 H new ATOM 0 HD23 LEU A 89 2.522 5.302 1.587 1.00 0.00 H new ATOM 1460 N ALA A 90 1.309 6.880 -2.358 1.00 0.00 N ATOM 1461 CA ALA A 90 2.232 7.772 -3.048 1.00 0.00 C ATOM 1462 C ALA A 90 1.497 8.987 -3.607 1.00 0.00 C ATOM 1463 O ALA A 90 1.944 9.603 -4.574 1.00 0.00 O ATOM 1464 CB ALA A 90 2.950 7.028 -4.163 1.00 0.00 C ATOM 0 H ALA A 90 0.667 6.380 -2.973 1.00 0.00 H new ATOM 0 HA ALA A 90 2.971 8.123 -2.328 1.00 0.00 H new ATOM 0 HB1 ALA A 90 3.636 7.706 -4.670 1.00 0.00 H new ATOM 0 HB2 ALA A 90 3.510 6.193 -3.742 1.00 0.00 H new ATOM 0 HB3 ALA A 90 2.219 6.650 -4.878 1.00 0.00 H new ATOM 1470 N GLU A 91 0.366 9.326 -2.992 1.00 0.00 N ATOM 1471 CA GLU A 91 -0.428 10.467 -3.429 1.00 0.00 C ATOM 1472 C GLU A 91 0.093 11.758 -2.809 1.00 0.00 C ATOM 1473 O GLU A 91 0.217 12.779 -3.485 1.00 0.00 O ATOM 1474 CB GLU A 91 -1.899 10.265 -3.059 1.00 0.00 C ATOM 1475 CG GLU A 91 -2.856 10.508 -4.214 1.00 0.00 C ATOM 1476 CD GLU A 91 -4.221 9.891 -3.980 1.00 0.00 C ATOM 1477 OE1 GLU A 91 -4.909 10.314 -3.028 1.00 0.00 O ATOM 1478 OE2 GLU A 91 -4.602 8.984 -4.751 1.00 0.00 O ATOM 0 H GLU A 91 -0.019 8.826 -2.191 1.00 0.00 H new ATOM 0 HA GLU A 91 -0.343 10.545 -4.513 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -2.036 9.248 -2.692 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -2.154 10.937 -2.239 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -2.968 11.581 -4.368 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -2.428 10.097 -5.128 1.00 0.00 H new ATOM 1485 N ASN A 92 0.393 11.708 -1.515 1.00 0.00 N ATOM 1486 CA ASN A 92 0.899 12.875 -0.805 1.00 0.00 C ATOM 1487 C ASN A 92 2.278 12.605 -0.204 1.00 0.00 C ATOM 1488 O ASN A 92 2.716 13.310 0.705 1.00 0.00 O ATOM 1489 CB ASN A 92 -0.076 13.289 0.299 1.00 0.00 C ATOM 1490 CG ASN A 92 -0.495 12.119 1.168 1.00 0.00 C ATOM 1491 OD1 ASN A 92 0.011 11.007 1.018 1.00 0.00 O ATOM 1492 ND2 ASN A 92 -1.426 12.365 2.083 1.00 0.00 N ATOM 0 H ASN A 92 0.294 10.873 -0.938 1.00 0.00 H new ATOM 0 HA ASN A 92 0.994 13.687 -1.526 1.00 0.00 H new ATOM 0 HB2 ASN A 92 0.388 14.053 0.922 1.00 0.00 H new ATOM 0 HB3 ASN A 92 -0.961 13.739 -0.151 1.00 0.00 H new ATOM 0 HD21 ASN A 92 -1.749 11.617 2.696 1.00 0.00 H new ATOM 0 HD22 ASN A 92 -1.818 13.302 2.172 1.00 0.00 H new ATOM 1499 N GLY A 93 2.957 11.582 -0.715 1.00 0.00 N ATOM 1500 CA GLY A 93 4.274 11.244 -0.212 1.00 0.00 C ATOM 1501 C GLY A 93 4.211 10.424 1.059 1.00 0.00 C ATOM 1502 O GLY A 93 4.866 10.749 2.049 1.00 0.00 O ATOM 0 H GLY A 93 2.618 10.983 -1.467 1.00 0.00 H new ATOM 0 HA2 GLY A 93 4.820 10.687 -0.974 1.00 0.00 H new ATOM 0 HA3 GLY A 93 4.834 12.160 -0.024 1.00 0.00 H new ATOM 1506 N ARG A 94 3.418 9.358 1.033 1.00 0.00 N ATOM 1507 CA ARG A 94 3.269 8.490 2.193 1.00 0.00 C ATOM 1508 C ARG A 94 4.191 7.277 2.095 1.00 0.00 C ATOM 1509 O ARG A 94 3.915 6.230 2.679 1.00 0.00 O ATOM 1510 CB ARG A 94 1.816 8.030 2.330 1.00 0.00 C ATOM 1511 CG ARG A 94 1.339 7.944 3.770 1.00 0.00 C ATOM 1512 CD ARG A 94 0.761 9.268 4.245 1.00 0.00 C ATOM 1513 NE ARG A 94 1.056 9.520 5.653 1.00 0.00 N ATOM 1514 CZ ARG A 94 0.651 10.603 6.313 1.00 0.00 C ATOM 1515 NH1 ARG A 94 -0.066 11.535 5.698 1.00 0.00 N ATOM 1516 NH2 ARG A 94 0.963 10.755 7.593 1.00 0.00 N ATOM 0 H ARG A 94 2.869 9.075 0.221 1.00 0.00 H new ATOM 0 HA ARG A 94 3.548 9.063 3.078 1.00 0.00 H new ATOM 0 HB2 ARG A 94 1.172 8.719 1.783 1.00 0.00 H new ATOM 0 HB3 ARG A 94 1.707 7.052 1.861 1.00 0.00 H new ATOM 0 HG2 ARG A 94 0.583 7.163 3.858 1.00 0.00 H new ATOM 0 HG3 ARG A 94 2.171 7.657 4.413 1.00 0.00 H new ATOM 0 HD2 ARG A 94 1.166 10.079 3.639 1.00 0.00 H new ATOM 0 HD3 ARG A 94 -0.319 9.267 4.095 1.00 0.00 H new ATOM 0 HE ARG A 94 1.604 8.826 6.160 1.00 0.00 H new ATOM 0 HH11 ARG A 94 -0.310 11.424 4.714 1.00 0.00 H new ATOM 0 HH12 ARG A 94 -0.373 12.362 6.209 1.00 0.00 H new ATOM 0 HH21 ARG A 94 1.513 10.042 8.072 1.00 0.00 H new ATOM 0 HH22 ARG A 94 0.653 11.585 8.099 1.00 0.00 H new ATOM 1530 N LEU A 95 5.288 7.427 1.356 1.00 0.00 N ATOM 1531 CA LEU A 95 6.247 6.340 1.190 1.00 0.00 C ATOM 1532 C LEU A 95 7.425 6.509 2.143 1.00 0.00 C ATOM 1533 O LEU A 95 8.564 6.187 1.805 1.00 0.00 O ATOM 1534 CB LEU A 95 6.743 6.283 -0.256 1.00 0.00 C ATOM 1535 CG LEU A 95 5.897 5.423 -1.198 1.00 0.00 C ATOM 1536 CD1 LEU A 95 6.030 3.951 -0.841 1.00 0.00 C ATOM 1537 CD2 LEU A 95 4.439 5.854 -1.149 1.00 0.00 C ATOM 0 H LEU A 95 5.533 8.287 0.865 1.00 0.00 H new ATOM 0 HA LEU A 95 5.744 5.403 1.426 1.00 0.00 H new ATOM 0 HB2 LEU A 95 6.781 7.298 -0.651 1.00 0.00 H new ATOM 0 HB3 LEU A 95 7.764 5.901 -0.259 1.00 0.00 H new ATOM 0 HG LEU A 95 6.264 5.565 -2.215 1.00 0.00 H new ATOM 0 HD11 LEU A 95 5.422 3.355 -1.521 1.00 0.00 H new ATOM 0 HD12 LEU A 95 7.074 3.648 -0.928 1.00 0.00 H new ATOM 0 HD13 LEU A 95 5.690 3.793 0.183 1.00 0.00 H new ATOM 0 HD21 LEU A 95 3.853 5.232 -1.825 1.00 0.00 H new ATOM 0 HD22 LEU A 95 4.061 5.742 -0.133 1.00 0.00 H new ATOM 0 HD23 LEU A 95 4.358 6.897 -1.454 1.00 0.00 H new ATOM 1549 N THR A 96 7.136 7.010 3.338 1.00 0.00 N ATOM 1550 CA THR A 96 8.159 7.217 4.354 1.00 0.00 C ATOM 1551 C THR A 96 7.858 6.364 5.579 1.00 0.00 C ATOM 1552 O THR A 96 8.758 5.790 6.191 1.00 0.00 O ATOM 1553 CB THR A 96 8.232 8.694 4.747 1.00 0.00 C ATOM 1554 OG1 THR A 96 7.158 9.038 5.604 1.00 0.00 O ATOM 1555 CG2 THR A 96 8.192 9.632 3.561 1.00 0.00 C ATOM 0 H THR A 96 6.196 7.281 3.627 1.00 0.00 H new ATOM 0 HA THR A 96 9.123 6.919 3.942 1.00 0.00 H new ATOM 0 HB THR A 96 9.192 8.812 5.250 1.00 0.00 H new ATOM 0 HG1 THR A 96 7.370 8.764 6.521 1.00 0.00 H new ATOM 0 HG21 THR A 96 8.247 10.663 3.910 1.00 0.00 H new ATOM 0 HG22 THR A 96 9.038 9.425 2.905 1.00 0.00 H new ATOM 0 HG23 THR A 96 7.262 9.485 3.012 1.00 0.00 H new ATOM 1563 N ASN A 97 6.576 6.279 5.921 1.00 0.00 N ATOM 1564 CA ASN A 97 6.133 5.490 7.060 1.00 0.00 C ATOM 1565 C ASN A 97 5.144 4.419 6.612 1.00 0.00 C ATOM 1566 O ASN A 97 4.281 3.993 7.382 1.00 0.00 O ATOM 1567 CB ASN A 97 5.487 6.391 8.113 1.00 0.00 C ATOM 1568 CG ASN A 97 6.497 7.281 8.811 1.00 0.00 C ATOM 1569 OD1 ASN A 97 6.763 8.445 8.228 1.00 0.00 O flip ATOM 1570 ND2 ASN A 97 7.032 6.928 9.862 1.00 0.00 N flip ATOM 0 H ASN A 97 5.823 6.751 5.420 1.00 0.00 H new ATOM 0 HA ASN A 97 7.003 5.003 7.500 1.00 0.00 H new ATOM 0 HB2 ASN A 97 4.726 7.012 7.639 1.00 0.00 H new ATOM 0 HB3 ASN A 97 4.978 5.773 8.853 1.00 0.00 H new ATOM 0 HD21 ASN A 97 6.798 6.025 10.275 1.00 0.00 H new ATOM 0 HD22 ASN A 97 7.709 7.538 10.320 1.00 0.00 H new ATOM 1577 N THR A 98 5.270 3.992 5.354 1.00 0.00 N ATOM 1578 CA THR A 98 4.384 2.976 4.791 1.00 0.00 C ATOM 1579 C THR A 98 4.165 1.799 5.750 1.00 0.00 C ATOM 1580 O THR A 98 3.031 1.373 5.947 1.00 0.00 O ATOM 1581 CB THR A 98 4.908 2.473 3.437 1.00 0.00 C ATOM 1582 OG1 THR A 98 4.321 1.227 3.107 1.00 0.00 O ATOM 1583 CG2 THR A 98 6.412 2.295 3.376 1.00 0.00 C ATOM 0 H THR A 98 5.979 4.336 4.706 1.00 0.00 H new ATOM 0 HA THR A 98 3.418 3.455 4.636 1.00 0.00 H new ATOM 0 HB THR A 98 4.632 3.254 2.728 1.00 0.00 H new ATOM 0 HG1 THR A 98 5.023 0.592 2.852 1.00 0.00 H new ATOM 0 HG21 THR A 98 6.696 1.938 2.386 1.00 0.00 H new ATOM 0 HG22 THR A 98 6.900 3.250 3.571 1.00 0.00 H new ATOM 0 HG23 THR A 98 6.723 1.569 4.127 1.00 0.00 H new ATOM 1591 N PRO A 99 5.229 1.247 6.370 1.00 0.00 N ATOM 1592 CA PRO A 99 5.090 0.121 7.298 1.00 0.00 C ATOM 1593 C PRO A 99 3.981 0.343 8.322 1.00 0.00 C ATOM 1594 O PRO A 99 3.406 -0.612 8.844 1.00 0.00 O ATOM 1595 CB PRO A 99 6.460 0.037 7.993 1.00 0.00 C ATOM 1596 CG PRO A 99 7.212 1.254 7.559 1.00 0.00 C ATOM 1597 CD PRO A 99 6.634 1.651 6.233 1.00 0.00 C ATOM 0 HA PRO A 99 4.814 -0.795 6.776 1.00 0.00 H new ATOM 0 HB2 PRO A 99 6.348 0.013 9.077 1.00 0.00 H new ATOM 0 HB3 PRO A 99 6.989 -0.872 7.707 1.00 0.00 H new ATOM 0 HG2 PRO A 99 7.105 2.058 8.287 1.00 0.00 H new ATOM 0 HG3 PRO A 99 8.278 1.043 7.472 1.00 0.00 H new ATOM 0 HD2 PRO A 99 6.733 2.721 6.050 1.00 0.00 H new ATOM 0 HD3 PRO A 99 7.125 1.139 5.406 1.00 0.00 H new ATOM 1605 N ALA A 100 3.680 1.607 8.602 1.00 0.00 N ATOM 1606 CA ALA A 100 2.635 1.946 9.559 1.00 0.00 C ATOM 1607 C ALA A 100 1.249 1.726 8.960 1.00 0.00 C ATOM 1608 O ALA A 100 0.282 1.490 9.684 1.00 0.00 O ATOM 1609 CB ALA A 100 2.790 3.387 10.023 1.00 0.00 C ATOM 0 H ALA A 100 4.144 2.411 8.180 1.00 0.00 H new ATOM 0 HA ALA A 100 2.738 1.286 10.421 1.00 0.00 H new ATOM 0 HB1 ALA A 100 2.002 3.626 10.738 1.00 0.00 H new ATOM 0 HB2 ALA A 100 3.762 3.513 10.499 1.00 0.00 H new ATOM 0 HB3 ALA A 100 2.716 4.055 9.165 1.00 0.00 H new ATOM 1615 N VAL A 101 1.158 1.803 7.635 1.00 0.00 N ATOM 1616 CA VAL A 101 -0.113 1.611 6.948 1.00 0.00 C ATOM 1617 C VAL A 101 -0.518 0.138 6.937 1.00 0.00 C ATOM 1618 O VAL A 101 -1.702 -0.189 6.862 1.00 0.00 O ATOM 1619 CB VAL A 101 -0.065 2.145 5.496 1.00 0.00 C ATOM 1620 CG1 VAL A 101 0.728 1.215 4.585 1.00 0.00 C ATOM 1621 CG2 VAL A 101 -1.472 2.351 4.959 1.00 0.00 C ATOM 0 H VAL A 101 1.947 1.996 7.019 1.00 0.00 H new ATOM 0 HA VAL A 101 -0.859 2.181 7.502 1.00 0.00 H new ATOM 0 HB VAL A 101 0.447 3.107 5.511 1.00 0.00 H new ATOM 0 HG11 VAL A 101 0.741 1.621 3.573 1.00 0.00 H new ATOM 0 HG12 VAL A 101 1.750 1.128 4.954 1.00 0.00 H new ATOM 0 HG13 VAL A 101 0.261 0.230 4.575 1.00 0.00 H new ATOM 0 HG21 VAL A 101 -1.420 2.727 3.937 1.00 0.00 H new ATOM 0 HG22 VAL A 101 -2.008 1.402 4.970 1.00 0.00 H new ATOM 0 HG23 VAL A 101 -1.998 3.072 5.584 1.00 0.00 H new ATOM 1631 N ILE A 102 0.474 -0.745 7.012 1.00 0.00 N ATOM 1632 CA ILE A 102 0.217 -2.179 7.009 1.00 0.00 C ATOM 1633 C ILE A 102 -0.323 -2.651 8.358 1.00 0.00 C ATOM 1634 O ILE A 102 -0.923 -3.721 8.454 1.00 0.00 O ATOM 1635 CB ILE A 102 1.492 -2.976 6.672 1.00 0.00 C ATOM 1636 CG1 ILE A 102 2.150 -2.415 5.410 1.00 0.00 C ATOM 1637 CG2 ILE A 102 1.165 -4.451 6.494 1.00 0.00 C ATOM 1638 CD1 ILE A 102 3.605 -2.805 5.261 1.00 0.00 C ATOM 0 H ILE A 102 1.460 -0.492 7.075 1.00 0.00 H new ATOM 0 HA ILE A 102 -0.534 -2.362 6.240 1.00 0.00 H new ATOM 0 HB ILE A 102 2.193 -2.878 7.501 1.00 0.00 H new ATOM 0 HG12 ILE A 102 1.598 -2.763 4.537 1.00 0.00 H new ATOM 0 HG13 ILE A 102 2.073 -1.328 5.423 1.00 0.00 H new ATOM 0 HG21 ILE A 102 2.076 -5.000 6.256 1.00 0.00 H new ATOM 0 HG22 ILE A 102 0.736 -4.842 7.416 1.00 0.00 H new ATOM 0 HG23 ILE A 102 0.448 -4.569 5.681 1.00 0.00 H new ATOM 0 HD11 ILE A 102 4.006 -2.372 4.344 1.00 0.00 H new ATOM 0 HD12 ILE A 102 4.171 -2.433 6.115 1.00 0.00 H new ATOM 0 HD13 ILE A 102 3.688 -3.891 5.216 1.00 0.00 H new ATOM 1650 N SER A 103 -0.105 -1.850 9.397 1.00 0.00 N ATOM 1651 CA SER A 103 -0.570 -2.196 10.736 1.00 0.00 C ATOM 1652 C SER A 103 -2.059 -1.903 10.895 1.00 0.00 C ATOM 1653 O SER A 103 -2.752 -2.572 11.662 1.00 0.00 O ATOM 1654 CB SER A 103 0.228 -1.429 11.791 1.00 0.00 C ATOM 1655 OG SER A 103 1.615 -1.457 11.503 1.00 0.00 O ATOM 0 H SER A 103 0.389 -0.960 9.338 1.00 0.00 H new ATOM 0 HA SER A 103 -0.415 -3.265 10.878 1.00 0.00 H new ATOM 0 HB2 SER A 103 -0.117 -0.396 11.832 1.00 0.00 H new ATOM 0 HB3 SER A 103 0.049 -1.864 12.774 1.00 0.00 H new ATOM 0 HG SER A 103 2.102 -0.958 12.192 1.00 0.00 H new ATOM 1661 N ALA A 104 -2.549 -0.906 10.165 1.00 0.00 N ATOM 1662 CA ALA A 104 -3.958 -0.539 10.229 1.00 0.00 C ATOM 1663 C ALA A 104 -4.828 -1.622 9.599 1.00 0.00 C ATOM 1664 O ALA A 104 -6.013 -1.745 9.909 1.00 0.00 O ATOM 1665 CB ALA A 104 -4.187 0.797 9.540 1.00 0.00 C ATOM 0 H ALA A 104 -1.993 -0.340 9.524 1.00 0.00 H new ATOM 0 HA ALA A 104 -4.241 -0.443 11.277 1.00 0.00 H new ATOM 0 HB1 ALA A 104 -5.244 1.059 9.595 1.00 0.00 H new ATOM 0 HB2 ALA A 104 -3.596 1.568 10.035 1.00 0.00 H new ATOM 0 HB3 ALA A 104 -3.886 0.724 8.495 1.00 0.00 H new ATOM 1671 N PHE A 105 -4.225 -2.407 8.712 1.00 0.00 N ATOM 1672 CA PHE A 105 -4.925 -3.487 8.030 1.00 0.00 C ATOM 1673 C PHE A 105 -5.158 -4.659 8.973 1.00 0.00 C ATOM 1674 O PHE A 105 -6.290 -5.098 9.168 1.00 0.00 O ATOM 1675 CB PHE A 105 -4.102 -3.952 6.827 1.00 0.00 C ATOM 1676 CG PHE A 105 -4.913 -4.387 5.638 1.00 0.00 C ATOM 1677 CD1 PHE A 105 -5.339 -3.463 4.699 1.00 0.00 C ATOM 1678 CD2 PHE A 105 -5.228 -5.724 5.444 1.00 0.00 C ATOM 1679 CE1 PHE A 105 -6.061 -3.863 3.593 1.00 0.00 C ATOM 1680 CE2 PHE A 105 -5.953 -6.127 4.342 1.00 0.00 C ATOM 1681 CZ PHE A 105 -6.368 -5.197 3.416 1.00 0.00 C ATOM 0 H PHE A 105 -3.244 -2.313 8.448 1.00 0.00 H new ATOM 0 HA PHE A 105 -5.893 -3.115 7.693 1.00 0.00 H new ATOM 0 HB2 PHE A 105 -3.441 -3.141 6.521 1.00 0.00 H new ATOM 0 HB3 PHE A 105 -3.466 -4.781 7.138 1.00 0.00 H new ATOM 0 HD1 PHE A 105 -5.104 -2.418 4.834 1.00 0.00 H new ATOM 0 HD2 PHE A 105 -4.901 -6.459 6.165 1.00 0.00 H new ATOM 0 HE1 PHE A 105 -6.386 -3.133 2.866 1.00 0.00 H new ATOM 0 HE2 PHE A 105 -6.195 -7.171 4.206 1.00 0.00 H new ATOM 0 HZ PHE A 105 -6.934 -5.511 2.551 1.00 0.00 H new ATOM 1691 N SER A 106 -4.075 -5.165 9.554 1.00 0.00 N ATOM 1692 CA SER A 106 -4.155 -6.294 10.475 1.00 0.00 C ATOM 1693 C SER A 106 -5.197 -6.054 11.560 1.00 0.00 C ATOM 1694 O SER A 106 -5.758 -6.999 12.114 1.00 0.00 O ATOM 1695 CB SER A 106 -2.788 -6.558 11.111 1.00 0.00 C ATOM 1696 OG SER A 106 -2.556 -7.947 11.264 1.00 0.00 O ATOM 0 H SER A 106 -3.130 -4.811 9.403 1.00 0.00 H new ATOM 0 HA SER A 106 -4.460 -7.170 9.902 1.00 0.00 H new ATOM 0 HB2 SER A 106 -2.005 -6.122 10.491 1.00 0.00 H new ATOM 0 HB3 SER A 106 -2.735 -6.068 12.083 1.00 0.00 H new ATOM 0 HG SER A 106 -1.676 -8.089 11.671 1.00 0.00 H new ATOM 1702 N THR A 107 -5.455 -4.786 11.859 1.00 0.00 N ATOM 1703 CA THR A 107 -6.433 -4.436 12.876 1.00 0.00 C ATOM 1704 C THR A 107 -7.845 -4.617 12.348 1.00 0.00 C ATOM 1705 O THR A 107 -8.620 -5.400 12.898 1.00 0.00 O ATOM 1706 CB THR A 107 -6.220 -2.998 13.354 1.00 0.00 C ATOM 1707 OG1 THR A 107 -4.911 -2.830 13.868 1.00 0.00 O ATOM 1708 CG2 THR A 107 -7.193 -2.575 14.431 1.00 0.00 C ATOM 0 H THR A 107 -5.002 -3.988 11.413 1.00 0.00 H new ATOM 0 HA THR A 107 -6.297 -5.106 13.725 1.00 0.00 H new ATOM 0 HB THR A 107 -6.383 -2.374 12.475 1.00 0.00 H new ATOM 0 HG1 THR A 107 -4.907 -2.100 14.522 1.00 0.00 H new ATOM 0 HG21 THR A 107 -6.986 -1.546 14.724 1.00 0.00 H new ATOM 0 HG22 THR A 107 -8.212 -2.646 14.049 1.00 0.00 H new ATOM 0 HG23 THR A 107 -7.084 -3.228 15.297 1.00 0.00 H new ATOM 1716 N MET A 108 -8.177 -3.921 11.269 1.00 0.00 N ATOM 1717 CA MET A 108 -9.498 -4.063 10.686 1.00 0.00 C ATOM 1718 C MET A 108 -9.636 -5.459 10.094 1.00 0.00 C ATOM 1719 O MET A 108 -10.743 -5.942 9.861 1.00 0.00 O ATOM 1720 CB MET A 108 -9.741 -2.999 9.623 1.00 0.00 C ATOM 1721 CG MET A 108 -11.204 -2.617 9.467 1.00 0.00 C ATOM 1722 SD MET A 108 -11.830 -1.678 10.874 1.00 0.00 S ATOM 1723 CE MET A 108 -11.450 -0.004 10.360 1.00 0.00 C ATOM 0 H MET A 108 -7.561 -3.265 10.789 1.00 0.00 H new ATOM 0 HA MET A 108 -10.249 -3.926 11.464 1.00 0.00 H new ATOM 0 HB2 MET A 108 -9.166 -2.108 9.875 1.00 0.00 H new ATOM 0 HB3 MET A 108 -9.365 -3.361 8.666 1.00 0.00 H new ATOM 0 HG2 MET A 108 -11.327 -2.028 8.558 1.00 0.00 H new ATOM 0 HG3 MET A 108 -11.801 -3.521 9.344 1.00 0.00 H new ATOM 0 HE1 MET A 108 -11.778 0.696 11.129 1.00 0.00 H new ATOM 0 HE2 MET A 108 -10.375 0.096 10.213 1.00 0.00 H new ATOM 0 HE3 MET A 108 -11.966 0.216 9.425 1.00 0.00 H new ATOM 1733 N MET A 109 -8.492 -6.112 9.876 1.00 0.00 N ATOM 1734 CA MET A 109 -8.474 -7.459 9.341 1.00 0.00 C ATOM 1735 C MET A 109 -9.205 -8.394 10.294 1.00 0.00 C ATOM 1736 O MET A 109 -9.942 -9.283 9.868 1.00 0.00 O ATOM 1737 CB MET A 109 -7.031 -7.941 9.152 1.00 0.00 C ATOM 1738 CG MET A 109 -6.460 -7.679 7.767 1.00 0.00 C ATOM 1739 SD MET A 109 -5.069 -8.763 7.377 1.00 0.00 S ATOM 1740 CE MET A 109 -5.878 -10.359 7.302 1.00 0.00 C ATOM 0 H MET A 109 -7.569 -5.722 10.065 1.00 0.00 H new ATOM 0 HA MET A 109 -8.973 -7.460 8.372 1.00 0.00 H new ATOM 0 HB2 MET A 109 -6.397 -7.452 9.892 1.00 0.00 H new ATOM 0 HB3 MET A 109 -6.989 -9.011 9.353 1.00 0.00 H new ATOM 0 HG2 MET A 109 -7.244 -7.817 7.022 1.00 0.00 H new ATOM 0 HG3 MET A 109 -6.137 -6.640 7.701 1.00 0.00 H new ATOM 0 HE1 MET A 109 -5.149 -11.124 7.034 1.00 0.00 H new ATOM 0 HE2 MET A 109 -6.310 -10.594 8.275 1.00 0.00 H new ATOM 0 HE3 MET A 109 -6.668 -10.332 6.551 1.00 0.00 H new ATOM 1750 N SER A 110 -8.997 -8.180 11.594 1.00 0.00 N ATOM 1751 CA SER A 110 -9.644 -9.002 12.608 1.00 0.00 C ATOM 1752 C SER A 110 -11.160 -8.819 12.571 1.00 0.00 C ATOM 1753 O SER A 110 -11.909 -9.677 13.036 1.00 0.00 O ATOM 1754 CB SER A 110 -9.109 -8.654 13.998 1.00 0.00 C ATOM 1755 OG SER A 110 -8.009 -9.479 14.344 1.00 0.00 O ATOM 0 H SER A 110 -8.389 -7.449 11.964 1.00 0.00 H new ATOM 0 HA SER A 110 -9.417 -10.046 12.392 1.00 0.00 H new ATOM 0 HB2 SER A 110 -8.804 -7.608 14.022 1.00 0.00 H new ATOM 0 HB3 SER A 110 -9.902 -8.772 14.736 1.00 0.00 H new ATOM 0 HG SER A 110 -7.685 -9.235 15.236 1.00 0.00 H new ATOM 1761 N VAL A 111 -11.605 -7.696 12.014 1.00 0.00 N ATOM 1762 CA VAL A 111 -13.029 -7.404 11.915 1.00 0.00 C ATOM 1763 C VAL A 111 -13.671 -8.179 10.769 1.00 0.00 C ATOM 1764 O VAL A 111 -14.765 -8.726 10.913 1.00 0.00 O ATOM 1765 CB VAL A 111 -13.282 -5.900 11.707 1.00 0.00 C ATOM 1766 CG1 VAL A 111 -14.767 -5.587 11.807 1.00 0.00 C ATOM 1767 CG2 VAL A 111 -12.489 -5.080 12.713 1.00 0.00 C ATOM 0 H VAL A 111 -10.999 -6.974 11.625 1.00 0.00 H new ATOM 0 HA VAL A 111 -13.480 -7.713 12.858 1.00 0.00 H new ATOM 0 HB VAL A 111 -12.945 -5.631 10.706 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -14.925 -4.519 11.657 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -15.309 -6.144 11.043 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -15.134 -5.873 12.793 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -12.681 -4.019 12.550 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -12.792 -5.352 13.724 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -11.425 -5.280 12.587 1.00 0.00 H new ATOM 1777 N HIS A 112 -12.985 -8.222 9.631 1.00 0.00 N ATOM 1778 CA HIS A 112 -13.494 -8.932 8.462 1.00 0.00 C ATOM 1779 C HIS A 112 -13.495 -10.440 8.700 1.00 0.00 C ATOM 1780 O HIS A 112 -14.317 -11.166 8.139 1.00 0.00 O ATOM 1781 CB HIS A 112 -12.659 -8.586 7.221 1.00 0.00 C ATOM 1782 CG HIS A 112 -11.360 -9.323 7.130 1.00 0.00 C ATOM 1783 ND1 HIS A 112 -11.094 -10.636 6.954 1.00 0.00 N flip ATOM 1784 CD2 HIS A 112 -10.143 -8.703 7.246 1.00 0.00 C flip ATOM 1785 CE1 HIS A 112 -9.732 -10.784 6.972 1.00 0.00 C flip ATOM 1786 NE2 HIS A 112 -9.179 -9.603 7.150 1.00 0.00 N flip ATOM 0 H HIS A 112 -12.078 -7.775 9.493 1.00 0.00 H new ATOM 0 HA HIS A 112 -14.522 -8.614 8.291 1.00 0.00 H new ATOM 0 HB2 HIS A 112 -13.248 -8.800 6.329 1.00 0.00 H new ATOM 0 HB3 HIS A 112 -12.457 -7.515 7.220 1.00 0.00 H new ATOM 0 HD1 HIS A 112 -11.781 -11.380 6.830 1.00 0.00 H new ATOM 0 HD2 HIS A 112 -9.994 -7.643 7.393 1.00 0.00 H new ATOM 0 HE1 HIS A 112 -9.200 -11.717 6.859 1.00 0.00 H new ATOM 1795 N ARG A 113 -12.571 -10.906 9.537 1.00 0.00 N ATOM 1796 CA ARG A 113 -12.469 -12.327 9.848 1.00 0.00 C ATOM 1797 C ARG A 113 -13.610 -12.768 10.758 1.00 0.00 C ATOM 1798 O ARG A 113 -14.061 -13.912 10.695 1.00 0.00 O ATOM 1799 CB ARG A 113 -11.125 -12.630 10.513 1.00 0.00 C ATOM 1800 CG ARG A 113 -10.743 -14.100 10.471 1.00 0.00 C ATOM 1801 CD ARG A 113 -9.841 -14.408 9.286 1.00 0.00 C ATOM 1802 NE ARG A 113 -10.606 -14.772 8.095 1.00 0.00 N ATOM 1803 CZ ARG A 113 -10.088 -15.408 7.047 1.00 0.00 C ATOM 1804 NH1 ARG A 113 -8.806 -15.751 7.038 1.00 0.00 N ATOM 1805 NH2 ARG A 113 -10.854 -15.702 6.005 1.00 0.00 N ATOM 0 H ARG A 113 -11.884 -10.320 10.011 1.00 0.00 H new ATOM 0 HA ARG A 113 -12.538 -12.883 8.913 1.00 0.00 H new ATOM 0 HB2 ARG A 113 -10.346 -12.047 10.022 1.00 0.00 H new ATOM 0 HB3 ARG A 113 -11.161 -12.302 11.552 1.00 0.00 H new ATOM 0 HG2 ARG A 113 -10.235 -14.372 11.396 1.00 0.00 H new ATOM 0 HG3 ARG A 113 -11.645 -14.710 10.411 1.00 0.00 H new ATOM 0 HD2 ARG A 113 -9.221 -13.539 9.067 1.00 0.00 H new ATOM 0 HD3 ARG A 113 -9.166 -15.223 9.546 1.00 0.00 H new ATOM 0 HE ARG A 113 -11.595 -14.524 8.065 1.00 0.00 H new ATOM 0 HH11 ARG A 113 -8.213 -15.527 7.837 1.00 0.00 H new ATOM 0 HH12 ARG A 113 -8.414 -16.238 6.232 1.00 0.00 H new ATOM 0 HH21 ARG A 113 -11.840 -15.441 6.007 1.00 0.00 H new ATOM 0 HH22 ARG A 113 -10.457 -16.189 5.202 1.00 0.00 H new ATOM 1819 N GLY A 114 -14.073 -11.853 11.605 1.00 0.00 N ATOM 1820 CA GLY A 114 -15.157 -12.167 12.516 1.00 0.00 C ATOM 1821 C GLY A 114 -16.503 -11.691 12.005 1.00 0.00 C ATOM 1822 O GLY A 114 -17.541 -12.255 12.350 1.00 0.00 O ATOM 0 H GLY A 114 -13.716 -10.900 11.676 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -15.193 -13.245 12.675 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -14.957 -11.709 13.485 1.00 0.00 H new ATOM 1826 N GLU A 115 -16.485 -10.649 11.179 1.00 0.00 N ATOM 1827 CA GLU A 115 -17.713 -10.096 10.619 1.00 0.00 C ATOM 1828 C GLU A 115 -18.473 -11.151 9.821 1.00 0.00 C ATOM 1829 O GLU A 115 -19.701 -11.112 9.734 1.00 0.00 O ATOM 1830 CB GLU A 115 -17.395 -8.896 9.726 1.00 0.00 C ATOM 1831 CG GLU A 115 -18.630 -8.229 9.140 1.00 0.00 C ATOM 1832 CD GLU A 115 -19.044 -6.991 9.911 1.00 0.00 C ATOM 1833 OE1 GLU A 115 -18.554 -5.892 9.576 1.00 0.00 O ATOM 1834 OE2 GLU A 115 -19.858 -7.120 10.850 1.00 0.00 O ATOM 0 H GLU A 115 -15.634 -10.171 10.883 1.00 0.00 H new ATOM 0 HA GLU A 115 -18.344 -9.769 11.446 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -16.836 -8.161 10.305 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -16.747 -9.221 8.912 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -18.435 -7.958 8.102 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -19.455 -8.941 9.133 1.00 0.00 H new ATOM 1841 N VAL A 116 -17.737 -12.093 9.242 1.00 0.00 N ATOM 1842 CA VAL A 116 -18.342 -13.159 8.452 1.00 0.00 C ATOM 1843 C VAL A 116 -18.117 -14.521 9.103 1.00 0.00 C ATOM 1844 O VAL A 116 -17.197 -15.251 8.732 1.00 0.00 O ATOM 1845 CB VAL A 116 -17.777 -13.187 7.018 1.00 0.00 C ATOM 1846 CG1 VAL A 116 -18.528 -14.199 6.166 1.00 0.00 C ATOM 1847 CG2 VAL A 116 -17.838 -11.803 6.391 1.00 0.00 C ATOM 0 H VAL A 116 -16.720 -12.140 9.305 1.00 0.00 H new ATOM 0 HA VAL A 116 -19.411 -12.952 8.408 1.00 0.00 H new ATOM 0 HB VAL A 116 -16.732 -13.492 7.067 1.00 0.00 H new ATOM 0 HG11 VAL A 116 -18.114 -14.204 5.158 1.00 0.00 H new ATOM 0 HG12 VAL A 116 -18.426 -15.191 6.605 1.00 0.00 H new ATOM 0 HG13 VAL A 116 -19.583 -13.928 6.124 1.00 0.00 H new ATOM 0 HG21 VAL A 116 -17.435 -11.844 5.379 1.00 0.00 H new ATOM 0 HG22 VAL A 116 -18.874 -11.465 6.355 1.00 0.00 H new ATOM 0 HG23 VAL A 116 -17.249 -11.107 6.988 1.00 0.00 H new ATOM 1857 N PRO A 117 -18.958 -14.883 10.087 1.00 0.00 N ATOM 1858 CA PRO A 117 -18.846 -16.165 10.791 1.00 0.00 C ATOM 1859 C PRO A 117 -18.793 -17.349 9.830 1.00 0.00 C ATOM 1860 O PRO A 117 -18.781 -17.173 8.612 1.00 0.00 O ATOM 1861 CB PRO A 117 -20.119 -16.220 11.637 1.00 0.00 C ATOM 1862 CG PRO A 117 -20.501 -14.796 11.840 1.00 0.00 C ATOM 1863 CD PRO A 117 -20.082 -14.072 10.591 1.00 0.00 C ATOM 0 HA PRO A 117 -17.928 -16.230 11.376 1.00 0.00 H new ATOM 0 HB2 PRO A 117 -20.909 -16.773 11.128 1.00 0.00 H new ATOM 0 HB3 PRO A 117 -19.941 -16.721 12.588 1.00 0.00 H new ATOM 0 HG2 PRO A 117 -21.574 -14.700 12.005 1.00 0.00 H new ATOM 0 HG3 PRO A 117 -20.005 -14.380 12.717 1.00 0.00 H new ATOM 0 HD2 PRO A 117 -20.895 -14.017 9.867 1.00 0.00 H new ATOM 0 HD3 PRO A 117 -19.775 -13.048 10.804 1.00 0.00 H new ATOM 1871 N CYS A 118 -18.762 -18.555 10.388 1.00 0.00 N ATOM 1872 CA CYS A 118 -18.711 -19.769 9.581 1.00 0.00 C ATOM 1873 C CYS A 118 -17.460 -19.790 8.709 1.00 0.00 C ATOM 1874 O CYS A 118 -16.766 -18.783 8.576 1.00 0.00 O ATOM 1875 CB CYS A 118 -19.959 -19.877 8.704 1.00 0.00 C ATOM 1876 SG CYS A 118 -21.510 -19.588 9.588 1.00 0.00 S ATOM 0 H CYS A 118 -18.771 -18.718 11.395 1.00 0.00 H new ATOM 0 HA CYS A 118 -18.676 -20.623 10.257 1.00 0.00 H new ATOM 0 HB2 CYS A 118 -19.879 -19.159 7.888 1.00 0.00 H new ATOM 0 HB3 CYS A 118 -19.989 -20.869 8.254 1.00 0.00 H new ATOM 0 HG CYS A 118 -22.508 -19.699 8.762 1.00 0.00 H new ATOM 1882 N THR A 119 -17.177 -20.946 8.116 1.00 0.00 N ATOM 1883 CA THR A 119 -16.010 -21.098 7.256 1.00 0.00 C ATOM 1884 C THR A 119 -16.246 -22.176 6.202 1.00 0.00 C ATOM 1885 O THR A 119 -15.972 -21.972 5.020 1.00 0.00 O ATOM 1886 CB THR A 119 -14.777 -21.448 8.092 1.00 0.00 C ATOM 1887 OG1 THR A 119 -14.852 -22.782 8.562 1.00 0.00 O ATOM 1888 CG2 THR A 119 -14.594 -20.547 9.293 1.00 0.00 C ATOM 0 H THR A 119 -17.740 -21.791 8.216 1.00 0.00 H new ATOM 0 HA THR A 119 -15.839 -20.149 6.747 1.00 0.00 H new ATOM 0 HB THR A 119 -13.927 -21.313 7.424 1.00 0.00 H new ATOM 0 HG1 THR A 119 -14.054 -22.987 9.093 1.00 0.00 H new ATOM 0 HG21 THR A 119 -13.702 -20.849 9.842 1.00 0.00 H new ATOM 0 HG22 THR A 119 -14.483 -19.515 8.960 1.00 0.00 H new ATOM 0 HG23 THR A 119 -15.465 -20.626 9.944 1.00 0.00 H new ATOM 1896 N VAL A 120 -16.758 -23.322 6.641 1.00 0.00 N ATOM 1897 CA VAL A 120 -17.031 -24.431 5.735 1.00 0.00 C ATOM 1898 C VAL A 120 -18.498 -24.449 5.315 1.00 0.00 C ATOM 1899 O VAL A 120 -19.362 -24.180 6.177 1.00 0.00 O ATOM 1900 CB VAL A 120 -16.678 -25.784 6.381 1.00 0.00 C ATOM 1901 CG1 VAL A 120 -15.179 -25.890 6.614 1.00 0.00 C ATOM 1902 CG2 VAL A 120 -17.443 -25.970 7.683 1.00 0.00 C ATOM 1903 OXT VAL A 120 -18.769 -24.731 4.129 1.00 0.00 O ATOM 0 H VAL A 120 -16.992 -23.506 7.617 1.00 0.00 H new ATOM 0 HA VAL A 120 -16.405 -24.282 4.855 1.00 0.00 H new ATOM 0 HB VAL A 120 -16.972 -26.580 5.697 1.00 0.00 H new ATOM 0 HG11 VAL A 120 -14.949 -26.852 7.071 1.00 0.00 H new ATOM 0 HG12 VAL A 120 -14.656 -25.806 5.661 1.00 0.00 H new ATOM 0 HG13 VAL A 120 -14.856 -25.087 7.277 1.00 0.00 H new ATOM 0 HG21 VAL A 120 -17.181 -26.931 8.125 1.00 0.00 H new ATOM 0 HG22 VAL A 120 -17.183 -25.169 8.375 1.00 0.00 H new ATOM 0 HG23 VAL A 120 -18.514 -25.943 7.483 1.00 0.00 H new TER 1913 VAL A 120