USER MOD reduce.3.24.130724 H: found=0, std=0, add=760, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 757 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 60 ASN : amide:sc= -0.854 X(o=-3.3,f=-2.8) USER MOD Set 1.2: A 63 HIS : no HD1:sc= -2.44! C(o=-3.3!,f=-9.1!) USER MOD Set 2.1: A 9 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: A 12 GLN : amide:sc= 0.564 K(o=0.56,f=-1) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 156:sc= 0.158 (180deg=0.0498) USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 THR OG1 : rot 180:sc= 0 USER MOD Single : A 8 CYS SG : rot 3:sc= -2.34 USER MOD Single : A 18 GLN : amide:sc= -3.81! C(o=-3.8!,f=-9.1!) USER MOD Single : A 21 GLN : amide:sc= 0.433 K(o=0.43,f=-0.28) USER MOD Single : A 23 TYR OH : rot 30:sc= 0 USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 TYR OH : rot 180:sc= 0 USER MOD Single : A 33 ASN : amide:sc= -1.75 K(o=-1.8,f=-2.9!) USER MOD Single : A 36 SER OG : rot -120:sc= -0.516 USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 GLN :FLIP amide:sc= -1.17 F(o=-2.3!,f=-1.2) USER MOD Single : A 44 GLN :FLIP amide:sc= -0.233 F(o=-0.84,f=-0.23) USER MOD Single : A 45 HIS : no HD1:sc= -0.373 X(o=-0.37,f=-0.013) USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 GLN :FLIP amide:sc= -0.138 F(o=-0.97,f=-0.14) USER MOD Single : A 48 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 52 ASN : amide:sc= -0.189 K(o=-0.19,f=-1.8!) USER MOD Single : A 54 LYS NZ :NH3+ -159:sc=-0.00864 (180deg=-0.172) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 ASN : amide:sc= -0.149 X(o=-0.15,f=-0.58) USER MOD Single : A 58 MET CE :methyl -165:sc= -13.2! (180deg=-14.1!) USER MOD Single : A 59 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 GLN : amide:sc= -0.146 X(o=-0.15,f=-0.32) USER MOD Single : A 71 MET CE :methyl -101:sc= -12.9! (180deg=-19.7!) USER MOD Single : A 73 ASN : amide:sc= -1.17 K(o=-1.2,f=-6.4!) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 82 HIS : no HE2:sc= -1.13 K(o=-1.1,f=-1.7) USER MOD Single : A 86 TYR OH : rot 180:sc= 0 USER MOD Single : A 87 THR OG1 : rot 180:sc= 0 USER MOD Single : A 91 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.00674) USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -7.633 -26.506 51.369 1.00 74.34 N ATOM 2 CA MET A 1 -7.984 -26.117 49.972 1.00 5.24 C ATOM 3 C MET A 1 -7.833 -24.614 49.764 1.00 63.22 C ATOM 4 O MET A 1 -7.969 -23.830 50.704 1.00 43.14 O ATOM 5 CB MET A 1 -9.426 -26.546 49.687 1.00 32.40 C ATOM 6 CG MET A 1 -9.545 -27.959 49.137 1.00 40.53 C ATOM 7 SD MET A 1 -9.562 -29.211 50.436 1.00 23.45 S ATOM 8 CE MET A 1 -9.652 -30.711 49.462 1.00 0.14 C ATOM 0 H1 MET A 1 -8.108 -27.399 51.610 1.00 74.34 H new ATOM 0 H2 MET A 1 -6.603 -26.629 51.447 1.00 74.34 H new ATOM 0 H3 MET A 1 -7.943 -25.761 52.025 1.00 74.34 H new ATOM 0 HA MET A 1 -7.302 -26.616 49.283 1.00 5.24 H new ATOM 0 HB2 MET A 1 -10.006 -26.473 50.607 1.00 32.40 H new ATOM 0 HB3 MET A 1 -9.869 -25.850 48.975 1.00 32.40 H new ATOM 0 HG2 MET A 1 -10.459 -28.040 48.548 1.00 40.53 H new ATOM 0 HG3 MET A 1 -8.712 -28.153 48.461 1.00 40.53 H new ATOM 0 HE1 MET A 1 -9.670 -31.575 50.126 1.00 0.14 H new ATOM 0 HE2 MET A 1 -10.559 -30.699 48.858 1.00 0.14 H new ATOM 0 HE3 MET A 1 -8.782 -30.773 48.809 1.00 0.14 H new ATOM 20 N GLY A 2 -7.550 -24.217 48.527 1.00 62.30 N ATOM 21 CA GLY A 2 -7.385 -22.807 48.222 1.00 74.12 C ATOM 22 C GLY A 2 -6.855 -22.570 46.820 1.00 25.02 C ATOM 23 O GLY A 2 -5.777 -23.047 46.468 1.00 24.42 O ATOM 0 H GLY A 2 -7.432 -24.845 47.732 1.00 62.30 H new ATOM 0 HA2 GLY A 2 -8.344 -22.300 48.334 1.00 74.12 H new ATOM 0 HA3 GLY A 2 -6.702 -22.360 48.945 1.00 74.12 H new ATOM 27 N SER A 3 -7.614 -21.825 46.021 1.00 50.14 N ATOM 28 CA SER A 3 -7.216 -21.518 44.652 1.00 44.11 C ATOM 29 C SER A 3 -7.983 -20.311 44.124 1.00 63.22 C ATOM 30 O SER A 3 -9.191 -20.196 44.323 1.00 1.32 O ATOM 31 CB SER A 3 -7.457 -22.725 43.742 1.00 62.01 C ATOM 32 OG SER A 3 -8.658 -23.393 44.086 1.00 44.20 O ATOM 0 H SER A 3 -8.509 -21.423 46.299 1.00 50.14 H new ATOM 0 HA SER A 3 -6.152 -21.282 44.654 1.00 44.11 H new ATOM 0 HB2 SER A 3 -7.504 -22.397 42.704 1.00 62.01 H new ATOM 0 HB3 SER A 3 -6.618 -23.416 43.820 1.00 62.01 H new ATOM 0 HG SER A 3 -8.789 -24.159 43.489 1.00 44.20 H new ATOM 38 N ARG A 4 -7.272 -19.411 43.452 1.00 31.34 N ATOM 39 CA ARG A 4 -7.888 -18.212 42.899 1.00 43.33 C ATOM 40 C ARG A 4 -8.085 -18.339 41.391 1.00 64.44 C ATOM 41 O ARG A 4 -7.278 -17.842 40.606 1.00 62.35 O ATOM 42 CB ARG A 4 -7.032 -16.982 43.211 1.00 75.15 C ATOM 43 CG ARG A 4 -7.848 -15.729 43.487 1.00 51.01 C ATOM 44 CD ARG A 4 -7.001 -14.639 44.127 1.00 3.44 C ATOM 45 NE ARG A 4 -6.714 -14.920 45.534 1.00 11.55 N ATOM 46 CZ ARG A 4 -5.635 -15.577 45.959 1.00 0.02 C ATOM 47 NH1 ARG A 4 -4.740 -16.036 45.094 1.00 3.51 N ATOM 48 NH2 ARG A 4 -5.453 -15.777 47.258 1.00 22.33 N ATOM 0 H ARG A 4 -6.270 -19.490 43.278 1.00 31.34 H new ATOM 0 HA ARG A 4 -8.867 -18.094 43.364 1.00 43.33 H new ATOM 0 HB2 ARG A 4 -6.405 -17.196 44.077 1.00 75.15 H new ATOM 0 HB3 ARG A 4 -6.363 -16.793 42.372 1.00 75.15 H new ATOM 0 HG2 ARG A 4 -8.274 -15.359 42.555 1.00 51.01 H new ATOM 0 HG3 ARG A 4 -8.683 -15.975 44.144 1.00 51.01 H new ATOM 0 HD2 ARG A 4 -6.064 -14.540 43.579 1.00 3.44 H new ATOM 0 HD3 ARG A 4 -7.520 -13.684 44.047 1.00 3.44 H new ATOM 0 HE ARG A 4 -7.381 -14.593 46.233 1.00 11.55 H new ATOM 0 HH11 ARG A 4 -4.874 -15.887 44.094 1.00 3.51 H new ATOM 0 HH12 ARG A 4 -3.917 -16.538 45.429 1.00 3.51 H new ATOM 0 HH21 ARG A 4 -6.138 -15.428 47.929 1.00 22.33 H new ATOM 0 HH22 ARG A 4 -4.628 -16.279 47.586 1.00 22.33 H new ATOM 62 N THR A 5 -9.167 -19.001 40.997 1.00 61.43 N ATOM 63 CA THR A 5 -9.481 -19.189 39.585 1.00 75.42 C ATOM 64 C THR A 5 -10.898 -18.713 39.288 1.00 53.15 C ATOM 65 O THR A 5 -11.873 -19.307 39.750 1.00 32.22 O ATOM 66 CB THR A 5 -9.332 -20.660 39.195 1.00 2.14 C ATOM 67 OG1 THR A 5 -8.174 -21.223 39.788 1.00 3.05 O ATOM 68 CG2 THR A 5 -9.230 -20.875 37.701 1.00 34.41 C ATOM 0 H THR A 5 -9.843 -19.417 41.637 1.00 61.43 H new ATOM 0 HA THR A 5 -8.780 -18.597 38.996 1.00 75.42 H new ATOM 0 HB THR A 5 -10.238 -21.147 39.557 1.00 2.14 H new ATOM 0 HG1 THR A 5 -8.098 -22.165 39.527 1.00 3.05 H new ATOM 0 HG21 THR A 5 -9.126 -21.940 37.493 1.00 34.41 H new ATOM 0 HG22 THR A 5 -10.130 -20.497 37.217 1.00 34.41 H new ATOM 0 HG23 THR A 5 -8.360 -20.344 37.315 1.00 34.41 H new ATOM 76 N ILE A 6 -11.007 -17.632 38.524 1.00 1.53 N ATOM 77 CA ILE A 6 -12.307 -17.073 38.174 1.00 33.41 C ATOM 78 C ILE A 6 -12.936 -17.819 37.001 1.00 11.10 C ATOM 79 O ILE A 6 -12.399 -18.817 36.522 1.00 72.21 O ATOM 80 CB ILE A 6 -12.198 -15.570 37.823 1.00 12.34 C ATOM 81 CG1 ILE A 6 -11.513 -15.372 36.466 1.00 14.45 C ATOM 82 CG2 ILE A 6 -11.441 -14.825 38.916 1.00 42.42 C ATOM 83 CD1 ILE A 6 -11.621 -13.959 35.936 1.00 23.21 C ATOM 0 H ILE A 6 -10.211 -17.126 38.135 1.00 1.53 H new ATOM 0 HA ILE A 6 -12.945 -17.188 39.050 1.00 33.41 H new ATOM 0 HB ILE A 6 -13.206 -15.162 37.755 1.00 12.34 H new ATOM 0 HG12 ILE A 6 -10.460 -15.638 36.557 1.00 14.45 H new ATOM 0 HG13 ILE A 6 -11.953 -16.058 35.742 1.00 14.45 H new ATOM 0 HG21 ILE A 6 -11.372 -13.769 38.656 1.00 42.42 H new ATOM 0 HG22 ILE A 6 -11.971 -14.932 39.863 1.00 42.42 H new ATOM 0 HG23 ILE A 6 -10.438 -15.241 39.012 1.00 42.42 H new ATOM 0 HD11 ILE A 6 -11.114 -13.892 34.973 1.00 23.21 H new ATOM 0 HD12 ILE A 6 -12.672 -13.696 35.812 1.00 23.21 H new ATOM 0 HD13 ILE A 6 -11.155 -13.270 36.640 1.00 23.21 H new ATOM 95 N PHE A 7 -14.073 -17.313 36.541 1.00 13.34 N ATOM 96 CA PHE A 7 -14.781 -17.906 35.414 1.00 50.22 C ATOM 97 C PHE A 7 -15.036 -16.846 34.353 1.00 42.14 C ATOM 98 O PHE A 7 -15.926 -16.008 34.502 1.00 72.41 O ATOM 99 CB PHE A 7 -16.105 -18.518 35.875 1.00 50.24 C ATOM 100 CG PHE A 7 -16.610 -19.610 34.973 1.00 70.43 C ATOM 101 CD1 PHE A 7 -15.932 -20.814 34.873 1.00 13.11 C ATOM 102 CD2 PHE A 7 -17.765 -19.430 34.227 1.00 40.51 C ATOM 103 CE1 PHE A 7 -16.396 -21.821 34.046 1.00 14.44 C ATOM 104 CE2 PHE A 7 -18.233 -20.433 33.398 1.00 31.12 C ATOM 105 CZ PHE A 7 -17.547 -21.630 33.308 1.00 21.53 C ATOM 0 H PHE A 7 -14.527 -16.488 36.934 1.00 13.34 H new ATOM 0 HA PHE A 7 -14.165 -18.698 34.989 1.00 50.22 H new ATOM 0 HB2 PHE A 7 -15.980 -18.918 36.881 1.00 50.24 H new ATOM 0 HB3 PHE A 7 -16.857 -17.732 35.936 1.00 50.24 H new ATOM 0 HD1 PHE A 7 -15.031 -20.968 35.448 1.00 13.11 H new ATOM 0 HD2 PHE A 7 -18.305 -18.497 34.294 1.00 40.51 H new ATOM 0 HE1 PHE A 7 -15.859 -22.755 33.978 1.00 14.44 H new ATOM 0 HE2 PHE A 7 -19.134 -20.281 32.821 1.00 31.12 H new ATOM 0 HZ PHE A 7 -17.911 -22.415 32.661 1.00 21.53 H new ATOM 115 N CYS A 8 -14.243 -16.872 33.289 1.00 31.32 N ATOM 116 CA CYS A 8 -14.384 -15.895 32.218 1.00 54.41 C ATOM 117 C CYS A 8 -15.742 -16.022 31.531 1.00 65.22 C ATOM 118 O CYS A 8 -16.322 -17.107 31.480 1.00 34.32 O ATOM 119 CB CYS A 8 -13.254 -16.051 31.198 1.00 24.25 C ATOM 120 SG CYS A 8 -13.150 -14.700 30.002 1.00 51.15 S ATOM 0 H CYS A 8 -13.499 -17.555 33.145 1.00 31.32 H new ATOM 0 HA CYS A 8 -14.321 -14.901 32.661 1.00 54.41 H new ATOM 0 HB2 CYS A 8 -12.306 -16.125 31.730 1.00 24.25 H new ATOM 0 HB3 CYS A 8 -13.391 -16.989 30.660 1.00 24.25 H new ATOM 0 HG CYS A 8 -14.045 -13.800 30.285 1.00 51.15 H new ATOM 126 N THR A 9 -16.242 -14.908 30.999 1.00 52.25 N ATOM 127 CA THR A 9 -17.530 -14.899 30.310 1.00 12.21 C ATOM 128 C THR A 9 -17.332 -14.923 28.796 1.00 43.22 C ATOM 129 O THR A 9 -18.202 -15.378 28.053 1.00 73.23 O ATOM 130 CB THR A 9 -18.346 -13.668 30.717 1.00 25.02 C ATOM 131 OG1 THR A 9 -19.659 -13.743 30.194 1.00 2.15 O ATOM 132 CG2 THR A 9 -17.739 -12.364 30.249 1.00 1.45 C ATOM 0 H THR A 9 -15.775 -14.002 31.032 1.00 52.25 H new ATOM 0 HA THR A 9 -18.079 -15.795 30.601 1.00 12.21 H new ATOM 0 HB THR A 9 -18.353 -13.674 31.807 1.00 25.02 H new ATOM 0 HG1 THR A 9 -20.165 -12.949 30.466 1.00 2.15 H new ATOM 0 HG21 THR A 9 -18.367 -11.534 30.571 1.00 1.45 H new ATOM 0 HG22 THR A 9 -16.743 -12.252 30.677 1.00 1.45 H new ATOM 0 HG23 THR A 9 -17.669 -12.365 29.161 1.00 1.45 H new ATOM 140 N PHE A 10 -16.178 -14.436 28.348 1.00 65.32 N ATOM 141 CA PHE A 10 -15.856 -14.408 26.926 1.00 62.40 C ATOM 142 C PHE A 10 -15.521 -15.812 26.443 1.00 73.04 C ATOM 143 O PHE A 10 -16.014 -16.263 25.410 1.00 1.33 O ATOM 144 CB PHE A 10 -14.674 -13.468 26.677 1.00 25.33 C ATOM 145 CG PHE A 10 -14.244 -13.396 25.239 1.00 64.10 C ATOM 146 CD1 PHE A 10 -15.138 -13.022 24.251 1.00 61.21 C ATOM 147 CD2 PHE A 10 -12.939 -13.692 24.878 1.00 62.10 C ATOM 148 CE1 PHE A 10 -14.742 -12.948 22.930 1.00 51.44 C ATOM 149 CE2 PHE A 10 -12.536 -13.618 23.560 1.00 3.30 C ATOM 150 CZ PHE A 10 -13.439 -13.245 22.583 1.00 24.22 C ATOM 0 H PHE A 10 -15.449 -14.055 28.951 1.00 65.32 H new ATOM 0 HA PHE A 10 -16.720 -14.041 26.372 1.00 62.40 H new ATOM 0 HB2 PHE A 10 -14.941 -12.467 27.016 1.00 25.33 H new ATOM 0 HB3 PHE A 10 -13.829 -13.795 27.283 1.00 25.33 H new ATOM 0 HD1 PHE A 10 -16.158 -12.785 24.516 1.00 61.21 H new ATOM 0 HD2 PHE A 10 -12.229 -13.984 25.637 1.00 62.10 H new ATOM 0 HE1 PHE A 10 -15.451 -12.658 22.169 1.00 51.44 H new ATOM 0 HE2 PHE A 10 -11.516 -13.851 23.293 1.00 3.30 H new ATOM 0 HZ PHE A 10 -13.127 -13.186 21.551 1.00 24.22 H new ATOM 160 N LEU A 11 -14.691 -16.506 27.215 1.00 73.11 N ATOM 161 CA LEU A 11 -14.299 -17.869 26.892 1.00 31.00 C ATOM 162 C LEU A 11 -15.263 -18.864 27.525 1.00 73.10 C ATOM 163 O LEU A 11 -15.334 -20.022 27.114 1.00 62.15 O ATOM 164 CB LEU A 11 -12.875 -18.145 27.377 1.00 1.01 C ATOM 165 CG LEU A 11 -11.854 -17.052 27.054 1.00 4.35 C ATOM 166 CD1 LEU A 11 -10.867 -16.890 28.199 1.00 41.20 C ATOM 167 CD2 LEU A 11 -11.122 -17.375 25.760 1.00 2.01 C ATOM 0 H LEU A 11 -14.276 -16.142 28.073 1.00 73.11 H new ATOM 0 HA LEU A 11 -14.332 -17.986 25.809 1.00 31.00 H new ATOM 0 HB2 LEU A 11 -12.898 -18.291 28.457 1.00 1.01 H new ATOM 0 HB3 LEU A 11 -12.533 -19.081 26.936 1.00 1.01 H new ATOM 0 HG LEU A 11 -12.386 -16.110 26.923 1.00 4.35 H new ATOM 0 HD11 LEU A 11 -10.148 -16.109 27.952 1.00 41.20 H new ATOM 0 HD12 LEU A 11 -11.404 -16.615 29.107 1.00 41.20 H new ATOM 0 HD13 LEU A 11 -10.340 -17.830 28.361 1.00 41.20 H new ATOM 0 HD21 LEU A 11 -10.399 -16.588 25.544 1.00 2.01 H new ATOM 0 HD22 LEU A 11 -10.601 -18.327 25.864 1.00 2.01 H new ATOM 0 HD23 LEU A 11 -11.840 -17.442 24.943 1.00 2.01 H new ATOM 179 N GLN A 12 -16.001 -18.405 28.533 1.00 23.53 N ATOM 180 CA GLN A 12 -16.955 -19.255 29.228 1.00 23.44 C ATOM 181 C GLN A 12 -16.238 -20.423 29.893 1.00 25.43 C ATOM 182 O GLN A 12 -16.722 -21.554 29.879 1.00 51.41 O ATOM 183 CB GLN A 12 -18.021 -19.767 28.257 1.00 53.11 C ATOM 184 CG GLN A 12 -19.008 -18.697 27.821 1.00 64.42 C ATOM 185 CD GLN A 12 -19.855 -18.180 28.969 1.00 42.33 C ATOM 186 OE1 GLN A 12 -20.267 -18.943 29.842 1.00 24.32 O ATOM 187 NE2 GLN A 12 -20.117 -16.878 28.973 1.00 71.40 N ATOM 0 H GLN A 12 -15.954 -17.449 28.884 1.00 23.53 H new ATOM 0 HA GLN A 12 -17.447 -18.664 30.001 1.00 23.44 H new ATOM 0 HB2 GLN A 12 -17.530 -20.178 27.375 1.00 53.11 H new ATOM 0 HB3 GLN A 12 -18.568 -20.584 28.728 1.00 53.11 H new ATOM 0 HG2 GLN A 12 -18.463 -17.866 27.374 1.00 64.42 H new ATOM 0 HG3 GLN A 12 -19.660 -19.103 27.048 1.00 64.42 H new ATOM 0 HE21 GLN A 12 -19.755 -16.283 28.228 1.00 71.40 H new ATOM 0 HE22 GLN A 12 -20.681 -16.474 29.721 1.00 71.40 H new ATOM 196 N ARG A 13 -15.080 -20.135 30.483 1.00 31.42 N ATOM 197 CA ARG A 13 -14.289 -21.154 31.166 1.00 30.23 C ATOM 198 C ARG A 13 -13.744 -20.616 32.484 1.00 63.10 C ATOM 199 O ARG A 13 -14.088 -19.511 32.906 1.00 64.23 O ATOM 200 CB ARG A 13 -13.126 -21.619 30.284 1.00 73.20 C ATOM 201 CG ARG A 13 -13.406 -21.523 28.795 1.00 72.11 C ATOM 202 CD ARG A 13 -12.155 -21.790 27.973 1.00 24.42 C ATOM 203 NE ARG A 13 -12.471 -22.297 26.638 1.00 51.31 N ATOM 204 CZ ARG A 13 -11.564 -22.792 25.799 1.00 21.21 C ATOM 205 NH1 ARG A 13 -10.286 -22.851 26.151 1.00 22.03 N ATOM 206 NH2 ARG A 13 -11.938 -23.232 24.604 1.00 63.21 N ATOM 0 H ARG A 13 -14.669 -19.202 30.501 1.00 31.42 H new ATOM 0 HA ARG A 13 -14.942 -22.003 31.369 1.00 30.23 H new ATOM 0 HB2 ARG A 13 -12.245 -21.021 30.517 1.00 73.20 H new ATOM 0 HB3 ARG A 13 -12.885 -22.653 30.532 1.00 73.20 H new ATOM 0 HG2 ARG A 13 -14.181 -22.240 28.523 1.00 72.11 H new ATOM 0 HG3 ARG A 13 -13.792 -20.531 28.560 1.00 72.11 H new ATOM 0 HD2 ARG A 13 -11.578 -20.870 27.883 1.00 24.42 H new ATOM 0 HD3 ARG A 13 -11.526 -22.511 28.495 1.00 24.42 H new ATOM 0 HE ARG A 13 -13.444 -22.270 26.332 1.00 51.31 H new ATOM 0 HH11 ARG A 13 -9.994 -22.516 27.069 1.00 22.03 H new ATOM 0 HH12 ARG A 13 -9.596 -23.231 25.504 1.00 22.03 H new ATOM 0 HH21 ARG A 13 -12.919 -23.191 24.330 1.00 63.21 H new ATOM 0 HH22 ARG A 13 -11.244 -23.612 23.960 1.00 63.21 H new ATOM 220 N GLU A 14 -12.886 -21.400 33.127 1.00 1.13 N ATOM 221 CA GLU A 14 -12.286 -20.998 34.394 1.00 34.13 C ATOM 222 C GLU A 14 -10.814 -20.651 34.201 1.00 14.15 C ATOM 223 O GLU A 14 -10.014 -21.497 33.800 1.00 14.24 O ATOM 224 CB GLU A 14 -12.425 -22.112 35.433 1.00 13.12 C ATOM 225 CG GLU A 14 -12.631 -21.598 36.848 1.00 33.02 C ATOM 226 CD GLU A 14 -13.104 -22.681 37.798 1.00 62.23 C ATOM 227 OE1 GLU A 14 -14.256 -23.140 37.651 1.00 33.53 O ATOM 228 OE2 GLU A 14 -12.323 -23.069 38.692 1.00 65.42 O ATOM 0 H GLU A 14 -12.590 -22.317 32.792 1.00 1.13 H new ATOM 0 HA GLU A 14 -12.813 -20.114 34.754 1.00 34.13 H new ATOM 0 HB2 GLU A 14 -13.266 -22.750 35.160 1.00 13.12 H new ATOM 0 HB3 GLU A 14 -11.531 -22.735 35.408 1.00 13.12 H new ATOM 0 HG2 GLU A 14 -11.696 -21.178 37.218 1.00 33.02 H new ATOM 0 HG3 GLU A 14 -13.360 -20.788 36.834 1.00 33.02 H new ATOM 235 N ALA A 15 -10.461 -19.399 34.481 1.00 12.03 N ATOM 236 CA ALA A 15 -9.085 -18.943 34.329 1.00 21.22 C ATOM 237 C ALA A 15 -8.542 -18.365 35.630 1.00 54.41 C ATOM 238 O ALA A 15 -9.286 -18.150 36.587 1.00 2.04 O ATOM 239 CB ALA A 15 -8.995 -17.913 33.214 1.00 50.14 C ATOM 0 H ALA A 15 -11.108 -18.685 34.814 1.00 12.03 H new ATOM 0 HA ALA A 15 -8.472 -19.806 34.068 1.00 21.22 H new ATOM 0 HB1 ALA A 15 -7.963 -17.579 33.109 1.00 50.14 H new ATOM 0 HB2 ALA A 15 -9.328 -18.360 32.278 1.00 50.14 H new ATOM 0 HB3 ALA A 15 -9.629 -17.060 33.455 1.00 50.14 H new ATOM 245 N GLU A 16 -7.238 -18.115 35.655 1.00 3.04 N ATOM 246 CA GLU A 16 -6.587 -17.563 36.836 1.00 72.43 C ATOM 247 C GLU A 16 -6.996 -16.111 37.071 1.00 31.24 C ATOM 248 O GLU A 16 -6.736 -15.551 38.136 1.00 54.24 O ATOM 249 CB GLU A 16 -5.068 -17.659 36.691 1.00 40.45 C ATOM 250 CG GLU A 16 -4.536 -17.006 35.424 1.00 2.55 C ATOM 251 CD GLU A 16 -4.100 -18.019 34.380 1.00 45.03 C ATOM 252 OE1 GLU A 16 -3.803 -19.173 34.757 1.00 45.02 O ATOM 253 OE2 GLU A 16 -4.054 -17.656 33.186 1.00 44.31 O ATOM 0 H GLU A 16 -6.610 -18.286 34.869 1.00 3.04 H new ATOM 0 HA GLU A 16 -6.907 -18.148 37.698 1.00 72.43 H new ATOM 0 HB2 GLU A 16 -4.598 -17.191 37.556 1.00 40.45 H new ATOM 0 HB3 GLU A 16 -4.776 -18.709 36.699 1.00 40.45 H new ATOM 0 HG2 GLU A 16 -5.308 -16.363 35.000 1.00 2.55 H new ATOM 0 HG3 GLU A 16 -3.691 -16.366 35.678 1.00 2.55 H new ATOM 260 N GLY A 17 -7.635 -15.505 36.075 1.00 52.13 N ATOM 261 CA GLY A 17 -8.065 -14.125 36.201 1.00 51.12 C ATOM 262 C GLY A 17 -6.903 -13.170 36.387 1.00 22.35 C ATOM 263 O GLY A 17 -5.802 -13.585 36.751 1.00 53.22 O ATOM 0 H GLY A 17 -7.862 -15.945 35.183 1.00 52.13 H new ATOM 0 HA2 GLY A 17 -8.626 -13.840 35.311 1.00 51.12 H new ATOM 0 HA3 GLY A 17 -8.744 -14.035 37.049 1.00 51.12 H new ATOM 267 N GLN A 18 -7.146 -11.888 36.138 1.00 21.14 N ATOM 268 CA GLN A 18 -6.109 -10.873 36.283 1.00 54.11 C ATOM 269 C GLN A 18 -5.869 -10.548 37.753 1.00 43.52 C ATOM 270 O GLN A 18 -6.490 -11.137 38.638 1.00 15.54 O ATOM 271 CB GLN A 18 -6.500 -9.603 35.523 1.00 11.52 C ATOM 272 CG GLN A 18 -6.969 -9.865 34.101 1.00 53.05 C ATOM 273 CD GLN A 18 -8.477 -9.797 33.964 1.00 62.42 C ATOM 274 OE1 GLN A 18 -9.213 -10.197 34.866 1.00 1.12 O ATOM 275 NE2 GLN A 18 -8.947 -9.287 32.831 1.00 14.32 N ATOM 0 H GLN A 18 -8.051 -11.527 35.835 1.00 21.14 H new ATOM 0 HA GLN A 18 -5.185 -11.269 35.862 1.00 54.11 H new ATOM 0 HB2 GLN A 18 -7.292 -9.092 36.070 1.00 11.52 H new ATOM 0 HB3 GLN A 18 -5.645 -8.928 35.496 1.00 11.52 H new ATOM 0 HG2 GLN A 18 -6.514 -9.135 33.432 1.00 53.05 H new ATOM 0 HG3 GLN A 18 -6.623 -10.849 33.783 1.00 53.05 H new ATOM 0 HE21 GLN A 18 -8.301 -8.967 32.109 1.00 14.32 H new ATOM 0 HE22 GLN A 18 -9.954 -9.215 32.683 1.00 14.32 H new ATOM 284 N ASP A 19 -4.962 -9.611 38.008 1.00 30.30 N ATOM 285 CA ASP A 19 -4.636 -9.211 39.372 1.00 31.15 C ATOM 286 C ASP A 19 -4.973 -7.741 39.618 1.00 54.34 C ATOM 287 O ASP A 19 -5.217 -7.335 40.753 1.00 62.12 O ATOM 288 CB ASP A 19 -3.152 -9.456 39.656 1.00 61.25 C ATOM 289 CG ASP A 19 -2.843 -10.919 39.902 1.00 4.21 C ATOM 290 OD1 ASP A 19 -3.419 -11.495 40.848 1.00 32.45 O ATOM 291 OD2 ASP A 19 -2.023 -11.486 39.151 1.00 63.02 O ATOM 0 H ASP A 19 -4.439 -9.114 37.287 1.00 30.30 H new ATOM 0 HA ASP A 19 -5.239 -9.817 40.048 1.00 31.15 H new ATOM 0 HB2 ASP A 19 -2.560 -9.100 38.813 1.00 61.25 H new ATOM 0 HB3 ASP A 19 -2.851 -8.873 40.526 1.00 61.25 H new ATOM 296 N PHE A 20 -4.977 -6.948 38.551 1.00 75.50 N ATOM 297 CA PHE A 20 -5.276 -5.525 38.661 1.00 61.11 C ATOM 298 C PHE A 20 -6.202 -5.069 37.537 1.00 11.10 C ATOM 299 O PHE A 20 -6.070 -5.508 36.394 1.00 10.14 O ATOM 300 CB PHE A 20 -3.978 -4.715 38.629 1.00 42.10 C ATOM 301 CG PHE A 20 -3.053 -5.109 37.512 1.00 20.33 C ATOM 302 CD1 PHE A 20 -3.218 -4.580 36.241 1.00 53.11 C ATOM 303 CD2 PHE A 20 -2.020 -6.005 37.732 1.00 62.20 C ATOM 304 CE1 PHE A 20 -2.368 -4.939 35.212 1.00 13.12 C ATOM 305 CE2 PHE A 20 -1.167 -6.367 36.706 1.00 64.11 C ATOM 306 CZ PHE A 20 -1.342 -5.834 35.444 1.00 51.01 C ATOM 0 H PHE A 20 -4.777 -7.266 37.603 1.00 75.50 H new ATOM 0 HA PHE A 20 -5.785 -5.357 39.610 1.00 61.11 H new ATOM 0 HB2 PHE A 20 -4.222 -3.657 38.532 1.00 42.10 H new ATOM 0 HB3 PHE A 20 -3.459 -4.837 39.580 1.00 42.10 H new ATOM 0 HD1 PHE A 20 -4.019 -3.880 36.053 1.00 53.11 H new ATOM 0 HD2 PHE A 20 -1.879 -6.426 38.717 1.00 62.20 H new ATOM 0 HE1 PHE A 20 -2.506 -4.520 34.226 1.00 13.12 H new ATOM 0 HE2 PHE A 20 -0.365 -7.066 36.891 1.00 64.11 H new ATOM 0 HZ PHE A 20 -0.678 -6.116 34.640 1.00 51.01 H new ATOM 316 N GLN A 21 -7.140 -4.187 37.868 1.00 15.34 N ATOM 317 CA GLN A 21 -8.087 -3.673 36.884 1.00 22.42 C ATOM 318 C GLN A 21 -7.355 -2.982 35.739 1.00 75.54 C ATOM 319 O GLN A 21 -6.745 -1.928 35.923 1.00 3.30 O ATOM 320 CB GLN A 21 -9.071 -2.704 37.542 1.00 41.11 C ATOM 321 CG GLN A 21 -10.398 -2.596 36.809 1.00 63.45 C ATOM 322 CD GLN A 21 -11.425 -1.786 37.577 1.00 14.32 C ATOM 323 OE1 GLN A 21 -11.821 -2.153 38.683 1.00 21.41 O ATOM 324 NE2 GLN A 21 -11.866 -0.678 36.991 1.00 51.02 N ATOM 0 H GLN A 21 -7.265 -3.814 38.809 1.00 15.34 H new ATOM 0 HA GLN A 21 -8.645 -4.517 36.478 1.00 22.42 H new ATOM 0 HB2 GLN A 21 -9.256 -3.027 38.566 1.00 41.11 H new ATOM 0 HB3 GLN A 21 -8.614 -1.716 37.597 1.00 41.11 H new ATOM 0 HG2 GLN A 21 -10.234 -2.137 35.834 1.00 63.45 H new ATOM 0 HG3 GLN A 21 -10.791 -3.596 36.628 1.00 63.45 H new ATOM 0 HE21 GLN A 21 -11.511 -0.411 36.073 1.00 51.02 H new ATOM 0 HE22 GLN A 21 -12.560 -0.095 37.459 1.00 51.02 H new ATOM 333 N LEU A 22 -7.417 -3.588 34.558 1.00 10.45 N ATOM 334 CA LEU A 22 -6.757 -3.041 33.378 1.00 4.02 C ATOM 335 C LEU A 22 -7.501 -1.816 32.853 1.00 35.51 C ATOM 336 O LEU A 22 -6.885 -0.825 32.461 1.00 71.53 O ATOM 337 CB LEU A 22 -6.669 -4.112 32.290 1.00 12.14 C ATOM 338 CG LEU A 22 -6.222 -5.491 32.782 1.00 25.31 C ATOM 339 CD1 LEU A 22 -6.238 -6.498 31.643 1.00 12.30 C ATOM 340 CD2 LEU A 22 -4.837 -5.409 33.404 1.00 4.03 C ATOM 0 H LEU A 22 -7.919 -4.460 34.392 1.00 10.45 H new ATOM 0 HA LEU A 22 -5.751 -2.730 33.659 1.00 4.02 H new ATOM 0 HB2 LEU A 22 -7.646 -4.210 31.816 1.00 12.14 H new ATOM 0 HB3 LEU A 22 -5.974 -3.773 31.521 1.00 12.14 H new ATOM 0 HG LEU A 22 -6.924 -5.828 33.545 1.00 25.31 H new ATOM 0 HD11 LEU A 22 -5.917 -7.472 32.014 1.00 12.30 H new ATOM 0 HD12 LEU A 22 -7.248 -6.577 31.242 1.00 12.30 H new ATOM 0 HD13 LEU A 22 -5.560 -6.168 30.856 1.00 12.30 H new ATOM 0 HD21 LEU A 22 -4.534 -6.398 33.749 1.00 4.03 H new ATOM 0 HD22 LEU A 22 -4.125 -5.050 32.661 1.00 4.03 H new ATOM 0 HD23 LEU A 22 -4.858 -4.721 34.249 1.00 4.03 H new ATOM 352 N TYR A 23 -8.827 -1.889 32.857 1.00 34.05 N ATOM 353 CA TYR A 23 -9.655 -0.784 32.390 1.00 23.50 C ATOM 354 C TYR A 23 -10.111 0.072 33.574 1.00 25.40 C ATOM 355 O TYR A 23 -9.967 -0.328 34.728 1.00 43.13 O ATOM 356 CB TYR A 23 -10.868 -1.319 31.628 1.00 63.45 C ATOM 357 CG TYR A 23 -10.981 -0.802 30.219 1.00 52.33 C ATOM 358 CD1 TYR A 23 -9.976 -1.017 29.289 1.00 65.42 C ATOM 359 CD2 TYR A 23 -12.100 -0.089 29.825 1.00 4.51 C ATOM 360 CE1 TYR A 23 -10.084 -0.530 27.999 1.00 33.35 C ATOM 361 CE2 TYR A 23 -12.218 0.405 28.543 1.00 71.50 C ATOM 362 CZ TYR A 23 -11.207 0.182 27.632 1.00 12.35 C ATOM 363 OH TYR A 23 -11.320 0.672 26.351 1.00 2.05 O ATOM 0 H TYR A 23 -9.352 -2.702 33.179 1.00 34.05 H new ATOM 0 HA TYR A 23 -9.064 -0.164 31.717 1.00 23.50 H new ATOM 0 HB2 TYR A 23 -10.817 -2.407 31.602 1.00 63.45 H new ATOM 0 HB3 TYR A 23 -11.773 -1.055 32.175 1.00 63.45 H new ATOM 0 HD1 TYR A 23 -9.096 -1.573 29.576 1.00 65.42 H new ATOM 0 HD2 TYR A 23 -12.895 0.084 30.535 1.00 4.51 H new ATOM 0 HE1 TYR A 23 -9.294 -0.706 27.284 1.00 33.35 H new ATOM 0 HE2 TYR A 23 -13.096 0.963 28.254 1.00 71.50 H new ATOM 0 HH TYR A 23 -10.838 0.084 25.732 1.00 2.05 H new ATOM 373 N PRO A 24 -10.661 1.268 33.307 1.00 32.24 N ATOM 374 CA PRO A 24 -11.129 2.177 34.349 1.00 11.05 C ATOM 375 C PRO A 24 -12.600 1.971 34.692 1.00 1.33 C ATOM 376 O PRO A 24 -13.231 1.015 34.240 1.00 21.12 O ATOM 377 CB PRO A 24 -10.947 3.526 33.672 1.00 65.33 C ATOM 378 CG PRO A 24 -11.347 3.251 32.265 1.00 43.20 C ATOM 379 CD PRO A 24 -10.867 1.850 31.968 1.00 63.42 C ATOM 0 HA PRO A 24 -10.599 2.046 35.292 1.00 11.05 H new ATOM 0 HB2 PRO A 24 -11.573 4.294 34.127 1.00 65.33 H new ATOM 0 HB3 PRO A 24 -9.916 3.875 33.738 1.00 65.33 H new ATOM 0 HG2 PRO A 24 -12.427 3.328 32.143 1.00 43.20 H new ATOM 0 HG3 PRO A 24 -10.897 3.972 31.582 1.00 43.20 H new ATOM 0 HD2 PRO A 24 -11.603 1.287 31.394 1.00 63.42 H new ATOM 0 HD3 PRO A 24 -9.945 1.856 31.386 1.00 63.42 H new ATOM 387 N GLY A 25 -13.138 2.899 35.478 1.00 62.31 N ATOM 388 CA GLY A 25 -14.535 2.858 35.873 1.00 55.53 C ATOM 389 C GLY A 25 -15.078 1.466 36.143 1.00 61.45 C ATOM 390 O GLY A 25 -14.389 0.611 36.700 1.00 31.03 O ATOM 0 H GLY A 25 -12.620 3.693 35.854 1.00 62.31 H new ATOM 0 HA2 GLY A 25 -14.662 3.463 36.771 1.00 55.53 H new ATOM 0 HA3 GLY A 25 -15.134 3.321 35.089 1.00 55.53 H new ATOM 394 N GLU A 26 -16.334 1.264 35.758 1.00 34.32 N ATOM 395 CA GLU A 26 -17.021 -0.007 35.965 1.00 25.33 C ATOM 396 C GLU A 26 -16.601 -1.053 34.940 1.00 14.12 C ATOM 397 O GLU A 26 -16.347 -2.206 35.286 1.00 61.02 O ATOM 398 CB GLU A 26 -18.536 0.204 35.893 1.00 60.13 C ATOM 399 CG GLU A 26 -19.251 -0.046 37.212 1.00 32.34 C ATOM 400 CD GLU A 26 -19.734 1.235 37.863 1.00 53.51 C ATOM 401 OE1 GLU A 26 -18.888 1.997 38.375 1.00 61.30 O ATOM 402 OE2 GLU A 26 -20.959 1.477 37.859 1.00 44.40 O ATOM 0 H GLU A 26 -16.903 1.973 35.296 1.00 34.32 H new ATOM 0 HA GLU A 26 -16.743 -0.376 36.952 1.00 25.33 H new ATOM 0 HB2 GLU A 26 -18.737 1.225 35.569 1.00 60.13 H new ATOM 0 HB3 GLU A 26 -18.951 -0.459 35.134 1.00 60.13 H new ATOM 0 HG2 GLU A 26 -20.102 -0.706 37.041 1.00 32.34 H new ATOM 0 HG3 GLU A 26 -18.577 -0.565 37.894 1.00 32.34 H new ATOM 409 N LEU A 27 -16.532 -0.648 33.676 1.00 43.20 N ATOM 410 CA LEU A 27 -16.144 -1.560 32.607 1.00 70.03 C ATOM 411 C LEU A 27 -14.871 -2.309 32.984 1.00 3.24 C ATOM 412 O LEU A 27 -14.788 -3.528 32.838 1.00 43.43 O ATOM 413 CB LEU A 27 -15.953 -0.797 31.297 1.00 42.54 C ATOM 414 CG LEU A 27 -17.026 -1.061 30.237 1.00 51.12 C ATOM 415 CD1 LEU A 27 -16.814 -0.164 29.024 1.00 14.22 C ATOM 416 CD2 LEU A 27 -17.026 -2.530 29.830 1.00 51.13 C ATOM 0 H LEU A 27 -16.739 0.302 33.368 1.00 43.20 H new ATOM 0 HA LEU A 27 -16.942 -2.289 32.465 1.00 70.03 H new ATOM 0 HB2 LEU A 27 -15.932 0.271 31.515 1.00 42.54 H new ATOM 0 HB3 LEU A 27 -14.980 -1.056 30.881 1.00 42.54 H new ATOM 0 HG LEU A 27 -18.000 -0.826 30.667 1.00 51.12 H new ATOM 0 HD11 LEU A 27 -17.586 -0.367 28.282 1.00 14.22 H new ATOM 0 HD12 LEU A 27 -16.870 0.881 29.330 1.00 14.22 H new ATOM 0 HD13 LEU A 27 -15.834 -0.363 28.591 1.00 14.22 H new ATOM 0 HD21 LEU A 27 -17.795 -2.699 29.076 1.00 51.13 H new ATOM 0 HD22 LEU A 27 -16.051 -2.794 29.420 1.00 51.13 H new ATOM 0 HD23 LEU A 27 -17.232 -3.149 30.703 1.00 51.13 H new ATOM 428 N GLY A 28 -13.886 -1.573 33.488 1.00 3.43 N ATOM 429 CA GLY A 28 -12.640 -2.189 33.899 1.00 70.33 C ATOM 430 C GLY A 28 -12.852 -3.218 34.983 1.00 53.45 C ATOM 431 O GLY A 28 -12.167 -4.241 35.021 1.00 64.53 O ATOM 0 H GLY A 28 -13.929 -0.562 33.619 1.00 3.43 H new ATOM 0 HA2 GLY A 28 -12.167 -2.661 33.038 1.00 70.33 H new ATOM 0 HA3 GLY A 28 -11.956 -1.420 34.257 1.00 70.33 H new ATOM 435 N LYS A 29 -13.816 -2.959 35.854 1.00 41.30 N ATOM 436 CA LYS A 29 -14.130 -3.882 36.932 1.00 11.31 C ATOM 437 C LYS A 29 -14.610 -5.213 36.363 1.00 74.12 C ATOM 438 O LYS A 29 -14.060 -6.267 36.674 1.00 50.10 O ATOM 439 CB LYS A 29 -15.201 -3.289 37.848 1.00 13.40 C ATOM 440 CG LYS A 29 -15.326 -4.007 39.182 1.00 74.43 C ATOM 441 CD LYS A 29 -15.962 -3.114 40.236 1.00 54.40 C ATOM 442 CE LYS A 29 -14.921 -2.539 41.185 1.00 33.14 C ATOM 443 NZ LYS A 29 -14.843 -1.055 41.091 1.00 73.52 N ATOM 0 H LYS A 29 -14.393 -2.118 35.835 1.00 41.30 H new ATOM 0 HA LYS A 29 -13.225 -4.052 37.516 1.00 11.31 H new ATOM 0 HB2 LYS A 29 -14.971 -2.239 38.030 1.00 13.40 H new ATOM 0 HB3 LYS A 29 -16.163 -3.320 37.336 1.00 13.40 H new ATOM 0 HG2 LYS A 29 -15.926 -4.908 39.057 1.00 74.43 H new ATOM 0 HG3 LYS A 29 -14.340 -4.325 39.520 1.00 74.43 H new ATOM 0 HD2 LYS A 29 -16.499 -2.301 39.748 1.00 54.40 H new ATOM 0 HD3 LYS A 29 -16.696 -3.686 40.804 1.00 54.40 H new ATOM 0 HE2 LYS A 29 -15.165 -2.826 42.208 1.00 33.14 H new ATOM 0 HE3 LYS A 29 -13.946 -2.969 40.957 1.00 33.14 H new ATOM 0 HZ1 LYS A 29 -14.123 -0.703 41.753 1.00 73.52 H new ATOM 0 HZ2 LYS A 29 -14.585 -0.782 40.121 1.00 73.52 H new ATOM 0 HZ3 LYS A 29 -15.767 -0.643 41.333 1.00 73.52 H new ATOM 457 N ARG A 30 -15.643 -5.148 35.527 1.00 14.42 N ATOM 458 CA ARG A 30 -16.209 -6.347 34.912 1.00 74.43 C ATOM 459 C ARG A 30 -15.156 -7.124 34.122 1.00 51.04 C ATOM 460 O ARG A 30 -15.111 -8.345 34.195 1.00 65.32 O ATOM 461 CB ARG A 30 -17.400 -5.997 34.011 1.00 42.34 C ATOM 462 CG ARG A 30 -17.180 -4.785 33.126 1.00 12.00 C ATOM 463 CD ARG A 30 -18.496 -4.239 32.593 1.00 64.35 C ATOM 464 NE ARG A 30 -19.305 -3.636 33.652 1.00 14.55 N ATOM 465 CZ ARG A 30 -19.892 -2.441 33.562 1.00 44.23 C ATOM 466 NH1 ARG A 30 -19.761 -1.704 32.465 1.00 71.24 N ATOM 467 NH2 ARG A 30 -20.616 -1.983 34.574 1.00 70.40 N ATOM 0 H ARG A 30 -16.105 -4.279 35.260 1.00 14.42 H new ATOM 0 HA ARG A 30 -16.564 -6.986 35.721 1.00 74.43 H new ATOM 0 HB2 ARG A 30 -17.628 -6.856 33.380 1.00 42.34 H new ATOM 0 HB3 ARG A 30 -18.275 -5.821 34.637 1.00 42.34 H new ATOM 0 HG2 ARG A 30 -16.665 -4.009 33.692 1.00 12.00 H new ATOM 0 HG3 ARG A 30 -16.532 -5.055 32.292 1.00 12.00 H new ATOM 0 HD2 ARG A 30 -18.295 -3.495 31.822 1.00 64.35 H new ATOM 0 HD3 ARG A 30 -19.058 -5.044 32.120 1.00 64.35 H new ATOM 0 HE ARG A 30 -19.429 -4.164 34.516 1.00 14.55 H new ATOM 0 HH11 ARG A 30 -19.208 -2.050 31.681 1.00 71.24 H new ATOM 0 HH12 ARG A 30 -20.214 -0.792 32.406 1.00 71.24 H new ATOM 0 HH21 ARG A 30 -20.723 -2.544 35.419 1.00 70.40 H new ATOM 0 HH22 ARG A 30 -21.066 -1.070 34.507 1.00 70.40 H new ATOM 481 N ILE A 31 -14.308 -6.426 33.368 1.00 42.52 N ATOM 482 CA ILE A 31 -13.269 -7.107 32.592 1.00 44.44 C ATOM 483 C ILE A 31 -12.323 -7.828 33.532 1.00 73.55 C ATOM 484 O ILE A 31 -12.157 -9.043 33.466 1.00 62.43 O ATOM 485 CB ILE A 31 -12.460 -6.134 31.708 1.00 54.41 C ATOM 486 CG1 ILE A 31 -13.393 -5.248 30.884 1.00 20.53 C ATOM 487 CG2 ILE A 31 -11.523 -6.911 30.795 1.00 14.54 C ATOM 488 CD1 ILE A 31 -12.874 -3.842 30.708 1.00 24.11 C ATOM 0 H ILE A 31 -14.317 -5.410 33.277 1.00 42.52 H new ATOM 0 HA ILE A 31 -13.770 -7.815 31.932 1.00 44.44 H new ATOM 0 HB ILE A 31 -11.865 -5.491 32.357 1.00 54.41 H new ATOM 0 HG12 ILE A 31 -13.540 -5.700 29.903 1.00 20.53 H new ATOM 0 HG13 ILE A 31 -14.369 -5.210 31.367 1.00 20.53 H new ATOM 0 HG21 ILE A 31 -10.958 -6.214 30.176 1.00 14.54 H new ATOM 0 HG22 ILE A 31 -10.834 -7.502 31.399 1.00 14.54 H new ATOM 0 HG23 ILE A 31 -12.105 -7.574 30.155 1.00 14.54 H new ATOM 0 HD11 ILE A 31 -13.582 -3.264 30.114 1.00 24.11 H new ATOM 0 HD12 ILE A 31 -12.753 -3.374 31.685 1.00 24.11 H new ATOM 0 HD13 ILE A 31 -11.911 -3.871 30.198 1.00 24.11 H new ATOM 500 N TYR A 32 -11.726 -7.059 34.423 1.00 64.50 N ATOM 501 CA TYR A 32 -10.810 -7.597 35.411 1.00 23.32 C ATOM 502 C TYR A 32 -11.518 -8.626 36.297 1.00 71.21 C ATOM 503 O TYR A 32 -10.867 -9.423 36.974 1.00 4.24 O ATOM 504 CB TYR A 32 -10.228 -6.447 36.244 1.00 61.31 C ATOM 505 CG TYR A 32 -9.960 -6.780 37.695 1.00 14.12 C ATOM 506 CD1 TYR A 32 -10.966 -6.678 38.647 1.00 20.14 C ATOM 507 CD2 TYR A 32 -8.699 -7.183 38.112 1.00 54.11 C ATOM 508 CE1 TYR A 32 -10.723 -6.973 39.975 1.00 50.43 C ATOM 509 CE2 TYR A 32 -8.447 -7.478 39.436 1.00 31.22 C ATOM 510 CZ TYR A 32 -9.463 -7.371 40.366 1.00 75.01 C ATOM 511 OH TYR A 32 -9.217 -7.663 41.689 1.00 23.44 O ATOM 0 H TYR A 32 -11.861 -6.050 34.483 1.00 64.50 H new ATOM 0 HA TYR A 32 -9.991 -8.111 34.907 1.00 23.32 H new ATOM 0 HB2 TYR A 32 -9.295 -6.121 35.784 1.00 61.31 H new ATOM 0 HB3 TYR A 32 -10.917 -5.603 36.202 1.00 61.31 H new ATOM 0 HD1 TYR A 32 -11.954 -6.363 38.345 1.00 20.14 H new ATOM 0 HD2 TYR A 32 -7.902 -7.267 37.388 1.00 54.11 H new ATOM 0 HE1 TYR A 32 -11.517 -6.892 40.703 1.00 50.43 H new ATOM 0 HE2 TYR A 32 -7.460 -7.791 39.744 1.00 31.22 H new ATOM 0 HH TYR A 32 -8.280 -7.929 41.797 1.00 23.44 H new ATOM 521 N ASN A 33 -12.853 -8.594 36.304 1.00 73.34 N ATOM 522 CA ASN A 33 -13.630 -9.522 37.131 1.00 54.32 C ATOM 523 C ASN A 33 -14.126 -10.741 36.348 1.00 71.34 C ATOM 524 O ASN A 33 -13.875 -11.880 36.739 1.00 44.01 O ATOM 525 CB ASN A 33 -14.822 -8.798 37.759 1.00 0.31 C ATOM 526 CG ASN A 33 -14.454 -8.101 39.055 1.00 15.51 C ATOM 527 OD1 ASN A 33 -13.476 -8.462 39.708 1.00 33.41 O ATOM 528 ND2 ASN A 33 -15.236 -7.097 39.429 1.00 61.25 N ATOM 0 H ASN A 33 -13.414 -7.944 35.753 1.00 73.34 H new ATOM 0 HA ASN A 33 -12.959 -9.885 37.909 1.00 54.32 H new ATOM 0 HB2 ASN A 33 -15.212 -8.065 37.053 1.00 0.31 H new ATOM 0 HB3 ASN A 33 -15.621 -9.515 37.949 1.00 0.31 H new ATOM 0 HD21 ASN A 33 -15.037 -6.589 40.291 1.00 61.25 H new ATOM 0 HD22 ASN A 33 -16.037 -6.833 38.855 1.00 61.25 H new ATOM 535 N GLU A 34 -14.858 -10.497 35.264 1.00 11.44 N ATOM 536 CA GLU A 34 -15.418 -11.580 34.455 1.00 12.01 C ATOM 537 C GLU A 34 -14.524 -11.951 33.275 1.00 33.04 C ATOM 538 O GLU A 34 -14.635 -13.047 32.736 1.00 14.34 O ATOM 539 CB GLU A 34 -16.808 -11.192 33.948 1.00 14.34 C ATOM 540 CG GLU A 34 -17.690 -10.570 35.016 1.00 71.44 C ATOM 541 CD GLU A 34 -18.909 -11.415 35.336 1.00 43.43 C ATOM 542 OE1 GLU A 34 -18.803 -12.657 35.270 1.00 51.51 O ATOM 543 OE2 GLU A 34 -19.968 -10.832 35.652 1.00 60.04 O ATOM 0 H GLU A 34 -15.078 -9.561 34.925 1.00 11.44 H new ATOM 0 HA GLU A 34 -15.488 -12.457 35.099 1.00 12.01 H new ATOM 0 HB2 GLU A 34 -16.702 -10.490 33.121 1.00 14.34 H new ATOM 0 HB3 GLU A 34 -17.302 -12.079 33.551 1.00 14.34 H new ATOM 0 HG2 GLU A 34 -17.105 -10.425 35.924 1.00 71.44 H new ATOM 0 HG3 GLU A 34 -18.014 -9.584 34.684 1.00 71.44 H new ATOM 550 N ILE A 35 -13.640 -11.048 32.868 1.00 41.23 N ATOM 551 CA ILE A 35 -12.743 -11.324 31.751 1.00 15.01 C ATOM 552 C ILE A 35 -11.344 -11.674 32.254 1.00 22.10 C ATOM 553 O ILE A 35 -10.816 -11.024 33.155 1.00 72.42 O ATOM 554 CB ILE A 35 -12.668 -10.130 30.771 1.00 65.24 C ATOM 555 CG1 ILE A 35 -14.063 -9.792 30.232 1.00 43.31 C ATOM 556 CG2 ILE A 35 -11.716 -10.438 29.620 1.00 51.33 C ATOM 557 CD1 ILE A 35 -14.848 -11.003 29.778 1.00 44.35 C ATOM 0 H ILE A 35 -13.525 -10.126 33.290 1.00 41.23 H new ATOM 0 HA ILE A 35 -13.151 -12.179 31.212 1.00 15.01 H new ATOM 0 HB ILE A 35 -12.285 -9.266 31.313 1.00 65.24 H new ATOM 0 HG12 ILE A 35 -14.627 -9.274 31.008 1.00 43.31 H new ATOM 0 HG13 ILE A 35 -13.962 -9.101 29.395 1.00 43.31 H new ATOM 0 HG21 ILE A 35 -11.677 -9.586 28.942 1.00 51.33 H new ATOM 0 HG22 ILE A 35 -10.719 -10.633 30.015 1.00 51.33 H new ATOM 0 HG23 ILE A 35 -12.070 -11.316 29.080 1.00 51.33 H new ATOM 0 HD11 ILE A 35 -15.824 -10.687 29.410 1.00 44.35 H new ATOM 0 HD12 ILE A 35 -14.306 -11.510 28.980 1.00 44.35 H new ATOM 0 HD13 ILE A 35 -14.981 -11.686 30.617 1.00 44.35 H new ATOM 569 N SER A 36 -10.754 -12.714 31.673 1.00 32.24 N ATOM 570 CA SER A 36 -9.423 -13.156 32.072 1.00 70.31 C ATOM 571 C SER A 36 -8.362 -12.668 31.089 1.00 1.11 C ATOM 572 O SER A 36 -8.681 -12.065 30.066 1.00 2.44 O ATOM 573 CB SER A 36 -9.377 -14.682 32.167 1.00 53.15 C ATOM 574 OG SER A 36 -8.120 -15.122 32.653 1.00 41.34 O ATOM 0 H SER A 36 -11.176 -13.265 30.926 1.00 32.24 H new ATOM 0 HA SER A 36 -9.208 -12.727 33.051 1.00 70.31 H new ATOM 0 HB2 SER A 36 -10.170 -15.033 32.828 1.00 53.15 H new ATOM 0 HB3 SER A 36 -9.564 -15.117 31.185 1.00 53.15 H new ATOM 0 HG SER A 36 -7.696 -15.702 31.986 1.00 41.34 H new ATOM 580 N LYS A 37 -7.101 -12.937 31.409 1.00 42.00 N ATOM 581 CA LYS A 37 -5.990 -12.529 30.557 1.00 52.25 C ATOM 582 C LYS A 37 -6.122 -13.141 29.166 1.00 52.31 C ATOM 583 O LYS A 37 -5.863 -12.483 28.159 1.00 14.05 O ATOM 584 CB LYS A 37 -4.658 -12.945 31.183 1.00 71.22 C ATOM 585 CG LYS A 37 -4.169 -11.996 32.265 1.00 2.54 C ATOM 586 CD LYS A 37 -3.090 -11.063 31.742 1.00 32.52 C ATOM 587 CE LYS A 37 -2.950 -9.828 32.618 1.00 55.32 C ATOM 588 NZ LYS A 37 -2.086 -8.790 31.986 1.00 43.10 N ATOM 0 H LYS A 37 -6.822 -13.437 32.254 1.00 42.00 H new ATOM 0 HA LYS A 37 -6.016 -11.443 30.464 1.00 52.25 H new ATOM 0 HB2 LYS A 37 -4.762 -13.943 31.608 1.00 71.22 H new ATOM 0 HB3 LYS A 37 -3.903 -13.009 30.400 1.00 71.22 H new ATOM 0 HG2 LYS A 37 -5.007 -11.410 32.642 1.00 2.54 H new ATOM 0 HG3 LYS A 37 -3.779 -12.571 33.105 1.00 2.54 H new ATOM 0 HD2 LYS A 37 -2.138 -11.592 31.702 1.00 32.52 H new ATOM 0 HD3 LYS A 37 -3.330 -10.762 30.722 1.00 32.52 H new ATOM 0 HE2 LYS A 37 -3.937 -9.408 32.813 1.00 55.32 H new ATOM 0 HE3 LYS A 37 -2.528 -10.113 33.582 1.00 55.32 H new ATOM 0 HZ1 LYS A 37 -2.017 -7.965 32.616 1.00 43.10 H new ATOM 0 HZ2 LYS A 37 -1.136 -9.181 31.823 1.00 43.10 H new ATOM 0 HZ3 LYS A 37 -2.501 -8.498 31.078 1.00 43.10 H new ATOM 602 N GLU A 38 -6.529 -14.405 29.120 1.00 41.40 N ATOM 603 CA GLU A 38 -6.699 -15.110 27.855 1.00 54.20 C ATOM 604 C GLU A 38 -7.753 -14.424 26.992 1.00 31.43 C ATOM 605 O GLU A 38 -7.555 -14.225 25.794 1.00 60.21 O ATOM 606 CB GLU A 38 -7.096 -16.565 28.112 1.00 41.40 C ATOM 607 CG GLU A 38 -6.913 -17.470 26.905 1.00 62.41 C ATOM 608 CD GLU A 38 -6.987 -18.940 27.264 1.00 30.14 C ATOM 609 OE1 GLU A 38 -6.579 -19.299 28.388 1.00 72.33 O ATOM 610 OE2 GLU A 38 -7.455 -19.734 26.421 1.00 54.15 O ATOM 0 H GLU A 38 -6.748 -14.963 29.945 1.00 41.40 H new ATOM 0 HA GLU A 38 -5.749 -15.090 27.320 1.00 54.20 H new ATOM 0 HB2 GLU A 38 -6.503 -16.954 28.940 1.00 41.40 H new ATOM 0 HB3 GLU A 38 -8.140 -16.598 28.425 1.00 41.40 H new ATOM 0 HG2 GLU A 38 -7.679 -17.241 26.164 1.00 62.41 H new ATOM 0 HG3 GLU A 38 -5.949 -17.261 26.441 1.00 62.41 H new ATOM 617 N ALA A 39 -8.871 -14.060 27.611 1.00 51.41 N ATOM 618 CA ALA A 39 -9.955 -13.392 26.903 1.00 63.44 C ATOM 619 C ALA A 39 -9.568 -11.965 26.532 1.00 13.12 C ATOM 620 O ALA A 39 -9.923 -11.474 25.460 1.00 44.04 O ATOM 621 CB ALA A 39 -11.217 -13.394 27.753 1.00 12.31 C ATOM 0 H ALA A 39 -9.050 -14.217 28.603 1.00 51.41 H new ATOM 0 HA ALA A 39 -10.149 -13.940 25.981 1.00 63.44 H new ATOM 0 HB1 ALA A 39 -12.020 -12.892 27.213 1.00 12.31 H new ATOM 0 HB2 ALA A 39 -11.510 -14.422 27.966 1.00 12.31 H new ATOM 0 HB3 ALA A 39 -11.026 -12.870 28.689 1.00 12.31 H new ATOM 627 N TRP A 40 -8.838 -11.304 27.425 1.00 21.45 N ATOM 628 CA TRP A 40 -8.402 -9.933 27.193 1.00 64.40 C ATOM 629 C TRP A 40 -7.445 -9.857 26.009 1.00 11.24 C ATOM 630 O TRP A 40 -7.478 -8.903 25.232 1.00 3.30 O ATOM 631 CB TRP A 40 -7.729 -9.372 28.447 1.00 22.34 C ATOM 632 CG TRP A 40 -7.528 -7.888 28.403 1.00 24.04 C ATOM 633 CD1 TRP A 40 -6.347 -7.216 28.535 1.00 14.34 C ATOM 634 CD2 TRP A 40 -8.539 -6.889 28.219 1.00 71.33 C ATOM 635 NE1 TRP A 40 -6.561 -5.862 28.445 1.00 2.03 N ATOM 636 CE2 TRP A 40 -7.899 -5.636 28.251 1.00 22.04 C ATOM 637 CE3 TRP A 40 -9.924 -6.933 28.030 1.00 10.53 C ATOM 638 CZ2 TRP A 40 -8.595 -4.438 28.102 1.00 13.34 C ATOM 639 CZ3 TRP A 40 -10.614 -5.743 27.882 1.00 12.25 C ATOM 640 CH2 TRP A 40 -9.949 -4.512 27.918 1.00 72.40 C ATOM 0 H TRP A 40 -8.536 -11.697 28.317 1.00 21.45 H new ATOM 0 HA TRP A 40 -9.282 -9.333 26.962 1.00 64.40 H new ATOM 0 HB2 TRP A 40 -8.334 -9.623 29.318 1.00 22.34 H new ATOM 0 HB3 TRP A 40 -6.762 -9.858 28.580 1.00 22.34 H new ATOM 0 HD1 TRP A 40 -5.384 -7.681 28.688 1.00 14.34 H new ATOM 0 HE1 TRP A 40 -5.841 -5.142 28.512 1.00 2.03 H new ATOM 0 HE3 TRP A 40 -10.445 -7.878 28.000 1.00 10.53 H new ATOM 0 HZ2 TRP A 40 -8.085 -3.487 28.131 1.00 13.34 H new ATOM 0 HZ3 TRP A 40 -11.684 -5.764 27.736 1.00 12.25 H new ATOM 0 HH2 TRP A 40 -10.517 -3.601 27.798 1.00 72.40 H new ATOM 651 N ALA A 41 -6.595 -10.871 25.874 1.00 22.20 N ATOM 652 CA ALA A 41 -5.632 -10.918 24.781 1.00 53.14 C ATOM 653 C ALA A 41 -6.342 -11.000 23.432 1.00 42.33 C ATOM 654 O ALA A 41 -5.763 -10.683 22.394 1.00 53.05 O ATOM 655 CB ALA A 41 -4.684 -12.095 24.959 1.00 23.01 C ATOM 0 H ALA A 41 -6.554 -11.669 26.507 1.00 22.20 H new ATOM 0 HA ALA A 41 -5.049 -9.997 24.800 1.00 53.14 H new ATOM 0 HB1 ALA A 41 -3.971 -12.116 24.135 1.00 23.01 H new ATOM 0 HB2 ALA A 41 -4.146 -11.990 25.901 1.00 23.01 H new ATOM 0 HB3 ALA A 41 -5.255 -13.024 24.969 1.00 23.01 H new ATOM 661 N GLN A 42 -7.604 -11.415 23.459 1.00 45.32 N ATOM 662 CA GLN A 42 -8.398 -11.526 22.244 1.00 24.31 C ATOM 663 C GLN A 42 -8.996 -10.170 21.875 1.00 23.11 C ATOM 664 O GLN A 42 -9.239 -9.886 20.702 1.00 73.11 O ATOM 665 CB GLN A 42 -9.501 -12.570 22.433 1.00 64.34 C ATOM 666 CG GLN A 42 -8.980 -13.911 22.927 1.00 12.21 C ATOM 667 CD GLN A 42 -9.680 -15.089 22.277 1.00 5.23 C ATOM 668 OE1 GLN A 42 -9.967 -16.118 23.066 1.00 75.14 O flip ATOM 669 NE2 GLN A 42 -9.961 -15.073 21.079 1.00 44.42 N flip ATOM 0 H GLN A 42 -8.098 -11.680 24.311 1.00 45.32 H new ATOM 0 HA GLN A 42 -7.752 -11.847 21.427 1.00 24.31 H new ATOM 0 HB2 GLN A 42 -10.235 -12.189 23.143 1.00 64.34 H new ATOM 0 HB3 GLN A 42 -10.020 -12.716 21.486 1.00 64.34 H new ATOM 0 HG2 GLN A 42 -7.910 -13.975 22.729 1.00 12.21 H new ATOM 0 HG3 GLN A 42 -9.108 -13.969 24.008 1.00 12.21 H new ATOM 0 HE21 GLN A 42 -9.722 -14.261 20.510 1.00 44.42 H new ATOM 0 HE22 GLN A 42 -10.433 -15.872 20.655 1.00 44.42 H new ATOM 678 N TRP A 43 -9.214 -9.331 22.885 1.00 55.12 N ATOM 679 CA TRP A 43 -9.764 -7.997 22.670 1.00 54.33 C ATOM 680 C TRP A 43 -8.656 -7.038 22.247 1.00 32.20 C ATOM 681 O TRP A 43 -8.769 -6.348 21.234 1.00 45.45 O ATOM 682 CB TRP A 43 -10.453 -7.490 23.943 1.00 21.24 C ATOM 683 CG TRP A 43 -10.626 -5.999 23.990 1.00 14.31 C ATOM 684 CD1 TRP A 43 -10.065 -5.140 24.891 1.00 42.10 C ATOM 685 CD2 TRP A 43 -11.405 -5.193 23.099 1.00 45.21 C ATOM 686 NE1 TRP A 43 -10.452 -3.851 24.618 1.00 3.05 N ATOM 687 CE2 TRP A 43 -11.276 -3.857 23.524 1.00 43.44 C ATOM 688 CE3 TRP A 43 -12.201 -5.470 21.983 1.00 21.12 C ATOM 689 CZ2 TRP A 43 -11.914 -2.804 22.876 1.00 41.34 C ATOM 690 CZ3 TRP A 43 -12.831 -4.422 21.339 1.00 23.33 C ATOM 691 CH2 TRP A 43 -12.686 -3.104 21.787 1.00 23.41 C ATOM 0 H TRP A 43 -9.018 -9.553 23.861 1.00 55.12 H new ATOM 0 HA TRP A 43 -10.507 -8.048 21.875 1.00 54.33 H new ATOM 0 HB2 TRP A 43 -11.432 -7.962 24.027 1.00 21.24 H new ATOM 0 HB3 TRP A 43 -9.872 -7.806 24.809 1.00 21.24 H new ATOM 0 HD1 TRP A 43 -9.412 -5.432 25.700 1.00 42.10 H new ATOM 0 HE1 TRP A 43 -10.171 -3.024 25.144 1.00 3.05 H new ATOM 0 HE3 TRP A 43 -12.321 -6.484 21.631 1.00 21.12 H new ATOM 0 HZ2 TRP A 43 -11.804 -1.786 23.220 1.00 41.34 H new ATOM 0 HZ3 TRP A 43 -13.446 -4.624 20.475 1.00 23.33 H new ATOM 0 HH2 TRP A 43 -13.194 -2.308 21.263 1.00 23.41 H new ATOM 702 N GLN A 44 -7.580 -7.003 23.033 1.00 51.52 N ATOM 703 CA GLN A 44 -6.445 -6.132 22.743 1.00 3.30 C ATOM 704 C GLN A 44 -6.017 -6.269 21.285 1.00 74.45 C ATOM 705 O GLN A 44 -5.737 -5.276 20.614 1.00 32.54 O ATOM 706 CB GLN A 44 -5.269 -6.464 23.661 1.00 73.54 C ATOM 707 CG GLN A 44 -5.616 -6.407 25.140 1.00 4.42 C ATOM 708 CD GLN A 44 -4.821 -5.352 25.887 1.00 41.44 C ATOM 709 OE1 GLN A 44 -5.496 -4.284 26.298 1.00 2.02 O flip ATOM 710 NE2 GLN A 44 -3.617 -5.495 26.092 1.00 2.33 N flip ATOM 0 H GLN A 44 -7.472 -7.568 23.875 1.00 51.52 H new ATOM 0 HA GLN A 44 -6.755 -5.102 22.921 1.00 3.30 H new ATOM 0 HB2 GLN A 44 -4.902 -7.462 23.421 1.00 73.54 H new ATOM 0 HB3 GLN A 44 -4.455 -5.768 23.460 1.00 73.54 H new ATOM 0 HG2 GLN A 44 -6.680 -6.201 25.252 1.00 4.42 H new ATOM 0 HG3 GLN A 44 -5.431 -7.382 25.590 1.00 4.42 H new ATOM 0 HE21 GLN A 44 -3.139 -6.332 25.758 1.00 2.33 H new ATOM 0 HE22 GLN A 44 -3.097 -4.777 26.596 1.00 2.33 H new ATOM 719 N HIS A 45 -5.981 -7.506 20.799 1.00 5.13 N ATOM 720 CA HIS A 45 -5.601 -7.770 19.418 1.00 12.51 C ATOM 721 C HIS A 45 -6.632 -7.172 18.466 1.00 52.13 C ATOM 722 O HIS A 45 -6.307 -6.779 17.346 1.00 22.04 O ATOM 723 CB HIS A 45 -5.467 -9.278 19.179 1.00 61.45 C ATOM 724 CG HIS A 45 -5.313 -9.646 17.735 1.00 44.53 C ATOM 725 ND1 HIS A 45 -4.091 -9.877 17.140 1.00 20.33 N ATOM 726 CD2 HIS A 45 -6.239 -9.817 16.763 1.00 31.41 C ATOM 727 CE1 HIS A 45 -4.269 -10.174 15.866 1.00 42.21 C ATOM 728 NE2 HIS A 45 -5.565 -10.144 15.612 1.00 45.21 N ATOM 0 H HIS A 45 -6.210 -8.339 21.341 1.00 5.13 H new ATOM 0 HA HIS A 45 -4.635 -7.303 19.227 1.00 12.51 H new ATOM 0 HB2 HIS A 45 -4.606 -9.650 19.734 1.00 61.45 H new ATOM 0 HB3 HIS A 45 -6.347 -9.781 19.581 1.00 61.45 H new ATOM 0 HD2 HIS A 45 -7.309 -9.715 16.872 1.00 31.41 H new ATOM 0 HE1 HIS A 45 -3.489 -10.402 15.154 1.00 42.21 H new ATOM 0 HE2 HIS A 45 -5.996 -10.333 14.707 1.00 45.21 H new ATOM 736 N LYS A 46 -7.876 -7.099 18.927 1.00 55.53 N ATOM 737 CA LYS A 46 -8.959 -6.537 18.131 1.00 40.11 C ATOM 738 C LYS A 46 -9.025 -5.023 18.310 1.00 73.41 C ATOM 739 O LYS A 46 -9.573 -4.311 17.472 1.00 51.20 O ATOM 740 CB LYS A 46 -10.293 -7.173 18.529 1.00 2.14 C ATOM 741 CG LYS A 46 -11.479 -6.655 17.732 1.00 34.23 C ATOM 742 CD LYS A 46 -12.012 -7.707 16.773 1.00 13.22 C ATOM 743 CE LYS A 46 -13.137 -7.156 15.911 1.00 12.15 C ATOM 744 NZ LYS A 46 -14.465 -7.319 16.564 1.00 74.13 N ATOM 0 H LYS A 46 -8.159 -7.424 19.852 1.00 55.53 H new ATOM 0 HA LYS A 46 -8.764 -6.754 17.081 1.00 40.11 H new ATOM 0 HB2 LYS A 46 -10.223 -8.253 18.399 1.00 2.14 H new ATOM 0 HB3 LYS A 46 -10.471 -6.990 19.589 1.00 2.14 H new ATOM 0 HG2 LYS A 46 -12.272 -6.350 18.415 1.00 34.23 H new ATOM 0 HG3 LYS A 46 -11.182 -5.768 17.172 1.00 34.23 H new ATOM 0 HD2 LYS A 46 -11.203 -8.062 16.134 1.00 13.22 H new ATOM 0 HD3 LYS A 46 -12.373 -8.567 17.338 1.00 13.22 H new ATOM 0 HE2 LYS A 46 -12.958 -6.100 15.711 1.00 12.15 H new ATOM 0 HE3 LYS A 46 -13.140 -7.667 14.948 1.00 12.15 H new ATOM 0 HZ1 LYS A 46 -15.206 -6.931 15.946 1.00 74.13 H new ATOM 0 HZ2 LYS A 46 -14.648 -8.329 16.732 1.00 74.13 H new ATOM 0 HZ3 LYS A 46 -14.470 -6.811 17.471 1.00 74.13 H new ATOM 758 N GLN A 47 -8.457 -4.535 19.408 1.00 52.34 N ATOM 759 CA GLN A 47 -8.447 -3.107 19.691 1.00 41.35 C ATOM 760 C GLN A 47 -7.545 -2.374 18.700 1.00 55.42 C ATOM 761 O GLN A 47 -7.926 -1.346 18.140 1.00 61.23 O ATOM 762 CB GLN A 47 -7.987 -2.864 21.137 1.00 50.34 C ATOM 763 CG GLN A 47 -7.388 -1.483 21.383 1.00 75.45 C ATOM 764 CD GLN A 47 -6.861 -1.299 22.798 1.00 54.04 C ATOM 765 OE1 GLN A 47 -7.469 -1.981 23.764 1.00 60.30 O flip ATOM 766 NE2 GLN A 47 -5.914 -0.546 23.020 1.00 24.34 N flip ATOM 0 H GLN A 47 -7.998 -5.109 20.116 1.00 52.34 H new ATOM 0 HA GLN A 47 -9.458 -2.715 19.579 1.00 41.35 H new ATOM 0 HB2 GLN A 47 -8.838 -3.002 21.804 1.00 50.34 H new ATOM 0 HB3 GLN A 47 -7.248 -3.620 21.402 1.00 50.34 H new ATOM 0 HG2 GLN A 47 -6.576 -1.316 20.676 1.00 75.45 H new ATOM 0 HG3 GLN A 47 -8.146 -0.725 21.183 1.00 75.45 H new ATOM 0 HE21 GLN A 47 -5.474 -0.040 22.252 1.00 24.34 H new ATOM 0 HE22 GLN A 47 -5.569 -0.428 23.973 1.00 24.34 H new ATOM 775 N THR A 48 -6.346 -2.908 18.498 1.00 2.31 N ATOM 776 CA THR A 48 -5.383 -2.304 17.582 1.00 41.14 C ATOM 777 C THR A 48 -5.951 -2.177 16.170 1.00 32.32 C ATOM 778 O THR A 48 -5.788 -1.143 15.523 1.00 11.51 O ATOM 779 CB THR A 48 -4.095 -3.128 17.547 1.00 74.14 C ATOM 780 OG1 THR A 48 -3.131 -2.518 16.707 1.00 65.15 O ATOM 781 CG2 THR A 48 -4.306 -4.542 17.053 1.00 22.44 C ATOM 0 H THR A 48 -6.017 -3.758 18.956 1.00 2.31 H new ATOM 0 HA THR A 48 -5.165 -1.302 17.951 1.00 41.14 H new ATOM 0 HB THR A 48 -3.748 -3.168 18.580 1.00 74.14 H new ATOM 0 HG1 THR A 48 -2.314 -3.060 16.699 1.00 65.15 H new ATOM 0 HG21 THR A 48 -3.354 -5.073 17.052 1.00 22.44 H new ATOM 0 HG22 THR A 48 -5.008 -5.056 17.710 1.00 22.44 H new ATOM 0 HG23 THR A 48 -4.708 -4.517 16.040 1.00 22.44 H new ATOM 789 N MET A 49 -6.602 -3.234 15.684 1.00 63.31 N ATOM 790 CA MET A 49 -7.168 -3.222 14.337 1.00 24.21 C ATOM 791 C MET A 49 -8.399 -2.323 14.249 1.00 40.42 C ATOM 792 O MET A 49 -8.559 -1.579 13.282 1.00 5.35 O ATOM 793 CB MET A 49 -7.521 -4.644 13.885 1.00 25.43 C ATOM 794 CG MET A 49 -8.270 -5.455 14.929 1.00 13.45 C ATOM 795 SD MET A 49 -9.375 -6.679 14.198 1.00 74.20 S ATOM 796 CE MET A 49 -8.199 -7.916 13.653 1.00 41.13 C ATOM 0 H MET A 49 -6.749 -4.102 16.199 1.00 63.31 H new ATOM 0 HA MET A 49 -6.408 -2.816 13.670 1.00 24.21 H new ATOM 0 HB2 MET A 49 -8.127 -4.587 12.980 1.00 25.43 H new ATOM 0 HB3 MET A 49 -6.603 -5.169 13.621 1.00 25.43 H new ATOM 0 HG2 MET A 49 -7.552 -5.960 15.575 1.00 13.45 H new ATOM 0 HG3 MET A 49 -8.848 -4.781 15.561 1.00 13.45 H new ATOM 0 HE1 MET A 49 -8.732 -8.740 13.179 1.00 41.13 H new ATOM 0 HE2 MET A 49 -7.508 -7.471 12.937 1.00 41.13 H new ATOM 0 HE3 MET A 49 -7.641 -8.291 14.511 1.00 41.13 H new ATOM 806 N LEU A 50 -9.265 -2.388 15.254 1.00 10.12 N ATOM 807 CA LEU A 50 -10.474 -1.570 15.263 1.00 72.50 C ATOM 808 C LEU A 50 -10.121 -0.089 15.172 1.00 24.05 C ATOM 809 O LEU A 50 -10.735 0.660 14.415 1.00 31.33 O ATOM 810 CB LEU A 50 -11.297 -1.834 16.528 1.00 35.02 C ATOM 811 CG LEU A 50 -12.070 -3.156 16.542 1.00 62.32 C ATOM 812 CD1 LEU A 50 -12.694 -3.393 17.908 1.00 23.33 C ATOM 813 CD2 LEU A 50 -13.138 -3.166 15.459 1.00 64.03 C ATOM 0 H LEU A 50 -9.155 -2.993 16.068 1.00 10.12 H new ATOM 0 HA LEU A 50 -11.072 -1.843 14.393 1.00 72.50 H new ATOM 0 HB2 LEU A 50 -10.627 -1.815 17.388 1.00 35.02 H new ATOM 0 HB3 LEU A 50 -12.006 -1.016 16.658 1.00 35.02 H new ATOM 0 HG LEU A 50 -11.368 -3.965 16.337 1.00 62.32 H new ATOM 0 HD11 LEU A 50 -13.239 -4.337 17.900 1.00 23.33 H new ATOM 0 HD12 LEU A 50 -11.910 -3.433 18.664 1.00 23.33 H new ATOM 0 HD13 LEU A 50 -13.381 -2.579 18.141 1.00 23.33 H new ATOM 0 HD21 LEU A 50 -13.675 -4.114 15.486 1.00 64.03 H new ATOM 0 HD22 LEU A 50 -13.837 -2.348 15.630 1.00 64.03 H new ATOM 0 HD23 LEU A 50 -12.668 -3.044 14.483 1.00 64.03 H new ATOM 825 N ILE A 51 -9.127 0.322 15.945 1.00 21.21 N ATOM 826 CA ILE A 51 -8.686 1.709 15.954 1.00 51.32 C ATOM 827 C ILE A 51 -8.064 2.093 14.614 1.00 51.43 C ATOM 828 O ILE A 51 -8.263 3.204 14.121 1.00 23.00 O ATOM 829 CB ILE A 51 -7.678 1.953 17.097 1.00 73.01 C ATOM 830 CG1 ILE A 51 -8.348 1.664 18.442 1.00 34.51 C ATOM 831 CG2 ILE A 51 -7.137 3.377 17.065 1.00 5.23 C ATOM 832 CD1 ILE A 51 -7.402 1.722 19.619 1.00 32.24 C ATOM 0 H ILE A 51 -8.608 -0.288 16.577 1.00 21.21 H new ATOM 0 HA ILE A 51 -9.561 2.337 16.120 1.00 51.32 H new ATOM 0 HB ILE A 51 -6.833 1.278 16.962 1.00 73.01 H new ATOM 0 HG12 ILE A 51 -9.152 2.383 18.599 1.00 34.51 H new ATOM 0 HG13 ILE A 51 -8.806 0.676 18.404 1.00 34.51 H new ATOM 0 HG21 ILE A 51 -6.430 3.516 17.883 1.00 5.23 H new ATOM 0 HG22 ILE A 51 -6.632 3.553 16.115 1.00 5.23 H new ATOM 0 HG23 ILE A 51 -7.961 4.082 17.174 1.00 5.23 H new ATOM 0 HD11 ILE A 51 -7.949 1.507 20.537 1.00 32.24 H new ATOM 0 HD12 ILE A 51 -6.611 0.984 19.487 1.00 32.24 H new ATOM 0 HD13 ILE A 51 -6.963 2.717 19.684 1.00 32.24 H new ATOM 844 N ASN A 52 -7.308 1.170 14.029 1.00 53.30 N ATOM 845 CA ASN A 52 -6.659 1.419 12.748 1.00 52.52 C ATOM 846 C ASN A 52 -7.655 1.325 11.594 1.00 23.31 C ATOM 847 O ASN A 52 -7.504 2.006 10.579 1.00 63.50 O ATOM 848 CB ASN A 52 -5.514 0.428 12.536 1.00 74.33 C ATOM 849 CG ASN A 52 -4.193 0.949 13.067 1.00 12.23 C ATOM 850 OD1 ASN A 52 -3.968 2.157 13.132 1.00 63.13 O ATOM 851 ND2 ASN A 52 -3.308 0.036 13.453 1.00 75.53 N ATOM 0 H ASN A 52 -7.130 0.245 14.421 1.00 53.30 H new ATOM 0 HA ASN A 52 -6.258 2.432 12.766 1.00 52.52 H new ATOM 0 HB2 ASN A 52 -5.755 -0.513 13.030 1.00 74.33 H new ATOM 0 HB3 ASN A 52 -5.415 0.213 11.472 1.00 74.33 H new ATOM 0 HD21 ASN A 52 -2.402 0.327 13.820 1.00 75.53 H new ATOM 0 HD22 ASN A 52 -3.535 -0.956 13.382 1.00 75.53 H new ATOM 858 N GLU A 53 -8.671 0.480 11.751 1.00 22.35 N ATOM 859 CA GLU A 53 -9.683 0.305 10.712 1.00 2.12 C ATOM 860 C GLU A 53 -10.784 1.354 10.842 1.00 0.01 C ATOM 861 O GLU A 53 -11.074 2.079 9.891 1.00 44.44 O ATOM 862 CB GLU A 53 -10.286 -1.101 10.786 1.00 54.44 C ATOM 863 CG GLU A 53 -10.483 -1.751 9.426 1.00 72.53 C ATOM 864 CD GLU A 53 -9.222 -1.741 8.584 1.00 60.14 C ATOM 865 OE1 GLU A 53 -8.240 -2.409 8.977 1.00 64.12 O ATOM 866 OE2 GLU A 53 -9.213 -1.068 7.533 1.00 3.25 O ATOM 0 H GLU A 53 -8.815 -0.092 12.583 1.00 22.35 H new ATOM 0 HA GLU A 53 -9.199 0.432 9.744 1.00 2.12 H new ATOM 0 HB2 GLU A 53 -9.637 -1.734 11.391 1.00 54.44 H new ATOM 0 HB3 GLU A 53 -11.247 -1.049 11.297 1.00 54.44 H new ATOM 0 HG2 GLU A 53 -10.814 -2.780 9.564 1.00 72.53 H new ATOM 0 HG3 GLU A 53 -11.277 -1.230 8.890 1.00 72.53 H new ATOM 873 N LYS A 54 -11.383 1.441 12.026 1.00 2.21 N ATOM 874 CA LYS A 54 -12.438 2.419 12.270 1.00 51.31 C ATOM 875 C LYS A 54 -11.848 3.819 12.422 1.00 13.10 C ATOM 876 O LYS A 54 -12.580 4.808 12.472 1.00 20.24 O ATOM 877 CB LYS A 54 -13.236 2.056 13.527 1.00 24.31 C ATOM 878 CG LYS A 54 -14.260 0.955 13.303 1.00 71.11 C ATOM 879 CD LYS A 54 -13.635 -0.426 13.423 1.00 44.52 C ATOM 880 CE LYS A 54 -14.036 -1.325 12.264 1.00 52.22 C ATOM 881 NZ LYS A 54 -15.516 -1.452 12.145 1.00 54.31 N ATOM 0 H LYS A 54 -11.158 0.850 12.827 1.00 2.21 H new ATOM 0 HA LYS A 54 -13.110 2.408 11.412 1.00 51.31 H new ATOM 0 HB2 LYS A 54 -12.544 1.743 14.308 1.00 24.31 H new ATOM 0 HB3 LYS A 54 -13.747 2.947 13.892 1.00 24.31 H new ATOM 0 HG2 LYS A 54 -15.066 1.054 14.030 1.00 71.11 H new ATOM 0 HG3 LYS A 54 -14.706 1.068 12.315 1.00 71.11 H new ATOM 0 HD2 LYS A 54 -12.549 -0.333 13.453 1.00 44.52 H new ATOM 0 HD3 LYS A 54 -13.942 -0.885 14.363 1.00 44.52 H new ATOM 0 HE2 LYS A 54 -13.630 -0.923 11.336 1.00 52.22 H new ATOM 0 HE3 LYS A 54 -13.597 -2.313 12.402 1.00 52.22 H new ATOM 0 HZ1 LYS A 54 -15.749 -2.312 11.609 1.00 54.31 H new ATOM 0 HZ2 LYS A 54 -15.937 -1.511 13.094 1.00 54.31 H new ATOM 0 HZ3 LYS A 54 -15.897 -0.621 11.649 1.00 54.31 H new ATOM 895 N LYS A 55 -10.522 3.895 12.495 1.00 43.42 N ATOM 896 CA LYS A 55 -9.833 5.169 12.642 1.00 74.11 C ATOM 897 C LYS A 55 -10.213 5.843 13.957 1.00 31.21 C ATOM 898 O LYS A 55 -10.800 6.925 13.965 1.00 5.25 O ATOM 899 CB LYS A 55 -10.155 6.091 11.461 1.00 72.23 C ATOM 900 CG LYS A 55 -9.658 5.566 10.123 1.00 12.00 C ATOM 901 CD LYS A 55 -8.170 5.247 10.161 1.00 1.15 C ATOM 902 CE LYS A 55 -7.426 5.906 9.010 1.00 24.22 C ATOM 903 NZ LYS A 55 -6.053 6.326 9.404 1.00 61.25 N ATOM 0 H LYS A 55 -9.903 3.085 12.454 1.00 43.42 H new ATOM 0 HA LYS A 55 -8.760 4.975 12.653 1.00 74.11 H new ATOM 0 HB2 LYS A 55 -11.234 6.234 11.407 1.00 72.23 H new ATOM 0 HB3 LYS A 55 -9.712 7.070 11.644 1.00 72.23 H new ATOM 0 HG2 LYS A 55 -10.216 4.669 9.854 1.00 12.00 H new ATOM 0 HG3 LYS A 55 -9.852 6.306 9.347 1.00 12.00 H new ATOM 0 HD2 LYS A 55 -7.749 5.585 11.108 1.00 1.15 H new ATOM 0 HD3 LYS A 55 -8.028 4.167 10.116 1.00 1.15 H new ATOM 0 HE2 LYS A 55 -7.367 5.212 8.171 1.00 24.22 H new ATOM 0 HE3 LYS A 55 -7.987 6.775 8.666 1.00 24.22 H new ATOM 0 HZ1 LYS A 55 -5.579 6.771 8.592 1.00 61.25 H new ATOM 0 HZ2 LYS A 55 -6.110 7.008 10.187 1.00 61.25 H new ATOM 0 HZ3 LYS A 55 -5.509 5.493 9.708 1.00 61.25 H new ATOM 917 N LEU A 56 -9.867 5.198 15.066 1.00 30.41 N ATOM 918 CA LEU A 56 -10.161 5.739 16.385 1.00 52.41 C ATOM 919 C LEU A 56 -8.995 6.591 16.884 1.00 51.14 C ATOM 920 O LEU A 56 -8.029 6.818 16.158 1.00 44.51 O ATOM 921 CB LEU A 56 -10.450 4.601 17.371 1.00 75.54 C ATOM 922 CG LEU A 56 -11.751 3.834 17.107 1.00 34.35 C ATOM 923 CD1 LEU A 56 -11.942 2.737 18.143 1.00 32.03 C ATOM 924 CD2 LEU A 56 -12.942 4.784 17.103 1.00 14.14 C ATOM 0 H LEU A 56 -9.383 4.300 15.076 1.00 30.41 H new ATOM 0 HA LEU A 56 -11.045 6.372 16.313 1.00 52.41 H new ATOM 0 HB2 LEU A 56 -9.618 3.897 17.345 1.00 75.54 H new ATOM 0 HB3 LEU A 56 -10.487 5.014 18.379 1.00 75.54 H new ATOM 0 HG LEU A 56 -11.683 3.369 16.124 1.00 34.35 H new ATOM 0 HD11 LEU A 56 -12.870 2.203 17.940 1.00 32.03 H new ATOM 0 HD12 LEU A 56 -11.105 2.041 18.094 1.00 32.03 H new ATOM 0 HD13 LEU A 56 -11.988 3.180 19.138 1.00 32.03 H new ATOM 0 HD21 LEU A 56 -13.856 4.221 16.914 1.00 14.14 H new ATOM 0 HD22 LEU A 56 -13.015 5.280 18.071 1.00 14.14 H new ATOM 0 HD23 LEU A 56 -12.808 5.532 16.321 1.00 14.14 H new ATOM 936 N ASN A 57 -9.090 7.061 18.123 1.00 32.03 N ATOM 937 CA ASN A 57 -8.042 7.887 18.712 1.00 20.43 C ATOM 938 C ASN A 57 -8.015 7.735 20.232 1.00 1.23 C ATOM 939 O ASN A 57 -8.884 8.250 20.935 1.00 1.02 O ATOM 940 CB ASN A 57 -8.251 9.355 18.334 1.00 15.31 C ATOM 941 CG ASN A 57 -6.984 10.001 17.812 1.00 61.42 C ATOM 942 OD1 ASN A 57 -6.220 9.388 17.066 1.00 54.21 O ATOM 943 ND2 ASN A 57 -6.755 11.247 18.205 1.00 70.12 N ATOM 0 H ASN A 57 -9.883 6.884 18.740 1.00 32.03 H new ATOM 0 HA ASN A 57 -7.083 7.551 18.318 1.00 20.43 H new ATOM 0 HB2 ASN A 57 -9.031 9.425 17.576 1.00 15.31 H new ATOM 0 HB3 ASN A 57 -8.604 9.906 19.206 1.00 15.31 H new ATOM 0 HD21 ASN A 57 -5.918 11.736 17.888 1.00 70.12 H new ATOM 0 HD22 ASN A 57 -7.416 11.716 18.824 1.00 70.12 H new ATOM 950 N MET A 58 -7.010 7.022 20.729 1.00 5.10 N ATOM 951 CA MET A 58 -6.863 6.791 22.164 1.00 4.22 C ATOM 952 C MET A 58 -6.789 8.107 22.930 1.00 4.32 C ATOM 953 O MET A 58 -7.048 8.153 24.131 1.00 31.45 O ATOM 954 CB MET A 58 -5.616 5.945 22.460 1.00 30.22 C ATOM 955 CG MET A 58 -4.438 6.234 21.542 1.00 34.55 C ATOM 956 SD MET A 58 -4.060 4.860 20.435 1.00 24.45 S ATOM 957 CE MET A 58 -5.674 4.525 19.734 1.00 24.34 C ATOM 0 H MET A 58 -6.282 6.592 20.158 1.00 5.10 H new ATOM 0 HA MET A 58 -7.745 6.245 22.497 1.00 4.22 H new ATOM 0 HB2 MET A 58 -5.310 6.117 23.492 1.00 30.22 H new ATOM 0 HB3 MET A 58 -5.877 4.890 22.377 1.00 30.22 H new ATOM 0 HG2 MET A 58 -4.655 7.123 20.949 1.00 34.55 H new ATOM 0 HG3 MET A 58 -3.559 6.460 22.146 1.00 34.55 H new ATOM 0 HE1 MET A 58 -5.663 3.551 19.244 1.00 24.34 H new ATOM 0 HE2 MET A 58 -6.422 4.524 20.527 1.00 24.34 H new ATOM 0 HE3 MET A 58 -5.920 5.296 19.004 1.00 24.34 H new ATOM 967 N MET A 59 -6.437 9.178 22.234 1.00 1.01 N ATOM 968 CA MET A 59 -6.341 10.484 22.866 1.00 74.53 C ATOM 969 C MET A 59 -7.715 11.143 22.961 1.00 71.54 C ATOM 970 O MET A 59 -7.928 12.037 23.780 1.00 44.32 O ATOM 971 CB MET A 59 -5.375 11.382 22.088 1.00 2.02 C ATOM 972 CG MET A 59 -4.060 11.628 22.809 1.00 24.22 C ATOM 973 SD MET A 59 -4.089 13.125 23.813 1.00 11.43 S ATOM 974 CE MET A 59 -4.240 12.428 25.455 1.00 3.04 C ATOM 0 H MET A 59 -6.215 9.169 21.239 1.00 1.01 H new ATOM 0 HA MET A 59 -5.956 10.346 23.877 1.00 74.53 H new ATOM 0 HB2 MET A 59 -5.169 10.927 21.119 1.00 2.02 H new ATOM 0 HB3 MET A 59 -5.858 12.340 21.894 1.00 2.02 H new ATOM 0 HG2 MET A 59 -3.833 10.773 23.445 1.00 24.22 H new ATOM 0 HG3 MET A 59 -3.256 11.702 22.076 1.00 24.22 H new ATOM 0 HE1 MET A 59 -4.271 13.232 26.190 1.00 3.04 H new ATOM 0 HE2 MET A 59 -5.157 11.843 25.519 1.00 3.04 H new ATOM 0 HE3 MET A 59 -3.384 11.784 25.657 1.00 3.04 H new ATOM 984 N ASN A 60 -8.644 10.694 22.123 1.00 72.24 N ATOM 985 CA ASN A 60 -9.994 11.240 22.120 1.00 13.25 C ATOM 986 C ASN A 60 -10.930 10.375 22.958 1.00 2.34 C ATOM 987 O ASN A 60 -10.973 9.156 22.798 1.00 73.54 O ATOM 988 CB ASN A 60 -10.522 11.351 20.689 1.00 54.23 C ATOM 989 CG ASN A 60 -11.731 12.260 20.591 1.00 60.15 C ATOM 990 OD1 ASN A 60 -12.705 11.943 19.908 1.00 45.25 O ATOM 991 ND2 ASN A 60 -11.673 13.401 21.270 1.00 43.22 N ATOM 0 H ASN A 60 -8.486 9.954 21.439 1.00 72.24 H new ATOM 0 HA ASN A 60 -9.958 12.236 22.560 1.00 13.25 H new ATOM 0 HB2 ASN A 60 -9.732 11.730 20.041 1.00 54.23 H new ATOM 0 HB3 ASN A 60 -10.786 10.359 20.323 1.00 54.23 H new ATOM 0 HD21 ASN A 60 -12.456 14.054 21.238 1.00 43.22 H new ATOM 0 HD22 ASN A 60 -10.846 13.624 21.824 1.00 43.22 H new ATOM 998 N ALA A 61 -11.672 11.015 23.855 1.00 10.14 N ATOM 999 CA ALA A 61 -12.604 10.305 24.722 1.00 75.00 C ATOM 1000 C ALA A 61 -13.735 9.667 23.919 1.00 54.22 C ATOM 1001 O ALA A 61 -14.139 8.536 24.191 1.00 53.14 O ATOM 1002 CB ALA A 61 -13.168 11.251 25.772 1.00 34.33 C ATOM 0 H ALA A 61 -11.646 12.024 24.000 1.00 10.14 H new ATOM 0 HA ALA A 61 -12.057 9.505 25.221 1.00 75.00 H new ATOM 0 HB1 ALA A 61 -13.863 10.710 26.414 1.00 34.33 H new ATOM 0 HB2 ALA A 61 -12.354 11.652 26.376 1.00 34.33 H new ATOM 0 HB3 ALA A 61 -13.692 12.070 25.280 1.00 34.33 H new ATOM 1008 N GLU A 62 -14.241 10.399 22.932 1.00 55.43 N ATOM 1009 CA GLU A 62 -15.326 9.903 22.090 1.00 72.21 C ATOM 1010 C GLU A 62 -14.958 8.569 21.456 1.00 14.54 C ATOM 1011 O GLU A 62 -15.803 7.688 21.301 1.00 50.50 O ATOM 1012 CB GLU A 62 -15.649 10.921 20.995 1.00 2.31 C ATOM 1013 CG GLU A 62 -17.104 11.359 20.976 1.00 22.12 C ATOM 1014 CD GLU A 62 -18.021 10.304 20.388 1.00 43.31 C ATOM 1015 OE1 GLU A 62 -18.118 9.208 20.976 1.00 1.12 O ATOM 1016 OE2 GLU A 62 -18.640 10.576 19.337 1.00 50.21 O ATOM 0 H GLU A 62 -13.918 11.337 22.695 1.00 55.43 H new ATOM 0 HA GLU A 62 -16.203 9.757 22.720 1.00 72.21 H new ATOM 0 HB2 GLU A 62 -15.017 11.799 21.130 1.00 2.31 H new ATOM 0 HB3 GLU A 62 -15.396 10.491 20.026 1.00 2.31 H new ATOM 0 HG2 GLU A 62 -17.424 11.588 21.992 1.00 22.12 H new ATOM 0 HG3 GLU A 62 -17.196 12.278 20.398 1.00 22.12 H new ATOM 1023 N HIS A 63 -13.689 8.426 21.095 1.00 50.11 N ATOM 1024 CA HIS A 63 -13.208 7.198 20.485 1.00 60.41 C ATOM 1025 C HIS A 63 -12.830 6.180 21.550 1.00 12.50 C ATOM 1026 O HIS A 63 -13.048 4.980 21.380 1.00 40.22 O ATOM 1027 CB HIS A 63 -12.011 7.481 19.585 1.00 24.44 C ATOM 1028 CG HIS A 63 -12.355 8.271 18.362 1.00 10.20 C ATOM 1029 ND1 HIS A 63 -11.505 8.397 17.286 1.00 53.10 N ATOM 1030 CD2 HIS A 63 -13.468 8.976 18.044 1.00 33.45 C ATOM 1031 CE1 HIS A 63 -12.075 9.141 16.358 1.00 31.32 C ATOM 1032 NE2 HIS A 63 -13.267 9.506 16.792 1.00 33.54 N ATOM 0 H HIS A 63 -12.977 9.146 21.215 1.00 50.11 H new ATOM 0 HA HIS A 63 -14.013 6.784 19.878 1.00 60.41 H new ATOM 0 HB2 HIS A 63 -11.257 8.022 20.157 1.00 24.44 H new ATOM 0 HB3 HIS A 63 -11.563 6.535 19.282 1.00 24.44 H new ATOM 0 HD2 HIS A 63 -14.347 9.098 18.659 1.00 33.45 H new ATOM 0 HE1 HIS A 63 -11.641 9.406 15.405 1.00 31.32 H new ATOM 0 HE2 HIS A 63 -13.931 10.087 16.281 1.00 33.54 H new ATOM 1040 N ARG A 64 -12.266 6.663 22.655 1.00 13.31 N ATOM 1041 CA ARG A 64 -11.868 5.782 23.744 1.00 25.03 C ATOM 1042 C ARG A 64 -13.069 4.980 24.235 1.00 71.40 C ATOM 1043 O ARG A 64 -12.985 3.768 24.431 1.00 61.24 O ATOM 1044 CB ARG A 64 -11.264 6.583 24.901 1.00 40.44 C ATOM 1045 CG ARG A 64 -10.108 5.876 25.598 1.00 33.11 C ATOM 1046 CD ARG A 64 -8.886 5.800 24.700 1.00 61.24 C ATOM 1047 NE ARG A 64 -8.106 4.575 24.898 1.00 14.00 N ATOM 1048 CZ ARG A 64 -8.574 3.339 24.714 1.00 25.11 C ATOM 1049 NH1 ARG A 64 -9.839 3.135 24.372 1.00 63.42 N ATOM 1050 NH2 ARG A 64 -7.772 2.297 24.880 1.00 33.54 N ATOM 0 H ARG A 64 -12.077 7.652 22.817 1.00 13.31 H new ATOM 0 HA ARG A 64 -11.109 5.096 23.368 1.00 25.03 H new ATOM 0 HB2 ARG A 64 -10.915 7.544 24.523 1.00 40.44 H new ATOM 0 HB3 ARG A 64 -12.044 6.792 25.633 1.00 40.44 H new ATOM 0 HG2 ARG A 64 -9.855 6.406 26.516 1.00 33.11 H new ATOM 0 HG3 ARG A 64 -10.414 4.870 25.885 1.00 33.11 H new ATOM 0 HD2 ARG A 64 -9.203 5.858 23.659 1.00 61.24 H new ATOM 0 HD3 ARG A 64 -8.249 6.664 24.888 1.00 61.24 H new ATOM 0 HE ARG A 64 -7.136 4.674 25.198 1.00 14.00 H new ATOM 0 HH11 ARG A 64 -10.468 3.928 24.246 1.00 63.42 H new ATOM 0 HH12 ARG A 64 -10.183 2.185 24.235 1.00 63.42 H new ATOM 0 HH21 ARG A 64 -6.798 2.440 25.148 1.00 33.54 H new ATOM 0 HH22 ARG A 64 -8.128 1.352 24.740 1.00 33.54 H new ATOM 1064 N LYS A 65 -14.192 5.671 24.416 1.00 13.21 N ATOM 1065 CA LYS A 65 -15.423 5.034 24.867 1.00 31.33 C ATOM 1066 C LYS A 65 -16.042 4.210 23.740 1.00 61.24 C ATOM 1067 O LYS A 65 -16.870 3.334 23.982 1.00 33.24 O ATOM 1068 CB LYS A 65 -16.420 6.082 25.369 1.00 52.43 C ATOM 1069 CG LYS A 65 -16.945 7.007 24.283 1.00 2.34 C ATOM 1070 CD LYS A 65 -18.363 7.468 24.582 1.00 51.14 C ATOM 1071 CE LYS A 65 -18.390 8.509 25.692 1.00 42.14 C ATOM 1072 NZ LYS A 65 -19.162 9.721 25.298 1.00 60.30 N ATOM 0 H LYS A 65 -14.273 6.675 24.256 1.00 13.21 H new ATOM 0 HA LYS A 65 -15.180 4.366 25.693 1.00 31.33 H new ATOM 0 HB2 LYS A 65 -17.263 5.572 25.836 1.00 52.43 H new ATOM 0 HB3 LYS A 65 -15.942 6.682 26.143 1.00 52.43 H new ATOM 0 HG2 LYS A 65 -16.290 7.874 24.194 1.00 2.34 H new ATOM 0 HG3 LYS A 65 -16.924 6.492 23.323 1.00 2.34 H new ATOM 0 HD2 LYS A 65 -18.809 7.886 23.679 1.00 51.14 H new ATOM 0 HD3 LYS A 65 -18.972 6.611 24.871 1.00 51.14 H new ATOM 0 HE2 LYS A 65 -18.831 8.073 26.588 1.00 42.14 H new ATOM 0 HE3 LYS A 65 -17.369 8.795 25.946 1.00 42.14 H new ATOM 0 HZ1 LYS A 65 -19.157 10.406 26.081 1.00 60.30 H new ATOM 0 HZ2 LYS A 65 -18.726 10.152 24.458 1.00 60.30 H new ATOM 0 HZ3 LYS A 65 -20.143 9.452 25.080 1.00 60.30 H new ATOM 1086 N LEU A 66 -15.622 4.482 22.508 1.00 15.23 N ATOM 1087 CA LEU A 66 -16.127 3.744 21.361 1.00 65.44 C ATOM 1088 C LEU A 66 -15.541 2.339 21.364 1.00 64.34 C ATOM 1089 O LEU A 66 -16.228 1.363 21.066 1.00 43.34 O ATOM 1090 CB LEU A 66 -15.770 4.459 20.058 1.00 3.13 C ATOM 1091 CG LEU A 66 -16.885 4.481 19.008 1.00 44.22 C ATOM 1092 CD1 LEU A 66 -17.531 5.855 18.941 1.00 44.03 C ATOM 1093 CD2 LEU A 66 -16.343 4.076 17.645 1.00 64.02 C ATOM 0 H LEU A 66 -14.938 5.204 22.282 1.00 15.23 H new ATOM 0 HA LEU A 66 -17.213 3.685 21.431 1.00 65.44 H new ATOM 0 HB2 LEU A 66 -15.489 5.486 20.290 1.00 3.13 H new ATOM 0 HB3 LEU A 66 -14.893 3.978 19.625 1.00 3.13 H new ATOM 0 HG LEU A 66 -17.647 3.760 19.302 1.00 44.22 H new ATOM 0 HD11 LEU A 66 -18.320 5.850 18.189 1.00 44.03 H new ATOM 0 HD12 LEU A 66 -17.957 6.105 19.913 1.00 44.03 H new ATOM 0 HD13 LEU A 66 -16.780 6.598 18.673 1.00 44.03 H new ATOM 0 HD21 LEU A 66 -17.149 4.097 16.912 1.00 64.02 H new ATOM 0 HD22 LEU A 66 -15.560 4.772 17.344 1.00 64.02 H new ATOM 0 HD23 LEU A 66 -15.931 3.068 17.702 1.00 64.02 H new ATOM 1105 N LEU A 67 -14.264 2.250 21.723 1.00 63.34 N ATOM 1106 CA LEU A 67 -13.577 0.970 21.790 1.00 22.20 C ATOM 1107 C LEU A 67 -14.208 0.102 22.868 1.00 1.33 C ATOM 1108 O LEU A 67 -14.590 -1.041 22.620 1.00 4.11 O ATOM 1109 CB LEU A 67 -12.093 1.174 22.093 1.00 1.32 C ATOM 1110 CG LEU A 67 -11.177 0.057 21.600 1.00 21.52 C ATOM 1111 CD1 LEU A 67 -10.547 0.427 20.268 1.00 44.30 C ATOM 1112 CD2 LEU A 67 -10.108 -0.248 22.639 1.00 25.32 C ATOM 0 H LEU A 67 -13.685 3.052 21.972 1.00 63.34 H new ATOM 0 HA LEU A 67 -13.671 0.473 20.824 1.00 22.20 H new ATOM 0 HB2 LEU A 67 -11.771 2.113 21.643 1.00 1.32 H new ATOM 0 HB3 LEU A 67 -11.968 1.277 23.171 1.00 1.32 H new ATOM 0 HG LEU A 67 -11.776 -0.841 21.450 1.00 21.52 H new ATOM 0 HD11 LEU A 67 -9.898 -0.383 19.935 1.00 44.30 H new ATOM 0 HD12 LEU A 67 -11.330 0.592 19.528 1.00 44.30 H new ATOM 0 HD13 LEU A 67 -9.960 1.338 20.384 1.00 44.30 H new ATOM 0 HD21 LEU A 67 -9.462 -1.047 22.273 1.00 25.32 H new ATOM 0 HD22 LEU A 67 -9.512 0.646 22.821 1.00 25.32 H new ATOM 0 HD23 LEU A 67 -10.583 -0.562 23.568 1.00 25.32 H new ATOM 1124 N GLU A 68 -14.328 0.666 24.069 1.00 45.01 N ATOM 1125 CA GLU A 68 -14.931 -0.045 25.188 1.00 31.11 C ATOM 1126 C GLU A 68 -16.336 -0.518 24.814 1.00 33.44 C ATOM 1127 O GLU A 68 -16.849 -1.486 25.374 1.00 63.34 O ATOM 1128 CB GLU A 68 -14.967 0.854 26.434 1.00 31.53 C ATOM 1129 CG GLU A 68 -16.216 1.715 26.550 1.00 52.31 C ATOM 1130 CD GLU A 68 -16.040 2.865 27.523 1.00 75.24 C ATOM 1131 OE1 GLU A 68 -14.893 3.113 27.952 1.00 41.25 O ATOM 1132 OE2 GLU A 68 -17.051 3.519 27.856 1.00 60.33 O ATOM 0 H GLU A 68 -14.015 1.612 24.289 1.00 45.01 H new ATOM 0 HA GLU A 68 -14.325 -0.921 25.420 1.00 31.11 H new ATOM 0 HB2 GLU A 68 -14.889 0.227 27.322 1.00 31.53 H new ATOM 0 HB3 GLU A 68 -14.092 1.504 26.424 1.00 31.53 H new ATOM 0 HG2 GLU A 68 -16.473 2.111 25.567 1.00 52.31 H new ATOM 0 HG3 GLU A 68 -17.052 1.095 26.873 1.00 52.31 H new ATOM 1139 N GLN A 69 -16.942 0.173 23.849 1.00 45.54 N ATOM 1140 CA GLN A 69 -18.275 -0.172 23.380 1.00 31.33 C ATOM 1141 C GLN A 69 -18.244 -1.476 22.594 1.00 54.04 C ATOM 1142 O GLN A 69 -19.101 -2.342 22.774 1.00 73.31 O ATOM 1143 CB GLN A 69 -18.835 0.950 22.500 1.00 42.43 C ATOM 1144 CG GLN A 69 -20.343 0.886 22.328 1.00 52.05 C ATOM 1145 CD GLN A 69 -21.077 0.848 23.653 1.00 70.01 C ATOM 1146 OE1 GLN A 69 -20.881 1.708 24.510 1.00 75.11 O ATOM 1147 NE2 GLN A 69 -21.930 -0.156 23.828 1.00 70.13 N ATOM 0 H GLN A 69 -16.526 0.977 23.378 1.00 45.54 H new ATOM 0 HA GLN A 69 -18.921 -0.300 24.249 1.00 31.33 H new ATOM 0 HB2 GLN A 69 -18.567 1.912 22.937 1.00 42.43 H new ATOM 0 HB3 GLN A 69 -18.362 0.902 21.519 1.00 42.43 H new ATOM 0 HG2 GLN A 69 -20.677 1.751 21.756 1.00 52.05 H new ATOM 0 HG3 GLN A 69 -20.602 0.001 21.747 1.00 52.05 H new ATOM 0 HE21 GLN A 69 -22.062 -0.848 23.090 1.00 70.13 H new ATOM 0 HE22 GLN A 69 -22.453 -0.235 24.700 1.00 70.13 H new ATOM 1156 N GLU A 70 -17.247 -1.610 21.726 1.00 3.11 N ATOM 1157 CA GLU A 70 -17.100 -2.811 20.916 1.00 33.15 C ATOM 1158 C GLU A 70 -16.617 -3.978 21.768 1.00 4.01 C ATOM 1159 O GLU A 70 -17.062 -5.113 21.593 1.00 44.01 O ATOM 1160 CB GLU A 70 -16.128 -2.560 19.762 1.00 60.04 C ATOM 1161 CG GLU A 70 -16.608 -1.495 18.788 1.00 12.23 C ATOM 1162 CD GLU A 70 -17.575 -2.041 17.757 1.00 62.35 C ATOM 1163 OE1 GLU A 70 -17.508 -3.253 17.463 1.00 22.20 O ATOM 1164 OE2 GLU A 70 -18.401 -1.257 17.241 1.00 42.42 O ATOM 0 H GLU A 70 -16.530 -0.902 21.566 1.00 3.11 H new ATOM 0 HA GLU A 70 -18.076 -3.066 20.502 1.00 33.15 H new ATOM 0 HB2 GLU A 70 -15.162 -2.261 20.169 1.00 60.04 H new ATOM 0 HB3 GLU A 70 -15.970 -3.493 19.220 1.00 60.04 H new ATOM 0 HG2 GLU A 70 -17.091 -0.691 19.344 1.00 12.23 H new ATOM 0 HG3 GLU A 70 -15.748 -1.059 18.279 1.00 12.23 H new ATOM 1171 N MET A 71 -15.705 -3.694 22.697 1.00 72.11 N ATOM 1172 CA MET A 71 -15.169 -4.728 23.576 1.00 42.11 C ATOM 1173 C MET A 71 -16.298 -5.533 24.223 1.00 0.22 C ATOM 1174 O MET A 71 -16.184 -6.745 24.395 1.00 15.12 O ATOM 1175 CB MET A 71 -14.249 -4.104 24.638 1.00 44.14 C ATOM 1176 CG MET A 71 -14.796 -4.137 26.058 1.00 2.34 C ATOM 1177 SD MET A 71 -13.593 -3.561 27.268 1.00 23.31 S ATOM 1178 CE MET A 71 -14.426 -2.109 27.899 1.00 23.35 C ATOM 0 H MET A 71 -15.325 -2.761 22.859 1.00 72.11 H new ATOM 0 HA MET A 71 -14.575 -5.418 22.977 1.00 42.11 H new ATOM 0 HB2 MET A 71 -13.292 -4.625 24.621 1.00 44.14 H new ATOM 0 HB3 MET A 71 -14.052 -3.068 24.364 1.00 44.14 H new ATOM 0 HG2 MET A 71 -15.691 -3.517 26.115 1.00 2.34 H new ATOM 0 HG3 MET A 71 -15.098 -5.155 26.305 1.00 2.34 H new ATOM 0 HE1 MET A 71 -14.001 -1.217 27.439 1.00 23.35 H new ATOM 0 HE2 MET A 71 -15.489 -2.168 27.663 1.00 23.35 H new ATOM 0 HE3 MET A 71 -14.297 -2.056 28.980 1.00 23.35 H new ATOM 1188 N VAL A 72 -17.393 -4.855 24.567 1.00 73.42 N ATOM 1189 CA VAL A 72 -18.538 -5.523 25.178 1.00 11.44 C ATOM 1190 C VAL A 72 -19.103 -6.568 24.229 1.00 55.10 C ATOM 1191 O VAL A 72 -19.121 -7.758 24.535 1.00 31.33 O ATOM 1192 CB VAL A 72 -19.653 -4.521 25.549 1.00 43.11 C ATOM 1193 CG1 VAL A 72 -20.896 -5.240 26.070 1.00 1.44 C ATOM 1194 CG2 VAL A 72 -19.140 -3.524 26.571 1.00 54.21 C ATOM 0 H VAL A 72 -17.510 -3.851 24.433 1.00 73.42 H new ATOM 0 HA VAL A 72 -18.186 -6.001 26.092 1.00 11.44 H new ATOM 0 HB VAL A 72 -19.940 -3.982 24.646 1.00 43.11 H new ATOM 0 HG11 VAL A 72 -21.662 -4.506 26.322 1.00 1.44 H new ATOM 0 HG12 VAL A 72 -21.277 -5.912 25.301 1.00 1.44 H new ATOM 0 HG13 VAL A 72 -20.638 -5.815 26.959 1.00 1.44 H new ATOM 0 HG21 VAL A 72 -19.934 -2.822 26.825 1.00 54.21 H new ATOM 0 HG22 VAL A 72 -18.823 -4.054 27.469 1.00 54.21 H new ATOM 0 HG23 VAL A 72 -18.294 -2.978 26.154 1.00 54.21 H new ATOM 1204 N ASN A 73 -19.548 -6.112 23.065 1.00 64.34 N ATOM 1205 CA ASN A 73 -20.102 -7.008 22.053 1.00 33.53 C ATOM 1206 C ASN A 73 -19.160 -8.186 21.788 1.00 45.13 C ATOM 1207 O ASN A 73 -19.572 -9.212 21.245 1.00 11.01 O ATOM 1208 CB ASN A 73 -20.366 -6.244 20.753 1.00 64.34 C ATOM 1209 CG ASN A 73 -21.764 -6.488 20.213 1.00 32.25 C ATOM 1210 OD1 ASN A 73 -22.436 -7.443 20.607 1.00 4.54 O ATOM 1211 ND2 ASN A 73 -22.209 -5.625 19.308 1.00 43.31 N ATOM 0 H ASN A 73 -19.537 -5.128 22.797 1.00 64.34 H new ATOM 0 HA ASN A 73 -21.045 -7.402 22.431 1.00 33.53 H new ATOM 0 HB2 ASN A 73 -20.228 -5.177 20.927 1.00 64.34 H new ATOM 0 HB3 ASN A 73 -19.633 -6.542 20.004 1.00 64.34 H new ATOM 0 HD21 ASN A 73 -23.141 -5.739 18.910 1.00 43.31 H new ATOM 0 HD22 ASN A 73 -21.619 -4.848 19.010 1.00 43.31 H new ATOM 1218 N PHE A 74 -17.895 -8.028 22.168 1.00 74.22 N ATOM 1219 CA PHE A 74 -16.899 -9.070 21.974 1.00 43.41 C ATOM 1220 C PHE A 74 -16.748 -9.933 23.226 1.00 53.44 C ATOM 1221 O PHE A 74 -16.780 -11.160 23.149 1.00 24.31 O ATOM 1222 CB PHE A 74 -15.550 -8.442 21.613 1.00 54.04 C ATOM 1223 CG PHE A 74 -14.586 -9.406 20.986 1.00 3.15 C ATOM 1224 CD1 PHE A 74 -14.774 -9.849 19.686 1.00 73.25 C ATOM 1225 CD2 PHE A 74 -13.489 -9.869 21.693 1.00 23.30 C ATOM 1226 CE1 PHE A 74 -13.886 -10.735 19.105 1.00 32.35 C ATOM 1227 CE2 PHE A 74 -12.599 -10.755 21.118 1.00 1.20 C ATOM 1228 CZ PHE A 74 -12.797 -11.188 19.823 1.00 14.42 C ATOM 0 H PHE A 74 -17.537 -7.183 22.614 1.00 74.22 H new ATOM 0 HA PHE A 74 -17.235 -9.710 21.158 1.00 43.41 H new ATOM 0 HB2 PHE A 74 -15.717 -7.611 20.927 1.00 54.04 H new ATOM 0 HB3 PHE A 74 -15.100 -8.026 22.514 1.00 54.04 H new ATOM 0 HD1 PHE A 74 -15.624 -9.498 19.120 1.00 73.25 H new ATOM 0 HD2 PHE A 74 -13.327 -9.533 22.707 1.00 23.30 H new ATOM 0 HE1 PHE A 74 -14.044 -11.072 18.091 1.00 32.35 H new ATOM 0 HE2 PHE A 74 -11.748 -11.109 21.682 1.00 1.20 H new ATOM 0 HZ PHE A 74 -12.101 -11.880 19.372 1.00 14.42 H new ATOM 1238 N LEU A 75 -16.565 -9.286 24.376 1.00 52.12 N ATOM 1239 CA LEU A 75 -16.383 -9.999 25.640 1.00 13.42 C ATOM 1240 C LEU A 75 -17.645 -9.982 26.506 1.00 31.53 C ATOM 1241 O LEU A 75 -18.064 -11.016 27.026 1.00 14.55 O ATOM 1242 CB LEU A 75 -15.217 -9.383 26.419 1.00 43.21 C ATOM 1243 CG LEU A 75 -13.988 -9.030 25.573 1.00 43.31 C ATOM 1244 CD1 LEU A 75 -13.574 -7.582 25.799 1.00 63.10 C ATOM 1245 CD2 LEU A 75 -12.833 -9.975 25.882 1.00 74.13 C ATOM 0 H LEU A 75 -16.539 -8.270 24.459 1.00 52.12 H new ATOM 0 HA LEU A 75 -16.166 -11.039 25.397 1.00 13.42 H new ATOM 0 HB2 LEU A 75 -15.569 -8.479 26.916 1.00 43.21 H new ATOM 0 HB3 LEU A 75 -14.914 -10.079 27.201 1.00 43.21 H new ATOM 0 HG LEU A 75 -14.253 -9.147 24.522 1.00 43.31 H new ATOM 0 HD11 LEU A 75 -12.700 -7.354 25.189 1.00 63.10 H new ATOM 0 HD12 LEU A 75 -14.394 -6.921 25.519 1.00 63.10 H new ATOM 0 HD13 LEU A 75 -13.331 -7.433 26.851 1.00 63.10 H new ATOM 0 HD21 LEU A 75 -11.971 -9.708 25.271 1.00 74.13 H new ATOM 0 HD22 LEU A 75 -12.570 -9.895 26.937 1.00 74.13 H new ATOM 0 HD23 LEU A 75 -13.132 -10.999 25.659 1.00 74.13 H new ATOM 1257 N PHE A 76 -18.231 -8.801 26.675 1.00 73.34 N ATOM 1258 CA PHE A 76 -19.433 -8.643 27.499 1.00 61.03 C ATOM 1259 C PHE A 76 -20.705 -8.725 26.674 1.00 53.21 C ATOM 1260 O PHE A 76 -21.721 -8.123 27.017 1.00 1.11 O ATOM 1261 CB PHE A 76 -19.402 -7.308 28.203 1.00 51.14 C ATOM 1262 CG PHE A 76 -18.228 -7.155 29.105 1.00 33.21 C ATOM 1263 CD1 PHE A 76 -18.006 -8.064 30.124 1.00 44.41 C ATOM 1264 CD2 PHE A 76 -17.341 -6.110 28.930 1.00 2.43 C ATOM 1265 CE1 PHE A 76 -16.917 -7.934 30.954 1.00 73.25 C ATOM 1266 CE2 PHE A 76 -16.248 -5.974 29.760 1.00 14.30 C ATOM 1267 CZ PHE A 76 -16.040 -6.889 30.772 1.00 10.35 C ATOM 0 H PHE A 76 -17.895 -7.935 26.253 1.00 73.34 H new ATOM 0 HA PHE A 76 -19.436 -9.459 28.221 1.00 61.03 H new ATOM 0 HB2 PHE A 76 -19.388 -6.511 27.459 1.00 51.14 H new ATOM 0 HB3 PHE A 76 -20.317 -7.187 28.783 1.00 51.14 H new ATOM 0 HD1 PHE A 76 -18.694 -8.883 30.269 1.00 44.41 H new ATOM 0 HD2 PHE A 76 -17.505 -5.395 28.138 1.00 2.43 H new ATOM 0 HE1 PHE A 76 -16.751 -8.649 31.746 1.00 73.25 H new ATOM 0 HE2 PHE A 76 -15.558 -5.155 29.619 1.00 14.30 H new ATOM 0 HZ PHE A 76 -15.185 -6.785 31.424 1.00 10.35 H new ATOM 1277 N GLU A 77 -20.634 -9.460 25.589 1.00 54.11 N ATOM 1278 CA GLU A 77 -21.761 -9.632 24.686 1.00 1.24 C ATOM 1279 C GLU A 77 -22.881 -10.416 25.361 1.00 64.35 C ATOM 1280 O GLU A 77 -23.269 -11.491 24.905 1.00 22.34 O ATOM 1281 CB GLU A 77 -21.308 -10.359 23.421 1.00 71.23 C ATOM 1282 CG GLU A 77 -22.310 -10.283 22.281 1.00 55.43 C ATOM 1283 CD GLU A 77 -22.153 -11.421 21.292 1.00 0.31 C ATOM 1284 OE1 GLU A 77 -21.063 -12.030 21.257 1.00 30.04 O ATOM 1285 OE2 GLU A 77 -23.119 -11.705 20.555 1.00 31.00 O ATOM 0 H GLU A 77 -19.792 -9.960 25.302 1.00 54.11 H new ATOM 0 HA GLU A 77 -22.142 -8.646 24.420 1.00 1.24 H new ATOM 0 HB2 GLU A 77 -20.360 -9.935 23.089 1.00 71.23 H new ATOM 0 HB3 GLU A 77 -21.123 -11.406 23.661 1.00 71.23 H new ATOM 0 HG2 GLU A 77 -23.321 -10.297 22.689 1.00 55.43 H new ATOM 0 HG3 GLU A 77 -22.190 -9.334 21.759 1.00 55.43 H new ATOM 1292 N GLY A 78 -23.390 -9.868 26.453 1.00 23.53 N ATOM 1293 CA GLY A 78 -24.456 -10.524 27.180 1.00 62.55 C ATOM 1294 C GLY A 78 -25.080 -9.634 28.236 1.00 72.21 C ATOM 1295 O GLY A 78 -26.286 -9.699 28.476 1.00 64.15 O ATOM 0 H GLY A 78 -23.084 -8.980 26.849 1.00 23.53 H new ATOM 0 HA2 GLY A 78 -25.227 -10.842 26.478 1.00 62.55 H new ATOM 0 HA3 GLY A 78 -24.066 -11.424 27.654 1.00 62.55 H new ATOM 1299 N LYS A 79 -24.261 -8.805 28.876 1.00 32.33 N ATOM 1300 CA LYS A 79 -24.754 -7.906 29.915 1.00 32.52 C ATOM 1301 C LYS A 79 -25.293 -6.607 29.318 1.00 51.14 C ATOM 1302 O LYS A 79 -26.106 -5.922 29.937 1.00 73.20 O ATOM 1303 CB LYS A 79 -23.647 -7.599 30.927 1.00 2.30 C ATOM 1304 CG LYS A 79 -24.137 -7.573 32.367 1.00 54.35 C ATOM 1305 CD LYS A 79 -23.415 -8.600 33.224 1.00 61.23 C ATOM 1306 CE LYS A 79 -21.943 -8.256 33.387 1.00 14.24 C ATOM 1307 NZ LYS A 79 -21.612 -7.889 34.791 1.00 33.31 N ATOM 0 H LYS A 79 -23.259 -8.737 28.695 1.00 32.33 H new ATOM 0 HA LYS A 79 -25.574 -8.410 30.426 1.00 32.52 H new ATOM 0 HB2 LYS A 79 -22.860 -8.347 30.832 1.00 2.30 H new ATOM 0 HB3 LYS A 79 -23.201 -6.634 30.685 1.00 2.30 H new ATOM 0 HG2 LYS A 79 -23.985 -6.578 32.785 1.00 54.35 H new ATOM 0 HG3 LYS A 79 -25.209 -7.768 32.390 1.00 54.35 H new ATOM 0 HD2 LYS A 79 -23.888 -8.654 34.205 1.00 61.23 H new ATOM 0 HD3 LYS A 79 -23.511 -9.586 32.770 1.00 61.23 H new ATOM 0 HE2 LYS A 79 -21.335 -9.107 33.081 1.00 14.24 H new ATOM 0 HE3 LYS A 79 -21.688 -7.428 32.725 1.00 14.24 H new ATOM 0 HZ1 LYS A 79 -20.600 -7.661 34.861 1.00 33.31 H new ATOM 0 HZ2 LYS A 79 -22.173 -7.061 35.075 1.00 33.31 H new ATOM 0 HZ3 LYS A 79 -21.831 -8.688 35.420 1.00 33.31 H new ATOM 1321 N GLU A 80 -24.838 -6.276 28.112 1.00 54.33 N ATOM 1322 CA GLU A 80 -25.283 -5.061 27.434 1.00 42.52 C ATOM 1323 C GLU A 80 -24.852 -3.813 28.200 1.00 1.35 C ATOM 1324 O GLU A 80 -25.611 -3.275 29.005 1.00 50.30 O ATOM 1325 CB GLU A 80 -26.804 -5.070 27.270 1.00 72.03 C ATOM 1326 CG GLU A 80 -27.334 -6.307 26.561 1.00 31.34 C ATOM 1327 CD GLU A 80 -28.099 -5.977 25.294 1.00 54.44 C ATOM 1328 OE1 GLU A 80 -27.941 -4.850 24.778 1.00 51.11 O ATOM 1329 OE2 GLU A 80 -28.858 -6.847 24.816 1.00 30.25 O ATOM 0 H GLU A 80 -24.163 -6.830 27.585 1.00 54.33 H new ATOM 0 HA GLU A 80 -24.816 -5.038 26.449 1.00 42.52 H new ATOM 0 HB2 GLU A 80 -27.267 -4.999 28.254 1.00 72.03 H new ATOM 0 HB3 GLU A 80 -27.106 -4.184 26.711 1.00 72.03 H new ATOM 0 HG2 GLU A 80 -26.500 -6.964 26.315 1.00 31.34 H new ATOM 0 HG3 GLU A 80 -27.985 -6.858 27.240 1.00 31.34 H new ATOM 1336 N VAL A 81 -23.630 -3.357 27.942 1.00 1.11 N ATOM 1337 CA VAL A 81 -23.099 -2.178 28.598 1.00 33.02 C ATOM 1338 C VAL A 81 -23.272 -0.940 27.723 1.00 43.32 C ATOM 1339 O VAL A 81 -22.460 -0.679 26.835 1.00 70.23 O ATOM 1340 CB VAL A 81 -21.608 -2.356 28.924 1.00 62.31 C ATOM 1341 CG1 VAL A 81 -21.122 -1.215 29.789 1.00 44.42 C ATOM 1342 CG2 VAL A 81 -21.362 -3.695 29.603 1.00 2.11 C ATOM 0 H VAL A 81 -22.989 -3.793 27.278 1.00 1.11 H new ATOM 0 HA VAL A 81 -23.658 -2.044 29.524 1.00 33.02 H new ATOM 0 HB VAL A 81 -21.044 -2.345 27.991 1.00 62.31 H new ATOM 0 HG11 VAL A 81 -20.064 -1.353 30.013 1.00 44.42 H new ATOM 0 HG12 VAL A 81 -21.261 -0.272 29.260 1.00 44.42 H new ATOM 0 HG13 VAL A 81 -21.690 -1.196 30.719 1.00 44.42 H new ATOM 0 HG21 VAL A 81 -20.300 -3.801 29.825 1.00 2.11 H new ATOM 0 HG22 VAL A 81 -21.933 -3.743 30.530 1.00 2.11 H new ATOM 0 HG23 VAL A 81 -21.676 -4.502 28.941 1.00 2.11 H new ATOM 1352 N HIS A 82 -24.333 -0.185 27.977 1.00 1.34 N ATOM 1353 CA HIS A 82 -24.613 1.022 27.208 1.00 24.43 C ATOM 1354 C HIS A 82 -23.924 2.236 27.822 1.00 41.42 C ATOM 1355 O HIS A 82 -23.302 2.142 28.880 1.00 1.31 O ATOM 1356 CB HIS A 82 -26.122 1.264 27.131 1.00 12.43 C ATOM 1357 CG HIS A 82 -26.882 0.122 26.531 1.00 72.21 C ATOM 1358 ND1 HIS A 82 -28.128 0.265 25.960 1.00 25.14 N ATOM 1359 CD2 HIS A 82 -26.566 -1.191 26.415 1.00 64.43 C ATOM 1360 CE1 HIS A 82 -28.548 -0.908 25.520 1.00 2.20 C ATOM 1361 NE2 HIS A 82 -27.618 -1.807 25.781 1.00 45.11 N ATOM 0 H HIS A 82 -25.014 -0.386 28.709 1.00 1.34 H new ATOM 0 HA HIS A 82 -24.221 0.877 26.201 1.00 24.43 H new ATOM 0 HB2 HIS A 82 -26.503 1.456 28.134 1.00 12.43 H new ATOM 0 HB3 HIS A 82 -26.308 2.162 26.543 1.00 12.43 H new ATOM 0 HD1 HIS A 82 -28.646 1.141 25.888 1.00 25.14 H new ATOM 0 HD2 HIS A 82 -25.657 -1.664 26.757 1.00 64.43 H new ATOM 0 HE1 HIS A 82 -29.492 -1.098 25.030 1.00 2.20 H new ATOM 1369 N ILE A 83 -24.043 3.376 27.150 1.00 41.44 N ATOM 1370 CA ILE A 83 -23.437 4.613 27.626 1.00 51.00 C ATOM 1371 C ILE A 83 -24.368 5.339 28.593 1.00 64.22 C ATOM 1372 O ILE A 83 -25.589 5.283 28.451 1.00 51.35 O ATOM 1373 CB ILE A 83 -23.087 5.555 26.456 1.00 32.41 C ATOM 1374 CG1 ILE A 83 -22.348 4.785 25.357 1.00 3.23 C ATOM 1375 CG2 ILE A 83 -22.247 6.726 26.947 1.00 53.41 C ATOM 1376 CD1 ILE A 83 -23.181 4.560 24.114 1.00 15.41 C ATOM 0 H ILE A 83 -24.555 3.468 26.272 1.00 41.44 H new ATOM 0 HA ILE A 83 -22.518 4.340 28.145 1.00 51.00 H new ATOM 0 HB ILE A 83 -24.013 5.950 26.039 1.00 32.41 H new ATOM 0 HG12 ILE A 83 -21.445 5.332 25.086 1.00 3.23 H new ATOM 0 HG13 ILE A 83 -22.030 3.820 25.751 1.00 3.23 H new ATOM 0 HG21 ILE A 83 -22.009 7.380 26.108 1.00 53.41 H new ATOM 0 HG22 ILE A 83 -22.806 7.286 27.697 1.00 53.41 H new ATOM 0 HG23 ILE A 83 -21.323 6.351 27.388 1.00 53.41 H new ATOM 0 HD11 ILE A 83 -22.595 4.009 23.378 1.00 15.41 H new ATOM 0 HD12 ILE A 83 -24.072 3.987 24.372 1.00 15.41 H new ATOM 0 HD13 ILE A 83 -23.477 5.522 23.696 1.00 15.41 H new ATOM 1388 N GLU A 84 -23.784 6.013 29.576 1.00 1.31 N ATOM 1389 CA GLU A 84 -24.563 6.744 30.569 1.00 55.30 C ATOM 1390 C GLU A 84 -24.426 8.252 30.377 1.00 43.44 C ATOM 1391 O GLU A 84 -23.418 8.848 30.756 1.00 20.11 O ATOM 1392 CB GLU A 84 -24.116 6.358 31.979 1.00 43.15 C ATOM 1393 CG GLU A 84 -24.700 5.041 32.464 1.00 21.54 C ATOM 1394 CD GLU A 84 -25.106 5.085 33.924 1.00 12.54 C ATOM 1395 OE1 GLU A 84 -25.699 6.101 34.343 1.00 44.45 O ATOM 1396 OE2 GLU A 84 -24.831 4.105 34.647 1.00 0.44 O ATOM 0 H GLU A 84 -22.774 6.069 29.707 1.00 1.31 H new ATOM 0 HA GLU A 84 -25.611 6.476 30.437 1.00 55.30 H new ATOM 0 HB2 GLU A 84 -23.028 6.293 32.001 1.00 43.15 H new ATOM 0 HB3 GLU A 84 -24.403 7.150 32.671 1.00 43.15 H new ATOM 0 HG2 GLU A 84 -25.569 4.788 31.857 1.00 21.54 H new ATOM 0 HG3 GLU A 84 -23.967 4.247 32.318 1.00 21.54 H new ATOM 1403 N GLY A 85 -25.450 8.864 29.791 1.00 74.03 N ATOM 1404 CA GLY A 85 -25.428 10.298 29.566 1.00 44.45 C ATOM 1405 C GLY A 85 -24.557 10.701 28.392 1.00 62.51 C ATOM 1406 O GLY A 85 -23.382 11.027 28.565 1.00 51.43 O ATOM 0 H GLY A 85 -26.295 8.393 29.468 1.00 74.03 H new ATOM 0 HA2 GLY A 85 -26.446 10.649 29.393 1.00 44.45 H new ATOM 0 HA3 GLY A 85 -25.068 10.796 30.466 1.00 44.45 H new ATOM 1410 N TYR A 86 -25.134 10.686 27.194 1.00 23.45 N ATOM 1411 CA TYR A 86 -24.402 11.062 25.988 1.00 62.13 C ATOM 1412 C TYR A 86 -24.503 12.565 25.745 1.00 32.32 C ATOM 1413 O TYR A 86 -25.466 13.207 26.168 1.00 34.34 O ATOM 1414 CB TYR A 86 -24.942 10.301 24.777 1.00 13.40 C ATOM 1415 CG TYR A 86 -24.028 10.349 23.571 1.00 33.51 C ATOM 1416 CD1 TYR A 86 -22.700 9.955 23.668 1.00 70.14 C ATOM 1417 CD2 TYR A 86 -24.494 10.787 22.339 1.00 12.00 C ATOM 1418 CE1 TYR A 86 -21.861 9.997 22.571 1.00 4.42 C ATOM 1419 CE2 TYR A 86 -23.662 10.833 21.236 1.00 22.22 C ATOM 1420 CZ TYR A 86 -22.346 10.436 21.358 1.00 21.22 C ATOM 1421 OH TYR A 86 -21.514 10.480 20.262 1.00 42.32 O ATOM 0 H TYR A 86 -26.105 10.418 27.032 1.00 23.45 H new ATOM 0 HA TYR A 86 -23.354 10.800 26.131 1.00 62.13 H new ATOM 0 HB2 TYR A 86 -25.106 9.260 25.056 1.00 13.40 H new ATOM 0 HB3 TYR A 86 -25.913 10.714 24.503 1.00 13.40 H new ATOM 0 HD1 TYR A 86 -22.317 9.610 24.617 1.00 70.14 H new ATOM 0 HD2 TYR A 86 -25.524 11.097 22.241 1.00 12.00 H new ATOM 0 HE1 TYR A 86 -20.830 9.687 22.664 1.00 4.42 H new ATOM 0 HE2 TYR A 86 -24.040 11.178 20.285 1.00 22.22 H new ATOM 0 HH TYR A 86 -22.012 10.812 19.486 1.00 42.32 H new ATOM 1431 N THR A 87 -23.504 13.124 25.069 1.00 34.54 N ATOM 1432 CA THR A 87 -23.487 14.553 24.780 1.00 13.52 C ATOM 1433 C THR A 87 -22.917 14.828 23.387 1.00 71.31 C ATOM 1434 O THR A 87 -21.703 14.787 23.189 1.00 14.22 O ATOM 1435 CB THR A 87 -22.667 15.300 25.836 1.00 53.41 C ATOM 1436 OG1 THR A 87 -22.169 14.405 26.815 1.00 61.40 O ATOM 1437 CG2 THR A 87 -23.456 16.370 26.555 1.00 74.10 C ATOM 0 H THR A 87 -22.698 12.611 24.712 1.00 34.54 H new ATOM 0 HA THR A 87 -24.516 14.912 24.806 1.00 13.52 H new ATOM 0 HB THR A 87 -21.854 15.774 25.286 1.00 53.41 H new ATOM 0 HG1 THR A 87 -21.647 14.903 27.478 1.00 61.40 H new ATOM 0 HG21 THR A 87 -22.818 16.861 27.289 1.00 74.10 H new ATOM 0 HG22 THR A 87 -23.812 17.106 25.834 1.00 74.10 H new ATOM 0 HG23 THR A 87 -24.308 15.916 27.061 1.00 74.10 H new ATOM 1445 N PRO A 88 -23.787 15.114 22.402 1.00 52.40 N ATOM 1446 CA PRO A 88 -23.357 15.397 21.029 1.00 15.22 C ATOM 1447 C PRO A 88 -22.694 16.766 20.894 1.00 14.22 C ATOM 1448 O PRO A 88 -22.057 17.057 19.881 1.00 24.20 O ATOM 1449 CB PRO A 88 -24.664 15.354 20.235 1.00 70.12 C ATOM 1450 CG PRO A 88 -25.716 15.729 21.221 1.00 61.15 C ATOM 1451 CD PRO A 88 -25.256 15.186 22.548 1.00 62.05 C ATOM 0 HA PRO A 88 -22.606 14.686 20.683 1.00 15.22 H new ATOM 0 HB2 PRO A 88 -24.641 16.050 19.396 1.00 70.12 H new ATOM 0 HB3 PRO A 88 -24.844 14.362 19.821 1.00 70.12 H new ATOM 0 HG2 PRO A 88 -25.841 16.811 21.265 1.00 61.15 H new ATOM 0 HG3 PRO A 88 -26.681 15.307 20.941 1.00 61.15 H new ATOM 0 HD2 PRO A 88 -25.546 15.839 23.371 1.00 62.05 H new ATOM 0 HD3 PRO A 88 -25.687 14.206 22.752 1.00 62.05 H new ATOM 1459 N GLU A 89 -22.842 17.603 21.919 1.00 42.21 N ATOM 1460 CA GLU A 89 -22.255 18.939 21.908 1.00 12.41 C ATOM 1461 C GLU A 89 -20.748 18.874 22.144 1.00 22.14 C ATOM 1462 O GLU A 89 -19.965 19.445 21.384 1.00 73.11 O ATOM 1463 CB GLU A 89 -22.915 19.818 22.974 1.00 52.44 C ATOM 1464 CG GLU A 89 -23.423 21.148 22.439 1.00 54.22 C ATOM 1465 CD GLU A 89 -22.603 22.327 22.929 1.00 4.33 C ATOM 1466 OE1 GLU A 89 -22.323 22.391 24.144 1.00 40.40 O ATOM 1467 OE2 GLU A 89 -22.241 23.184 22.096 1.00 31.15 O ATOM 0 H GLU A 89 -23.363 17.379 22.767 1.00 42.21 H new ATOM 0 HA GLU A 89 -22.431 19.378 20.926 1.00 12.41 H new ATOM 0 HB2 GLU A 89 -23.748 19.273 23.418 1.00 52.44 H new ATOM 0 HB3 GLU A 89 -22.197 20.007 23.772 1.00 52.44 H new ATOM 0 HG2 GLU A 89 -23.407 21.127 21.349 1.00 54.22 H new ATOM 0 HG3 GLU A 89 -24.462 21.283 22.740 1.00 54.22 H new ATOM 1474 N ASP A 90 -20.351 18.174 23.202 1.00 50.34 N ATOM 1475 CA ASP A 90 -18.939 18.032 23.544 1.00 5.33 C ATOM 1476 C ASP A 90 -18.294 19.394 23.784 1.00 42.23 C ATOM 1477 O ASP A 90 -18.925 20.434 23.596 1.00 5.20 O ATOM 1478 CB ASP A 90 -18.193 17.287 22.433 1.00 31.34 C ATOM 1479 CG ASP A 90 -17.393 16.113 22.964 1.00 74.42 C ATOM 1480 OD1 ASP A 90 -16.676 16.290 23.971 1.00 62.52 O ATOM 1481 OD2 ASP A 90 -17.485 15.017 22.373 1.00 45.10 O ATOM 0 H ASP A 90 -20.988 17.695 23.839 1.00 50.34 H new ATOM 0 HA ASP A 90 -18.873 17.454 24.466 1.00 5.33 H new ATOM 0 HB2 ASP A 90 -18.910 16.931 21.693 1.00 31.34 H new ATOM 0 HB3 ASP A 90 -17.523 17.978 21.921 1.00 31.34 H new ATOM 1486 N LYS A 91 -17.032 19.377 24.199 1.00 5.12 N ATOM 1487 CA LYS A 91 -16.298 20.608 24.468 1.00 32.13 C ATOM 1488 C LYS A 91 -15.155 20.791 23.473 1.00 14.42 C ATOM 1489 O LYS A 91 -15.196 21.678 22.620 1.00 12.31 O ATOM 1490 CB LYS A 91 -15.747 20.601 25.896 1.00 22.13 C ATOM 1491 CG LYS A 91 -15.123 21.922 26.312 1.00 11.13 C ATOM 1492 CD LYS A 91 -15.264 22.156 27.807 1.00 51.34 C ATOM 1493 CE LYS A 91 -14.116 22.993 28.348 1.00 0.22 C ATOM 1494 NZ LYS A 91 -14.102 24.361 27.760 1.00 35.33 N ATOM 0 H LYS A 91 -16.496 18.524 24.356 1.00 5.12 H new ATOM 0 HA LYS A 91 -16.991 21.442 24.357 1.00 32.13 H new ATOM 0 HB2 LYS A 91 -16.554 20.356 26.587 1.00 22.13 H new ATOM 0 HB3 LYS A 91 -15.000 19.812 25.985 1.00 22.13 H new ATOM 0 HG2 LYS A 91 -14.068 21.929 26.039 1.00 11.13 H new ATOM 0 HG3 LYS A 91 -15.599 22.738 25.768 1.00 11.13 H new ATOM 0 HD2 LYS A 91 -16.210 22.658 28.011 1.00 51.34 H new ATOM 0 HD3 LYS A 91 -15.294 21.198 28.326 1.00 51.34 H new ATOM 0 HE2 LYS A 91 -14.198 23.065 29.433 1.00 0.22 H new ATOM 0 HE3 LYS A 91 -13.171 22.495 28.132 1.00 0.22 H new ATOM 0 HZ1 LYS A 91 -13.336 24.917 28.191 1.00 35.33 H new ATOM 0 HZ2 LYS A 91 -13.947 24.296 26.734 1.00 35.33 H new ATOM 0 HZ3 LYS A 91 -15.013 24.827 27.944 1.00 35.33 H new ATOM 1508 N LYS A 92 -14.134 19.948 23.591 1.00 73.12 N ATOM 1509 CA LYS A 92 -12.976 20.017 22.706 1.00 22.12 C ATOM 1510 C LYS A 92 -13.278 19.390 21.347 1.00 70.24 C ATOM 1511 O LYS A 92 -12.586 19.657 20.364 1.00 31.04 O ATOM 1512 CB LYS A 92 -11.777 19.316 23.347 1.00 32.32 C ATOM 1513 CG LYS A 92 -12.034 17.855 23.680 1.00 74.24 C ATOM 1514 CD LYS A 92 -11.988 17.605 25.180 1.00 52.14 C ATOM 1515 CE LYS A 92 -12.018 16.119 25.499 1.00 22.32 C ATOM 1516 NZ LYS A 92 -10.691 15.619 25.955 1.00 40.43 N ATOM 0 H LYS A 92 -14.085 19.208 24.292 1.00 73.12 H new ATOM 0 HA LYS A 92 -12.738 21.069 22.550 1.00 22.12 H new ATOM 0 HB2 LYS A 92 -10.924 19.382 22.671 1.00 32.32 H new ATOM 0 HB3 LYS A 92 -11.502 19.845 24.259 1.00 32.32 H new ATOM 0 HG2 LYS A 92 -13.008 17.559 23.291 1.00 74.24 H new ATOM 0 HG3 LYS A 92 -11.290 17.232 23.184 1.00 74.24 H new ATOM 0 HD2 LYS A 92 -11.084 18.049 25.596 1.00 52.14 H new ATOM 0 HD3 LYS A 92 -12.835 18.098 25.658 1.00 52.14 H new ATOM 0 HE2 LYS A 92 -12.762 15.929 26.273 1.00 22.32 H new ATOM 0 HE3 LYS A 92 -12.330 15.564 24.614 1.00 22.32 H new ATOM 0 HZ1 LYS A 92 -10.756 14.602 26.162 1.00 40.43 H new ATOM 0 HZ2 LYS A 92 -9.985 15.776 25.207 1.00 40.43 H new ATOM 0 HZ3 LYS A 92 -10.404 16.129 26.815 1.00 40.43 H new TER 1530 LYS A 92